A0A5K4ETH8_SCHMA Loading...

TROVE domain-containing protein AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A5K4ETH8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 3,234 aa.

						>A0A5K4ETH8_SCHMA|A0A5K4ETH8
MRMDHESGHLKGPSSLLSPVYLEGKNLVKNKLLDEPFAKTSSASSTLSSLSLNNESLKSSISLSYTGSVLHCDHKETIRPNDKHHEAKQTSDASPLKSTPIDWLKDAIIKISDTSFQDILECTVGGSVESNPIHNTFGDLLTYERGDTYKQLKLGLISCISSSIVDGGPSKEKKIILGQSIHACIDKDPEFILKAALYCRRELNIRTTTNMLIAVASCNERSRSFIKKYFSSCIRTPSDWIEVAEYYATISGNLSLKGMPKVLRSSMISKFLEFDEYQLAKHSKHRARANRSTKSKALKKSRNSGVVSTDIDAILYRLAHSPRIYFTIKELIRRLHISKPKFNVMCVLGKPYPSDSTDFIRMGLEGDWDSSKAGTRMKFPVPVTWETELSVNGNNSDSWSKLITLNKVPHMALLRNLRNILLSNVQDSIHEIVLKRLTDPRIIMEGKQFPFRYFAAFDTIDRLKRDLHYHRFVMRTTVTEVLKRKKTTPRQLKKSEWLEKSMKKGIGKFLLCDFEMLDRYKNALSTALELSMKHNLPPICGSTLIICSTSKYVNSSKHKSSKSYVQILGFLLGAMCTSICETPTTYVTVDDQYNLTPIEVVLRGNQTLNNHDKDSDFCGWKQNEYRSKRKSMGILERTKQMYKRRKSLRSTSITTVVEKLYAYRKQFDKIVVFGDCHKEIVDYVINYRTYIGPLKAIWGNLSGEDVWPNSCSKDGWIEFKGCTDQILRYIAEPNEDKLLERIEEIDEIYGLNKNISYHFNLKTKTQENLDNSILPKHDYFRSGWKCCQLFISSTFRDMHAERDLLCGILVPALRRNVALGLRVHLNEIDLRWGVPEPVTYNSQALQICLEQAAASDIFVLLLGDRYGCIPDETEVMALPESLLSEVCKFYKPGMSMTEMEYHMARQAAISKVPIHERRQQNTISFHEAIRLRICVFIRDSASMENVPDELKHYFEEYDNEKRNRLNAFKELIRNDGVIVSYNYSAQFNGLINDYPVMGNLDEFGSQFLATVKSLLLRLFHNDNDNTPIYNNDHNLPVTANKSLNTIEFLREYVYSAACAIGPRHLLEVEQAFNSLTERGRRAHLTRAIQSTENKLSVQNNSSYPTNLQGCDGSILLIVGSNGSGKTTYLSALTISLIESNWYKSIPMNKTIQNKFATKLNSIGSFMNDSMDHSKLITSQRPIFVKHQILIHFCNGLSITGLPSNKKLNEILQNCILLIVGSNGSGKTTYLSALTISLIESNWYKSIPMNKTIQNKFATKLNSIGSFMNDSMDHSKLITSQRPIFVKHQILIHFCNGLSITGLPSNKKLNEILQNWLNLLIIQLDNICNCNDILKKLLSELKLSFNMNKISSNIDLKFYIQCFARFINFLGYLNDIQFAFLIDDCDRLEPMTLEWLPQILPKNVRFVLTCDSKSSVARNLCNRIDCQLLTVSGLTTHERGAAVRSLLGKYGKVLNESGFRNQLSVLIQKRDASIPLYLKLACDELRLYSNYEQLGAKLKQLPDTISSLVIDVVKRVECSCGSELTRITLGLLTCSRQPLSTEELHNLIDEWLIESWMEEQYKNGYTDSWQELKVPLDNLDNIMSNEKIIYQINDQFNNKNKPTLSKGQPHLPSLLLYILLTGLHPLLSGFNDERADIDEIDEELPFDDSMQTIKQEKLTIWNLGSRALSFSSREIHNLVYDICFNQSKYSIGHKKYEYSFKNNQTKNCNKRAKYSESIPDDKIHLKTVTLQTIHNILASKLRNMKDLIYHLHHAGRLNEVVCLLTSPAFLIHQIESGYGLTLLDDMNRYITTTTAHHQSESNNIPTSLDLMRDKIRTMQRFLASNYEFLIKHPYSFAELAINQDVDEWIHTIGYACLLSSNYQEKINGDLCKNFFRIKLNTNDNSCILPKIIQPIAIHKPVTPLTGSQDIPIAIELDRTGILLAYGTESGTVTVVEVQSLKTLCSFLGHNMPILSLCFLDEVDSSTTRSYSIPSSQLWLVSTSQDASILIWDLSNVIKSVTCGITTSTSSQLCSLGGYHNKPVTVSAWHPKRRLLATGGLDCLICLWEVGELGFGSYFTSTSSGCKKIKPSKKLNIKSSINSISFRLPNYASDSEKSIPPEYLRDVLAVGCWDGSVHFYSLISMSWIKSLAISSSAICSLAYSPNNGRLLAILDREGQSFILNADTFVYLGRLTENVSFSSINEFTSLDELHHLLPSQKGVLCFSKPTGRYLIQTGGGSSVGRINVWNAHLGAPEGPWINVIRNKKEMKQTILATTYAIDISGKHIIIGWNDGLFTIVLITNGETIFSSDKLIPLINDNSSVQAISCGISPYYDDANLVIVGWSSGAVRLYHFSFKPGTKSKRDDNSTVQSDLHSICDVSIVPLYTSWSHSIEHAENGTGEAGGTLCAAASDFIAVSGGGNCEVWVYFVGSVLENPLVKSFCFREHSSQITAVAVQMDFIATGSKDKNVAIYKYDSNSTTVTLQYIIYNASKDWIISLKWSYILYKMSDRKLTLLVGSNDQLIRLYRIKSKKYKLKQTLVSDQSGIKSLDFNFPYIFSATSNGHISVWRYGKNGNFELISEMIISSPLDNLNSSTTDENVVNLVKIQSFEYTPCYNPSTNESVINTCDELEPHQNEDSVVDTLEFSNRSSSPLSSEDDSSQHHGITDENLFGDKNSMKGTSDYDELMDEGSDETPSQCSEKDLMTVDKCNNVAFNGDLSTGFQMFDKYINRPGSSSELLNGTNVKLLIGQTISGSRNIQEFQFRVYEPSLTGYHATLSGHAGLIPCGLSCTKPLNSNNDDTLLISVAGQNCDSKTIGCDIRLWDLPLSNNSSLCKPTLQHTGPIICANYLNVTKNLQLCITGSVDGDCIIWAVYDSSTSQSIKPMATTTTTTTTTTTTTTTTTTTTYQPLIRLTHSYMKPRYSINSIVTQRGIMDNEKTKIDYFIYIAFGYEIATLHIQLNHDSLMNEIDLENIILELFSNRKQLNINFIELNTLWSIQTMDGYAEIQRFKTDHIVVEMSTLHHEPVNMNQCGVVALLSNGEVVIIPFQRTDNELVHLRVRDNCNLSSHWCSSICTYQDGILVAHDGSALFHPFDDSTHVFTPLPGSINNLENIHIDRIEPLCLPNGNSFKLLYIVTSKLESEPRIIFFNNNEHMLLNISLEGMELQVTAYCIISTHFDNKTLIAYLLLATSDSFLRLFKCSIDVSDESESSKWEQIKIYPTGEQIKKLVTFNKDPVKIMCCLQSGQIDFYTIEL
					

Structure and PAE viewers are unavailable as this is a multi-fragment structure.

Download 11 Fragment Structures AlphaSync Parameters PDBs Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	23.9	Very low	31.7	Very low	247 Å²	247	171.3 Å²	171.3	100%	1.217	86%	0.862	S	S	*	*				0	92.8	0	-72.7	-176.2	153.8	0	0	107.5
2	R	26.1	Very low	31.3	Very low	246 Å²	246	162.7 Å²	162.7	93%	0.928	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-90.8	127.3	173.6	-85.3	-177.4	174.1	169.7	-2.1	107.3
3	M	24.4	Very low	31.1	Very low	153 Å²	153	160.3 Å²	160.3	75%	0.754	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-78.5	120.2	167.3	-69.7	-146.2	-66.5	0	0	107.2
4	D	31.8	Very low	30.7	Very low	150 Å²	150	156.2 Å²	156.2	80%	0.802	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-84.8	127.2	166.6	-85.8	-27.1	0	0	0	109.2	E6	D4-E6 VanDerWaalsContact C-N 3.28Å; D4-E6 PolarHBondContact O-N 2.61Å
5	H	40.9	Very low	30.6	Very low	175 Å²	175	153.2 Å²	153.2	81%	0.81	84%	0.836	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	11.2	-156	-100.9	-75.9	0	0	0	115.6
6	E	42.8	Very low	30.3	Very low	193 Å²	193	155.1 Å²	155.1	90%	0.902	84%	0.844	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.7	2.8	-169.1	-70.7	-169.5	159.7	0	0	116.7	D4	D4-E6 VanDerWaalsContact C-N 3.28Å; D4-E6 PolarHBondContact O-N 2.61Å
7	S	43.3	Very low	30	Very low	98 Å²	98	155.2 Å²	155.2	69%	0.685	84%	0.843	S	S	*	*	S	Bend	trans	-147.6	9.1	174.6	58.4	0	0	0	0	118.4	H9	S7-H9 PolarHBondContact O-N 3.3Å
8	G	30.8	Very low	29.8	Very low	79 Å²	79	152.3 Å²	152.3	81%	0.814	84%	0.836	S	S	*	*			trans	58.1	9.6	157.4	0	0	0	0	0	118.6
9	H	29.5	Very low	29.6	Very low	166 Å²	166	150.6 Å²	150.6	77%	0.769	83%	0.833	S	S	*	*			trans	-126.6	114.6	-177.8	-83.6	-60.5	0	0	0	112.8	S7 K11	S7-H9 PolarHBondContact O-N 3.3Å; H9-K11 PolarHBondContact O-N 3.06Å
10	L	26.6	Very low	29.5	Very low	183 Å²	183	149.6 Å²	149.6	96%	0.958	83%	0.83	S	S	*	*			trans	-70.8	99.3	168.3	-85.5	142.1	0	0	0	109.9
11	K	29.1	Very low	29.2	Very low	194 Å²	194	152.8 Å²	152.8	84%	0.843	83%	0.831	S	S	*	*			trans	-105.1	110.6	168.5	-79.2	-173.1	175.5	179.6	0	110.1	H9	H9-K11 PolarHBondContact O-N 3.06Å
12	G	26.9	Very low	29.4	Very low	68 Å²	68	149 Å²	149	70%	0.701	82%	0.815	S	S	*	*			trans	-74	139.6	173.3	0	0	0	0	0	111.3	S14	G12-S14 PolarHBondContact O-N 3.21Å
13	P	28.3	Very low	29.3	Very low	132 Å²	132	145.5 Å²	145.5	86%	0.857	81%	0.809	S	S	*	*			trans	-90.3	106.4	174.9	32.5	-26.5	0	0	0	109.5
14	S	25.6	Very low	29.3	Very low	103 Å²	103	142.2 Å²	142.2	72%	0.72	81%	0.814	S	S	*	*			trans	-67.3	152.5	155.4	46.2	0	0	0	0	110.4	G12	G12-S14 PolarHBondContact O-N 3.21Å
15	S	28.5	Very low	29	Very low	111 Å²	111	143.7 Å²	143.7	78%	0.776	81%	0.814	S	S	*	*			trans	68.5	83.7	167.4	64.4	0	0	0	0	118.1
16	L	26.3	Very low	28.3	Very low	184 Å²	184	141.9 Å²	141.9	96%	0.963	81%	0.81	S	S	*	*			trans	-97.2	102.3	150.7	-83.7	162.5	0	0	0	108.2
17	L	25.5	Very low	27.5	Very low	157 Å²	157	140.4 Å²	140.4	82%	0.822	81%	0.808	S	S	*	*			trans	-119.3	141	163	-94.4	164.3	0	0	0	107.7
18	S	26.6	Very low	26.7	Very low	103 Å²	103	142.3 Å²	142.3	72%	0.72	81%	0.814	S	S	*	*			trans	84.1	105.4	176.9	75.2	0	0	0	0	117.1
19	P	25.7	Very low	26.5	Very low	120 Å²	120	147.3 Å²	147.3	78%	0.779	81%	0.814	S	S	*	*			trans	-86.7	114.8	173.4	32.7	-26.8	0	0	0	109.8
20	V	27.8	Very low	26.3	Very low	129 Å²	129	147 Å²	147	78%	0.782	82%	0.818	S	S	*	*			trans	-86.8	115.9	170.8	176.7	0	0	0	0	108.1	L22	V20-L22 PolarHBondContact O-N 3.2Å
21	Y	23.6	Very low	26.3	Very low	217 Å²	217	147.2 Å²	147.2	85%	0.851	81%	0.811	S	S	*	*			trans	-56.9	126.3	170.9	-86.4	-104.5	0	0	0	110.6
22	L	26.4	Very low	26.3	Very low	169 Å²	169	146 Å²	146	89%	0.885	81%	0.813	S	S	*	*			trans	-105.6	105.6	167.5	-82.8	165.2	0	0	0	109	V20 G24	V20-L22 PolarHBondContact O-N 3.2Å; L22-G24 PolarHBondContact O-N 3.19Å
23	E	25.7	Very low	26.2	Very low	172 Å²	172	150.6 Å²	150.6	80%	0.804	82%	0.821	S	S	*	*			trans	-57.9	121.6	170.6	-72.1	176.8	139	0	0	111.2	K25	E23-K25 PolarHBondContact O-N 2.69Å; E23-K25 VanDerWaalsContact O-N 3.17Å
24	G	23.8	Very low	26.1	Very low	83 Å²	83	151.7 Å²	151.7	86%	0.856	82%	0.819	S	S	*	*			trans	-74.9	97.7	172.9	0	0	0	0	0	111.5	L22	L22-G24 PolarHBondContact O-N 3.19Å
25	K	25.3	Very low	26.2	Very low	181 Å²	181	155.8 Å²	155.8	79%	0.787	83%	0.827	S	S	*	*			trans	-79.9	116.5	168.5	-78.4	-178.9	176.7	175	0	111.2	E23	E23-K25 PolarHBondContact O-N 2.69Å; E23-K25 VanDerWaalsContact O-N 3.17Å
26	N	26.8	Very low	26.2	Very low	137 Å²	137	156 Å²	156	73%	0.733	83%	0.826	S	S	*	*			trans	51.8	98.7	141.5	-66.6	-24.2	0	0	0	120.5
27	L	25.6	Very low	26.1	Very low	163 Å²	163	157.7 Å²	157.7	85%	0.853	83%	0.826	S	S	*	*				35	96	114.9	-71.6	158.8	0	0	0	116.8	K29	L27-K29 PolarHBondContact O-N 3.27Å
28	V	27.5	Very low	26.3	Very low	137 Å²	137	154.8 Å²	154.8	83%	0.83	82%	0.824	S	S	*	*			trans	-67.1	116.3	160.5	175.6	0	0	0	0	108.6	N30	V28-N30 PolarHBondContact O-N 3.08Å
29	K	25	Very low	26.2	Very low	184 Å²	184	159.7 Å²	159.7	80%	0.8	83%	0.833	S	S	*	*			trans	-53.5	114.2	176.1	-79.6	173.9	169.9	176.1	0	111.7	L27 K31	L27-K29 PolarHBondContact O-N 3.27Å; K29-K31 PolarHBondContact O-N 2.64Å; K29-K31 VanDerWaalsContact O-N 3.1Å
30	N	26.6	Very low	26.4	Very low	161 Å²	161	161 Å²	161	86%	0.861	84%	0.838	S	S	*	*			trans	-69.1	98.1	165.5	-77.8	-29.1	0	0	0	109.8	V28 L32	V28-N30 PolarHBondContact O-N 3.08Å; N30-L32 PolarHBondContact O-N 2.94Å
31	K	26	Very low	26.4	Very low	187 Å²	187	160.1 Å²	160.1	81%	0.813	84%	0.838	S	S	*	*			trans	-93.2	47.1	-179.6	-111.3	-165	179.7	-168.6	0	112.6	K29	K29-K31 PolarHBondContact O-N 2.64Å; K29-K31 VanDerWaalsContact O-N 3.1Å
32	L	28.7	Very low	26.5	Very low	169 Å²	169	154.9 Å²	154.9	89%	0.885	83%	0.833	S	S	*	*			trans	-135	48.1	177.7	-79.8	167.3	0	0	0	111.4	N30	N30-L32 PolarHBondContact O-N 2.94Å
33	L	25.7	Very low	26.5	Very low	164 Å²	164	151.7 Å²	151.7	86%	0.859	83%	0.831	S	S	*	*			trans	-121.6	21.3	167.7	-83	176.9	0	0	0	112.7
34	D	24.9	Very low	26.5	Very low	154 Å²	154	148.5 Å²	148.5	82%	0.824	83%	0.828	S	S	*	*			trans	-124.9	89.2	171.7	-68.3	-41.8	0	0	0	108.3
35	E	28.2	Very low	26.6	Very low	190 Å²	190	149.6 Å²	149.6	89%	0.888	82%	0.822	S	S	*	*	S	Bend	trans	-170.6	138.1	137	-83.5	-130.9	153.9	0	0	109.8
36	P	28.5	Very low	26.8	Very low	115 Å²	115	147 Å²	147	75%	0.747	82%	0.822	S	S	*	*			trans	-91.1	143	-151.3	34.8	-33.6	0	0	0	114.5	A38	P36-A38 PolarHBondContact O-N 3.01Å
37	F	24.9	Very low	26.7	Very low	220 Å²	220	149.2 Å²	149.2	97%	0.965	83%	0.833	S	S	*	*			trans	-47.6	112.7	171.2	-79.5	-95.6	0	0	0	113.6
38	A	28.2	Very low	26.9	Very low	95 Å²	95	147 Å²	147	79%	0.785	83%	0.831	S	S	*	*			trans	-100	100.7	165.8	0	0	0	0	0	110.7	P36	P36-A38 PolarHBondContact O-N 3.01Å
39	K	25.7	Very low	26.9	Very low	207 Å²	207	145 Å²	145	90%	0.9	82%	0.823	S	S	*	*			trans	15.9	108.4	150.8	-63.4	176.3	179.5	176.2	0	117.8
40	T	28.8	Very low	26.9	Very low	146 Å²	146	143.8 Å²	143.8	90%	0.896	82%	0.824	S	S	*	*			trans	-122.8	133.2	148.1	49.1	0	0	0	0	110
41	S	28.3	Very low	26.8	Very low	111 Å²	111	141.2 Å²	141.2	78%	0.776	82%	0.819	S	S	*	*			trans	-83.1	143	-159.2	45	0	0	0	0	114.3
42	S	25.9	Very low	26.8	Very low	108 Å²	108	139.2 Å²	139.2	76%	0.755	82%	0.817	S	S	*	*			trans	-16.8	115.2	158.8	54.6	0	0	0	0	117.4
43	A	27.1	Very low	26.8	Very low	101 Å²	101	138.4 Å²	138.4	84%	0.835	81%	0.813	S	S	*	*			trans	-121.2	72.7	158.7	0	0	0	0	0	109
44	S	24.8	Very low	26.8	Very low	106 Å²	106	138.4 Å²	138.4	74%	0.741	81%	0.814	S	S	*	*			trans	-126	71.4	175.7	62.4	0	0	0	0	110
45	S	26.9	Very low	26.9	Very low	105 Å²	105	140 Å²	140	73%	0.734	82%	0.816	S	S	*	*			trans	-165.7	66.4	173.7	46.5	0	0	0	0	111
46	T	28	Very low	26.9	Very low	126 Å²	126	136.1 Å²	136.1	77%	0.773	81%	0.81	S	S	*	*	S	Bend	trans	-151.6	17.2	168.5	7.8	0	0	0	0	114.7
47	L	25.7	Very low	26.9	Very low	185 Å²	185	139.2 Å²	139.2	97%	0.969	82%	0.82	S	S	*	*	S	Bend	trans	-117.6	27.2	-177.7	-85.9	166.1	0	0	0	114.7
48	S	29.2	Very low	27.1	Very low	117 Å²	117	138.4 Å²	138.4	82%	0.818	82%	0.816	S	S	*	*	S	Bend	trans	-121.2	13	177.8	57	0	0	0	0	115.8
49	S	28.4	Very low	27	Very low	95 Å²	95	138.7 Å²	138.7	66%	0.664	81%	0.812	S	S	*	*			trans	-129.1	49.1	-173.5	51.8	0	0	0	0	114.3
50	L	24.1	Very low	27	Very low	157 Å²	157	134.6 Å²	134.6	82%	0.822	81%	0.809	S	S	*	*			trans	-143.6	58.5	167.2	-92.5	166.8	0	0	0	110.9	L52	L50-L52 HydrophobicContact CD2-CD1 4.01Å; L50-L52 PolarHBondContact O-N 3.31Å
51	S	24.3	Very low	26.8	Very low	108 Å²	108	134.7 Å²	134.7	76%	0.755	80%	0.803	S	S	*	*			trans	-83.3	88.2	163.3	61	0	0	0	0	109.4
52	L	26.7	Very low	26.4	Very low	145 Å²	145	134.7 Å²	134.7	76%	0.759	80%	0.803	S	S	*	*			trans	-85.9	116.1	171.7	-91.2	154	0	0	0	109.9	L50	L50-L52 HydrophobicContact CD2-CD1 4.01Å; L50-L52 PolarHBondContact O-N 3.31Å
53	N	27.5	Very low	26.3	Very low	151 Å²	151	137.5 Å²	137.5	81%	0.807	81%	0.809	S	S	*	*			trans	-60	125.7	-176.6	-73.1	-28	0	0	0	113.1	E55	N53-E55 VanDerWaalsContact C-N 3.33Å; N53-E55 PolarHBondContact O-N 3.42Å; N53-E55 VanDerWaalsContact O-N 3.16Å
54	N	26.3	Very low	26.1	Very low	164 Å²	164	138 Å²	138	88%	0.877	81%	0.806	S	S	*	*			trans	-84.4	48.1	-177	-92.1	-31.5	0	0	0	114.1
55	E	28.2	Very low	25.9	Very low	187 Å²	187	143.9 Å²	143.9	87%	0.874	81%	0.813	S	S	*	*			trans	-116.2	67.5	176.5	-71.2	-163.5	167.3	0	0	112.6	N53	N53-E55 VanDerWaalsContact C-N 3.33Å; N53-E55 PolarHBondContact O-N 3.42Å; N53-E55 VanDerWaalsContact O-N 3.16Å
56	S	27.7	Very low	25.7	Very low	109 Å²	109	145.2 Å²	145.2	76%	0.762	82%	0.817	S	S	*	*			trans	-167.9	55.2	159.6	52.1	0	0	0	0	113.6
57	L	28.3	Very low	25.4	Very low	180 Å²	180	142.2 Å²	142.2	94%	0.942	81%	0.812	S	S	*	*			trans	-123.3	80.6	163.2	-77	169.8	0	0	0	109.7
58	K	28.2	Very low	25.2	Very low	203 Å²	203	139.1 Å²	139.1	88%	0.883	81%	0.805	S	S	*	*			trans	-68.1	132.5	171	-87.1	-178.3	174.3	177.5	0	111.3
59	S	27.5	Very low	25.1	Very low	101 Å²	101	139.9 Å²	139.9	71%	0.706	80%	0.804	S	S	*	*			trans	52.5	105.6	153.4	60.3	0	0	0	0	120
60	S	24.3	Very low	24.8	Very low	121 Å²	121	142.9 Å²	142.9	85%	0.846	81%	0.812	S	S	*	*			trans	-4.9	110.5	145	50.6	0	0	0	0	117.4
61	I	24.3	Very low	24.7	Very low	149 Å²	149	143.6 Å²	143.6	76%	0.764	81%	0.811	S	S	*	*			trans	-87.4	110.3	160.5	-62.7	170.3	0	0	0	106.9	L63	I61-L63 HydrophobicContact CG2-CG 4.46Å; I61-L63 PolarHBondContact O-N 2.99Å
62	S	21.9	Very low	24.7	Very low	111 Å²	111	142.8 Å²	142.8	78%	0.776	80%	0.804	S	S	*	*			trans	-73	108.8	172.5	58.1	0	0	0	0	109.5	S64	S62-S64 PolarHBondContact O-N 3.07Å
63	L	23.3	Very low	24.5	Very low	167 Å²	167	142.7 Å²	142.7	87%	0.874	81%	0.805	S	S	*	*			trans	-89.7	95.3	175.6	-77.4	153.8	0	0	0	109	I61	I61-L63 HydrophobicContact CG2-CG 4.46Å; I61-L63 PolarHBondContact O-N 2.99Å
64	S	21.5	Very low	24.5	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	80%	0.803	S	S	*	*			trans	-92.3	134	167.1	55.1	0	0	0	0	110.6	S62	S62-S64 PolarHBondContact O-N 3.07Å
65	Y	20.7	Very low	24.3	Very low	230 Å²	230	145.4 Å²	145.4	90%	0.902	80%	0.804	S	S	*	*			trans	-84.4	109.9	-171.9	-162.7	-92	0	0	0	109.9
66	T	23.7	Very low	24.2	Very low	134 Å²	134	144.9 Å²	144.9	82%	0.822	80%	0.801	S	S	*	*			trans	-142.8	129.8	162.5	48.1	0	0	0	0	110.3
67	G	21.2	Very low	24.1	Very low	63 Å²	63	146.1 Å²	146.1	65%	0.649	81%	0.805	S	S	*	*			trans	-74.1	146.2	-176.2	0	0	0	0	0	113
68	S	22.4	Very low	23.9	Very low	119 Å²	119	145 Å²	145	83%	0.832	80%	0.798	S	S	*	*	S	Bend	trans	77.2	124.5	160	74.1	0	0	0	0	119.1
69	V	26	Very low	23.8	Very low	133 Å²	133	146.5 Å²	146.5	81%	0.806	80%	0.798	S	S	*	*			trans	74.6	103.3	163.4	-164.9	0	0	0	0	117.2	H71	V69-H71 PolarHBondContact O-N 3.44Å; V69-H71 VanDerWaalsContact O-N 3.12Å
70	L	23.1	Very low	23.8	Very low	158 Å²	158	146.8 Å²	146.8	83%	0.827	80%	0.798	S	S	*	*			trans	-54.3	100.4	172.2	-71.7	149	0	0	0	112.8
71	H	21.2	Very low	23.9	Very low	172 Å²	172	147.6 Å²	147.6	80%	0.796	79%	0.792	S	S	*	*			trans	-107.5	104.2	150.3	-104.7	-59.2	0	0	0	108.3	V69 D73	V69-H71 PolarHBondContact O-N 3.44Å; V69-H71 VanDerWaalsContact O-N 3.12Å; H71-D73 PolarHBondContact O-N 3.47Å
72	C	24	Very low	24.1	Very low	91 Å²	91	149 Å²	149	62%	0.615	80%	0.801	S	S	*	*			trans	-83.1	91.6	174.9	-67.4	0	0	0	0	109.1	H74	C72-H74 PolarHBondContact O-N 3.08Å
73	D	22.5	Very low	24.4	Very low	143 Å²	143	151.3 Å²	151.3	77%	0.765	80%	0.798	S	S	*	*			trans	-78.9	96	168.2	-74	-20.3	0	0	0	109.3	H71	H71-D73 PolarHBondContact O-N 3.47Å
74	H	27.2	Very low	24.6	Very low	166 Å²	166	150 Å²	150	77%	0.769	79%	0.787	S	S	*	*			trans	-94.8	106.3	166.3	-77.6	-57.3	0	0	0	109	C72 E76	C72-H74 PolarHBondContact O-N 3.08Å; H74-E76 PolarHBondContact O-N 3.04Å
75	K	24	Very low	25	Very low	207 Å²	207	154.5 Å²	154.5	90%	0.9	80%	0.795	S	S	*	*			trans	-59.2	103.8	166.2	-74.8	-176.5	175.3	-179.7	0	108.8	T77	K75-T77 PolarHBondContact O-N 3.27Å
76	E	25.8	Very low	25.4	Very low	175 Å²	175	152 Å²	152	82%	0.818	79%	0.792	S	S	*	*			trans	-66.6	116	172.3	-74.9	-178.1	155.4	0	0	109.6	H74 I78	H74-E76 PolarHBondContact O-N 3.04Å; E76-I78 PolarHBondContact O-N 3.48Å; E76-I78 VanDerWaalsContact O-N 3.09Å
77	T	25.2	Very low	25.5	Very low	136 Å²	136	149.7 Å²	149.7	83%	0.834	79%	0.786	S	S	*	*			trans	-72.7	95.4	166.6	32.4	0	0	0	0	108.6	K75 R79	K75-T77 PolarHBondContact O-N 3.27Å; T77-R79 PolarHBondContact O-N 3.27Å; T77-R79 VanDerWaalsContact O-N 3.15Å
78	I	23.9	Very low	25.8	Very low	156 Å²	156	156.5 Å²	156.5	80%	0.8	80%	0.798	S	S	*	*			trans	-58.5	111.4	172.9	-59.5	167.8	0	0	0	108.4	E76	E76-I78 PolarHBondContact O-N 3.48Å; E76-I78 VanDerWaalsContact O-N 3.09Å
79	R	25.3	Very low	26	Very low	234 Å²	234	159.7 Å²	159.7	88%	0.883	80%	0.8	S	S	*	*			trans	-92.6	132.7	162.2	-77.6	-172.2	177.4	-174.6	-0.5	108.6	T77	T77-R79 PolarHBondContact O-N 3.27Å; T77-R79 VanDerWaalsContact O-N 3.15Å
80	P	29.2	Very low	26.1	Very low	108 Å²	108	159.7 Å²	159.7	70%	0.701	80%	0.8	S	S	*	*			trans	-83.8	142.3	-162	33.2	-34.3	0	0	0	112.8
81	N	25.4	Very low	26.3	Very low	137 Å²	137	156.8 Å²	156.8	73%	0.733	79%	0.793	S	S	*	*			trans	35.8	103.5	141.2	-69.3	-14.5	0	0	0	117.9
82	D	29.2	Very low	26.6	Very low	179 Å²	179	156 Å²	156	96%	0.957	80%	0.795	S	S	*	*			trans	-106.7	130.3	136	-92.8	-35.9	0	0	0	109.9
83	K	27.7	Very low	26.6	Very low	160 Å²	160	156 Å²	156	70%	0.696	80%	0.801	S	S	*	*			trans	-92.4	157.6	-158.7	-73.2	174.4	168	179	0	112.3
84	H	27.5	Very low	26.8	Very low	140 Å²	140	154 Å²	154	65%	0.648	80%	0.799	S	S	*	*			trans	59.2	102.7	152.2	-61.2	-59	0	0	0	118
85	H	30.6	Very low	26.9	Very low	204 Å²	204	152 Å²	152	94%	0.944	80%	0.8	S	S	*	*				-140.4	111.9	126.5	-89.7	-58.9	0	0	0	109.9
86	E	27.4	Very low	27.1	Very low	177 Å²	177	150.5 Å²	150.5	83%	0.827	80%	0.801	S	S	*	*			trans	-66	152.3	-179.4	-71.4	174.8	147.9	0	0	112.8
87	A	26.5	Very low	27.2	Very low	86 Å²	86	151.5 Å²	151.5	71%	0.711	80%	0.803	S	S	*	*			trans	-56.7	138.1	-178.6	0	0	0	0	0	114
88	K	28.7	Very low	27.3	Very low	206 Å²	206	150.3 Å²	150.3	90%	0.896	80%	0.8	S	S	*	*			trans	-125.6	97.3	144.3	-83.3	-174.2	176.3	178.4	0	108.5
89	Q	25.2	Very low	27.6	Very low	185 Å²	185	148.6 Å²	148.6	86%	0.864	80%	0.797	S	S	*	*			trans	-67	120	159.1	-73.8	173.9	-12.5	0	0	108.2
90	T	29	Very low	27.9	Very low	134 Å²	134	142.7 Å²	142.7	82%	0.822	79%	0.789	S	S	*	*			trans	-143.8	119.9	152.4	42	0	0	0	0	107.1
91	S	26.1	Very low	28.1	Very low	97 Å²	97	143.7 Å²	143.7	68%	0.678	79%	0.787	S	S	*	*			trans	-63	165.7	179.3	49.9	0	0	0	0	112.5
92	D	27.7	Very low	29.2	Very low	154 Å²	154	139.9 Å²	139.9	82%	0.824	77%	0.767	S	S	*	*			trans	87.3	88	160.4	-50.4	-39.8	0	0	0	117.9
93	A	25.5	Very low	30.2	Very low	92 Å²	92	133.5 Å²	133.5	76%	0.76	73%	0.729	S	S	*	*			trans	-160	102.2	145.3	0	0	0	0	0	112.6
94	S	25.9	Very low	30.9	Very low	102 Å²	102	126.3 Å²	126.3	71%	0.713	70%	0.698	S	S	*	*			trans	35.6	138.1	141.7	64	0	0	0	0	121.7	L96	S94-L96 PolarHBondContact O-N 3.42Å; S94-L96 VanDerWaalsContact O-N 3.14Å
95	P	29.3	Very low	31.7	Very low	122 Å²	122	125 Å²	125	79%	0.792	69%	0.691	S	S	*	*			trans	-66.5	115.2	-169.8	28.4	-33.2	0	0	0	111.9	K97	P95-K97 PolarHBondContact O-N 3.43Å
96	L	28.5	Very low	32.4	Very low	176 Å²	176	120.3 Å²	120.3	92%	0.921	67%	0.673	S	S	*	*			trans	-54.8	98.8	167.9	-82.9	150.2	0	0	0	109.6	S94 S98	S94-L96 PolarHBondContact O-N 3.42Å; S94-L96 VanDerWaalsContact O-N 3.14Å; L96-S98 VanDerWaalsContact C-N 3.31Å; L96-S98 PolarHBondContact O-N 2.91Å
97	K	28	Very low	33.2	Very low	197 Å²	197	112.6 Å²	112.6	86%	0.857	64%	0.639	S	S	*	*			trans	-63.4	93.7	164	-77.5	179.5	177.7	171.7	0	108	P95 T99	P95-K97 PolarHBondContact O-N 3.43Å; K97-T99 PolarHBondContact O-N 3Å
98	S	27.4	Very low	34	Very low	110 Å²	110	113 Å²	113	77%	0.769	63%	0.628	S	S	*	*			trans	-61	103.5	170.3	59.9	0	0	0	0	108.9	L96	L96-S98 VanDerWaalsContact C-N 3.31Å; L96-S98 PolarHBondContact O-N 2.91Å
99	T	30.1	Very low	34	Very low	120 Å²	120	109.4 Å²	109.4	74%	0.736	62%	0.618	S	S	*	*			trans	-62	124.3	167.8	40.7	0	0	0	0	108.5	K97 I101	K97-T99 PolarHBondContact O-N 3Å; T99-I101 PolarHBondContact O-N 2.67Å
100	P	31.1	Very low	34.2	Very low	110 Å²	110	109.6 Å²	109.6	71%	0.714	62%	0.615	S	S	*	*			trans	-65.7	120	-176.1	24.5	-30.2	0	0	0	109.8	D102	P100-D102 PolarHBondContact O-N 2.7Å
101	I	33.1	Very low	34.2	Very low	130 Å²	130	110 Å²	110	67%	0.667	61%	0.612	S	S	*	*			trans	-68.5	109.9	-179.9	-62	167.4	0	0	0	109	T99 W103 D106	T99-I101 PolarHBondContact O-N 2.67Å; I101-W103 PolarHBondContact O-N 2.86Å; I101-D106 WeakPolarHBondContact CG2-OD2 3.37Å
102	D	49.3	Very low	34.3	Very low	56 Å²	56	110.5 Å²	110.5	30%	0.299	62%	0.615	S	S	.	*			trans	-77.9	80.5	-175.1	-168.2	5.3	0	0	0	111	P100 L104 K105 D106	P100-D102 PolarHBondContact O-N 2.7Å; D102-L104 PolarHBondContact O-N 3.48Å; D102-L104 VanDerWaalsContact O-N 3.16Å; D102-K105 HydrophobicContact CB-CB 4.11Å; D102-K105 WeakPolarHBondContact O-CA 3.25Å; D102-K105 WeakPolarHBondContact O-CB 3.38Å; D102-K105 PolarHBondContact O-N 3Å; D102-D106 PolarHBondContact O-N 2.65Å
103	W	50.4	Low	34.3	Very low	45 Å²	45	110.7 Å²	110.7	17%	0.17	62%	0.616	C	S	.	*	H	α-helix	trans	-58.1	-28.1	-172.8	67.9	-74	0	0	0	116.3	I101 K105 I567 K639 Y642 K643	I101-W103 PolarHBondContact O-N 2.86Å; W103-K105 PolarHBondContact O-N 3.03Å; W103-I567 HydrophobicContact CH2-CD1 4.17Å; W103-I567 HydrophobicContact CZ3-CG2 3.87Å; W103-K639 HydrophobicContact CD2-CD 4.45Å; W103-K639 HydrophobicContact CD2-CG 4.1Å; W103-K639 HydrophobicContact CE3-CG 4.45Å; W103-K639 HydrophobicContact CH2-CB 4.05Å; W103-K639 HydrophobicContact CH2-CG 4.21Å; W103-K639 HydrophobicContact CZ2-CB 4.04Å; W103-K639 HydrophobicContact CZ2-CD 3.86Å; W103-K639 HydrophobicContact CZ2-CG 3.85Å; W103-K639 HydrophobicContact CZ3-CG 4.49Å; W103-Y642 AromaticContact CE3-CD1 3.73Å; W103-Y642 HydrophobicContact CE3-CD1 3.73Å; W103-Y642 HydrophobicContact CE3-CE1 4.36Å; W103-Y642 HydrophobicContact CE3-CG 4.3Å; W103-Y642 HydrophobicContact CZ3-CD1 4.08Å; W103-Y642 HydrophobicContact CZ3-CG 4.19Å; W103-K643 HydrophobicContact CB-CD 4.1Å; W103-K643 HydrophobicContact CB-CG 4.01Å; W103-K643 HydrophobicContact CG-CD 4.38Å; W103-K643 HydrophobicContact CG-CG 4.41Å
104	L	41.1	Very low	34.4	Very low	10 Å²	10	112.6 Å²	112.6	5%	0.052	62%	0.618	C	S	.	*	H	α-helix	trans	-76.3	-14.2	177.7	-139.3	138.3	0	0	0	110.4	D102 I108 I567	D102-L104 PolarHBondContact O-N 3.48Å; D102-L104 VanDerWaalsContact O-N 3.16Å; L104-I108 VanDerWaalsContact O-CD1 3.3Å; L104-I108 WeakPolarHBondContact O-CD1 3.35Å; L104-I108 VanDerWaalsContact O-CG1 3.28Å; L104-I108 WeakPolarHBondContact O-CG1 3.31Å; L104-I567 HydrophobicContact CD1-CD1 4.48Å
105	K	43.9	Very low	34.5	Very low	112 Å²	112	113 Å²	113	49%	0.487	62%	0.621	S	S	.	*	H	α-helix	trans	-91.7	-33.1	174	-130.1	-174.3	-175.3	-175.9	0	113	D102 W103 A107 I108	D102-K105 HydrophobicContact CB-CB 4.11Å; D102-K105 WeakPolarHBondContact O-CA 3.25Å; D102-K105 WeakPolarHBondContact O-CB 3.38Å; D102-K105 PolarHBondContact O-N 3Å; W103-K105 PolarHBondContact O-N 3.03Å; K105-A107 PolarHBondContact O-N 2.64Å; K105-I108 HydrophobicContact CG-CD1 4.15Å; K105-I108 WeakPolarHBondContact O-CA 3.23Å; K105-I108 WeakPolarHBondContact O-CB 3.41Å; K105-I108 PolarHBondContact O-N 3.44Å
106	D	46.9	Very low	34.4	Very low	105 Å²	105	116.7 Å²	116.7	56%	0.561	63%	0.625	S	S	*	*	H	α-helix	trans	-63.7	-25.4	174	-70.9	-25.6	0	0	0	112.4	I101 D102 I108	I101-D106 WeakPolarHBondContact CG2-OD2 3.37Å; D102-D106 PolarHBondContact O-N 2.65Å; D106-I108 PolarHBondContact O-N 2.93Å
107	A	44.5	Very low	34.4	Very low	15 Å²	15	116.1 Å²	116.1	12%	0.124	62%	0.618	C	S	.	*	T	Hydrogen-bonded Turn	trans	-59.3	-25.6	166.6	0	0	0	0	0	114	K105 Q566 Y642	K105-A107 PolarHBondContact O-N 2.64Å; A107-Q566 VanDerWaalsContact CB-OE1 3.25Å; A107-Q566 PolarHBondContact O-NE2 2.88Å; A107-Q566 PolarHBondContact O-OE1 3.42Å; A107-Y642 WeakPolarHBondContact CA-OH 3.47Å; A107-Y642 HydrophobicContact CB-CE1 4.36Å; A107-Y642 WeakPolarHBondContact CB-OH 3.45Å
108	I	42	Very low	34.4	Very low	95 Å²	95	114 Å²	114	49%	0.487	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94	-24	-163.2	-56.9	179.2	0	0	0	112.8	L104 K105 D106	L104-I108 VanDerWaalsContact O-CD1 3.3Å; L104-I108 WeakPolarHBondContact O-CD1 3.35Å; L104-I108 VanDerWaalsContact O-CG1 3.28Å; L104-I108 WeakPolarHBondContact O-CG1 3.31Å; K105-I108 HydrophobicContact CG-CD1 4.15Å; K105-I108 WeakPolarHBondContact O-CA 3.23Å; K105-I108 WeakPolarHBondContact O-CB 3.41Å; K105-I108 PolarHBondContact O-N 3.44Å; D106-I108 PolarHBondContact O-N 2.93Å
109	I	29	Very low	34.4	Very low	131 Å²	131	116.7 Å²	116.7	67%	0.672	62%	0.62	S	S	*	*	S	Bend	trans	-100.1	-9.5	-162.3	-63.7	179.2	0	0	0	115.5	I111	I109-I111 PolarHBondContact O-N 3.49Å
110	K	29.4	Very low	34.1	Very low	188 Å²	188	118.7 Å²	118.7	82%	0.817	63%	0.625	S	S	*	*			trans	-92.7	74.2	176.4	-75.2	-165.7	175.5	-166.5	0	112.8
111	I	28.7	Very low	33.8	Very low	144 Å²	144	122.3 Å²	122.3	74%	0.738	63%	0.632	S	S	*	*			trans	-140.3	85.5	159.9	-51.8	176.6	0	0	0	106.7	I109	I109-I111 PolarHBondContact O-N 3.49Å
112	S	27.7	Very low	33.4	Very low	106 Å²	106	122 Å²	122	74%	0.741	64%	0.64	S	S	*	*			trans	-116.7	107.1	167.8	56.4	0	0	0	0	108.1
113	D	27.8	Very low	32.1	Very low	158 Å²	158	126.2 Å²	126.2	85%	0.845	67%	0.668	S	S	*	*			trans	42.4	83.9	144.3	-54.1	-25.3	0	0	0	117.7
114	T	29.2	Very low	31	Very low	132 Å²	132	130.4 Å²	130.4	81%	0.81	70%	0.699	S	S	*	*			trans	-114.3	115.9	146.9	50.5	0	0	0	0	108.1
115	S	27.8	Very low	30.1	Very low	111 Å²	111	133.7 Å²	133.7	78%	0.776	74%	0.735	S	S	*	*			trans	-48.7	132.6	-172.9	45	0	0	0	0	113.8	Q117	S115-Q117 VanDerWaalsContact C-N 3.34Å; S115-Q117 PolarHBondContact O-N 2.85Å
116	F	26.5	Very low	29.2	Very low	200 Å²	200	131.6 Å²	131.6	88%	0.877	75%	0.745	S	S	*	*	S	Bend	trans	-90.6	25.5	-166.1	-131.9	-90.5	0	0	0	113.8
117	Q	27.8	Very low	28.2	Very low	164 Å²	164	132 Å²	132	77%	0.766	76%	0.756	S	S	*	*			trans	-104.4	-10.5	-162.4	-133	96.4	13	0	0	116.7	S115	S115-Q117 VanDerWaalsContact C-N 3.34Å; S115-Q117 PolarHBondContact O-N 2.85Å
118	D	28.6	Very low	27.3	Very low	153 Å²	153	138 Å²	138	82%	0.818	79%	0.791	S	S	*	*	S	Bend	trans	-107.7	13.1	-166.2	-68.8	-14.6	0	0	0	116.6
119	I	27.4	Very low	26.5	Very low	166 Å²	166	142 Å²	142	85%	0.851	81%	0.807	S	S	*	*	S	Bend	trans	-127.7	25.4	-177.1	-40.3	-178.9	0	0	0	113.2
120	L	23.2	Very low	26.2	Very low	162 Å²	162	140.9 Å²	140.9	85%	0.848	81%	0.811	S	S	*	*	S	Bend	trans	-101	6.5	178.5	-106.5	162.8	0	0	0	115.8
121	E	24.7	Very low	26	Very low	185 Å²	185	139.6 Å²	139.6	86%	0.864	81%	0.813	S	S	*	*			trans	-130.6	86	179.1	-70.8	-174.7	171.9	0	0	112
122	C	25.5	Very low	25.9	Very low	123 Å²	123	138.3 Å²	138.3	83%	0.831	82%	0.815	S	S	*	*			trans	-156.1	74.8	157	-94.4	0	0	0	0	108.9	V124	C122-V124 PolarHBondContact O-N 3.27Å
123	T	22.8	Very low	25.8	Very low	146 Å²	146	140.1 Å²	140.1	90%	0.896	81%	0.814	S	S	*	*			trans	-72	107.8	162.9	42.3	0	0	0	0	108.8
124	V	26.6	Very low	25.9	Very low	133 Å²	133	140.7 Å²	140.7	81%	0.806	81%	0.811	S	S	*	*			trans	-114.9	103.9	170.6	-179.2	0	0	0	0	108.5	C122	C122-V124 PolarHBondContact O-N 3.27Å
125	G	21.8	Very low	25.8	Very low	79 Å²	79	141.9 Å²	141.9	81%	0.814	81%	0.813	S	S	*	*			trans	-80.4	141.2	159.2	0	0	0	0	0	109.6
126	G	25.9	Very low	25.9	Very low	68 Å²	68	142.4 Å²	142.4	70%	0.701	81%	0.812	S	S	*	*			trans	-175.6	95	177	0	0	0	0	0	109.5
127	S	24.8	Very low	25.9	Very low	114 Å²	114	141.8 Å²	141.8	80%	0.797	81%	0.809	S	S	*	*			trans	-61.8	127.7	176.1	42.2	0	0	0	0	111.3
128	V	26	Very low	26.2	Very low	141 Å²	141	136.5 Å²	136.5	86%	0.855	80%	0.798	S	S	*	*			trans	-84.6	109.9	175.7	176	0	0	0	0	108.5
129	E	24.3	Very low	26.5	Very low	178 Å²	178	137.2 Å²	137.2	83%	0.832	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-77.6	125.5	169.5	-72.4	-178.3	163.3	0	0	110
130	S	24.1	Very low	26.5	Very low	107 Å²	107	133.6 Å²	133.6	75%	0.748	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-82.7	118	-177.8	53.2	0	0	0	0	111.1	P132	S130-P132 WeakPolarHBondContact O-CD 3.29Å
131	N	24.1	Very low	26.9	Very low	161 Å²	161	129.9 Å²	129.9	86%	0.861	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-72.4	118.4	170.9	-79.8	-29.9	0	0	0	111.2
132	P	28.4	Very low	27.3	Very low	118 Å²	118	127.2 Å²	127.2	77%	0.766	76%	0.761	S	S	*	*			trans	-105.9	94.4	175.8	33.7	-18.4	0	0	0	109.6	S130	S130-P132 WeakPolarHBondContact O-CD 3.29Å
133	I	25.4	Very low	27.4	Very low	144 Å²	144	125.9 Å²	125.9	74%	0.738	74%	0.739	S	S	*	*			trans	-139.5	101.4	166.4	-55.1	177.9	0	0	0	108.1
134	H	29.3	Very low	28.1	Very low	169 Å²	169	124.6 Å²	124.6	78%	0.782	72%	0.723	S	S	*	*			trans	175.9	80.8	133.9	-98.1	-69.6	0	0	0	109.5
135	N	27.8	Very low	28.4	Very low	158 Å²	158	126.4 Å²	126.4	85%	0.845	72%	0.716	S	S	*	*			trans	-115.1	92.7	165.1	-91.7	-18.5	0	0	0	107.6
136	T	28.1	Very low	29.5	Very low	122 Å²	122	125 Å²	125	75%	0.748	70%	0.701	S	S	*	*			trans	178.8	65.3	157.8	27	0	0	0	0	112.3
137	F	28.2	Very low	30.8	Very low	186 Å²	186	125.9 Å²	125.9	82%	0.816	69%	0.69	S	S	*	*			trans	-153.1	82.9	159.9	-86.6	-72.1	0	0	0	110.4
138	G	33.8	Very low	32.7	Very low	53 Å²	53	123.5 Å²	123.5	55%	0.546	67%	0.67	S	S	.	*			trans	-81.9	-11	-170.7	0	0	0	0	0	117.1	L141	G138-L141 WeakPolarHBondContact O-CD1 3.3Å
139	D	34.3	Very low	35.2	Very low	168 Å²	168	119.9 Å²	119.9	90%	0.898	64%	0.642	S	S	*	*	S	Bend	trans	-109.3	6.3	-168.2	-69.1	-26.6	0	0	0	115.6
140	L	28.2	Very low	37.8	Very low	91 Å²	91	114.7 Å²	114.7	48%	0.476	62%	0.616	S	S	.	*			trans	-96.3	9.5	174.3	-101.2	148	0	0	0	114.2	T142	L140-T142 VanDerWaalsContact C-N 3.3Å; L140-T142 PolarHBondContact O-N 2.92Å; L140-T142 VanDerWaalsContact O-N 3.07Å
141	L	30.4	Very low	40.4	Very low	83 Å²	83	115.7 Å²	115.7	44%	0.435	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.4	12.7	-166.9	-77.2	171	0	0	0	117.2	G138 R145	G138-L141 WeakPolarHBondContact O-CD1 3.3Å; L141-R145 VanDerWaalsContact O-CD 3.28Å; L141-R145 WeakPolarHBondContact O-CD 3.41Å; L141-R145 VanDerWaalsContact O-CG 3.29Å; L141-R145 WeakPolarHBondContact O-CG 3.05Å; L141-R145 PolarHBondContact O-NE 2.77Å
142	T	34	Very low	43.2	Very low	129 Å²	129	111.1 Å²	111.1	79%	0.791	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	-30	173.4	44.7	0	0	0	0	113.9	L140	L140-T142 VanDerWaalsContact C-N 3.3Å; L140-T142 PolarHBondContact O-N 2.92Å; L140-T142 VanDerWaalsContact O-N 3.07Å
143	Y	27.8	Very low	46	Very low	95 Å²	95	105.7 Å²	105.7	37%	0.373	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-41.1	177.9	-145.8	-98	0	0	0	112.1	R145 G146 L1189	Y143-R145 PolarHBondContact O-N 3.41Å; Y143-R145 VanDerWaalsContact O-N 3.16Å; Y143-G146 PolarHBondContact O-N 3.5Å; Y143-L1189 HydrophobicContact CD2-CD1 3.67Å; Y143-L1189 HydrophobicContact CD2-CD2 4.06Å; Y143-L1189 HydrophobicContact CD2-CG 4.35Å; Y143-L1189 HydrophobicContact CE2-CB 4.23Å; Y143-L1189 HydrophobicContact CE2-CD1 3.81Å; Y143-L1189 HydrophobicContact CE2-CD2 4.43Å; Y143-L1189 HydrophobicContact CE2-CG 4.38Å; Y143-L1189 HydrophobicContact CG-CD2 4.29Å
144	E	36.2	Very low	48.6	Very low	120 Å²	120	99.9 Å²	99.9	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-63.1	-23.8	175.5	-72.4	-170.9	162.4	0	0	113	G146 D147 T148	E144-G146 VanDerWaalsContact C-N 3.31Å; E144-G146 PolarHBondContact O-N 3.38Å; E144-D147 PolarHBondContact O-N 3.29Å; E144-T148 VanDerWaalsContact O-CB 3.25Å; E144-T148 WeakPolarHBondContact O-CB 3.43Å; E144-T148 WeakPolarHBondContact O-CG2 3.5Å; E144-T148 PolarHBondContact O-N 3.47Å; E144-T148 PolarHBondContact O-OG1 3.35Å
145	R	34.2	Very low	50.9	Low	170 Å²	170	93.2 Å²	93.2	64%	0.642	50%	0.497	S	S	*	.	H	α-helix	trans	-66.4	-30.3	179.1	-81.8	-177.6	-175.2	-175	4.9	113.7	L141 Y143 T148 Y149	L141-R145 VanDerWaalsContact O-CD 3.28Å; L141-R145 WeakPolarHBondContact O-CD 3.41Å; L141-R145 VanDerWaalsContact O-CG 3.29Å; L141-R145 WeakPolarHBondContact O-CG 3.05Å; L141-R145 PolarHBondContact O-NE 2.77Å; Y143-R145 PolarHBondContact O-N 3.41Å; Y143-R145 VanDerWaalsContact O-N 3.16Å; R145-T148 WeakPolarHBondContact CA-OG1 3.35Å; R145-T148 PolarHBondContact O-OG1 2.8Å; R145-Y149 WeakPolarHBondContact O-CB 3.38Å; R145-Y149 PolarHBondContact O-N 2.68Å
146	G	43.9	Very low	53.6	Low	49 Å²	49	85.7 Å²	85.7	51%	0.505	46%	0.456	S	S	.	.	H	α-helix	trans	-70.4	-49.9	175.8	0	0	0	0	0	111.7	Y143 E144 Y149 K150	Y143-G146 PolarHBondContact O-N 3.5Å; E144-G146 VanDerWaalsContact C-N 3.31Å; E144-G146 PolarHBondContact O-N 3.38Å; G146-Y149 PolarHBondContact O-N 3.08Å; G146-K150 PolarHBondContact O-N 3.27Å
147	D	53.4	Low	56.1	Low	88 Å²	88	80.3 Å²	80.3	47%	0.471	42%	0.423	S	S	.	.	H	α-helix	trans	-70.5	-39.8	-178.8	-79.8	-24.6	0	0	0	112.7	E144 Y149 K150 Q151	E144-D147 PolarHBondContact O-N 3.29Å; D147-Y149 VanDerWaalsContact C-N 3.27Å; D147-Y149 PolarHBondContact O-N 2.86Å; D147-K150 PolarHBondContact O-N 3.31Å; D147-Q151 WeakPolarHBondContact O-CB 3.39Å; D147-Q151 WeakPolarHBondContact O-CG 3.15Å; D147-Q151 PolarHBondContact O-N 3.16Å
148	T	65.8	Low	58.3	Low	63 Å²	63	73.8 Å²	73.8	39%	0.387	40%	0.4	S	S	.	.	H	α-helix	trans	-60	-39.1	176.3	50.2	0	0	0	0	111.5	E144 R145 Q151 L152	E144-T148 VanDerWaalsContact O-CB 3.25Å; E144-T148 WeakPolarHBondContact O-CB 3.43Å; E144-T148 WeakPolarHBondContact O-CG2 3.5Å; E144-T148 PolarHBondContact O-N 3.47Å; E144-T148 PolarHBondContact O-OG1 3.35Å; R145-T148 WeakPolarHBondContact CA-OG1 3.35Å; R145-T148 PolarHBondContact O-OG1 2.8Å; T148-Q151 PolarHBondContact O-N 2.97Å; T148-L152 VanDerWaalsContact O-CG 3.31Å; T148-L152 WeakPolarHBondContact O-CG 3.28Å; T148-L152 PolarHBondContact O-N 3.36Å
149	Y	78.2	Confident	60.2	Low	65 Å²	65	72.3 Å²	72.3	26%	0.255	38%	0.381	S	S	.	.	H	α-helix	trans	-70.4	-43.3	178.9	174.9	-109.2	0	0	0	112.9	R145 G146 D147 Q151 L152 K153 K187 D188	R145-Y149 WeakPolarHBondContact O-CB 3.38Å; R145-Y149 PolarHBondContact O-N 2.68Å; G146-Y149 PolarHBondContact O-N 3.08Å; D147-Y149 VanDerWaalsContact C-N 3.27Å; D147-Y149 PolarHBondContact O-N 2.86Å; Y149-Q151 VanDerWaalsContact C-N 3.27Å; Y149-Q151 PolarHBondContact O-N 3.06Å; Y149-L152 PolarHBondContact O-N 2.86Å; Y149-K153 HydrophobicContact CE1-CD 4.08Å; Y149-K153 HydrophobicContact CE2-CG 4.48Å; Y149-K153 PolarHBondContact O-N 2.83Å; Y149-K153 VanDerWaalsContact O-N 3.09Å; Y149-K153 WeakPolarHBondContact OH-CE 3.41Å; Y149-K153 PolarHBondContact OH-NZ 3.31Å; Y149-K187 HydrophobicContact CD2-CB 3.76Å; Y149-K187 HydrophobicContact CD2-CG 4.24Å; Y149-K187 HydrophobicContact CE2-CB 3.55Å; Y149-D188 HydrophobicContact CE2-CB 3.96Å; Y149-D188 WeakPolarHBondContact OH-CB 3.3Å; Y149-D188 VanDerWaalsContact OH-CG 3.29Å; Y149-D188 PolarHBondContact OH-OD2 2.92Å
150	K	78.9	Confident	62.2	Low	69 Å²	69	64.3 Å²	64.3	30%	0.3	34%	0.339	S	S	.	.	H	α-helix	trans	-56.3	-45.9	171.8	-173.5	-179.1	175.9	-171.1	0	110.1	G146 D147 L152 K153 L154 D736 L739	G146-K150 PolarHBondContact O-N 3.27Å; D147-K150 PolarHBondContact O-N 3.31Å; K150-L152 PolarHBondContact O-N 2.93Å; K150-K153 PolarHBondContact O-N 3.37Å; K150-L154 HydrophobicContact CG-CD1 4.19Å; K150-L154 HydrophobicContact CG-CG 4.46Å; K150-L154 WeakPolarHBondContact O-CB 3.15Å; K150-L154 VanDerWaalsContact O-CG 3.29Å; K150-L154 WeakPolarHBondContact O-CG 3.38Å; K150-L154 PolarHBondContact O-N 3.41Å; K150-D736 WeakPolarHBondContact CE-OD1 3.48Å; K150-D736 IonicContact NZ-OD1 3.37Å; K150-D736 PolarHBondContact NZ-OD1 3.28Å; K150-D736 IonicContact NZ-OD2 3.76Å; K150-D736 PolarHBondContact NZ-OD2 3.47Å; K150-L739 HydrophobicContact CG-CD2 3.71Å
151	Q	77.7	Confident	64.1	Low	128 Å²	128	60 Å²	60	60%	0.598	32%	0.316	S	S	*	.	H	α-helix	trans	-61.5	-38.6	176.6	-73.7	174.7	4.2	0	0	113.1	D147 T148 Y149 L154 G155	D147-Q151 WeakPolarHBondContact O-CB 3.39Å; D147-Q151 WeakPolarHBondContact O-CG 3.15Å; D147-Q151 PolarHBondContact O-N 3.16Å; T148-Q151 PolarHBondContact O-N 2.97Å; Y149-Q151 VanDerWaalsContact C-N 3.27Å; Y149-Q151 PolarHBondContact O-N 3.06Å; Q151-L154 PolarHBondContact O-N 3.29Å; Q151-G155 PolarHBondContact O-N 3.12Å
152	L	83.1	Confident	65.7	Low	65 Å²	65	57.6 Å²	57.6	34%	0.34	31%	0.306	S	S	.	.	H	α-helix	trans	-62.3	-45.6	175	-72.8	177.1	0	0	0	111.7	T148 Y149 K150 G155 L156 A183 C184	T148-L152 VanDerWaalsContact O-CG 3.31Å; T148-L152 WeakPolarHBondContact O-CG 3.28Å; T148-L152 PolarHBondContact O-N 3.36Å; Y149-L152 PolarHBondContact O-N 2.86Å; K150-L152 PolarHBondContact O-N 2.93Å; L152-G155 PolarHBondContact O-N 3.24Å; L152-L156 PolarHBondContact O-N 3.47Å; L152-A183 HydrophobicContact CD1-CB 4.27Å; L152-A183 HydrophobicContact CD2-CB 3.64Å; L152-C184 VanDerWaalsContact C-SG 3.56Å; L152-C184 PolarHBondContact O-SG 3.24Å
153	K	86.6	Confident	67	Low	4 Å²	4	51.5 Å²	51.5	2%	0.017	27%	0.269	C	S	.	.	H	α-helix	trans	-63.5	-44.8	176.5	-71	-167	167.7	178.6	0	111.9	Y149 K150 G155 L156 I157 D188 F191 L739 E743	Y149-K153 HydrophobicContact CE1-CD 4.08Å; Y149-K153 HydrophobicContact CE2-CG 4.48Å; Y149-K153 PolarHBondContact O-N 2.83Å; Y149-K153 VanDerWaalsContact O-N 3.09Å; Y149-K153 WeakPolarHBondContact OH-CE 3.41Å; Y149-K153 PolarHBondContact OH-NZ 3.31Å; K150-K153 PolarHBondContact O-N 3.37Å; K153-G155 VanDerWaalsContact C-N 3.32Å; K153-G155 PolarHBondContact O-N 3.05Å; K153-L156 PolarHBondContact O-N 2.9Å; K153-I157 VanDerWaalsContact O-CG1 3.3Å; K153-I157 WeakPolarHBondContact O-CG1 3.48Å; K153-I157 PolarHBondContact O-N 3.26Å; K153-D188 WeakPolarHBondContact CE-OD2 3.23Å; K153-D188 IonicContact NZ-OD2 3.97Å; K153-D188 PolarHBondContact NZ-OD2 2.77Å; K153-F191 HydrophobicContact CB-CD1 4.42Å; K153-F191 HydrophobicContact CB-CE1 3.71Å; K153-F191 HydrophobicContact CB-CZ 3.81Å; K153-F191 HydrophobicContact CD-CD1 3.98Å; K153-F191 HydrophobicContact CD-CD2 3.84Å; K153-F191 HydrophobicContact CD-CE1 3.89Å; K153-F191 HydrophobicContact CD-CE2 3.75Å; K153-F191 HydrophobicContact CD-CG 3.95Å; K153-F191 HydrophobicContact CD-CZ 3.77Å; K153-F191 VanDerWaalsContact CE-CG 3.48Å; K153-F191 HydrophobicContact CG-CD1 3.83Å; K153-F191 HydrophobicContact CG-CE1 3.62Å; K153-F191 HydrophobicContact CG-CE2 4.4Å; K153-F191 HydrophobicContact CG-CG 4.31Å; K153-F191 HydrophobicContact CG-CZ 3.93Å; K153-L739 HydrophobicContact CB-CD1 3.61Å; K153-L739 HydrophobicContact CD-CD1 3.66Å; K153-L739 HydrophobicContact CG-CD1 4.29Å; K153-E743 IonicContact NZ-OE1 2.79Å; K153-E743 PolarHBondContact NZ-OE1 2.85Å
154	L	81.1	Confident	68.3	Low	22 Å²	22	48.2 Å²	48.2	12%	0.115	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-40.6	175.3	-69.5	-177.8	0	0	0	111.8	K150 Q151 L156 I157 S158 E735 L739	K150-L154 HydrophobicContact CG-CD1 4.19Å; K150-L154 HydrophobicContact CG-CG 4.46Å; K150-L154 WeakPolarHBondContact O-CB 3.15Å; K150-L154 VanDerWaalsContact O-CG 3.29Å; K150-L154 WeakPolarHBondContact O-CG 3.38Å; K150-L154 PolarHBondContact O-N 3.41Å; Q151-L154 PolarHBondContact O-N 3.29Å; L154-L156 VanDerWaalsContact C-N 3.35Å; L154-L156 PolarHBondContact O-N 3.47Å; L154-I157 HydrophobicContact CD2-CD1 4.26Å; L154-I157 PolarHBondContact O-N 3Å; L154-S158 WeakPolarHBondContact O-CB 3.43Å; L154-S158 PolarHBondContact O-N 3.19Å; L154-E735 HydrophobicContact CD1-CB 4.32Å; L154-E735 HydrophobicContact CD2-CB 3.76Å; L154-E735 WeakPolarHBondContact CD2-O 3.34Å; L154-L739 HydrophobicContact CD2-CB 3.99Å; L154-L739 HydrophobicContact CD2-CD2 4.24Å; L154-L739 HydrophobicContact CG-CD2 4.44Å
155	G	77.4	Confident	68.8	Low	30 Å²	30	43.2 Å²	43.2	31%	0.309	24%	0.235	S	C	.	.	H	α-helix	trans	-59.4	-43.2	173.7	0	0	0	0	0	112.4	Q151 L152 K153 S158 C159	Q151-G155 PolarHBondContact O-N 3.12Å; L152-G155 PolarHBondContact O-N 3.24Å; K153-G155 VanDerWaalsContact C-N 3.32Å; K153-G155 PolarHBondContact O-N 3.05Å; G155-S158 PolarHBondContact O-N 3Å; G155-C159 WeakPolarHBondContact O-CB 3.33Å; G155-C159 PolarHBondContact O-N 3.38Å; G155-C159 PolarHBondContact O-SG 3.05Å
156	L	83.7	Confident	69.4	Low	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65	-44.5	174.3	178.6	62.1	0	0	0	112.1	L152 K153 L154 S158 C159 I160 L177 I181 C184 F191 I192	L152-L156 PolarHBondContact O-N 3.47Å; K153-L156 PolarHBondContact O-N 2.9Å; L154-L156 VanDerWaalsContact C-N 3.35Å; L154-L156 PolarHBondContact O-N 3.47Å; L156-S158 VanDerWaalsContact C-N 3.32Å; L156-S158 PolarHBondContact O-N 3.41Å; L156-C159 PolarHBondContact O-N 3.17Å; L156-I160 HydrophobicContact CD1-CD1 4.03Å; L156-I160 HydrophobicContact CD1-CG1 4.25Å; L156-I160 HydrophobicContact CG-CD1 3.9Å; L156-I160 WeakPolarHBondContact O-CB 3.46Å; L156-I160 WeakPolarHBondContact O-CG1 3.17Å; L156-I160 PolarHBondContact O-N 2.88Å; L156-L177 HydrophobicContact CD1-CD1 3.81Å; L156-I181 HydrophobicContact CD1-CG1 3.7Å; L156-C184 HydrophobicContact CD2-CB 4.23Å; L156-F191 HydrophobicContact CD2-CD1 4.16Å; L156-F191 HydrophobicContact CD2-CE1 4.07Å; L156-I192 HydrophobicContact CD2-CD1 3.38Å
157	I	81.6	Confident	69.6	Low	8 Å²	8	38.9 Å²	38.9	4%	0.041	23%	0.229	C	C	.	.	H	α-helix	trans	-60.1	-43.5	177.2	-68.3	164.7	0	0	0	110.5	K153 L154 I160 S161 F191 L738 L739 I742	K153-I157 VanDerWaalsContact O-CG1 3.3Å; K153-I157 WeakPolarHBondContact O-CG1 3.48Å; K153-I157 PolarHBondContact O-N 3.26Å; L154-I157 HydrophobicContact CD2-CD1 4.26Å; L154-I157 PolarHBondContact O-N 3Å; I157-I160 PolarHBondContact O-N 3Å; I157-S161 VanDerWaalsContact O-CB 3.28Å; I157-S161 WeakPolarHBondContact O-CB 3.18Å; I157-S161 PolarHBondContact O-N 2.98Å; I157-S161 PolarHBondContact O-OG 3.12Å; I157-F191 HydrophobicContact CD1-CZ 4.02Å; I157-F191 HydrophobicContact CG1-CZ 4.19Å; I157-L738 HydrophobicContact CG2-CD2 3.49Å; I157-L738 VanDerWaalsContact CG2-CD2 3.49Å; I157-L738 HydrophobicContact CG2-CG 4.16Å; I157-L739 HydrophobicContact CD1-CB 4.18Å; I157-L739 HydrophobicContact CD1-CD1 3.79Å; I157-I742 HydrophobicContact CD1-CD1 3.7Å; I157-I742 HydrophobicContact CG1-CD1 3.68Å; I157-I742 HydrophobicContact CG2-CD1 4.29Å
158	S	73.8	Confident	69.6	Low	50 Å²	50	35.8 Å²	35.8	35%	0.35	22%	0.218	S	C	.	.	H	α-helix	trans	-62.5	-43.4	176.5	-176.8	0	0	0	0	111.9	L154 G155 L156 I160 S161 S162	L154-S158 WeakPolarHBondContact O-CB 3.43Å; L154-S158 PolarHBondContact O-N 3.19Å; G155-S158 PolarHBondContact O-N 3Å; L156-S158 VanDerWaalsContact C-N 3.32Å; L156-S158 PolarHBondContact O-N 3.41Å; S158-I160 PolarHBondContact O-N 3.12Å; S158-S161 PolarHBondContact O-N 3.3Å; S158-S162 WeakPolarHBondContact O-CB 3.46Å; S158-S162 PolarHBondContact O-N 2.74Å; S158-S162 PolarHBondContact O-OG 2.93Å; S158-S162 VanDerWaalsContact O-OG 3.13Å
159	C	74.6	Confident	69.1	Low	21 Å²	21	33.2 Å²	33.2	14%	0.142	20%	0.202	C	C	.	.	H	α-helix	trans	-64.2	-39.4	175.2	-71	0	0	0	0	113.2	G155 L156 S162 S163 L177	G155-C159 WeakPolarHBondContact O-CB 3.33Å; G155-C159 PolarHBondContact O-N 3.38Å; G155-C159 PolarHBondContact O-SG 3.05Å; L156-C159 PolarHBondContact O-N 3.17Å; C159-S162 PolarHBondContact O-OG 2.91Å; C159-S163 PolarHBondContact O-N 2.9Å; C159-S163 PolarHBondContact O-OG 3.16Å; C159-L177 HydrophobicContact CB-CD1 3.97Å
160	I	76	Confident	68.4	Low	1 Å²	1	32.1 Å²	32.1	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-46.1	175.3	-75.8	171	0	0	0	110.5	L156 I157 S158 S162 S163 I164 L177 A195 C199 L203 T208 L212	L156-I160 HydrophobicContact CD1-CD1 4.03Å; L156-I160 HydrophobicContact CD1-CG1 4.25Å; L156-I160 HydrophobicContact CG-CD1 3.9Å; L156-I160 WeakPolarHBondContact O-CB 3.46Å; L156-I160 WeakPolarHBondContact O-CG1 3.17Å; L156-I160 PolarHBondContact O-N 2.88Å; I157-I160 PolarHBondContact O-N 3Å; S158-I160 PolarHBondContact O-N 3.12Å; I160-S162 PolarHBondContact O-N 3.03Å; I160-S163 WeakPolarHBondContact O-CA 3.36Å; I160-S163 VanDerWaalsContact O-CB 3.25Å; I160-S163 WeakPolarHBondContact O-CB 3.39Å; I160-S163 PolarHBondContact O-N 2.96Å; I160-I164 PolarHBondContact O-N 3.43Å; I160-L177 HydrophobicContact CG1-CD1 3.91Å; I160-A195 HydrophobicContact CD1-CB 3.79Å; I160-C199 WeakPolarHBondContact CG2-SG 3.31Å; I160-L203 HydrophobicContact CG2-CD1 4.11Å; I160-T208 HydrophobicContact CG1-CG2 4.42Å; I160-L212 HydrophobicContact CD1-CD1 4.02Å
161	S	67.6	Low	67.8	Low	1 Å²	1	35.5 Å²	35.5	1%	0.007	22%	0.219	C	C	.	.	H	α-helix	trans	-62.8	-42.8	-178	-61.4	0	0	0	0	111.5	I157 S158 S163 I164 Y729	I157-S161 VanDerWaalsContact O-CB 3.28Å; I157-S161 WeakPolarHBondContact O-CB 3.18Å; I157-S161 PolarHBondContact O-N 2.98Å; I157-S161 PolarHBondContact O-OG 3.12Å; S158-S161 PolarHBondContact O-N 3.3Å; S161-S163 PolarHBondContact O-N 2.95Å; S161-I164 WeakPolarHBondContact O-CB 3.33Å; S161-I164 WeakPolarHBondContact O-CD1 3.46Å; S161-I164 VanDerWaalsContact O-CG1 3.3Å; S161-I164 WeakPolarHBondContact O-CG1 3.32Å; S161-I164 PolarHBondContact O-N 2.98Å; S161-Y729 VanDerWaalsContact CB-CE2 3.41Å
162	S	64.2	Low	67.2	Low	31 Å²	31	36.4 Å²	36.4	22%	0.217	22%	0.223	C	C	.	.	H	α-helix	trans	-67.9	-15.3	173.8	63.9	0	0	0	0	113.8	S158 C159 I160 K173	S158-S162 WeakPolarHBondContact O-CB 3.46Å; S158-S162 PolarHBondContact O-N 2.74Å; S158-S162 PolarHBondContact O-OG 2.93Å; S158-S162 VanDerWaalsContact O-OG 3.13Å; C159-S162 PolarHBondContact O-OG 2.91Å; I160-S162 PolarHBondContact O-N 3.03Å; S162-K173 PolarHBondContact O-NZ 3.34Å
163	S	61.6	Low	66.5	Low	2 Å²	2	35.3 Å²	35.3	1%	0.014	22%	0.215	C	C	.	.	H	α-helix	trans	-82.4	-16.9	175.2	-61.7	0	0	0	0	113.9	C159 I160 S161 V165	C159-S163 PolarHBondContact O-N 2.9Å; C159-S163 PolarHBondContact O-OG 3.16Å; I160-S163 WeakPolarHBondContact O-CA 3.36Å; I160-S163 VanDerWaalsContact O-CB 3.25Å; I160-S163 WeakPolarHBondContact O-CB 3.39Å; I160-S163 PolarHBondContact O-N 2.96Å; S161-S163 PolarHBondContact O-N 2.95Å; S163-V165 PolarHBondContact O-N 3.41Å; S163-V165 VanDerWaalsContact O-N 3.16Å
164	I	54.6	Low	65.9	Low	26 Å²	26	37.3 Å²	37.3	13%	0.133	22%	0.224	C	C	.	.	S	Bend	trans	-53.1	-35	173.2	-64.1	163.8	0	0	0	110.7	I160 S161 L203 I205 Y729	I160-I164 PolarHBondContact O-N 3.43Å; S161-I164 WeakPolarHBondContact O-CB 3.33Å; S161-I164 WeakPolarHBondContact O-CD1 3.46Å; S161-I164 VanDerWaalsContact O-CG1 3.3Å; S161-I164 WeakPolarHBondContact O-CG1 3.32Å; S161-I164 PolarHBondContact O-N 2.98Å; I164-L203 HydrophobicContact CD1-CD1 3.84Å; I164-L203 HydrophobicContact CD1-CD2 3.8Å; I164-L203 HydrophobicContact CD1-CG 4.28Å; I164-L203 HydrophobicContact CG1-CD1 4.14Å; I164-I205 HydrophobicContact CB-CD1 4.09Å; I164-I205 HydrophobicContact CD1-CD1 4.39Å; I164-I205 HydrophobicContact CG1-CD1 3.22Å; I164-I205 HydrophobicContact CG1-CG1 3.91Å; I164-Y729 HydrophobicContact CD1-CD2 4.44Å
165	V	47.2	Very low	65.5	Low	14 Å²	14	38.8 Å²	38.8	9%	0.085	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-38.9	-160.3	-176.5	0	0	0	0	113.6	S163 G167 F719 K720	S163-V165 PolarHBondContact O-N 3.41Å; S163-V165 VanDerWaalsContact O-N 3.16Å; V165-G167 VanDerWaalsContact C-N 3.33Å; V165-G167 PolarHBondContact O-N 3.02Å; V165-F719 HydrophobicContact CG1-CD1 4.49Å; V165-F719 HydrophobicContact CG2-CD1 3.34Å; V165-F719 HydrophobicContact CG2-CE1 3.61Å; V165-F719 HydrophobicContact CG2-CG 4.21Å; V165-K720 HydrophobicContact CG1-CB 4.08Å; V165-K720 WeakPolarHBondContact CG1-O 3.3Å
166	D	46.6	Very low	65.3	Low	63 Å²	63	41.3 Å²	41.3	34%	0.337	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	2.2	-172.4	-66.3	-28.4	0	0	0	113.6	G168 K173	D166-G168 VanDerWaalsContact CB-O 3.31Å; D166-G168 WeakPolarHBondContact CB-O 3.46Å; D166-G168 PolarHBondContact O-N 3.33Å; D166-K173 IonicContact OD1-NZ 3.51Å; D166-K173 WeakPolarHBondContact OD2-CD 3.38Å; D166-K173 WeakPolarHBondContact OD2-CE 3.49Å; D166-K173 IonicContact OD2-NZ 3.86Å; D166-K173 PolarHBondContact OD2-NZ 3.37Å
167	G	48.1	Very low	65.1	Low	66 Å²	66	41.4 Å²	41.4	68%	0.68	24%	0.237	S	C	*	.	S	Bend	trans	68.4	-15.4	-171.9	0	0	0	0	0	114.4	V165	V165-G167 VanDerWaalsContact C-N 3.33Å; V165-G167 PolarHBondContact O-N 3.02Å
168	G	52.7	Low	64.9	Low	23 Å²	23	41.3 Å²	41.3	24%	0.237	24%	0.239	C	C	.	.	S	Bend	trans	-169.1	150.3	166.5	0	0	0	0	0	110.2	D166 S170	D166-G168 VanDerWaalsContact CB-O 3.31Å; D166-G168 WeakPolarHBondContact CB-O 3.46Å; D166-G168 PolarHBondContact O-N 3.33Å; G168-S170 PolarHBondContact O-N 3.19Å
169	P	56.4	Low	65.2	Low	9 Å²	9	43.8 Å²	43.8	6%	0.058	25%	0.245	C	C	.	.			trans	-62.7	127.6	-175.8	25.2	-33.4	0	0	0	110.3	K173 K174 M211	P169-K173 HydrophobicContact CB-CB 4.08Å; P169-K174 HydrophobicContact CB-CG 3.8Å; P169-K174 HydrophobicContact CG-CG 3.76Å; P169-K174 VanDerWaalsContact O-CE 3.32Å; P169-K174 WeakPolarHBondContact O-CE 3.38Å; P169-M211 HydrophobicContact CG-SD 4.35Å
170	S	62.8	Low	65.5	Low	42 Å²	42	44 Å²	44	29%	0.294	25%	0.246	S	C	.	.			trans	-56.4	167.2	171	73.8	0	0	0	0	111	G168 E172 K173 K174	G168-S170 PolarHBondContact O-N 3.19Å; S170-E172 VanDerWaalsContact C-N 3.3Å; S170-E172 PolarHBondContact O-N 3.41Å; S170-K173 PolarHBondContact O-N 3.4Å; S170-K173 WeakPolarHBondContact OG-CB 3.39Å; S170-K173 WeakPolarHBondContact OG-CG 3.32Å; S170-K173 PolarHBondContact OG-N 2.9Å; S170-K173 VanDerWaalsContact OG-N 3.1Å; S170-K174 WeakPolarHBondContact O-CG 3.27Å; S170-K174 PolarHBondContact O-N 2.88Å
171	K	66.8	Low	65.9	Low	140 Å²	140	44 Å²	44	61%	0.609	25%	0.246	S	C	*	.	H	α-helix	trans	-56.2	-46.9	178.4	-74.8	-176.7	179.3	177.3	0	111.5	K174 I175	K171-K174 PolarHBondContact O-N 2.82Å; K171-I175 WeakPolarHBondContact O-CG1 3.33Å; K171-I175 PolarHBondContact O-N 2.81Å
172	E	65.6	Low	66.5	Low	146 Å²	146	46.3 Å²	46.3	68%	0.682	26%	0.257	S	S	*	.	H	α-helix	trans	-61.2	-48.3	175.2	-69.6	139.6	-153.3	0	0	111.5	S170 K174 I175 I176	S170-E172 VanDerWaalsContact C-N 3.3Å; S170-E172 PolarHBondContact O-N 3.41Å; E172-K174 VanDerWaalsContact C-N 3.27Å; E172-K174 PolarHBondContact O-N 3.1Å; E172-I175 WeakPolarHBondContact O-CA 3.41Å; E172-I175 WeakPolarHBondContact O-CB 3.45Å; E172-I175 PolarHBondContact O-N 3.49Å; E172-I176 WeakPolarHBondContact O-CG1 3.27Å; E172-I176 PolarHBondContact O-N 3.03Å
173	K	67.9	Low	67.3	Low	43 Å²	43	46.4 Å²	46.4	19%	0.187	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-32.8	179	-76.7	-177.4	176.7	176.5	0	112.9	S162 D166 P169 S170 I175 L177	S162-K173 PolarHBondContact O-NZ 3.34Å; D166-K173 IonicContact OD1-NZ 3.51Å; D166-K173 WeakPolarHBondContact OD2-CD 3.38Å; D166-K173 WeakPolarHBondContact OD2-CE 3.49Å; D166-K173 IonicContact OD2-NZ 3.86Å; D166-K173 PolarHBondContact OD2-NZ 3.37Å; P169-K173 HydrophobicContact CB-CB 4.08Å; S170-K173 PolarHBondContact O-N 3.4Å; S170-K173 WeakPolarHBondContact OG-CB 3.39Å; S170-K173 WeakPolarHBondContact OG-CG 3.32Å; S170-K173 PolarHBondContact OG-N 2.9Å; S170-K173 VanDerWaalsContact OG-N 3.1Å; K173-I175 VanDerWaalsContact C-N 3.3Å; K173-I175 PolarHBondContact O-N 3.5Å; K173-L177 WeakPolarHBondContact O-CB 3.24Å; K173-L177 PolarHBondContact O-N 3.12Å
174	K	74	Confident	68.5	Low	45 Å²	45	46.3 Å²	46.3	20%	0.196	26%	0.259	C	S	.	.	H	α-helix	trans	-64.8	-35.8	173.7	-73.8	176.5	-175.6	176.9	0	112.3	P169 S170 K171 E172 G178 M211	P169-K174 HydrophobicContact CB-CG 3.8Å; P169-K174 HydrophobicContact CG-CG 3.76Å; P169-K174 VanDerWaalsContact O-CE 3.32Å; P169-K174 WeakPolarHBondContact O-CE 3.38Å; S170-K174 WeakPolarHBondContact O-CG 3.27Å; S170-K174 PolarHBondContact O-N 2.88Å; K171-K174 PolarHBondContact O-N 2.82Å; E172-K174 VanDerWaalsContact C-N 3.27Å; E172-K174 PolarHBondContact O-N 3.1Å; K174-G178 PolarHBondContact O-N 2.79Å; K174-M211 HydrophobicContact CB-CE 4.49Å; K174-M211 HydrophobicContact CG-CE 4.49Å; K174-M211 HydrophobicContact CG-SD 4.43Å
175	I	72.5	Confident	69.9	Low	54 Å²	54	45.2 Å²	45.2	28%	0.277	25%	0.253	S	S	.	.	H	α-helix	trans	-67.5	-54	177.1	-63.5	167.8	0	0	0	108.7	K171 E172 K173 L177 G178 Q179 A319	K171-I175 WeakPolarHBondContact O-CG1 3.33Å; K171-I175 PolarHBondContact O-N 2.81Å; E172-I175 WeakPolarHBondContact O-CA 3.41Å; E172-I175 WeakPolarHBondContact O-CB 3.45Å; E172-I175 PolarHBondContact O-N 3.49Å; K173-I175 VanDerWaalsContact C-N 3.3Å; K173-I175 PolarHBondContact O-N 3.5Å; I175-L177 PolarHBondContact O-N 3.34Å; I175-G178 PolarHBondContact O-N 3.24Å; I175-Q179 WeakPolarHBondContact O-CG 3.35Å; I175-Q179 PolarHBondContact O-N 2.89Å; I175-A319 HydrophobicContact CD1-CB 3.99Å; I175-A319 HydrophobicContact CG1-CB 3.79Å
176	I	73.7	Confident	71.4	Confident	83 Å²	83	47.7 Å²	47.7	43%	0.426	27%	0.266	S	S	.	.	H	α-helix	trans	-57.8	-50.5	179.3	-60.9	168.6	0	0	0	110.4	E172 G178 Q179 S180	E172-I176 WeakPolarHBondContact O-CG1 3.27Å; E172-I176 PolarHBondContact O-N 3.03Å; I176-G178 VanDerWaalsContact C-N 3.3Å; I176-G178 PolarHBondContact O-N 3.35Å; I176-Q179 WeakPolarHBondContact O-CB 3.26Å; I176-Q179 PolarHBondContact O-N 3.49Å; I176-Q179 VanDerWaalsContact O-N 3.15Å; I176-S180 PolarHBondContact O-N 3.4Å; I176-S180 PolarHBondContact O-OG 2.97Å; I176-S180 VanDerWaalsContact O-OG 3.12Å
177	L	79.1	Confident	73.1	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-58.7	-42.6	179.2	-179.5	65.9	0	0	0	111.4	L156 C159 I160 K173 I175 S180 I181 T208 M211	L156-L177 HydrophobicContact CD1-CD1 3.81Å; C159-L177 HydrophobicContact CB-CD1 3.97Å; I160-L177 HydrophobicContact CG1-CD1 3.91Å; K173-L177 WeakPolarHBondContact O-CB 3.24Å; K173-L177 PolarHBondContact O-N 3.12Å; I175-L177 PolarHBondContact O-N 3.34Å; L177-S180 PolarHBondContact O-N 3.41Å; L177-I181 HydrophobicContact CD1-CD1 4.32Å; L177-I181 HydrophobicContact CD1-CG1 4.45Å; L177-I181 HydrophobicContact CD2-CD1 4.45Å; L177-I181 HydrophobicContact CG-CD1 3.84Å; L177-I181 HydrophobicContact CG-CG1 4.42Å; L177-I181 WeakPolarHBondContact O-CB 3.46Å; L177-I181 WeakPolarHBondContact O-CD1 3.18Å; L177-I181 WeakPolarHBondContact O-CG1 3.29Å; L177-I181 PolarHBondContact O-N 2.76Å; L177-T208 HydrophobicContact CD2-CG2 4Å; L177-M211 HydrophobicContact CD2-CE 4.12Å; L177-M211 HydrophobicContact CD2-SD 4.26Å
178	G	78.3	Confident	75	Confident	7 Å²	7	50.4 Å²	50.4	7%	0.072	26%	0.258	C	S	.	.	H	α-helix	trans	-71.3	-31.4	179	0	0	0	0	0	113.6	K174 I175 I176 H182	K174-G178 PolarHBondContact O-N 2.79Å; I175-G178 PolarHBondContact O-N 3.24Å; I176-G178 VanDerWaalsContact C-N 3.3Å; I176-G178 PolarHBondContact O-N 3.35Å; G178-H182 WeakPolarHBondContact O-CB 3.45Å; G178-H182 PolarHBondContact O-N 3.39Å
179	Q	78.9	Confident	76.8	Confident	102 Å²	102	50.3 Å²	50.3	48%	0.477	25%	0.253	S	S	.	.	H	α-helix	trans	-64.1	-46.5	170.4	-71.7	173.9	-24.4	0	0	110.7	I175 I176 I181 H182 A183 L315	I175-Q179 WeakPolarHBondContact O-CG 3.35Å; I175-Q179 PolarHBondContact O-N 2.89Å; I176-Q179 WeakPolarHBondContact O-CB 3.26Å; I176-Q179 PolarHBondContact O-N 3.49Å; I176-Q179 VanDerWaalsContact O-N 3.15Å; Q179-I181 PolarHBondContact O-N 3.48Å; Q179-H182 PolarHBondContact O-N 2.77Å; Q179-A183 PolarHBondContact O-N 3.44Å; Q179-L315 HydrophobicContact CG-CD1 3.54Å
180	S	81.9	Confident	78.5	Confident	25 Å²	25	51.6 Å²	51.6	18%	0.175	26%	0.258	C	S	.	.	H	α-helix	trans	-63.7	-41.2	176.7	-53.5	0	0	0	0	112.5	I176 L177 H182 A183 C184	I176-S180 PolarHBondContact O-N 3.4Å; I176-S180 PolarHBondContact O-OG 2.97Å; I176-S180 VanDerWaalsContact O-OG 3.12Å; L177-S180 PolarHBondContact O-N 3.41Å; S180-H182 VanDerWaalsContact C-N 3.32Å; S180-H182 PolarHBondContact O-N 2.88Å; S180-A183 PolarHBondContact O-N 3.32Å; S180-C184 PolarHBondContact O-N 3.15Å; S180-C184 VanDerWaalsContact O-N 3.13Å; S180-C184 PolarHBondContact O-SG 3.5Å; S180-C184 VanDerWaalsContact O-SG 3.35Å
181	I	83.9	Confident	79.9	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-59.1	-46.8	174	-71.2	161.5	0	0	0	109.6	L156 L177 Q179 C184 I185 I192 L212 V215	L156-I181 HydrophobicContact CD1-CG1 3.7Å; L177-I181 HydrophobicContact CD1-CD1 4.32Å; L177-I181 HydrophobicContact CD1-CG1 4.45Å; L177-I181 HydrophobicContact CD2-CD1 4.45Å; L177-I181 HydrophobicContact CG-CD1 3.84Å; L177-I181 HydrophobicContact CG-CG1 4.42Å; L177-I181 WeakPolarHBondContact O-CB 3.46Å; L177-I181 WeakPolarHBondContact O-CD1 3.18Å; L177-I181 WeakPolarHBondContact O-CG1 3.29Å; L177-I181 PolarHBondContact O-N 2.76Å; Q179-I181 PolarHBondContact O-N 3.48Å; I181-C184 PolarHBondContact O-N 2.79Å; I181-I185 HydrophobicContact CG2-CD1 3.35Å; I181-I185 HydrophobicContact CG2-CG1 3.89Å; I181-I185 VanDerWaalsContact O-CG1 3.3Å; I181-I185 WeakPolarHBondContact O-CG1 3.43Å; I181-I185 PolarHBondContact O-N 3.13Å; I181-I192 HydrophobicContact CG2-CD1 4.1Å; I181-I192 HydrophobicContact CG2-CG1 4.35Å; I181-I192 HydrophobicContact CG2-CG2 4.35Å; I181-L212 HydrophobicContact CD1-CD2 3.39Å; I181-L212 HydrophobicContact CG1-CD2 3.63Å; I181-V215 HydrophobicContact CG2-CG1 3.77Å
182	H	79.8	Confident	81.1	Confident	49 Å²	49	43 Å²	43	23%	0.227	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-50.2	-178.4	-176.1	-95.4	0	0	0	112.2	G178 Q179 S180 C184 I185 D186 I311	G178-H182 WeakPolarHBondContact O-CB 3.45Å; G178-H182 PolarHBondContact O-N 3.39Å; Q179-H182 PolarHBondContact O-N 2.77Å; S180-H182 VanDerWaalsContact C-N 3.32Å; S180-H182 PolarHBondContact O-N 2.88Å; H182-C184 PolarHBondContact O-N 3.31Å; H182-I185 PolarHBondContact O-N 3.05Å; H182-D186 IonicContact CE1-OD2 3.83Å; H182-D186 PolarHBondContact CE1-OD2 3.24Å; H182-D186 IonicContact ND1-OD2 2.83Å; H182-D186 IonicContact NE2-OD1 3.87Å; H182-D186 IonicContact NE2-OD2 2.86Å; H182-D186 PolarHBondContact O-N 3.46Å; H182-I311 HydrophobicContact CB-CG2 3.85Å; H182-I311 WeakPolarHBondContact CD2-CD1 3.1Å; H182-I311 WeakPolarHBondContact CD2-CG1 3.39Å; H182-I311 WeakPolarHBondContact CE1-CD1 3.39Å; H182-I311 WeakPolarHBondContact NE2-CD1 3.35Å; H182-I311 WeakPolarHBondContact NE2-CG1 3.44Å
183	A	82	Confident	82.5	Confident	33 Å²	33	36.1 Å²	36.1	27%	0.273	18%	0.183	S	C	.	.	H	α-helix	trans	-58.1	-33.7	179	0	0	0	0	0	112.4	L152 Q179 S180	L152-A183 HydrophobicContact CD1-CB 4.27Å; L152-A183 HydrophobicContact CD2-CB 3.64Å; Q179-A183 PolarHBondContact O-N 3.44Å; S180-A183 PolarHBondContact O-N 3.32Å
184	C	85	Confident	83.7	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.007	18%	0.181	C	C	.	.	H	α-helix	trans	-77	-43.8	175.7	-71.1	0	0	0	0	113.5	L152 L156 S180 I181 H182 D186 K187 D188 I192	L152-C184 VanDerWaalsContact C-SG 3.56Å; L152-C184 PolarHBondContact O-SG 3.24Å; L156-C184 HydrophobicContact CD2-CB 4.23Å; S180-C184 PolarHBondContact O-N 3.15Å; S180-C184 VanDerWaalsContact O-N 3.13Å; S180-C184 PolarHBondContact O-SG 3.5Å; S180-C184 VanDerWaalsContact O-SG 3.35Å; I181-C184 PolarHBondContact O-N 2.79Å; H182-C184 PolarHBondContact O-N 3.31Å; C184-D186 VanDerWaalsContact C-N 3.26Å; C184-D186 PolarHBondContact O-N 3.04Å; C184-K187 PolarHBondContact O-N 2.85Å; C184-K187 VanDerWaalsContact O-N 3.11Å; C184-D188 PolarHBondContact O-N 3.45Å; C184-I192 HydrophobicContact CB-CD1 3.71Å
185	I	84.6	Confident	84.5	Confident	3 Å²	3	33.3 Å²	33.3	2%	0.015	17%	0.171	C	C	.	.	H	α-helix	trans	-58.5	-38.5	-174.7	-75.5	175.2	0	0	0	112	I181 H182 K187 P189 I192 V215 N219	I181-I185 HydrophobicContact CG2-CD1 3.35Å; I181-I185 HydrophobicContact CG2-CG1 3.89Å; I181-I185 VanDerWaalsContact O-CG1 3.3Å; I181-I185 WeakPolarHBondContact O-CG1 3.43Å; I181-I185 PolarHBondContact O-N 3.13Å; H182-I185 PolarHBondContact O-N 3.05Å; I185-K187 PolarHBondContact O-N 2.98Å; I185-P189 HydrophobicContact CG2-CB 4.39Å; I185-I192 HydrophobicContact CD1-CG1 4.12Å; I185-I192 HydrophobicContact CG1-CB 4.48Å; I185-I192 HydrophobicContact CG1-CD1 4.02Å; I185-I192 HydrophobicContact CG1-CG1 3.35Å; I185-V215 HydrophobicContact CD1-CG1 4.19Å; I185-N219 HydrophobicContact CG2-CB 4.08Å; I185-N219 VanDerWaalsContact CG2-CG 3.46Å; I185-N219 WeakPolarHBondContact CG2-ND2 3.37Å
186	D	79	Confident	85.5	Confident	65 Å²	65	30.8 Å²	30.8	35%	0.348	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-25.5	-177.5	-82.3	-19.4	0	0	0	113.1	H182 C184 R221	H182-D186 IonicContact CE1-OD2 3.83Å; H182-D186 PolarHBondContact CE1-OD2 3.24Å; H182-D186 IonicContact ND1-OD2 2.83Å; H182-D186 IonicContact NE2-OD1 3.87Å; H182-D186 IonicContact NE2-OD2 2.86Å; H182-D186 PolarHBondContact O-N 3.46Å; C184-D186 VanDerWaalsContact C-N 3.26Å; C184-D186 PolarHBondContact O-N 3.04Å; D186-R221 PolarHBondContact O-NH1 2.9Å; D186-R221 IonicContact OD1-NH1 3.07Å
187	K	82.9	Confident	86.4	Confident	150 Å²	150	26.8 Å²	26.8	65%	0.652	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-46.9	-178.3	-58.9	-60.1	-176.4	-178.6	0	112.1	Y149 C184 I185	Y149-K187 HydrophobicContact CD2-CB 3.76Å; Y149-K187 HydrophobicContact CD2-CG 4.24Å; Y149-K187 HydrophobicContact CE2-CB 3.55Å; C184-K187 PolarHBondContact O-N 2.85Å; C184-K187 VanDerWaalsContact O-N 3.11Å; I185-K187 PolarHBondContact O-N 2.98Å
188	D	87.8	Confident	86.9	Confident	37 Å²	37	27 Å²	27	20%	0.198	14%	0.138	C	C	.	.			trans	-140	91.3	-179.2	-177.9	-5.4	0	0	0	111.2	Y149 K153 C184 E190 F191	Y149-D188 HydrophobicContact CE2-CB 3.96Å; Y149-D188 WeakPolarHBondContact OH-CB 3.3Å; Y149-D188 VanDerWaalsContact OH-CG 3.29Å; Y149-D188 PolarHBondContact OH-OD2 2.92Å; K153-D188 WeakPolarHBondContact CE-OD2 3.23Å; K153-D188 IonicContact NZ-OD2 3.97Å; K153-D188 PolarHBondContact NZ-OD2 2.77Å; C184-D188 PolarHBondContact O-N 3.45Å; D188-E190 VanDerWaalsContact C-N 3.27Å; D188-E190 PolarHBondContact O-N 3.26Å; D188-E190 PolarHBondContact OD1-N 3.13Å; D188-E190 VanDerWaalsContact OD1-N 3.16Å; D188-F191 HydrophobicContact CB-CB 4.17Å; D188-F191 PolarHBondContact O-N 3.15Å; D188-F191 PolarHBondContact OD1-N 3.19Å; D188-F191 WeakPolarHBondContact OD2-CB 3.28Å
189	P	89.3	Confident	87.2	Confident	21 Å²	21	26.6 Å²	26.6	14%	0.136	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-21.3	-178.1	29.7	-37	0	0	0	113.1	I185 R221 F225	I185-P189 HydrophobicContact CG2-CB 4.39Å; P189-R221 HydrophobicContact CB-CB 3.93Å; P189-R221 HydrophobicContact CG-CB 4.01Å; P189-F225 HydrophobicContact CG-CE2 3.97Å
190	E	92.2	Very high	87.6	Confident	36 Å²	36	22.5 Å²	22.5	17%	0.168	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-36.4	178.5	-174.7	168.5	-168	0	0	111	D188 I192 L193 K194 F225 K228 Y229	D188-E190 VanDerWaalsContact C-N 3.27Å; D188-E190 PolarHBondContact O-N 3.26Å; D188-E190 PolarHBondContact OD1-N 3.13Å; D188-E190 VanDerWaalsContact OD1-N 3.16Å; E190-I192 PolarHBondContact O-N 3.46Å; E190-I192 VanDerWaalsContact O-N 3.12Å; E190-L193 WeakPolarHBondContact O-CA 3.37Å; E190-L193 WeakPolarHBondContact O-CB 3.45Å; E190-L193 PolarHBondContact O-N 3.29Å; E190-K194 HydrophobicContact CG-CG 4.43Å; E190-K194 PolarHBondContact O-N 3.41Å; E190-K194 VanDerWaalsContact O-N 3.09Å; E190-F225 HydrophobicContact CB-CD1 3.91Å; E190-F225 HydrophobicContact CB-CD2 3.99Å; E190-F225 HydrophobicContact CB-CE1 4.02Å; E190-F225 HydrophobicContact CB-CE2 4.12Å; E190-F225 HydrophobicContact CB-CG 3.9Å; E190-F225 HydrophobicContact CB-CZ 4.13Å; E190-F225 VanDerWaalsContact CD-CD1 3.42Å; E190-F225 HydrophobicContact CG-CB 4.31Å; E190-F225 HydrophobicContact CG-CD1 3.74Å; E190-F225 HydrophobicContact CG-CE1 4.18Å; E190-F225 HydrophobicContact CG-CG 3.95Å; E190-F225 WeakPolarHBondContact OE2-CD1 3.15Å; E190-F225 WeakPolarHBondContact OE2-CE1 3.33Å; E190-K228 IonicContact OE1-NZ 3.52Å; E190-K228 PolarHBondContact OE1-NZ 3.1Å; E190-Y229 HydrophobicContact CG-CE2 3.84Å; E190-Y229 WeakPolarHBondContact OE1-CE2 3.46Å; E190-Y229 PolarHBondContact OE1-OH 3.28Å
191	F	92.9	Very high	87.7	Confident	1 Å²	1	25.5 Å²	25.5	0%	0.004	12%	0.123	C	C	.	.	H	α-helix	trans	-54.9	-33.8	-179.8	-174.9	-106.5	0	0	0	113.8	K153 L156 I157 D188 L193 K194 A195 L739 I742 E743	K153-F191 HydrophobicContact CB-CD1 4.42Å; K153-F191 HydrophobicContact CB-CE1 3.71Å; K153-F191 HydrophobicContact CB-CZ 3.81Å; K153-F191 HydrophobicContact CD-CD1 3.98Å; K153-F191 HydrophobicContact CD-CD2 3.84Å; K153-F191 HydrophobicContact CD-CE1 3.89Å; K153-F191 HydrophobicContact CD-CE2 3.75Å; K153-F191 HydrophobicContact CD-CG 3.95Å; K153-F191 HydrophobicContact CD-CZ 3.77Å; K153-F191 VanDerWaalsContact CE-CG 3.48Å; K153-F191 HydrophobicContact CG-CD1 3.83Å; K153-F191 HydrophobicContact CG-CE1 3.62Å; K153-F191 HydrophobicContact CG-CE2 4.4Å; K153-F191 HydrophobicContact CG-CG 4.31Å; K153-F191 HydrophobicContact CG-CZ 3.93Å; L156-F191 HydrophobicContact CD2-CD1 4.16Å; L156-F191 HydrophobicContact CD2-CE1 4.07Å; I157-F191 HydrophobicContact CD1-CZ 4.02Å; I157-F191 HydrophobicContact CG1-CZ 4.19Å; D188-F191 HydrophobicContact CB-CB 4.17Å; D188-F191 PolarHBondContact O-N 3.15Å; D188-F191 PolarHBondContact OD1-N 3.19Å; D188-F191 WeakPolarHBondContact OD2-CB 3.28Å; F191-L193 VanDerWaalsContact C-N 3.26Å; F191-L193 PolarHBondContact O-N 2.91Å; F191-K194 PolarHBondContact O-N 2.63Å; F191-A195 WeakPolarHBondContact O-CB 3.33Å; F191-A195 PolarHBondContact O-N 3.48Å; F191-L739 HydrophobicContact CE2-CD1 3.81Å; F191-L739 HydrophobicContact CZ-CD1 3.74Å; F191-I742 HydrophobicContact CD2-CG2 4.3Å; F191-I742 HydrophobicContact CE2-CB 4.25Å; F191-I742 HydrophobicContact CE2-CG2 3.55Å; F191-I742 HydrophobicContact CZ-CG2 3.97Å; F191-E743 HydrophobicContact CD2-CG 4.29Å; F191-E743 HydrophobicContact CE2-CG 4.14Å
192	I	92.4	Very high	87.4	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.3	-37.9	175.5	-57.7	-50.6	0	0	0	112	L156 I181 C184 I185 E190 A196 L212 A216	L156-I192 HydrophobicContact CD2-CD1 3.38Å; I181-I192 HydrophobicContact CG2-CD1 4.1Å; I181-I192 HydrophobicContact CG2-CG1 4.35Å; I181-I192 HydrophobicContact CG2-CG2 4.35Å; C184-I192 HydrophobicContact CB-CD1 3.71Å; I185-I192 HydrophobicContact CD1-CG1 4.12Å; I185-I192 HydrophobicContact CG1-CB 4.48Å; I185-I192 HydrophobicContact CG1-CD1 4.02Å; I185-I192 HydrophobicContact CG1-CG1 3.35Å; E190-I192 PolarHBondContact O-N 3.46Å; E190-I192 VanDerWaalsContact O-N 3.12Å; I192-A196 WeakPolarHBondContact O-CB 2.76Å; I192-A196 PolarHBondContact O-N 2.84Å; I192-L212 HydrophobicContact CG2-CB 4.34Å; I192-L212 HydrophobicContact CG2-CD2 3.92Å; I192-A216 HydrophobicContact CG2-CB 4.22Å
193	L	93.8	Very high	87	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-78.3	-32.8	178.8	-66.8	167.6	0	0	0	111.5	E190 F191 A196 L197 I213 A216 F225 I226 Y229	E190-L193 WeakPolarHBondContact O-CA 3.37Å; E190-L193 WeakPolarHBondContact O-CB 3.45Å; E190-L193 PolarHBondContact O-N 3.29Å; F191-L193 VanDerWaalsContact C-N 3.26Å; F191-L193 PolarHBondContact O-N 2.91Å; L193-A196 WeakPolarHBondContact O-CB 3.34Å; L193-A196 PolarHBondContact O-N 3.17Å; L193-L197 PolarHBondContact O-N 3.44Å; L193-I213 HydrophobicContact CD2-CG1 4.29Å; L193-A216 HydrophobicContact CD2-CB 3.95Å; L193-A216 HydrophobicContact CG-CB 4.25Å; L193-F225 HydrophobicContact CD1-CB 3.46Å; L193-F225 VanDerWaalsContact CD1-CB 3.46Å; L193-I226 HydrophobicContact CD1-CG1 4.15Å; L193-Y229 HydrophobicContact CB-CD1 4.42Å; L193-Y229 HydrophobicContact CB-CD2 3.51Å; L193-Y229 HydrophobicContact CB-CE2 4.04Å; L193-Y229 HydrophobicContact CB-CG 3.74Å; L193-Y229 HydrophobicContact CD1-CD2 3.91Å; L193-Y229 HydrophobicContact CG-CD2 4.31Å
194	K	93.9	Very high	86.7	Confident	30 Å²	30	28 Å²	28	13%	0.13	13%	0.133	C	C	.	.	H	α-helix	trans	-61.5	-47.1	168.4	-66.6	-168.1	178.6	-159	0	111.2	E190 F191 A196 L197 Y198 Y229 I742 E743 I745 D746	E190-K194 HydrophobicContact CG-CG 4.43Å; E190-K194 PolarHBondContact O-N 3.41Å; E190-K194 VanDerWaalsContact O-N 3.09Å; F191-K194 PolarHBondContact O-N 2.63Å; K194-A196 VanDerWaalsContact C-N 3.3Å; K194-A196 PolarHBondContact O-N 3.47Å; K194-L197 WeakPolarHBondContact O-CB 3.36Å; K194-L197 PolarHBondContact O-N 3.25Å; K194-L197 VanDerWaalsContact O-N 3.1Å; K194-Y198 PolarHBondContact O-N 3.11Å; K194-Y229 WeakPolarHBondContact CE-OH 3.21Å; K194-Y229 HydrophobicContact CG-CE1 3.98Å; K194-Y229 WeakPolarHBondContact CG-OH 3.46Å; K194-I742 HydrophobicContact CB-CG2 4.24Å; K194-I742 WeakPolarHBondContact CB-O 3.38Å; K194-E743 WeakPolarHBondContact CD-O 3.48Å; K194-E743 PolarHBondContact NZ-O 3.47Å; K194-I745 HydrophobicContact CB-CG2 3.7Å; K194-I745 HydrophobicContact CD-CG2 4.38Å; K194-I745 HydrophobicContact CG-CG2 4.01Å; K194-D746 VanDerWaalsContact CE-CG 3.49Å; K194-D746 WeakPolarHBondContact CE-OD1 3.44Å; K194-D746 VanDerWaalsContact CE-OD2 3.28Å; K194-D746 WeakPolarHBondContact CE-OD2 3.42Å; K194-D746 IonicContact NZ-OD1 3.52Å; K194-D746 PolarHBondContact NZ-OD1 3.42Å; K194-D746 IonicContact NZ-OD2 2.82Å; K194-D746 PolarHBondContact NZ-OD2 2.84Å
195	A	91.4	Very high	86.4	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.5	-36.9	173.7	0	0	0	0	0	112.2	I160 F191 Y198 C199	I160-A195 HydrophobicContact CD1-CB 3.79Å; F191-A195 WeakPolarHBondContact O-CB 3.33Å; F191-A195 PolarHBondContact O-N 3.48Å; A195-Y198 WeakPolarHBondContact O-CB 3.37Å; A195-Y198 PolarHBondContact O-N 3.02Å; A195-C199 WeakPolarHBondContact O-CB 3.37Å; A195-C199 PolarHBondContact O-N 3.34Å; A195-C199 PolarHBondContact O-SG 3.32Å
196	A	92.3	Very high	86.4	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.8	-38.2	173.3	0	0	0	0	0	112.3	I192 L193 K194 C199 R200 T209 L212 I213	I192-A196 WeakPolarHBondContact O-CB 2.76Å; I192-A196 PolarHBondContact O-N 2.84Å; L193-A196 WeakPolarHBondContact O-CB 3.34Å; L193-A196 PolarHBondContact O-N 3.17Å; K194-A196 VanDerWaalsContact C-N 3.3Å; K194-A196 PolarHBondContact O-N 3.47Å; A196-C199 WeakPolarHBondContact O-CB 3.13Å; A196-C199 PolarHBondContact O-N 3.1Å; A196-R200 PolarHBondContact O-N 2.96Å; A196-R200 VanDerWaalsContact O-N 3.16Å; A196-T209 HydrophobicContact CB-CG2 4.27Å; A196-T209 WeakPolarHBondContact O-CG2 3.38Å; A196-T209 PolarHBondContact O-OG1 3.11Å; A196-L212 HydrophobicContact CB-CB 3.82Å; A196-L212 HydrophobicContact CB-CD1 3.99Å; A196-I213 HydrophobicContact CB-CG1 4.23Å
197	L	92.5	Very high	86.6	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65.7	-43.6	174.3	-173.9	65.6	0	0	0	111.1	L193 K194 R200 R201 Y229 C233 I745 Y749 L751	L193-L197 PolarHBondContact O-N 3.44Å; K194-L197 WeakPolarHBondContact O-CB 3.36Å; K194-L197 PolarHBondContact O-N 3.25Å; K194-L197 VanDerWaalsContact O-N 3.1Å; L197-R200 PolarHBondContact O-N 2.93Å; L197-R200 VanDerWaalsContact O-N 3.14Å; L197-R201 HydrophobicContact CD1-CG 3.57Å; L197-R201 HydrophobicContact CG-CG 4.05Å; L197-R201 WeakPolarHBondContact O-CB 3.22Å; L197-R201 PolarHBondContact O-N 3.38Å; L197-Y229 HydrophobicContact CB-CD1 4.31Å; L197-Y229 HydrophobicContact CD2-CD1 4.13Å; L197-Y229 HydrophobicContact CD2-CE1 4.37Å; L197-C233 VanDerWaalsContact CA-SG 3.57Å; L197-I745 HydrophobicContact CB-CD1 4.49Å; L197-I745 HydrophobicContact CD2-CG1 4.14Å; L197-I745 HydrophobicContact CD2-CG2 4.15Å; L197-I745 HydrophobicContact CG-CD1 4.36Å; L197-I745 HydrophobicContact CG-CG1 4.44Å; L197-Y749 HydrophobicContact CD2-CD2 3.97Å; L197-Y749 HydrophobicContact CG-CD2 4.39Å; L197-L751 HydrophobicContact CD2-CD1 3.44Å; L197-L751 VanDerWaalsContact CD2-CD1 3.44Å
198	Y	89.4	Confident	86.7	Confident	4 Å²	4	22.9 Å²	22.9	2%	0.016	11%	0.108	C	C	.	.	H	α-helix	trans	-56.6	-50.6	174.1	174.5	-113.3	0	0	0	111.6	K194 A195 R200 R201 E202 L203 E732 L738 I742 I745	K194-Y198 PolarHBondContact O-N 3.11Å; A195-Y198 WeakPolarHBondContact O-CB 3.37Å; A195-Y198 PolarHBondContact O-N 3.02Å; Y198-R200 PolarHBondContact O-N 2.74Å; Y198-R201 PolarHBondContact O-N 3.44Å; Y198-E202 HydrophobicContact CD2-CB 3.69Å; Y198-E202 HydrophobicContact CD2-CG 3.76Å; Y198-E202 HydrophobicContact CE2-CB 3.63Å; Y198-E202 HydrophobicContact CE2-CG 4.04Å; Y198-E202 WeakPolarHBondContact CE2-OE2 3.23Å; Y198-E202 PolarHBondContact O-N 3.25Å; Y198-L203 HydrophobicContact CD1-CD1 3.86Å; Y198-L203 HydrophobicContact CD1-CG 4.23Å; Y198-L203 HydrophobicContact CE1-CD1 3.34Å; Y198-L203 HydrophobicContact CE1-CD2 4.22Å; Y198-L203 HydrophobicContact CE1-CG 3.7Å; Y198-L203 HydrophobicContact CE2-CG 4.41Å; Y198-L203 PolarHBondContact O-N 3.3Å; Y198-L203 VanDerWaalsContact O-N 3.16Å; Y198-E732 PolarHBondContact OH-OE1 3.23Å; Y198-E732 PolarHBondContact OH-OE2 3.34Å; Y198-L738 HydrophobicContact CE1-CD1 4.43Å; Y198-L738 HydrophobicContact CE2-CD1 4.02Å; Y198-L738 WeakPolarHBondContact OH-CD1 3.21Å; Y198-I742 HydrophobicContact CD1-CD1 3.67Å; Y198-I742 HydrophobicContact CD1-CG1 4.08Å; Y198-I742 HydrophobicContact CD2-CD1 4.36Å; Y198-I742 HydrophobicContact CD2-CG1 3.94Å; Y198-I742 HydrophobicContact CE1-CD1 3.9Å; Y198-I742 HydrophobicContact CE2-CG1 4.42Å; Y198-I742 HydrophobicContact CG-CD1 3.92Å; Y198-I742 HydrophobicContact CG-CG1 3.78Å; Y198-I745 HydrophobicContact CD2-CD1 4.14Å; Y198-I745 HydrophobicContact CG-CD1 4.36Å
199	C	85.9	Confident	86.8	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-51.5	-42.8	175.3	-72	0	0	0	0	111.9	I160 A195 A196 L203 N204 I205 T209	I160-C199 WeakPolarHBondContact CG2-SG 3.31Å; A195-C199 WeakPolarHBondContact O-CB 3.37Å; A195-C199 PolarHBondContact O-N 3.34Å; A195-C199 PolarHBondContact O-SG 3.32Å; A196-C199 WeakPolarHBondContact O-CB 3.13Å; A196-C199 PolarHBondContact O-N 3.1Å; C199-L203 CarbonylContact O-C 3.57Å; C199-L203 WeakPolarHBondContact O-CB 3.13Å; C199-N204 CarbonylContact O-C 3.59Å; C199-N204 PolarHBondContact O-N 3.28Å; C199-I205 PolarHBondContact O-N 2.68Å; C199-T209 WeakPolarHBondContact CB-OG1 3.32Å
200	R	87.5	Confident	86.9	Confident	16 Å²	16	20.1 Å²	20.1	6%	0.06	9%	0.092	C	C	.	.	H	α-helix	trans	-82.2	-44	-176.3	-167.2	75.2	179.9	109.7	-8.8	114	A196 L197 Y198 N204 T209 C233 D239	A196-R200 PolarHBondContact O-N 2.96Å; A196-R200 VanDerWaalsContact O-N 3.16Å; L197-R200 PolarHBondContact O-N 2.93Å; L197-R200 VanDerWaalsContact O-N 3.14Å; Y198-R200 PolarHBondContact O-N 2.74Å; R200-N204 PolarHBondContact NH1-OD1 3.05Å; R200-N204 VanDerWaalsContact O-CA 3.3Å; R200-N204 WeakPolarHBondContact O-CA 3.41Å; R200-T209 HydrophobicContact CB-CG2 4.05Å; R200-T209 PolarHBondContact N-OG1 3.31Å; R200-C233 WeakPolarHBondContact CD-O 3.27Å; R200-C233 WeakPolarHBondContact CG-O 3.45Å; R200-C233 PolarHBondContact NE-O 2.87Å; R200-D239 IonicContact CZ-OD2 2.67Å; R200-D239 IonicContact NE-OD2 2.66Å; R200-D239 IonicContact NH2-OD1 3.02Å; R200-D239 IonicContact NH2-OD2 3.18Å; R200-D239 PolarHBondContact NH2-OD2 2.96Å
201	R	83.7	Confident	86.7	Confident	88 Å²	88	18.4 Å²	18.4	33%	0.332	8%	0.084	S	C	.	.	H	α-helix	trans	-85.9	-42.5	-168.7	-70.6	-70.4	-177.8	147.2	4.9	111.5	L197 Y198 S232 Y749	L197-R201 HydrophobicContact CD1-CG 3.57Å; L197-R201 HydrophobicContact CG-CG 4.05Å; L197-R201 WeakPolarHBondContact O-CB 3.22Å; L197-R201 PolarHBondContact O-N 3.38Å; Y198-R201 PolarHBondContact O-N 3.44Å; R201-S232 PolarHBondContact NE-O 3.04Å; R201-S232 VanDerWaalsContact NE-O 3.09Å; R201-S232 PolarHBondContact NH2-O 3.03Å; R201-Y749 HydrophobicContact CB-CE1 4.08Å; R201-Y749 HydrophobicContact CB-CE2 3.8Å; R201-Y749 WeakPolarHBondContact CB-OH 3.44Å; R201-Y749 HydrophobicContact CG-CD2 4.48Å; R201-Y749 HydrophobicContact CG-CE1 4.15Å; R201-Y749 HydrophobicContact CG-CE2 4.15Å
202	E	76.9	Confident	86.6	Confident	18 Å²	18	18.4 Å²	18.4	8%	0.084	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-51.6	-177.1	-52.8	-145	150	0	0	110.7	Y198 R728 R741	Y198-E202 HydrophobicContact CD2-CB 3.69Å; Y198-E202 HydrophobicContact CD2-CG 3.76Å; Y198-E202 HydrophobicContact CE2-CB 3.63Å; Y198-E202 HydrophobicContact CE2-CG 4.04Å; Y198-E202 WeakPolarHBondContact CE2-OE2 3.23Å; Y198-E202 PolarHBondContact O-N 3.25Å; E202-R728 PolarHBondContact O-NH1 3.01Å; E202-R728 PolarHBondContact O-NH2 2.87Å; E202-R741 IonicContact OE1-CZ 3.84Å; E202-R741 IonicContact OE1-NE 3.54Å; E202-R741 PolarHBondContact OE1-NE 3.39Å; E202-R741 IonicContact OE1-NH2 3.93Å; E202-R741 PolarHBondContact OE1-NH2 2.87Å; E202-R741 IonicContact OE2-CZ 2.64Å; E202-R741 IonicContact OE2-NE 3.91Å; E202-R741 PolarHBondContact OE2-NE 3.02Å; E202-R741 IonicContact OE2-NH2 2.8Å
203	L	72.8	Confident	86.6	Confident	19 Å²	19	18.4 Å²	18.4	10%	0.099	8%	0.084	C	C	.	.	S	Bend	trans	-84.1	-14.9	-177.8	-56.2	179.4	0	0	0	114	I160 I164 Y198 C199 I205 E732	I160-L203 HydrophobicContact CG2-CD1 4.11Å; I164-L203 HydrophobicContact CD1-CD1 3.84Å; I164-L203 HydrophobicContact CD1-CD2 3.8Å; I164-L203 HydrophobicContact CD1-CG 4.28Å; I164-L203 HydrophobicContact CG1-CD1 4.14Å; Y198-L203 HydrophobicContact CD1-CD1 3.86Å; Y198-L203 HydrophobicContact CD1-CG 4.23Å; Y198-L203 HydrophobicContact CE1-CD1 3.34Å; Y198-L203 HydrophobicContact CE1-CD2 4.22Å; Y198-L203 HydrophobicContact CE1-CG 3.7Å; Y198-L203 HydrophobicContact CE2-CG 4.41Å; Y198-L203 PolarHBondContact O-N 3.3Å; Y198-L203 VanDerWaalsContact O-N 3.16Å; C199-L203 CarbonylContact O-C 3.57Å; C199-L203 WeakPolarHBondContact O-CB 3.13Å; L203-I205 HydrophobicContact CB-CD1 3.97Å; L203-I205 HydrophobicContact CB-CG1 3.78Å; L203-I205 HydrophobicContact CD1-CD1 3.96Å; L203-I205 PolarHBondContact O-N 3.22Å; L203-I205 VanDerWaalsContact O-N 3.13Å; L203-E732 WeakPolarHBondContact CD2-OE1 3.44Å
204	N	74.8	Confident	86.4	Confident	99 Å²	99	18.4 Å²	18.4	53%	0.529	8%	0.084	S	C	.	.			trans	53.6	26.2	-175.3	-162.4	26	0	0	0	114.7	C199 R200	C199-N204 CarbonylContact O-C 3.59Å; C199-N204 PolarHBondContact O-N 3.28Å; R200-N204 PolarHBondContact NH1-OD1 3.05Å; R200-N204 VanDerWaalsContact O-CA 3.3Å; R200-N204 WeakPolarHBondContact O-CA 3.41Å
205	I	77.5	Confident	86.1	Confident	22 Å²	22	17.8 Å²	17.8	11%	0.113	8%	0.083	C	C	.	.			trans	-82.4	118.1	174.1	-48.2	169.7	0	0	0	109.5	I164 C199 L203 T208 T209	I164-I205 HydrophobicContact CB-CD1 4.09Å; I164-I205 HydrophobicContact CD1-CD1 4.39Å; I164-I205 HydrophobicContact CG1-CD1 3.22Å; I164-I205 HydrophobicContact CG1-CG1 3.91Å; C199-I205 PolarHBondContact O-N 2.68Å; L203-I205 HydrophobicContact CB-CD1 3.97Å; L203-I205 HydrophobicContact CB-CG1 3.78Å; L203-I205 HydrophobicContact CD1-CD1 3.96Å; L203-I205 PolarHBondContact O-N 3.22Å; L203-I205 VanDerWaalsContact O-N 3.13Å; I205-T208 WeakPolarHBondContact CG2-OG1 2.99Å; I205-T209 WeakPolarHBondContact O-CB 3.42Å; I205-T209 PolarHBondContact O-OG1 2.69Å
206	R	85.1	Confident	86	Confident	63 Å²	63	17.8 Å²	17.8	24%	0.238	8%	0.083	C	C	.	.	H	α-helix	trans	-83.6	-53.3	-178.8	175.5	-169.8	150.6	153.5	-6.1	113	T208 T209 N210 S238 D239 E242	R206-T208 PolarHBondContact O-N 3.14Å; R206-T209 WeakPolarHBondContact O-CB 3.06Å; R206-T209 PolarHBondContact O-N 2.69Å; R206-N210 WeakPolarHBondContact CG-ND2 3.49Å; R206-N210 VanDerWaalsContact O-CG 3.24Å; R206-N210 PolarHBondContact O-N 3.43Å; R206-N210 PolarHBondContact O-ND2 2.85Å; R206-S238 PolarHBondContact NH2-O 3.33Å; R206-D239 WeakPolarHBondContact CD-OD1 3.48Å; R206-D239 WeakPolarHBondContact CG-OD1 3.23Å; R206-D239 IonicContact CZ-OD1 2.68Å; R206-D239 VanDerWaalsContact CZ-OD1 3.24Å; R206-D239 IonicContact NE-OD1 2.94Å; R206-D239 PolarHBondContact NE-OD1 3.31Å; R206-D239 IonicContact NH1-OD1 2.8Å; R206-D239 PolarHBondContact NH1-OD1 3.21Å; R206-E242 IonicContact CZ-OE2 2.92Å; R206-E242 VanDerWaalsContact CZ-OE2 3.26Å; R206-E242 IonicContact NE-OE2 2.74Å; R206-E242 PolarHBondContact NE-OE2 2.68Å; R206-E242 IonicContact NH2-OE2 2.68Å; R206-E242 PolarHBondContact NH2-OE2 3.23Å
207	T	84.3	Confident	85.8	Confident	26 Å²	26	17.8 Å²	17.8	16%	0.16	8%	0.083	C	C	.	.	H	α-helix	trans	-65.8	-43.4	-167.4	-63.4	0	0	0	0	111.9	N210 M211 E242 Y246	T207-N210 PolarHBondContact O-N 3.24Å; T207-M211 WeakPolarHBondContact O-CB 3.43Å; T207-M211 PolarHBondContact O-N 2.99Å; T207-E242 PolarHBondContact OG1-OE1 2.89Å; T207-Y246 HydrophobicContact CG2-CE2 4.17Å; T207-Y246 WeakPolarHBondContact CG2-OH 3.02Å
208	T	84.4	Confident	85.4	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-62.2	-44	174.5	-49.8	0	0	0	0	111.7	I160 L177 I205 R206 N210 M211 L212	I160-T208 HydrophobicContact CG1-CG2 4.42Å; L177-T208 HydrophobicContact CD2-CG2 4Å; I205-T208 WeakPolarHBondContact CG2-OG1 2.99Å; R206-T208 PolarHBondContact O-N 3.14Å; T208-N210 PolarHBondContact O-N 3.35Å; T208-M211 PolarHBondContact O-N 2.8Å; T208-L212 HydrophobicContact CG2-CD1 4.12Å; T208-L212 HydrophobicContact CG2-CG 4.47Å; T208-L212 VanDerWaalsContact O-CG 3.32Å; T208-L212 WeakPolarHBondContact O-CG 3.27Å; T208-L212 PolarHBondContact O-N 2.83Å
209	T	90.4	Very high	85.1	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-56	-49.2	174.6	-60.2	0	0	0	0	111.9	A196 C199 R200 I205 R206 M211 L212 I213 C233	A196-T209 HydrophobicContact CB-CG2 4.27Å; A196-T209 WeakPolarHBondContact O-CG2 3.38Å; A196-T209 PolarHBondContact O-OG1 3.11Å; C199-T209 WeakPolarHBondContact CB-OG1 3.32Å; R200-T209 HydrophobicContact CB-CG2 4.05Å; R200-T209 PolarHBondContact N-OG1 3.31Å; I205-T209 WeakPolarHBondContact O-CB 3.42Å; I205-T209 PolarHBondContact O-OG1 2.69Å; R206-T209 WeakPolarHBondContact O-CB 3.06Å; R206-T209 PolarHBondContact O-N 2.69Å; T209-M211 VanDerWaalsContact C-N 3.29Å; T209-M211 PolarHBondContact O-N 2.74Å; T209-L212 PolarHBondContact O-N 3.34Å; T209-I213 HydrophobicContact CG2-CD1 3.84Å; T209-I213 WeakPolarHBondContact O-CG1 3.29Å; T209-I213 PolarHBondContact O-N 3.33Å; T209-C233 HydrophobicContact CG2-CB 3.8Å
210	N	91.7	Very high	85	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.7	-35.6	-177.2	-64.3	-20.8	0	0	0	111.7	R206 T207 T208 A214 I234 D239 E242 V243 Y246	R206-N210 WeakPolarHBondContact CG-ND2 3.49Å; R206-N210 VanDerWaalsContact O-CG 3.24Å; R206-N210 PolarHBondContact O-N 3.43Å; R206-N210 PolarHBondContact O-ND2 2.85Å; T207-N210 PolarHBondContact O-N 3.24Å; T208-N210 PolarHBondContact O-N 3.35Å; N210-A214 WeakPolarHBondContact O-CB 3.49Å; N210-A214 PolarHBondContact O-N 2.84Å; N210-A214 VanDerWaalsContact O-N 3.16Å; N210-I234 WeakPolarHBondContact OD1-CD1 3.33Å; N210-D239 WeakPolarHBondContact ND2-CA 3.47Å; N210-E242 HydrophobicContact CB-CB 4.37Å; N210-E242 HydrophobicContact CB-CG 4.14Å; N210-E242 PolarHBondContact ND2-OE2 2.98Å; N210-V243 HydrophobicContact CB-CG2 3.76Å; N210-Y246 HydrophobicContact CB-CD2 4.29Å
211	M	87.3	Confident	84.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.9	-47.6	173.5	179	176.3	161.2	0	0	111.6	P169 K174 L177 T207 T208 T209 I213 A214 V215 Y246 L318	P169-M211 HydrophobicContact CG-SD 4.35Å; K174-M211 HydrophobicContact CB-CE 4.49Å; K174-M211 HydrophobicContact CG-CE 4.49Å; K174-M211 HydrophobicContact CG-SD 4.43Å; L177-M211 HydrophobicContact CD2-CE 4.12Å; L177-M211 HydrophobicContact CD2-SD 4.26Å; T207-M211 WeakPolarHBondContact O-CB 3.43Å; T207-M211 PolarHBondContact O-N 2.99Å; T208-M211 PolarHBondContact O-N 2.8Å; T209-M211 VanDerWaalsContact C-N 3.29Å; T209-M211 PolarHBondContact O-N 2.74Å; M211-I213 VanDerWaalsContact C-N 3.35Å; M211-I213 PolarHBondContact O-N 2.85Å; M211-A214 PolarHBondContact O-N 3.48Å; M211-A214 VanDerWaalsContact O-N 3.16Å; M211-V215 HydrophobicContact CG-CG2 4.46Å; M211-V215 WeakPolarHBondContact O-CG2 3.47Å; M211-V215 PolarHBondContact O-N 3.07Å; M211-Y246 HydrophobicContact CB-CD1 4.28Å; M211-Y246 HydrophobicContact CB-CD2 4.19Å; M211-Y246 HydrophobicContact CB-CE1 4.14Å; M211-Y246 HydrophobicContact CB-CE2 4.07Å; M211-Y246 HydrophobicContact CB-CG 4.31Å; M211-Y246 HydrophobicContact CG-CD1 4.28Å; M211-Y246 HydrophobicContact CG-CE1 4.2Å; M211-Y246 HydrophobicContact SD-CE1 4.35Å; M211-L318 HydrophobicContact CE-CD1 3.99Å; M211-L318 HydrophobicContact CE-CD2 4.42Å
212	L	90.4	Very high	85	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-57.5	-45.9	178.7	-73.3	166.3	0	0	0	111.6	I160 I181 I192 A196 T208 T209 A214 V215 A216	I160-L212 HydrophobicContact CD1-CD1 4.02Å; I181-L212 HydrophobicContact CD1-CD2 3.39Å; I181-L212 HydrophobicContact CG1-CD2 3.63Å; I192-L212 HydrophobicContact CG2-CB 4.34Å; I192-L212 HydrophobicContact CG2-CD2 3.92Å; A196-L212 HydrophobicContact CB-CB 3.82Å; A196-L212 HydrophobicContact CB-CD1 3.99Å; T208-L212 HydrophobicContact CG2-CD1 4.12Å; T208-L212 HydrophobicContact CG2-CG 4.47Å; T208-L212 VanDerWaalsContact O-CG 3.32Å; T208-L212 WeakPolarHBondContact O-CG 3.27Å; T208-L212 PolarHBondContact O-N 2.83Å; T209-L212 PolarHBondContact O-N 3.34Å; L212-A214 VanDerWaalsContact C-N 3.34Å; L212-A214 PolarHBondContact O-N 2.95Å; L212-V215 PolarHBondContact O-N 2.98Å; L212-A216 VanDerWaalsContact O-CB 3.28Å; L212-A216 WeakPolarHBondContact O-CB 3.41Å; L212-A216 PolarHBondContact O-N 3.27Å
213	I	92.6	Very high	85.5	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-62.9	-41.5	177.3	-67	166.6	0	0	0	111.2	L193 A196 T209 M211 S217 F230 C233 I234 V243	L193-I213 HydrophobicContact CD2-CG1 4.29Å; A196-I213 HydrophobicContact CB-CG1 4.23Å; T209-I213 HydrophobicContact CG2-CD1 3.84Å; T209-I213 WeakPolarHBondContact O-CG1 3.29Å; T209-I213 PolarHBondContact O-N 3.33Å; M211-I213 VanDerWaalsContact C-N 3.35Å; M211-I213 PolarHBondContact O-N 2.85Å; I213-S217 WeakPolarHBondContact O-CB 3.4Å; I213-S217 PolarHBondContact O-N 3.45Å; I213-S217 PolarHBondContact O-OG 3.32Å; I213-F230 HydrophobicContact CG2-CD2 3.82Å; I213-F230 HydrophobicContact CG2-CE2 3.99Å; I213-C233 HydrophobicContact CD1-CB 3.48Å; I213-C233 VanDerWaalsContact CD1-CB 3.48Å; I213-I234 HydrophobicContact CD1-CD1 4.01Å; I213-V243 HydrophobicContact CG2-CG1 4.04Å
214	A	90.1	Very high	86.1	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.3	-43.2	179.2	0	0	0	0	0	111.9	N210 M211 L212 S217 C218 V243 Y246 I250	N210-A214 WeakPolarHBondContact O-CB 3.49Å; N210-A214 PolarHBondContact O-N 2.84Å; N210-A214 VanDerWaalsContact O-N 3.16Å; M211-A214 PolarHBondContact O-N 3.48Å; M211-A214 VanDerWaalsContact O-N 3.16Å; L212-A214 VanDerWaalsContact C-N 3.34Å; L212-A214 PolarHBondContact O-N 2.95Å; A214-S217 WeakPolarHBondContact O-CB 3.29Å; A214-S217 PolarHBondContact O-N 3.37Å; A214-C218 PolarHBondContact O-N 3.04Å; A214-V243 HydrophobicContact CB-CG1 4.49Å; A214-Y246 VanDerWaalsContact CB-CB 3.48Å; A214-I250 HydrophobicContact CB-CD1 3.92Å
215	V	86.4	Confident	86.9	Confident	18 Å²	18	32.6 Å²	32.6	11%	0.109	16%	0.156	C	C	.	.	H	α-helix	trans	-64.4	-47.3	175.8	176	0	0	0	0	110.8	I181 I185 M211 L212 S217 C218 N219 I250 L318	I181-V215 HydrophobicContact CG2-CG1 3.77Å; I185-V215 HydrophobicContact CD1-CG1 4.19Å; M211-V215 HydrophobicContact CG-CG2 4.46Å; M211-V215 WeakPolarHBondContact O-CG2 3.47Å; M211-V215 PolarHBondContact O-N 3.07Å; L212-V215 PolarHBondContact O-N 2.98Å; V215-S217 PolarHBondContact O-N 3.01Å; V215-C218 WeakPolarHBondContact O-CB 3.24Å; V215-C218 PolarHBondContact O-N 2.82Å; V215-N219 PolarHBondContact O-N 3.24Å; V215-I250 HydrophobicContact CB-CD1 4.45Å; V215-I250 HydrophobicContact CG2-CD1 3.6Å; V215-L318 HydrophobicContact CG2-CD1 4.26Å
216	A	89.5	Confident	87.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.3	-25.6	175.4	0	0	0	0	0	112.9	I192 L193 L212 S222	I192-A216 HydrophobicContact CG2-CB 4.22Å; L193-A216 HydrophobicContact CD2-CB 3.95Å; L193-A216 HydrophobicContact CG-CB 4.25Å; L212-A216 VanDerWaalsContact O-CB 3.28Å; L212-A216 WeakPolarHBondContact O-CB 3.41Å; L212-A216 PolarHBondContact O-N 3.27Å; A216-S222 WeakPolarHBondContact CA-OG 3.3Å; A216-S222 WeakPolarHBondContact O-CB 3.48Å; A216-S222 PolarHBondContact O-OG 3.39Å
217	S	88.7	Confident	87.8	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-73.3	-28.5	174.4	-58.7	0	0	0	0	113.5	I213 A214 V215 R223 I226 P260	I213-S217 WeakPolarHBondContact O-CB 3.4Å; I213-S217 PolarHBondContact O-N 3.45Å; I213-S217 PolarHBondContact O-OG 3.32Å; A214-S217 WeakPolarHBondContact O-CB 3.29Å; A214-S217 PolarHBondContact O-N 3.37Å; V215-S217 PolarHBondContact O-N 3.01Å; S217-R223 PolarHBondContact O-NE 2.91Å; S217-I226 WeakPolarHBondContact OG-CD1 3.41Å; S217-P260 VanDerWaalsContact O-CG 3.3Å; S217-P260 WeakPolarHBondContact O-CG 3.27Å
218	C	83.3	Confident	88	Confident	32 Å²	32	36.1 Å²	36.1	22%	0.216	17%	0.17	C	C	.	.	H	α-helix	trans	-75.1	-39.4	178.6	-70.6	0	0	0	0	111.9	A214 V215 R223 Y247 I250	A214-C218 PolarHBondContact O-N 3.04Å; V215-C218 WeakPolarHBondContact O-CB 3.24Å; V215-C218 PolarHBondContact O-N 2.82Å; C218-R223 PolarHBondContact O-NH2 3.49Å; C218-Y247 VanDerWaalsContact SG-CE2 3.54Å; C218-I250 HydrophobicContact CB-CG2 4.22Å; C218-I250 WeakPolarHBondContact SG-CG2 3.3Å
219	N	83.8	Confident	88.5	Confident	40 Å²	40	36.1 Å²	36.1	21%	0.214	17%	0.17	C	C	.	.	S	Bend	trans	-76.4	133.6	179.2	-168.7	-52.3	0	0	0	111.7	I185 V215 R221 S222 R223	I185-N219 HydrophobicContact CG2-CB 4.08Å; I185-N219 VanDerWaalsContact CG2-CG 3.46Å; I185-N219 WeakPolarHBondContact CG2-ND2 3.37Å; V215-N219 PolarHBondContact O-N 3.24Å; N219-R221 PolarHBondContact O-N 3.19Å; N219-R221 WeakPolarHBondContact OD1-CB 3.38Å; N219-R221 PolarHBondContact OD1-N 3.37Å; N219-S222 PolarHBondContact O-OG 3.29Å; N219-R223 WeakPolarHBondContact O-CG 3.48Å
220	E	83.5	Confident	88.6	Confident	141 Å²	141	36.3 Å²	36.3	66%	0.659	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-35.4	-175.9	-44	-144	120.3	0	0	113.1	S222 R223	E220-S222 VanDerWaalsContact C-N 3.31Å; E220-S222 PolarHBondContact O-N 3.12Å; E220-R223 PolarHBondContact O-N 2.99Å; E220-R223 IonicContact OE1-CZ 2.79Å; E220-R223 IonicContact OE1-NH1 3.24Å; E220-R223 PolarHBondContact OE1-NH1 3.49Å; E220-R223 IonicContact OE1-NH2 3.77Å; E220-R223 PolarHBondContact OE1-NH2 2.78Å
221	R	84.3	Confident	88.5	Confident	143 Å²	143	38.4 Å²	38.4	54%	0.54	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-29.8	-176	-62.1	-174.7	-179.1	166.2	7	113	D186 P189 N219	D186-R221 PolarHBondContact O-NH1 2.9Å; D186-R221 IonicContact OD1-NH1 3.07Å; P189-R221 HydrophobicContact CB-CB 3.93Å; P189-R221 HydrophobicContact CG-CB 4.01Å; N219-R221 PolarHBondContact O-N 3.19Å; N219-R221 WeakPolarHBondContact OD1-CB 3.38Å; N219-R221 PolarHBondContact OD1-N 3.37Å
222	S	87.2	Confident	88.7	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-10.8	179.3	41.2	0	0	0	0	114.1	A216 N219 E220 S224 F225	A216-S222 WeakPolarHBondContact CA-OG 3.3Å; A216-S222 WeakPolarHBondContact O-CB 3.48Å; A216-S222 PolarHBondContact O-OG 3.39Å; N219-S222 PolarHBondContact O-OG 3.29Å; E220-S222 VanDerWaalsContact C-N 3.31Å; E220-S222 PolarHBondContact O-N 3.12Å; S222-S224 VanDerWaalsContact C-N 3.33Å; S222-S224 PolarHBondContact O-N 3.33Å; S222-F225 PolarHBondContact O-N 3.06Å
223	R	87.7	Confident	88.8	Confident	71 Å²	71	39.1 Å²	39.1	27%	0.268	19%	0.191	S	C	.	.	H	α-helix	trans	-61.9	-36.2	-173.8	-76.7	172.9	-165.5	157.5	8	113.8	S217 C218 N219 E220 F225 I226 V262	S217-R223 PolarHBondContact O-NE 2.91Å; C218-R223 PolarHBondContact O-NH2 3.49Å; N219-R223 WeakPolarHBondContact O-CG 3.48Å; E220-R223 PolarHBondContact O-N 2.99Å; E220-R223 IonicContact OE1-CZ 2.79Å; E220-R223 IonicContact OE1-NH1 3.24Å; E220-R223 PolarHBondContact OE1-NH1 3.49Å; E220-R223 IonicContact OE1-NH2 3.77Å; E220-R223 PolarHBondContact OE1-NH2 2.78Å; R223-F225 PolarHBondContact O-N 2.87Å; R223-I226 HydrophobicContact CB-CD1 4.43Å; R223-I226 HydrophobicContact CG-CD1 4.32Å; R223-I226 PolarHBondContact O-N 3.3Å; R223-V262 WeakPolarHBondContact O-CG1 3.33Å
224	S	86.2	Confident	88.8	Confident	78 Å²	78	39 Å²	39	55%	0.545	19%	0.19	S	C	.	.	H	α-helix	trans	-59.6	-35.6	179.6	47.1	0	0	0	0	112.3	S222	S222-S224 VanDerWaalsContact C-N 3.33Å; S222-S224 PolarHBondContact O-N 3.33Å
225	F	90.7	Very high	88.7	Confident	49 Å²	49	45.2 Å²	45.2	22%	0.215	21%	0.214	C	C	.	.	H	α-helix	trans	-84.3	-20.9	-174.4	-56.3	-73	0	0	0	113.5	P189 E190 L193 S222 R223 K227 K228 Y229	P189-F225 HydrophobicContact CG-CE2 3.97Å; E190-F225 HydrophobicContact CB-CD1 3.91Å; E190-F225 HydrophobicContact CB-CD2 3.99Å; E190-F225 HydrophobicContact CB-CE1 4.02Å; E190-F225 HydrophobicContact CB-CE2 4.12Å; E190-F225 HydrophobicContact CB-CG 3.9Å; E190-F225 HydrophobicContact CB-CZ 4.13Å; E190-F225 VanDerWaalsContact CD-CD1 3.42Å; E190-F225 HydrophobicContact CG-CB 4.31Å; E190-F225 HydrophobicContact CG-CD1 3.74Å; E190-F225 HydrophobicContact CG-CE1 4.18Å; E190-F225 HydrophobicContact CG-CG 3.95Å; E190-F225 WeakPolarHBondContact OE2-CD1 3.15Å; E190-F225 WeakPolarHBondContact OE2-CE1 3.33Å; L193-F225 HydrophobicContact CD1-CB 3.46Å; L193-F225 VanDerWaalsContact CD1-CB 3.46Å; S222-F225 PolarHBondContact O-N 3.06Å; R223-F225 PolarHBondContact O-N 2.87Å; F225-K227 VanDerWaalsContact C-N 3.26Å; F225-K227 PolarHBondContact O-N 2.88Å; F225-K227 VanDerWaalsContact O-N 3.15Å; F225-K228 WeakPolarHBondContact O-CB 3.27Å; F225-K228 PolarHBondContact O-N 2.98Å; F225-Y229 HydrophobicContact CB-CD2 4.43Å; F225-Y229 HydrophobicContact CB-CE2 4.29Å; F225-Y229 WeakPolarHBondContact O-CD2 3.2Å
226	I	91.7	Very high	88.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-53.8	-43	-174.8	-65.6	167.3	0	0	0	112.2	L193 S217 R223 K228 Y229 F230 V262	L193-I226 HydrophobicContact CD1-CG1 4.15Å; S217-I226 WeakPolarHBondContact OG-CD1 3.41Å; R223-I226 HydrophobicContact CB-CD1 4.43Å; R223-I226 HydrophobicContact CG-CD1 4.32Å; R223-I226 PolarHBondContact O-N 3.3Å; I226-K228 PolarHBondContact O-N 2.85Å; I226-Y229 PolarHBondContact O-N 3.09Å; I226-F230 HydrophobicContact CG2-CB 4.2Å; I226-F230 HydrophobicContact CG2-CD2 4.16Å; I226-F230 WeakPolarHBondContact O-CB 3.48Å; I226-F230 PolarHBondContact O-N 2.93Å; I226-V262 HydrophobicContact CB-CG1 4.08Å; I226-V262 HydrophobicContact CG2-CG1 4.4Å
227	K	89.7	Confident	88.9	Confident	157 Å²	157	46.2 Å²	46.2	68%	0.683	22%	0.22	S	C	*	.	H	α-helix	trans	-58.7	-32.9	-178.1	-167.4	-178.5	177.8	-171.2	0	112.2	F225 V262	F225-K227 VanDerWaalsContact C-N 3.26Å; F225-K227 PolarHBondContact O-N 2.88Å; F225-K227 VanDerWaalsContact O-N 3.15Å; K227-V262 HydrophobicContact CB-CG1 4.18Å
228	K	89	Confident	88.8	Confident	28 Å²	28	46.6 Å²	46.6	12%	0.122	22%	0.222	C	C	.	.	H	α-helix	trans	-69.1	-41.7	179	179.1	177.7	168.5	-172.6	0	112.1	E190 F225 I226 D746 L751	E190-K228 IonicContact OE1-NZ 3.52Å; E190-K228 PolarHBondContact OE1-NZ 3.1Å; F225-K228 WeakPolarHBondContact O-CB 3.27Å; F225-K228 PolarHBondContact O-N 2.98Å; I226-K228 PolarHBondContact O-N 2.85Å; K228-D746 IonicContact NZ-OD2 3.67Å; K228-D746 PolarHBondContact NZ-OD2 2.91Å; K228-L751 WeakPolarHBondContact CE-O 3.35Å; K228-L751 HydrophobicContact CG-CB 4.17Å
229	Y	93.8	Very high	89.1	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-100.1	-24.6	-170.7	-62.8	-83.6	0	0	0	114.6	E190 L193 K194 L197 F225 I226 S231 S232 C233 D746 L751	E190-Y229 HydrophobicContact CG-CE2 3.84Å; E190-Y229 WeakPolarHBondContact OE1-CE2 3.46Å; E190-Y229 PolarHBondContact OE1-OH 3.28Å; L193-Y229 HydrophobicContact CB-CD1 4.42Å; L193-Y229 HydrophobicContact CB-CD2 3.51Å; L193-Y229 HydrophobicContact CB-CE2 4.04Å; L193-Y229 HydrophobicContact CB-CG 3.74Å; L193-Y229 HydrophobicContact CD1-CD2 3.91Å; L193-Y229 HydrophobicContact CG-CD2 4.31Å; K194-Y229 WeakPolarHBondContact CE-OH 3.21Å; K194-Y229 HydrophobicContact CG-CE1 3.98Å; K194-Y229 WeakPolarHBondContact CG-OH 3.46Å; L197-Y229 HydrophobicContact CB-CD1 4.31Å; L197-Y229 HydrophobicContact CD2-CD1 4.13Å; L197-Y229 HydrophobicContact CD2-CE1 4.37Å; F225-Y229 HydrophobicContact CB-CD2 4.43Å; F225-Y229 HydrophobicContact CB-CE2 4.29Å; F225-Y229 WeakPolarHBondContact O-CD2 3.2Å; I226-Y229 PolarHBondContact O-N 3.09Å; Y229-S231 PolarHBondContact O-N 2.88Å; Y229-S232 PolarHBondContact O-N 3.4Å; Y229-S232 VanDerWaalsContact O-N 3.16Å; Y229-C233 PolarHBondContact O-N 3.4Å; Y229-C233 PolarHBondContact O-SG 3.31Å; Y229-C233 VanDerWaalsContact O-SG 3.36Å; Y229-D746 HydrophobicContact CE1-CB 4.01Å; Y229-D746 PolarHBondContact OH-OD2 2.88Å; Y229-L751 HydrophobicContact CD1-CD1 3.91Å; Y229-L751 HydrophobicContact CE1-CD1 4.13Å
230	F	93.9	Very high	89.6	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.018	20%	0.202	C	C	.	.	H	α-helix	trans	-57.5	-49	-168.2	-172	-88.1	0	0	0	113.5	I213 I226 S232 C233 I234 V243 L263 M267 K270	I213-F230 HydrophobicContact CG2-CD2 3.82Å; I213-F230 HydrophobicContact CG2-CE2 3.99Å; I226-F230 HydrophobicContact CG2-CB 4.2Å; I226-F230 HydrophobicContact CG2-CD2 4.16Å; I226-F230 WeakPolarHBondContact O-CB 3.48Å; I226-F230 PolarHBondContact O-N 2.93Å; F230-S232 VanDerWaalsContact C-N 3.27Å; F230-S232 PolarHBondContact O-N 3.45Å; F230-C233 PolarHBondContact O-N 3.07Å; F230-I234 HydrophobicContact CD1-CG1 4.24Å; F230-I234 HydrophobicContact CD2-CG1 4.44Å; F230-I234 HydrophobicContact CE1-CB 4.44Å; F230-I234 HydrophobicContact CE1-CG1 3.92Å; F230-I234 HydrophobicContact CE2-CG1 4.14Å; F230-I234 HydrophobicContact CG-CG1 4.48Å; F230-I234 HydrophobicContact CZ-CG1 3.85Å; F230-I234 WeakPolarHBondContact O-CG1 3.32Å; F230-I234 PolarHBondContact O-N 3.48Å; F230-V243 HydrophobicContact CE2-CG1 4.27Å; F230-L263 HydrophobicContact CD2-CD1 4.2Å; F230-L263 HydrophobicContact CE2-CD1 3.67Å; F230-L263 HydrophobicContact CZ-CD1 4.46Å; F230-M267 HydrophobicContact CE1-CG 4.21Å; F230-M267 HydrophobicContact CE2-CG 4.19Å; F230-M267 HydrophobicContact CZ-CB 4.46Å; F230-M267 HydrophobicContact CZ-CG 3.54Å; F230-K270 HydrophobicContact CD1-CB 4.25Å; F230-K270 HydrophobicContact CE1-CB 3.85Å; F230-K270 HydrophobicContact CE1-CG 4.21Å
231	S	89.9	Confident	90	Very high	45 Å²	45	36.5 Å²	36.5	32%	0.315	17%	0.171	S	C	.	.	H	α-helix	trans	-63.7	-33.7	-178.6	54.8	0	0	0	0	112.4	Y229 K270	Y229-S231 PolarHBondContact O-N 2.88Å; S231-K270 PolarHBondContact O-NZ 3.36Å
232	S	89.8	Confident	90.3	Very high	14 Å²	14	30 Å²	30	10%	0.098	15%	0.147	C	C	.	.	H	α-helix	trans	-78.5	-26.9	-179.6	-72.6	0	0	0	0	114.1	R201 Y229 F230 L751	R201-S232 PolarHBondContact NE-O 3.04Å; R201-S232 VanDerWaalsContact NE-O 3.09Å; R201-S232 PolarHBondContact NH2-O 3.03Å; Y229-S232 PolarHBondContact O-N 3.4Å; Y229-S232 VanDerWaalsContact O-N 3.16Å; F230-S232 VanDerWaalsContact C-N 3.27Å; F230-S232 PolarHBondContact O-N 3.45Å; S232-L751 VanDerWaalsContact OG-CD2 3.25Å; S232-L751 WeakPolarHBondContact OG-CD2 3.33Å
233	C	93	Very high	90.5	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-85.9	-34.5	176.8	-66.8	0	0	0	0	113.2	L197 R200 T209 I213 Y229 F230	L197-C233 VanDerWaalsContact CA-SG 3.57Å; R200-C233 WeakPolarHBondContact CD-O 3.27Å; R200-C233 WeakPolarHBondContact CG-O 3.45Å; R200-C233 PolarHBondContact NE-O 2.87Å; T209-C233 HydrophobicContact CG2-CB 3.8Å; I213-C233 HydrophobicContact CD1-CB 3.48Å; I213-C233 VanDerWaalsContact CD1-CB 3.48Å; Y229-C233 PolarHBondContact O-N 3.4Å; Y229-C233 PolarHBondContact O-SG 3.31Å; Y229-C233 VanDerWaalsContact O-SG 3.36Å; F230-C233 PolarHBondContact O-N 3.07Å
234	I	93.3	Very high	90.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.134	C	C	.	.			trans	-89.5	115.7	-178.3	-57.7	-52.4	0	0	0	109	N210 I213 F230 D239 W240 V243 K270 F274	N210-I234 WeakPolarHBondContact OD1-CD1 3.33Å; I213-I234 HydrophobicContact CD1-CD1 4.01Å; F230-I234 HydrophobicContact CD1-CG1 4.24Å; F230-I234 HydrophobicContact CD2-CG1 4.44Å; F230-I234 HydrophobicContact CE1-CB 4.44Å; F230-I234 HydrophobicContact CE1-CG1 3.92Å; F230-I234 HydrophobicContact CE2-CG1 4.14Å; F230-I234 HydrophobicContact CG-CG1 4.48Å; F230-I234 HydrophobicContact CZ-CG1 3.85Å; F230-I234 WeakPolarHBondContact O-CG1 3.32Å; F230-I234 PolarHBondContact O-N 3.48Å; I234-D239 HydrophobicContact CD1-CB 4.04Å; I234-D239 HydrophobicContact CG2-CB 4.02Å; I234-W240 HydrophobicContact CG2-CB 3.92Å; I234-V243 HydrophobicContact CD1-CG2 3.57Å; I234-K270 HydrophobicContact CB-CG 4.34Å; I234-K270 HydrophobicContact CG2-CG 4.04Å; I234-K270 WeakPolarHBondContact O-CE 3.27Å; I234-K270 PolarHBondContact O-NZ 3.15Å; I234-F274 HydrophobicContact CG2-CZ 4.16Å
235	R	88	Confident	90.8	Very high	130 Å²	130	23.3 Å²	23.3	49%	0.491	11%	0.11	S	C	.	.			trans	-112	-29.6	-178.6	-60.2	-178.4	73.4	174.5	4.7	113.2	D239	R235-D239 PolarHBondContact N-OD2 3.5Å; R235-D239 VanDerWaalsContact N-OD2 3.08Å
236	T	89.3	Confident	90.6	Very high	37 Å²	37	21.9 Å²	21.9	23%	0.227	10%	0.103	C	C	.	.	S	Bend	trans	-121	152.7	-179.1	76.4	0	0	0	0	111.8	S238 D239 W240	T236-S238 PolarHBondContact O-N 3.26Å; T236-S238 VanDerWaalsContact O-N 3.1Å; T236-S238 PolarHBondContact OG1-N 3.35Å; T236-D239 PolarHBondContact N-OD2 3.16Å; T236-D239 WeakPolarHBondContact O-CA 3.25Å; T236-D239 VanDerWaalsContact O-CB 3.29Å; T236-D239 WeakPolarHBondContact O-CB 3.42Å; T236-D239 PolarHBondContact O-N 3.32Å; T236-D239 PolarHBondContact OG1-N 2.92Å; T236-D239 PolarHBondContact OG1-OD1 3.22Å; T236-D239 PolarHBondContact OG1-OD2 3.49Å; T236-W240 PolarHBondContact O-N 3Å
237	P	89.5	Confident	90.4	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-55.6	-28.2	171.8	-27.3	32.3	0	0	0	113.4	D239 W240 I241 F274 Q278 L279 H282 I328	P237-D239 VanDerWaalsContact C-N 3.35Å; P237-W240 WeakPolarHBondContact O-CB 3.37Å; P237-W240 PolarHBondContact O-N 3.14Å; P237-I241 WeakPolarHBondContact O-CD1 3.4Å; P237-I241 VanDerWaalsContact O-CG1 3.22Å; P237-I241 WeakPolarHBondContact O-CG1 3.2Å; P237-I241 PolarHBondContact O-N 3.23Å; P237-F274 HydrophobicContact CB-CD2 4.37Å; P237-F274 HydrophobicContact CB-CE2 4.32Å; P237-F274 HydrophobicContact CG-CB 4.31Å; P237-F274 HydrophobicContact CG-CD1 3.86Å; P237-F274 HydrophobicContact CG-CD2 4.02Å; P237-F274 HydrophobicContact CG-CE1 4.14Å; P237-F274 HydrophobicContact CG-CE2 4.3Å; P237-F274 HydrophobicContact CG-CG 3.81Å; P237-F274 HydrophobicContact CG-CZ 4.36Å; P237-Q278 HydrophobicContact CG-CB 3.87Å; P237-L279 HydrophobicContact CB-CD2 4.49Å; P237-L279 HydrophobicContact CG-CD2 4.21Å; P237-H282 HydrophobicContact CB-CB 3.96Å; P237-H282 HydrophobicContact CG-CB 4.43Å; P237-I328 HydrophobicContact CB-CD1 4.32Å
238	S	87.7	Confident	90.3	Very high	8 Å²	8	15.2 Å²	15.2	6%	0.056	7%	0.074	C	C	.	.	H	α-helix	trans	-70.8	-31.2	174.8	-74.8	0	0	0	0	112.8	R206 T236 E242 H282	R206-S238 PolarHBondContact NH2-O 3.33Å; T236-S238 PolarHBondContact O-N 3.26Å; T236-S238 VanDerWaalsContact O-N 3.1Å; T236-S238 PolarHBondContact OG1-N 3.35Å; S238-E242 WeakPolarHBondContact O-CB 3.47Å; S238-E242 PolarHBondContact O-N 3.17Å; S238-E242 VanDerWaalsContact O-N 3.12Å; S238-H282 PolarHBondContact OG-CE1 2.86Å; S238-H282 VanDerWaalsContact OG-CE1 3.31Å; S238-H282 PolarHBondContact OG-ND1 3.45Å
239	D	90.3	Very high	90	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-65.1	-46.3	174.1	-52.2	-14.7	0	0	0	109.2	R200 R206 N210 I234 R235 T236 P237 I241 E242 V243	R200-D239 IonicContact CZ-OD2 2.67Å; R200-D239 IonicContact NE-OD2 2.66Å; R200-D239 IonicContact NH2-OD1 3.02Å; R200-D239 IonicContact NH2-OD2 3.18Å; R200-D239 PolarHBondContact NH2-OD2 2.96Å; R206-D239 WeakPolarHBondContact CD-OD1 3.48Å; R206-D239 WeakPolarHBondContact CG-OD1 3.23Å; R206-D239 IonicContact CZ-OD1 2.68Å; R206-D239 VanDerWaalsContact CZ-OD1 3.24Å; R206-D239 IonicContact NE-OD1 2.94Å; R206-D239 PolarHBondContact NE-OD1 3.31Å; R206-D239 IonicContact NH1-OD1 2.8Å; R206-D239 PolarHBondContact NH1-OD1 3.21Å; N210-D239 WeakPolarHBondContact ND2-CA 3.47Å; I234-D239 HydrophobicContact CD1-CB 4.04Å; I234-D239 HydrophobicContact CG2-CB 4.02Å; R235-D239 PolarHBondContact N-OD2 3.5Å; R235-D239 VanDerWaalsContact N-OD2 3.08Å; T236-D239 PolarHBondContact N-OD2 3.16Å; T236-D239 WeakPolarHBondContact O-CA 3.25Å; T236-D239 VanDerWaalsContact O-CB 3.29Å; T236-D239 WeakPolarHBondContact O-CB 3.42Å; T236-D239 PolarHBondContact O-N 3.32Å; T236-D239 PolarHBondContact OG1-N 2.92Å; T236-D239 PolarHBondContact OG1-OD1 3.22Å; T236-D239 PolarHBondContact OG1-OD2 3.49Å; P237-D239 VanDerWaalsContact C-N 3.35Å; D239-I241 VanDerWaalsContact C-N 3.32Å; D239-I241 PolarHBondContact O-N 2.98Å; D239-E242 PolarHBondContact O-N 3.1Å; D239-V243 PolarHBondContact O-N 3.04Å
240	W	93.8	Very high	89.3	Confident	1 Å²	1	14.7 Å²	14.7	0%	0.004	7%	0.073	C	C	.	.	H	α-helix	trans	-56.3	-42.2	176.3	-178.7	86.4	0	0	0	113.1	I234 T236 P237 M267 F271 F274 I328 L331 L335 I337	I234-W240 HydrophobicContact CG2-CB 3.92Å; T236-W240 PolarHBondContact O-N 3Å; P237-W240 WeakPolarHBondContact O-CB 3.37Å; P237-W240 PolarHBondContact O-N 3.14Å; W240-M267 HydrophobicContact CD2-CE 3.93Å; W240-M267 HydrophobicContact CG-CE 4.17Å; W240-M267 HydrophobicContact CZ2-CE 3.94Å; W240-M267 PolarHBondContact NE1-O 3.01Å; W240-F271 HydrophobicContact CH2-CD2 4.16Å; W240-F271 HydrophobicContact CZ2-CD2 4.24Å; W240-F274 HydrophobicContact CB-CE2 3.97Å; W240-F274 HydrophobicContact CB-CZ 3.87Å; W240-F274 HydrophobicContact CD2-CE2 4.41Å; W240-F274 AromaticContact CG-CE2 3.97Å; W240-F274 HydrophobicContact CG-CE2 3.97Å; W240-F274 HydrophobicContact CG-CZ 4.29Å; W240-I328 HydrophobicContact CZ3-CG2 4.32Å; W240-L331 HydrophobicContact CE3-CD1 3.75Å; W240-L331 HydrophobicContact CH2-CB 3.41Å; W240-L331 VanDerWaalsContact CH2-CB 3.41Å; W240-L331 HydrophobicContact CH2-CD1 4.01Å; W240-L331 HydrophobicContact CH2-CG 4.34Å; W240-L331 HydrophobicContact CZ2-CB 4.44Å; W240-L331 HydrophobicContact CZ3-CB 3.52Å; W240-L331 HydrophobicContact CZ3-CD1 3.4Å; W240-L331 VanDerWaalsContact CZ3-CD1 3.4Å; W240-L331 HydrophobicContact CZ3-CG 4.1Å; W240-L335 HydrophobicContact CH2-CD1 3.83Å; W240-L335 HydrophobicContact CZ2-CD1 3.36Å; W240-I337 HydrophobicContact CH2-CD1 3.93Å; W240-I337 HydrophobicContact CZ2-CD1 3.66Å
241	I	91.1	Very high	88.5	Confident	1 Å²	1	15.7 Å²	15.7	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-64.8	-45.6	174.3	-64	159.9	0	0	0	111.1	P237 D239 V243 A244 E245 F326 I328 L331	P237-I241 WeakPolarHBondContact O-CD1 3.4Å; P237-I241 VanDerWaalsContact O-CG1 3.22Å; P237-I241 WeakPolarHBondContact O-CG1 3.2Å; P237-I241 PolarHBondContact O-N 3.23Å; D239-I241 VanDerWaalsContact C-N 3.32Å; D239-I241 PolarHBondContact O-N 2.98Å; I241-V243 PolarHBondContact O-N 3.37Å; I241-A244 WeakPolarHBondContact O-CB 3.26Å; I241-A244 PolarHBondContact O-N 2.88Å; I241-A244 VanDerWaalsContact O-N 3.13Å; I241-E245 HydrophobicContact CG2-CG 4.17Å; I241-E245 WeakPolarHBondContact CG2-OE1 3.43Å; I241-E245 WeakPolarHBondContact O-CG 3.42Å; I241-E245 PolarHBondContact O-N 3.16Å; I241-F326 HydrophobicContact CG2-CB 4.21Å; I241-I328 HydrophobicContact CD1-CD1 4.18Å; I241-I328 HydrophobicContact CD1-CG1 3.49Å; I241-I328 VanDerWaalsContact CD1-CG1 3.49Å; I241-I328 HydrophobicContact CG1-CG1 4.12Å; I241-L331 HydrophobicContact CB-CD1 4.18Å; I241-L331 HydrophobicContact CG1-CD1 3.9Å; I241-L331 HydrophobicContact CG2-CD1 4.26Å
242	E	89.9	Confident	87.7	Confident	6 Å²	6	15.2 Å²	15.2	3%	0.028	8%	0.083	C	C	.	.	H	α-helix	trans	-68	-33.6	-173.4	-173.6	170	-151.2	0	0	112.3	R206 T207 N210 S238 D239 A244 E245 Y246 R323	R206-E242 IonicContact CZ-OE2 2.92Å; R206-E242 VanDerWaalsContact CZ-OE2 3.26Å; R206-E242 IonicContact NE-OE2 2.74Å; R206-E242 PolarHBondContact NE-OE2 2.68Å; R206-E242 IonicContact NH2-OE2 2.68Å; R206-E242 PolarHBondContact NH2-OE2 3.23Å; T207-E242 PolarHBondContact OG1-OE1 2.89Å; N210-E242 HydrophobicContact CB-CB 4.37Å; N210-E242 HydrophobicContact CB-CG 4.14Å; N210-E242 PolarHBondContact ND2-OE2 2.98Å; S238-E242 WeakPolarHBondContact O-CB 3.47Å; S238-E242 PolarHBondContact O-N 3.17Å; S238-E242 VanDerWaalsContact O-N 3.12Å; D239-E242 PolarHBondContact O-N 3.1Å; E242-A244 VanDerWaalsContact C-N 3.32Å; E242-A244 PolarHBondContact O-N 3.23Å; E242-E245 PolarHBondContact O-N 3.19Å; E242-Y246 HydrophobicContact CG-CD2 3.83Å; E242-Y246 HydrophobicContact CG-CE2 3.63Å; E242-Y246 VanDerWaalsContact O-CD2 3.26Å; E242-Y246 WeakPolarHBondContact O-CD2 3.38Å; E242-Y246 PolarHBondContact O-N 2.79Å; E242-R323 IonicContact OE1-NH2 2.69Å; E242-R323 PolarHBondContact OE1-NH2 3.36Å
243	V	92.1	Very high	87	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59	-44.9	170.2	175.1	0	0	0	0	111	N210 I213 A214 F230 I234 D239 I241 E245 Y246 Y247 L263	N210-V243 HydrophobicContact CB-CG2 3.76Å; I213-V243 HydrophobicContact CG2-CG1 4.04Å; A214-V243 HydrophobicContact CB-CG1 4.49Å; F230-V243 HydrophobicContact CE2-CG1 4.27Å; I234-V243 HydrophobicContact CD1-CG2 3.57Å; D239-V243 PolarHBondContact O-N 3.04Å; I241-V243 PolarHBondContact O-N 3.37Å; V243-E245 VanDerWaalsContact C-N 3.34Å; V243-E245 PolarHBondContact O-N 3.25Å; V243-Y246 PolarHBondContact O-N 3.17Å; V243-Y247 WeakPolarHBondContact O-CB 3.18Å; V243-Y247 PolarHBondContact O-N 3.04Å; V243-L263 HydrophobicContact CG1-CD1 4.3Å
244	A	90.5	Very high	85.9	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.008	11%	0.106	C	C	.	.	H	α-helix	trans	-66.1	-37.3	178	0	0	0	0	0	112.2	I241 E242 Y247 A248 M267 F326 L331	I241-A244 WeakPolarHBondContact O-CB 3.26Å; I241-A244 PolarHBondContact O-N 2.88Å; I241-A244 VanDerWaalsContact O-N 3.13Å; E242-A244 VanDerWaalsContact C-N 3.32Å; E242-A244 PolarHBondContact O-N 3.23Å; A244-Y247 PolarHBondContact O-N 3.39Å; A244-A248 WeakPolarHBondContact O-CB 3.39Å; A244-A248 PolarHBondContact O-N 3.1Å; A244-M267 HydrophobicContact CB-CE 3.88Å; A244-F326 HydrophobicContact CB-CD2 4.13Å; A244-F326 HydrophobicContact CB-CE2 4.45Å; A244-L331 HydrophobicContact CB-CD1 4.12Å; A244-L331 HydrophobicContact CB-CD2 3.78Å
245	E	89.1	Confident	84.7	Confident	7 Å²	7	22.5 Å²	22.5	3%	0.033	13%	0.125	C	C	.	.	H	α-helix	trans	-61.3	-49.6	174.3	-69.3	175.1	170.1	0	0	110.8	I241 E242 V243 A248 T249 I324 Y325 F326	I241-E245 HydrophobicContact CG2-CG 4.17Å; I241-E245 WeakPolarHBondContact CG2-OE1 3.43Å; I241-E245 WeakPolarHBondContact O-CG 3.42Å; I241-E245 PolarHBondContact O-N 3.16Å; E242-E245 PolarHBondContact O-N 3.19Å; V243-E245 VanDerWaalsContact C-N 3.34Å; V243-E245 PolarHBondContact O-N 3.25Å; E245-A248 PolarHBondContact O-N 3.38Å; E245-T249 PolarHBondContact O-N 3.27Å; E245-T249 PolarHBondContact O-OG1 3.03Å; E245-T249 VanDerWaalsContact O-OG1 3.12Å; E245-I324 WeakPolarHBondContact CB-O 3.32Å; E245-I324 VanDerWaalsContact CD-O 3.31Å; E245-I324 VanDerWaalsContact CG-O 3.23Å; E245-I324 WeakPolarHBondContact CG-O 3.42Å; E245-Y325 WeakPolarHBondContact OE1-CA 3.48Å; E245-F326 HydrophobicContact CG-CB 4.47Å; E245-F326 HydrophobicContact CG-CD2 3.79Å; E245-F326 HydrophobicContact CG-CE2 4.48Å; E245-F326 HydrophobicContact CG-CG 4.43Å; E245-F326 PolarHBondContact OE1-N 2.95Å
246	Y	87.1	Confident	84.2	Confident	19 Å²	19	16.6 Å²	16.6	8%	0.075	10%	0.103	C	C	.	.	H	α-helix	trans	-61.7	-45	175.8	-83	-64.5	0	0	0	112.2	T207 N210 M211 A214 E242 V243 A248 T249 I250 L318	T207-Y246 HydrophobicContact CG2-CE2 4.17Å; T207-Y246 WeakPolarHBondContact CG2-OH 3.02Å; N210-Y246 HydrophobicContact CB-CD2 4.29Å; M211-Y246 HydrophobicContact CB-CD1 4.28Å; M211-Y246 HydrophobicContact CB-CD2 4.19Å; M211-Y246 HydrophobicContact CB-CE1 4.14Å; M211-Y246 HydrophobicContact CB-CE2 4.07Å; M211-Y246 HydrophobicContact CB-CG 4.31Å; M211-Y246 HydrophobicContact CG-CD1 4.28Å; M211-Y246 HydrophobicContact CG-CE1 4.2Å; M211-Y246 HydrophobicContact SD-CE1 4.35Å; A214-Y246 VanDerWaalsContact CB-CB 3.48Å; E242-Y246 HydrophobicContact CG-CD2 3.83Å; E242-Y246 HydrophobicContact CG-CE2 3.63Å; E242-Y246 VanDerWaalsContact O-CD2 3.26Å; E242-Y246 WeakPolarHBondContact O-CD2 3.38Å; E242-Y246 PolarHBondContact O-N 2.79Å; V243-Y246 PolarHBondContact O-N 3.17Å; Y246-A248 VanDerWaalsContact C-N 3.35Å; Y246-A248 PolarHBondContact O-N 3.49Å; Y246-T249 WeakPolarHBondContact O-CB 3.47Å; Y246-T249 PolarHBondContact O-N 3.44Å; Y246-T249 VanDerWaalsContact O-N 3.15Å; Y246-I250 WeakPolarHBondContact O-CD1 3.42Å; Y246-I250 VanDerWaalsContact O-CG1 3.26Å; Y246-I250 WeakPolarHBondContact O-CG1 3.47Å; Y246-I250 PolarHBondContact O-N 3.42Å; Y246-L318 HydrophobicContact CD1-CD2 4.01Å; Y246-L318 HydrophobicContact CE1-CD2 4.41Å
247	Y	88.4	Confident	83.2	Confident	17 Å²	17	22.4 Å²	22.4	7%	0.067	13%	0.125	C	C	.	.	H	α-helix	trans	-61.9	-41.6	178.6	-179.9	-91.3	0	0	0	112	C218 V243 A244 T249 I250 S251 L256 M259 P260 L263	C218-Y247 VanDerWaalsContact SG-CE2 3.54Å; V243-Y247 WeakPolarHBondContact O-CB 3.18Å; V243-Y247 PolarHBondContact O-N 3.04Å; A244-Y247 PolarHBondContact O-N 3.39Å; Y247-T249 VanDerWaalsContact C-N 3.32Å; Y247-T249 PolarHBondContact O-N 3.3Å; Y247-I250 PolarHBondContact O-N 2.99Å; Y247-S251 VanDerWaalsContact O-CB 3.3Å; Y247-S251 WeakPolarHBondContact O-CB 3.36Å; Y247-S251 PolarHBondContact O-N 3.21Å; Y247-S251 PolarHBondContact O-OG 2.84Å; Y247-L256 HydrophobicContact CD1-CD2 3.76Å; Y247-L256 HydrophobicContact CE1-CD2 4.32Å; Y247-M259 HydrophobicContact CD1-CG 4.34Å; Y247-M259 HydrophobicContact CE1-CB 3.94Å; Y247-M259 HydrophobicContact CE1-CG 3.93Å; Y247-M259 WeakPolarHBondContact OH-CA 3.5Å; Y247-P260 HydrophobicContact CE2-CG 4.36Å; Y247-P260 WeakPolarHBondContact OH-CD 3.46Å; Y247-L263 HydrophobicContact CD1-CD2 4.48Å; Y247-L263 HydrophobicContact CD2-CD2 3.74Å; Y247-L263 HydrophobicContact CE2-CD2 4.19Å; Y247-L263 HydrophobicContact CG-CD2 3.92Å
248	A	86.3	Confident	82.5	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.9	-38	174.8	0	0	0	0	0	112.2	A244 E245 Y246 G252 L256 I324 F326	A244-A248 WeakPolarHBondContact O-CB 3.39Å; A244-A248 PolarHBondContact O-N 3.1Å; E245-A248 PolarHBondContact O-N 3.38Å; Y246-A248 VanDerWaalsContact C-N 3.35Å; Y246-A248 PolarHBondContact O-N 3.49Å; A248-G252 PolarHBondContact O-N 2.93Å; A248-L256 HydrophobicContact CB-CD2 3.89Å; A248-I324 HydrophobicContact CB-CD1 3.81Å; A248-I324 HydrophobicContact CB-CG2 4.47Å; A248-F326 HydrophobicContact CB-CE2 3.67Å; A248-F326 HydrophobicContact CB-CZ 3.71Å
249	T	83.2	Confident	82.4	Confident	15 Å²	15	25.4 Å²	25.4	9%	0.092	16%	0.156	C	C	.	.	H	α-helix	trans	-66.5	-43.9	176.2	-65	0	0	0	0	111.4	E245 Y246 Y247	E245-T249 PolarHBondContact O-N 3.27Å; E245-T249 PolarHBondContact O-OG1 3.03Å; E245-T249 VanDerWaalsContact O-OG1 3.12Å; Y246-T249 WeakPolarHBondContact O-CB 3.47Å; Y246-T249 PolarHBondContact O-N 3.44Å; Y246-T249 VanDerWaalsContact O-N 3.15Å; Y247-T249 VanDerWaalsContact C-N 3.32Å; Y247-T249 PolarHBondContact O-N 3.3Å
250	I	79.2	Confident	82.3	Confident	3 Å²	3	26.1 Å²	26.1	2%	0.015	16%	0.16	C	C	.	.	H	α-helix	trans	-69.9	-51	-179.2	-65.1	159.5	0	0	0	110.8	A214 V215 C218 Y246 Y247 G252 I314 R317 L318	A214-I250 HydrophobicContact CB-CD1 3.92Å; V215-I250 HydrophobicContact CB-CD1 4.45Å; V215-I250 HydrophobicContact CG2-CD1 3.6Å; C218-I250 HydrophobicContact CB-CG2 4.22Å; C218-I250 WeakPolarHBondContact SG-CG2 3.3Å; Y246-I250 WeakPolarHBondContact O-CD1 3.42Å; Y246-I250 VanDerWaalsContact O-CG1 3.26Å; Y246-I250 WeakPolarHBondContact O-CG1 3.47Å; Y246-I250 PolarHBondContact O-N 3.42Å; Y247-I250 PolarHBondContact O-N 2.99Å; I250-G252 PolarHBondContact O-N 3.13Å; I250-G252 VanDerWaalsContact O-N 3.16Å; I250-I314 HydrophobicContact CG1-CG2 4.5Å; I250-I314 HydrophobicContact CG2-CB 4.49Å; I250-I314 HydrophobicContact CG2-CD1 4.36Å; I250-I314 HydrophobicContact CG2-CG1 4.11Å; I250-I314 HydrophobicContact CG2-CG2 3.76Å; I250-R317 PolarHBondContact O-NH1 3Å; I250-L318 HydrophobicContact CD1-CD1 4.5Å; I250-L318 HydrophobicContact CD1-CD2 4.09Å; I250-L318 HydrophobicContact CG1-CD1 4.14Å; I250-L318 HydrophobicContact CG1-CD2 3.67Å; I250-L318 HydrophobicContact CG1-CG 3.88Å
251	S	78.1	Confident	82.1	Confident	25 Å²	25	34.8 Å²	34.8	18%	0.175	20%	0.198	C	C	.	.	H	α-helix	trans	-67.9	-14.5	-178.4	60.4	0	0	0	0	113.6	Y247 N253	Y247-S251 VanDerWaalsContact O-CB 3.3Å; Y247-S251 WeakPolarHBondContact O-CB 3.36Å; Y247-S251 PolarHBondContact O-N 3.21Å; Y247-S251 PolarHBondContact O-OG 2.84Å; S251-N253 PolarHBondContact O-N 3.39Å; S251-N253 PolarHBondContact OG-N 3.04Å
252	G	72.6	Confident	82	Confident	35 Å²	35	37 Å²	37	36%	0.361	21%	0.212	S	C	.	.			trans	65.5	-7.1	-169.6	0	0	0	0	0	113.9	A248 I250 L254	A248-G252 PolarHBondContact O-N 2.93Å; I250-G252 PolarHBondContact O-N 3.13Å; I250-G252 VanDerWaalsContact O-N 3.16Å; G252-L254 PolarHBondContact O-N 3.07Å
253	N	74.3	Confident	82.1	Confident	60 Å²	60	36.7 Å²	36.7	32%	0.321	21%	0.21	S	C	.	.			trans	-96.6	92.1	-176.2	-165.2	-27.5	0	0	0	111.1	S251 S255 L256 K257	S251-N253 PolarHBondContact O-N 3.39Å; S251-N253 PolarHBondContact OG-N 3.04Å; N253-S255 PolarHBondContact O-N 3Å; N253-S255 VanDerWaalsContact O-N 3.1Å; N253-S255 WeakPolarHBondContact OD1-CB 3.38Å; N253-S255 PolarHBondContact OD1-N 2.85Å; N253-L256 PolarHBondContact O-N 3.46Å; N253-K257 PolarHBondContact ND2-O 3.39Å
254	L	69.9	Low	82.1	Confident	51 Å²	51	40 Å²	40	27%	0.267	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-22.2	178.4	-73.4	115.9	0	0	0	114.3	G252 L256 K299 I324 R334	G252-L254 PolarHBondContact O-N 3.07Å; L254-L256 PolarHBondContact O-N 2.99Å; L254-K299 HydrophobicContact CD1-CG 4.45Å; L254-K299 HydrophobicContact CD2-CD 4.49Å; L254-I324 HydrophobicContact CD2-CD1 3.79Å; L254-I324 HydrophobicContact CD2-CG1 4.05Å; L254-I324 HydrophobicContact CD2-CG2 4.17Å; L254-I324 HydrophobicContact CG-CD1 3.94Å; L254-R334 PolarHBondContact O-NH1 3.28Å
255	S	69.5	Low	82.1	Confident	55 Å²	55	43.1 Å²	43.1	39%	0.385	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-7.5	179.8	-59.1	0	0	0	0	112.3	N253 K257	N253-S255 PolarHBondContact O-N 3Å; N253-S255 VanDerWaalsContact O-N 3.1Å; N253-S255 WeakPolarHBondContact OD1-CB 3.38Å; N253-S255 PolarHBondContact OD1-N 2.85Å; S255-K257 PolarHBondContact O-N 3.36Å
256	L	76.5	Confident	82.3	Confident	6 Å²	6	43.2 Å²	43.2	3%	0.031	25%	0.246	C	C	.	.			trans	55.5	16.2	-169.6	-56.2	171.4	0	0	0	112.6	Y247 A248 N253 L254 G258 M259 R264 F326 L331	Y247-L256 HydrophobicContact CD1-CD2 3.76Å; Y247-L256 HydrophobicContact CE1-CD2 4.32Å; A248-L256 HydrophobicContact CB-CD2 3.89Å; N253-L256 PolarHBondContact O-N 3.46Å; L254-L256 PolarHBondContact O-N 2.99Å; L256-G258 PolarHBondContact O-N 2.91Å; L256-M259 HydrophobicContact CB-CE 3.69Å; L256-M259 HydrophobicContact CD1-CE 3.82Å; L256-M259 HydrophobicContact CD2-CE 3.98Å; L256-M259 HydrophobicContact CG-CE 4.04Å; L256-M259 WeakPolarHBondContact O-CB 3.38Å; L256-M259 PolarHBondContact O-N 3.15Å; L256-R264 PolarHBondContact O-NH2 3.27Å; L256-F326 HydrophobicContact CD1-CE2 4.35Å; L256-F326 HydrophobicContact CD2-CE2 4.48Å; L256-L331 HydrophobicContact CD1-CD2 3.82Å
257	K	69.2	Low	82.7	Confident	159 Å²	159	42.3 Å²	42.3	69%	0.691	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	125.2	171.1	-75.2	-174.5	176.7	-171.2	0	106.4	N253 S255	N253-K257 PolarHBondContact ND2-O 3.39Å; S255-K257 PolarHBondContact O-N 3.36Å
258	G	73.6	Confident	82.9	Confident	67 Å²	67	44.1 Å²	44.1	69%	0.691	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	5.8	-173.1	0	0	0	0	0	116	L256	L256-G258 PolarHBondContact O-N 2.91Å
259	M	85.8	Confident	83.1	Confident	6 Å²	6	47.2 Å²	47.2	3%	0.03	27%	0.274	C	S	.	.			trans	-54.7	134	170.3	-173.3	-168.1	-48.7	0	0	110.7	Y247 L256 K261 L263 R264 M267 L335	Y247-M259 HydrophobicContact CD1-CG 4.34Å; Y247-M259 HydrophobicContact CE1-CB 3.94Å; Y247-M259 HydrophobicContact CE1-CG 3.93Å; Y247-M259 WeakPolarHBondContact OH-CA 3.5Å; L256-M259 HydrophobicContact CB-CE 3.69Å; L256-M259 HydrophobicContact CD1-CE 3.82Å; L256-M259 HydrophobicContact CD2-CE 3.98Å; L256-M259 HydrophobicContact CG-CE 4.04Å; L256-M259 WeakPolarHBondContact O-CB 3.38Å; L256-M259 PolarHBondContact O-N 3.15Å; M259-K261 PolarHBondContact O-N 3.14Å; M259-L263 HydrophobicContact CG-CB 4.19Å; M259-L263 HydrophobicContact CG-CD2 3.75Å; M259-L263 HydrophobicContact CG-CG 4.06Å; M259-L263 HydrophobicContact SD-CB 4.36Å; M259-L263 HydrophobicContact SD-CD2 3.95Å; M259-L263 HydrophobicContact SD-CG 3.86Å; M259-R264 PolarHBondContact O-NH1 3.33Å; M259-R264 PolarHBondContact O-NH2 3.48Å; M259-R264 HydrophobicContact SD-CB 3.91Å; M259-M267 HydrophobicContact SD-SD 4.12Å; M259-L335 HydrophobicContact CE-CD2 3.66Å; M259-L335 HydrophobicContact SD-CD2 4Å
260	P	87.9	Confident	83.6	Confident	14 Å²	14	47.5 Å²	47.5	9%	0.091	27%	0.274	C	S	.	.			trans	-51.1	139.1	177.4	-26.2	27.1	0	0	0	111.8	S217 Y247 V262 L263 R264	S217-P260 VanDerWaalsContact O-CG 3.3Å; S217-P260 WeakPolarHBondContact O-CG 3.27Å; Y247-P260 HydrophobicContact CE2-CG 4.36Å; Y247-P260 WeakPolarHBondContact OH-CD 3.46Å; P260-V262 PolarHBondContact O-N 3.37Å; P260-L263 HydrophobicContact CB-CB 4.33Å; P260-L263 PolarHBondContact O-N 3.1Å; P260-R264 PolarHBondContact O-N 2.93Å
261	K	89	Confident	84.3	Confident	183 Å²	183	47.4 Å²	47.4	80%	0.796	27%	0.273	S	S	*	.	H	α-helix	trans	-56.3	-38.3	179.6	-169.1	177.4	179.7	-178.6	0	111.6	M259 S265	M259-K261 PolarHBondContact O-N 3.14Å; K261-S265 VanDerWaalsContact O-CB 3.23Å; K261-S265 WeakPolarHBondContact O-CB 3.44Å; K261-S265 PolarHBondContact O-N 2.93Å
262	V	89.5	Confident	84.8	Confident	48 Å²	48	50.5 Å²	50.5	29%	0.291	29%	0.288	S	S	.	.	H	α-helix	trans	-64.6	-47.8	178.4	-175.9	0	0	0	0	111.9	R223 I226 K227 P260 S265 S266	R223-V262 WeakPolarHBondContact O-CG1 3.33Å; I226-V262 HydrophobicContact CB-CG1 4.08Å; I226-V262 HydrophobicContact CG2-CG1 4.4Å; K227-V262 HydrophobicContact CB-CG1 4.18Å; P260-V262 PolarHBondContact O-N 3.37Å; V262-S265 PolarHBondContact O-N 2.79Å; V262-S266 WeakPolarHBondContact O-CB 3.48Å; V262-S266 PolarHBondContact O-N 3.32Å; V262-S266 PolarHBondContact O-OG 3.43Å
263	L	92.1	Very high	85.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.6	-46.2	177.5	176.6	61.7	0	0	0	110.8	F230 V243 Y247 M259 P260 S265 S266 M267	F230-L263 HydrophobicContact CD2-CD1 4.2Å; F230-L263 HydrophobicContact CE2-CD1 3.67Å; F230-L263 HydrophobicContact CZ-CD1 4.46Å; V243-L263 HydrophobicContact CG1-CD1 4.3Å; Y247-L263 HydrophobicContact CD1-CD2 4.48Å; Y247-L263 HydrophobicContact CD2-CD2 3.74Å; Y247-L263 HydrophobicContact CE2-CD2 4.19Å; Y247-L263 HydrophobicContact CG-CD2 3.92Å; M259-L263 HydrophobicContact CG-CB 4.19Å; M259-L263 HydrophobicContact CG-CD2 3.75Å; M259-L263 HydrophobicContact CG-CG 4.06Å; M259-L263 HydrophobicContact SD-CB 4.36Å; M259-L263 HydrophobicContact SD-CD2 3.95Å; M259-L263 HydrophobicContact SD-CG 3.86Å; P260-L263 HydrophobicContact CB-CB 4.33Å; P260-L263 PolarHBondContact O-N 3.1Å; L263-S265 PolarHBondContact O-N 3.43Å; L263-S266 PolarHBondContact O-N 2.9Å; L263-M267 HydrophobicContact CD1-CG 4.09Å; L263-M267 HydrophobicContact CD1-SD 4.26Å; L263-M267 HydrophobicContact CG-CG 4.48Å; L263-M267 HydrophobicContact CG-SD 4.28Å; L263-M267 WeakPolarHBondContact O-CB 3.34Å; L263-M267 WeakPolarHBondContact O-CG 3.34Å; L263-M267 PolarHBondContact O-N 3.35Å
264	R	92.3	Very high	86.5	Confident	70 Å²	70	51.3 Å²	51.3	26%	0.264	28%	0.28	S	S	.	.	H	α-helix	trans	-58.1	-48.8	177.2	-176.5	-179.5	-69.4	95.8	-0.4	111.2	L256 M259 P260 M267 I268 L335	L256-R264 PolarHBondContact O-NH2 3.27Å; M259-R264 PolarHBondContact O-NH1 3.33Å; M259-R264 PolarHBondContact O-NH2 3.48Å; M259-R264 HydrophobicContact SD-CB 3.91Å; P260-R264 PolarHBondContact O-N 2.93Å; R264-M267 PolarHBondContact O-N 2.92Å; R264-I268 HydrophobicContact CG-CD1 3.87Å; R264-I268 VanDerWaalsContact O-CG1 3.23Å; R264-I268 WeakPolarHBondContact O-CG1 3.48Å; R264-I268 PolarHBondContact O-N 3.35Å; R264-L335 HydrophobicContact CG-CD2 3.95Å
265	S	91.6	Very high	87.2	Confident	65 Å²	65	52.3 Å²	52.3	46%	0.455	29%	0.286	S	S	.	.	H	α-helix	trans	-62.2	-44.1	178.7	177	0	0	0	0	112.1	K261 V262 L263 M267 I268 S269	K261-S265 VanDerWaalsContact O-CB 3.23Å; K261-S265 WeakPolarHBondContact O-CB 3.44Å; K261-S265 PolarHBondContact O-N 2.93Å; V262-S265 PolarHBondContact O-N 2.79Å; L263-S265 PolarHBondContact O-N 3.43Å; S265-M267 PolarHBondContact O-N 3.34Å; S265-I268 PolarHBondContact O-N 2.82Å; S265-S269 WeakPolarHBondContact O-CB 3.32Å; S265-S269 PolarHBondContact O-N 2.93Å
266	S	92.8	Very high	88	Confident	9 Å²	9	53.3 Å²	53.3	6%	0.063	28%	0.284	C	S	.	.	H	α-helix	trans	-64.1	-40.4	178.5	-54.7	0	0	0	0	111.7	V262 L263 K270	V262-S266 WeakPolarHBondContact O-CB 3.48Å; V262-S266 PolarHBondContact O-N 3.32Å; V262-S266 PolarHBondContact O-OG 3.43Å; L263-S266 PolarHBondContact O-N 2.9Å; S266-K270 VanDerWaalsContact O-CB 3.31Å; S266-K270 WeakPolarHBondContact O-CB 3.35Å; S266-K270 PolarHBondContact O-N 3.37Å
267	M	94.3	Very high	88.2	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.8	-41.9	174.8	-77	-171.8	77.7	0	0	112.9	F230 W240 A244 M259 L263 R264 S265 F271 L335	F230-M267 HydrophobicContact CE1-CG 4.21Å; F230-M267 HydrophobicContact CE2-CG 4.19Å; F230-M267 HydrophobicContact CZ-CB 4.46Å; F230-M267 HydrophobicContact CZ-CG 3.54Å; W240-M267 HydrophobicContact CD2-CE 3.93Å; W240-M267 HydrophobicContact CG-CE 4.17Å; W240-M267 HydrophobicContact CZ2-CE 3.94Å; W240-M267 PolarHBondContact NE1-O 3.01Å; A244-M267 HydrophobicContact CB-CE 3.88Å; M259-M267 HydrophobicContact SD-SD 4.12Å; L263-M267 HydrophobicContact CD1-CG 4.09Å; L263-M267 HydrophobicContact CD1-SD 4.26Å; L263-M267 HydrophobicContact CG-CG 4.48Å; L263-M267 HydrophobicContact CG-SD 4.28Å; L263-M267 WeakPolarHBondContact O-CB 3.34Å; L263-M267 WeakPolarHBondContact O-CG 3.34Å; L263-M267 PolarHBondContact O-N 3.35Å; R264-M267 PolarHBondContact O-N 2.92Å; S265-M267 PolarHBondContact O-N 3.34Å; M267-F271 PolarHBondContact O-N 3.46Å; M267-L335 HydrophobicContact CB-CD1 4.18Å; M267-L335 HydrophobicContact CE-CD1 3.78Å; M267-L335 HydrophobicContact SD-CD1 4.29Å
268	I	92.9	Very high	89	Confident	56 Å²	56	52.4 Å²	52.4	29%	0.287	28%	0.279	S	S	.	.	H	α-helix	trans	-65.1	-48	177.2	-67.8	165.4	0	0	0	109.8	R264 S265 K270 F271 L335 I337	R264-I268 HydrophobicContact CG-CD1 3.87Å; R264-I268 VanDerWaalsContact O-CG1 3.23Å; R264-I268 WeakPolarHBondContact O-CG1 3.48Å; R264-I268 PolarHBondContact O-N 3.35Å; S265-I268 PolarHBondContact O-N 2.82Å; I268-K270 VanDerWaalsContact C-N 3.31Å; I268-K270 PolarHBondContact O-N 3.22Å; I268-F271 WeakPolarHBondContact O-CB 3.4Å; I268-F271 PolarHBondContact O-N 3.07Å; I268-L335 WeakPolarHBondContact CD1-O 3.25Å; I268-L335 HydrophobicContact CG1-CB 4.34Å; I268-I337 HydrophobicContact CG1-CG1 4.01Å
269	S	91.6	Very high	89.6	Confident	65 Å²	65	49.2 Å²	49.2	46%	0.455	25%	0.246	S	C	.	.	H	α-helix	trans	-57.9	-45.7	177.9	-166.6	0	0	0	0	111.1	S265 F271 L272	S265-S269 WeakPolarHBondContact O-CB 3.32Å; S265-S269 PolarHBondContact O-N 2.93Å; S269-F271 VanDerWaalsContact C-N 3.27Å; S269-F271 PolarHBondContact O-N 3.45Å; S269-L272 WeakPolarHBondContact O-CB 3.48Å; S269-L272 PolarHBondContact O-N 3.33Å; S269-L272 VanDerWaalsContact O-N 3.15Å
270	K	93.2	Very high	89.4	Confident	20 Å²	20	49.8 Å²	49.8	9%	0.087	25%	0.252	C	S	.	.	H	α-helix	trans	-66.5	-27.7	-178.5	-171.6	57.5	-178.9	-166.9	0	113.5	F230 S231 I234 S266 I268 L272 E273 F274	F230-K270 HydrophobicContact CD1-CB 4.25Å; F230-K270 HydrophobicContact CE1-CB 3.85Å; F230-K270 HydrophobicContact CE1-CG 4.21Å; S231-K270 PolarHBondContact O-NZ 3.36Å; I234-K270 HydrophobicContact CB-CG 4.34Å; I234-K270 HydrophobicContact CG2-CG 4.04Å; I234-K270 WeakPolarHBondContact O-CE 3.27Å; I234-K270 PolarHBondContact O-NZ 3.15Å; S266-K270 VanDerWaalsContact O-CB 3.31Å; S266-K270 WeakPolarHBondContact O-CB 3.35Å; S266-K270 PolarHBondContact O-N 3.37Å; I268-K270 VanDerWaalsContact C-N 3.31Å; I268-K270 PolarHBondContact O-N 3.22Å; K270-L272 PolarHBondContact O-N 3.05Å; K270-E273 HydrophobicContact CD-CB 4.36Å; K270-E273 HydrophobicContact CD-CG 4.46Å; K270-E273 WeakPolarHBondContact CD-OE2 3.22Å; K270-E273 WeakPolarHBondContact CE-OE2 3.47Å; K270-E273 IonicContact NZ-OE2 2.69Å; K270-E273 PolarHBondContact NZ-OE2 3.31Å; K270-E273 PolarHBondContact O-N 2.82Å; K270-F274 HydrophobicContact CG-CE1 4.46Å; K270-F274 HydrophobicContact CG-CE2 4.46Å; K270-F274 HydrophobicContact CG-CZ 3.97Å
271	F	93.2	Very high	89	Confident	1 Å²	1	54.5 Å²	54.5	0%	0.004	27%	0.271	C	S	.	.	H	α-helix	trans	-63.2	-31.3	176.2	-175.7	-89.4	0	0	0	112.3	W240 M267 I268 S269 E273 F274 L279 I328 I332 I337 V344	W240-F271 HydrophobicContact CH2-CD2 4.16Å; W240-F271 HydrophobicContact CZ2-CD2 4.24Å; M267-F271 PolarHBondContact O-N 3.46Å; I268-F271 WeakPolarHBondContact O-CB 3.4Å; I268-F271 PolarHBondContact O-N 3.07Å; S269-F271 VanDerWaalsContact C-N 3.27Å; S269-F271 PolarHBondContact O-N 3.45Å; F271-E273 PolarHBondContact O-N 2.96Å; F271-F274 HydrophobicContact CD2-CD2 4.29Å; F271-F274 PolarHBondContact O-N 3.35Å; F271-L279 HydrophobicContact CE2-CD2 3.92Å; F271-L279 HydrophobicContact CZ-CD1 4.3Å; F271-L279 HydrophobicContact CZ-CD2 4.3Å; F271-I328 HydrophobicContact CE2-CG2 4.13Å; F271-I332 HydrophobicContact CE2-CD1 3.98Å; F271-I332 HydrophobicContact CE2-CG1 4.01Å; F271-I332 HydrophobicContact CZ-CD1 3.76Å; F271-I332 HydrophobicContact CZ-CG1 4.09Å; F271-I337 HydrophobicContact CB-CD1 4.02Å; F271-I337 HydrophobicContact CD1-CD1 4.46Å; F271-I337 HydrophobicContact CD1-CG2 3.51Å; F271-I337 HydrophobicContact CD2-CD1 4.15Å; F271-I337 HydrophobicContact CE1-CG2 3.78Å; F271-I337 HydrophobicContact CG-CD1 3.95Å; F271-I337 HydrophobicContact CG-CG2 4.09Å; F271-V344 HydrophobicContact CE1-CG2 3.83Å; F271-V344 HydrophobicContact CZ-CG2 4.32Å
272	L	89.9	Confident	88.5	Confident	90 Å²	90	48.1 Å²	48.1	47%	0.471	24%	0.244	S	C	.	.	H	α-helix	trans	-65.8	-26.5	177.9	-56.6	176.2	0	0	0	112.6	S269 K270 K339 P340	S269-L272 WeakPolarHBondContact O-CB 3.48Å; S269-L272 PolarHBondContact O-N 3.33Å; S269-L272 VanDerWaalsContact O-N 3.15Å; K270-L272 PolarHBondContact O-N 3.05Å; L272-K339 HydrophobicContact CD2-CB 3.98Å; L272-K339 VanDerWaalsContact CD2-O 3.22Å; L272-K339 WeakPolarHBondContact CD2-O 3.3Å; L272-P340 HydrophobicContact CD2-CG 4.41Å
273	E	89.9	Confident	87.9	Confident	106 Å²	106	47.3 Å²	47.3	50%	0.495	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-13.1	-178.7	-63.2	173.1	-141.6	0	0	113.4	K270 F271 D275	K270-E273 HydrophobicContact CD-CB 4.36Å; K270-E273 HydrophobicContact CD-CG 4.46Å; K270-E273 WeakPolarHBondContact CD-OE2 3.22Å; K270-E273 WeakPolarHBondContact CE-OE2 3.47Å; K270-E273 IonicContact NZ-OE2 2.69Å; K270-E273 PolarHBondContact NZ-OE2 3.31Å; K270-E273 PolarHBondContact O-N 2.82Å; F271-E273 PolarHBondContact O-N 2.96Å; E273-D275 PolarHBondContact O-N 3.42Å
274	F	91.2	Very high	86.6	Confident	6 Å²	6	55.6 Å²	55.6	3%	0.026	28%	0.276	C	S	.	.			trans	-77.6	122.8	-178.9	-64.1	-44.9	0	0	0	111.3	I234 P237 W240 K270 F271 L279	I234-F274 HydrophobicContact CG2-CZ 4.16Å; P237-F274 HydrophobicContact CB-CD2 4.37Å; P237-F274 HydrophobicContact CB-CE2 4.32Å; P237-F274 HydrophobicContact CG-CB 4.31Å; P237-F274 HydrophobicContact CG-CD1 3.86Å; P237-F274 HydrophobicContact CG-CD2 4.02Å; P237-F274 HydrophobicContact CG-CE1 4.14Å; P237-F274 HydrophobicContact CG-CE2 4.3Å; P237-F274 HydrophobicContact CG-CG 3.81Å; P237-F274 HydrophobicContact CG-CZ 4.36Å; W240-F274 HydrophobicContact CB-CE2 3.97Å; W240-F274 HydrophobicContact CB-CZ 3.87Å; W240-F274 HydrophobicContact CD2-CE2 4.41Å; W240-F274 AromaticContact CG-CE2 3.97Å; W240-F274 HydrophobicContact CG-CE2 3.97Å; W240-F274 HydrophobicContact CG-CZ 4.29Å; K270-F274 HydrophobicContact CG-CE1 4.46Å; K270-F274 HydrophobicContact CG-CE2 4.46Å; K270-F274 HydrophobicContact CG-CZ 3.97Å; F271-F274 HydrophobicContact CD2-CD2 4.29Å; F271-F274 PolarHBondContact O-N 3.35Å; F274-L279 HydrophobicContact CB-CD1 4.34Å; F274-L279 HydrophobicContact CB-CD2 3.98Å; F274-L279 HydrophobicContact CB-CG 3.96Å; F274-L279 HydrophobicContact CD2-CD2 4.3Å
275	D	85.7	Confident	85	Confident	73 Å²	73	56.5 Å²	56.5	39%	0.39	28%	0.283	S	S	.	.			trans	-67.9	162.1	174.2	67.5	44.9	0	0	0	112.5	E273 Y277 Q278 L279	E273-D275 PolarHBondContact O-N 3.42Å; D275-Y277 VanDerWaalsContact C-N 3.25Å; D275-Y277 PolarHBondContact O-N 2.9Å; D275-Y277 WeakPolarHBondContact OD1-CA 3.33Å; D275-Y277 WeakPolarHBondContact OD1-CB 3.37Å; D275-Y277 PolarHBondContact OD1-N 3.27Å; D275-Y277 VanDerWaalsContact OD1-N 3.11Å; D275-Q278 PolarHBondContact O-N 2.86Å; D275-Q278 VanDerWaalsContact OD1-CB 3.27Å; D275-Q278 WeakPolarHBondContact OD1-CB 3.41Å; D275-Q278 WeakPolarHBondContact OD1-CG 3.48Å; D275-Q278 PolarHBondContact OD1-N 2.97Å; D275-Q278 PolarHBondContact OD2-NE2 2.85Å; D275-L279 WeakPolarHBondContact O-CG 3.1Å; D275-L279 PolarHBondContact O-N 2.67Å; D275-L279 VanDerWaalsContact O-N 3.15Å
276	E	85.6	Confident	83.4	Confident	76 Å²	76	63.8 Å²	63.8	36%	0.355	30%	0.301	S	S	.	.	H	α-helix	trans	-59.4	-35.9	180	-64.7	-176.5	-169.9	0	0	112.6	L279 A280 F379 P380	E276-L279 PolarHBondContact O-N 3.34Å; E276-A280 WeakPolarHBondContact O-CB 3.45Å; E276-A280 PolarHBondContact O-N 2.96Å; E276-F379 HydrophobicContact CB-CD1 3.86Å; E276-F379 HydrophobicContact CB-CE1 4.18Å; E276-F379 HydrophobicContact CG-CD1 4.13Å; E276-F379 HydrophobicContact CG-CE1 4.2Å; E276-P380 WeakPolarHBondContact OE2-CD 3.37Å; E276-P380 VanDerWaalsContact OE2-CG 3.28Å; E276-P380 WeakPolarHBondContact OE2-CG 3.23Å
277	Y	81.3	Confident	82	Confident	96 Å²	96	66.5 Å²	66.5	38%	0.376	32%	0.324	S	S	.	.	H	α-helix	trans	-64.2	-47.5	180	170.9	-98.9	0	0	0	111.8	D275 A280 K281 P382 T384	D275-Y277 VanDerWaalsContact C-N 3.25Å; D275-Y277 PolarHBondContact O-N 2.9Å; D275-Y277 WeakPolarHBondContact OD1-CA 3.33Å; D275-Y277 WeakPolarHBondContact OD1-CB 3.37Å; D275-Y277 PolarHBondContact OD1-N 3.27Å; D275-Y277 VanDerWaalsContact OD1-N 3.11Å; Y277-A280 PolarHBondContact O-N 3.47Å; Y277-K281 HydrophobicContact CE1-CD 4.1Å; Y277-K281 VanDerWaalsContact O-CB 3.3Å; Y277-K281 WeakPolarHBondContact O-CB 3.45Å; Y277-K281 PolarHBondContact O-N 3.42Å; Y277-P382 HydrophobicContact CD2-CB 3.51Å; Y277-P382 HydrophobicContact CD2-CG 3.52Å; Y277-P382 HydrophobicContact CE2-CB 3.9Å; Y277-P382 HydrophobicContact CE2-CG 3.67Å; Y277-T384 HydrophobicContact CE2-CG2 3.88Å
278	Q	85.1	Confident	80.8	Confident	50 Å²	50	69.7 Å²	69.7	23%	0.234	34%	0.336	C	S	.	.	H	α-helix	trans	-62.6	-45.8	178.9	-73	175.1	30.2	0	0	110.2	P237 D275 K281 H282	P237-Q278 HydrophobicContact CG-CB 3.87Å; D275-Q278 PolarHBondContact O-N 2.86Å; D275-Q278 VanDerWaalsContact OD1-CB 3.27Å; D275-Q278 WeakPolarHBondContact OD1-CB 3.41Å; D275-Q278 WeakPolarHBondContact OD1-CG 3.48Å; D275-Q278 PolarHBondContact OD1-N 2.97Å; D275-Q278 PolarHBondContact OD2-NE2 2.85Å; Q278-K281 PolarHBondContact O-N 3.33Å; Q278-H282 WeakPolarHBondContact O-CB 3.46Å; Q278-H282 PolarHBondContact O-CD2 3.48Å; Q278-H282 PolarHBondContact O-N 2.9Å
279	L	86.9	Confident	79.4	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-64.1	-42.7	176.7	-67.7	175.8	0	0	0	111.6	P237 F271 F274 D275 E276 H282 S283 N343 F379	P237-L279 HydrophobicContact CB-CD2 4.49Å; P237-L279 HydrophobicContact CG-CD2 4.21Å; F271-L279 HydrophobicContact CE2-CD2 3.92Å; F271-L279 HydrophobicContact CZ-CD1 4.3Å; F271-L279 HydrophobicContact CZ-CD2 4.3Å; F274-L279 HydrophobicContact CB-CD1 4.34Å; F274-L279 HydrophobicContact CB-CD2 3.98Å; F274-L279 HydrophobicContact CB-CG 3.96Å; F274-L279 HydrophobicContact CD2-CD2 4.3Å; D275-L279 WeakPolarHBondContact O-CG 3.1Å; D275-L279 PolarHBondContact O-N 2.67Å; D275-L279 VanDerWaalsContact O-N 3.15Å; E276-L279 PolarHBondContact O-N 3.34Å; L279-H282 PolarHBondContact O-N 3.48Å; L279-S283 WeakPolarHBondContact O-CB 3.48Å; L279-S283 PolarHBondContact O-N 2.66Å; L279-S283 PolarHBondContact O-OG 3.14Å; L279-N343 HydrophobicContact CD1-CB 3.81Å; L279-F379 HydrophobicContact CB-CE1 4.35Å; L279-F379 HydrophobicContact CB-CE2 3.92Å; L279-F379 HydrophobicContact CB-CZ 3.68Å; L279-F379 HydrophobicContact CD1-CZ 4.08Å
280	A	82.1	Confident	78.3	Confident	18 Å²	18	70 Å²	70	15%	0.149	34%	0.337	C	S	.	.	H	α-helix	trans	-62	-44.2	175.4	0	0	0	0	0	112.1	E276 Y277 S283 F379	E276-A280 WeakPolarHBondContact O-CB 3.45Å; E276-A280 PolarHBondContact O-N 2.96Å; Y277-A280 PolarHBondContact O-N 3.47Å; A280-S283 PolarHBondContact O-OG 3.38Å; A280-S283 VanDerWaalsContact O-OG 3.07Å; A280-F379 HydrophobicContact CB-CB 3.74Å; A280-F379 HydrophobicContact CB-CD2 3.93Å; A280-F379 HydrophobicContact CB-CG 3.97Å
281	K	78.4	Confident	77.2	Confident	113 Å²	113	75.4 Å²	75.4	49%	0.491	36%	0.356	S	S	.	.	H	α-helix	trans	-63.9	-42.6	178.9	-174.6	174.3	-173.7	168.9	0	112.2	Y277 Q278	Y277-K281 HydrophobicContact CE1-CD 4.1Å; Y277-K281 VanDerWaalsContact O-CB 3.3Å; Y277-K281 WeakPolarHBondContact O-CB 3.45Å; Y277-K281 PolarHBondContact O-N 3.42Å; Q278-K281 PolarHBondContact O-N 3.33Å
282	H	79	Confident	76	Confident	49 Å²	49	75.9 Å²	75.9	23%	0.227	36%	0.36	C	S	.	.	H	α-helix	trans	-92.4	-9.7	-173.8	-68.4	-64	0	0	0	114.9	P237 S238 Q278 L279 K284 I328	P237-H282 HydrophobicContact CB-CB 3.96Å; P237-H282 HydrophobicContact CG-CB 4.43Å; S238-H282 PolarHBondContact OG-CE1 2.86Å; S238-H282 VanDerWaalsContact OG-CE1 3.31Å; S238-H282 PolarHBondContact OG-ND1 3.45Å; Q278-H282 WeakPolarHBondContact O-CB 3.46Å; Q278-H282 PolarHBondContact O-CD2 3.48Å; Q278-H282 PolarHBondContact O-N 2.9Å; L279-H282 PolarHBondContact O-N 3.48Å; H282-K284 VanDerWaalsContact C-N 3.33Å; H282-I328 HydrophobicContact CB-CD1 4.04Å
283	S	75.8	Confident	74.9	Confident	30 Å²	30	75.6 Å²	75.6	21%	0.21	36%	0.362	C	S	.	.			trans	-79.7	-9.4	174.9	57.5	0	0	0	0	114.2	L279 A280 H285	L279-S283 WeakPolarHBondContact O-CB 3.48Å; L279-S283 PolarHBondContact O-N 2.66Å; L279-S283 PolarHBondContact O-OG 3.14Å; A280-S283 PolarHBondContact O-OG 3.38Å; A280-S283 VanDerWaalsContact O-OG 3.07Å; S283-H285 PolarHBondContact O-CD2 3.46Å; S283-H285 PolarHBondContact O-N 2.95Å; S283-H285 VanDerWaalsContact O-N 3.1Å
284	K	66.8	Low	73.8	Confident	175 Å²	175	78 Å²	78	76%	0.761	37%	0.371	S	S	*	.			trans	-58.3	116.4	-177.2	-69.9	-173	179.4	-178.9	0	111.7	H282	H282-K284 VanDerWaalsContact C-N 3.33Å
285	H	56.7	Low	72.4	Confident	89 Å²	89	78.9 Å²	78.9	41%	0.412	38%	0.378	S	S	.	.			trans	-90.3	-38	-145.3	-124.9	-83.4	0	0	0	115.6	S283 A287 A289	S283-H285 PolarHBondContact O-CD2 3.46Å; S283-H285 PolarHBondContact O-N 2.95Å; S283-H285 VanDerWaalsContact O-N 3.1Å; H285-A287 PolarHBondContact O-N 3.48Å; H285-A289 WeakPolarHBondContact O-CA 3.39Å; H285-A289 WeakPolarHBondContact O-CB 3.34Å; H285-A289 PolarHBondContact O-N 3.22Å
286	R	60	Low	71.5	Confident	218 Å²	218	80 Å²	80	82%	0.823	38%	0.379	S	S	*	.	H	α-helix	trans	-64.4	-50.5	-158.1	-75.6	-173.7	-174.9	172.9	2	114.7	N290	R286-N290 WeakPolarHBondContact O-CB 3.31Å; R286-N290 PolarHBondContact O-N 2.88Å; R286-N290 PolarHBondContact O-ND2 3.09Å; R286-N290 PolarHBondContact O-OD1 3.26Å
287	A	62.9	Low	70.1	Confident	66 Å²	66	79.7 Å²	79.7	55%	0.545	39%	0.39	S	S	.	.	H	α-helix	trans	-66.7	-44.8	-175.1	0	0	0	0	0	112.8	H285 R291	H285-A287 PolarHBondContact O-N 3.48Å; A287-R291 WeakPolarHBondContact O-CG 3.28Å; A287-R291 PolarHBondContact O-N 2.96Å; A287-R291 VanDerWaalsContact O-N 3.13Å
288	R	69.6	Low	69.1	Low	67 Å²	67	80.5 Å²	80.5	25%	0.253	40%	0.4	S	S	.	.	H	α-helix	trans	-73.1	-36.5	177.5	-79.5	-170.7	179.5	-157.3	1.4	112.5	R291 S292	R288-R291 PolarHBondContact O-N 3.41Å; R288-S292 WeakPolarHBondContact O-CB 3.22Å; R288-S292 PolarHBondContact O-N 3.01Å
289	A	62.3	Low	67.7	Low	27 Å²	27	82.4 Å²	82.4	22%	0.223	41%	0.408	C	S	.	.	H	α-helix	trans	-60.7	-47.5	173.6	0	0	0	0	0	110.6	H285 R291 S292 T293	H285-A289 WeakPolarHBondContact O-CA 3.39Å; H285-A289 WeakPolarHBondContact O-CB 3.34Å; H285-A289 PolarHBondContact O-N 3.22Å; A289-R291 VanDerWaalsContact C-N 3.34Å; A289-R291 PolarHBondContact O-N 3.16Å; A289-S292 CarbonylContact O-C 3.59Å; A289-S292 WeakPolarHBondContact O-CA 3.34Å; A289-S292 WeakPolarHBondContact O-CB 3.42Å; A289-S292 PolarHBondContact O-N 3.47Å; A289-T293 PolarHBondContact O-N 2.89Å; A289-T293 PolarHBondContact O-OG1 3.24Å
290	N	69.5	Low	66.1	Low	101 Å²	101	92 Å²	92	54%	0.54	45%	0.449	S	S	.	.	H	α-helix	trans	-58.2	-44.4	177.1	-71.2	-2.5	0	0	0	111.9	R286 T293 K294	R286-N290 WeakPolarHBondContact O-CB 3.31Å; R286-N290 PolarHBondContact O-N 2.88Å; R286-N290 PolarHBondContact O-ND2 3.09Å; R286-N290 PolarHBondContact O-OD1 3.26Å; N290-T293 VanDerWaalsContact CA-OG1 3.29Å; N290-T293 WeakPolarHBondContact CA-OG1 3.5Å; N290-T293 PolarHBondContact O-N 3.41Å; N290-T293 PolarHBondContact O-OG1 3.09Å; N290-K294 WeakPolarHBondContact O-CG 3.47Å; N290-K294 PolarHBondContact O-N 3.2Å
291	R	70.2	Confident	64.7	Low	132 Å²	132	96.1 Å²	96.1	50%	0.498	48%	0.477	S	S	.	.	H	α-helix	trans	-64.2	-38.7	174.3	-71.1	177.9	-172.9	-178.9	2.3	112.4	A287 R288 A289 K294 S295 Y325	A287-R291 WeakPolarHBondContact O-CG 3.28Å; A287-R291 PolarHBondContact O-N 2.96Å; A287-R291 VanDerWaalsContact O-N 3.13Å; R288-R291 PolarHBondContact O-N 3.41Å; A289-R291 VanDerWaalsContact C-N 3.34Å; A289-R291 PolarHBondContact O-N 3.16Å; R291-K294 PolarHBondContact O-N 3.49Å; R291-S295 PolarHBondContact O-N 3.37Å; R291-Y325 HydrophobicContact CB-CD1 4.41Å; R291-Y325 HydrophobicContact CB-CD2 3.76Å; R291-Y325 HydrophobicContact CB-CE2 4.12Å; R291-Y325 HydrophobicContact CB-CG 3.9Å
292	S	66.7	Low	63.3	Low	11 Å²	11	99.8 Å²	99.8	8%	0.077	49%	0.488	C	S	.	.	H	α-helix	trans	-64.3	-44.6	175.5	-168	0	0	0	0	111.3	R288 A289 K294 S295 K296 Y325	R288-S292 WeakPolarHBondContact O-CB 3.22Å; R288-S292 PolarHBondContact O-N 3.01Å; A289-S292 CarbonylContact O-C 3.59Å; A289-S292 WeakPolarHBondContact O-CA 3.34Å; A289-S292 WeakPolarHBondContact O-CB 3.42Å; A289-S292 PolarHBondContact O-N 3.47Å; S292-K294 PolarHBondContact O-N 3.35Å; S292-S295 WeakPolarHBondContact CA-OG 3.33Å; S292-S295 PolarHBondContact O-N 2.87Å; S292-S295 PolarHBondContact O-OG 2.9Å; S292-K296 WeakPolarHBondContact O-CG 3.33Å; S292-K296 PolarHBondContact O-N 3.14Å; S292-Y325 WeakPolarHBondContact CB-O 3.39Å; S292-Y325 PolarHBondContact OG-O 3.27Å
293	T	67.5	Low	61.5	Low	85 Å²	85	105.1 Å²	105.1	52%	0.521	52%	0.518	S	S	.	.	H	α-helix	trans	-60.7	-43.4	172.3	20.7	0	0	0	0	112.4	A289 N290 S295 K296 A297	A289-T293 PolarHBondContact O-N 2.89Å; A289-T293 PolarHBondContact O-OG1 3.24Å; N290-T293 VanDerWaalsContact CA-OG1 3.29Å; N290-T293 WeakPolarHBondContact CA-OG1 3.5Å; N290-T293 PolarHBondContact O-N 3.41Å; N290-T293 PolarHBondContact O-OG1 3.09Å; T293-S295 VanDerWaalsContact C-N 3.34Å; T293-S295 PolarHBondContact O-N 2.96Å; T293-K296 WeakPolarHBondContact O-CB 3.47Å; T293-K296 PolarHBondContact O-N 3.39Å; T293-K296 VanDerWaalsContact O-N 3.13Å; T293-A297 PolarHBondContact O-N 2.92Å
294	K	66.1	Low	59.9	Low	155 Å²	155	109.5 Å²	109.5	67%	0.674	55%	0.549	S	S	*	.	H	α-helix	trans	-59.5	-43.8	173.8	-74.7	-173.3	178.2	-169.3	0	111.6	N290 R291 S292 K296 A297 L298	N290-K294 WeakPolarHBondContact O-CG 3.47Å; N290-K294 PolarHBondContact O-N 3.2Å; R291-K294 PolarHBondContact O-N 3.49Å; S292-K294 PolarHBondContact O-N 3.35Å; K294-K296 VanDerWaalsContact C-N 3.29Å; K294-K296 PolarHBondContact O-N 3.42Å; K294-A297 WeakPolarHBondContact O-CB 3.46Å; K294-A297 PolarHBondContact O-N 3.37Å; K294-A297 VanDerWaalsContact O-N 3.1Å; K294-L298 WeakPolarHBondContact O-CD1 3.48Å; K294-L298 PolarHBondContact O-N 3.44Å
295	S	62.4	Low	58.9	Low	25 Å²	25	103.9 Å²	103.9	18%	0.175	54%	0.54	C	S	.	.	H	α-helix	trans	-63.8	-32.4	175.8	74.2	0	0	0	0	113	R291 S292 T293	R291-S295 PolarHBondContact O-N 3.37Å; S292-S295 WeakPolarHBondContact CA-OG 3.33Å; S292-S295 PolarHBondContact O-N 2.87Å; S292-S295 PolarHBondContact O-OG 2.9Å; T293-S295 VanDerWaalsContact C-N 3.34Å; T293-S295 PolarHBondContact O-N 2.96Å
296	K	66.7	Low	58.5	Low	97 Å²	97	107.1 Å²	107.1	42%	0.422	57%	0.566	S	S	.	*	H	α-helix	trans	-71.6	-29.3	172.8	-72.2	179.2	-177.9	-177	0	112.7	S292 T293 K294 K299	S292-K296 WeakPolarHBondContact O-CG 3.33Å; S292-K296 PolarHBondContact O-N 3.14Å; T293-K296 WeakPolarHBondContact O-CB 3.47Å; T293-K296 PolarHBondContact O-N 3.39Å; T293-K296 VanDerWaalsContact O-N 3.13Å; K294-K296 VanDerWaalsContact C-N 3.29Å; K294-K296 PolarHBondContact O-N 3.42Å; K296-K299 WeakPolarHBondContact O-CB 3.46Å; K296-K299 PolarHBondContact O-N 3.08Å
297	A	56.4	Low	58.1	Low	70 Å²	70	100.1 Å²	100.1	58%	0.579	55%	0.547	S	S	*	.	H	α-helix	trans	-70.5	-44.2	176.6	0	0	0	0	0	111.9	T293 K294 K299 K300	T293-A297 PolarHBondContact O-N 2.92Å; K294-A297 WeakPolarHBondContact O-CB 3.46Å; K294-A297 PolarHBondContact O-N 3.37Å; K294-A297 VanDerWaalsContact O-N 3.1Å; A297-K299 PolarHBondContact O-N 3.17Å; A297-K299 VanDerWaalsContact O-N 3.07Å; A297-K300 PolarHBondContact O-N 3.5Å
298	L	60.7	Low	57.6	Low	113 Å²	113	99.7 Å²	99.7	59%	0.592	54%	0.54	S	S	*	.	H	α-helix	trans	-58.7	-21	172.2	-87.1	107.7	0	0	0	113.1	K294 P322	K294-L298 WeakPolarHBondContact O-CD1 3.48Å; K294-L298 PolarHBondContact O-N 3.44Å; L298-P322 HydrophobicContact CD2-CB 4.47Å; L298-P322 HydrophobicContact CD2-CG 4.41Å
299	K	55.5	Low	57	Low	89 Å²	89	102.5 Å²	102.5	39%	0.387	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-68.9	-29.5	-176.2	-152.4	-176.1	-179	-168.6	0	114.2	L254 K296 A297 S301 R302	L254-K299 HydrophobicContact CD1-CG 4.45Å; L254-K299 HydrophobicContact CD2-CD 4.49Å; K296-K299 WeakPolarHBondContact O-CB 3.46Å; K296-K299 PolarHBondContact O-N 3.08Å; A297-K299 PolarHBondContact O-N 3.17Å; A297-K299 VanDerWaalsContact O-N 3.07Å; K299-S301 PolarHBondContact O-N 2.84Å; K299-S301 VanDerWaalsContact O-N 3.09Å; K299-R302 PolarHBondContact O-N 3.36Å
300	K	53.9	Low	56.9	Low	201 Å²	201	106.5 Å²	106.5	87%	0.874	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-64.3	-13.6	-177.4	-80.5	-170.5	176.2	-174.7	0	113.2	A297	A297-K300 PolarHBondContact O-N 3.5Å
301	S	51	Low	56.5	Low	105 Å²	105	104.2 Å²	104.2	73%	0.734	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-94.1	-14.3	-174.9	168.8	0	0	0	0	115.3	K299	K299-S301 PolarHBondContact O-N 2.84Å; K299-S301 VanDerWaalsContact O-N 3.09Å
302	R	49	Very low	56.2	Low	190 Å²	190	103.8 Å²	103.8	72%	0.717	58%	0.578	S	S	*	*			trans	-121.8	94.5	-173.4	-75.9	-176.3	168.1	172.3	-4	111.8	K299	K299-R302 PolarHBondContact O-N 3.36Å
303	N	42.6	Very low	56.2	Low	162 Å²	162	104.4 Å²	104.4	87%	0.866	58%	0.584	S	S	*	*			trans	-78.4	156.6	171.4	-95.5	-8.6	0	0	0	112.3	G305	N303-G305 PolarHBondContact O-N 2.65Å
304	S	42.3	Very low	56.4	Low	121 Å²	121	101.9 Å²	101.9	85%	0.846	57%	0.567	S	S	*	*			trans	-61.5	105.1	-165.7	51.2	0	0	0	0	115.1
305	G	45.1	Very low	56.5	Low	57 Å²	57	95 Å²	95	59%	0.588	54%	0.537	S	S	*	.			trans	-96.1	149.9	160	0	0	0	0	0	111.2	N303 V307	N303-G305 PolarHBondContact O-N 2.65Å; G305-V307 WeakPolarHBondContact O-CG2 3.32Å; G305-V307 PolarHBondContact O-N 3.31Å
306	V	48.1	Very low	56.8	Low	157 Å²	157	101 Å²	101	95%	0.952	56%	0.557	S	S	*	*			trans	-56.6	117.8	171.2	177.6	0	0	0	0	108.3	S308	V306-S308 PolarHBondContact O-N 3.28Å
307	V	52.4	Low	57.1	Low	71 Å²	71	98.2 Å²	98.2	43%	0.43	54%	0.544	S	S	.	.			trans	-82.6	107.4	-170.3	179.6	0	0	0	0	108.8	G305	G305-V307 WeakPolarHBondContact O-CG2 3.32Å; G305-V307 PolarHBondContact O-N 3.31Å
308	S	51.8	Low	57.8	Low	57 Å²	57	95.2 Å²	95.2	40%	0.399	52%	0.518	S	S	.	.			trans	-61	141.7	172.4	76	0	0	0	0	110	V306 D310 A313 R317	V306-S308 PolarHBondContact O-N 3.28Å; S308-D310 VanDerWaalsContact C-N 3.3Å; S308-A313 WeakPolarHBondContact OG-CB 3.24Å; S308-R317 PolarHBondContact O-NH2 3.33Å
309	T	56	Low	58.2	Low	127 Å²	127	90.2 Å²	90.2	78%	0.779	49%	0.493	S	S	*	.			trans	-92.4	7.2	175.1	45.8	0	0	0	0	112.5
310	D	61	Low	58.9	Low	110 Å²	110	90.6 Å²	90.6	59%	0.588	50%	0.496	S	S	*	.			trans	-59.6	143.1	177.5	-84.6	-36	0	0	0	111.9	S308 D312 A313 I314	S308-D310 VanDerWaalsContact C-N 3.3Å; D310-D312 PolarHBondContact O-N 2.96Å; D310-A313 HydrophobicContact CB-CB 4.46Å; D310-A313 WeakPolarHBondContact O-CA 3.41Å; D310-A313 VanDerWaalsContact O-CB 3.28Å; D310-A313 WeakPolarHBondContact O-CB 3.41Å; D310-A313 PolarHBondContact O-N 3.17Å; D310-I314 PolarHBondContact O-N 3.13Å
311	I	60.9	Low	59.5	Low	54 Å²	54	82.8 Å²	82.8	28%	0.277	47%	0.466	S	S	.	.	H	α-helix	trans	-66.1	-41.4	-170.7	-61.2	128.5	0	0	0	110.9	H182 A313 I314 L315	H182-I311 HydrophobicContact CB-CG2 3.85Å; H182-I311 WeakPolarHBondContact CD2-CD1 3.1Å; H182-I311 WeakPolarHBondContact CD2-CG1 3.39Å; H182-I311 WeakPolarHBondContact CE1-CD1 3.39Å; H182-I311 WeakPolarHBondContact NE2-CD1 3.35Å; H182-I311 WeakPolarHBondContact NE2-CG1 3.44Å; I311-A313 PolarHBondContact O-N 3.23Å; I311-I314 CarbonylContact O-C 3.46Å; I311-I314 WeakPolarHBondContact O-CA 3.38Å; I311-I314 WeakPolarHBondContact O-CB 3.42Å; I311-I314 PolarHBondContact O-N 3.23Å; I311-L315 HydrophobicContact CG2-CD1 3.9Å; I311-L315 HydrophobicContact CG2-CG 4.18Å; I311-L315 WeakPolarHBondContact O-CB 3.27Å; I311-L315 VanDerWaalsContact O-CG 3.31Å; I311-L315 WeakPolarHBondContact O-CG 3.34Å; I311-L315 PolarHBondContact O-N 3.3Å
312	D	63.7	Low	60.2	Low	123 Å²	123	81 Å²	81	66%	0.658	45%	0.452	S	S	*	.	H	α-helix	trans	-59.6	-35	174.5	-66	-31.2	0	0	0	110.9	D310 Y316	D310-D312 PolarHBondContact O-N 2.96Å; D312-Y316 WeakPolarHBondContact O-CB 3.46Å; D312-Y316 PolarHBondContact O-N 2.82Å
313	A	68	Low	61.3	Low	24 Å²	24	77.6 Å²	77.6	20%	0.198	44%	0.44	C	S	.	.	H	α-helix	trans	-71.8	-34.6	175.1	0	0	0	0	0	112.6	S308 D310 I311 R317	S308-A313 WeakPolarHBondContact OG-CB 3.24Å; D310-A313 HydrophobicContact CB-CB 4.46Å; D310-A313 WeakPolarHBondContact O-CA 3.41Å; D310-A313 VanDerWaalsContact O-CB 3.28Å; D310-A313 WeakPolarHBondContact O-CB 3.41Å; D310-A313 PolarHBondContact O-N 3.17Å; I311-A313 PolarHBondContact O-N 3.23Å; A313-R317 WeakPolarHBondContact O-CB 3.48Å; A313-R317 WeakPolarHBondContact O-CG 3.39Å; A313-R317 PolarHBondContact O-N 3.38Å; A313-R317 PolarHBondContact O-NE 2.9Å
314	I	69.8	Low	63	Low	32 Å²	32	70.8 Å²	70.8	16%	0.164	40%	0.403	C	S	.	.	H	α-helix	trans	-67.6	-48.2	173.7	-69.7	171.9	0	0	0	110.6	I250 D310 I311 R317 L318	I250-I314 HydrophobicContact CG1-CG2 4.5Å; I250-I314 HydrophobicContact CG2-CB 4.49Å; I250-I314 HydrophobicContact CG2-CD1 4.36Å; I250-I314 HydrophobicContact CG2-CG1 4.11Å; I250-I314 HydrophobicContact CG2-CG2 3.76Å; D310-I314 PolarHBondContact O-N 3.13Å; I311-I314 CarbonylContact O-C 3.46Å; I311-I314 WeakPolarHBondContact O-CA 3.38Å; I311-I314 WeakPolarHBondContact O-CB 3.42Å; I311-I314 PolarHBondContact O-N 3.23Å; I314-R317 PolarHBondContact O-N 2.91Å; I314-L318 HydrophobicContact CG2-CD1 3.85Å; I314-L318 WeakPolarHBondContact O-CG 3.37Å; I314-L318 PolarHBondContact O-N 2.95Å
315	L	68.8	Low	64.9	Low	9 Å²	9	67.4 Å²	67.4	5%	0.047	37%	0.372	C	S	.	.	H	α-helix	trans	-60.4	-48.8	177.5	-75	177.6	0	0	0	111.3	Q179 I311 R317 L318 A319	Q179-L315 HydrophobicContact CG-CD1 3.54Å; I311-L315 HydrophobicContact CG2-CD1 3.9Å; I311-L315 HydrophobicContact CG2-CG 4.18Å; I311-L315 WeakPolarHBondContact O-CB 3.27Å; I311-L315 VanDerWaalsContact O-CG 3.31Å; I311-L315 WeakPolarHBondContact O-CG 3.34Å; I311-L315 PolarHBondContact O-N 3.3Å; L315-R317 VanDerWaalsContact C-N 3.29Å; L315-R317 PolarHBondContact O-N 3.47Å; L315-L318 PolarHBondContact O-N 3.43Å; L315-A319 WeakPolarHBondContact O-CB 3.15Å; L315-A319 PolarHBondContact O-N 3.42Å
316	Y	70	Confident	66.8	Low	153 Å²	153	64.9 Å²	64.9	60%	0.6	35%	0.345	S	S	*	.	H	α-helix	trans	-56.9	-45.3	175.2	-175.8	-92.5	0	0	0	110.7	D312 A319 H320	D312-Y316 WeakPolarHBondContact O-CB 3.46Å; D312-Y316 PolarHBondContact O-N 2.82Å; Y316-A319 PolarHBondContact O-N 3.36Å; Y316-H320 AromaticContact CD2-CE1 3.82Å; Y316-H320 AromaticContact CD2-ND1 3.48Å; Y316-H320 WeakPolarHBondContact CD2-ND1 3.42Å; Y316-H320 HydrophobicContact CE1-CB 4.22Å; Y316-H320 AromaticContact CE2-CE1 3.95Å; Y316-H320 AromaticContact CE2-CG 3.96Å; Y316-H320 AromaticContact CE2-ND1 3.68Å; Y316-H320 AromaticContact CG-ND1 3.86Å; Y316-H320 VanDerWaalsContact O-CB 3.28Å; Y316-H320 WeakPolarHBondContact O-CB 3.27Å; Y316-H320 PolarHBondContact O-N 3.2Å; Y316-H320 PolarHBondContact O-ND1 3.22Å
317	R	71.9	Confident	68.7	Low	37 Å²	37	58.5 Å²	58.5	14%	0.14	31%	0.306	C	S	.	.	H	α-helix	trans	-63.5	-42.6	176.6	-85.9	175.4	-90.9	179.7	-20.5	112.9	I250 S308 A313 I314 L315 A319 S321	I250-R317 PolarHBondContact O-NH1 3Å; S308-R317 PolarHBondContact O-NH2 3.33Å; A313-R317 WeakPolarHBondContact O-CB 3.48Å; A313-R317 WeakPolarHBondContact O-CG 3.39Å; A313-R317 PolarHBondContact O-N 3.38Å; A313-R317 PolarHBondContact O-NE 2.9Å; I314-R317 PolarHBondContact O-N 2.91Å; L315-R317 VanDerWaalsContact C-N 3.29Å; L315-R317 PolarHBondContact O-N 3.47Å; R317-A319 VanDerWaalsContact C-N 3.31Å; R317-A319 PolarHBondContact O-N 3.2Å; R317-S321 WeakPolarHBondContact CA-OG 3.34Å; R317-S321 WeakPolarHBondContact O-CA 3.48Å; R317-S321 WeakPolarHBondContact O-CB 3.37Å; R317-S321 PolarHBondContact O-N 3.04Å; R317-S321 PolarHBondContact O-OG 2.99Å
318	L	71.9	Confident	70.4	Confident	8 Å²	8	55.4 Å²	55.4	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-35.3	179.4	-81.6	164.3	0	0	0	112.9	M211 V215 Y246 I250 I314 L315	M211-L318 HydrophobicContact CE-CD1 3.99Å; M211-L318 HydrophobicContact CE-CD2 4.42Å; V215-L318 HydrophobicContact CG2-CD1 4.26Å; Y246-L318 HydrophobicContact CD1-CD2 4.01Å; Y246-L318 HydrophobicContact CE1-CD2 4.41Å; I250-L318 HydrophobicContact CD1-CD1 4.5Å; I250-L318 HydrophobicContact CD1-CD2 4.09Å; I250-L318 HydrophobicContact CG1-CD1 4.14Å; I250-L318 HydrophobicContact CG1-CD2 3.67Å; I250-L318 HydrophobicContact CG1-CG 3.88Å; I314-L318 HydrophobicContact CG2-CD1 3.85Å; I314-L318 WeakPolarHBondContact O-CG 3.37Å; I314-L318 PolarHBondContact O-N 2.95Å; L315-L318 PolarHBondContact O-N 3.43Å
319	A	69.4	Low	72.2	Confident	7 Å²	7	54.7 Å²	54.7	6%	0.058	28%	0.277	C	S	.	.	H	α-helix	trans	-84.2	-37.6	-179.8	0	0	0	0	0	113.3	I175 L315 Y316 R317	I175-A319 HydrophobicContact CD1-CB 3.99Å; I175-A319 HydrophobicContact CG1-CB 3.79Å; L315-A319 WeakPolarHBondContact O-CB 3.15Å; L315-A319 PolarHBondContact O-N 3.42Å; Y316-A319 PolarHBondContact O-N 3.36Å; R317-A319 VanDerWaalsContact C-N 3.31Å; R317-A319 PolarHBondContact O-N 3.2Å
320	H	68.9	Low	73.6	Confident	98 Å²	98	50.3 Å²	50.3	45%	0.454	25%	0.247	S	C	.	.	H	α-helix	trans	-110.9	-17.8	-168	-57.2	88.2	0	0	0	114.9	Y316	Y316-H320 AromaticContact CD2-CE1 3.82Å; Y316-H320 AromaticContact CD2-ND1 3.48Å; Y316-H320 WeakPolarHBondContact CD2-ND1 3.42Å; Y316-H320 HydrophobicContact CE1-CB 4.22Å; Y316-H320 AromaticContact CE2-CE1 3.95Å; Y316-H320 AromaticContact CE2-CG 3.96Å; Y316-H320 AromaticContact CE2-ND1 3.68Å; Y316-H320 AromaticContact CG-ND1 3.86Å; Y316-H320 VanDerWaalsContact O-CB 3.28Å; Y316-H320 WeakPolarHBondContact O-CB 3.27Å; Y316-H320 PolarHBondContact O-N 3.2Å; Y316-H320 PolarHBondContact O-ND1 3.22Å
321	S	66.6	Low	75	Confident	36 Å²	36	45 Å²	45	25%	0.252	22%	0.219	S	C	.	.	S	Bend	trans	-73.6	140.1	-178.9	-59	0	0	0	0	111.5	R317 R323	R317-S321 WeakPolarHBondContact CA-OG 3.34Å; R317-S321 WeakPolarHBondContact O-CA 3.48Å; R317-S321 WeakPolarHBondContact O-CB 3.37Å; R317-S321 PolarHBondContact O-N 3.04Å; R317-S321 PolarHBondContact O-OG 2.99Å; S321-R323 PolarHBondContact O-N 3.23Å
322	P	66.9	Low	76.4	Confident	69 Å²	69	42.7 Å²	42.7	45%	0.448	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-59.9	137.7	171.8	24.9	-32.4	0	0	0	110.1	L298 I324	L298-P322 HydrophobicContact CD2-CB 4.47Å; L298-P322 HydrophobicContact CD2-CG 4.41Å; P322-I324 PolarHBondContact O-N 3Å
323	R	70.9	Confident	77.6	Confident	118 Å²	118	43.6 Å²	43.6	45%	0.445	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-62.1	123.6	-178.3	-165.9	168.6	-177.7	166.2	7.1	110.1	E242 S321 Y325	E242-R323 IonicContact OE1-NH2 2.69Å; E242-R323 PolarHBondContact OE1-NH2 3.36Å; S321-R323 PolarHBondContact O-N 3.23Å; R323-Y325 HydrophobicContact CB-CE2 4.03Å; R323-Y325 HydrophobicContact CG-CE1 4.28Å; R323-Y325 HydrophobicContact CG-CE2 4.25Å; R323-Y325 VanDerWaalsContact O-CD2 3.3Å; R323-Y325 WeakPolarHBondContact O-CD2 2.99Å; R323-Y325 WeakPolarHBondContact O-CE2 3.4Å
324	I	77.9	Confident	78.5	Confident	18 Å²	18	44.9 Å²	44.9	9%	0.092	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-81.5	139	176.5	-60.3	171.4	0	0	0	108.1	E245 A248 L254 P322 F326	E245-I324 WeakPolarHBondContact CB-O 3.32Å; E245-I324 VanDerWaalsContact CD-O 3.31Å; E245-I324 VanDerWaalsContact CG-O 3.23Å; E245-I324 WeakPolarHBondContact CG-O 3.42Å; A248-I324 HydrophobicContact CB-CD1 3.81Å; A248-I324 HydrophobicContact CB-CG2 4.47Å; L254-I324 HydrophobicContact CD2-CD1 3.79Å; L254-I324 HydrophobicContact CD2-CG1 4.05Å; L254-I324 HydrophobicContact CD2-CG2 4.17Å; L254-I324 HydrophobicContact CG-CD1 3.94Å; P322-I324 PolarHBondContact O-N 3Å; I324-F326 HydrophobicContact CG2-CD1 4.45Å; I324-F326 HydrophobicContact CG2-CE1 3.77Å; I324-F326 HydrophobicContact CG2-CE2 3.94Å; I324-F326 HydrophobicContact CG2-CZ 3.51Å
325	Y	82.9	Confident	79.4	Confident	50 Å²	50	43.5 Å²	43.5	20%	0.196	19%	0.194	C	C	.	.			trans	-121.8	125.6	179.1	-67.1	-80.1	0	0	0	111.6	E245 R291 S292 R323	E245-Y325 WeakPolarHBondContact OE1-CA 3.48Å; R291-Y325 HydrophobicContact CB-CD1 4.41Å; R291-Y325 HydrophobicContact CB-CD2 3.76Å; R291-Y325 HydrophobicContact CB-CE2 4.12Å; R291-Y325 HydrophobicContact CB-CG 3.9Å; S292-Y325 WeakPolarHBondContact CB-O 3.39Å; S292-Y325 PolarHBondContact OG-O 3.27Å; R323-Y325 HydrophobicContact CB-CE2 4.03Å; R323-Y325 HydrophobicContact CG-CE1 4.28Å; R323-Y325 HydrophobicContact CG-CE2 4.25Å; R323-Y325 VanDerWaalsContact O-CD2 3.3Å; R323-Y325 WeakPolarHBondContact O-CD2 2.99Å; R323-Y325 WeakPolarHBondContact O-CE2 3.4Å
326	F	85.5	Confident	80.4	Confident	5 Å²	5	50.7 Å²	50.7	2%	0.022	23%	0.227	C	C	.	.			trans	-108.9	149.8	173.5	-62.9	-51	0	0	0	112.2	I241 A244 E245 A248 L256 I324 E330 L331 R334	I241-F326 HydrophobicContact CG2-CB 4.21Å; A244-F326 HydrophobicContact CB-CD2 4.13Å; A244-F326 HydrophobicContact CB-CE2 4.45Å; E245-F326 HydrophobicContact CG-CB 4.47Å; E245-F326 HydrophobicContact CG-CD2 3.79Å; E245-F326 HydrophobicContact CG-CE2 4.48Å; E245-F326 HydrophobicContact CG-CG 4.43Å; E245-F326 PolarHBondContact OE1-N 2.95Å; A248-F326 HydrophobicContact CB-CE2 3.67Å; A248-F326 HydrophobicContact CB-CZ 3.71Å; L256-F326 HydrophobicContact CD1-CE2 4.35Å; L256-F326 HydrophobicContact CD2-CE2 4.48Å; I324-F326 HydrophobicContact CG2-CD1 4.45Å; I324-F326 HydrophobicContact CG2-CE1 3.77Å; I324-F326 HydrophobicContact CG2-CE2 3.94Å; I324-F326 HydrophobicContact CG2-CZ 3.51Å; F326-E330 HydrophobicContact CD1-CG 4.33Å; F326-L331 HydrophobicContact CB-CD1 4.15Å; F326-L331 HydrophobicContact CB-CD2 4.08Å; F326-L331 HydrophobicContact CB-CG 3.93Å; F326-L331 HydrophobicContact CD2-CD2 3.96Å; F326-L331 HydrophobicContact CG-CD2 4.01Å; F326-L331 HydrophobicContact CG-CG 4.41Å; F326-R334 VanDerWaalsContact CZ-NH1 3.32Å
327	T	86.8	Confident	81.4	Confident	22 Å²	22	43.9 Å²	43.9	14%	0.135	20%	0.201	C	C	.	.			trans	-99.7	153.8	166.6	64.1	0	0	0	0	108.7	K329 E330 L331	T327-K329 PolarHBondContact O-N 3.26Å; T327-E330 WeakPolarHBondContact O-CB 3.47Å; T327-E330 PolarHBondContact O-N 3.11Å; T327-E330 WeakPolarHBondContact OG1-CB 3.45Å; T327-E330 PolarHBondContact OG1-N 3.5Å; T327-L331 PolarHBondContact O-N 2.87Å; T327-L331 VanDerWaalsContact O-N 3.07Å
328	I	88.5	Confident	82.2	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-55.9	-42.7	176.4	-58.2	176.8	0	0	0	110.1	P237 W240 I241 F271 H282 E330 L331 I332 V347	P237-I328 HydrophobicContact CB-CD1 4.32Å; W240-I328 HydrophobicContact CZ3-CG2 4.32Å; I241-I328 HydrophobicContact CD1-CD1 4.18Å; I241-I328 HydrophobicContact CD1-CG1 3.49Å; I241-I328 VanDerWaalsContact CD1-CG1 3.49Å; I241-I328 HydrophobicContact CG1-CG1 4.12Å; F271-I328 HydrophobicContact CE2-CG2 4.13Å; H282-I328 HydrophobicContact CB-CD1 4.04Å; I328-E330 VanDerWaalsContact C-N 3.3Å; I328-E330 PolarHBondContact O-N 2.94Å; I328-L331 PolarHBondContact O-N 3.31Å; I328-L331 VanDerWaalsContact O-N 3.12Å; I328-I332 HydrophobicContact CG2-CD1 3.93Å; I328-I332 HydrophobicContact CG2-CG1 4.25Å; I328-I332 WeakPolarHBondContact O-CG1 3.36Å; I328-I332 PolarHBondContact O-N 2.93Å; I328-V347 HydrophobicContact CB-CG1 4.06Å; I328-V347 HydrophobicContact CG2-CG1 3.78Å
329	K	89.1	Confident	82.9	Confident	42 Å²	42	52.1 Å²	52.1	18%	0.183	25%	0.247	C	C	.	.	H	α-helix	trans	-55.9	-41.1	175.5	172.8	157.9	-175.6	171.8	0	113.2	T327 R333 V347 L348	T327-K329 PolarHBondContact O-N 3.26Å; K329-R333 VanDerWaalsContact CE-CZ 3.43Å; K329-R333 WeakPolarHBondContact O-CG 3.35Å; K329-R333 PolarHBondContact O-N 3.33Å; K329-V347 HydrophobicContact CB-CG1 4.39Å; K329-L348 HydrophobicContact CB-CD2 4.39Å; K329-L348 HydrophobicContact CD-CD2 4.22Å; K329-L348 HydrophobicContact CG-CD2 3.72Å; K329-L348 PolarHBondContact NZ-O 3.24Å
330	E	86.7	Confident	83.9	Confident	35 Å²	35	53.5 Å²	53.5	16%	0.164	26%	0.256	C	S	.	.	H	α-helix	trans	-67.6	-42.4	176.7	-172.7	67.9	-173	0	0	111.4	F326 T327 I328 R333 R334	F326-E330 HydrophobicContact CD1-CG 4.33Å; T327-E330 WeakPolarHBondContact O-CB 3.47Å; T327-E330 PolarHBondContact O-N 3.11Å; T327-E330 WeakPolarHBondContact OG1-CB 3.45Å; T327-E330 PolarHBondContact OG1-N 3.5Å; I328-E330 VanDerWaalsContact C-N 3.3Å; I328-E330 PolarHBondContact O-N 2.94Å; E330-R333 PolarHBondContact O-N 3.48Å; E330-R334 VanDerWaalsContact O-CG 3.28Å; E330-R334 WeakPolarHBondContact O-CG 3.41Å; E330-R334 PolarHBondContact O-N 3.49Å; E330-R334 IonicContact OE1-CZ 3.7Å; E330-R334 IonicContact OE1-NE 3.39Å; E330-R334 PolarHBondContact OE1-NE 3.13Å; E330-R334 IonicContact OE1-NH2 3.51Å; E330-R334 PolarHBondContact OE1-NH2 2.95Å
331	L	89.6	Confident	84.8	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-68.5	-40.7	179.1	-68.5	176.3	0	0	0	112.5	W240 I241 A244 L256 F326 T327 I328 R333 R334 L335	W240-L331 HydrophobicContact CE3-CD1 3.75Å; W240-L331 HydrophobicContact CH2-CB 3.41Å; W240-L331 VanDerWaalsContact CH2-CB 3.41Å; W240-L331 HydrophobicContact CH2-CD1 4.01Å; W240-L331 HydrophobicContact CH2-CG 4.34Å; W240-L331 HydrophobicContact CZ2-CB 4.44Å; W240-L331 HydrophobicContact CZ3-CB 3.52Å; W240-L331 HydrophobicContact CZ3-CD1 3.4Å; W240-L331 VanDerWaalsContact CZ3-CD1 3.4Å; W240-L331 HydrophobicContact CZ3-CG 4.1Å; I241-L331 HydrophobicContact CB-CD1 4.18Å; I241-L331 HydrophobicContact CG1-CD1 3.9Å; I241-L331 HydrophobicContact CG2-CD1 4.26Å; A244-L331 HydrophobicContact CB-CD1 4.12Å; A244-L331 HydrophobicContact CB-CD2 3.78Å; L256-L331 HydrophobicContact CD1-CD2 3.82Å; F326-L331 HydrophobicContact CB-CD1 4.15Å; F326-L331 HydrophobicContact CB-CD2 4.08Å; F326-L331 HydrophobicContact CB-CG 3.93Å; F326-L331 HydrophobicContact CD2-CD2 3.96Å; F326-L331 HydrophobicContact CG-CD2 4.01Å; F326-L331 HydrophobicContact CG-CG 4.41Å; T327-L331 PolarHBondContact O-N 2.87Å; T327-L331 VanDerWaalsContact O-N 3.07Å; I328-L331 PolarHBondContact O-N 3.31Å; I328-L331 VanDerWaalsContact O-N 3.12Å; L331-R333 VanDerWaalsContact C-N 3.27Å; L331-R333 PolarHBondContact O-N 2.83Å; L331-R334 PolarHBondContact O-N 2.92Å; L331-L335 HydrophobicContact CB-CD1 4.36Å; L331-L335 VanDerWaalsContact O-CB 3.27Å; L331-L335 WeakPolarHBondContact O-CB 3.47Å; L331-L335 WeakPolarHBondContact O-CG 3.26Å; L331-L335 PolarHBondContact O-N 3.46Å
332	I	89.6	Confident	85.9	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-53.8	-46.8	173.5	-73.9	173.3	0	0	0	110.5	F271 I328 H336 I337 V344 V347 L348	F271-I332 HydrophobicContact CE2-CD1 3.98Å; F271-I332 HydrophobicContact CE2-CG1 4.01Å; F271-I332 HydrophobicContact CZ-CD1 3.76Å; F271-I332 HydrophobicContact CZ-CG1 4.09Å; I328-I332 HydrophobicContact CG2-CD1 3.93Å; I328-I332 HydrophobicContact CG2-CG1 4.25Å; I328-I332 WeakPolarHBondContact O-CG1 3.36Å; I328-I332 PolarHBondContact O-N 2.93Å; I332-H336 WeakPolarHBondContact O-CA 3.4Å; I332-H336 PolarHBondContact O-N 3.35Å; I332-I337 HydrophobicContact CG2-CB 4.35Å; I332-I337 PolarHBondContact O-N 2.93Å; I332-V344 HydrophobicContact CG2-CG1 3.93Å; I332-V347 HydrophobicContact CD1-CB 3.8Å; I332-V347 HydrophobicContact CD1-CG1 3.58Å; I332-V347 HydrophobicContact CD1-CG2 4.33Å; I332-L348 HydrophobicContact CG2-CD1 4.37Å; I332-L348 HydrophobicContact CG2-CD2 4.13Å; I332-L348 HydrophobicContact CG2-CG 4.36Å
333	R	89.7	Confident	87	Confident	143 Å²	143	51.3 Å²	51.3	54%	0.54	23%	0.234	S	C	.	.	H	α-helix	trans	-66	-40.6	179.8	-71.5	170.5	174.2	-175.9	-10.4	112.6	K329 E330 L331 L348	K329-R333 VanDerWaalsContact CE-CZ 3.43Å; K329-R333 WeakPolarHBondContact O-CG 3.35Å; K329-R333 PolarHBondContact O-N 3.33Å; E330-R333 PolarHBondContact O-N 3.48Å; L331-R333 VanDerWaalsContact C-N 3.27Å; L331-R333 PolarHBondContact O-N 2.83Å; R333-L348 HydrophobicContact CG-CD2 4.29Å
334	R	87.1	Confident	87.9	Confident	51 Å²	51	46.2 Å²	46.2	19%	0.192	22%	0.216	C	C	.	.	H	α-helix	trans	-78.8	-30.4	-177.1	-70.2	176.5	-176.4	-164.9	1.5	114.2	L254 F326 E330 L331 H336	L254-R334 PolarHBondContact O-NH1 3.28Å; F326-R334 VanDerWaalsContact CZ-NH1 3.32Å; E330-R334 VanDerWaalsContact O-CG 3.28Å; E330-R334 WeakPolarHBondContact O-CG 3.41Å; E330-R334 PolarHBondContact O-N 3.49Å; E330-R334 IonicContact OE1-CZ 3.7Å; E330-R334 IonicContact OE1-NE 3.39Å; E330-R334 PolarHBondContact OE1-NE 3.13Å; E330-R334 IonicContact OE1-NH2 3.51Å; E330-R334 PolarHBondContact OE1-NH2 2.95Å; L331-R334 PolarHBondContact O-N 2.92Å; R334-H336 VanDerWaalsContact C-N 3.34Å
335	L	89.4	Confident	88.4	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-90.2	-4.2	177	-64.4	171.6	0	0	0	112	W240 M259 R264 M267 I268 L331 I337	W240-L335 HydrophobicContact CH2-CD1 3.83Å; W240-L335 HydrophobicContact CZ2-CD1 3.36Å; M259-L335 HydrophobicContact CE-CD2 3.66Å; M259-L335 HydrophobicContact SD-CD2 4Å; R264-L335 HydrophobicContact CG-CD2 3.95Å; M267-L335 HydrophobicContact CB-CD1 4.18Å; M267-L335 HydrophobicContact CE-CD1 3.78Å; M267-L335 HydrophobicContact SD-CD1 4.29Å; I268-L335 WeakPolarHBondContact CD1-O 3.25Å; I268-L335 HydrophobicContact CG1-CB 4.34Å; L331-L335 HydrophobicContact CB-CD1 4.36Å; L331-L335 VanDerWaalsContact O-CB 3.27Å; L331-L335 WeakPolarHBondContact O-CB 3.47Å; L331-L335 WeakPolarHBondContact O-CG 3.26Å; L331-L335 PolarHBondContact O-N 3.46Å; L335-I337 VanDerWaalsContact C-N 3.33Å; L335-I337 HydrophobicContact CB-CD1 3.98Å; L335-I337 HydrophobicContact CB-CG1 3.88Å; L335-I337 HydrophobicContact CD1-CD1 4.1Å; L335-I337 PolarHBondContact O-N 3.31Å
336	H	89.6	Confident	88.6	Confident	160 Å²	160	45 Å²	45	74%	0.741	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	44.5	-178.1	-59.3	-81.9	0	0	0	113	I332 R334 S338	I332-H336 WeakPolarHBondContact O-CA 3.4Å; I332-H336 PolarHBondContact O-N 3.35Å; R334-H336 VanDerWaalsContact C-N 3.34Å; H336-S338 PolarHBondContact O-N 2.79Å
337	I	91.2	Very high	88.8	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.051	22%	0.216	C	C	.	.			trans	-78.3	122.3	179.5	-62	170	0	0	0	109.2	W240 I268 F271 I332 L335 K339 V344	W240-I337 HydrophobicContact CH2-CD1 3.93Å; W240-I337 HydrophobicContact CZ2-CD1 3.66Å; I268-I337 HydrophobicContact CG1-CG1 4.01Å; F271-I337 HydrophobicContact CB-CD1 4.02Å; F271-I337 HydrophobicContact CD1-CD1 4.46Å; F271-I337 HydrophobicContact CD1-CG2 3.51Å; F271-I337 HydrophobicContact CD2-CD1 4.15Å; F271-I337 HydrophobicContact CE1-CG2 3.78Å; F271-I337 HydrophobicContact CG-CD1 3.95Å; F271-I337 HydrophobicContact CG-CG2 4.09Å; I332-I337 HydrophobicContact CG2-CB 4.35Å; I332-I337 PolarHBondContact O-N 2.93Å; L335-I337 VanDerWaalsContact C-N 3.33Å; L335-I337 HydrophobicContact CB-CD1 3.98Å; L335-I337 HydrophobicContact CB-CG1 3.88Å; L335-I337 HydrophobicContact CD1-CD1 4.1Å; L335-I337 PolarHBondContact O-N 3.31Å; I337-K339 WeakPolarHBondContact CG2-O 3.15Å; I337-V344 HydrophobicContact CG2-CG2 3.95Å
338	S	87.3	Confident	88.8	Confident	79 Å²	79	45.7 Å²	45.7	55%	0.552	22%	0.217	S	C	*	.			trans	-115	-14.1	-179.3	58.2	0	0	0	0	114.3	H336 K341	H336-S338 PolarHBondContact O-N 2.79Å; S338-K341 WeakPolarHBondContact O-CG 3.19Å
339	K	87.7	Confident	88.7	Confident	138 Å²	138	46.2 Å²	46.2	60%	0.6	22%	0.223	S	C	*	.			trans	-126.3	150.2	-178.4	-63.5	-175.3	180	-174.8	0	111.1	L272 I337	L272-K339 HydrophobicContact CD2-CB 3.98Å; L272-K339 VanDerWaalsContact CD2-O 3.22Å; L272-K339 WeakPolarHBondContact CD2-O 3.3Å; I337-K339 WeakPolarHBondContact CG2-O 3.15Å
340	P	89.3	Confident	88.7	Confident	37 Å²	37	49.5 Å²	49.5	24%	0.24	24%	0.238	C	C	.	.	S	Bend	cis	-67.1	139.3	-12.5	-14.6	30.9	0	0	0	110.8	L272 F342 N343 V344	L272-P340 HydrophobicContact CD2-CG 4.41Å; P340-F342 PolarHBondContact O-N 3.06Å; P340-N343 HydrophobicContact CB-CB 4.4Å; P340-N343 PolarHBondContact O-N 2.81Å; P340-V344 WeakPolarHBondContact O-CG2 3.43Å; P340-V344 PolarHBondContact O-N 3.36Å
341	K	88.1	Confident	88.9	Confident	74 Å²	74	51.3 Å²	51.3	32%	0.322	25%	0.253	S	S	.	.	H	α-helix	trans	-64.3	-41.4	-168.6	-69.3	-165.7	-175.5	174.8	0	112.5	S338 V344 M345 M362 L364	S338-K341 WeakPolarHBondContact O-CG 3.19Å; K341-V344 PolarHBondContact O-N 3.1Å; K341-M345 WeakPolarHBondContact O-CB 3.32Å; K341-M345 WeakPolarHBondContact O-CG 3.34Å; K341-M345 PolarHBondContact O-N 2.84Å; K341-M362 WeakPolarHBondContact CD-O 3Å; K341-M362 WeakPolarHBondContact CE-O 3.48Å; K341-M362 VanDerWaalsContact NZ-C 3.31Å; K341-M362 PolarHBondContact NZ-O 3.47Å; K341-L364 HydrophobicContact CB-CD2 4.33Å
342	F	89.1	Confident	89	Confident	68 Å²	68	52.3 Å²	52.3	30%	0.298	26%	0.257	S	S	.	.	H	α-helix	trans	-56	-54.6	175.1	-179.5	-106.1	0	0	0	111.7	P340 V344 M345 C346 L364 M377 F379	P340-F342 PolarHBondContact O-N 3.06Å; F342-V344 PolarHBondContact O-N 3.38Å; F342-M345 PolarHBondContact O-N 2.85Å; F342-C346 PolarHBondContact O-N 2.85Å; F342-L364 HydrophobicContact CB-CD2 4.17Å; F342-M377 HydrophobicContact CD2-CE 3.53Å; F342-M377 HydrophobicContact CE2-CE 3.82Å; F342-F379 HydrophobicContact CE1-CD1 4.44Å
343	N	90	Very high	88.9	Confident	15 Å²	15	52.4 Å²	52.4	8%	0.08	26%	0.257	C	S	.	.	H	α-helix	trans	-58.6	-46.1	-179.9	-65.6	13.3	0	0	0	112	L279 P340 C346 V347 F379	L279-N343 HydrophobicContact CD1-CB 3.81Å; P340-N343 HydrophobicContact CB-CB 4.4Å; P340-N343 PolarHBondContact O-N 2.81Å; N343-C346 PolarHBondContact O-N 2.81Å; N343-V347 WeakPolarHBondContact O-CG2 3.37Å; N343-V347 PolarHBondContact O-N 2.87Å; N343-F379 HydrophobicContact CB-CE1 4.24Å; N343-F379 HydrophobicContact CB-CZ 4.32Å; N343-F379 WeakPolarHBondContact O-CZ 3.43Å
344	V	90	Very high	88.9	Confident	10 Å²	10	49.3 Å²	49.3	6%	0.061	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-46.3	178	169.9	0	0	0	0	110.8	F271 I332 I337 P340 K341 F342 V347 L348	F271-V344 HydrophobicContact CE1-CG2 3.83Å; F271-V344 HydrophobicContact CZ-CG2 4.32Å; I332-V344 HydrophobicContact CG2-CG1 3.93Å; I337-V344 HydrophobicContact CG2-CG2 3.95Å; P340-V344 WeakPolarHBondContact O-CG2 3.43Å; P340-V344 PolarHBondContact O-N 3.36Å; K341-V344 PolarHBondContact O-N 3.1Å; F342-V344 PolarHBondContact O-N 3.38Å; V344-V347 PolarHBondContact O-N 3.03Å; V344-L348 HydrophobicContact CG1-CD1 3.87Å; V344-L348 HydrophobicContact CG1-CG 4.33Å; V344-L348 WeakPolarHBondContact O-CB 3.5Å; V344-L348 VanDerWaalsContact O-CG 3.25Å; V344-L348 WeakPolarHBondContact O-CG 3.29Å; V344-L348 PolarHBondContact O-N 2.68Å
345	M	89.5	Confident	88.9	Confident	31 Å²	31	49.9 Å²	49.9	15%	0.153	26%	0.264	C	S	.	.	H	α-helix	trans	-67	-40.9	-179.2	-73	-179.8	170.8	0	0	112.8	K341 F342 L348 G349 K350 M362 L364 M377	K341-M345 WeakPolarHBondContact O-CB 3.32Å; K341-M345 WeakPolarHBondContact O-CG 3.34Å; K341-M345 PolarHBondContact O-N 2.84Å; F342-M345 PolarHBondContact O-N 2.85Å; M345-L348 PolarHBondContact O-N 2.89Å; M345-G349 WeakPolarHBondContact O-CA 3.46Å; M345-G349 PolarHBondContact O-N 3.36Å; M345-K350 HydrophobicContact CB-CB 4.27Å; M345-K350 HydrophobicContact CG-CB 4.42Å; M345-K350 PolarHBondContact O-N 3.49Å; M345-K350 VanDerWaalsContact O-N 3.1Å; M345-M362 HydrophobicContact CE-CB 4.14Å; M345-M362 HydrophobicContact CE-CE 3.17Å; M345-M362 HydrophobicContact CE-CG 4.19Å; M345-M362 HydrophobicContact CE-SD 4.48Å; M345-M362 HydrophobicContact SD-CE 3.46Å; M345-M362 WeakPolarHBondContact SD-CE 3.44Å; M345-L364 HydrophobicContact SD-CD1 4.39Å; M345-L364 HydrophobicContact SD-CD2 3.8Å; M345-L364 HydrophobicContact SD-CG 4.31Å; M345-M377 HydrophobicContact CB-CE 4.16Å; M345-M377 HydrophobicContact CB-SD 3.77Å; M345-M377 HydrophobicContact SD-SD 4.18Å
346	C	88	Confident	88.7	Confident	12 Å²	12	52.6 Å²	52.6	8%	0.081	28%	0.284	C	S	.	.	H	α-helix	trans	-61.4	-43.2	174	-76.2	0	0	0	0	111.6	F342 N343 G349 F379	F342-C346 PolarHBondContact O-N 2.85Å; N343-C346 PolarHBondContact O-N 2.81Å; C346-G349 PolarHBondContact O-N 3.27Å; C346-F379 HydrophobicContact CB-CD1 4Å; C346-F379 HydrophobicContact CB-CD2 3.93Å; C346-F379 HydrophobicContact CB-CE1 3.82Å; C346-F379 HydrophobicContact CB-CE2 3.74Å; C346-F379 HydrophobicContact CB-CG 4.06Å; C346-F379 HydrophobicContact CB-CZ 3.69Å
347	V	88.2	Confident	88.7	Confident	11 Å²	11	49 Å²	49	7%	0.067	27%	0.273	C	S	.	.	H	α-helix	trans	-67.2	-41.1	176.1	176.1	0	0	0	0	112	I328 K329 I332 N343 V344 G349 F379	I328-V347 HydrophobicContact CB-CG1 4.06Å; I328-V347 HydrophobicContact CG2-CG1 3.78Å; K329-V347 HydrophobicContact CB-CG1 4.39Å; I332-V347 HydrophobicContact CD1-CB 3.8Å; I332-V347 HydrophobicContact CD1-CG1 3.58Å; I332-V347 HydrophobicContact CD1-CG2 4.33Å; N343-V347 WeakPolarHBondContact O-CG2 3.37Å; N343-V347 PolarHBondContact O-N 2.87Å; V344-V347 PolarHBondContact O-N 3.03Å; V347-G349 PolarHBondContact O-N 2.86Å; V347-F379 HydrophobicContact CG2-CE2 3.6Å; V347-F379 HydrophobicContact CG2-CZ 3.75Å
348	L	88.1	Confident	88.5	Confident	30 Å²	30	50.3 Å²	50.3	16%	0.157	28%	0.28	C	S	.	.	H	α-helix	trans	-69.8	-22.3	177.1	-67.9	-178.1	0	0	0	112	K329 I332 R333 V344 M345 K350	K329-L348 HydrophobicContact CB-CD2 4.39Å; K329-L348 HydrophobicContact CD-CD2 4.22Å; K329-L348 HydrophobicContact CG-CD2 3.72Å; K329-L348 PolarHBondContact NZ-O 3.24Å; I332-L348 HydrophobicContact CG2-CD1 4.37Å; I332-L348 HydrophobicContact CG2-CD2 4.13Å; I332-L348 HydrophobicContact CG2-CG 4.36Å; R333-L348 HydrophobicContact CG-CD2 4.29Å; V344-L348 HydrophobicContact CG1-CD1 3.87Å; V344-L348 HydrophobicContact CG1-CG 4.33Å; V344-L348 WeakPolarHBondContact O-CB 3.5Å; V344-L348 VanDerWaalsContact O-CG 3.25Å; V344-L348 WeakPolarHBondContact O-CG 3.29Å; V344-L348 PolarHBondContact O-N 2.68Å; M345-L348 PolarHBondContact O-N 2.89Å; L348-K350 HydrophobicContact CB-CG 4.14Å
349	G	86.4	Confident	88.5	Confident	17 Å²	17	47.1 Å²	47.1	18%	0.175	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	47.4	-176.1	0	0	0	0	0	111.7	M345 C346 V347 R376	M345-G349 WeakPolarHBondContact O-CA 3.46Å; M345-G349 PolarHBondContact O-N 3.36Å; C346-G349 PolarHBondContact O-N 3.27Å; V347-G349 PolarHBondContact O-N 2.86Å; G349-R376 PolarHBondContact O-NE 2.98Å
350	K	88.7	Confident	88.3	Confident	111 Å²	111	46.7 Å²	46.7	48%	0.483	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-74.4	153.2	174.5	-72.4	-73.1	-172.8	168.4	0	110.7	M345 L348 M377	M345-K350 HydrophobicContact CB-CB 4.27Å; M345-K350 HydrophobicContact CG-CB 4.42Å; M345-K350 PolarHBondContact O-N 3.49Å; M345-K350 VanDerWaalsContact O-N 3.1Å; L348-K350 HydrophobicContact CB-CG 4.14Å; K350-M377 WeakPolarHBondContact O-CB 3.22Å; K350-M377 WeakPolarHBondContact O-CG 3.47Å; K350-M377 PolarHBondContact O-N 3.47Å
351	P	90.5	Very high	88.1	Confident	73 Å²	73	52.8 Å²	52.8	47%	0.474	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-67.4	148	171.1	30.1	-33.7	0	0	0	110.1	T375	P351-T375 CarbonylContact C-O 3.58Å; P351-T375 WeakPolarHBondContact CA-O 3.28Å
352	Y	91	Very high	87.9	Confident	22 Å²	22	51.2 Å²	51.2	9%	0.086	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-70.4	142.5	170.6	-171.1	-95.8	0	0	0	108.9	S354 F359 W368 D369 K372 G374 T375 M377	Y352-S354 PolarHBondContact O-N 3.06Å; Y352-F359 HydrophobicContact CE1-CD2 4.49Å; Y352-F359 HydrophobicContact CE2-CD2 4.29Å; Y352-F359 HydrophobicContact CE2-CE2 4.07Å; Y352-F359 AromaticContact CZ-CD2 3.88Å; Y352-F359 AromaticContact CZ-CE2 3.86Å; Y352-F359 VanDerWaalsContact OH-CE2 3.29Å; Y352-F359 WeakPolarHBondContact OH-CE2 2.91Å; Y352-W368 AromaticContact CE1-CD1 3.66Å; Y352-W368 AromaticContact CE1-NE1 3.84Å; Y352-D369 WeakPolarHBondContact CE1-O 3.29Å; Y352-D369 PolarHBondContact OH-N 3.12Å; Y352-K372 WeakPolarHBondContact CB-O 3.4Å; Y352-K372 HydrophobicContact CD1-CB 3.55Å; Y352-K372 HydrophobicContact CD2-CB 4.43Å; Y352-K372 HydrophobicContact CE1-CB 3.79Å; Y352-K372 HydrophobicContact CG-CB 3.89Å; Y352-G374 PolarHBondContact O-N 3.23Å; Y352-G374 VanDerWaalsContact O-N 3.08Å; Y352-T375 WeakPolarHBondContact CB-O 3.29Å; Y352-T375 PolarHBondContact N-O 2.93Å; Y352-M377 HydrophobicContact CD2-CE 4.18Å; Y352-M377 HydrophobicContact CD2-CG 4.06Å; Y352-M377 HydrophobicContact CD2-SD 4.24Å; Y352-M377 HydrophobicContact CG-CG 4.46Å
353	P	89.1	Confident	87.5	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.032	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-52.3	136.1	-176.3	-24.3	31.2	0	0	0	112.9	D355 D358 F359 M362 L364 W368	P353-D355 PolarHBondContact O-N 3.47Å; P353-D358 HydrophobicContact CB-CB 3.97Å; P353-F359 HydrophobicContact CB-CB 3.86Å; P353-F359 HydrophobicContact CG-CB 3.92Å; P353-F359 HydrophobicContact CG-CD2 3.95Å; P353-F359 HydrophobicContact CG-CG 4.38Å; P353-M362 HydrophobicContact CB-SD 4.28Å; P353-M362 HydrophobicContact CG-CE 4.29Å; P353-M362 HydrophobicContact CG-SD 3.73Å; P353-L364 HydrophobicContact CG-CD1 3.69Å; P353-W368 PolarHBondContact O-NE1 2.87Å
354	S	87.9	Confident	87.2	Confident	78 Å²	78	49.6 Å²	49.6	55%	0.545	27%	0.274	S	S	.	.	S	Bend	trans	-73.4	-20.4	-177.8	-49.1	0	0	0	0	113	Y352 W368	Y352-S354 PolarHBondContact O-N 3.06Å; S354-W368 VanDerWaalsContact O-CZ2 3.23Å; S354-W368 WeakPolarHBondContact O-CZ2 3.44Å
355	D	88.4	Confident	86.8	Confident	63 Å²	63	57.6 Å²	57.6	34%	0.337	31%	0.311	S	S	.	.	S	Bend	trans	-151.8	155.9	-167.2	40.4	-26.8	0	0	0	110.5	P353 T357 D358 F359	P353-D355 PolarHBondContact O-N 3.47Å; D355-T357 VanDerWaalsContact C-N 3.34Å; D355-T357 PolarHBondContact O-N 3.21Å; D355-T357 PolarHBondContact OD2-OG1 3.29Å; D355-D358 WeakPolarHBondContact O-CB 3.32Å; D355-D358 PolarHBondContact O-N 3.03Å; D355-D358 WeakPolarHBondContact OD1-CB 3.47Å; D355-F359 PolarHBondContact O-N 3.41Å
356	S	85.7	Confident	86.5	Confident	61 Å²	61	59 Å²	59	43%	0.427	33%	0.333	S	S	.	.	H	α-helix	trans	-66.3	-34.5	-173.3	60.2	0	0	0	0	112.9	F359 I360	S356-F359 WeakPolarHBondContact O-CB 3.47Å; S356-F359 PolarHBondContact O-N 3.46Å; S356-I360 WeakPolarHBondContact O-CG1 3.41Å; S356-I360 PolarHBondContact O-N 2.8Å
357	T	88.1	Confident	86.3	Confident	84 Å²	84	65.9 Å²	65.9	52%	0.515	37%	0.369	S	S	.	.	H	α-helix	trans	-59.7	-47.2	173.5	46.3	0	0	0	0	111.2	D355 F359 I360 R361	D355-T357 VanDerWaalsContact C-N 3.34Å; D355-T357 PolarHBondContact O-N 3.21Å; D355-T357 PolarHBondContact OD2-OG1 3.29Å; T357-F359 VanDerWaalsContact C-N 3.32Å; T357-F359 PolarHBondContact O-N 2.87Å; T357-I360 PolarHBondContact O-N 3.33Å; T357-R361 VanDerWaalsContact O-CB 3.3Å; T357-R361 WeakPolarHBondContact O-CB 3.35Å; T357-R361 PolarHBondContact O-N 3.07Å
358	D	86.9	Confident	86.2	Confident	37 Å²	37	69.4 Å²	69.4	20%	0.198	38%	0.381	C	S	.	.	H	α-helix	trans	-64.1	-37.9	176.5	-86.1	21.9	0	0	0	111.5	P353 D355 R361 M362	P353-D358 HydrophobicContact CB-CB 3.97Å; D355-D358 WeakPolarHBondContact O-CB 3.32Å; D355-D358 PolarHBondContact O-N 3.03Å; D355-D358 WeakPolarHBondContact OD1-CB 3.47Å; D358-R361 PolarHBondContact O-N 3.38Å; D358-R361 IonicContact OD1-CZ 2.94Å; D358-R361 IonicContact OD1-NH1 2.67Å; D358-R361 PolarHBondContact OD1-NH1 3.43Å; D358-R361 IonicContact OD1-NH2 2.69Å; D358-R361 PolarHBondContact OD1-NH2 3.18Å; D358-R361 IonicContact OD2-CZ 3.36Å; D358-R361 IonicContact OD2-NH2 3.23Å; D358-R361 PolarHBondContact OD2-NH2 2.9Å; D358-M362 WeakPolarHBondContact O-CB 3.29Å; D358-M362 WeakPolarHBondContact O-CG 3.46Å; D358-M362 PolarHBondContact O-N 3.17Å
359	F	87.6	Confident	86.1	Confident	12 Å²	12	70.3 Å²	70.3	5%	0.053	39%	0.386	C	S	.	.	H	α-helix	trans	-62.1	-48.8	175.8	-178.9	-84.7	0	0	0	112.5	Y352 P353 D355 S356 T357 M362 G363 L364 G366 W368	Y352-F359 HydrophobicContact CE1-CD2 4.49Å; Y352-F359 HydrophobicContact CE2-CD2 4.29Å; Y352-F359 HydrophobicContact CE2-CE2 4.07Å; Y352-F359 AromaticContact CZ-CD2 3.88Å; Y352-F359 AromaticContact CZ-CE2 3.86Å; Y352-F359 VanDerWaalsContact OH-CE2 3.29Å; Y352-F359 WeakPolarHBondContact OH-CE2 2.91Å; P353-F359 HydrophobicContact CB-CB 3.86Å; P353-F359 HydrophobicContact CG-CB 3.92Å; P353-F359 HydrophobicContact CG-CD2 3.95Å; P353-F359 HydrophobicContact CG-CG 4.38Å; D355-F359 PolarHBondContact O-N 3.41Å; S356-F359 WeakPolarHBondContact O-CB 3.47Å; S356-F359 PolarHBondContact O-N 3.46Å; T357-F359 VanDerWaalsContact C-N 3.32Å; T357-F359 PolarHBondContact O-N 2.87Å; F359-M362 CarbonylContact O-C 3.55Å; F359-M362 PolarHBondContact O-N 3.25Å; F359-G363 PolarHBondContact O-N 3.36Å; F359-G363 VanDerWaalsContact O-N 3.08Å; F359-L364 HydrophobicContact CD2-CB 3.97Å; F359-L364 HydrophobicContact CD2-CD1 3.8Å; F359-L364 HydrophobicContact CE1-CB 4.08Å; F359-L364 WeakPolarHBondContact CE1-O 3.12Å; F359-L364 HydrophobicContact CE2-CB 3.47Å; F359-L364 VanDerWaalsContact CE2-CB 3.47Å; F359-L364 HydrophobicContact CE2-CD1 3.83Å; F359-L364 HydrophobicContact CE2-CG 4.3Å; F359-L364 HydrophobicContact CG-CB 4.46Å; F359-L364 HydrophobicContact CZ-CB 3.54Å; F359-L364 PolarHBondContact O-N 3.18Å; F359-G366 WeakPolarHBondContact CE1-O 3.4Å; F359-G366 VanDerWaalsContact CZ-O 3.3Å; F359-G366 WeakPolarHBondContact CZ-O 3.41Å; F359-W368 HydrophobicContact CB-CB 4.04Å; F359-W368 HydrophobicContact CB-CG 4.09Å; F359-W368 HydrophobicContact CD1-CB 4.15Å; F359-W368 HydrophobicContact CD2-CB 4.15Å; F359-W368 AromaticContact CD2-CD1 3.86Å; F359-W368 HydrophobicContact CD2-CG 4.43Å; F359-W368 HydrophobicContact CG-CB 3.85Å; F359-W368 AromaticContact CG-CD1 3.95Å; F359-W368 HydrophobicContact CG-CG 4.28Å
360	I	84.3	Confident	86.1	Confident	129 Å²	129	73.3 Å²	73.3	66%	0.662	41%	0.405	S	S	*	.	H	α-helix	trans	-64.4	-44.8	177	-64.7	167.3	0	0	0	110.3	S356 T357 M362 G363	S356-I360 WeakPolarHBondContact O-CG1 3.41Å; S356-I360 PolarHBondContact O-N 2.8Å; T357-I360 PolarHBondContact O-N 3.33Å; I360-M362 VanDerWaalsContact C-N 3.27Å; I360-M362 PolarHBondContact O-N 2.46Å; I360-G363 WeakPolarHBondContact O-CA 3.22Å; I360-G363 PolarHBondContact O-N 3.31Å
361	R	85.1	Confident	86	Confident	166 Å²	166	72.4 Å²	72.4	63%	0.626	41%	0.412	S	S	*	.	H	α-helix	trans	-60.2	-39.7	176.4	-173.1	177.1	70.4	-128.3	-1.9	111.6	T357 D358 G363	T357-R361 VanDerWaalsContact O-CB 3.3Å; T357-R361 WeakPolarHBondContact O-CB 3.35Å; T357-R361 PolarHBondContact O-N 3.07Å; D358-R361 PolarHBondContact O-N 3.38Å; D358-R361 IonicContact OD1-CZ 2.94Å; D358-R361 IonicContact OD1-NH1 2.67Å; D358-R361 PolarHBondContact OD1-NH1 3.43Å; D358-R361 IonicContact OD1-NH2 2.69Å; D358-R361 PolarHBondContact OD1-NH2 3.18Å; D358-R361 IonicContact OD2-CZ 3.36Å; D358-R361 IonicContact OD2-NH2 3.23Å; D358-R361 PolarHBondContact OD2-NH2 2.9Å; R361-G363 PolarHBondContact O-N 3.2Å
362	M	83.3	Confident	85.7	Confident	41 Å²	41	73.6 Å²	73.6	20%	0.202	41%	0.41	C	S	.	.	H	α-helix	trans	-70.6	-11.5	174.5	-74.6	172.9	73.4	0	0	112	K341 M345 P353 D358 F359 I360 L364	K341-M362 WeakPolarHBondContact CD-O 3Å; K341-M362 WeakPolarHBondContact CE-O 3.48Å; K341-M362 VanDerWaalsContact NZ-C 3.31Å; K341-M362 PolarHBondContact NZ-O 3.47Å; M345-M362 HydrophobicContact CE-CB 4.14Å; M345-M362 HydrophobicContact CE-CE 3.17Å; M345-M362 HydrophobicContact CE-CG 4.19Å; M345-M362 HydrophobicContact CE-SD 4.48Å; M345-M362 HydrophobicContact SD-CE 3.46Å; M345-M362 WeakPolarHBondContact SD-CE 3.44Å; P353-M362 HydrophobicContact CB-SD 4.28Å; P353-M362 HydrophobicContact CG-CE 4.29Å; P353-M362 HydrophobicContact CG-SD 3.73Å; D358-M362 WeakPolarHBondContact O-CB 3.29Å; D358-M362 WeakPolarHBondContact O-CG 3.46Å; D358-M362 PolarHBondContact O-N 3.17Å; F359-M362 CarbonylContact O-C 3.55Å; F359-M362 PolarHBondContact O-N 3.25Å; I360-M362 VanDerWaalsContact C-N 3.27Å; I360-M362 PolarHBondContact O-N 2.46Å; M362-L364 HydrophobicContact CB-CG 4.37Å; M362-L364 PolarHBondContact O-N 2.88Å
363	G	81.6	Confident	85.4	Confident	32 Å²	32	74.5 Å²	74.5	33%	0.33	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	38.1	176.5	0	0	0	0	0	112.9	F359 I360 R361	F359-G363 PolarHBondContact O-N 3.36Å; F359-G363 VanDerWaalsContact O-N 3.08Å; I360-G363 WeakPolarHBondContact O-CA 3.22Å; I360-G363 PolarHBondContact O-N 3.31Å; R361-G363 PolarHBondContact O-N 3.2Å
364	L	83.6	Confident	85.3	Confident	16 Å²	16	76.5 Å²	76.5	8%	0.084	44%	0.443	C	S	.	.			trans	-73.9	145	168.5	-69.3	171.9	0	0	0	108.5	K341 F342 M345 P353 F359 M362 M377	K341-L364 HydrophobicContact CB-CD2 4.33Å; F342-L364 HydrophobicContact CB-CD2 4.17Å; M345-L364 HydrophobicContact SD-CD1 4.39Å; M345-L364 HydrophobicContact SD-CD2 3.8Å; M345-L364 HydrophobicContact SD-CG 4.31Å; P353-L364 HydrophobicContact CG-CD1 3.69Å; F359-L364 HydrophobicContact CD2-CB 3.97Å; F359-L364 HydrophobicContact CD2-CD1 3.8Å; F359-L364 HydrophobicContact CE1-CB 4.08Å; F359-L364 WeakPolarHBondContact CE1-O 3.12Å; F359-L364 HydrophobicContact CE2-CB 3.47Å; F359-L364 VanDerWaalsContact CE2-CB 3.47Å; F359-L364 HydrophobicContact CE2-CD1 3.83Å; F359-L364 HydrophobicContact CE2-CG 4.3Å; F359-L364 HydrophobicContact CG-CB 4.46Å; F359-L364 HydrophobicContact CZ-CB 3.54Å; F359-L364 PolarHBondContact O-N 3.18Å; M362-L364 HydrophobicContact CB-CG 4.37Å; M362-L364 PolarHBondContact O-N 2.88Å; L364-M377 HydrophobicContact CD1-CE 4.11Å; L364-M377 HydrophobicContact CD1-SD 4.44Å; L364-M377 HydrophobicContact CD2-CE 4.03Å
365	E	80.4	Confident	85.3	Confident	179 Å²	179	76.1 Å²	76.1	84%	0.836	44%	0.438	S	S	*	.	S	Bend	trans	-87.2	142.7	177.7	-67	167.6	-164.2	0	0	109.3
366	G	83	Confident	85.3	Confident	61 Å²	61	80.7 Å²	80.7	63%	0.629	45%	0.45	S	S	*	.	S	Bend	trans	101.3	-173.1	-178.4	0	0	0	0	0	114.4	F359	F359-G366 WeakPolarHBondContact CE1-O 3.4Å; F359-G366 VanDerWaalsContact CZ-O 3.3Å; F359-G366 WeakPolarHBondContact CZ-O 3.41Å
367	D	83.6	Confident	85.4	Confident	156 Å²	156	78.3 Å²	78.3	83%	0.834	43%	0.432	S	S	*	.			trans	-87.7	146.4	177.6	-61.3	-42.5	0	0	0	111.6	D369	D367-D369 PolarHBondContact O-N 3.33Å
368	W	87.9	Confident	85.3	Confident	84 Å²	84	81.9 Å²	81.9	32%	0.318	44%	0.441	S	S	.	.			trans	-71.3	124.6	175.1	176.2	74.3	0	0	0	110.6	Y352 P353 S354 F359 A373	Y352-W368 AromaticContact CE1-CD1 3.66Å; Y352-W368 AromaticContact CE1-NE1 3.84Å; P353-W368 PolarHBondContact O-NE1 2.87Å; S354-W368 VanDerWaalsContact O-CZ2 3.23Å; S354-W368 WeakPolarHBondContact O-CZ2 3.44Å; F359-W368 HydrophobicContact CB-CB 4.04Å; F359-W368 HydrophobicContact CB-CG 4.09Å; F359-W368 HydrophobicContact CD1-CB 4.15Å; F359-W368 HydrophobicContact CD2-CB 4.15Å; F359-W368 AromaticContact CD2-CD1 3.86Å; F359-W368 HydrophobicContact CD2-CG 4.43Å; F359-W368 HydrophobicContact CG-CB 3.85Å; F359-W368 AromaticContact CG-CD1 3.95Å; F359-W368 HydrophobicContact CG-CG 4.28Å; W368-A373 HydrophobicContact CZ2-CB 4.18Å
369	D	85.6	Confident	85.3	Confident	50 Å²	50	81.3 Å²	81.3	27%	0.267	44%	0.436	S	S	.	.			trans	-102.9	108.7	179.5	-178.4	-6.6	0	0	0	110.4	Y352 D367 S371 K372	Y352-D369 WeakPolarHBondContact CE1-O 3.29Å; Y352-D369 PolarHBondContact OH-N 3.12Å; D367-D369 PolarHBondContact O-N 3.33Å; D369-S371 VanDerWaalsContact CG-OG 3.25Å; D369-S371 PolarHBondContact O-N 3.38Å; D369-S371 WeakPolarHBondContact OD1-CB 3.36Å; D369-S371 PolarHBondContact OD1-N 2.74Å; D369-S371 PolarHBondContact OD1-OG 2.76Å; D369-S371 PolarHBondContact OD2-OG 3.27Å; D369-K372 HydrophobicContact CB-CB 4.48Å; D369-K372 HydrophobicContact CB-CD 4.28Å; D369-K372 HydrophobicContact CB-CG 4.32Å; D369-K372 PolarHBondContact O-N 3.06Å; D369-K372 VanDerWaalsContact O-N 3.08Å; D369-K372 WeakPolarHBondContact OD2-CE 3.33Å; D369-K372 IonicContact OD2-NZ 2.69Å; D369-K372 PolarHBondContact OD2-NZ 3.42Å
370	S	86.8	Confident	84.8	Confident	80 Å²	80	84.4 Å²	84.4	56%	0.559	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-60.7	-28.8	-177.7	76	0	0	0	0	113.2	K372 A373	S370-K372 PolarHBondContact O-N 2.95Å; S370-A373 VanDerWaalsContact O-CB 3.25Å; S370-A373 WeakPolarHBondContact O-CB 3.42Å; S370-A373 PolarHBondContact O-N 3.06Å
371	S	86.6	Confident	84.2	Confident	91 Å²	91	83.9 Å²	83.9	64%	0.636	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-68	-22.7	179.6	73.7	0	0	0	0	112.8	D369	D369-S371 VanDerWaalsContact CG-OG 3.25Å; D369-S371 PolarHBondContact O-N 3.38Å; D369-S371 WeakPolarHBondContact OD1-CB 3.36Å; D369-S371 PolarHBondContact OD1-N 2.74Å; D369-S371 PolarHBondContact OD1-OG 2.76Å; D369-S371 PolarHBondContact OD2-OG 3.27Å
372	K	83.3	Confident	83.4	Confident	99 Å²	99	78 Å²	78	43%	0.43	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-92.2	-7.2	178.8	-65.9	-175.8	-178.3	108.5	0	112.8	Y352 D369 S370 G374 T375	Y352-K372 WeakPolarHBondContact CB-O 3.4Å; Y352-K372 HydrophobicContact CD1-CB 3.55Å; Y352-K372 HydrophobicContact CD2-CB 4.43Å; Y352-K372 HydrophobicContact CE1-CB 3.79Å; Y352-K372 HydrophobicContact CG-CB 3.89Å; D369-K372 HydrophobicContact CB-CB 4.48Å; D369-K372 HydrophobicContact CB-CD 4.28Å; D369-K372 HydrophobicContact CB-CG 4.32Å; D369-K372 PolarHBondContact O-N 3.06Å; D369-K372 VanDerWaalsContact O-N 3.08Å; D369-K372 WeakPolarHBondContact OD2-CE 3.33Å; D369-K372 IonicContact OD2-NZ 2.69Å; D369-K372 PolarHBondContact OD2-NZ 3.42Å; S370-K372 PolarHBondContact O-N 2.95Å; K372-G374 PolarHBondContact O-N 3.33Å; K372-T375 VanDerWaalsContact O-CB 3.31Å; K372-T375 WeakPolarHBondContact O-CB 3.31Å; K372-T375 WeakPolarHBondContact O-CG2 3.29Å; K372-T375 PolarHBondContact O-N 2.84Å; K372-T375 PolarHBondContact O-OG1 2.89Å
373	A	85.8	Confident	82.6	Confident	40 Å²	40	81.4 Å²	81.4	33%	0.331	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	127.1	-177	0	0	0	0	0	112.3	W368 S370 T375	W368-A373 HydrophobicContact CZ2-CB 4.18Å; S370-A373 VanDerWaalsContact O-CB 3.25Å; S370-A373 WeakPolarHBondContact O-CB 3.42Å; S370-A373 PolarHBondContact O-N 3.06Å; A373-T375 PolarHBondContact O-N 3.4Å
374	G	85.8	Confident	82.3	Confident	47 Å²	47	81.2 Å²	81.2	49%	0.485	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	-12.6	-178.6	0	0	0	0	0	115.7	Y352 K372	Y352-G374 PolarHBondContact O-N 3.23Å; Y352-G374 VanDerWaalsContact O-N 3.08Å; K372-G374 PolarHBondContact O-N 3.33Å
375	T	87.9	Confident	82.1	Confident	70 Å²	70	81.9 Å²	81.9	43%	0.429	46%	0.461	S	S	.	.	S	Bend	trans	-69.4	147.1	177.4	71.8	0	0	0	0	110.8	P351 Y352 K372 A373 M377	P351-T375 CarbonylContact C-O 3.58Å; P351-T375 WeakPolarHBondContact CA-O 3.28Å; Y352-T375 WeakPolarHBondContact CB-O 3.29Å; Y352-T375 PolarHBondContact N-O 2.93Å; K372-T375 VanDerWaalsContact O-CB 3.31Å; K372-T375 WeakPolarHBondContact O-CB 3.31Å; K372-T375 WeakPolarHBondContact O-CG2 3.29Å; K372-T375 PolarHBondContact O-N 2.84Å; K372-T375 PolarHBondContact O-OG1 2.89Å; A373-T375 PolarHBondContact O-N 3.4Å; T375-M377 PolarHBondContact O-N 2.82Å
376	R	88.7	Confident	82	Confident	160 Å²	160	78 Å²	78	60%	0.604	44%	0.443	S	S	*	.	B	Isolated β-bridge	trans	-72.2	120	-178.4	-168.4	174.1	-170.4	-174	-2.6	110.7	G349 K378	G349-R376 PolarHBondContact O-NE 2.98Å; R376-K378 PolarHBondContact O-N 3.29Å
377	M	88.8	Confident	81.8	Confident	10 Å²	10	77 Å²	77	5%	0.049	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-60.1	132.4	178.1	-63.3	-178.6	74.7	0	0	111.1	F342 M345 K350 Y352 L364 T375	F342-M377 HydrophobicContact CD2-CE 3.53Å; F342-M377 HydrophobicContact CE2-CE 3.82Å; M345-M377 HydrophobicContact CB-CE 4.16Å; M345-M377 HydrophobicContact CB-SD 3.77Å; M345-M377 HydrophobicContact SD-SD 4.18Å; K350-M377 WeakPolarHBondContact O-CB 3.22Å; K350-M377 WeakPolarHBondContact O-CG 3.47Å; K350-M377 PolarHBondContact O-N 3.47Å; Y352-M377 HydrophobicContact CD2-CE 4.18Å; Y352-M377 HydrophobicContact CD2-CG 4.06Å; Y352-M377 HydrophobicContact CD2-SD 4.24Å; Y352-M377 HydrophobicContact CG-CG 4.46Å; L364-M377 HydrophobicContact CD1-CE 4.11Å; L364-M377 HydrophobicContact CD1-SD 4.44Å; L364-M377 HydrophobicContact CD2-CE 4.03Å; T375-M377 PolarHBondContact O-N 2.82Å
378	K	85.5	Confident	81.7	Confident	160 Å²	160	71.9 Å²	71.9	70%	0.696	40%	0.395	S	S	*	.			trans	-138.7	152.9	176.7	-67.4	175.6	-173.7	169.9	0	108.2	R376	R376-K378 PolarHBondContact O-N 3.29Å
379	F	85.6	Confident	81.4	Confident	24 Å²	24	68.9 Å²	68.9	11%	0.105	39%	0.386	C	S	.	.			trans	-63.4	148.1	169	-68.9	-70.2	0	0	0	110.5	E276 L279 A280 F342 N343 C346 V347 V381	E276-F379 HydrophobicContact CB-CD1 3.86Å; E276-F379 HydrophobicContact CB-CE1 4.18Å; E276-F379 HydrophobicContact CG-CD1 4.13Å; E276-F379 HydrophobicContact CG-CE1 4.2Å; L279-F379 HydrophobicContact CB-CE1 4.35Å; L279-F379 HydrophobicContact CB-CE2 3.92Å; L279-F379 HydrophobicContact CB-CZ 3.68Å; L279-F379 HydrophobicContact CD1-CZ 4.08Å; A280-F379 HydrophobicContact CB-CB 3.74Å; A280-F379 HydrophobicContact CB-CD2 3.93Å; A280-F379 HydrophobicContact CB-CG 3.97Å; F342-F379 HydrophobicContact CE1-CD1 4.44Å; N343-F379 HydrophobicContact CB-CE1 4.24Å; N343-F379 HydrophobicContact CB-CZ 4.32Å; N343-F379 WeakPolarHBondContact O-CZ 3.43Å; C346-F379 HydrophobicContact CB-CD1 4Å; C346-F379 HydrophobicContact CB-CD2 3.93Å; C346-F379 HydrophobicContact CB-CE1 3.82Å; C346-F379 HydrophobicContact CB-CE2 3.74Å; C346-F379 HydrophobicContact CB-CG 4.06Å; C346-F379 HydrophobicContact CB-CZ 3.69Å; V347-F379 HydrophobicContact CG2-CE2 3.6Å; V347-F379 HydrophobicContact CG2-CZ 3.75Å; F379-V381 PolarHBondContact O-N 3.19Å
380	P	78	Confident	81.2	Confident	78 Å²	78	71.4 Å²	71.4	51%	0.506	41%	0.407	S	S	.	.			trans	-56.1	136.2	170.1	24.2	-32.2	0	0	0	109.4	E276 P382	E276-P380 WeakPolarHBondContact OE2-CD 3.37Å; E276-P380 VanDerWaalsContact OE2-CG 3.28Å; E276-P380 WeakPolarHBondContact OE2-CG 3.23Å; P380-P382 VanDerWaalsContact O-CD 3.23Å; P380-P382 WeakPolarHBondContact O-CD 3.27Å
381	V	70.8	Confident	80.8	Confident	117 Å²	117	73.2 Å²	73.2	71%	0.709	41%	0.414	S	S	*	.			trans	-69.9	115.6	175.9	179.5	0	0	0	0	106.8	F379 V383 T387	F379-V381 PolarHBondContact O-N 3.19Å; V381-V383 PolarHBondContact O-N 3.38Å; V381-T387 HydrophobicContact CG1-CG2 3.95Å
382	P	68.3	Low	80.6	Confident	44 Å²	44	72.2 Å²	72.2	29%	0.286	40%	0.402	S	S	.	.			trans	-68.8	134.6	-177.3	29.1	-35.4	0	0	0	109.7	Y277 P380 T384 T387	Y277-P382 HydrophobicContact CD2-CB 3.51Å; Y277-P382 HydrophobicContact CD2-CG 3.52Å; Y277-P382 HydrophobicContact CE2-CB 3.9Å; Y277-P382 HydrophobicContact CE2-CG 3.67Å; P380-P382 VanDerWaalsContact O-CD 3.23Å; P380-P382 WeakPolarHBondContact O-CD 3.27Å; P382-T384 VanDerWaalsContact C-N 3.33Å; P382-T384 HydrophobicContact CB-CG2 4.11Å; P382-T384 HydrophobicContact CG-CG2 4.15Å; P382-T384 PolarHBondContact O-N 2.9Å; P382-T387 PolarHBondContact O-OG1 3.36Å
383	V	67.9	Low	80.4	Confident	111 Å²	111	68.9 Å²	68.9	67%	0.673	40%	0.396	S	S	*	.			trans	-69.2	94.3	172.2	-176.3	0	0	0	0	108.2	V381 E388	V381-V383 PolarHBondContact O-N 3.38Å; V383-E388 HydrophobicContact CG1-CG 4.25Å
384	T	74.9	Confident	80.2	Confident	29 Å²	29	71.2 Å²	71.2	18%	0.178	40%	0.402	C	S	.	.			trans	-114.5	157	175.4	62.9	0	0	0	0	109.9	Y277 P382 E386 T387 E388	Y277-T384 HydrophobicContact CE2-CG2 3.88Å; P382-T384 VanDerWaalsContact C-N 3.33Å; P382-T384 HydrophobicContact CB-CG2 4.11Å; P382-T384 HydrophobicContact CG-CG2 4.15Å; P382-T384 PolarHBondContact O-N 2.9Å; T384-E386 PolarHBondContact O-N 2.64Å; T384-T387 PolarHBondContact N-OG1 2.67Å; T384-T387 PolarHBondContact O-N 2.97Å; T384-T387 VanDerWaalsContact O-N 3.12Å; T384-T387 PolarHBondContact O-OG1 2.86Å; T384-T387 WeakPolarHBondContact OG1-CG2 3.48Å; T384-T387 PolarHBondContact OG1-N 2.81Å; T384-T387 PolarHBondContact OG1-OG1 3.05Å; T384-E388 PolarHBondContact O-N 3.17Å
385	W	79.3	Confident	80.2	Confident	30 Å²	30	72 Å²	72	11%	0.114	40%	0.395	C	S	.	.	H	α-helix	trans	-57.9	-32.8	173.4	71	-86.3	0	0	0	112.2	L389 W399 L402 V408 A412 N416	W385-L389 HydrophobicContact CE3-CD1 3.46Å; W385-L389 VanDerWaalsContact CE3-CD1 3.46Å; W385-L389 HydrophobicContact CE3-CG 4.43Å; W385-L389 HydrophobicContact CZ3-CD1 3.62Å; W385-L389 WeakPolarHBondContact O-CB 3.42Å; W385-L389 VanDerWaalsContact O-CG 3.27Å; W385-L389 WeakPolarHBondContact O-CG 3.41Å; W385-L389 PolarHBondContact O-N 2.83Å; W385-W399 HydrophobicContact CE3-CH2 4.28Å; W385-W399 HydrophobicContact CZ3-CH2 4.31Å; W385-L402 HydrophobicContact CB-CD1 4.08Å; W385-L402 HydrophobicContact CB-CD2 4Å; W385-V408 HydrophobicContact CB-CG2 4.33Å; W385-A412 HydrophobicContact CD2-CB 3.98Å; W385-A412 HydrophobicContact CG-CB 4.44Å; W385-A412 HydrophobicContact CH2-CB 4.35Å; W385-A412 HydrophobicContact CZ2-CB 3.57Å; W385-N416 WeakPolarHBondContact CH2-ND2 3.18Å; W385-N416 VanDerWaalsContact CZ3-ND2 3.32Å; W385-N416 WeakPolarHBondContact CZ3-ND2 2.93Å
386	E	78.9	Confident	80	Confident	98 Å²	98	70 Å²	70	46%	0.458	39%	0.385	S	S	.	.	H	α-helix	trans	-65.7	-41.5	175.9	-65.3	-177.6	162.9	0	0	111.9	T384 S390 R415	T384-E386 PolarHBondContact O-N 2.64Å; E386-S390 WeakPolarHBondContact O-CB 3.49Å; E386-S390 PolarHBondContact O-N 3.15Å; E386-S390 PolarHBondContact O-OG 2.96Å; E386-R415 IonicContact OE1-NH2 3.91Å; E386-R415 PolarHBondContact OE1-NH2 2.95Å
387	T	78.9	Confident	79.9	Confident	40 Å²	40	68.3 Å²	68.3	25%	0.245	39%	0.388	C	S	.	.	H	α-helix	trans	-70.4	-42	177.8	47.5	0	0	0	0	111.4	V381 P382 T384 S390 V391	V381-T387 HydrophobicContact CG1-CG2 3.95Å; P382-T387 PolarHBondContact O-OG1 3.36Å; T384-T387 PolarHBondContact N-OG1 2.67Å; T384-T387 PolarHBondContact O-N 2.97Å; T384-T387 VanDerWaalsContact O-N 3.12Å; T384-T387 PolarHBondContact O-OG1 2.86Å; T384-T387 WeakPolarHBondContact OG1-CG2 3.48Å; T384-T387 PolarHBondContact OG1-N 2.81Å; T384-T387 PolarHBondContact OG1-OG1 3.05Å; T387-S390 PolarHBondContact O-N 3.5Å; T387-S390 VanDerWaalsContact O-N 3.17Å; T387-V391 WeakPolarHBondContact O-CG2 3.36Å; T387-V391 PolarHBondContact O-N 3.41Å
388	E	80.6	Confident	79.7	Confident	47 Å²	47	68.2 Å²	68.2	22%	0.22	39%	0.388	C	S	.	.	H	α-helix	trans	-60.7	-46.3	176	-75.5	-71.4	156.8	0	0	111.6	V383 T384 S390 V391 N392 L402	V383-E388 HydrophobicContact CG1-CG 4.25Å; T384-E388 PolarHBondContact O-N 3.17Å; E388-S390 VanDerWaalsContact C-N 3.28Å; E388-S390 PolarHBondContact O-N 3.46Å; E388-V391 PolarHBondContact O-N 3.44Å; E388-N392 WeakPolarHBondContact O-CB 3.41Å; E388-N392 PolarHBondContact O-N 2.94Å; E388-N392 PolarHBondContact O-ND2 3.39Å; E388-N392 PolarHBondContact OE2-ND2 3.44Å; E388-L402 HydrophobicContact CB-CD1 4.21Å; E388-L402 HydrophobicContact CB-CD2 3.9Å; E388-L402 HydrophobicContact CB-CG 4.39Å; E388-L402 HydrophobicContact CG-CD2 4.03Å
389	L	82.1	Confident	79.9	Confident	22 Å²	22	60.6 Å²	60.6	12%	0.115	35%	0.354	C	S	.	.	H	α-helix	trans	-67.7	-27.2	175.7	-69.6	177.5	0	0	0	113.3	W385 G393 W399 L402	W385-L389 HydrophobicContact CE3-CD1 3.46Å; W385-L389 VanDerWaalsContact CE3-CD1 3.46Å; W385-L389 HydrophobicContact CE3-CG 4.43Å; W385-L389 HydrophobicContact CZ3-CD1 3.62Å; W385-L389 WeakPolarHBondContact O-CB 3.42Å; W385-L389 VanDerWaalsContact O-CG 3.27Å; W385-L389 WeakPolarHBondContact O-CG 3.41Å; W385-L389 PolarHBondContact O-N 2.83Å; L389-G393 CarbonylContact O-C 3.55Å; L389-G393 VanDerWaalsContact O-C 3.29Å; L389-G393 WeakPolarHBondContact O-CA 3.4Å; L389-G393 PolarHBondContact O-N 3.2Å; L389-W399 HydrophobicContact CD1-CH2 3.54Å; L389-W399 HydrophobicContact CD1-CZ2 3.54Å; L389-W399 HydrophobicContact CD1-CZ3 4.23Å; L389-W399 HydrophobicContact CD2-CD2 4.34Å; L389-W399 HydrophobicContact CD2-CZ2 4.22Å; L389-L402 HydrophobicContact CD2-CD1 3.84Å; L389-L402 HydrophobicContact CG-CD1 3.8Å
390	S	80.3	Confident	80	Confident	102 Å²	102	60.6 Å²	60.6	71%	0.713	36%	0.357	S	S	*	.	H	α-helix	trans	-74.2	-34.6	176.2	-60.6	0	0	0	0	111.9	E386 T387 E388	E386-S390 WeakPolarHBondContact O-CB 3.49Å; E386-S390 PolarHBondContact O-N 3.15Å; E386-S390 PolarHBondContact O-OG 2.96Å; T387-S390 PolarHBondContact O-N 3.5Å; T387-S390 VanDerWaalsContact O-N 3.17Å; E388-S390 VanDerWaalsContact C-N 3.28Å; E388-S390 PolarHBondContact O-N 3.46Å
391	V	79.8	Confident	80.5	Confident	119 Å²	119	62.2 Å²	62.2	72%	0.721	36%	0.357	S	S	*	.	H	α-helix	trans	-81.4	-50.3	179.8	175.3	0	0	0	0	110.9	T387 E388	T387-V391 WeakPolarHBondContact O-CG2 3.36Å; T387-V391 PolarHBondContact O-N 3.41Å; E388-V391 PolarHBondContact O-N 3.44Å
392	N	81.4	Confident	81.3	Confident	70 Å²	70	56.9 Å²	56.9	37%	0.374	32%	0.324	S	S	.	.	H	α-helix	trans	-91.3	-12.7	-172.8	-56	-28.2	0	0	0	113	E388 N395 S398	E388-N392 WeakPolarHBondContact O-CB 3.41Å; E388-N392 PolarHBondContact O-N 2.94Å; E388-N392 PolarHBondContact O-ND2 3.39Å; E388-N392 PolarHBondContact OE2-ND2 3.44Å; N392-N395 PolarHBondContact O-ND2 2.81Å; N392-S398 WeakPolarHBondContact CB-OG 3.5Å
393	G	79.7	Confident	82.3	Confident	29 Å²	29	55 Å²	55	30%	0.299	31%	0.311	S	S	.	.			trans	87.1	167	-176	0	0	0	0	0	114	L389 N395 S398	L389-G393 CarbonylContact O-C 3.55Å; L389-G393 VanDerWaalsContact O-C 3.29Å; L389-G393 WeakPolarHBondContact O-CA 3.4Å; L389-G393 PolarHBondContact O-N 3.2Å; G393-N395 VanDerWaalsContact C-N 3.31Å; G393-N395 PolarHBondContact O-N 3.32Å; G393-N395 VanDerWaalsContact O-N 3.12Å; G393-S398 WeakPolarHBondContact O-CB 3.41Å; G393-S398 PolarHBondContact O-OG 3Å
394	N	81.7	Confident	83.2	Confident	88 Å²	88	54 Å²	54	47%	0.471	31%	0.306	S	S	.	.	S	Bend	trans	-87.1	67.3	178.4	-171.6	12.9	0	0	0	110.6	W399	N394-W399 PolarHBondContact OD1-NE1 3.37Å
395	N	84.7	Confident	83.7	Confident	63 Å²	63	57.4 Å²	57.4	34%	0.337	32%	0.323	S	S	.	.	S	Bend	trans	-118.4	172.2	-177.4	60.2	21.5	0	0	0	112.2	N392 G393 D397 S398 W399	N392-N395 PolarHBondContact O-ND2 2.81Å; G393-N395 VanDerWaalsContact C-N 3.31Å; G393-N395 PolarHBondContact O-N 3.32Å; G393-N395 VanDerWaalsContact O-N 3.12Å; N395-D397 PolarHBondContact O-N 3.45Å; N395-S398 PolarHBondContact O-N 2.96Å; N395-S398 WeakPolarHBondContact OD1-CB 3.31Å; N395-S398 PolarHBondContact OD1-N 3.46Å; N395-S398 PolarHBondContact OD1-OG 3.3Å; N395-W399 VanDerWaalsContact O-CD1 3.27Å; N395-W399 PolarHBondContact O-N 3.13Å
396	S	84	Confident	84	Confident	29 Å²	29	61.2 Å²	61.2	20%	0.203	35%	0.345	C	S	.	.	H	α-helix	trans	-57.5	-46.7	-178.2	-167.6	0	0	0	0	112.7	S398 W399 S400 S423 N424 V425	S396-S398 PolarHBondContact O-N 3.13Å; S396-W399 PolarHBondContact O-N 2.8Å; S396-S400 WeakPolarHBondContact O-CB 3.47Å; S396-S400 PolarHBondContact O-N 3.31Å; S396-S400 PolarHBondContact O-OG 3.47Å; S396-S423 VanDerWaalsContact CB-O 3.27Å; S396-S423 WeakPolarHBondContact CB-O 3.37Å; S396-N424 PolarHBondContact OG-O 2.86Å; S396-V425 VanDerWaalsContact OG-CA 3.32Å; S396-V425 WeakPolarHBondContact OG-CA 3.4Å
397	D	85.9	Confident	84.2	Confident	125 Å²	125	62.2 Å²	62.2	67%	0.668	35%	0.348	S	S	*	.	H	α-helix	trans	-63.5	-41.7	-176.3	-57.5	-36.3	0	0	0	112.1	N395 S400 K401	N395-D397 PolarHBondContact O-N 3.45Å; D397-S400 PolarHBondContact O-N 2.88Å; D397-K401 WeakPolarHBondContact O-CB 3.32Å; D397-K401 PolarHBondContact O-N 3.44Å
398	S	86.4	Confident	84.6	Confident	7 Å²	7	60.3 Å²	60.3	5%	0.049	34%	0.336	C	S	.	.	H	α-helix	trans	-64.7	-43.4	179	-60	0	0	0	0	111.7	N392 G393 N395 S396 L402	N392-S398 WeakPolarHBondContact CB-OG 3.5Å; G393-S398 WeakPolarHBondContact O-CB 3.41Å; G393-S398 PolarHBondContact O-OG 3Å; N395-S398 PolarHBondContact O-N 2.96Å; N395-S398 WeakPolarHBondContact OD1-CB 3.31Å; N395-S398 PolarHBondContact OD1-N 3.46Å; N395-S398 PolarHBondContact OD1-OG 3.3Å; S396-S398 PolarHBondContact O-N 3.13Å; S398-L402 VanDerWaalsContact O-CB 3.29Å; S398-L402 WeakPolarHBondContact O-CB 3.12Å; S398-L402 WeakPolarHBondContact O-CD1 3.46Å; S398-L402 WeakPolarHBondContact O-CG 3.44Å; S398-L402 PolarHBondContact O-N 2.99Å
399	W	89.1	Confident	84.8	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-65.3	-44.2	175.3	-77.7	116.9	0	0	0	112.1	W385 L389 N394 N395 S396 K401 L402 I403 V408 N416 N419 I420 V425	W385-W399 HydrophobicContact CE3-CH2 4.28Å; W385-W399 HydrophobicContact CZ3-CH2 4.31Å; L389-W399 HydrophobicContact CD1-CH2 3.54Å; L389-W399 HydrophobicContact CD1-CZ2 3.54Å; L389-W399 HydrophobicContact CD1-CZ3 4.23Å; L389-W399 HydrophobicContact CD2-CD2 4.34Å; L389-W399 HydrophobicContact CD2-CZ2 4.22Å; N394-W399 PolarHBondContact OD1-NE1 3.37Å; N395-W399 VanDerWaalsContact O-CD1 3.27Å; N395-W399 PolarHBondContact O-N 3.13Å; S396-W399 PolarHBondContact O-N 2.8Å; W399-K401 PolarHBondContact O-N 3.32Å; W399-L402 PolarHBondContact O-N 2.74Å; W399-I403 HydrophobicContact CB-CD1 4.3Å; W399-I403 HydrophobicContact CE3-CD1 4.39Å; W399-I403 WeakPolarHBondContact O-CB 3.49Å; W399-I403 WeakPolarHBondContact O-CD1 3.46Å; W399-I403 VanDerWaalsContact O-CG1 3.24Å; W399-I403 WeakPolarHBondContact O-CG1 3.35Å; W399-I403 PolarHBondContact O-N 3.13Å; W399-V408 HydrophobicContact CZ3-CG1 4.47Å; W399-V408 HydrophobicContact CZ3-CG2 4.2Å; W399-N416 HydrophobicContact CH2-CB 3.46Å; W399-N416 VanDerWaalsContact CH2-CB 3.46Å; W399-N416 HydrophobicContact CZ2-CB 3.93Å; W399-N416 HydrophobicContact CZ3-CB 4.29Å; W399-N419 HydrophobicContact CZ2-CB 4.2Å; W399-I420 HydrophobicContact CD2-CG1 3.7Å; W399-I420 HydrophobicContact CE3-CD1 4.07Å; W399-I420 HydrophobicContact CE3-CG1 3.76Å; W399-I420 HydrophobicContact CG-CG1 4.17Å; W399-I420 HydrophobicContact CH2-CG1 4.44Å; W399-I420 HydrophobicContact CZ2-CG1 4.38Å; W399-I420 HydrophobicContact CZ3-CD1 4.17Å; W399-I420 HydrophobicContact CZ3-CG1 4.14Å; W399-V425 HydrophobicContact CB-CG1 3.92Å
400	S	88.1	Confident	85.1	Confident	24 Å²	24	61.3 Å²	61.3	17%	0.168	35%	0.347	C	S	.	.	H	α-helix	trans	-58	-48.2	178.8	-59	0	0	0	0	110.8	S396 D397 T404	S396-S400 WeakPolarHBondContact O-CB 3.47Å; S396-S400 PolarHBondContact O-N 3.31Å; S396-S400 PolarHBondContact O-OG 3.47Å; D397-S400 PolarHBondContact O-N 2.88Å; S400-T404 VanDerWaalsContact O-CB 3.28Å; S400-T404 WeakPolarHBondContact O-CB 3.38Å; S400-T404 PolarHBondContact O-N 3.21Å; S400-T404 PolarHBondContact O-OG1 3.23Å
401	K	87.2	Confident	85.4	Confident	113 Å²	113	59.1 Å²	59.1	49%	0.491	33%	0.326	S	S	.	.	H	α-helix	trans	-60.3	-46.9	176	-173.4	-179.9	179.8	-170.7	0	112.3	D397 W399 L405	D397-K401 WeakPolarHBondContact O-CB 3.32Å; D397-K401 PolarHBondContact O-N 3.44Å; W399-K401 PolarHBondContact O-N 3.32Å; K401-L405 HydrophobicContact CG-CD1 3.8Å; K401-L405 VanDerWaalsContact O-CB 3.32Å; K401-L405 WeakPolarHBondContact O-CB 3.25Å; K401-L405 VanDerWaalsContact O-CG 3.25Å; K401-L405 WeakPolarHBondContact O-CG 3.31Å; K401-L405 PolarHBondContact O-N 3.16Å
402	L	88.2	Confident	85.7	Confident	5.5 Å²	5.5	53.7 Å²	53.7	3%	0.029	29%	0.294	C	S	.	.	H	α-helix	trans	-67.1	-38.5	-177	-76.6	171.7	0	0	0	113.5	W385 E388 L389 S398 W399 N406 K407 V408	W385-L402 HydrophobicContact CB-CD1 4.08Å; W385-L402 HydrophobicContact CB-CD2 4Å; E388-L402 HydrophobicContact CB-CD1 4.21Å; E388-L402 HydrophobicContact CB-CD2 3.9Å; E388-L402 HydrophobicContact CB-CG 4.39Å; E388-L402 HydrophobicContact CG-CD2 4.03Å; L389-L402 HydrophobicContact CD2-CD1 3.84Å; L389-L402 HydrophobicContact CG-CD1 3.8Å; S398-L402 VanDerWaalsContact O-CB 3.29Å; S398-L402 WeakPolarHBondContact O-CB 3.12Å; S398-L402 WeakPolarHBondContact O-CD1 3.46Å; S398-L402 WeakPolarHBondContact O-CG 3.44Å; S398-L402 PolarHBondContact O-N 2.99Å; W399-L402 PolarHBondContact O-N 2.74Å; L402-N406 PolarHBondContact O-N 3.06Å; L402-K407 HydrophobicContact CD2-CB 4.01Å; L402-K407 PolarHBondContact O-N 3.25Å; L402-V408 HydrophobicContact CB-CG2 3.74Å
403	I	89.4	Confident	86.1	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.015	28%	0.276	C	S	.	.	H	α-helix	trans	-72.4	-45.3	179.6	-67.8	164.5	0	0	0	109.8	W399 L405 N406 V408 I420 I429 I432 V433	W399-I403 HydrophobicContact CB-CD1 4.3Å; W399-I403 HydrophobicContact CE3-CD1 4.39Å; W399-I403 WeakPolarHBondContact O-CB 3.49Å; W399-I403 WeakPolarHBondContact O-CD1 3.46Å; W399-I403 VanDerWaalsContact O-CG1 3.24Å; W399-I403 WeakPolarHBondContact O-CG1 3.35Å; W399-I403 PolarHBondContact O-N 3.13Å; I403-L405 PolarHBondContact O-N 3.11Å; I403-N406 PolarHBondContact O-N 3.22Å; I403-N406 VanDerWaalsContact O-N 3.08Å; I403-V408 HydrophobicContact CG1-CG2 4.37Å; I403-I420 HydrophobicContact CD1-CD1 4.12Å; I403-I420 HydrophobicContact CD1-CG1 4.42Å; I403-I420 HydrophobicContact CD1-CG2 4.27Å; I403-I429 HydrophobicContact CB-CG2 4.12Å; I403-I429 HydrophobicContact CD1-CG2 3.54Å; I403-I429 VanDerWaalsContact CD1-CG2 3.5Å; I403-I429 HydrophobicContact CG1-CG2 4.43Å; I403-I429 HydrophobicContact CG2-CG2 3.99Å; I403-I432 HydrophobicContact CG2-CB 4.29Å; I403-I432 HydrophobicContact CG2-CG2 3.76Å; I403-V433 HydrophobicContact CD1-CG2 3.82Å; I403-V433 HydrophobicContact CG1-CG2 4.43Å; I403-V433 HydrophobicContact CG2-CG2 4.04Å
404	T	87.6	Confident	86.6	Confident	91.5 Å²	91.5	49.4 Å²	49.4	56%	0.561	26%	0.264	S	S	*	.	H	α-helix	trans	-63.8	-39.9	179	-53.4	0	0	0	0	112.1	S400 N406 I429	S400-T404 VanDerWaalsContact O-CB 3.28Å; S400-T404 WeakPolarHBondContact O-CB 3.38Å; S400-T404 PolarHBondContact O-N 3.21Å; S400-T404 PolarHBondContact O-OG1 3.23Å; T404-N406 PolarHBondContact O-N 3.02Å; T404-I429 WeakPolarHBondContact OG1-CD1 3.42Å
405	L	85.5	Confident	86.8	Confident	100 Å²	100	53.3 Å²	53.3	52%	0.524	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	4.7	175.7	-65.3	175.2	0	0	0	114	K401 I403 K407	K401-L405 HydrophobicContact CG-CD1 3.8Å; K401-L405 VanDerWaalsContact O-CB 3.32Å; K401-L405 WeakPolarHBondContact O-CB 3.25Å; K401-L405 VanDerWaalsContact O-CG 3.25Å; K401-L405 WeakPolarHBondContact O-CG 3.31Å; K401-L405 PolarHBondContact O-N 3.16Å; I403-L405 PolarHBondContact O-N 3.11Å; L405-K407 HydrophobicContact CB-CG 3.84Å; L405-K407 WeakPolarHBondContact O-CG 3.44Å; L405-K407 PolarHBondContact O-N 2.94Å; L405-K407 VanDerWaalsContact O-N 3.12Å
406	N	83.8	Confident	87.1	Confident	109.5 Å²	109.5	51 Å²	51	59%	0.586	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	33.8	-176.1	-160.2	20.5	0	0	0	113.8	L402 I403 T404 V408 R436	L402-N406 PolarHBondContact O-N 3.06Å; I403-N406 PolarHBondContact O-N 3.22Å; I403-N406 VanDerWaalsContact O-N 3.08Å; T404-N406 PolarHBondContact O-N 3.02Å; N406-V408 VanDerWaalsContact C-N 3.34Å; N406-R436 VanDerWaalsContact OD1-CZ 3.28Å; N406-R436 PolarHBondContact OD1-NH1 3.17Å; N406-R436 PolarHBondContact OD1-NH2 3.2Å; N406-R436 VanDerWaalsContact OD1-NH2 3.14Å
407	K	83.8	Confident	87.4	Confident	118.5 Å²	118.5	49.7 Å²	49.7	52%	0.515	25%	0.25	S	S	.	.			trans	-91.2	3.2	-179	-63.2	-60.2	-178.2	-178.4	0	113.6	L402 L405 P409	L402-K407 HydrophobicContact CD2-CB 4.01Å; L402-K407 PolarHBondContact O-N 3.25Å; L405-K407 HydrophobicContact CB-CG 3.84Å; L405-K407 WeakPolarHBondContact O-CG 3.44Å; L405-K407 PolarHBondContact O-N 2.94Å; L405-K407 VanDerWaalsContact O-N 3.12Å; K407-P409 WeakPolarHBondContact O-CD 3.41Å
408	V	86.8	Confident	87.5	Confident	0.5 Å²	0.5	49 Å²	49	0%	0.003	24%	0.239	C	C	.	.	S	Bend	trans	-102.8	105.3	172.8	-171.3	0	0	0	0	109	W385 W399 L402 I403 N406 A412 L413 R436	W385-V408 HydrophobicContact CB-CG2 4.33Å; W399-V408 HydrophobicContact CZ3-CG1 4.47Å; W399-V408 HydrophobicContact CZ3-CG2 4.2Å; L402-V408 HydrophobicContact CB-CG2 3.74Å; I403-V408 HydrophobicContact CG1-CG2 4.37Å; N406-V408 VanDerWaalsContact C-N 3.34Å; V408-A412 HydrophobicContact CG1-CB 3.78Å; V408-L413 HydrophobicContact CG1-CB 4Å; V408-L413 HydrophobicContact CG1-CD1 4.42Å; V408-R436 PolarHBondContact O-NH1 3.07Å; V408-R436 VanDerWaalsContact O-NH1 3.14Å; V408-R436 PolarHBondContact O-NH2 3.25Å
409	P	86.2	Confident	87.5	Confident	74.5 Å²	74.5	51 Å²	51	48%	0.484	25%	0.249	S	C	.	.			trans	-61.1	154.2	172.8	-23	33.5	0	0	0	111.5	K407 M411 A412 L413	K407-P409 WeakPolarHBondContact O-CD 3.41Å; P409-M411 PolarHBondContact O-N 3.03Å; P409-A412 WeakPolarHBondContact O-CA 3.48Å; P409-A412 WeakPolarHBondContact O-CB 3.13Å; P409-A412 PolarHBondContact O-N 3.12Å; P409-L413 PolarHBondContact O-N 3.09Å
410	H	88.6	Confident	87.5	Confident	14.5 Å²	14.5	51 Å²	51	7%	0.067	25%	0.249	C	C	.	.	H	α-helix	trans	-51.6	-37.3	-176	-165	55.9	0	0	0	114	L413 L414 I442 Y453	H410-L413 WeakPolarHBondContact O-CB 3.24Å; H410-L413 PolarHBondContact O-N 3.08Å; H410-L414 WeakPolarHBondContact O-CG 3.09Å; H410-L414 PolarHBondContact O-N 3.12Å; H410-I442 HydrophobicContact CB-CG2 4.25Å; H410-Y453 AromaticContact NE2-CE1 3.65Å; H410-Y453 AromaticContact NE2-CZ 3.74Å; H410-Y453 PolarHBondContact NE2-OH 3.04Å; H410-Y453 VanDerWaalsContact NE2-OH 3.11Å
411	M	85.3	Confident	87.5	Confident	56 Å²	56	50.1 Å²	50.1	28%	0.276	24%	0.242	S	C	.	.	H	α-helix	trans	-71.2	-37.1	176.1	-71.6	-42.6	10.5	0	0	115.2	P409 L413 L414 R415 Q448 R452	P409-M411 PolarHBondContact O-N 3.03Å; M411-L413 VanDerWaalsContact C-N 3.25Å; M411-L414 HydrophobicContact CE-CB 4.37Å; M411-L414 HydrophobicContact CE-CD1 3.4Å; M411-L414 VanDerWaalsContact CE-CD1 3.45Å; M411-L414 HydrophobicContact CE-CG 3.92Å; M411-L414 HydrophobicContact SD-CD1 3.94Å; M411-R415 WeakPolarHBondContact O-CB 3.47Å; M411-R415 PolarHBondContact O-N 3.03Å; M411-R415 VanDerWaalsContact O-N 3.17Å; M411-Q448 HydrophobicContact CE-CB 3.99Å; M411-Q448 HydrophobicContact CE-CG 3.26Å; M411-Q448 HydrophobicContact CG-CG 4.33Å; M411-Q448 VanDerWaalsContact CG-NE2 3.35Å; M411-Q448 VanDerWaalsContact CG-OE1 3.24Å; M411-Q448 HydrophobicContact SD-CB 4.32Å; M411-Q448 HydrophobicContact SD-CG 3.61Å; M411-Q448 WeakPolarHBondContact SD-CG 3.1Å; M411-Q448 PolarHBondContact SD-NE2 3Å; M411-Q448 PolarHBondContact SD-OE1 3.19Å; M411-Q448 VanDerWaalsContact SD-OE1 3.36Å; M411-R452 HydrophobicContact CE-CB 4.12Å; M411-R452 HydrophobicContact CE-CG 4.28Å; M411-R452 HydrophobicContact SD-CB 4.44Å; M411-R452 HydrophobicContact SD-CG 4.09Å
412	A	86	Confident	87.3	Confident	7 Å²	7	46.1 Å²	46.1	6%	0.058	23%	0.226	C	C	.	.	H	α-helix	trans	-66.3	-36.3	173.3	0	0	0	0	0	110	W385 V408 P409 N416	W385-A412 HydrophobicContact CD2-CB 3.98Å; W385-A412 HydrophobicContact CG-CB 4.44Å; W385-A412 HydrophobicContact CH2-CB 4.35Å; W385-A412 HydrophobicContact CZ2-CB 3.57Å; V408-A412 HydrophobicContact CG1-CB 3.78Å; P409-A412 WeakPolarHBondContact O-CA 3.48Å; P409-A412 WeakPolarHBondContact O-CB 3.13Å; P409-A412 PolarHBondContact O-N 3.12Å; A412-N416 WeakPolarHBondContact O-CB 3.33Å; A412-N416 PolarHBondContact O-N 3.13Å; A412-N416 VanDerWaalsContact O-N 3.16Å; A412-N416 PolarHBondContact O-ND2 3.14Å
413	L	90.8	Very high	87	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-56.3	176	-173.6	65	0	0	0	110.8	V408 P409 H410 M411 R415 N416 L417 I420 V433 R436 L437	V408-L413 HydrophobicContact CG1-CB 4Å; V408-L413 HydrophobicContact CG1-CD1 4.42Å; P409-L413 PolarHBondContact O-N 3.09Å; H410-L413 WeakPolarHBondContact O-CB 3.24Å; H410-L413 PolarHBondContact O-N 3.08Å; M411-L413 VanDerWaalsContact C-N 3.25Å; L413-R415 VanDerWaalsContact C-N 3.28Å; L413-R415 PolarHBondContact O-N 2.98Å; L413-N416 CarbonylContact O-C 3.57Å; L413-N416 PolarHBondContact O-N 3.12Å; L413-L417 HydrophobicContact CD1-CD2 4.17Å; L413-L417 HydrophobicContact CG-CD2 4.02Å; L413-L417 VanDerWaalsContact O-CD2 3.31Å; L413-L417 WeakPolarHBondContact O-CD2 3.3Å; L413-L417 VanDerWaalsContact O-CG 3.3Å; L413-L417 WeakPolarHBondContact O-CG 3.45Å; L413-L417 PolarHBondContact O-N 3.26Å; L413-L417 VanDerWaalsContact O-N 3.1Å; L413-I420 HydrophobicContact CD1-CD1 3.65Å; L413-V433 HydrophobicContact CD1-CG1 3.95Å; L413-V433 HydrophobicContact CD1-CG2 4.08Å; L413-V433 HydrophobicContact CD2-CG1 4.24Å; L413-V433 HydrophobicContact CG-CG1 4.34Å; L413-R436 HydrophobicContact CD2-CB 4.31Å; L413-L437 HydrophobicContact CD2-CD2 4.17Å; L413-L437 HydrophobicContact CD2-CG 4.48Å
414	L	90.1	Very high	86.5	Confident	8 Å²	8	50.7 Å²	50.7	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-55.1	-40.2	179.2	-71.4	-178.6	0	0	0	113.2	H410 M411 N416 L417 L437 R452 Y453 A456 L524	H410-L414 WeakPolarHBondContact O-CG 3.09Å; H410-L414 PolarHBondContact O-N 3.12Å; M411-L414 HydrophobicContact CE-CB 4.37Å; M411-L414 HydrophobicContact CE-CD1 3.4Å; M411-L414 VanDerWaalsContact CE-CD1 3.45Å; M411-L414 HydrophobicContact CE-CG 3.92Å; M411-L414 HydrophobicContact SD-CD1 3.94Å; L414-N416 VanDerWaalsContact C-N 3.32Å; L414-N416 PolarHBondContact O-N 2.83Å; L414-L417 HydrophobicContact CD2-CD1 4.32Å; L414-L437 HydrophobicContact CD2-CD2 3.58Å; L414-R452 HydrophobicContact CD1-CB 3.93Å; L414-Y453 HydrophobicContact CD1-CD1 3.91Å; L414-Y453 HydrophobicContact CD1-CE1 3.77Å; L414-Y453 HydrophobicContact CD1-CG 4.27Å; L414-Y453 HydrophobicContact CD2-CD1 3.9Å; L414-Y453 HydrophobicContact CD2-CE1 4.06Å; L414-Y453 HydrophobicContact CG-CE1 4.36Å; L414-A456 HydrophobicContact CB-CB 4.37Å; L414-A456 HydrophobicContact CD2-CB 4.22Å; L414-L524 HydrophobicContact CD2-CD2 3.67Å
415	R	85.9	Confident	86.4	Confident	170.5 Å²	170.5	46.6 Å²	46.6	64%	0.643	23%	0.227	S	C	*	.	H	α-helix	trans	-72.7	-24	-179.6	-171.2	172.8	65	-178.5	0.5	113.4	E386 M411 L413	E386-R415 IonicContact OE1-NH2 3.91Å; E386-R415 PolarHBondContact OE1-NH2 2.95Å; M411-R415 WeakPolarHBondContact O-CB 3.47Å; M411-R415 PolarHBondContact O-N 3.03Å; M411-R415 VanDerWaalsContact O-N 3.17Å; L413-R415 VanDerWaalsContact C-N 3.28Å; L413-R415 PolarHBondContact O-N 2.98Å
416	N	90	Very high	86.3	Confident	14.5 Å²	14.5	48.5 Å²	48.5	8%	0.078	23%	0.233	C	C	.	.	H	α-helix	trans	-110.6	5.3	-173.6	-71.9	-71.1	0	0	0	114.3	W385 W399 A412 L413 L414 R418 N419 I420	W385-N416 WeakPolarHBondContact CH2-ND2 3.18Å; W385-N416 VanDerWaalsContact CZ3-ND2 3.32Å; W385-N416 WeakPolarHBondContact CZ3-ND2 2.93Å; W399-N416 HydrophobicContact CH2-CB 3.46Å; W399-N416 VanDerWaalsContact CH2-CB 3.46Å; W399-N416 HydrophobicContact CZ2-CB 3.93Å; W399-N416 HydrophobicContact CZ3-CB 4.29Å; A412-N416 WeakPolarHBondContact O-CB 3.33Å; A412-N416 PolarHBondContact O-N 3.13Å; A412-N416 VanDerWaalsContact O-N 3.16Å; A412-N416 PolarHBondContact O-ND2 3.14Å; L413-N416 CarbonylContact O-C 3.57Å; L413-N416 PolarHBondContact O-N 3.12Å; L414-N416 VanDerWaalsContact C-N 3.32Å; L414-N416 PolarHBondContact O-N 2.83Å; N416-R418 PolarHBondContact O-N 3.01Å; N416-R418 VanDerWaalsContact O-N 3.14Å; N416-N419 WeakPolarHBondContact O-CA 3.26Å; N416-N419 WeakPolarHBondContact O-CB 3.41Å; N416-N419 PolarHBondContact O-N 3.22Å; N416-N419 PolarHBondContact OD1-ND2 2.93Å; N416-I420 PolarHBondContact O-N 3.22Å
417	L	91.1	Very high	86.5	Confident	0.5 Å²	0.5	48.3 Å²	48.3	0%	0.003	23%	0.232	C	C	.	.	H	α-helix	trans	-51.1	-41.5	179.8	-63.6	-176.5	0	0	0	113	L413 L414 N419 I420 L421 V433 L437 A456 I460 Y520 L524	L413-L417 HydrophobicContact CD1-CD2 4.17Å; L413-L417 HydrophobicContact CG-CD2 4.02Å; L413-L417 VanDerWaalsContact O-CD2 3.31Å; L413-L417 WeakPolarHBondContact O-CD2 3.3Å; L413-L417 VanDerWaalsContact O-CG 3.3Å; L413-L417 WeakPolarHBondContact O-CG 3.45Å; L413-L417 PolarHBondContact O-N 3.26Å; L413-L417 VanDerWaalsContact O-N 3.1Å; L414-L417 HydrophobicContact CD2-CD1 4.32Å; L417-N419 VanDerWaalsContact C-N 3.31Å; L417-N419 PolarHBondContact O-N 3.02Å; L417-I420 HydrophobicContact CD2-CD1 4.47Å; L417-I420 PolarHBondContact O-N 3.08Å; L417-L421 WeakPolarHBondContact O-CB 3.36Å; L417-L421 WeakPolarHBondContact O-CD1 3.39Å; L417-L421 VanDerWaalsContact O-CG 3.31Å; L417-L421 WeakPolarHBondContact O-CG 3.25Å; L417-L421 PolarHBondContact O-N 2.81Å; L417-V433 HydrophobicContact CD2-CG1 4.05Å; L417-L437 HydrophobicContact CD1-CD1 4.26Å; L417-L437 HydrophobicContact CD2-CD1 4.36Å; L417-A456 HydrophobicContact CD1-CB 4.12Å; L417-I460 HydrophobicContact CB-CD1 4.16Å; L417-I460 HydrophobicContact CD1-CD1 4Å; L417-Y520 HydrophobicContact CD1-CD1 4.44Å; L417-Y520 HydrophobicContact CD2-CD1 4.43Å; L417-Y520 HydrophobicContact CD2-CE1 4.06Å; L417-L524 HydrophobicContact CD1-CD1 4.06Å; L417-L524 HydrophobicContact CD1-CD2 4.03Å; L417-L524 HydrophobicContact CD1-CG 4.43Å
418	R	88	Confident	86.6	Confident	112 Å²	112	45.8 Å²	45.8	42%	0.423	23%	0.229	S	C	.	.	H	α-helix	trans	-57.4	-42.1	174.9	177.2	177.7	177.4	-114	1.7	112.7	N416 L422 L463	N416-R418 PolarHBondContact O-N 3.01Å; N416-R418 VanDerWaalsContact O-N 3.14Å; R418-L422 HydrophobicContact CG-CD1 3.96Å; R418-L422 WeakPolarHBondContact O-CB 3.23Å; R418-L422 VanDerWaalsContact O-CG 3.28Å; R418-L422 WeakPolarHBondContact O-CG 3.36Å; R418-L422 PolarHBondContact O-N 3Å; R418-L422 VanDerWaalsContact O-N 3.09Å; R418-L463 HydrophobicContact CG-CD1 4.5Å; R418-L463 HydrophobicContact CG-CD2 4.48Å
419	N	86.7	Confident	86.8	Confident	47.5 Å²	47.5	46.1 Å²	46.1	25%	0.254	23%	0.231	S	C	.	.	H	α-helix	trans	-72.2	-38.8	-178.5	-66.5	-25.7	0	0	0	111	W399 N416 L417 L422 S423	W399-N419 HydrophobicContact CZ2-CB 4.2Å; N416-N419 WeakPolarHBondContact O-CA 3.26Å; N416-N419 WeakPolarHBondContact O-CB 3.41Å; N416-N419 PolarHBondContact O-N 3.22Å; N416-N419 PolarHBondContact OD1-ND2 2.93Å; L417-N419 VanDerWaalsContact C-N 3.31Å; L417-N419 PolarHBondContact O-N 3.02Å; N419-L422 PolarHBondContact O-N 3.27Å; N419-S423 VanDerWaalsContact O-CB 3.27Å; N419-S423 WeakPolarHBondContact O-CB 3.45Å; N419-S423 PolarHBondContact O-N 3.02Å; N419-S423 PolarHBondContact O-OG 3.22Å
420	I	88.4	Confident	87	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.7	-50.2	175.8	-64.5	165.6	0	0	0	109.7	W399 I403 L413 N416 L417 L422 S423 V425	W399-I420 HydrophobicContact CD2-CG1 3.7Å; W399-I420 HydrophobicContact CE3-CD1 4.07Å; W399-I420 HydrophobicContact CE3-CG1 3.76Å; W399-I420 HydrophobicContact CG-CG1 4.17Å; W399-I420 HydrophobicContact CH2-CG1 4.44Å; W399-I420 HydrophobicContact CZ2-CG1 4.38Å; W399-I420 HydrophobicContact CZ3-CD1 4.17Å; W399-I420 HydrophobicContact CZ3-CG1 4.14Å; I403-I420 HydrophobicContact CD1-CD1 4.12Å; I403-I420 HydrophobicContact CD1-CG1 4.42Å; I403-I420 HydrophobicContact CD1-CG2 4.27Å; L413-I420 HydrophobicContact CD1-CD1 3.65Å; N416-I420 PolarHBondContact O-N 3.22Å; L417-I420 HydrophobicContact CD2-CD1 4.47Å; L417-I420 PolarHBondContact O-N 3.08Å; I420-L422 VanDerWaalsContact C-N 3.31Å; I420-L422 PolarHBondContact O-N 2.97Å; I420-S423 PolarHBondContact O-N 2.76Å; I420-S423 VanDerWaalsContact O-N 3.11Å; I420-S423 PolarHBondContact O-OG 3.14Å; I420-V425 HydrophobicContact CG2-CG2 3.99Å
421	L	87.5	Confident	87.2	Confident	6.5 Å²	6.5	46.7 Å²	46.7	3%	0.034	23%	0.227	C	C	.	.	H	α-helix	trans	-59.7	-38	177.6	-74.9	162.7	0	0	0	113	L417 S423 I460 L463 C512 M516 L517 Y520	L417-L421 WeakPolarHBondContact O-CB 3.36Å; L417-L421 WeakPolarHBondContact O-CD1 3.39Å; L417-L421 VanDerWaalsContact O-CG 3.31Å; L417-L421 WeakPolarHBondContact O-CG 3.25Å; L417-L421 PolarHBondContact O-N 2.81Å; L421-S423 VanDerWaalsContact C-N 3.3Å; L421-S423 PolarHBondContact O-N 3.21Å; L421-I460 HydrophobicContact CD1-CD1 3.78Å; L421-I460 HydrophobicContact CD1-CG1 4.26Å; L421-L463 HydrophobicContact CB-CD2 4.17Å; L421-L463 HydrophobicContact CD1-CD2 4.2Å; L421-C512 VanDerWaalsContact C-SG 3.58Å; L421-C512 PolarHBondContact O-SG 2.91Å; L421-M516 HydrophobicContact CD2-CG 4.08Å; L421-M516 HydrophobicContact CD2-SD 4.35Å; L421-L517 HydrophobicContact CD1-CD2 3.88Å; L421-L517 HydrophobicContact CD2-CD2 4.3Å; L421-Y520 HydrophobicContact CD1-CD2 4.48Å; L421-Y520 HydrophobicContact CD1-CG 4.38Å; L421-Y520 HydrophobicContact CD2-CD2 3.96Å; L421-Y520 HydrophobicContact CD2-CE2 3.84Å; L421-Y520 HydrophobicContact CD2-CG 4.47Å; L421-Y520 HydrophobicContact CG-CE2 4.39Å
422	L	84.3	Confident	87.5	Confident	27.5 Å²	27.5	47.1 Å²	47.1	14%	0.144	23%	0.23	C	C	.	.	H	α-helix	trans	-81.2	-8.3	178.4	-72.1	175.3	0	0	0	114.3	R418 N419 I420 L463 K508 F509	R418-L422 HydrophobicContact CG-CD1 3.96Å; R418-L422 WeakPolarHBondContact O-CB 3.23Å; R418-L422 VanDerWaalsContact O-CG 3.28Å; R418-L422 WeakPolarHBondContact O-CG 3.36Å; R418-L422 PolarHBondContact O-N 3Å; R418-L422 VanDerWaalsContact O-N 3.09Å; N419-L422 PolarHBondContact O-N 3.27Å; I420-L422 VanDerWaalsContact C-N 3.31Å; I420-L422 PolarHBondContact O-N 2.97Å; L422-L463 HydrophobicContact CD1-CD1 4.24Å; L422-L463 HydrophobicContact CD2-CD1 4.02Å; L422-L463 HydrophobicContact CG-CD1 4.23Å; L422-K508 WeakPolarHBondContact CD2-O 3.42Å; L422-F509 HydrophobicContact CD2-CD1 4.33Å; L422-F509 HydrophobicContact CD2-CE1 4.45Å
423	S	81.6	Confident	87.8	Confident	18 Å²	18	46.8 Å²	46.8	13%	0.126	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-4.5	-175.2	64.4	0	0	0	0	114.6	S396 N419 I420 L421	S396-S423 VanDerWaalsContact CB-O 3.27Å; S396-S423 WeakPolarHBondContact CB-O 3.37Å; N419-S423 VanDerWaalsContact O-CB 3.27Å; N419-S423 WeakPolarHBondContact O-CB 3.45Å; N419-S423 PolarHBondContact O-N 3.02Å; N419-S423 PolarHBondContact O-OG 3.22Å; I420-S423 PolarHBondContact O-N 2.76Å; I420-S423 VanDerWaalsContact O-N 3.11Å; I420-S423 PolarHBondContact O-OG 3.14Å; L421-S423 VanDerWaalsContact C-N 3.3Å; L421-S423 PolarHBondContact O-N 3.21Å
424	N	78.2	Confident	88	Confident	87 Å²	87	47.5 Å²	47.5	47%	0.465	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	55.1	-179.6	-161.7	59.5	0	0	0	112.8	S396 L511	S396-N424 PolarHBondContact OG-O 2.86Å; N424-L511 HydrophobicContact CB-CB 4.22Å; N424-L511 HydrophobicContact CB-CD1 4.02Å; N424-L511 HydrophobicContact CB-CD2 4.24Å; N424-L511 HydrophobicContact CB-CG 4.34Å
425	V	85.3	Confident	88.1	Confident	7 Å²	7	54.6 Å²	54.6	4%	0.042	26%	0.261	C	S	.	.			trans	-75.4	156.6	171.2	-65.2	0	0	0	0	110.2	S396 W399 I420 I429 H430	S396-V425 VanDerWaalsContact OG-CA 3.32Å; S396-V425 WeakPolarHBondContact OG-CA 3.4Å; W399-V425 HydrophobicContact CB-CG1 3.92Å; I420-V425 HydrophobicContact CG2-CG2 3.99Å; V425-I429 HydrophobicContact CB-CB 4.17Å; V425-I429 HydrophobicContact CB-CG2 4.18Å; V425-I429 HydrophobicContact CG2-CB 4.2Å; V425-I429 HydrophobicContact CG2-CG2 4.08Å; V425-H430 WeakPolarHBondContact CG2-CE1 3.46Å; V425-H430 VanDerWaalsContact CG2-NE2 3.27Å; V425-H430 WeakPolarHBondContact CG2-NE2 3.41Å
426	Q	85	Confident	88.3	Confident	138 Å²	138	47.8 Å²	47.8	65%	0.645	24%	0.236	S	C	*	.			trans	-62.3	150.5	177.2	-66.5	-176.1	-27.3	0	0	111.4	S428 I429 H430	Q426-S428 PolarHBondContact O-N 3.18Å; Q426-S428 VanDerWaalsContact O-N 3.16Å; Q426-I429 HydrophobicContact CB-CG1 4.47Å; Q426-I429 WeakPolarHBondContact O-CB 3.32Å; Q426-I429 PolarHBondContact O-N 3.39Å; Q426-H430 PolarHBondContact O-N 2.91Å
427	D	85.9	Confident	88.5	Confident	106.5 Å²	106.5	47.1 Å²	47.1	57%	0.57	23%	0.232	S	C	*	.	H	α-helix	trans	-56.3	-33.6	179.2	-73	-29.3	0	0	0	113.1	I429 H430 E431 M516	D427-I429 VanDerWaalsContact C-N 3.25Å; D427-I429 PolarHBondContact O-N 3.25Å; D427-H430 WeakPolarHBondContact O-CA 3.44Å; D427-H430 WeakPolarHBondContact O-CB 3.41Å; D427-H430 PolarHBondContact O-N 3.17Å; D427-E431 PolarHBondContact O-N 3.3Å; D427-M516 WeakPolarHBondContact OD1-CE 3.39Å
428	S	87.3	Confident	88.5	Confident	65 Å²	65	49.7 Å²	49.7	46%	0.455	25%	0.248	S	C	.	.	H	α-helix	trans	-56.3	-37.8	173.7	57.7	0	0	0	0	113	Q426 E431 I432	Q426-S428 PolarHBondContact O-N 3.18Å; Q426-S428 VanDerWaalsContact O-N 3.16Å; S428-E431 PolarHBondContact O-N 3.29Å; S428-I432 WeakPolarHBondContact O-CG1 3.41Å; S428-I432 PolarHBondContact O-N 3.21Å
429	I	90	Very high	88.6	Confident	8.5 Å²	8.5	46.2 Å²	46.2	4%	0.044	24%	0.238	C	C	.	.	H	α-helix	trans	-72.1	-38.2	176.8	-57.9	-60.1	0	0	0	110.4	I403 T404 V425 Q426 D427 E431 I432 V433	I403-I429 HydrophobicContact CB-CG2 4.12Å; I403-I429 HydrophobicContact CD1-CG2 3.54Å; I403-I429 VanDerWaalsContact CD1-CG2 3.5Å; I403-I429 HydrophobicContact CG1-CG2 4.43Å; I403-I429 HydrophobicContact CG2-CG2 3.99Å; T404-I429 WeakPolarHBondContact OG1-CD1 3.42Å; V425-I429 HydrophobicContact CB-CB 4.17Å; V425-I429 HydrophobicContact CB-CG2 4.18Å; V425-I429 HydrophobicContact CG2-CB 4.2Å; V425-I429 HydrophobicContact CG2-CG2 4.08Å; Q426-I429 HydrophobicContact CB-CG1 4.47Å; Q426-I429 WeakPolarHBondContact O-CB 3.32Å; Q426-I429 PolarHBondContact O-N 3.39Å; D427-I429 VanDerWaalsContact C-N 3.25Å; D427-I429 PolarHBondContact O-N 3.25Å; I429-E431 VanDerWaalsContact C-N 3.31Å; I429-E431 PolarHBondContact O-N 3.14Å; I429-I432 HydrophobicContact CD1-CD1 4.27Å; I429-I432 PolarHBondContact O-N 3.32Å; I429-V433 WeakPolarHBondContact O-CG2 3.47Å; I429-V433 PolarHBondContact O-N 2.98Å
430	H	91.3	Very high	88.7	Confident	8 Å²	8	46.6 Å²	46.6	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-60.9	-40.6	174	-71.8	-61.2	0	0	0	111.7	V425 Q426 D427 I432 V433 L434 M516 Y520	V425-H430 WeakPolarHBondContact CG2-CE1 3.46Å; V425-H430 VanDerWaalsContact CG2-NE2 3.27Å; V425-H430 WeakPolarHBondContact CG2-NE2 3.41Å; Q426-H430 PolarHBondContact O-N 2.91Å; D427-H430 WeakPolarHBondContact O-CA 3.44Å; D427-H430 WeakPolarHBondContact O-CB 3.41Å; D427-H430 PolarHBondContact O-N 3.17Å; H430-I432 VanDerWaalsContact C-N 3.35Å; H430-I432 PolarHBondContact O-N 3.23Å; H430-V433 PolarHBondContact O-N 3.14Å; H430-L434 WeakPolarHBondContact O-CB 3.4Å; H430-L434 VanDerWaalsContact O-CG 3.31Å; H430-L434 WeakPolarHBondContact O-CG 3.25Å; H430-L434 PolarHBondContact O-N 3.22Å; H430-M516 HydrophobicContact CB-CE 3.64Å; H430-M516 HydrophobicContact CB-SD 4.05Å; H430-M516 VanDerWaalsContact CD2-CE 3.46Å; H430-M516 WeakPolarHBondContact CD2-CE 3.47Å; H430-M516 PolarHBondContact CD2-SD 3.18Å; H430-M516 PolarHBondContact NE2-SD 3.16Å; H430-M516 VanDerWaalsContact NE2-SD 3.44Å; H430-Y520 HydrophobicContact CB-CE2 4.47Å; H430-Y520 AromaticContact ND1-CE2 3.76Å; H430-Y520 AromaticContact ND1-CZ 3.72Å; H430-Y520 PolarHBondContact ND1-OH 3.38Å
431	E	92	Very high	88.6	Confident	92 Å²	92	55.2 Å²	55.2	43%	0.43	28%	0.275	S	S	.	.	H	α-helix	trans	-61.7	-41.8	174.4	-65.7	-49.6	140.5	0	0	112.7	D427 S428 I429 V433 L434 K435 R519	D427-E431 PolarHBondContact O-N 3.3Å; S428-E431 PolarHBondContact O-N 3.29Å; I429-E431 VanDerWaalsContact C-N 3.31Å; I429-E431 PolarHBondContact O-N 3.14Å; E431-V433 VanDerWaalsContact C-N 3.31Å; E431-V433 PolarHBondContact O-N 3.18Å; E431-L434 PolarHBondContact O-N 3.37Å; E431-K435 VanDerWaalsContact O-CB 3.29Å; E431-K435 WeakPolarHBondContact O-CB 3.3Å; E431-K435 PolarHBondContact O-N 3.27Å; E431-R519 IonicContact OE1-CZ 2.87Å; E431-R519 IonicContact OE1-NH1 3.06Å; E431-R519 PolarHBondContact OE1-NH1 2.99Å; E431-R519 IonicContact OE1-NH2 3.35Å; E431-R519 IonicContact OE2-NH1 2.7Å
432	I	92	Very high	88.6	Confident	65.5 Å²	65.5	56.8 Å²	56.8	34%	0.336	28%	0.284	S	S	.	.	H	α-helix	trans	-60.2	-44.6	175.2	-65.6	167.6	0	0	0	110.3	I403 S428 I429 H430 R436	I403-I432 HydrophobicContact CG2-CB 4.29Å; I403-I432 HydrophobicContact CG2-CG2 3.76Å; S428-I432 WeakPolarHBondContact O-CG1 3.41Å; S428-I432 PolarHBondContact O-N 3.21Å; I429-I432 HydrophobicContact CD1-CD1 4.27Å; I429-I432 PolarHBondContact O-N 3.32Å; H430-I432 VanDerWaalsContact C-N 3.35Å; H430-I432 PolarHBondContact O-N 3.23Å; I432-R436 WeakPolarHBondContact O-CB 3.37Å; I432-R436 VanDerWaalsContact O-CG 3.29Å; I432-R436 WeakPolarHBondContact O-CG 3.45Å; I432-R436 PolarHBondContact O-N 2.84Å
433	V	93.2	Very high	88.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.4	-45.7	178.8	174.3	0	0	0	0	111.3	I403 L413 L417 I429 H430 E431 K435 R436 L437 Y520	I403-V433 HydrophobicContact CD1-CG2 3.82Å; I403-V433 HydrophobicContact CG1-CG2 4.43Å; I403-V433 HydrophobicContact CG2-CG2 4.04Å; L413-V433 HydrophobicContact CD1-CG1 3.95Å; L413-V433 HydrophobicContact CD1-CG2 4.08Å; L413-V433 HydrophobicContact CD2-CG1 4.24Å; L413-V433 HydrophobicContact CG-CG1 4.34Å; L417-V433 HydrophobicContact CD2-CG1 4.05Å; I429-V433 WeakPolarHBondContact O-CG2 3.47Å; I429-V433 PolarHBondContact O-N 2.98Å; H430-V433 PolarHBondContact O-N 3.14Å; E431-V433 VanDerWaalsContact C-N 3.31Å; E431-V433 PolarHBondContact O-N 3.18Å; V433-K435 PolarHBondContact O-N 3.49Å; V433-R436 PolarHBondContact O-N 2.93Å; V433-L437 HydrophobicContact CG1-CD1 4.12Å; V433-L437 HydrophobicContact CG1-CG 4.4Å; V433-L437 WeakPolarHBondContact O-CG 3.41Å; V433-L437 PolarHBondContact O-N 2.82Å; V433-Y520 HydrophobicContact CB-CE1 4.38Å; V433-Y520 WeakPolarHBondContact CB-OH 3.42Å; V433-Y520 HydrophobicContact CG1-CE1 3.56Å; V433-Y520 WeakPolarHBondContact CG1-OH 3.27Å
434	L	93.5	Very high	88.7	Confident	16 Å²	16	58.6 Å²	58.6	8%	0.084	29%	0.29	C	S	.	.	H	α-helix	trans	-60.7	-46.1	178.2	-72.5	171.6	0	0	0	111.1	H430 E431 R436 L437 T438 R519 Y520 A523	H430-L434 WeakPolarHBondContact O-CB 3.4Å; H430-L434 VanDerWaalsContact O-CG 3.31Å; H430-L434 WeakPolarHBondContact O-CG 3.25Å; H430-L434 PolarHBondContact O-N 3.22Å; E431-L434 PolarHBondContact O-N 3.37Å; L434-R436 VanDerWaalsContact C-N 3.29Å; L434-R436 PolarHBondContact O-N 2.75Å; L434-L437 CarbonylContact O-C 3.29Å; L434-L437 PolarHBondContact O-N 3.12Å; L434-L437 VanDerWaalsContact O-N 3.1Å; L434-T438 PolarHBondContact O-N 3.15Å; L434-T438 PolarHBondContact O-OG1 3.32Å; L434-T438 VanDerWaalsContact O-OG1 3.09Å; L434-R519 HydrophobicContact CD1-CB 4.15Å; L434-R519 HydrophobicContact CD2-CB 4.36Å; L434-Y520 HydrophobicContact CD1-CE2 4.34Å; L434-Y520 HydrophobicContact CD2-CD1 4.32Å; L434-Y520 HydrophobicContact CD2-CD2 3.8Å; L434-Y520 HydrophobicContact CD2-CE1 4.39Å; L434-Y520 HydrophobicContact CD2-CE2 3.99Å; L434-Y520 HydrophobicContact CD2-CG 3.98Å; L434-Y520 HydrophobicContact CG-CD2 4.3Å; L434-Y520 HydrophobicContact CG-CE2 4.13Å; L434-A523 HydrophobicContact CD2-CB 3.79Å
435	K	92.5	Very high	88.7	Confident	156 Å²	156	61.8 Å²	61.8	68%	0.678	30%	0.302	S	S	*	.	H	α-helix	trans	-58	-41.3	175	-172.4	176.1	-178.6	177.1	0	111.8	E431 V433 L437 T438 D439	E431-K435 VanDerWaalsContact O-CB 3.29Å; E431-K435 WeakPolarHBondContact O-CB 3.3Å; E431-K435 PolarHBondContact O-N 3.27Å; V433-K435 PolarHBondContact O-N 3.49Å; K435-L437 VanDerWaalsContact C-N 3.34Å; K435-L437 PolarHBondContact O-N 3.34Å; K435-T438 PolarHBondContact O-N 3.3Å; K435-T438 PolarHBondContact O-OG1 3.18Å; K435-D439 WeakPolarHBondContact O-CB 3.41Å; K435-D439 PolarHBondContact O-N 2.99Å
436	R	91.6	Very high	88.2	Confident	27 Å²	27	62.3 Å²	62.3	10%	0.102	31%	0.31	C	S	.	.	H	α-helix	trans	-68	-31.3	175.7	-72.3	-178.1	70.4	-174.3	1.2	113.5	N406 V408 L413 I432 V433 L434 T438 I442	N406-R436 VanDerWaalsContact OD1-CZ 3.28Å; N406-R436 PolarHBondContact OD1-NH1 3.17Å; N406-R436 PolarHBondContact OD1-NH2 3.2Å; N406-R436 VanDerWaalsContact OD1-NH2 3.14Å; V408-R436 PolarHBondContact O-NH1 3.07Å; V408-R436 VanDerWaalsContact O-NH1 3.14Å; V408-R436 PolarHBondContact O-NH2 3.25Å; L413-R436 HydrophobicContact CD2-CB 4.31Å; I432-R436 WeakPolarHBondContact O-CB 3.37Å; I432-R436 VanDerWaalsContact O-CG 3.29Å; I432-R436 WeakPolarHBondContact O-CG 3.45Å; I432-R436 PolarHBondContact O-N 2.84Å; V433-R436 PolarHBondContact O-N 2.93Å; L434-R436 VanDerWaalsContact C-N 3.29Å; L434-R436 PolarHBondContact O-N 2.75Å; R436-T438 VanDerWaalsContact C-N 3.34Å; R436-I442 HydrophobicContact CB-CD1 4.06Å; R436-I442 HydrophobicContact CG-CD1 3.86Å
437	L	92.1	Very high	87.6	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-75.4	-23.8	176.6	-70.5	175.7	0	0	0	112.6	L413 L414 L417 V433 L434 K435 I443 Y520 A523 L524 A527	L413-L437 HydrophobicContact CD2-CD2 4.17Å; L413-L437 HydrophobicContact CD2-CG 4.48Å; L414-L437 HydrophobicContact CD2-CD2 3.58Å; L417-L437 HydrophobicContact CD1-CD1 4.26Å; L417-L437 HydrophobicContact CD2-CD1 4.36Å; V433-L437 HydrophobicContact CG1-CD1 4.12Å; V433-L437 HydrophobicContact CG1-CG 4.4Å; V433-L437 WeakPolarHBondContact O-CG 3.41Å; V433-L437 PolarHBondContact O-N 2.82Å; L434-L437 CarbonylContact O-C 3.29Å; L434-L437 PolarHBondContact O-N 3.12Å; L434-L437 VanDerWaalsContact O-N 3.1Å; K435-L437 VanDerWaalsContact C-N 3.34Å; K435-L437 PolarHBondContact O-N 3.34Å; L437-I443 WeakPolarHBondContact O-CD1 3.36Å; L437-Y520 HydrophobicContact CD1-CD1 3.97Å; L437-Y520 HydrophobicContact CD1-CE1 4.15Å; L437-A523 HydrophobicContact CB-CB 4.13Å; L437-A523 HydrophobicContact CD1-CB 4.41Å; L437-L524 HydrophobicContact CD1-CD2 4.31Å; L437-L524 HydrophobicContact CD1-CG 4.46Å; L437-L524 HydrophobicContact CD2-CD2 4.23Å; L437-A527 VanDerWaalsContact O-CB 3.27Å; L437-A527 WeakPolarHBondContact O-CB 3.33Å
438	T	91.4	Very high	87.2	Confident	56.5 Å²	56.5	60 Å²	60	35%	0.347	29%	0.293	S	S	.	.	H	α-helix	trans	-105.3	-7.8	-179.9	56.9	0	0	0	0	114.4	L434 K435 R436 P440 A523 T526 L530	L434-T438 PolarHBondContact O-N 3.15Å; L434-T438 PolarHBondContact O-OG1 3.32Å; L434-T438 VanDerWaalsContact O-OG1 3.09Å; K435-T438 PolarHBondContact O-N 3.3Å; K435-T438 PolarHBondContact O-OG1 3.18Å; R436-T438 VanDerWaalsContact C-N 3.34Å; T438-P440 VanDerWaalsContact O-CD 3.27Å; T438-P440 WeakPolarHBondContact O-CD 3.24Å; T438-A523 HydrophobicContact CG2-CB 3.82Å; T438-T526 HydrophobicContact CG2-CG2 4.46Å; T438-L530 WeakPolarHBondContact O-CD1 3.43Å
439	D	90.4	Very high	86.8	Confident	37.5 Å²	37.5	58.5 Å²	58.5	20%	0.201	28%	0.278	C	S	.	.			trans	-69.3	116	177.6	-171.4	-22.6	0	0	0	111.1	K435 R441 I442 I443	K435-D439 WeakPolarHBondContact O-CB 3.41Å; K435-D439 PolarHBondContact O-N 2.99Å; D439-R441 PolarHBondContact O-N 2.97Å; D439-R441 WeakPolarHBondContact OD1-CB 3.42Å; D439-R441 PolarHBondContact OD1-N 3.36Å; D439-R441 IonicContact OD1-NE 3.3Å; D439-R441 PolarHBondContact OD1-NE 2.98Å; D439-R441 IonicContact OD2-CZ 2.8Å; D439-R441 IonicContact OD2-NE 2.82Å; D439-R441 IonicContact OD2-NH2 3.7Å; D439-R441 PolarHBondContact OD2-NH2 2.95Å; D439-I442 HydrophobicContact CB-CB 4.32Å; D439-I442 HydrophobicContact CB-CD1 4.02Å; D439-I442 HydrophobicContact CB-CG1 4.13Å; D439-I442 PolarHBondContact O-N 3.09Å; D439-I443 WeakPolarHBondContact O-CD1 3.35Å; D439-I443 VanDerWaalsContact O-CG1 3.27Å; D439-I443 WeakPolarHBondContact O-CG1 3.4Å; D439-I443 PolarHBondContact O-N 3.09Å
440	P	88.3	Confident	86.3	Confident	56 Å²	56	58.2 Å²	58.2	36%	0.364	28%	0.277	S	S	.	.	H	α-helix	trans	-56.1	-36.7	178.4	-24.4	34.7	0	0	0	113.2	T438 I442 I443 M444 L530	T438-P440 VanDerWaalsContact O-CD 3.27Å; T438-P440 WeakPolarHBondContact O-CD 3.24Å; P440-I442 PolarHBondContact O-N 3.33Å; P440-I443 PolarHBondContact O-N 3.3Å; P440-M444 WeakPolarHBondContact O-CB 3.32Å; P440-M444 WeakPolarHBondContact O-CG 3.36Å; P440-M444 PolarHBondContact O-N 3.28Å; P440-L530 HydrophobicContact CB-CD1 4.46Å; P440-L530 HydrophobicContact CB-CD2 4.4Å; P440-L530 HydrophobicContact CG-CD1 4.18Å; P440-L530 HydrophobicContact CG-CD2 4.3Å
441	R	88.1	Confident	85.7	Confident	180.5 Å²	180.5	59.5 Å²	59.5	68%	0.681	28%	0.282	S	S	*	.	H	α-helix	trans	-64.5	-47.1	-176.8	-63.4	177	-123.5	179	0.2	111.1	D439 I443 M444 E445	D439-R441 PolarHBondContact O-N 2.97Å; D439-R441 WeakPolarHBondContact OD1-CB 3.42Å; D439-R441 PolarHBondContact OD1-N 3.36Å; D439-R441 IonicContact OD1-NE 3.3Å; D439-R441 PolarHBondContact OD1-NE 2.98Å; D439-R441 IonicContact OD2-CZ 2.8Å; D439-R441 IonicContact OD2-NE 2.82Å; D439-R441 IonicContact OD2-NH2 3.7Å; D439-R441 PolarHBondContact OD2-NH2 2.95Å; R441-I443 VanDerWaalsContact C-N 3.3Å; R441-I443 PolarHBondContact O-N 3.32Å; R441-M444 PolarHBondContact O-N 2.95Å; R441-E445 WeakPolarHBondContact O-CB 3.41Å; R441-E445 WeakPolarHBondContact O-CG 3.31Å; R441-E445 PolarHBondContact O-N 3.15Å
442	I	86.9	Confident	85.4	Confident	40 Å²	40	61.8 Å²	61.8	21%	0.205	29%	0.287	C	S	.	.	H	α-helix	trans	-64.5	-37.3	179.2	-62.8	176.7	0	0	0	111	H410 R436 D439 P440 G446	H410-I442 HydrophobicContact CB-CG2 4.25Å; R436-I442 HydrophobicContact CB-CD1 4.06Å; R436-I442 HydrophobicContact CG-CD1 3.86Å; D439-I442 HydrophobicContact CB-CB 4.32Å; D439-I442 HydrophobicContact CB-CD1 4.02Å; D439-I442 HydrophobicContact CB-CG1 4.13Å; D439-I442 PolarHBondContact O-N 3.09Å; P440-I442 PolarHBondContact O-N 3.33Å; I442-G446 WeakPolarHBondContact O-CA 3.29Å; I442-G446 PolarHBondContact O-N 3.17Å
443	I	86.4	Confident	85.3	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-69.8	-42.1	178.7	-66	160.5	0	0	0	111.3	L437 D439 P440 R441 G446 K447 A527 L530 N535	L437-I443 WeakPolarHBondContact O-CD1 3.36Å; D439-I443 WeakPolarHBondContact O-CD1 3.35Å; D439-I443 VanDerWaalsContact O-CG1 3.27Å; D439-I443 WeakPolarHBondContact O-CG1 3.4Å; D439-I443 PolarHBondContact O-N 3.09Å; P440-I443 PolarHBondContact O-N 3.3Å; R441-I443 VanDerWaalsContact C-N 3.3Å; R441-I443 PolarHBondContact O-N 3.32Å; I443-G446 PolarHBondContact O-N 3.41Å; I443-K447 PolarHBondContact O-N 2.98Å; I443-A527 HydrophobicContact CD1-CB 4.03Å; I443-L530 HydrophobicContact CD1-CB 3.89Å; I443-L530 HydrophobicContact CD1-CD1 3.54Å; I443-L530 VanDerWaalsContact CD1-CD1 3.47Å; I443-L530 HydrophobicContact CD1-CG 4.37Å; I443-L530 HydrophobicContact CG2-CB 4.2Å; I443-N535 PolarHBondContact O-ND2 3.02Å
444	M	81.6	Confident	84.9	Confident	83.5 Å²	83.5	59 Å²	59	41%	0.411	27%	0.272	S	S	.	.	H	α-helix	trans	-63.5	-51.8	176.5	-73.1	174.1	67.4	0	0	111.3	P440 R441 G446 K447 H534 N535	P440-M444 WeakPolarHBondContact O-CB 3.32Å; P440-M444 WeakPolarHBondContact O-CG 3.36Å; P440-M444 PolarHBondContact O-N 3.28Å; R441-M444 PolarHBondContact O-N 2.95Å; M444-G446 VanDerWaalsContact C-N 3.28Å; M444-G446 PolarHBondContact O-N 3.36Å; M444-K447 WeakPolarHBondContact O-CG 3.23Å; M444-K447 PolarHBondContact O-N 3.25Å; M444-K447 VanDerWaalsContact O-N 3.15Å; M444-H534 HydrophobicContact CE-CB 4.36Å; M444-H534 HydrophobicContact CG-CB 3.61Å; M444-H534 HydrophobicContact SD-CB 4.16Å; M444-N535 WeakPolarHBondContact CA-OD1 3.45Å; M444-N535 PolarHBondContact O-OD1 3.4Å
445	E	77.8	Confident	84.5	Confident	153.5 Å²	153.5	60 Å²	60	72%	0.717	28%	0.283	S	S	*	.	H	α-helix	trans	-66.2	-33.1	177.9	-71.5	177.1	-176.8	0	0	112.4	R441 K447	R441-E445 WeakPolarHBondContact O-CB 3.41Å; R441-E445 WeakPolarHBondContact O-CG 3.31Å; R441-E445 PolarHBondContact O-N 3.15Å; E445-K447 PolarHBondContact O-N 3.34Å; E445-K447 VanDerWaalsContact O-N 3.12Å
446	G	74.2	Confident	84.4	Confident	19 Å²	19	52.8 Å²	52.8	20%	0.196	25%	0.253	C	S	.	.	H	α-helix	trans	-58.8	-27.6	178.3	0	0	0	0	0	112.7	I442 I443 M444 Q448	I442-G446 WeakPolarHBondContact O-CA 3.29Å; I442-G446 PolarHBondContact O-N 3.17Å; I443-G446 PolarHBondContact O-N 3.41Å; M444-G446 VanDerWaalsContact C-N 3.28Å; M444-G446 PolarHBondContact O-N 3.36Å; G446-Q448 VanDerWaalsContact O-CG 3.29Å; G446-Q448 WeakPolarHBondContact O-CG 3.19Å; G446-Q448 PolarHBondContact O-N 3.02Å; G446-Q448 VanDerWaalsContact O-N 3.13Å; G446-Q448 PolarHBondContact O-NE2 3.34Å
447	K	73.7	Confident	84.3	Confident	161 Å²	161	52.5 Å²	52.5	70%	0.7	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	37.8	-176.9	-64.1	-177.2	-179	-177.1	0	112.5	I443 M444 E445	I443-K447 PolarHBondContact O-N 2.98Å; M444-K447 WeakPolarHBondContact O-CG 3.23Å; M444-K447 PolarHBondContact O-N 3.25Å; M444-K447 VanDerWaalsContact O-N 3.15Å; E445-K447 PolarHBondContact O-N 3.34Å; E445-K447 VanDerWaalsContact O-N 3.12Å
448	Q	77.9	Confident	84	Confident	35.5 Å²	35.5	53.7 Å²	53.7	17%	0.166	26%	0.259	C	S	.	.			trans	-88.3	141.2	-175.7	-63.5	-54.8	-37	0	0	110.9	M411 G446 P450 Y453 S531 N535	M411-Q448 HydrophobicContact CE-CB 3.99Å; M411-Q448 HydrophobicContact CE-CG 3.26Å; M411-Q448 HydrophobicContact CG-CG 4.33Å; M411-Q448 VanDerWaalsContact CG-NE2 3.35Å; M411-Q448 VanDerWaalsContact CG-OE1 3.24Å; M411-Q448 HydrophobicContact SD-CB 4.32Å; M411-Q448 HydrophobicContact SD-CG 3.61Å; M411-Q448 WeakPolarHBondContact SD-CG 3.1Å; M411-Q448 PolarHBondContact SD-NE2 3Å; M411-Q448 PolarHBondContact SD-OE1 3.19Å; M411-Q448 VanDerWaalsContact SD-OE1 3.36Å; G446-Q448 VanDerWaalsContact O-CG 3.29Å; G446-Q448 WeakPolarHBondContact O-CG 3.19Å; G446-Q448 PolarHBondContact O-N 3.02Å; G446-Q448 VanDerWaalsContact O-N 3.13Å; G446-Q448 PolarHBondContact O-NE2 3.34Å; Q448-P450 WeakPolarHBondContact O-CD 3.4Å; Q448-Y453 HydrophobicContact CB-CE2 3.82Å; Q448-S531 PolarHBondContact O-OG 3.3Å; Q448-N535 PolarHBondContact N-ND2 3.48Å; Q448-N535 PolarHBondContact O-ND2 3.18Å
449	F	77.1	Confident	83.8	Confident	32 Å²	32	53.8 Å²	53.8	14%	0.14	26%	0.259	C	S	.	.			trans	-72.6	136.3	174	-70.3	-67.9	0	0	0	110.7	F451 R452 L536 D724 Q725 R728	F449-F451 VanDerWaalsContact C-N 3.26Å; F449-F451 PolarHBondContact O-N 3.08Å; F449-F451 VanDerWaalsContact O-N 3.13Å; F449-R452 HydrophobicContact CB-CG 4.14Å; F449-R452 VanDerWaalsContact O-CB 3.28Å; F449-R452 WeakPolarHBondContact O-CB 3.22Å; F449-R452 PolarHBondContact O-N 3.35Å; F449-L536 HydrophobicContact CD1-CD2 3.69Å; F449-L536 HydrophobicContact CE1-CD2 3.57Å; F449-D724 VanDerWaalsContact C-OD2 3.32Å; F449-D724 WeakPolarHBondContact CA-OD2 3.44Å; F449-D724 VanDerWaalsContact CB-CG 3.43Å; F449-D724 WeakPolarHBondContact CB-OD2 3.26Å; F449-D724 VanDerWaalsContact CD1-CG 3.5Å; F449-D724 WeakPolarHBondContact CD1-OD1 3.44Å; F449-D724 WeakPolarHBondContact CE1-OD1 3.49Å; F449-D724 VanDerWaalsContact CG-OD1 3.31Å; F449-D724 WeakPolarHBondContact CG-OD1 3.45Å; F449-Q725 HydrophobicContact CD2-CG 4.37Å; F449-Q725 HydrophobicContact CE1-CB 4.46Å; F449-Q725 HydrophobicContact CE1-CG 4.05Å; F449-Q725 VanDerWaalsContact CE1-NE2 3.27Å; F449-Q725 HydrophobicContact CE2-CG 4.09Å; F449-Q725 HydrophobicContact CZ-CG 4.11Å; F449-R728 HydrophobicContact CE1-CB 4.42Å
450	P	79.5	Confident	83.8	Confident	2.5 Å²	2.5	52 Å²	52	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-39.8	-40.4	174.1	-35.2	37.3	0	0	0	115.3	Q448 R452 Y453 F454 L528 M532 L536 M575 D724	Q448-P450 WeakPolarHBondContact O-CD 3.4Å; P450-R452 PolarHBondContact O-N 3.14Å; P450-R452 VanDerWaalsContact O-N 3.16Å; P450-Y453 WeakPolarHBondContact O-CB 3.42Å; P450-Y453 PolarHBondContact O-N 3.03Å; P450-Y453 VanDerWaalsContact O-N 3.09Å; P450-F454 PolarHBondContact O-N 3.02Å; P450-L528 VanDerWaalsContact CA-CD1 3.5Å; P450-L528 HydrophobicContact CB-CD1 3.38Å; P450-L528 HydrophobicContact CB-CG 4.09Å; P450-L528 HydrophobicContact CG-CD1 4.19Å; P450-M532 HydrophobicContact CB-CG 3.88Å; P450-M532 HydrophobicContact CB-SD 4.33Å; P450-M532 HydrophobicContact CG-CB 4.44Å; P450-M532 HydrophobicContact CG-CG 3.76Å; P450-M532 HydrophobicContact CG-SD 4.2Å; P450-L536 HydrophobicContact CG-CD1 4.1Å; P450-M575 HydrophobicContact CB-CE 3.4Å; P450-M575 HydrophobicContact CB-SD 4.06Å; P450-M575 HydrophobicContact CG-CE 3.56Å; P450-D724 HydrophobicContact CB-CB 4.39Å; P450-D724 VanDerWaalsContact CB-OD2 3.25Å; P450-D724 WeakPolarHBondContact CB-OD2 3.44Å; P450-D724 WeakPolarHBondContact CD-OD2 3.48Å; P450-D724 HydrophobicContact CG-CB 4.38Å; P450-D724 WeakPolarHBondContact CG-OD2 3.44Å
451	F	80.5	Confident	83.6	Confident	35 Å²	35	50.1 Å²	50.1	15%	0.154	24%	0.237	C	C	.	.	H	α-helix	trans	-60.6	-27.5	179.5	-127.9	-45.5	0	0	0	113.8	F449 Y453 F454 A455 Y564 L568 L571 L572 M575 D724	F449-F451 VanDerWaalsContact C-N 3.26Å; F449-F451 PolarHBondContact O-N 3.08Å; F449-F451 VanDerWaalsContact O-N 3.13Å; F451-Y453 VanDerWaalsContact C-N 3.34Å; F451-Y453 PolarHBondContact O-N 3.31Å; F451-F454 HydrophobicContact CE2-CD1 4.44Å; F451-F454 PolarHBondContact O-N 3.24Å; F451-A455 HydrophobicContact CE1-CB 4.4Å; F451-A455 VanDerWaalsContact O-CB 3.24Å; F451-A455 WeakPolarHBondContact O-CB 3.33Å; F451-A455 PolarHBondContact O-N 2.91Å; F451-Y564 AromaticContact CE2-CD2 3.76Å; F451-Y564 HydrophobicContact CE2-CD2 3.76Å; F451-Y564 HydrophobicContact CE2-CE2 4.04Å; F451-Y564 AromaticContact CZ-CD2 3.59Å; F451-Y564 HydrophobicContact CZ-CD2 3.59Å; F451-Y564 AromaticContact CZ-CE2 3.57Å; F451-Y564 HydrophobicContact CZ-CE2 3.57Å; F451-L568 HydrophobicContact CD2-CD1 3.98Å; F451-L568 HydrophobicContact CE1-CD1 4.04Å; F451-L568 HydrophobicContact CE2-CD1 3.85Å; F451-L568 HydrophobicContact CZ-CD1 3.27Å; F451-L568 HydrophobicContact CZ-CG 4.29Å; F451-L571 HydrophobicContact CD1-CD2 4.23Å; F451-L571 HydrophobicContact CE1-CD2 3.8Å; F451-L571 HydrophobicContact CE1-CG 4.25Å; F451-L572 HydrophobicContact CE1-CD2 3.85Å; F451-L572 HydrophobicContact CE1-CG 4.3Å; F451-L572 HydrophobicContact CE2-CD2 4.27Å; F451-L572 HydrophobicContact CZ-CD1 4.19Å; F451-L572 HydrophobicContact CZ-CD2 3.36Å; F451-L572 HydrophobicContact CZ-CG 3.65Å; F451-M575 HydrophobicContact CD1-CE 4.15Å; F451-M575 HydrophobicContact CD1-SD 4.26Å; F451-M575 HydrophobicContact CE1-CE 4.14Å; F451-M575 HydrophobicContact CE1-SD 3.85Å; F451-D724 WeakPolarHBondContact CA-OD2 3.45Å; F451-D724 HydrophobicContact CB-CB 4.3Å; F451-D724 WeakPolarHBondContact CB-OD2 3.32Å; F451-D724 HydrophobicContact CD1-CB 3.7Å; F451-D724 HydrophobicContact CD2-CB 3.73Å; F451-D724 HydrophobicContact CE1-CB 3.91Å; F451-D724 HydrophobicContact CE2-CB 3.93Å; F451-D724 HydrophobicContact CG-CB 3.62Å; F451-D724 VanDerWaalsContact CG-CG 3.45Å; F451-D724 VanDerWaalsContact CG-OD2 3.31Å; F451-D724 WeakPolarHBondContact CG-OD2 3.04Å; F451-D724 HydrophobicContact CZ-CB 4.03Å; F451-D724 PolarHBondContact N-OD2 3.13Å
452	R	84.2	Confident	83.5	Confident	141.5 Å²	141.5	48.5 Å²	48.5	53%	0.534	23%	0.23	S	C	.	.	H	α-helix	trans	-66.6	-37.8	176.2	-65.5	-63.7	-175.1	-167.9	-3.5	111.8	M411 L414 F449 P450 A455 A456	M411-R452 HydrophobicContact CE-CB 4.12Å; M411-R452 HydrophobicContact CE-CG 4.28Å; M411-R452 HydrophobicContact SD-CB 4.44Å; M411-R452 HydrophobicContact SD-CG 4.09Å; L414-R452 HydrophobicContact CD1-CB 3.93Å; F449-R452 HydrophobicContact CB-CG 4.14Å; F449-R452 VanDerWaalsContact O-CB 3.28Å; F449-R452 WeakPolarHBondContact O-CB 3.22Å; F449-R452 PolarHBondContact O-N 3.35Å; P450-R452 PolarHBondContact O-N 3.14Å; P450-R452 VanDerWaalsContact O-N 3.16Å; R452-A455 PolarHBondContact O-N 2.97Å; R452-A456 WeakPolarHBondContact O-CB 3.49Å; R452-A456 PolarHBondContact O-N 2.83Å; R452-A456 VanDerWaalsContact O-N 3.13Å
453	Y	89.7	Confident	83.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-69.6	-39.6	174.4	-60.6	-79.9	0	0	0	111.2	H410 L414 Q448 P450 F451 A456 F457 L524 A527 S531	H410-Y453 AromaticContact NE2-CE1 3.65Å; H410-Y453 AromaticContact NE2-CZ 3.74Å; H410-Y453 PolarHBondContact NE2-OH 3.04Å; H410-Y453 VanDerWaalsContact NE2-OH 3.11Å; L414-Y453 HydrophobicContact CD1-CD1 3.91Å; L414-Y453 HydrophobicContact CD1-CE1 3.77Å; L414-Y453 HydrophobicContact CD1-CG 4.27Å; L414-Y453 HydrophobicContact CD2-CD1 3.9Å; L414-Y453 HydrophobicContact CD2-CE1 4.06Å; L414-Y453 HydrophobicContact CG-CE1 4.36Å; Q448-Y453 HydrophobicContact CB-CE2 3.82Å; P450-Y453 WeakPolarHBondContact O-CB 3.42Å; P450-Y453 PolarHBondContact O-N 3.03Å; P450-Y453 VanDerWaalsContact O-N 3.09Å; F451-Y453 VanDerWaalsContact C-N 3.34Å; F451-Y453 PolarHBondContact O-N 3.31Å; Y453-A456 WeakPolarHBondContact O-CB 3.38Å; Y453-A456 PolarHBondContact O-N 3.11Å; Y453-F457 VanDerWaalsContact O-CB 3.3Å; Y453-F457 WeakPolarHBondContact O-CB 3.26Å; Y453-F457 PolarHBondContact O-N 3.13Å; Y453-L524 HydrophobicContact CD1-CD2 4.16Å; Y453-A527 HydrophobicContact CD1-CB 3.47Å; Y453-A527 VanDerWaalsContact CD1-CB 3.41Å; Y453-A527 HydrophobicContact CE1-CB 3.49Å; Y453-A527 HydrophobicContact CG-CB 4.24Å; Y453-S531 VanDerWaalsContact CE2-CB 3.47Å; Y453-S531 WeakPolarHBondContact CE2-OG 2.82Å
454	F	86.5	Confident	83.4	Confident	6 Å²	6	48.7 Å²	48.7	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-64.4	-42.5	174.5	-179.9	-113.2	0	0	0	112.9	P450 F451 A456 F457 D458 L528 Y564 I567 L571 L635	P450-F454 PolarHBondContact O-N 3.02Å; F451-F454 HydrophobicContact CE2-CD1 4.44Å; F451-F454 PolarHBondContact O-N 3.24Å; F454-A456 VanDerWaalsContact C-N 3.32Å; F454-A456 PolarHBondContact O-N 3.17Å; F454-F457 CarbonylContact O-C 3.6Å; F454-F457 WeakPolarHBondContact O-CA 3.31Å; F454-F457 WeakPolarHBondContact O-CB 3.29Å; F454-F457 PolarHBondContact O-N 3.4Å; F454-F457 VanDerWaalsContact O-N 3.14Å; F454-D458 PolarHBondContact O-N 2.95Å; F454-L528 HydrophobicContact CB-CD1 3.93Å; F454-Y564 HydrophobicContact CE1-CD1 4.17Å; F454-Y564 AromaticContact CE1-CD2 3.78Å; F454-Y564 HydrophobicContact CE1-CD2 3.78Å; F454-Y564 AromaticContact CE1-CG 3.59Å; F454-Y564 HydrophobicContact CE1-CG 3.59Å; F454-Y564 HydrophobicContact CZ-CG 4.28Å; F454-I567 HydrophobicContact CE2-CD1 4.48Å; F454-I567 HydrophobicContact CZ-CB 4.46Å; F454-I567 HydrophobicContact CZ-CD1 3.9Å; F454-I567 HydrophobicContact CZ-CG2 4.18Å; F454-L571 HydrophobicContact CB-CD2 4.14Å; F454-L571 HydrophobicContact CD1-CD2 3.74Å; F454-L571 HydrophobicContact CD2-CD2 4.1Å; F454-L571 HydrophobicContact CE1-CD2 4.12Å; F454-L571 HydrophobicContact CE2-CD2 4.27Å; F454-L571 HydrophobicContact CG-CD2 3.71Å; F454-L571 HydrophobicContact CZ-CD2 4.26Å; F454-L635 HydrophobicContact CB-CD2 4.02Å; F454-L635 HydrophobicContact CD2-CD2 3.55Å; F454-L635 VanDerWaalsContact CD2-CD2 3.49Å; F454-L635 HydrophobicContact CD2-CG 4.45Å; F454-L635 HydrophobicContact CE2-CD2 4.18Å; F454-L635 HydrophobicContact CG-CD2 4.16Å
455	A	84.8	Confident	83.4	Confident	38 Å²	38	48.8 Å²	48.8	31%	0.314	23%	0.226	S	C	.	.	H	α-helix	trans	-61.8	-42.4	175.7	0	0	0	0	0	111.2	F451 R452 F457 D458 T459	F451-A455 HydrophobicContact CE1-CB 4.4Å; F451-A455 VanDerWaalsContact O-CB 3.24Å; F451-A455 WeakPolarHBondContact O-CB 3.33Å; F451-A455 PolarHBondContact O-N 2.91Å; R452-A455 PolarHBondContact O-N 2.97Å; A455-F457 VanDerWaalsContact C-N 3.34Å; A455-D458 PolarHBondContact O-N 3.42Å; A455-T459 VanDerWaalsContact O-CG2 3.32Å; A455-T459 WeakPolarHBondContact O-CG2 3.18Å; A455-T459 PolarHBondContact O-N 3.38Å; A455-T459 VanDerWaalsContact O-N 3.07Å
456	A	89.8	Confident	83.6	Confident	4.5 Å²	4.5	44.1 Å²	44.1	4%	0.037	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-44.7	172.2	0	0	0	0	0	111.1	L414 L417 R452 Y453 F454 D458 T459 I460 L524	L414-A456 HydrophobicContact CB-CB 4.37Å; L414-A456 HydrophobicContact CD2-CB 4.22Å; L417-A456 HydrophobicContact CD1-CB 4.12Å; R452-A456 WeakPolarHBondContact O-CB 3.49Å; R452-A456 PolarHBondContact O-N 2.83Å; R452-A456 VanDerWaalsContact O-N 3.13Å; Y453-A456 WeakPolarHBondContact O-CB 3.38Å; Y453-A456 PolarHBondContact O-N 3.11Å; F454-A456 VanDerWaalsContact C-N 3.32Å; F454-A456 PolarHBondContact O-N 3.17Å; A456-D458 PolarHBondContact O-N 2.98Å; A456-T459 PolarHBondContact O-N 2.95Å; A456-T459 VanDerWaalsContact O-N 3.17Å; A456-T459 PolarHBondContact O-OG1 3.17Å; A456-I460 WeakPolarHBondContact O-CG1 3.17Å; A456-I460 PolarHBondContact O-N 2.74Å; A456-I460 VanDerWaalsContact O-N 3.08Å; A456-L524 HydrophobicContact CB-CD1 3.97Å; A456-L524 HydrophobicContact CB-CD2 3.92Å
457	F	90	Very high	84	Confident	19.5 Å²	19.5	43.7 Å²	43.7	9%	0.086	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-45.3	177.8	-179.9	-82.9	0	0	0	112	Y453 F454 A455 T459 I460 D461 K521 L524 L635 E636	Y453-F457 VanDerWaalsContact O-CB 3.3Å; Y453-F457 WeakPolarHBondContact O-CB 3.26Å; Y453-F457 PolarHBondContact O-N 3.13Å; F454-F457 CarbonylContact O-C 3.6Å; F454-F457 WeakPolarHBondContact O-CA 3.31Å; F454-F457 WeakPolarHBondContact O-CB 3.29Å; F454-F457 PolarHBondContact O-N 3.4Å; F454-F457 VanDerWaalsContact O-N 3.14Å; A455-F457 VanDerWaalsContact C-N 3.34Å; F457-T459 VanDerWaalsContact C-N 3.32Å; F457-T459 PolarHBondContact O-N 3.02Å; F457-I460 PolarHBondContact O-N 2.86Å; F457-D461 HydrophobicContact CE1-CB 4.39Å; F457-D461 WeakPolarHBondContact O-CB 3.43Å; F457-D461 PolarHBondContact O-N 2.99Å; F457-K521 HydrophobicContact CD2-CB 4.02Å; F457-K521 HydrophobicContact CD2-CG 4.08Å; F457-K521 WeakPolarHBondContact CD2-O 3.17Å; F457-K521 HydrophobicContact CE2-CB 3.64Å; F457-K521 HydrophobicContact CE2-CD 4.38Å; F457-K521 VanDerWaalsContact CE2-CE 3.43Å; F457-K521 HydrophobicContact CE2-CG 3.89Å; F457-K521 HydrophobicContact CZ-CB 4.43Å; F457-K521 HydrophobicContact CZ-CD 4.44Å; F457-K521 HydrophobicContact CZ-CG 4.44Å; F457-L524 HydrophobicContact CB-CB 4.4Å; F457-L524 HydrophobicContact CB-CD1 4.18Å; F457-L524 HydrophobicContact CD2-CB 4.37Å; F457-L635 HydrophobicContact CB-CD1 3.69Å; F457-L635 HydrophobicContact CD1-CB 4.16Å; F457-L635 HydrophobicContact CD1-CD1 4.35Å; F457-L635 HydrophobicContact CD2-CB 4.08Å; F457-L635 HydrophobicContact CD2-CD1 3.74Å; F457-L635 HydrophobicContact CE1-CB 4.05Å; F457-L635 HydrophobicContact CE1-CD1 4.31Å; F457-L635 HydrophobicContact CE2-CB 3.94Å; F457-L635 HydrophobicContact CE2-CD1 4.05Å; F457-L635 HydrophobicContact CG-CB 4.17Å; F457-L635 HydrophobicContact CG-CD1 3.89Å; F457-L635 HydrophobicContact CZ-CB 3.91Å; F457-L635 HydrophobicContact CZ-CD1 4.03Å; F457-E636 HydrophobicContact CZ-CB 4.17Å; F457-E636 VanDerWaalsContact CZ-OE2 3.3Å; F457-E636 WeakPolarHBondContact CZ-OE2 3.38Å
458	D	86.1	Confident	84.3	Confident	26 Å²	26	40.9 Å²	40.9	14%	0.139	19%	0.188	C	C	.	.	H	α-helix	trans	-64.6	-35.7	177.1	-172.9	60.8	0	0	0	111.8	F454 A455 A456 I460 D461 R462 R465 S563 K639	F454-D458 PolarHBondContact O-N 2.95Å; A455-D458 PolarHBondContact O-N 3.42Å; A456-D458 PolarHBondContact O-N 2.98Å; D458-I460 VanDerWaalsContact C-N 3.34Å; D458-I460 PolarHBondContact O-N 3.48Å; D458-D461 PolarHBondContact O-N 3.03Å; D458-R462 VanDerWaalsContact O-CB 3.31Å; D458-R462 WeakPolarHBondContact O-CB 3.19Å; D458-R462 PolarHBondContact O-N 3.21Å; D458-R465 IonicContact OD1-NH2 3.06Å; D458-S563 PolarHBondContact OD1-OG 3.22Å; D458-S563 PolarHBondContact OD2-OG 2.85Å; D458-K639 IonicContact OD1-NZ 2.56Å; D458-K639 PolarHBondContact OD1-NZ 3.09Å
459	T	86.7	Confident	84.2	Confident	57.5 Å²	57.5	46.8 Å²	46.8	35%	0.353	21%	0.21	S	C	.	.	H	α-helix	trans	-64.3	-38.6	174.1	62.9	0	0	0	0	112.6	A455 A456 F457 L463	A455-T459 VanDerWaalsContact O-CG2 3.32Å; A455-T459 WeakPolarHBondContact O-CG2 3.18Å; A455-T459 PolarHBondContact O-N 3.38Å; A455-T459 VanDerWaalsContact O-N 3.07Å; A456-T459 PolarHBondContact O-N 2.95Å; A456-T459 VanDerWaalsContact O-N 3.17Å; A456-T459 PolarHBondContact O-OG1 3.17Å; F457-T459 VanDerWaalsContact C-N 3.32Å; F457-T459 PolarHBondContact O-N 3.02Å; T459-L463 WeakPolarHBondContact O-CB 3.28Å; T459-L463 PolarHBondContact O-N 3.27Å; T459-L463 VanDerWaalsContact O-N 3.09Å
460	I	89.2	Confident	84	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-72.7	-39.6	176.4	-60.9	-109.5	0	0	0	110.7	L417 L421 A456 F457 D458 R462 L463 K464 L517 Y520 K521 L524	L417-I460 HydrophobicContact CB-CD1 4.16Å; L417-I460 HydrophobicContact CD1-CD1 4Å; L421-I460 HydrophobicContact CD1-CD1 3.78Å; L421-I460 HydrophobicContact CD1-CG1 4.26Å; A456-I460 WeakPolarHBondContact O-CG1 3.17Å; A456-I460 PolarHBondContact O-N 2.74Å; A456-I460 VanDerWaalsContact O-N 3.08Å; F457-I460 PolarHBondContact O-N 2.86Å; D458-I460 VanDerWaalsContact C-N 3.34Å; D458-I460 PolarHBondContact O-N 3.48Å; I460-R462 VanDerWaalsContact C-N 3.34Å; I460-R462 PolarHBondContact O-N 3.4Å; I460-L463 CarbonylContact O-C 3.55Å; I460-L463 WeakPolarHBondContact O-CB 3.24Å; I460-L463 PolarHBondContact O-N 2.99Å; I460-K464 PolarHBondContact O-N 3.26Å; I460-L517 HydrophobicContact CG2-CB 4.31Å; I460-L517 HydrophobicContact CG2-CD2 3.96Å; I460-Y520 HydrophobicContact CD1-CD1 4.08Å; I460-Y520 HydrophobicContact CD1-CG 4.24Å; I460-K521 HydrophobicContact CB-CG 4.38Å; I460-K521 HydrophobicContact CG2-CD 4.41Å; I460-K521 HydrophobicContact CG2-CG 3.82Å; I460-L524 HydrophobicContact CD1-CD1 3.7Å; I460-L524 HydrophobicContact CG1-CD1 4.11Å
461	D	85.7	Confident	83.9	Confident	17.5 Å²	17.5	53 Å²	53	9%	0.094	23%	0.234	C	C	.	.	H	α-helix	trans	-65.8	-38.6	177.3	-167.5	72.4	0	0	0	112	F457 D458 K464 R465 K521 K639	F457-D461 HydrophobicContact CE1-CB 4.39Å; F457-D461 WeakPolarHBondContact O-CB 3.43Å; F457-D461 PolarHBondContact O-N 2.99Å; D458-D461 PolarHBondContact O-N 3.03Å; D461-K464 WeakPolarHBondContact O-CB 3.49Å; D461-K464 PolarHBondContact O-N 3.13Å; D461-R465 WeakPolarHBondContact O-CG 3.38Å; D461-R465 PolarHBondContact O-N 3.08Å; D461-R465 IonicContact OD2-CZ 2.76Å; D461-R465 IonicContact OD2-NE 3.79Å; D461-R465 PolarHBondContact OD2-NE 3.09Å; D461-R465 IonicContact OD2-NH2 2.89Å; D461-R465 PolarHBondContact OD2-NH2 2.91Å; D461-K521 WeakPolarHBondContact OD1-CE 3.19Å; D461-K521 IonicContact OD1-NZ 3.36Å; D461-K521 PolarHBondContact OD1-NZ 2.89Å; D461-K639 WeakPolarHBondContact OD2-CE 3.47Å; D461-K639 IonicContact OD2-NZ 3.95Å; D461-K639 PolarHBondContact OD2-NZ 3.32Å
462	R	85	Confident	83.5	Confident	145 Å²	145	57.2 Å²	57.2	55%	0.547	25%	0.252	S	S	.	.	H	α-helix	trans	-63.2	-43.2	170.6	-173.9	175.9	-178.6	157.9	2.5	111.5	D458 I460 K464 R465 D466	D458-R462 VanDerWaalsContact O-CB 3.31Å; D458-R462 WeakPolarHBondContact O-CB 3.19Å; D458-R462 PolarHBondContact O-N 3.21Å; I460-R462 VanDerWaalsContact C-N 3.34Å; I460-R462 PolarHBondContact O-N 3.4Å; R462-K464 VanDerWaalsContact C-N 3.29Å; R462-K464 PolarHBondContact O-N 3.1Å; R462-R465 WeakPolarHBondContact O-CB 3.32Å; R462-R465 PolarHBondContact O-N 3.14Å; R462-R465 VanDerWaalsContact O-N 3.14Å; R462-D466 VanDerWaalsContact O-CG 3.24Å; R462-D466 PolarHBondContact O-N 3.1Å
463	L	85.5	Confident	82.9	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-58.6	-42.2	175.1	-174.7	67.3	0	0	0	111.4	R418 L421 L422 T459 I460 R465 D466 L467 F509 L517	R418-L463 HydrophobicContact CG-CD1 4.5Å; R418-L463 HydrophobicContact CG-CD2 4.48Å; L421-L463 HydrophobicContact CB-CD2 4.17Å; L421-L463 HydrophobicContact CD1-CD2 4.2Å; L422-L463 HydrophobicContact CD1-CD1 4.24Å; L422-L463 HydrophobicContact CD2-CD1 4.02Å; L422-L463 HydrophobicContact CG-CD1 4.23Å; T459-L463 WeakPolarHBondContact O-CB 3.28Å; T459-L463 PolarHBondContact O-N 3.27Å; T459-L463 VanDerWaalsContact O-N 3.09Å; I460-L463 CarbonylContact O-C 3.55Å; I460-L463 WeakPolarHBondContact O-CB 3.24Å; I460-L463 PolarHBondContact O-N 2.99Å; L463-R465 VanDerWaalsContact C-N 3.34Å; L463-R465 PolarHBondContact O-N 2.92Å; L463-D466 PolarHBondContact O-N 3.16Å; L463-L467 HydrophobicContact CG-CD1 4.26Å; L463-L467 WeakPolarHBondContact O-CB 3.3Å; L463-L467 WeakPolarHBondContact O-CD1 3.34Å; L463-L467 WeakPolarHBondContact O-CG 3.45Å; L463-L467 PolarHBondContact O-N 3.34Å; L463-F509 HydrophobicContact CD1-CD1 4.25Å; L463-F509 HydrophobicContact CD1-CE1 3.76Å; L463-L517 HydrophobicContact CD2-CD2 3.82Å; L463-L517 HydrophobicContact CG-CD2 4.41Å
464	K	85.9	Confident	81.8	Confident	43.5 Å²	43.5	54.5 Å²	54.5	19%	0.189	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-40.9	174.8	-168.2	177.8	-173	176.6	0	112.4	I460 D461 R462 L467 H468 F514 L517 D518	I460-K464 PolarHBondContact O-N 3.26Å; D461-K464 WeakPolarHBondContact O-CB 3.49Å; D461-K464 PolarHBondContact O-N 3.13Å; R462-K464 VanDerWaalsContact C-N 3.29Å; R462-K464 PolarHBondContact O-N 3.1Å; K464-L467 WeakPolarHBondContact O-CB 3.39Å; K464-L467 PolarHBondContact O-N 3.12Å; K464-H468 PolarHBondContact O-CD2 3.05Å; K464-H468 PolarHBondContact O-N 3.27Å; K464-F514 HydrophobicContact CG-CD1 3.97Å; K464-F514 HydrophobicContact CG-CE1 4.08Å; K464-L517 HydrophobicContact CB-CD1 3.99Å; K464-L517 HydrophobicContact CG-CD1 4.16Å; K464-D518 IonicContact NZ-OD1 3.37Å; K464-D518 PolarHBondContact NZ-OD1 3.37Å; K464-D518 IonicContact NZ-OD2 3.5Å; K464-D518 PolarHBondContact NZ-OD2 2.97Å
465	R	82.6	Confident	80.8	Confident	85.5 Å²	85.5	62.6 Å²	62.6	32%	0.323	28%	0.279	S	S	.	.	H	α-helix	trans	-67.4	-44.8	175.7	-71.5	-176.9	-107.7	161.1	0.1	112.3	D458 D461 R462 L463 L467 H468 Y469	D458-R465 IonicContact OD1-NH2 3.06Å; D461-R465 WeakPolarHBondContact O-CG 3.38Å; D461-R465 PolarHBondContact O-N 3.08Å; D461-R465 IonicContact OD2-CZ 2.76Å; D461-R465 IonicContact OD2-NE 3.79Å; D461-R465 PolarHBondContact OD2-NE 3.09Å; D461-R465 IonicContact OD2-NH2 2.89Å; D461-R465 PolarHBondContact OD2-NH2 2.91Å; R462-R465 WeakPolarHBondContact O-CB 3.32Å; R462-R465 PolarHBondContact O-N 3.14Å; R462-R465 VanDerWaalsContact O-N 3.14Å; L463-R465 VanDerWaalsContact C-N 3.34Å; L463-R465 PolarHBondContact O-N 2.92Å; R465-L467 PolarHBondContact O-N 3.12Å; R465-H468 WeakPolarHBondContact O-CB 3.32Å; R465-H468 PolarHBondContact O-N 2.92Å; R465-H468 VanDerWaalsContact O-N 3.14Å; R465-Y469 WeakPolarHBondContact O-CB 3.3Å; R465-Y469 PolarHBondContact O-N 3.22Å
466	D	81.7	Confident	80	Confident	56.5 Å²	56.5	63.2 Å²	63.2	30%	0.302	28%	0.279	S	S	.	.	H	α-helix	trans	-59.1	-41.2	176.2	-67.9	-14.6	0	0	0	110	R462 L463 Y469 H470 F509	R462-D466 VanDerWaalsContact O-CG 3.24Å; R462-D466 PolarHBondContact O-N 3.1Å; L463-D466 PolarHBondContact O-N 3.16Å; D466-Y469 PolarHBondContact O-N 3.45Å; D466-H470 WeakPolarHBondContact O-CB 3.32Å; D466-H470 PolarHBondContact O-CD2 3.38Å; D466-H470 PolarHBondContact O-N 2.97Å; D466-F509 HydrophobicContact CB-CE1 3.97Å; D466-F509 HydrophobicContact CB-CZ 4.4Å
467	L	82	Confident	78.7	Confident	10 Å²	10	64.8 Å²	64.8	5%	0.052	29%	0.288	C	S	.	.	H	α-helix	trans	-63.6	-45.3	173.9	-119.5	156.7	0	0	0	112.7	L463 K464 R465 Y469 H470 R471 F509 C512 F514 L517	L463-L467 HydrophobicContact CG-CD1 4.26Å; L463-L467 WeakPolarHBondContact O-CB 3.3Å; L463-L467 WeakPolarHBondContact O-CD1 3.34Å; L463-L467 WeakPolarHBondContact O-CG 3.45Å; L463-L467 PolarHBondContact O-N 3.34Å; K464-L467 WeakPolarHBondContact O-CB 3.39Å; K464-L467 PolarHBondContact O-N 3.12Å; R465-L467 PolarHBondContact O-N 3.12Å; L467-Y469 VanDerWaalsContact C-N 3.34Å; L467-Y469 PolarHBondContact O-N 2.9Å; L467-H470 PolarHBondContact O-N 3.29Å; L467-R471 WeakPolarHBondContact O-CB 3.31Å; L467-R471 PolarHBondContact O-N 3.04Å; L467-F509 WeakPolarHBondContact CD1-O 3.42Å; L467-F509 HydrophobicContact CD2-CB 3.76Å; L467-F509 HydrophobicContact CD2-CD1 3.69Å; L467-F509 HydrophobicContact CD2-CG 4.22Å; L467-F509 WeakPolarHBondContact CD2-O 3.49Å; L467-F509 HydrophobicContact CG-CD1 3.91Å; L467-C512 HydrophobicContact CD1-CB 3.77Å; L467-C512 WeakPolarHBondContact CD1-O 3.5Å; L467-C512 HydrophobicContact CD2-CB 4.25Å; L467-F514 HydrophobicContact CB-CE1 4.08Å; L467-F514 HydrophobicContact CB-CZ 4.39Å; L467-F514 HydrophobicContact CD2-CD1 4.28Å; L467-F514 HydrophobicContact CD2-CD2 4.37Å; L467-F514 HydrophobicContact CD2-CE1 3.61Å; L467-F514 HydrophobicContact CD2-CE2 3.73Å; L467-F514 HydrophobicContact CD2-CZ 3.3Å; L467-L517 HydrophobicContact CD1-CD1 3.79Å
468	H	79.2	Confident	77.2	Confident	102.5 Å²	102.5	67.7 Å²	67.7	48%	0.475	31%	0.307	S	S	.	.	H	α-helix	trans	-60.4	-46.5	175.9	-131.1	-69.5	0	0	0	112	K464 R465 H470 R471 F472 F514	K464-H468 PolarHBondContact O-CD2 3.05Å; K464-H468 PolarHBondContact O-N 3.27Å; R465-H468 WeakPolarHBondContact O-CB 3.32Å; R465-H468 PolarHBondContact O-N 2.92Å; R465-H468 VanDerWaalsContact O-N 3.14Å; H468-H470 VanDerWaalsContact C-N 3.27Å; H468-H470 PolarHBondContact O-N 3.42Å; H468-R471 PolarHBondContact O-N 3.45Å; H468-F472 WeakPolarHBondContact O-CB 3.46Å; H468-F472 PolarHBondContact O-N 3.09Å; H468-F514 AromaticContact CD2-CE1 3.52Å; H468-F514 AromaticContact CD2-CZ 3.93Å; H468-F514 AromaticContact CE1-CE1 3.71Å; H468-F514 AromaticContact CE1-CZ 3.52Å; H468-F514 AromaticContact CG-CE1 3.91Å; H468-F514 AromaticContact CG-CZ 3.87Å; H468-F514 AromaticContact ND1-CZ 3.63Å; H468-F514 AromaticContact NE2-CE1 3.4Å; H468-F514 WeakPolarHBondContact NE2-CE1 3.43Å; H468-F514 AromaticContact NE2-CZ 3.74Å
469	Y	75.7	Confident	75.7	Confident	159 Å²	159	70.3 Å²	70.3	62%	0.624	32%	0.324	S	S	*	.	H	α-helix	trans	-60.2	-45.6	176.3	178.9	-100.4	0	0	0	110.9	R465 D466 L467 R471 F472 V473	R465-Y469 WeakPolarHBondContact O-CB 3.3Å; R465-Y469 PolarHBondContact O-N 3.22Å; D466-Y469 PolarHBondContact O-N 3.45Å; L467-Y469 VanDerWaalsContact C-N 3.34Å; L467-Y469 PolarHBondContact O-N 2.9Å; Y469-R471 PolarHBondContact O-N 3.38Å; Y469-F472 WeakPolarHBondContact O-CB 3.09Å; Y469-F472 PolarHBondContact O-N 3.09Å; Y469-V473 HydrophobicContact CD1-CG2 4.17Å; Y469-V473 HydrophobicContact CD2-CG2 4.39Å; Y469-V473 HydrophobicContact CE1-CG2 3.76Å; Y469-V473 HydrophobicContact CE2-CG2 4.13Å; Y469-V473 HydrophobicContact CG-CG2 4.47Å; Y469-V473 WeakPolarHBondContact O-CG2 3.34Å; Y469-V473 PolarHBondContact O-N 3.45Å
470	H	73.5	Confident	74.2	Confident	48 Å²	48	72.3 Å²	72.3	22%	0.222	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-43.7	177.5	-129.2	-76.9	0	0	0	112.8	D466 L467 H468 F472 V473 M474 I506	D466-H470 WeakPolarHBondContact O-CB 3.32Å; D466-H470 PolarHBondContact O-CD2 3.38Å; D466-H470 PolarHBondContact O-N 2.97Å; L467-H470 PolarHBondContact O-N 3.29Å; H468-H470 VanDerWaalsContact C-N 3.27Å; H468-H470 PolarHBondContact O-N 3.42Å; H470-F472 VanDerWaalsContact C-N 3.31Å; H470-F472 PolarHBondContact O-N 3.25Å; H470-V473 PolarHBondContact O-N 2.75Å; H470-M474 WeakPolarHBondContact O-CB 3.44Å; H470-M474 VanDerWaalsContact O-CG 3.27Å; H470-M474 WeakPolarHBondContact O-CG 3.32Å; H470-M474 PolarHBondContact O-N 3.26Å; H470-I506 WeakPolarHBondContact CE1-CG1 3.11Å; H470-I506 VanDerWaalsContact NE2-CA 3.31Å; H470-I506 WeakPolarHBondContact NE2-CA 3.22Å; H470-I506 WeakPolarHBondContact NE2-CG1 3.43Å
471	R	77	Confident	72.6	Confident	117.5 Å²	117.5	77.5 Å²	77.5	44%	0.443	36%	0.361	S	S	.	.	H	α-helix	trans	-66.2	-33.7	177.4	-144.3	169.9	-174.2	152.5	-0.5	111.6	L467 H468 Y469 R475 F514	L467-R471 WeakPolarHBondContact O-CB 3.31Å; L467-R471 PolarHBondContact O-N 3.04Å; H468-R471 PolarHBondContact O-N 3.45Å; Y469-R471 PolarHBondContact O-N 3.38Å; R471-R475 WeakPolarHBondContact O-CG 3.4Å; R471-R475 PolarHBondContact O-N 3.19Å; R471-R475 VanDerWaalsContact O-N 3.09Å; R471-F514 VanDerWaalsContact NH1-CD2 3.27Å; R471-F514 VanDerWaalsContact NH1-CE2 3.31Å
472	F	73.3	Confident	71.1	Confident	122.5 Å²	122.5	83.3 Å²	83.3	54%	0.537	39%	0.391	S	S	.	.	H	α-helix	trans	-66.1	-51.6	171.4	175.1	-95.7	0	0	0	111.8	H468 Y469 H470 M474 R475 T476	H468-F472 WeakPolarHBondContact O-CB 3.46Å; H468-F472 PolarHBondContact O-N 3.09Å; Y469-F472 WeakPolarHBondContact O-CB 3.09Å; Y469-F472 PolarHBondContact O-N 3.09Å; H470-F472 VanDerWaalsContact C-N 3.31Å; H470-F472 PolarHBondContact O-N 3.25Å; F472-M474 VanDerWaalsContact C-N 3.29Å; F472-M474 PolarHBondContact O-N 3.36Å; F472-R475 WeakPolarHBondContact O-CB 3.3Å; F472-R475 PolarHBondContact O-N 3.31Å; F472-R475 VanDerWaalsContact O-N 3.12Å; F472-T476 HydrophobicContact CD1-CG2 4.37Å; F472-T476 HydrophobicContact CE1-CG2 3.99Å; F472-T476 HydrophobicContact CE2-CG2 4.21Å; F472-T476 HydrophobicContact CZ-CG2 3.86Å; F472-T476 PolarHBondContact O-N 3.05Å; F472-T476 PolarHBondContact O-OG1 3.34Å
473	V	70.8	Confident	69.6	Low	29.5 Å²	29.5	84.9 Å²	84.9	18%	0.179	40%	0.402	C	S	.	.	H	α-helix	trans	-57.2	-43.6	176.9	171.7	0	0	0	0	110.6	Y469 H470 R475 T476 T477 M502	Y469-V473 HydrophobicContact CD1-CG2 4.17Å; Y469-V473 HydrophobicContact CD2-CG2 4.39Å; Y469-V473 HydrophobicContact CE1-CG2 3.76Å; Y469-V473 HydrophobicContact CE2-CG2 4.13Å; Y469-V473 HydrophobicContact CG-CG2 4.47Å; Y469-V473 WeakPolarHBondContact O-CG2 3.34Å; Y469-V473 PolarHBondContact O-N 3.45Å; H470-V473 PolarHBondContact O-N 2.75Å; V473-R475 VanDerWaalsContact C-N 3.35Å; V473-R475 PolarHBondContact O-N 2.89Å; V473-T476 WeakPolarHBondContact CA-OG1 3.1Å; V473-T476 PolarHBondContact O-N 2.83Å; V473-T476 VanDerWaalsContact O-N 3.1Å; V473-T476 PolarHBondContact O-OG1 3.16Å; V473-T477 HydrophobicContact CG1-CG2 3.97Å; V473-T477 WeakPolarHBondContact O-CB 3.28Å; V473-T477 VanDerWaalsContact O-CG2 3.26Å; V473-T477 WeakPolarHBondContact O-CG2 3.2Å; V473-T477 PolarHBondContact O-N 3.05Å; V473-T477 PolarHBondContact O-OG1 2.88Å; V473-M502 HydrophobicContact CG1-CE 4.07Å
474	M	67.7	Low	68	Low	55.5 Å²	55.5	92.4 Å²	92.4	27%	0.273	43%	0.43	S	S	.	.	H	α-helix	trans	-61.4	-41.6	176.9	-72.6	-68	-99.6	0	0	112.7	H470 F472 T477 V478 I506 L510	H470-M474 WeakPolarHBondContact O-CB 3.44Å; H470-M474 VanDerWaalsContact O-CG 3.27Å; H470-M474 WeakPolarHBondContact O-CG 3.32Å; H470-M474 PolarHBondContact O-N 3.26Å; F472-M474 VanDerWaalsContact C-N 3.29Å; F472-M474 PolarHBondContact O-N 3.36Å; M474-T477 WeakPolarHBondContact CA-OG1 3.47Å; M474-T477 PolarHBondContact O-OG1 3.21Å; M474-V478 VanDerWaalsContact O-CB 3.26Å; M474-V478 WeakPolarHBondContact O-CB 3.18Å; M474-V478 WeakPolarHBondContact O-CG2 3.36Å; M474-V478 PolarHBondContact O-N 2.98Å; M474-I506 HydrophobicContact CE-CB 4.27Å; M474-I506 HydrophobicContact CE-CD1 3.86Å; M474-I506 HydrophobicContact CE-CG1 3.83Å; M474-I506 HydrophobicContact CE-CG2 3.76Å; M474-I506 HydrophobicContact CG-CD1 4.34Å; M474-I506 HydrophobicContact SD-CD1 3.58Å; M474-I506 VanDerWaalsContact SD-CD1 3.58Å; M474-I506 HydrophobicContact SD-CG1 3.91Å; M474-L510 HydrophobicContact CE-CD1 4.25Å
475	R	65.8	Low	65.9	Low	176 Å²	176	99.6 Å²	99.6	66%	0.664	46%	0.462	S	S	*	.	H	α-helix	trans	-61.3	-46.1	174.7	-78.8	177.7	174.9	150.7	-2.1	111.1	R471 F472 V473 T479	R471-R475 WeakPolarHBondContact O-CG 3.4Å; R471-R475 PolarHBondContact O-N 3.19Å; R471-R475 VanDerWaalsContact O-N 3.09Å; F472-R475 WeakPolarHBondContact O-CB 3.3Å; F472-R475 PolarHBondContact O-N 3.31Å; F472-R475 VanDerWaalsContact O-N 3.12Å; V473-R475 VanDerWaalsContact C-N 3.35Å; V473-R475 PolarHBondContact O-N 2.89Å; R475-T479 PolarHBondContact O-N 2.9Å; R475-T479 PolarHBondContact O-OG1 3.05Å
476	T	67.6	Low	64.1	Low	51 Å²	51	105.2 Å²	105.2	31%	0.313	49%	0.488	S	S	.	.	H	α-helix	trans	-68.2	-43.1	-179.3	57.5	0	0	0	0	112.7	F472 V473 T479 E480	F472-T476 HydrophobicContact CD1-CG2 4.37Å; F472-T476 HydrophobicContact CE1-CG2 3.99Å; F472-T476 HydrophobicContact CE2-CG2 4.21Å; F472-T476 HydrophobicContact CZ-CG2 3.86Å; F472-T476 PolarHBondContact O-N 3.05Å; F472-T476 PolarHBondContact O-OG1 3.34Å; V473-T476 WeakPolarHBondContact CA-OG1 3.1Å; V473-T476 PolarHBondContact O-N 2.83Å; V473-T476 VanDerWaalsContact O-N 3.1Å; V473-T476 PolarHBondContact O-OG1 3.16Å; T476-T479 VanDerWaalsContact C-OG1 3.28Å; T476-T479 VanDerWaalsContact CA-OG1 3.31Å; T476-T479 WeakPolarHBondContact CA-OG1 3.36Å; T476-T479 PolarHBondContact O-N 3.03Å; T476-T479 PolarHBondContact O-OG1 2.93Å; T476-E480 PolarHBondContact O-N 2.91Å
477	T	62.2	Low	62.8	Low	37.5 Å²	37.5	106.2 Å²	106.2	23%	0.23	50%	0.496	C	S	.	.	H	α-helix	trans	-69.7	-39.8	179.6	54.9	0	0	0	0	111.9	V473 M474 T479 E480 V481 M502	V473-T477 HydrophobicContact CG1-CG2 3.97Å; V473-T477 WeakPolarHBondContact O-CB 3.28Å; V473-T477 VanDerWaalsContact O-CG2 3.26Å; V473-T477 WeakPolarHBondContact O-CG2 3.2Å; V473-T477 PolarHBondContact O-N 3.05Å; V473-T477 PolarHBondContact O-OG1 2.88Å; M474-T477 WeakPolarHBondContact CA-OG1 3.47Å; M474-T477 PolarHBondContact O-OG1 3.21Å; T477-T479 VanDerWaalsContact C-N 3.32Å; T477-T479 PolarHBondContact O-N 3.09Å; T477-E480 PolarHBondContact O-N 3.35Å; T477-V481 WeakPolarHBondContact O-CB 3.26Å; T477-V481 WeakPolarHBondContact O-CG2 3.33Å; T477-V481 PolarHBondContact O-N 3.01Å; T477-M502 HydrophobicContact CG2-CE 4.26Å
478	V	57.5	Low	61.8	Low	80.5 Å²	80.5	109.7 Å²	109.7	49%	0.488	52%	0.518	S	S	.	.	H	α-helix	trans	-62.9	-42.2	174.4	171.3	0	0	0	0	110.4	M474 E480 V481 L482	M474-V478 VanDerWaalsContact O-CB 3.26Å; M474-V478 WeakPolarHBondContact O-CB 3.18Å; M474-V478 WeakPolarHBondContact O-CG2 3.36Å; M474-V478 PolarHBondContact O-N 2.98Å; V478-E480 PolarHBondContact O-N 3.08Å; V478-V481 PolarHBondContact O-N 2.93Å; V478-L482 HydrophobicContact CG1-CD1 3.88Å; V478-L482 HydrophobicContact CG1-CG 4.39Å; V478-L482 WeakPolarHBondContact O-CB 3.31Å; V478-L482 WeakPolarHBondContact O-CG 3.48Å; V478-L482 PolarHBondContact O-N 3.03Å; V478-L482 VanDerWaalsContact O-N 3.07Å
479	T	54.9	Low	61.1	Low	79.5 Å²	79.5	110.1 Å²	110.1	49%	0.488	53%	0.53	S	S	.	.	H	α-helix	trans	-65.5	-35	174.3	39.3	0	0	0	0	113.9	R475 T476 T477 K483	R475-T479 PolarHBondContact O-N 2.9Å; R475-T479 PolarHBondContact O-OG1 3.05Å; T476-T479 VanDerWaalsContact C-OG1 3.28Å; T476-T479 VanDerWaalsContact CA-OG1 3.31Å; T476-T479 WeakPolarHBondContact CA-OG1 3.36Å; T476-T479 PolarHBondContact O-N 3.03Å; T476-T479 PolarHBondContact O-OG1 2.93Å; T477-T479 VanDerWaalsContact C-N 3.32Å; T477-T479 PolarHBondContact O-N 3.09Å; T479-K483 WeakPolarHBondContact O-CG 3.34Å; T479-K483 PolarHBondContact O-N 3.17Å
480	E	55.7	Low	60.4	Low	101 Å²	101	113.4 Å²	113.4	47%	0.472	54%	0.541	S	S	.	.	H	α-helix	trans	-74.7	-39.4	176.7	-80.5	-167.2	167.7	0	0	112.7	T476 T477 V478 L482 K483 R484	T476-E480 PolarHBondContact O-N 2.91Å; T477-E480 PolarHBondContact O-N 3.35Å; V478-E480 PolarHBondContact O-N 3.08Å; E480-L482 VanDerWaalsContact C-N 3.35Å; E480-K483 PolarHBondContact O-N 3.17Å; E480-R484 PolarHBondContact O-N 2.89Å; E480-R484 VanDerWaalsContact O-N 3.12Å; E480-R484 IonicContact OE1-NH2 2.73Å; E480-R484 IonicContact OE2-CZ 3.85Å; E480-R484 IonicContact OE2-NH1 2.79Å; E480-R484 PolarHBondContact OE2-NH1 3.41Å; E480-R484 IonicContact OE2-NH2 2.66Å
481	V	55.3	Low	59.7	Low	109 Å²	109	116.4 Å²	116.4	66%	0.661	56%	0.555	S	S	*	*	H	α-helix	trans	-66.6	-40	178.2	171.4	0	0	0	0	110.6	T477 V478 K483 R484	T477-V481 WeakPolarHBondContact O-CB 3.26Å; T477-V481 WeakPolarHBondContact O-CG2 3.33Å; T477-V481 PolarHBondContact O-N 3.01Å; V478-V481 PolarHBondContact O-N 2.93Å; V481-K483 VanDerWaalsContact C-N 3.28Å; V481-K483 PolarHBondContact O-N 2.77Å; V481-R484 PolarHBondContact O-N 3.12Å
482	L	54.2	Low	59	Low	138.5 Å²	138.5	114.9 Å²	114.9	73%	0.725	56%	0.556	S	S	*	*	H	α-helix	trans	-64	-24.9	174.2	-73.9	168.8	0	0	0	113.2	V478 E480	V478-L482 HydrophobicContact CG1-CD1 3.88Å; V478-L482 HydrophobicContact CG1-CG 4.39Å; V478-L482 WeakPolarHBondContact O-CB 3.31Å; V478-L482 WeakPolarHBondContact O-CG 3.48Å; V478-L482 PolarHBondContact O-N 3.03Å; V478-L482 VanDerWaalsContact O-N 3.07Å; E480-L482 VanDerWaalsContact C-N 3.35Å
483	K	53.6	Low	58.6	Low	179 Å²	179	116.7 Å²	116.7	78%	0.778	56%	0.563	S	S	*	*	H	α-helix	trans	-87.3	-21.2	178.8	-75.7	-177.6	177.9	-174.7	0	114.2	T479 E480 V481 K485	T479-K483 WeakPolarHBondContact O-CG 3.34Å; T479-K483 PolarHBondContact O-N 3.17Å; E480-K483 PolarHBondContact O-N 3.17Å; V481-K483 VanDerWaalsContact C-N 3.28Å; V481-K483 PolarHBondContact O-N 2.77Å; K483-K485 PolarHBondContact O-N 3.02Å
484	R	50.9	Low	58.2	Low	159 Å²	159	122.5 Å²	122.5	60%	0.6	59%	0.586	S	S	*	*			trans	-91.7	81.7	-176	-73.4	-176.4	176.9	134.6	4.9	112	E480 V481 K486	E480-R484 PolarHBondContact O-N 2.89Å; E480-R484 VanDerWaalsContact O-N 3.12Å; E480-R484 IonicContact OE1-NH2 2.73Å; E480-R484 IonicContact OE2-CZ 3.85Å; E480-R484 IonicContact OE2-NH1 2.79Å; E480-R484 PolarHBondContact OE2-NH1 3.41Å; E480-R484 IonicContact OE2-NH2 2.66Å; V481-R484 PolarHBondContact O-N 3.12Å; R484-K486 PolarHBondContact O-N 3.14Å
485	K	43.1	Very low	57.7	Low	194 Å²	194	122.5 Å²	122.5	84%	0.843	59%	0.592	S	S	*	*			trans	-78.9	124.9	158.4	-76.5	-176.9	176.2	179	0	108.7	K483	K483-K485 PolarHBondContact O-N 3.02Å
486	K	45.1	Very low	57.5	Low	204 Å²	204	119 Å²	119	89%	0.887	58%	0.583	S	S	*	*			trans	89.1	102	176.1	-53.8	179.8	179.8	-177.5	0	115.5	R484	R484-K486 PolarHBondContact O-N 3.14Å
487	T	54.3	Low	57.3	Low	76.5 Å²	76.5	125 Å²	125	47%	0.469	60%	0.6	S	S	.	*			trans	-145	150	169.9	35.1	0	0	0	0	112
488	T	60	Low	57	Low	84 Å²	84	126.9 Å²	126.9	52%	0.515	61%	0.608	S	S	.	*			trans	-82.4	161.2	-168.7	54.1	0	0	0	0	113.8	R490 Q491 L492	T488-R490 VanDerWaalsContact C-N 3.31Å; T488-R490 PolarHBondContact O-N 3.16Å; T488-R490 VanDerWaalsContact O-N 3.12Å; T488-Q491 WeakPolarHBondContact O-CB 3.01Å; T488-Q491 PolarHBondContact O-N 3.04Å; T488-Q491 PolarHBondContact OG1-OE1 3.48Å; T488-L492 PolarHBondContact O-N 2.89Å
489	P	64.9	Low	57	Low	110.5 Å²	110.5	127.6 Å²	127.6	72%	0.718	61%	0.606	S	S	*	*	H	α-helix	trans	-58.2	-33.2	-172.4	-25.2	33.4	0	0	0	115.3	Q491 L492 K493	P489-Q491 VanDerWaalsContact C-N 3.34Å; P489-Q491 PolarHBondContact O-N 3.16Å; P489-L492 WeakPolarHBondContact O-CB 3.45Å; P489-L492 PolarHBondContact O-N 3.19Å; P489-K493 PolarHBondContact O-N 3.35Å; P489-K493 VanDerWaalsContact O-N 3.13Å
490	R	60.5	Low	57.2	Low	228.5 Å²	228.5	131.4 Å²	131.4	86%	0.862	62%	0.616	S	S	*	*	H	α-helix	trans	-69.6	-33.8	177.4	-112	-179.9	177.4	171.3	-0.2	112.5	T488 L492 K494	T488-R490 VanDerWaalsContact C-N 3.31Å; T488-R490 PolarHBondContact O-N 3.16Å; T488-R490 VanDerWaalsContact O-N 3.12Å; R490-L492 VanDerWaalsContact C-N 3.35Å; R490-K494 PolarHBondContact O-N 3.32Å
491	Q	59	Low	57.3	Low	110 Å²	110	129.7 Å²	129.7	51%	0.514	62%	0.615	S	S	.	*	H	α-helix	trans	-73.6	-33.5	174	-69.9	-177.9	-16.2	0	0	111	T488 P489 K493 K494 S495	T488-Q491 WeakPolarHBondContact O-CB 3.01Å; T488-Q491 PolarHBondContact O-N 3.04Å; T488-Q491 PolarHBondContact OG1-OE1 3.48Å; P489-Q491 VanDerWaalsContact C-N 3.34Å; P489-Q491 PolarHBondContact O-N 3.16Å; Q491-K493 PolarHBondContact O-N 2.93Å; Q491-K494 PolarHBondContact O-N 3.17Å; Q491-K494 VanDerWaalsContact O-N 3.15Å; Q491-S495 WeakPolarHBondContact O-CB 3.29Å; Q491-S495 PolarHBondContact O-N 3.3Å; Q491-S495 PolarHBondContact O-OG 3.06Å
492	L	62.5	Low	57.1	Low	86 Å²	86	128 Å²	128	45%	0.45	60%	0.601	S	S	.	*	H	α-helix	trans	-59	-44.9	174.9	-121.2	119.3	0	0	0	112.6	T488 P489 R490 K494 S495 E496	T488-L492 PolarHBondContact O-N 2.89Å; P489-L492 WeakPolarHBondContact O-CB 3.45Å; P489-L492 PolarHBondContact O-N 3.19Å; R490-L492 VanDerWaalsContact C-N 3.35Å; L492-K494 VanDerWaalsContact C-N 3.33Å; L492-K494 PolarHBondContact O-N 3.29Å; L492-S495 VanDerWaalsContact CA-OG 3.29Å; L492-S495 WeakPolarHBondContact CA-OG 3.41Å; L492-S495 PolarHBondContact O-N 3.16Å; L492-S495 PolarHBondContact O-OG 2.94Å; L492-E496 VanDerWaalsContact O-CB 3.3Å; L492-E496 WeakPolarHBondContact O-CB 3.47Å; L492-E496 VanDerWaalsContact O-CG 3.27Å; L492-E496 WeakPolarHBondContact O-CG 3.22Å; L492-E496 PolarHBondContact O-N 3.17Å
493	K	65.3	Low	57.2	Low	161 Å²	161	127.8 Å²	127.8	70%	0.7	59%	0.594	S	S	*	*	H	α-helix	trans	-64.4	-36.8	175.6	-100.7	-177.6	177.3	176.3	0	113.3	P489 Q491 W497	P489-K493 PolarHBondContact O-N 3.35Å; P489-K493 VanDerWaalsContact O-N 3.13Å; Q491-K493 PolarHBondContact O-N 2.93Å; K493-W497 PolarHBondContact O-N 3.29Å; K493-W497 VanDerWaalsContact O-N 3.13Å
494	K	61.2	Low	57.2	Low	152 Å²	152	128 Å²	128	66%	0.661	60%	0.595	S	S	*	*	H	α-helix	trans	-72.6	-38.5	177.7	-166.4	175.5	-178.2	179	0	111.1	R490 Q491 L492 W497 L498	R490-K494 PolarHBondContact O-N 3.32Å; Q491-K494 PolarHBondContact O-N 3.17Å; Q491-K494 VanDerWaalsContact O-N 3.15Å; L492-K494 VanDerWaalsContact C-N 3.33Å; L492-K494 PolarHBondContact O-N 3.29Å; K494-W497 PolarHBondContact O-N 3.36Å; K494-L498 HydrophobicContact CG-CD1 4.21Å; K494-L498 WeakPolarHBondContact O-CB 3.37Å; K494-L498 WeakPolarHBondContact O-CG 3.4Å; K494-L498 PolarHBondContact O-N 3.03Å
495	S	57.6	Low	57.3	Low	55.5 Å²	55.5	122 Å²	122	39%	0.388	58%	0.583	S	S	.	*	H	α-helix	trans	-66.7	-40.2	172.4	57.8	0	0	0	0	111.6	Q491 L492 W497 L498 E499	Q491-S495 WeakPolarHBondContact O-CB 3.29Å; Q491-S495 PolarHBondContact O-N 3.3Å; Q491-S495 PolarHBondContact O-OG 3.06Å; L492-S495 VanDerWaalsContact CA-OG 3.29Å; L492-S495 WeakPolarHBondContact CA-OG 3.41Å; L492-S495 PolarHBondContact O-N 3.16Å; L492-S495 PolarHBondContact O-OG 2.94Å; S495-W497 PolarHBondContact O-N 2.91Å; S495-L498 CarbonylContact O-C 3.37Å; S495-L498 PolarHBondContact O-N 3.08Å; S495-E499 WeakPolarHBondContact O-CA 3.36Å; S495-E499 VanDerWaalsContact O-CB 3.22Å; S495-E499 WeakPolarHBondContact O-CB 3.33Å; S495-E499 PolarHBondContact O-N 3.13Å
496	E	62.3	Low	57.7	Low	102.5 Å²	102.5	113.6 Å²	113.6	48%	0.479	55%	0.547	S	S	.	.	H	α-helix	trans	-62.5	-41.2	175	-82.3	-179.7	170.7	0	0	112.5	L492 E499 K500	L492-E496 VanDerWaalsContact O-CB 3.3Å; L492-E496 WeakPolarHBondContact O-CB 3.47Å; L492-E496 VanDerWaalsContact O-CG 3.27Å; L492-E496 WeakPolarHBondContact O-CG 3.22Å; L492-E496 PolarHBondContact O-N 3.17Å; E496-E499 PolarHBondContact O-N 3.21Å; E496-K500 VanDerWaalsContact O-CB 3.27Å; E496-K500 WeakPolarHBondContact O-CB 3.29Å; E496-K500 PolarHBondContact O-N 3.25Å
497	W	62.8	Low	58.2	Low	177 Å²	177	105.7 Å²	105.7	67%	0.67	52%	0.524	S	S	*	.	H	α-helix	trans	-67.9	-44.2	175.9	-176.3	87.6	0	0	0	111.7	K493 K494 S495 E499 K500 S501	K493-W497 PolarHBondContact O-N 3.29Å; K493-W497 VanDerWaalsContact O-N 3.13Å; K494-W497 PolarHBondContact O-N 3.36Å; S495-W497 PolarHBondContact O-N 2.91Å; W497-E499 VanDerWaalsContact C-N 3.3Å; W497-E499 PolarHBondContact O-N 3.22Å; W497-K500 PolarHBondContact O-N 3.06Å; W497-S501 VanDerWaalsContact O-CB 3.29Å; W497-S501 WeakPolarHBondContact O-CB 3.33Å; W497-S501 PolarHBondContact O-N 3.28Å
498	L	56	Low	58.2	Low	77.5 Å²	77.5	108.5 Å²	108.5	41%	0.406	53%	0.529	S	S	.	.	H	α-helix	trans	-60.5	-41.6	173.4	-80.1	166	0	0	0	110.9	K494 S495 S501 M502	K494-L498 HydrophobicContact CG-CD1 4.21Å; K494-L498 WeakPolarHBondContact O-CB 3.37Å; K494-L498 WeakPolarHBondContact O-CG 3.4Å; K494-L498 PolarHBondContact O-N 3.03Å; S495-L498 CarbonylContact O-C 3.37Å; S495-L498 PolarHBondContact O-N 3.08Å; L498-S501 PolarHBondContact O-N 3.16Å; L498-M502 WeakPolarHBondContact O-CA 3.01Å; L498-M502 WeakPolarHBondContact O-CB 3.27Å; L498-M502 VanDerWaalsContact O-CG 3.23Å; L498-M502 WeakPolarHBondContact O-CG 3.38Å; L498-M502 PolarHBondContact O-N 3.01Å
499	E	58.4	Low	58.1	Low	94.5 Å²	94.5	106.4 Å²	106.4	44%	0.442	51%	0.513	S	S	.	.	H	α-helix	trans	-69.5	-40.8	178.7	-165	-171.6	165.2	0	0	111.7	S495 E496 W497 M502 K503	S495-E499 WeakPolarHBondContact O-CA 3.36Å; S495-E499 VanDerWaalsContact O-CB 3.22Å; S495-E499 WeakPolarHBondContact O-CB 3.33Å; S495-E499 PolarHBondContact O-N 3.13Å; E496-E499 PolarHBondContact O-N 3.21Å; W497-E499 VanDerWaalsContact C-N 3.3Å; W497-E499 PolarHBondContact O-N 3.22Å; E499-M502 PolarHBondContact O-N 3.41Å; E499-K503 HydrophobicContact CG-CD 4.25Å; E499-K503 HydrophobicContact CG-CG 4.4Å; E499-K503 VanDerWaalsContact O-CB 3.27Å; E499-K503 WeakPolarHBondContact O-CB 3.2Å; E499-K503 VanDerWaalsContact O-CG 3.29Å; E499-K503 WeakPolarHBondContact O-CG 3.44Å; E499-K503 PolarHBondContact O-N 3.28Å; E499-K503 WeakPolarHBondContact OE1-CE 3.41Å; E499-K503 IonicContact OE1-NZ 3.82Å; E499-K503 PolarHBondContact OE1-NZ 3.35Å
500	K	58.9	Low	57.6	Low	160 Å²	160	106.7 Å²	106.7	70%	0.696	51%	0.508	S	S	*	.	H	α-helix	trans	-64.5	-42.7	172.6	-100.8	177.5	174.9	168	0	111.9	E496 W497 K504	E496-K500 VanDerWaalsContact O-CB 3.27Å; E496-K500 WeakPolarHBondContact O-CB 3.29Å; E496-K500 PolarHBondContact O-N 3.25Å; W497-K500 PolarHBondContact O-N 3.06Å; K500-K504 WeakPolarHBondContact O-CB 3.39Å; K500-K504 PolarHBondContact O-N 3.17Å; K500-K504 VanDerWaalsContact O-N 3.15Å
501	S	56.4	Low	57.6	Low	64.5 Å²	64.5	99.9 Å²	99.9	45%	0.451	49%	0.488	S	S	.	.	H	α-helix	trans	-67.5	-42.4	177.5	-171.4	0	0	0	0	111.1	W497 L498 K504 G505	W497-S501 VanDerWaalsContact O-CB 3.29Å; W497-S501 WeakPolarHBondContact O-CB 3.33Å; W497-S501 PolarHBondContact O-N 3.28Å; L498-S501 PolarHBondContact O-N 3.16Å; S501-K504 PolarHBondContact O-N 3.07Å; S501-G505 PolarHBondContact O-N 3.1Å; S501-G505 VanDerWaalsContact O-N 3.08Å
502	M	52.8	Low	57.9	Low	74.5 Å²	74.5	95 Å²	95	37%	0.367	47%	0.466	S	S	.	.	H	α-helix	trans	-62.7	-52.8	173.1	-81.5	-176.3	169.5	0	0	110.2	V473 T477 L498 E499 K504 G505 I506	V473-M502 HydrophobicContact CG1-CE 4.07Å; T477-M502 HydrophobicContact CG2-CE 4.26Å; L498-M502 WeakPolarHBondContact O-CA 3.01Å; L498-M502 WeakPolarHBondContact O-CB 3.27Å; L498-M502 VanDerWaalsContact O-CG 3.23Å; L498-M502 WeakPolarHBondContact O-CG 3.38Å; L498-M502 PolarHBondContact O-N 3.01Å; E499-M502 PolarHBondContact O-N 3.41Å; M502-K504 VanDerWaalsContact C-N 3.32Å; M502-K504 PolarHBondContact O-N 3.33Å; M502-G505 CarbonylContact O-C 3.59Å; M502-G505 WeakPolarHBondContact O-CA 3.46Å; M502-G505 PolarHBondContact O-N 3.17Å; M502-I506 VanDerWaalsContact C-CD1 3.43Å; M502-I506 HydrophobicContact CB-CD1 3.57Å; M502-I506 HydrophobicContact CB-CG1 4.37Å; M502-I506 HydrophobicContact CG-CD1 3.94Å; M502-I506 WeakPolarHBondContact O-CA 3.36Å; M502-I506 WeakPolarHBondContact O-CB 3.4Å; M502-I506 WeakPolarHBondContact O-CD1 3.4Å; M502-I506 WeakPolarHBondContact O-CG1 3.25Å; M502-I506 PolarHBondContact O-N 3.25Å; M502-I506 HydrophobicContact SD-CD1 4.41Å
503	K	54.6	Low	58.6	Low	133 Å²	133	96.2 Å²	96.2	58%	0.578	47%	0.473	S	S	*	.	H	α-helix	trans	-55.5	-40.9	177.7	-79.6	175.4	174.7	167.1	0	112.9	E499 G505 G507	E499-K503 HydrophobicContact CG-CD 4.25Å; E499-K503 HydrophobicContact CG-CG 4.4Å; E499-K503 VanDerWaalsContact O-CB 3.27Å; E499-K503 WeakPolarHBondContact O-CB 3.2Å; E499-K503 VanDerWaalsContact O-CG 3.29Å; E499-K503 WeakPolarHBondContact O-CG 3.44Å; E499-K503 PolarHBondContact O-N 3.28Å; E499-K503 WeakPolarHBondContact OE1-CE 3.41Å; E499-K503 IonicContact OE1-NZ 3.82Å; E499-K503 PolarHBondContact OE1-NZ 3.35Å; K503-G505 PolarHBondContact O-N 2.71Å; K503-G507 PolarHBondContact O-N 3.37Å; K503-G507 VanDerWaalsContact O-N 3.12Å
504	K	54.1	Low	59.5	Low	183.5 Å²	183.5	90.9 Å²	90.9	80%	0.798	45%	0.45	S	S	*	.	H	α-helix	trans	-65.6	-36.5	176.3	-88.3	-174.3	174.3	-179.6	0	113.7	K500 S501 M502	K500-K504 WeakPolarHBondContact O-CB 3.39Å; K500-K504 PolarHBondContact O-N 3.17Å; K500-K504 VanDerWaalsContact O-N 3.15Å; S501-K504 PolarHBondContact O-N 3.07Å; M502-K504 VanDerWaalsContact C-N 3.32Å; M502-K504 PolarHBondContact O-N 3.33Å
505	G	54	Low	60.6	Low	34 Å²	34	91 Å²	91	35%	0.351	45%	0.453	S	S	.	.	H	α-helix	trans	-80.3	-47.1	176.1	0	0	0	0	0	112.7	S501 M502 K503 G507 K508 F509	S501-G505 PolarHBondContact O-N 3.1Å; S501-G505 VanDerWaalsContact O-N 3.08Å; M502-G505 CarbonylContact O-C 3.59Å; M502-G505 WeakPolarHBondContact O-CA 3.46Å; M502-G505 PolarHBondContact O-N 3.17Å; K503-G505 PolarHBondContact O-N 2.71Å; G505-G507 PolarHBondContact O-N 3.04Å; G505-K508 PolarHBondContact O-N 2.98Å; G505-F509 VanDerWaalsContact O-CD2 3.29Å; G505-F509 WeakPolarHBondContact O-CD2 3.39Å
506	I	51.6	Low	62	Low	17.5 Å²	17.5	89.1 Å²	89.1	9%	0.09	44%	0.438	C	S	.	.	H	α-helix	trans	-63.4	-41.1	-175.5	-68.5	169.2	0	0	0	111.9	H470 M474 M502 K508 F509 L510	H470-I506 WeakPolarHBondContact CE1-CG1 3.11Å; H470-I506 VanDerWaalsContact NE2-CA 3.31Å; H470-I506 WeakPolarHBondContact NE2-CA 3.22Å; H470-I506 WeakPolarHBondContact NE2-CG1 3.43Å; M474-I506 HydrophobicContact CE-CB 4.27Å; M474-I506 HydrophobicContact CE-CD1 3.86Å; M474-I506 HydrophobicContact CE-CG1 3.83Å; M474-I506 HydrophobicContact CE-CG2 3.76Å; M474-I506 HydrophobicContact CG-CD1 4.34Å; M474-I506 HydrophobicContact SD-CD1 3.58Å; M474-I506 VanDerWaalsContact SD-CD1 3.58Å; M474-I506 HydrophobicContact SD-CG1 3.91Å; M502-I506 VanDerWaalsContact C-CD1 3.43Å; M502-I506 HydrophobicContact CB-CD1 3.57Å; M502-I506 HydrophobicContact CB-CG1 4.37Å; M502-I506 HydrophobicContact CG-CD1 3.94Å; M502-I506 WeakPolarHBondContact O-CA 3.36Å; M502-I506 WeakPolarHBondContact O-CB 3.4Å; M502-I506 WeakPolarHBondContact O-CD1 3.4Å; M502-I506 WeakPolarHBondContact O-CG1 3.25Å; M502-I506 PolarHBondContact O-N 3.25Å; M502-I506 HydrophobicContact SD-CD1 4.41Å; I506-K508 PolarHBondContact O-N 3.12Å; I506-K508 VanDerWaalsContact O-N 3.11Å; I506-F509 PolarHBondContact O-N 3.17Å; I506-F509 VanDerWaalsContact O-N 3.13Å; I506-L510 HydrophobicContact CG2-CD1 3.39Å; I506-L510 VanDerWaalsContact CG2-CD1 3.47Å; I506-L510 HydrophobicContact CG2-CG 3.86Å; I506-L510 PolarHBondContact O-N 3.03Å; I506-L510 VanDerWaalsContact O-N 3.13Å
507	G	54.2	Low	63.3	Low	38 Å²	38	84.2 Å²	84.2	39%	0.392	42%	0.415	S	S	.	.	H	α-helix	trans	-57.5	-29.3	-176.7	0	0	0	0	0	113.6	K503 G505 L511	K503-G507 PolarHBondContact O-N 3.37Å; K503-G507 VanDerWaalsContact O-N 3.12Å; G505-G507 PolarHBondContact O-N 3.04Å; G507-L511 WeakPolarHBondContact O-CD1 3.36Å; G507-L511 WeakPolarHBondContact O-CG 3.27Å
508	K	56.1	Low	64.6	Low	135.5 Å²	135.5	78 Å²	78	59%	0.589	40%	0.395	S	S	*	.	H	α-helix	trans	-82.6	-29.5	176.5	-71.9	-173.6	176.6	-176.1	0	114	L422 G505 I506	L422-K508 WeakPolarHBondContact CD2-O 3.42Å; G505-K508 PolarHBondContact O-N 2.98Å; I506-K508 PolarHBondContact O-N 3.12Å; I506-K508 VanDerWaalsContact O-N 3.11Å
509	F	56.3	Low	66.2	Low	38.5 Å²	38.5	78.5 Å²	78.5	17%	0.169	39%	0.392	C	S	.	.	H	α-helix	trans	-84.6	-29.8	-179	-77.4	-80.7	0	0	0	112.8	L422 L463 D466 L467 G505 I506 L511 C512	L422-F509 HydrophobicContact CD2-CD1 4.33Å; L422-F509 HydrophobicContact CD2-CE1 4.45Å; L463-F509 HydrophobicContact CD1-CD1 4.25Å; L463-F509 HydrophobicContact CD1-CE1 3.76Å; D466-F509 HydrophobicContact CB-CE1 3.97Å; D466-F509 HydrophobicContact CB-CZ 4.4Å; L467-F509 WeakPolarHBondContact CD1-O 3.42Å; L467-F509 HydrophobicContact CD2-CB 3.76Å; L467-F509 HydrophobicContact CD2-CD1 3.69Å; L467-F509 HydrophobicContact CD2-CG 4.22Å; L467-F509 WeakPolarHBondContact CD2-O 3.49Å; L467-F509 HydrophobicContact CG-CD1 3.91Å; G505-F509 VanDerWaalsContact O-CD2 3.29Å; G505-F509 WeakPolarHBondContact O-CD2 3.39Å; I506-F509 PolarHBondContact O-N 3.17Å; I506-F509 VanDerWaalsContact O-N 3.13Å; F509-L511 PolarHBondContact O-N 3.02Å; F509-C512 PolarHBondContact O-N 3.36Å
510	L	55.8	Low	67.9	Low	117.5 Å²	117.5	74 Å²	74	62%	0.615	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.8	178.5	-82.5	166.3	0	0	0	114.1	M474 I506	M474-L510 HydrophobicContact CE-CD1 4.25Å; I506-L510 HydrophobicContact CG2-CD1 3.39Å; I506-L510 VanDerWaalsContact CG2-CD1 3.47Å; I506-L510 HydrophobicContact CG2-CG 3.86Å; I506-L510 PolarHBondContact O-N 3.03Å; I506-L510 VanDerWaalsContact O-N 3.13Å
511	L	59.6	Low	69.4	Low	84.5 Å²	84.5	67.3 Å²	67.3	44%	0.442	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-8.2	-175.6	-63.4	164	0	0	0	113.9	N424 G507 F509	N424-L511 HydrophobicContact CB-CB 4.22Å; N424-L511 HydrophobicContact CB-CD1 4.02Å; N424-L511 HydrophobicContact CB-CD2 4.24Å; N424-L511 HydrophobicContact CB-CG 4.34Å; G507-L511 WeakPolarHBondContact O-CD1 3.36Å; G507-L511 WeakPolarHBondContact O-CG 3.27Å; F509-L511 PolarHBondContact O-N 3.02Å
512	C	65.7	Low	71.1	Confident	9 Å²	9	68.7 Å²	68.7	6%	0.061	34%	0.344	C	S	.	.			trans	-100.2	119.8	-175.9	-92.5	0	0	0	0	111.7	L421 L467 F509	L421-C512 VanDerWaalsContact C-SG 3.58Å; L421-C512 PolarHBondContact O-SG 2.91Å; L467-C512 HydrophobicContact CD1-CB 3.77Å; L467-C512 WeakPolarHBondContact CD1-O 3.5Å; L467-C512 HydrophobicContact CD2-CB 4.25Å; F509-C512 PolarHBondContact O-N 3.36Å
513	D	77.1	Confident	72.9	Confident	110 Å²	110	65.4 Å²	65.4	59%	0.588	33%	0.329	S	S	*	.			trans	-79.1	138.9	175.2	-80.4	-34.2	0	0	0	113.2	E515 M516 L517	D513-E515 VanDerWaalsContact C-N 3.3Å; D513-E515 PolarHBondContact O-N 3.21Å; D513-M516 HydrophobicContact CB-CB 4.27Å; D513-M516 PolarHBondContact O-N 3.39Å; D513-M516 VanDerWaalsContact O-N 3.16Å; D513-L517 WeakPolarHBondContact O-CG 3.39Å; D513-L517 PolarHBondContact O-N 3.1Å; D513-L517 VanDerWaalsContact O-N 3.14Å
514	F	83.3	Confident	74.8	Confident	50 Å²	50	59.1 Å²	59.1	22%	0.219	30%	0.301	C	S	.	.	H	α-helix	trans	-60.1	-38.8	177.7	-78.5	-61.3	0	0	0	112.1	K464 L467 H468 R471 M516 L517 D518	K464-F514 HydrophobicContact CG-CD1 3.97Å; K464-F514 HydrophobicContact CG-CE1 4.08Å; L467-F514 HydrophobicContact CB-CE1 4.08Å; L467-F514 HydrophobicContact CB-CZ 4.39Å; L467-F514 HydrophobicContact CD2-CD1 4.28Å; L467-F514 HydrophobicContact CD2-CD2 4.37Å; L467-F514 HydrophobicContact CD2-CE1 3.61Å; L467-F514 HydrophobicContact CD2-CE2 3.73Å; L467-F514 HydrophobicContact CD2-CZ 3.3Å; H468-F514 AromaticContact CD2-CE1 3.52Å; H468-F514 AromaticContact CD2-CZ 3.93Å; H468-F514 AromaticContact CE1-CE1 3.71Å; H468-F514 AromaticContact CE1-CZ 3.52Å; H468-F514 AromaticContact CG-CE1 3.91Å; H468-F514 AromaticContact CG-CZ 3.87Å; H468-F514 AromaticContact ND1-CZ 3.63Å; H468-F514 AromaticContact NE2-CE1 3.4Å; H468-F514 WeakPolarHBondContact NE2-CE1 3.43Å; H468-F514 AromaticContact NE2-CZ 3.74Å; R471-F514 VanDerWaalsContact NH1-CD2 3.27Å; R471-F514 VanDerWaalsContact NH1-CE2 3.31Å; F514-M516 VanDerWaalsContact C-N 3.32Å; F514-M516 PolarHBondContact O-N 3.37Å; F514-L517 PolarHBondContact O-N 3.49Å; F514-D518 PolarHBondContact O-N 3.17Å
515	E	84.8	Confident	76.5	Confident	153 Å²	153	51 Å²	51	72%	0.715	27%	0.268	S	S	*	.	H	α-helix	trans	-63	-42.6	177.5	-120.5	179	179.6	0	0	111.3	D513 L517 D518 R519	D513-E515 VanDerWaalsContact C-N 3.3Å; D513-E515 PolarHBondContact O-N 3.21Å; E515-L517 PolarHBondContact O-N 3.21Å; E515-D518 PolarHBondContact O-N 3.29Å; E515-D518 VanDerWaalsContact O-N 3.15Å; E515-R519 WeakPolarHBondContact O-CG 3.23Å; E515-R519 PolarHBondContact O-N 3.35Å
516	M	87.7	Confident	78.2	Confident	16 Å²	16	52.3 Å²	52.3	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-63.5	-42.8	176.6	-175.5	158.8	-78.9	0	0	112	L421 D427 H430 D513 F514 D518 R519 Y520	L421-M516 HydrophobicContact CD2-CG 4.08Å; L421-M516 HydrophobicContact CD2-SD 4.35Å; D427-M516 WeakPolarHBondContact OD1-CE 3.39Å; H430-M516 HydrophobicContact CB-CE 3.64Å; H430-M516 HydrophobicContact CB-SD 4.05Å; H430-M516 VanDerWaalsContact CD2-CE 3.46Å; H430-M516 WeakPolarHBondContact CD2-CE 3.47Å; H430-M516 PolarHBondContact CD2-SD 3.18Å; H430-M516 PolarHBondContact NE2-SD 3.16Å; H430-M516 VanDerWaalsContact NE2-SD 3.44Å; D513-M516 HydrophobicContact CB-CB 4.27Å; D513-M516 PolarHBondContact O-N 3.39Å; D513-M516 VanDerWaalsContact O-N 3.16Å; F514-M516 VanDerWaalsContact C-N 3.32Å; F514-M516 PolarHBondContact O-N 3.37Å; M516-D518 VanDerWaalsContact C-N 3.26Å; M516-D518 PolarHBondContact O-N 3.11Å; M516-R519 WeakPolarHBondContact O-CB 3.49Å; M516-R519 PolarHBondContact O-N 3.2Å; M516-R519 VanDerWaalsContact O-N 3.16Å; M516-Y520 HydrophobicContact CG-CD2 4.03Å; M516-Y520 HydrophobicContact CG-CE2 3.98Å; M516-Y520 WeakPolarHBondContact O-CD2 3.41Å; M516-Y520 PolarHBondContact O-N 3Å; M516-Y520 VanDerWaalsContact O-N 3.09Å; M516-Y520 HydrophobicContact SD-CE2 4.44Å
517	L	89.5	Confident	80.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.2	-39.3	174.6	-64.4	173.6	0	0	0	112	L421 I460 L463 K464 L467 D513 F514 E515 Y520 K521	L421-L517 HydrophobicContact CD1-CD2 3.88Å; L421-L517 HydrophobicContact CD2-CD2 4.3Å; I460-L517 HydrophobicContact CG2-CB 4.31Å; I460-L517 HydrophobicContact CG2-CD2 3.96Å; L463-L517 HydrophobicContact CD2-CD2 3.82Å; L463-L517 HydrophobicContact CG-CD2 4.41Å; K464-L517 HydrophobicContact CB-CD1 3.99Å; K464-L517 HydrophobicContact CG-CD1 4.16Å; L467-L517 HydrophobicContact CD1-CD1 3.79Å; D513-L517 WeakPolarHBondContact O-CG 3.39Å; D513-L517 PolarHBondContact O-N 3.1Å; D513-L517 VanDerWaalsContact O-N 3.14Å; F514-L517 PolarHBondContact O-N 3.49Å; E515-L517 PolarHBondContact O-N 3.21Å; L517-Y520 PolarHBondContact O-N 2.99Å; L517-K521 VanDerWaalsContact O-CG 3.32Å; L517-K521 WeakPolarHBondContact O-CG 3.41Å; L517-K521 PolarHBondContact O-N 2.95Å
518	D	88.9	Confident	81.8	Confident	47.5 Å²	47.5	49.7 Å²	49.7	25%	0.254	25%	0.246	S	C	.	.	H	α-helix	trans	-69.2	-37.2	176.8	-75.8	-28.1	0	0	0	112.4	K464 F514 E515 M516 Y520 K521 N522	K464-D518 IonicContact NZ-OD1 3.37Å; K464-D518 PolarHBondContact NZ-OD1 3.37Å; K464-D518 IonicContact NZ-OD2 3.5Å; K464-D518 PolarHBondContact NZ-OD2 2.97Å; F514-D518 PolarHBondContact O-N 3.17Å; E515-D518 PolarHBondContact O-N 3.29Å; E515-D518 VanDerWaalsContact O-N 3.15Å; M516-D518 VanDerWaalsContact C-N 3.26Å; M516-D518 PolarHBondContact O-N 3.11Å; D518-Y520 PolarHBondContact O-N 3.25Å; D518-K521 PolarHBondContact O-N 3.06Å; D518-N522 WeakPolarHBondContact O-CB 3.45Å; D518-N522 VanDerWaalsContact O-CG 3.26Å; D518-N522 PolarHBondContact O-N 3.46Å; D518-N522 PolarHBondContact O-ND2 3.12Å
519	R	91.3	Very high	83.3	Confident	87 Å²	87	46.9 Å²	46.9	33%	0.328	24%	0.235	S	C	.	.	H	α-helix	trans	-59.2	-45	171.8	-70.4	-166.2	-70.9	154.3	-10.1	112.1	E431 L434 E515 M516 K521 N522 A523	E431-R519 IonicContact OE1-CZ 2.87Å; E431-R519 IonicContact OE1-NH1 3.06Å; E431-R519 PolarHBondContact OE1-NH1 2.99Å; E431-R519 IonicContact OE1-NH2 3.35Å; E431-R519 IonicContact OE2-NH1 2.7Å; L434-R519 HydrophobicContact CD1-CB 4.15Å; L434-R519 HydrophobicContact CD2-CB 4.36Å; E515-R519 WeakPolarHBondContact O-CG 3.23Å; E515-R519 PolarHBondContact O-N 3.35Å; M516-R519 WeakPolarHBondContact O-CB 3.49Å; M516-R519 PolarHBondContact O-N 3.2Å; M516-R519 VanDerWaalsContact O-N 3.16Å; R519-K521 PolarHBondContact O-N 3.48Å; R519-N522 PolarHBondContact O-N 3.36Å; R519-A523 WeakPolarHBondContact O-CB 3.4Å; R519-A523 PolarHBondContact O-N 2.92Å
520	Y	93.3	Very high	84.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.7	-40.8	175.5	-87.2	-100.1	0	0	0	112.6	L417 L421 H430 V433 L434 L437 I460 M516 L517 D518 N522 A523 L524	L417-Y520 HydrophobicContact CD1-CD1 4.44Å; L417-Y520 HydrophobicContact CD2-CD1 4.43Å; L417-Y520 HydrophobicContact CD2-CE1 4.06Å; L421-Y520 HydrophobicContact CD1-CD2 4.48Å; L421-Y520 HydrophobicContact CD1-CG 4.38Å; L421-Y520 HydrophobicContact CD2-CD2 3.96Å; L421-Y520 HydrophobicContact CD2-CE2 3.84Å; L421-Y520 HydrophobicContact CD2-CG 4.47Å; L421-Y520 HydrophobicContact CG-CE2 4.39Å; H430-Y520 HydrophobicContact CB-CE2 4.47Å; H430-Y520 AromaticContact ND1-CE2 3.76Å; H430-Y520 AromaticContact ND1-CZ 3.72Å; H430-Y520 PolarHBondContact ND1-OH 3.38Å; V433-Y520 HydrophobicContact CB-CE1 4.38Å; V433-Y520 WeakPolarHBondContact CB-OH 3.42Å; V433-Y520 HydrophobicContact CG1-CE1 3.56Å; V433-Y520 WeakPolarHBondContact CG1-OH 3.27Å; L434-Y520 HydrophobicContact CD1-CE2 4.34Å; L434-Y520 HydrophobicContact CD2-CD1 4.32Å; L434-Y520 HydrophobicContact CD2-CD2 3.8Å; L434-Y520 HydrophobicContact CD2-CE1 4.39Å; L434-Y520 HydrophobicContact CD2-CE2 3.99Å; L434-Y520 HydrophobicContact CD2-CG 3.98Å; L434-Y520 HydrophobicContact CG-CD2 4.3Å; L434-Y520 HydrophobicContact CG-CE2 4.13Å; L437-Y520 HydrophobicContact CD1-CD1 3.97Å; L437-Y520 HydrophobicContact CD1-CE1 4.15Å; I460-Y520 HydrophobicContact CD1-CD1 4.08Å; I460-Y520 HydrophobicContact CD1-CG 4.24Å; M516-Y520 HydrophobicContact CG-CD2 4.03Å; M516-Y520 HydrophobicContact CG-CE2 3.98Å; M516-Y520 WeakPolarHBondContact O-CD2 3.41Å; M516-Y520 PolarHBondContact O-N 3Å; M516-Y520 VanDerWaalsContact O-N 3.09Å; M516-Y520 HydrophobicContact SD-CE2 4.44Å; L517-Y520 PolarHBondContact O-N 2.99Å; D518-Y520 PolarHBondContact O-N 3.25Å; Y520-N522 VanDerWaalsContact C-N 3.32Å; Y520-N522 PolarHBondContact O-N 3.01Å; Y520-A523 PolarHBondContact O-N 3.38Å; Y520-L524 WeakPolarHBondContact O-CB 3.17Å; Y520-L524 VanDerWaalsContact O-CG 3.26Å; Y520-L524 WeakPolarHBondContact O-CG 3.33Å; Y520-L524 PolarHBondContact O-N 2.88Å
521	K	91.3	Very high	86.4	Confident	20 Å²	20	41 Å²	41	9%	0.087	21%	0.206	C	C	.	.	H	α-helix	trans	-62	-42.3	176.1	-77.4	179.3	66.3	178.8	0	112	F457 I460 D461 L517 D518 R519 L524 S525 E636	F457-K521 HydrophobicContact CD2-CB 4.02Å; F457-K521 HydrophobicContact CD2-CG 4.08Å; F457-K521 WeakPolarHBondContact CD2-O 3.17Å; F457-K521 HydrophobicContact CE2-CB 3.64Å; F457-K521 HydrophobicContact CE2-CD 4.38Å; F457-K521 VanDerWaalsContact CE2-CE 3.43Å; F457-K521 HydrophobicContact CE2-CG 3.89Å; F457-K521 HydrophobicContact CZ-CB 4.43Å; F457-K521 HydrophobicContact CZ-CD 4.44Å; F457-K521 HydrophobicContact CZ-CG 4.44Å; I460-K521 HydrophobicContact CB-CG 4.38Å; I460-K521 HydrophobicContact CG2-CD 4.41Å; I460-K521 HydrophobicContact CG2-CG 3.82Å; D461-K521 WeakPolarHBondContact OD1-CE 3.19Å; D461-K521 IonicContact OD1-NZ 3.36Å; D461-K521 PolarHBondContact OD1-NZ 2.89Å; L517-K521 VanDerWaalsContact O-CG 3.32Å; L517-K521 WeakPolarHBondContact O-CG 3.41Å; L517-K521 PolarHBondContact O-N 2.95Å; D518-K521 PolarHBondContact O-N 3.06Å; R519-K521 PolarHBondContact O-N 3.48Å; K521-L524 PolarHBondContact O-N 3.32Å; K521-S525 PolarHBondContact O-N 2.89Å; K521-S525 VanDerWaalsContact O-N 3.11Å; K521-S525 PolarHBondContact O-OG 2.8Å; K521-E636 VanDerWaalsContact CE-OE2 3.28Å; K521-E636 WeakPolarHBondContact CE-OE2 3.42Å; K521-E636 IonicContact NZ-OE2 2.7Å; K521-E636 PolarHBondContact NZ-OE2 2.84Å
522	N	90.4	Very high	87.6	Confident	93 Å²	93	37.3 Å²	37.3	50%	0.497	19%	0.186	S	C	.	.	H	α-helix	trans	-65.1	-47.8	176.2	-69.8	-15.6	0	0	0	110.8	D518 R519 Y520 L524 S525 T526	D518-N522 WeakPolarHBondContact O-CB 3.45Å; D518-N522 VanDerWaalsContact O-CG 3.26Å; D518-N522 PolarHBondContact O-N 3.46Å; D518-N522 PolarHBondContact O-ND2 3.12Å; R519-N522 PolarHBondContact O-N 3.36Å; Y520-N522 VanDerWaalsContact C-N 3.32Å; Y520-N522 PolarHBondContact O-N 3.01Å; N522-L524 VanDerWaalsContact C-N 3.31Å; N522-L524 PolarHBondContact O-N 3.09Å; N522-S525 WeakPolarHBondContact O-CA 3.37Å; N522-S525 WeakPolarHBondContact O-CB 3.31Å; N522-S525 PolarHBondContact O-N 3.12Å; N522-S525 VanDerWaalsContact O-N 3.09Å; N522-T526 PolarHBondContact O-N 2.91Å; N522-T526 PolarHBondContact O-OG1 3.04Å; N522-T526 VanDerWaalsContact O-OG1 3.14Å
523	A	92.1	Very high	88.5	Confident	6 Å²	6	44.5 Å²	44.5	5%	0.05	22%	0.217	C	C	.	.	H	α-helix	trans	-57.2	-42.3	176.3	0	0	0	0	0	112.3	L434 L437 T438 R519 Y520 S525 T526 A527	L434-A523 HydrophobicContact CD2-CB 3.79Å; L437-A523 HydrophobicContact CB-CB 4.13Å; L437-A523 HydrophobicContact CD1-CB 4.41Å; T438-A523 HydrophobicContact CG2-CB 3.82Å; R519-A523 WeakPolarHBondContact O-CB 3.4Å; R519-A523 PolarHBondContact O-N 2.92Å; Y520-A523 PolarHBondContact O-N 3.38Å; A523-S525 VanDerWaalsContact C-N 3.32Å; A523-S525 PolarHBondContact O-N 3.47Å; A523-T526 PolarHBondContact O-N 3.13Å; A523-A527 VanDerWaalsContact O-CB 3.27Å; A523-A527 WeakPolarHBondContact O-CB 3.28Å; A523-A527 PolarHBondContact O-N 3.14Å
524	L	92.8	Very high	88.8	Confident	0.5 Å²	0.5	43.2 Å²	43.2	0%	0.003	21%	0.207	C	C	.	.	H	α-helix	trans	-67.2	-32.6	175.9	-72.6	170.4	0	0	0	113.3	L414 L417 L437 Y453 A456 F457 I460 Y520 K521 N522 A527 L528	L414-L524 HydrophobicContact CD2-CD2 3.67Å; L417-L524 HydrophobicContact CD1-CD1 4.06Å; L417-L524 HydrophobicContact CD1-CD2 4.03Å; L417-L524 HydrophobicContact CD1-CG 4.43Å; L437-L524 HydrophobicContact CD1-CD2 4.31Å; L437-L524 HydrophobicContact CD1-CG 4.46Å; L437-L524 HydrophobicContact CD2-CD2 4.23Å; Y453-L524 HydrophobicContact CD1-CD2 4.16Å; A456-L524 HydrophobicContact CB-CD1 3.97Å; A456-L524 HydrophobicContact CB-CD2 3.92Å; F457-L524 HydrophobicContact CB-CB 4.4Å; F457-L524 HydrophobicContact CB-CD1 4.18Å; F457-L524 HydrophobicContact CD2-CB 4.37Å; I460-L524 HydrophobicContact CD1-CD1 3.7Å; I460-L524 HydrophobicContact CG1-CD1 4.11Å; Y520-L524 WeakPolarHBondContact O-CB 3.17Å; Y520-L524 VanDerWaalsContact O-CG 3.26Å; Y520-L524 WeakPolarHBondContact O-CG 3.33Å; Y520-L524 PolarHBondContact O-N 2.88Å; K521-L524 PolarHBondContact O-N 3.32Å; N522-L524 VanDerWaalsContact C-N 3.31Å; N522-L524 PolarHBondContact O-N 3.09Å; L524-A527 PolarHBondContact O-N 3.43Å; L524-L528 WeakPolarHBondContact O-CB 3.4Å; L524-L528 PolarHBondContact O-N 2.95Å; L524-L528 VanDerWaalsContact O-N 3.08Å
525	S	90.5	Very high	88.8	Confident	14 Å²	14	42.1 Å²	42.1	10%	0.098	20%	0.204	C	C	.	.	H	α-helix	trans	-68	-45.1	174	-113.3	0	0	0	0	110.9	K521 N522 A523 A527 L528 E529	K521-S525 PolarHBondContact O-N 2.89Å; K521-S525 VanDerWaalsContact O-N 3.11Å; K521-S525 PolarHBondContact O-OG 2.8Å; N522-S525 WeakPolarHBondContact O-CA 3.37Å; N522-S525 WeakPolarHBondContact O-CB 3.31Å; N522-S525 PolarHBondContact O-N 3.12Å; N522-S525 VanDerWaalsContact O-N 3.09Å; A523-S525 VanDerWaalsContact C-N 3.32Å; A523-S525 PolarHBondContact O-N 3.47Å; S525-A527 VanDerWaalsContact C-N 3.32Å; S525-A527 PolarHBondContact O-N 3.45Å; S525-L528 WeakPolarHBondContact O-CB 3.33Å; S525-L528 PolarHBondContact O-N 3.11Å; S525-E529 WeakPolarHBondContact O-CG 3.46Å; S525-E529 PolarHBondContact O-N 2.93Å; S525-E529 VanDerWaalsContact O-N 3.15Å
526	T	89.7	Confident	88.7	Confident	61 Å²	61	35.5 Å²	35.5	37%	0.374	17%	0.173	S	C	.	.	H	α-helix	trans	-61.8	-41.8	173.7	-51.6	0	0	0	0	111.2	T438 N522 A523 L528 E529 L530	T438-T526 HydrophobicContact CG2-CG2 4.46Å; N522-T526 PolarHBondContact O-N 2.91Å; N522-T526 PolarHBondContact O-OG1 3.04Å; N522-T526 VanDerWaalsContact O-OG1 3.14Å; A523-T526 PolarHBondContact O-N 3.13Å; T526-L528 VanDerWaalsContact C-N 3.29Å; T526-L528 PolarHBondContact O-N 2.96Å; T526-E529 PolarHBondContact O-N 2.95Å; T526-L530 HydrophobicContact CG2-CD1 4.11Å; T526-L530 HydrophobicContact CG2-CG 4.44Å; T526-L530 WeakPolarHBondContact O-CB 3.18Å; T526-L530 WeakPolarHBondContact O-CG 3.24Å; T526-L530 PolarHBondContact O-N 2.98Å
527	A	91.5	Very high	88.3	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.1	-38.1	178	0	0	0	0	0	112.5	L437 I443 Y453 A523 L524 S525 S531	L437-A527 VanDerWaalsContact O-CB 3.27Å; L437-A527 WeakPolarHBondContact O-CB 3.33Å; I443-A527 HydrophobicContact CD1-CB 4.03Å; Y453-A527 HydrophobicContact CD1-CB 3.47Å; Y453-A527 VanDerWaalsContact CD1-CB 3.41Å; Y453-A527 HydrophobicContact CE1-CB 3.49Å; Y453-A527 HydrophobicContact CG-CB 4.24Å; A523-A527 VanDerWaalsContact O-CB 3.27Å; A523-A527 WeakPolarHBondContact O-CB 3.28Å; A523-A527 PolarHBondContact O-N 3.14Å; L524-A527 PolarHBondContact O-N 3.43Å; S525-A527 VanDerWaalsContact C-N 3.32Å; S525-A527 PolarHBondContact O-N 3.45Å; A527-S531 VanDerWaalsContact O-CB 3.29Å; A527-S531 WeakPolarHBondContact O-CB 3.44Å; A527-S531 PolarHBondContact O-N 3.03Å
528	L	90	Very high	88.1	Confident	0.5 Å²	0.5	41 Å²	41	0%	0.003	21%	0.21	C	C	.	.	H	α-helix	trans	-63.8	-46.4	174.5	178.8	110	0	0	0	111.3	P450 F454 L524 S525 T526 L530 S531 M532 M575 I634 L635	P450-L528 VanDerWaalsContact CA-CD1 3.5Å; P450-L528 HydrophobicContact CB-CD1 3.38Å; P450-L528 HydrophobicContact CB-CG 4.09Å; P450-L528 HydrophobicContact CG-CD1 4.19Å; F454-L528 HydrophobicContact CB-CD1 3.93Å; L524-L528 WeakPolarHBondContact O-CB 3.4Å; L524-L528 PolarHBondContact O-N 2.95Å; L524-L528 VanDerWaalsContact O-N 3.08Å; S525-L528 WeakPolarHBondContact O-CB 3.33Å; S525-L528 PolarHBondContact O-N 3.11Å; T526-L528 VanDerWaalsContact C-N 3.29Å; T526-L528 PolarHBondContact O-N 2.96Å; L528-L530 PolarHBondContact O-N 2.8Å; L528-S531 WeakPolarHBondContact O-CB 3.08Å; L528-S531 PolarHBondContact O-N 3.05Å; L528-M532 HydrophobicContact CD1-CG 4.31Å; L528-M532 HydrophobicContact CD1-SD 3.97Å; L528-M532 HydrophobicContact CD2-SD 3.74Å; L528-M532 HydrophobicContact CG-SD 3.84Å; L528-M532 VanDerWaalsContact O-CG 3.28Å; L528-M532 WeakPolarHBondContact O-CG 3.32Å; L528-M532 PolarHBondContact O-N 3.25Å; L528-M575 HydrophobicContact CD1-CE 3.99Å; L528-M575 HydrophobicContact CD2-CE 3.97Å; L528-M575 HydrophobicContact CG-CE 4.18Å; L528-I634 HydrophobicContact CD2-CB 4.13Å; L528-I634 HydrophobicContact CD2-CD1 4.1Å; L528-I634 HydrophobicContact CD2-CG2 3.8Å; L528-I634 HydrophobicContact CG-CG2 4.14Å; L528-L635 HydrophobicContact CD1-CD2 3.95Å; L528-L635 HydrophobicContact CD1-CG 4.33Å; L528-L635 HydrophobicContact CD2-CD1 4.07Å; L528-L635 HydrophobicContact CD2-CD2 3.22Å; L528-L635 HydrophobicContact CD2-CG 3.52Å
529	E	88.4	Confident	87.9	Confident	77.5 Å²	77.5	38.8 Å²	38.8	36%	0.362	20%	0.198	S	C	.	.	H	α-helix	trans	-64.7	-43.7	179.1	-72	173.8	-171.9	0	0	112.2	S525 T526 S531 M532 K533 G633 I634	S525-E529 WeakPolarHBondContact O-CG 3.46Å; S525-E529 PolarHBondContact O-N 2.93Å; S525-E529 VanDerWaalsContact O-N 3.15Å; T526-E529 PolarHBondContact O-N 2.95Å; E529-S531 VanDerWaalsContact C-N 3.32Å; E529-S531 PolarHBondContact O-N 2.96Å; E529-M532 PolarHBondContact O-N 2.83Å; E529-M532 VanDerWaalsContact O-N 3.16Å; E529-K533 WeakPolarHBondContact O-CB 3.15Å; E529-K533 PolarHBondContact O-N 3.18Å; E529-G633 WeakPolarHBondContact OE1-CA 3.37Å; E529-I634 HydrophobicContact CG-CD1 3.95Å; E529-I634 HydrophobicContact CG-CG1 4.12Å; E529-I634 HydrophobicContact CG-CG2 4.45Å; E529-I634 PolarHBondContact OE1-N 3.06Å; E529-I634 VanDerWaalsContact OE1-N 3.09Å
530	L	88.2	Confident	87.4	Confident	31.5 Å²	31.5	37.8 Å²	37.8	17%	0.165	20%	0.204	C	C	.	.	H	α-helix	trans	-62.6	-42.7	173.9	-71.9	173.7	0	0	0	111.7	T438 P440 I443 T526 L528 M532 K533 H534	T438-L530 WeakPolarHBondContact O-CD1 3.43Å; P440-L530 HydrophobicContact CB-CD1 4.46Å; P440-L530 HydrophobicContact CB-CD2 4.4Å; P440-L530 HydrophobicContact CG-CD1 4.18Å; P440-L530 HydrophobicContact CG-CD2 4.3Å; I443-L530 HydrophobicContact CD1-CB 3.89Å; I443-L530 HydrophobicContact CD1-CD1 3.54Å; I443-L530 VanDerWaalsContact CD1-CD1 3.47Å; I443-L530 HydrophobicContact CD1-CG 4.37Å; I443-L530 HydrophobicContact CG2-CB 4.2Å; T526-L530 HydrophobicContact CG2-CD1 4.11Å; T526-L530 HydrophobicContact CG2-CG 4.44Å; T526-L530 WeakPolarHBondContact O-CB 3.18Å; T526-L530 WeakPolarHBondContact O-CG 3.24Å; T526-L530 PolarHBondContact O-N 2.98Å; L528-L530 PolarHBondContact O-N 2.8Å; L530-M532 VanDerWaalsContact C-N 3.28Å; L530-M532 PolarHBondContact O-N 3.36Å; L530-K533 PolarHBondContact O-N 3.22Å; L530-H534 PolarHBondContact O-CD2 3.02Å; L530-H534 VanDerWaalsContact O-CD2 3.29Å; L530-H534 PolarHBondContact O-N 3.19Å
531	S	87.6	Confident	86.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61	-39.2	175.8	-177.1	0	0	0	0	111.5	Q448 Y453 A527 L528 E529 N535	Q448-S531 PolarHBondContact O-OG 3.3Å; Y453-S531 VanDerWaalsContact CE2-CB 3.47Å; Y453-S531 WeakPolarHBondContact CE2-OG 2.82Å; A527-S531 VanDerWaalsContact O-CB 3.29Å; A527-S531 WeakPolarHBondContact O-CB 3.44Å; A527-S531 PolarHBondContact O-N 3.03Å; L528-S531 WeakPolarHBondContact O-CB 3.08Å; L528-S531 PolarHBondContact O-N 3.05Å; E529-S531 VanDerWaalsContact C-N 3.32Å; E529-S531 PolarHBondContact O-N 2.96Å; S531-N535 WeakPolarHBondContact O-CA 3.3Å; S531-N535 WeakPolarHBondContact O-CB 3.31Å; S531-N535 PolarHBondContact O-N 3.18Å; S531-N535 PolarHBondContact OG-ND2 3.16Å; S531-N535 VanDerWaalsContact OG-ND2 3.08Å
532	M	86.4	Confident	86.7	Confident	6 Å²	6	38.7 Å²	38.7	3%	0.03	22%	0.215	C	C	.	.	H	α-helix	trans	-69.8	-45.3	176.9	-71.7	172.2	56.4	0	0	112.2	P450 L528 E529 L530 H534 L536 M575 S578 I579 I634	P450-M532 HydrophobicContact CB-CG 3.88Å; P450-M532 HydrophobicContact CB-SD 4.33Å; P450-M532 HydrophobicContact CG-CB 4.44Å; P450-M532 HydrophobicContact CG-CG 3.76Å; P450-M532 HydrophobicContact CG-SD 4.2Å; L528-M532 HydrophobicContact CD1-CG 4.31Å; L528-M532 HydrophobicContact CD1-SD 3.97Å; L528-M532 HydrophobicContact CD2-SD 3.74Å; L528-M532 HydrophobicContact CG-SD 3.84Å; L528-M532 VanDerWaalsContact O-CG 3.28Å; L528-M532 WeakPolarHBondContact O-CG 3.32Å; L528-M532 PolarHBondContact O-N 3.25Å; E529-M532 PolarHBondContact O-N 2.83Å; E529-M532 VanDerWaalsContact O-N 3.16Å; L530-M532 VanDerWaalsContact C-N 3.28Å; L530-M532 PolarHBondContact O-N 3.36Å; M532-H534 VanDerWaalsContact C-N 3.31Å; M532-H534 PolarHBondContact O-N 2.87Å; M532-L536 HydrophobicContact CB-CD1 4.42Å; M532-L536 HydrophobicContact CG-CD1 4.17Å; M532-L536 WeakPolarHBondContact O-CB 3.42Å; M532-L536 PolarHBondContact O-N 2.83Å; M532-M575 VanDerWaalsContact CE-CA 3.48Å; M532-M575 HydrophobicContact CE-CB 3.62Å; M532-M575 HydrophobicContact CE-CG 3.75Å; M532-M575 HydrophobicContact CG-CE 3.99Å; M532-M575 HydrophobicContact SD-CB 4.18Å; M532-M575 HydrophobicContact SD-CE 4.07Å; M532-M575 HydrophobicContact SD-CG 3.64Å; M532-M575 VanDerWaalsContact SD-CG 3.57Å; M532-M575 HydrophobicContact SD-SD 4.35Å; M532-S578 WeakPolarHBondContact CE-OG 3.42Å; M532-I579 HydrophobicContact CB-CD1 4.46Å; M532-I579 HydrophobicContact CE-CD1 3.68Å; M532-I579 HydrophobicContact CE-CG1 3.91Å; M532-I579 HydrophobicContact CE-CG2 4.15Å; M532-I634 HydrophobicContact CE-CD1 3.83Å; M532-I634 VanDerWaalsContact CE-CD1 3.41Å; M532-I634 HydrophobicContact SD-CD1 3.17Å; M532-I634 WeakPolarHBondContact SD-CD1 3.48Å
533	K	83.8	Confident	86.7	Confident	162 Å²	162	34.2 Å²	34.2	70%	0.704	19%	0.192	S	C	*	.	H	α-helix	trans	-62	-37.7	-179.1	-174.7	178.8	178.8	-176.7	0	112.7	E529 L530	E529-K533 WeakPolarHBondContact O-CB 3.15Å; E529-K533 PolarHBondContact O-N 3.18Å; L530-K533 PolarHBondContact O-N 3.22Å
534	H	83.7	Confident	86.8	Confident	81 Å²	81	34.1 Å²	34.1	38%	0.375	19%	0.19	S	C	.	.	H	α-helix	trans	-108	-27.3	-171.7	-62.9	-71.6	0	0	0	115	M444 L530 M532	M444-H534 HydrophobicContact CE-CB 4.36Å; M444-H534 HydrophobicContact CG-CB 3.61Å; M444-H534 HydrophobicContact SD-CB 4.16Å; L530-H534 PolarHBondContact O-CD2 3.02Å; L530-H534 VanDerWaalsContact O-CD2 3.29Å; L530-H534 PolarHBondContact O-N 3.19Å; M532-H534 VanDerWaalsContact C-N 3.31Å; M532-H534 PolarHBondContact O-N 2.87Å
535	N	82.8	Confident	86.8	Confident	28.5 Å²	28.5	34.1 Å²	34.1	15%	0.152	19%	0.19	C	C	.	.	H	α-helix	trans	-101.7	-9.3	-176.4	-58.2	-30	0	0	0	113.8	I443 M444 Q448 S531 R728	I443-N535 PolarHBondContact O-ND2 3.02Å; M444-N535 WeakPolarHBondContact CA-OD1 3.45Å; M444-N535 PolarHBondContact O-OD1 3.4Å; Q448-N535 PolarHBondContact N-ND2 3.48Å; Q448-N535 PolarHBondContact O-ND2 3.18Å; S531-N535 WeakPolarHBondContact O-CA 3.3Å; S531-N535 WeakPolarHBondContact O-CB 3.31Å; S531-N535 PolarHBondContact O-N 3.18Å; S531-N535 PolarHBondContact OG-ND2 3.16Å; S531-N535 VanDerWaalsContact OG-ND2 3.08Å; N535-R728 PolarHBondContact O-NE 3.28Å; N535-R728 PolarHBondContact O-NH2 3.34Å
536	L	82.2	Confident	86.9	Confident	14 Å²	14	33.8 Å²	33.8	7%	0.073	19%	0.187	C	C	.	.	S	Bend	trans	-113.8	135.6	176	-66.7	174.5	0	0	0	110.6	F449 P450 M532 M575 I579 L727 R728	F449-L536 HydrophobicContact CD1-CD2 3.69Å; F449-L536 HydrophobicContact CE1-CD2 3.57Å; P450-L536 HydrophobicContact CG-CD1 4.1Å; M532-L536 HydrophobicContact CB-CD1 4.42Å; M532-L536 HydrophobicContact CG-CD1 4.17Å; M532-L536 WeakPolarHBondContact O-CB 3.42Å; M532-L536 PolarHBondContact O-N 2.83Å; L536-M575 HydrophobicContact CD1-CE 4.24Å; L536-I579 HydrophobicContact CB-CD1 4.02Å; L536-I579 HydrophobicContact CD1-CD1 3.5Å; L536-I579 HydrophobicContact CG-CD1 4.4Å; L536-L727 HydrophobicContact CD1-CB 4.28Å; L536-L727 HydrophobicContact CD1-CD1 3.76Å; L536-L727 HydrophobicContact CD2-CB 4.34Å; L536-R728 HydrophobicContact CD2-CB 4.31Å; L536-R728 HydrophobicContact CD2-CG 3.99Å
537	P	80.7	Confident	86.9	Confident	48.5 Å²	48.5	30.9 Å²	30.9	32%	0.315	17%	0.169	S	C	.	.			trans	-70.3	149.3	173.3	29.6	-32.8	0	0	0	111.1	I579 R728 A731	P537-I579 VanDerWaalsContact O-CG2 3.28Å; P537-I579 WeakPolarHBondContact O-CG2 3.46Å; P537-R728 HydrophobicContact CG-CB 4.26Å; P537-R728 HydrophobicContact CG-CG 4.09Å; P537-A731 HydrophobicContact CB-CB 4.16Å; P537-A731 HydrophobicContact CG-CB 3.65Å
538	P	83.5	Confident	86.6	Confident	83 Å²	83	31 Å²	31	54%	0.539	17%	0.17	S	C	.	.			trans	-65.4	144.9	174.6	28.3	-33.8	0	0	0	111	C540	P538-C540 PolarHBondContact O-N 3.16Å
539	I	86	Confident	85.9	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	104.3	176	-61.2	167.1	0	0	0	107.7	I579 C580 E581 K669 I730 A731	I539-I579 HydrophobicContact CD1-CB 4.4Å; I539-I579 HydrophobicContact CD1-CD1 3.51Å; I539-I579 HydrophobicContact CD1-CG1 3.8Å; I539-I579 HydrophobicContact CD1-CG2 4.14Å; I539-I579 HydrophobicContact CG1-CD1 3.88Å; I539-I579 HydrophobicContact CG1-CG1 4.08Å; I539-I579 HydrophobicContact CG1-CG2 4Å; I539-I579 PolarHBondContact N-O 3.29Å; I539-I579 VanDerWaalsContact N-O 3.13Å; I539-C580 HydrophobicContact CB-CB 4.49Å; I539-C580 WeakPolarHBondContact O-CA 3.47Å; I539-E581 PolarHBondContact O-N 3.26Å; I539-K669 HydrophobicContact CG2-CD 4.19Å; I539-I730 HydrophobicContact CD1-CB 4.17Å; I539-I730 HydrophobicContact CD1-CG2 3.71Å; I539-I730 HydrophobicContact CG1-CG2 4.27Å; I539-I730 HydrophobicContact CG2-CG2 4.1Å; I539-A731 HydrophobicContact CG1-CB 3.83Å
540	C	80.8	Confident	84.9	Confident	67 Å²	67	28.8 Å²	28.8	45%	0.453	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	147.6	179.1	-55.8	0	0	0	0	111.8	P538 E581 K669	P538-C540 PolarHBondContact O-N 3.16Å; C540-E581 WeakPolarHBondContact CA-OE2 3.39Å; C540-E581 PolarHBondContact SG-OE1 2.95Å; C540-K669 PolarHBondContact O-NZ 2.84Å; C540-K669 VanDerWaalsContact O-NZ 3.1Å
541	G	81.5	Confident	83.9	Confident	18.5 Å²	18.5	32.1 Å²	32.1	19%	0.191	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	88.7	177.1	175.7	0	0	0	0	0	115.4	T543 E581 T582 D668	G541-T543 PolarHBondContact O-N 2.97Å; G541-E581 PolarHBondContact N-OE2 3.37Å; G541-E581 VanDerWaalsContact N-OE2 3.08Å; G541-T582 VanDerWaalsContact C-OG1 3.29Å; G541-T582 PolarHBondContact O-OG1 3.18Å; G541-T582 VanDerWaalsContact O-OG1 3.11Å; G541-D668 WeakPolarHBondContact CA-OD2 3.29Å
542	S	86.9	Confident	82.5	Confident	19.5 Å²	19.5	37.3 Å²	37.3	14%	0.136	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	115.5	-179.4	58.7	0	0	0	0	111.3	T582 Q666 F667 D668 K669	S542-T582 WeakPolarHBondContact CA-OG1 3.32Å; S542-T582 PolarHBondContact N-OG1 2.73Å; S542-Q666 PolarHBondContact OG-O 3.17Å; S542-Q666 VanDerWaalsContact OG-O 3.12Å; S542-F667 VanDerWaalsContact OG-CA 3.27Å; S542-F667 WeakPolarHBondContact OG-CA 3.42Å; S542-D668 PolarHBondContact N-OD2 2.87Å; S542-D668 PolarHBondContact O-N 2.86Å; S542-D668 PolarHBondContact OG-N 3.14Å; S542-D668 VanDerWaalsContact OG-N 3.09Å; S542-D668 PolarHBondContact OG-OD2 2.82Å; S542-K669 PolarHBondContact O-N 3.04Å; S542-K669 VanDerWaalsContact O-N 3.15Å
543	T	91.3	Very high	81.1	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	120	-173.6	-54.3	0	0	0	0	111.4	G541 I545 T582 T584 K669 V671	G541-T543 PolarHBondContact O-N 2.97Å; T543-I545 HydrophobicContact CG2-CD1 4.4Å; T543-I545 HydrophobicContact CG2-CG1 3.79Å; T543-T582 PolarHBondContact N-O 3.16Å; T543-T582 VanDerWaalsContact N-O 3.16Å; T543-T584 PolarHBondContact O-N 3.13Å; T543-K669 CarbonylContact C-O 3.59Å; T543-K669 VanDerWaalsContact CA-O 3.32Å; T543-K669 WeakPolarHBondContact CA-O 3.22Å; T543-K669 HydrophobicContact CG2-CB 4Å; T543-V671 HydrophobicContact CG2-CG2 3.88Å
544	L	93.6	Very high	79.6	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.016	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	117.5	169.4	178.5	59.8	0	0	0	109.4	T584 Y586 L660 F667 K669 I670 V671 Y683	L544-T584 WeakPolarHBondContact CA-O 3.44Å; L544-T584 HydrophobicContact CD1-CG2 4.17Å; L544-T584 WeakPolarHBondContact CD1-O 3.07Å; L544-Y586 HydrophobicContact CD1-CD2 3.92Å; L544-Y586 HydrophobicContact CD1-CE2 4.09Å; L544-L660 HydrophobicContact CD1-CD1 4.26Å; L544-L660 HydrophobicContact CD2-CD1 3.79Å; L544-F667 HydrophobicContact CB-CD1 3.69Å; L544-F667 HydrophobicContact CB-CD2 4.1Å; L544-F667 HydrophobicContact CB-CE1 3.76Å; L544-F667 HydrophobicContact CB-CE2 4.16Å; L544-F667 HydrophobicContact CB-CG 3.85Å; L544-F667 HydrophobicContact CB-CZ 3.98Å; L544-F667 HydrophobicContact CD1-CE1 4.42Å; L544-F667 HydrophobicContact CD1-CZ 4.07Å; L544-F667 HydrophobicContact CD2-CD2 4.29Å; L544-F667 HydrophobicContact CD2-CE2 4.06Å; L544-F667 HydrophobicContact CD2-CZ 4.41Å; L544-F667 HydrophobicContact CG-CE2 4.46Å; L544-F667 HydrophobicContact CG-CZ 4.38Å; L544-K669 PolarHBondContact N-O 3.22Å; L544-I670 HydrophobicContact CB-CB 4.4Å; L544-I670 HydrophobicContact CB-CG1 4.14Å; L544-I670 HydrophobicContact CD2-CD1 3.77Å; L544-I670 HydrophobicContact CD2-CG1 4.05Å; L544-I670 HydrophobicContact CG-CD1 4.36Å; L544-I670 HydrophobicContact CG-CG1 4.13Å; L544-I670 CarbonylContact O-C 3.5Å; L544-I670 WeakPolarHBondContact O-CA 3.34Å; L544-V671 PolarHBondContact O-N 3.18Å; L544-Y683 HydrophobicContact CD2-CE1 4.1Å
545	I	93.9	Very high	78	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	124.6	-176.8	-54.3	168.1	0	0	0	109.1	T543 C576 P583 T584 T585 Y586 V671 F673	T543-I545 HydrophobicContact CG2-CD1 4.4Å; T543-I545 HydrophobicContact CG2-CG1 3.79Å; I545-C576 HydrophobicContact CD1-CB 3.93Å; I545-C576 VanDerWaalsContact CD1-SG 3.6Å; I545-P583 HydrophobicContact CD1-CB 4.1Å; I545-T584 PolarHBondContact N-O 3.36Å; I545-T585 HydrophobicContact CB-CG2 4.02Å; I545-T585 HydrophobicContact CG2-CG2 4.05Å; I545-T585 CarbonylContact O-C 3.56Å; I545-T585 VanDerWaalsContact O-CA 3.3Å; I545-T585 WeakPolarHBondContact O-CA 3.22Å; I545-Y586 PolarHBondContact O-N 3.16Å; I545-V671 CarbonylContact C-O 3.59Å; I545-V671 WeakPolarHBondContact CA-O 3.32Å; I545-F673 HydrophobicContact CG2-CD2 4.14Å; I545-F673 HydrophobicContact CG2-CE2 4.07Å
546	I	92.2	Very high	76.4	Confident	7.5 Å²	7.5	35.6 Å²	35.6	4%	0.038	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	117.1	176	-58.8	175.6	0	0	0	108.7	T588 L595 V671 V672 F673 I680	I546-T588 HydrophobicContact CG2-CG2 4.46Å; I546-L595 HydrophobicContact CG2-CD2 4.27Å; I546-V671 PolarHBondContact N-O 3.48Å; I546-V672 HydrophobicContact CB-CG1 4.49Å; I546-V672 HydrophobicContact CB-CG2 4.36Å; I546-V672 HydrophobicContact CD1-CG2 4.49Å; I546-F673 PolarHBondContact O-N 3.3Å; I546-I680 HydrophobicContact CD1-CD1 3.55Å; I546-I680 VanDerWaalsContact CD1-CD1 3.47Å; I546-I680 HydrophobicContact CD1-CG1 3.88Å; I546-I680 HydrophobicContact CD1-CG2 4.17Å; I546-I680 HydrophobicContact CG2-CD1 4.23Å
547	C	90	Very high	74.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	112.3	-176.9	-47.6	0	0	0	0	109.7	F570 G573 Y586 V587 T588 M641	C547-F570 HydrophobicContact CB-CD1 3.83Å; C547-F570 HydrophobicContact CB-CE1 4.28Å; C547-G573 WeakPolarHBondContact SG-CA 3.33Å; C547-Y586 PolarHBondContact N-O 2.98Å; C547-V587 HydrophobicContact CB-CG2 4.2Å; C547-T588 PolarHBondContact O-N 3.4Å; C547-T588 PolarHBondContact O-OG1 3.23Å; C547-M641 HydrophobicContact CB-CE 4.1Å
548	S	84.7	Confident	73.2	Confident	3.5 Å²	3.5	43.6 Å²	43.6	2%	0.024	24%	0.24	C	C	.	.			trans	-119.2	152	-179.3	-170.7	0	0	0	0	112.4	T588 Y593 F673	S548-T588 WeakPolarHBondContact CA-OG1 3.37Å; S548-T588 PolarHBondContact OG-OG1 2.87Å; S548-Y593 PolarHBondContact OG-OH 3.41Å; S548-F673 WeakPolarHBondContact CA-O 3.44Å; S548-F673 WeakPolarHBondContact CB-O 3.3Å; S548-F673 PolarHBondContact N-O 3.33Å
549	T	74.8	Confident	71.3	Confident	20 Å²	20	48.7 Å²	48.7	12%	0.123	25%	0.253	C	S	.	.			trans	-83.4	135.1	164.9	54.4	0	0	0	0	109.2	K551 Q566 F570 Y642	T549-K551 PolarHBondContact O-N 3.46Å; T549-Q566 WeakPolarHBondContact CG2-O 3.31Å; T549-F570 HydrophobicContact CG2-CD2 4.22Å; T549-F570 HydrophobicContact CG2-CE2 3.32Å; T549-F570 HydrophobicContact CG2-CZ 3.69Å; T549-Y642 HydrophobicContact CG2-CD2 4.23Å; T549-Y642 HydrophobicContact CG2-CE2 3.82Å
550	S	68.8	Low	69.4	Low	11.5 Å²	11.5	53.5 Å²	53.5	8%	0.08	29%	0.287	C	S	.	.			trans	-81.7	125.1	175.3	-174.6	0	0	0	0	111.7	D675 S702	S550-D675 VanDerWaalsContact CA-OD1 3.27Å; S550-D675 WeakPolarHBondContact CA-OD1 3.46Å; S550-D675 VanDerWaalsContact CB-OD1 3.27Å; S550-D675 WeakPolarHBondContact CB-OD1 3.31Å; S550-D675 PolarHBondContact OG-OD1 2.86Å; S550-S702 WeakPolarHBondContact OG-CB 3.26Å
551	K	66.9	Low	67.9	Low	101 Å²	101	51.5 Å²	51.5	44%	0.439	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-31.7	177.6	-64.4	176.6	-176.6	180	0	112.1	T549 V553 D591 D675	T549-K551 PolarHBondContact O-N 3.46Å; K551-V553 VanDerWaalsContact C-N 3.33Å; K551-V553 PolarHBondContact O-N 3.33Å; K551-D591 VanDerWaalsContact CE-OD1 3.27Å; K551-D591 WeakPolarHBondContact CE-OD1 3.27Å; K551-D591 PolarHBondContact NZ-O 3.09Å; K551-D675 WeakPolarHBondContact CB-OD2 3.4Å; K551-D675 WeakPolarHBondContact CG-OD2 3.24Å; K551-D675 PolarHBondContact N-OD2 3.14Å
552	Y	56.9	Low	66.6	Low	109.5 Å²	109.5	56.6 Å²	56.6	43%	0.429	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	18	-168	-55.8	-85.5	0	0	0	113.9	N554 S702 V706	Y552-N554 PolarHBondContact O-N 2.99Å; Y552-S702 WeakPolarHBondContact O-CB 3.45Å; Y552-V706 HydrophobicContact CD1-CG2 4.15Å; Y552-V706 HydrophobicContact CD2-CB 4.14Å; Y552-V706 HydrophobicContact CD2-CG1 3.69Å; Y552-V706 HydrophobicContact CD2-CG2 3.86Å; Y552-V706 VanDerWaalsContact CD2-CG2 3.49Å; Y552-V706 HydrophobicContact CE1-CG1 4.46Å; Y552-V706 HydrophobicContact CE1-CG2 4.48Å; Y552-V706 HydrophobicContact CE2-CB 4.31Å; Y552-V706 HydrophobicContact CE2-CG1 3.4Å; Y552-V706 HydrophobicContact CE2-CG2 4.09Å; Y552-V706 HydrophobicContact CG-CB 4.41Å; Y552-V706 HydrophobicContact CG-CG1 4.06Å; Y552-V706 HydrophobicContact CG-CG2 3.76Å; Y552-V706 VanDerWaalsContact CG-CG2 3.42Å
553	V	58	Low	65.1	Low	31.5 Å²	31.5	57.5 Å²	57.5	19%	0.191	30%	0.297	C	S	.	.			trans	-70	101.9	177.2	-179.9	0	0	0	0	109.2	K551 S555 V565	K551-V553 VanDerWaalsContact C-N 3.33Å; K551-V553 PolarHBondContact O-N 3.33Å; V553-S555 PolarHBondContact O-N 3.01Å; V553-V565 HydrophobicContact CB-CG1 4.19Å; V553-V565 HydrophobicContact CG1-CB 3.87Å; V553-V565 HydrophobicContact CG1-CG1 3.54Å; V553-V565 VanDerWaalsContact CG1-CG1 3.44Å; V553-V565 HydrophobicContact CG1-CG2 4.27Å; V553-V565 HydrophobicContact CG2-CB 4.4Å; V553-V565 HydrophobicContact CG2-CG1 3.55Å; V553-V565 VanDerWaalsContact CG2-CG1 3.47Å
554	N	52.8	Low	64	Low	70.5 Å²	70.5	59.3 Å²	59.3	38%	0.377	30%	0.304	S	S	.	.			trans	-62.5	97.2	177.6	-125	-37.6	0	0	0	110.5	Y552 S556 K557 E704	Y552-N554 PolarHBondContact O-N 2.99Å; N554-S556 PolarHBondContact O-N 3.04Å; N554-S556 VanDerWaalsContact O-N 3.09Å; N554-S556 PolarHBondContact OD1-OG 3.23Å; N554-K557 PolarHBondContact O-N 2.89Å; N554-E704 WeakPolarHBondContact CB-OE1 3.36Å; N554-E704 PolarHBondContact ND2-OE1 2.88Å
555	S	50.4	Low	62.7	Low	62.5 Å²	62.5	59.6 Å²	59.6	44%	0.437	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-20.7	-174	2.7	0	0	0	0	113.3	V553 K562	V553-S555 PolarHBondContact O-N 3.01Å; S555-K562 WeakPolarHBondContact O-CE 3.32Å
556	S	48.1	Very low	61.5	Low	77.5 Å²	77.5	62.9 Å²	62.9	54%	0.542	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-35.9	-177.3	60	0	0	0	0	113.8	N554	N554-S556 PolarHBondContact O-N 3.04Å; N554-S556 VanDerWaalsContact O-N 3.09Å; N554-S556 PolarHBondContact OD1-OG 3.23Å
557	K	48.8	Very low	60.9	Low	157.5 Å²	157.5	62.8 Å²	62.8	69%	0.685	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-25.5	-175.2	-72.3	-180	-179	167.3	0	113.5	N554 K559	N554-K557 PolarHBondContact O-N 2.89Å; K557-K559 PolarHBondContact O-N 3.25Å
558	H	46.8	Very low	60.4	Low	72.5 Å²	72.5	62.9 Å²	62.9	34%	0.336	32%	0.322	S	S	.	.			trans	-110.2	61.3	-174.6	-68.4	-71.6	0	0	0	113.1	S560 S561 K562	H558-S560 VanDerWaalsContact C-N 3.28Å; H558-S560 PolarHBondContact O-N 2.86Å; H558-S560 VanDerWaalsContact O-N 3.13Å; H558-S561 PolarHBondContact O-N 3.2Å; H558-S561 VanDerWaalsContact O-N 3.07Å; H558-K562 WeakPolarHBondContact O-CG 3.29Å; H558-K562 PolarHBondContact O-N 3.38Å
559	K	43.8	Very low	60.4	Low	189.5 Å²	189.5	62.8 Å²	62.8	82%	0.824	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-32.8	-176.3	-75.7	-174.9	177.8	-179.9	0	115.3	K557 S561	K557-K559 PolarHBondContact O-N 3.25Å; K559-S561 VanDerWaalsContact C-N 3.3Å; K559-S561 PolarHBondContact O-N 3.15Å
560	S	45.8	Very low	61	Low	101.5 Å²	101.5	61.9 Å²	61.9	71%	0.71	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-10.9	-178.9	55.2	0	0	0	0	114.6	H558	H558-S560 VanDerWaalsContact C-N 3.28Å; H558-S560 PolarHBondContact O-N 2.86Å; H558-S560 VanDerWaalsContact O-N 3.13Å
561	S	50	Low	61.9	Low	25 Å²	25	61.4 Å²	61.4	18%	0.175	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.2	16	-155.4	-90.8	0	0	0	0	112	H558 K559 S563 Y564 V565	H558-S561 PolarHBondContact O-N 3.2Å; H558-S561 VanDerWaalsContact O-N 3.07Å; K559-S561 VanDerWaalsContact C-N 3.3Å; K559-S561 PolarHBondContact O-N 3.15Å; S561-S563 PolarHBondContact O-N 2.77Å; S561-Y564 VanDerWaalsContact C-CE1 3.42Å; S561-Y564 VanDerWaalsContact CA-CD1 3.47Å; S561-Y564 VanDerWaalsContact CA-CE1 3.45Å; S561-Y564 VanDerWaalsContact CB-CD1 3.44Å; S561-Y564 WeakPolarHBondContact CB-OH 3.49Å; S561-Y564 WeakPolarHBondContact O-CD1 3.48Å; S561-Y564 WeakPolarHBondContact O-CE1 2.92Å; S561-Y564 PolarHBondContact O-N 3.24Å; S561-Y564 WeakPolarHBondContact OG-CD1 3.41Å; S561-Y564 WeakPolarHBondContact OG-CE1 3.43Å; S561-Y564 PolarHBondContact OG-OH 3.18Å; S561-V565 WeakPolarHBondContact O-CG2 3.18Å
562	K	53.1	Low	62.9	Low	125.5 Å²	125.5	56.9 Å²	56.9	55%	0.546	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-34.3	-175.7	-70.5	-173.6	172.9	-174.8	0	114.8	S555 H558	S555-K562 WeakPolarHBondContact O-CE 3.32Å; H558-K562 WeakPolarHBondContact O-CG 3.29Å; H558-K562 PolarHBondContact O-N 3.38Å
563	S	57.2	Low	64.4	Low	39 Å²	39	51.7 Å²	51.7	27%	0.273	27%	0.272	S	S	.	.	H	α-helix	trans	-77.6	-31.8	-171.9	126.7	0	0	0	0	114.5	D458 S561 I567	D458-S563 PolarHBondContact OD1-OG 3.22Å; D458-S563 PolarHBondContact OD2-OG 2.85Å; S561-S563 PolarHBondContact O-N 2.77Å; S563-I567 WeakPolarHBondContact O-CD1 3.36Å; S563-I567 WeakPolarHBondContact O-CG1 3.5Å
564	Y	66.7	Low	65.8	Low	37 Å²	37	50.4 Å²	50.4	15%	0.145	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-23.5	-169.6	74.5	-84.6	0	0	0	113.9	F451 F454 S561 Q566 I567 L568	F451-Y564 AromaticContact CE2-CD2 3.76Å; F451-Y564 HydrophobicContact CE2-CD2 3.76Å; F451-Y564 HydrophobicContact CE2-CE2 4.04Å; F451-Y564 AromaticContact CZ-CD2 3.59Å; F451-Y564 HydrophobicContact CZ-CD2 3.59Å; F451-Y564 AromaticContact CZ-CE2 3.57Å; F451-Y564 HydrophobicContact CZ-CE2 3.57Å; F454-Y564 HydrophobicContact CE1-CD1 4.17Å; F454-Y564 AromaticContact CE1-CD2 3.78Å; F454-Y564 HydrophobicContact CE1-CD2 3.78Å; F454-Y564 AromaticContact CE1-CG 3.59Å; F454-Y564 HydrophobicContact CE1-CG 3.59Å; F454-Y564 HydrophobicContact CZ-CG 4.28Å; S561-Y564 VanDerWaalsContact C-CE1 3.42Å; S561-Y564 VanDerWaalsContact CA-CD1 3.47Å; S561-Y564 VanDerWaalsContact CA-CE1 3.45Å; S561-Y564 VanDerWaalsContact CB-CD1 3.44Å; S561-Y564 WeakPolarHBondContact CB-OH 3.49Å; S561-Y564 WeakPolarHBondContact O-CD1 3.48Å; S561-Y564 WeakPolarHBondContact O-CE1 2.92Å; S561-Y564 PolarHBondContact O-N 3.24Å; S561-Y564 WeakPolarHBondContact OG-CD1 3.41Å; S561-Y564 WeakPolarHBondContact OG-CE1 3.43Å; S561-Y564 PolarHBondContact OG-OH 3.18Å; Y564-Q566 VanDerWaalsContact C-N 3.28Å; Y564-Q566 PolarHBondContact O-N 2.9Å; Y564-I567 WeakPolarHBondContact O-CG1 3.41Å; Y564-I567 PolarHBondContact O-N 3.18Å; Y564-L568 HydrophobicContact CD2-CD1 4.14Å; Y564-L568 HydrophobicContact CE2-CD1 4.25Å; Y564-L568 PolarHBondContact O-N 3.16Å
565	V	66.4	Low	67.5	Low	9 Å²	9	47.1 Å²	47.1	6%	0.055	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-35.8	-178.3	-170.2	0	0	0	0	111.4	V553 S561 I567 L568	V553-V565 HydrophobicContact CB-CG1 4.19Å; V553-V565 HydrophobicContact CG1-CB 3.87Å; V553-V565 HydrophobicContact CG1-CG1 3.54Å; V553-V565 VanDerWaalsContact CG1-CG1 3.44Å; V553-V565 HydrophobicContact CG1-CG2 4.27Å; V553-V565 HydrophobicContact CG2-CB 4.4Å; V553-V565 HydrophobicContact CG2-CG1 3.55Å; V553-V565 VanDerWaalsContact CG2-CG1 3.47Å; S561-V565 WeakPolarHBondContact O-CG2 3.18Å; V565-I567 VanDerWaalsContact C-N 3.31Å; V565-I567 PolarHBondContact O-N 3.12Å; V565-L568 VanDerWaalsContact O-CB 3.27Å; V565-L568 WeakPolarHBondContact O-CB 3.41Å; V565-L568 PolarHBondContact O-N 3.09Å
566	Q	69.6	Low	69.4	Low	70 Å²	70	44.2 Å²	44.2	33%	0.327	23%	0.227	S	C	.	.	H	α-helix	trans	-66.3	-28	178.2	-65.9	-175.9	-5.3	0	0	113.6	A107 T549 Y564 Y642	A107-Q566 VanDerWaalsContact CB-OE1 3.25Å; A107-Q566 PolarHBondContact O-NE2 2.88Å; A107-Q566 PolarHBondContact O-OE1 3.42Å; T549-Q566 WeakPolarHBondContact CG2-O 3.31Å; Y564-Q566 VanDerWaalsContact C-N 3.28Å; Y564-Q566 PolarHBondContact O-N 2.9Å; Q566-Y642 HydrophobicContact CB-CE2 4.16Å; Q566-Y642 WeakPolarHBondContact CB-OH 3.4Å; Q566-Y642 WeakPolarHBondContact O-CE2 3.28Å; Q566-Y642 PolarHBondContact OE1-OH 3.22Å
567	I	79.3	Confident	71.4	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-92.5	-8.8	179.4	1.3	169.2	0	0	0	111.3	W103 L104 F454 S563 Y564 V565 G569 F570 L571 T638 K639 Y642	W103-I567 HydrophobicContact CH2-CD1 4.17Å; W103-I567 HydrophobicContact CZ3-CG2 3.87Å; L104-I567 HydrophobicContact CD1-CD1 4.48Å; F454-I567 HydrophobicContact CE2-CD1 4.48Å; F454-I567 HydrophobicContact CZ-CB 4.46Å; F454-I567 HydrophobicContact CZ-CD1 3.9Å; F454-I567 HydrophobicContact CZ-CG2 4.18Å; S563-I567 WeakPolarHBondContact O-CD1 3.36Å; S563-I567 WeakPolarHBondContact O-CG1 3.5Å; Y564-I567 WeakPolarHBondContact O-CG1 3.41Å; Y564-I567 PolarHBondContact O-N 3.18Å; V565-I567 VanDerWaalsContact C-N 3.31Å; V565-I567 PolarHBondContact O-N 3.12Å; I567-G569 VanDerWaalsContact C-N 3.31Å; I567-G569 PolarHBondContact O-N 3.09Å; I567-F570 CarbonylContact O-C 3.6Å; I567-F570 WeakPolarHBondContact O-CB 3.46Å; I567-F570 PolarHBondContact O-N 3.22Å; I567-L571 PolarHBondContact O-N 2.93Å; I567-T638 HydrophobicContact CB-CG2 4.41Å; I567-T638 HydrophobicContact CG2-CG2 3.7Å; I567-K639 HydrophobicContact CD1-CG 4.42Å; I567-Y642 HydrophobicContact CB-CD2 4.49Å; I567-Y642 HydrophobicContact CD1-CD1 4.07Å; I567-Y642 HydrophobicContact CD1-CG 4.2Å; I567-Y642 HydrophobicContact CG1-CD1 3.81Å; I567-Y642 HydrophobicContact CG1-CD2 3.72Å; I567-Y642 HydrophobicContact CG1-CE1 4.21Å; I567-Y642 HydrophobicContact CG1-CE2 4.12Å; I567-Y642 HydrophobicContact CG1-CG 3.57Å; I567-Y642 HydrophobicContact CG2-CD2 3.4Å; I567-Y642 VanDerWaalsContact CG2-CD2 3.4Å; I567-Y642 HydrophobicContact CG2-CE2 3.86Å; I567-Y642 HydrophobicContact CG2-CG 3.82Å
568	L	80.4	Confident	73.1	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-39.9	-169.6	-172.5	66.2	0	0	0	113	F451 Y564 V565 F570 L571 L572 L701 C722	F451-L568 HydrophobicContact CD2-CD1 3.98Å; F451-L568 HydrophobicContact CE1-CD1 4.04Å; F451-L568 HydrophobicContact CE2-CD1 3.85Å; F451-L568 HydrophobicContact CZ-CD1 3.27Å; F451-L568 HydrophobicContact CZ-CG 4.29Å; Y564-L568 HydrophobicContact CD2-CD1 4.14Å; Y564-L568 HydrophobicContact CE2-CD1 4.25Å; Y564-L568 PolarHBondContact O-N 3.16Å; V565-L568 VanDerWaalsContact O-CB 3.27Å; V565-L568 WeakPolarHBondContact O-CB 3.41Å; V565-L568 PolarHBondContact O-N 3.09Å; L568-F570 VanDerWaalsContact C-N 3.3Å; L568-F570 PolarHBondContact O-N 3.07Å; L568-L571 HydrophobicContact CD1-CD2 4.45Å; L568-L571 PolarHBondContact O-N 2.84Å; L568-L572 HydrophobicContact CD1-CG 4.44Å; L568-L572 HydrophobicContact CG-CD1 4.18Å; L568-L572 HydrophobicContact CG-CG 4.47Å; L568-L572 WeakPolarHBondContact O-CB 3.46Å; L568-L572 PolarHBondContact O-N 3.07Å; L568-L701 HydrophobicContact CB-CD1 4.22Å; L568-L701 HydrophobicContact CD2-CD1 4.32Å; L568-L701 HydrophobicContact CD2-CD2 4.07Å; L568-L701 HydrophobicContact CG-CD1 4.22Å; L568-L701 HydrophobicContact CG-CD2 4.4Å; L568-C722 HydrophobicContact CD2-CB 3.49Å; L568-C722 VanDerWaalsContact CD2-CB 3.42Å; L568-C722 WeakPolarHBondContact CD2-SG 3.31Å
569	G	84.6	Confident	75.1	Confident	1.5 Å²	1.5	34.6 Å²	34.6	2%	0.015	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-35.1	175.7	0	0	0	0	0	112.4	I567 G573 L701	I567-G569 VanDerWaalsContact C-N 3.31Å; I567-G569 PolarHBondContact O-N 3.09Å; G569-G573 WeakPolarHBondContact O-CA 3.46Å; G569-G573 PolarHBondContact O-N 2.98Å; G569-L701 VanDerWaalsContact CA-CD1 3.44Å; G569-L701 VanDerWaalsContact N-CD1 3.32Å
570	F	86.8	Confident	77.2	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-74.4	-36.1	176.2	-64.4	-94.7	0	0	0	111.7	C547 T549 I567 L568 A574 V587 T638 M641 Y642	C547-F570 HydrophobicContact CB-CD1 3.83Å; C547-F570 HydrophobicContact CB-CE1 4.28Å; T549-F570 HydrophobicContact CG2-CD2 4.22Å; T549-F570 HydrophobicContact CG2-CE2 3.32Å; T549-F570 HydrophobicContact CG2-CZ 3.69Å; I567-F570 CarbonylContact O-C 3.6Å; I567-F570 WeakPolarHBondContact O-CB 3.46Å; I567-F570 PolarHBondContact O-N 3.22Å; L568-F570 VanDerWaalsContact C-N 3.3Å; L568-F570 PolarHBondContact O-N 3.07Å; F570-A574 VanDerWaalsContact O-CB 3.28Å; F570-A574 WeakPolarHBondContact O-CB 3.29Å; F570-A574 PolarHBondContact O-N 3.39Å; F570-V587 HydrophobicContact CD1-CG1 3.89Å; F570-V587 HydrophobicContact CE1-CG1 3.34Å; F570-V587 VanDerWaalsContact CE1-CG1 3.45Å; F570-V587 HydrophobicContact CE2-CG1 4.13Å; F570-V587 HydrophobicContact CZ-CG1 3.86Å; F570-T638 HydrophobicContact CB-CG2 3.88Å; F570-M641 HydrophobicContact CB-CB 4.22Å; F570-M641 HydrophobicContact CB-CE 3.9Å; F570-M641 HydrophobicContact CB-SD 4.37Å; F570-M641 HydrophobicContact CD1-CB 4.27Å; F570-M641 HydrophobicContact CD1-CE 3.7Å; F570-M641 HydrophobicContact CD1-CG 3.76Å; F570-M641 HydrophobicContact CD1-SD 4.3Å; F570-M641 HydrophobicContact CE1-CE 4.3Å; F570-M641 HydrophobicContact CE1-CG 3.99Å; F570-M641 HydrophobicContact CG-CB 4.25Å; F570-M641 HydrophobicContact CG-CE 3.84Å; F570-Y642 AromaticContact CD2-CD2 3.98Å; F570-Y642 HydrophobicContact CD2-CD2 3.98Å; F570-Y642 AromaticContact CE2-CD2 3.8Å; F570-Y642 HydrophobicContact CE2-CD2 3.8Å
571	L	87.2	Confident	79	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-66.4	-52.2	176.1	-177.1	62.3	0	0	0	110.8	F451 F454 I567 L568 G573 A574 M575 I634 L635 T638	F451-L571 HydrophobicContact CD1-CD2 4.23Å; F451-L571 HydrophobicContact CE1-CD2 3.8Å; F451-L571 HydrophobicContact CE1-CG 4.25Å; F454-L571 HydrophobicContact CB-CD2 4.14Å; F454-L571 HydrophobicContact CD1-CD2 3.74Å; F454-L571 HydrophobicContact CD2-CD2 4.1Å; F454-L571 HydrophobicContact CE1-CD2 4.12Å; F454-L571 HydrophobicContact CE2-CD2 4.27Å; F454-L571 HydrophobicContact CG-CD2 3.71Å; F454-L571 HydrophobicContact CZ-CD2 4.26Å; I567-L571 PolarHBondContact O-N 2.93Å; L568-L571 HydrophobicContact CD1-CD2 4.45Å; L568-L571 PolarHBondContact O-N 2.84Å; L571-G573 VanDerWaalsContact C-N 3.28Å; L571-G573 PolarHBondContact O-N 3.09Å; L571-A574 PolarHBondContact O-N 3.21Å; L571-M575 HydrophobicContact CD1-CE 3.74Å; L571-M575 HydrophobicContact CD1-CG 4.32Å; L571-M575 HydrophobicContact CD1-SD 4.31Å; L571-M575 HydrophobicContact CD2-CE 4.13Å; L571-M575 HydrophobicContact CG-CE 3.75Å; L571-M575 HydrophobicContact CG-CG 4.49Å; L571-M575 HydrophobicContact CG-SD 4.12Å; L571-M575 WeakPolarHBondContact O-CB 3.41Å; L571-M575 VanDerWaalsContact O-CG 3.22Å; L571-M575 WeakPolarHBondContact O-CG 3.42Å; L571-M575 PolarHBondContact O-N 3.05Å; L571-I634 HydrophobicContact CD1-CG2 4.37Å; L571-L635 HydrophobicContact CD1-CD2 3.82Å; L571-T638 HydrophobicContact CB-CG2 4.01Å; L571-T638 HydrophobicContact CD1-CG2 4.38Å; L571-T638 WeakPolarHBondContact CD1-OG1 3.18Å
572	L	88	Confident	80.7	Confident	6 Å²	6	29.5 Å²	29.5	3%	0.031	16%	0.157	C	C	.	.	H	α-helix	trans	-60.3	-40.7	176.4	-74	171.8	0	0	0	111.5	F451 L568 M575 C576 F673 L701 I726 L727	F451-L572 HydrophobicContact CE1-CD2 3.85Å; F451-L572 HydrophobicContact CE1-CG 4.3Å; F451-L572 HydrophobicContact CE2-CD2 4.27Å; F451-L572 HydrophobicContact CZ-CD1 4.19Å; F451-L572 HydrophobicContact CZ-CD2 3.36Å; F451-L572 HydrophobicContact CZ-CG 3.65Å; L568-L572 HydrophobicContact CD1-CG 4.44Å; L568-L572 HydrophobicContact CG-CD1 4.18Å; L568-L572 HydrophobicContact CG-CG 4.47Å; L568-L572 WeakPolarHBondContact O-CB 3.46Å; L568-L572 PolarHBondContact O-N 3.07Å; L572-M575 PolarHBondContact O-N 3.02Å; L572-C576 WeakPolarHBondContact O-CB 3.4Å; L572-C576 PolarHBondContact O-N 3.18Å; L572-F673 HydrophobicContact CB-CD1 3.78Å; L572-F673 HydrophobicContact CB-CD2 4.12Å; L572-F673 HydrophobicContact CB-CE1 3.82Å; L572-F673 HydrophobicContact CB-CE2 4.16Å; L572-F673 HydrophobicContact CB-CG 3.92Å; L572-F673 HydrophobicContact CB-CZ 4.01Å; L572-F673 HydrophobicContact CD1-CD1 3.88Å; L572-F673 HydrophobicContact CD1-CE1 4.14Å; L572-F673 HydrophobicContact CG-CD1 4.34Å; L572-F673 HydrophobicContact CG-CE1 4.31Å; L572-L701 HydrophobicContact CD1-CD1 4.33Å; L572-L701 HydrophobicContact CD1-CD2 3.77Å; L572-I726 HydrophobicContact CD2-CG2 4.12Å; L572-L727 HydrophobicContact CD2-CD1 4.5Å; L572-L727 HydrophobicContact CD2-CG 4.43Å
573	G	88.5	Confident	82.5	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.3	-50.8	173.7	0	0	0	0	0	113.3	C547 G569 L571 M575 C576 T577	C547-G573 WeakPolarHBondContact SG-CA 3.33Å; G569-G573 WeakPolarHBondContact O-CA 3.46Å; G569-G573 PolarHBondContact O-N 2.98Å; L571-G573 VanDerWaalsContact C-N 3.28Å; L571-G573 PolarHBondContact O-N 3.09Å; G573-M575 PolarHBondContact O-N 3.4Å; G573-C576 PolarHBondContact O-N 3.17Å; G573-T577 WeakPolarHBondContact O-CB 3.28Å; G573-T577 PolarHBondContact O-N 3.27Å; G573-T577 PolarHBondContact O-OG1 3.13Å
574	A	88	Confident	84.1	Confident	5.5 Å²	5.5	24.7 Å²	24.7	5%	0.045	14%	0.137	C	C	.	.	H	α-helix	trans	-62	-39	176.6	0	0	0	0	0	112	F570 L571 T577 S578 I634 R637 M641	F570-A574 VanDerWaalsContact O-CB 3.28Å; F570-A574 WeakPolarHBondContact O-CB 3.29Å; F570-A574 PolarHBondContact O-N 3.39Å; L571-A574 PolarHBondContact O-N 3.21Å; A574-T577 PolarHBondContact O-N 2.93Å; A574-S578 PolarHBondContact O-N 3.03Å; A574-S578 VanDerWaalsContact O-N 3.17Å; A574-S578 PolarHBondContact O-OG 3.31Å; A574-I634 HydrophobicContact CB-CD1 4.35Å; A574-I634 HydrophobicContact CB-CG1 4.24Å; A574-I634 HydrophobicContact CB-CG2 4.22Å; A574-R637 HydrophobicContact CB-CB 4.49Å; A574-M641 HydrophobicContact CB-SD 4.03Å
575	M	89	Confident	85.3	Confident	1.5 Å²	1.5	23.2 Å²	23.2	1%	0.007	13%	0.132	C	C	.	.	H	α-helix	trans	-64.2	-49.5	175.7	-70.4	176.4	115.5	0	0	111.6	P450 F451 L528 M532 L536 L571 L572 G573 T577 S578 I579 I634 D724 L727	P450-M575 HydrophobicContact CB-CE 3.4Å; P450-M575 HydrophobicContact CB-SD 4.06Å; P450-M575 HydrophobicContact CG-CE 3.56Å; F451-M575 HydrophobicContact CD1-CE 4.15Å; F451-M575 HydrophobicContact CD1-SD 4.26Å; F451-M575 HydrophobicContact CE1-CE 4.14Å; F451-M575 HydrophobicContact CE1-SD 3.85Å; L528-M575 HydrophobicContact CD1-CE 3.99Å; L528-M575 HydrophobicContact CD2-CE 3.97Å; L528-M575 HydrophobicContact CG-CE 4.18Å; M532-M575 VanDerWaalsContact CE-CA 3.48Å; M532-M575 HydrophobicContact CE-CB 3.62Å; M532-M575 HydrophobicContact CE-CG 3.75Å; M532-M575 HydrophobicContact CG-CE 3.99Å; M532-M575 HydrophobicContact SD-CB 4.18Å; M532-M575 HydrophobicContact SD-CE 4.07Å; M532-M575 HydrophobicContact SD-CG 3.64Å; M532-M575 VanDerWaalsContact SD-CG 3.57Å; M532-M575 HydrophobicContact SD-SD 4.35Å; L536-M575 HydrophobicContact CD1-CE 4.24Å; L571-M575 HydrophobicContact CD1-CE 3.74Å; L571-M575 HydrophobicContact CD1-CG 4.32Å; L571-M575 HydrophobicContact CD1-SD 4.31Å; L571-M575 HydrophobicContact CD2-CE 4.13Å; L571-M575 HydrophobicContact CG-CE 3.75Å; L571-M575 HydrophobicContact CG-CG 4.49Å; L571-M575 HydrophobicContact CG-SD 4.12Å; L571-M575 WeakPolarHBondContact O-CB 3.41Å; L571-M575 VanDerWaalsContact O-CG 3.22Å; L571-M575 WeakPolarHBondContact O-CG 3.42Å; L571-M575 PolarHBondContact O-N 3.05Å; L572-M575 PolarHBondContact O-N 3.02Å; G573-M575 PolarHBondContact O-N 3.4Å; M575-T577 VanDerWaalsContact C-N 3.32Å; M575-T577 PolarHBondContact O-N 3.23Å; M575-S578 PolarHBondContact O-N 3.23Å; M575-S578 VanDerWaalsContact O-N 3.12Å; M575-S578 PolarHBondContact O-OG 3.25Å; M575-I579 WeakPolarHBondContact O-CG1 3.42Å; M575-I579 PolarHBondContact O-N 2.93Å; M575-I634 HydrophobicContact CG-CG2 4.03Å; M575-D724 HydrophobicContact CE-CB 4.4Å; M575-L727 HydrophobicContact CB-CD1 3.99Å; M575-L727 HydrophobicContact CE-CD1 3.73Å; M575-L727 HydrophobicContact SD-CD1 4.18Å
576	C	88.8	Confident	86.5	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.5	-46.5	177.8	-165.7	0	0	0	0	110.8	I545 L572 G573 S578 I579 C580 F673 L727	I545-C576 HydrophobicContact CD1-CB 3.93Å; I545-C576 VanDerWaalsContact CD1-SG 3.6Å; L572-C576 WeakPolarHBondContact O-CB 3.4Å; L572-C576 PolarHBondContact O-N 3.18Å; G573-C576 PolarHBondContact O-N 3.17Å; C576-S578 VanDerWaalsContact C-N 3.26Å; C576-S578 PolarHBondContact O-N 2.85Å; C576-S578 VanDerWaalsContact O-N 3.13Å; C576-I579 VanDerWaalsContact O-CG1 3.25Å; C576-I579 WeakPolarHBondContact O-CG1 3.31Å; C576-I579 PolarHBondContact O-N 3.01Å; C576-I579 VanDerWaalsContact O-N 3.14Å; C576-C580 WeakPolarHBondContact O-CB 3.37Å; C576-C580 PolarHBondContact O-N 2.87Å; C576-C580 PolarHBondContact O-SG 3.15Å; C576-F673 HydrophobicContact CB-CE2 3.77Å; C576-F673 HydrophobicContact CB-CZ 4.1Å; C576-L727 HydrophobicContact CB-CD2 4.03Å
577	T	89.9	Confident	87.4	Confident	26 Å²	26	21.2 Å²	21.2	16%	0.16	12%	0.121	C	C	.	.	H	α-helix	trans	-56.8	-35.4	176.4	-55	0	0	0	0	112.5	G573 A574 M575 P583 T585 I598	G573-T577 WeakPolarHBondContact O-CB 3.28Å; G573-T577 PolarHBondContact O-N 3.27Å; G573-T577 PolarHBondContact O-OG1 3.13Å; A574-T577 PolarHBondContact O-N 2.93Å; M575-T577 VanDerWaalsContact C-N 3.32Å; M575-T577 PolarHBondContact O-N 3.23Å; T577-P583 HydrophobicContact CG2-CB 4.02Å; T577-P583 HydrophobicContact CG2-CG 3.98Å; T577-P583 WeakPolarHBondContact O-CG 3.45Å; T577-T585 WeakPolarHBondContact OG1-CG2 3.24Å; T577-T585 PolarHBondContact OG1-OG1 3.27Å; T577-I598 HydrophobicContact CG2-CD1 4.36Å
578	S	86.2	Confident	87.8	Confident	60 Å²	60	21 Å²	21	42%	0.42	12%	0.12	S	C	.	.	H	α-helix	trans	-80.5	-17.4	-179.7	64.7	0	0	0	0	115.2	M532 A574 M575 C576	M532-S578 WeakPolarHBondContact CE-OG 3.42Å; A574-S578 PolarHBondContact O-N 3.03Å; A574-S578 VanDerWaalsContact O-N 3.17Å; A574-S578 PolarHBondContact O-OG 3.31Å; M575-S578 PolarHBondContact O-N 3.23Å; M575-S578 VanDerWaalsContact O-N 3.12Å; M575-S578 PolarHBondContact O-OG 3.25Å; C576-S578 VanDerWaalsContact C-N 3.26Å; C576-S578 PolarHBondContact O-N 2.85Å; C576-S578 VanDerWaalsContact O-N 3.13Å
579	I	87.5	Confident	87.9	Confident	21 Å²	21	21.4 Å²	21.4	11%	0.108	12%	0.122	C	C	.	.	H	α-helix	trans	-102.6	-17.2	-179.2	0.5	172.3	0	0	0	112.1	M532 L536 P537 I539 M575 C576 L727	M532-I579 HydrophobicContact CB-CD1 4.46Å; M532-I579 HydrophobicContact CE-CD1 3.68Å; M532-I579 HydrophobicContact CE-CG1 3.91Å; M532-I579 HydrophobicContact CE-CG2 4.15Å; L536-I579 HydrophobicContact CB-CD1 4.02Å; L536-I579 HydrophobicContact CD1-CD1 3.5Å; L536-I579 HydrophobicContact CG-CD1 4.4Å; P537-I579 VanDerWaalsContact O-CG2 3.28Å; P537-I579 WeakPolarHBondContact O-CG2 3.46Å; I539-I579 HydrophobicContact CD1-CB 4.4Å; I539-I579 HydrophobicContact CD1-CD1 3.51Å; I539-I579 HydrophobicContact CD1-CG1 3.8Å; I539-I579 HydrophobicContact CD1-CG2 4.14Å; I539-I579 HydrophobicContact CG1-CD1 3.88Å; I539-I579 HydrophobicContact CG1-CG1 4.08Å; I539-I579 HydrophobicContact CG1-CG2 4Å; I539-I579 PolarHBondContact N-O 3.29Å; I539-I579 VanDerWaalsContact N-O 3.13Å; M575-I579 WeakPolarHBondContact O-CG1 3.42Å; M575-I579 PolarHBondContact O-N 2.93Å; C576-I579 VanDerWaalsContact O-CG1 3.25Å; C576-I579 WeakPolarHBondContact O-CG1 3.31Å; C576-I579 PolarHBondContact O-N 3.01Å; C576-I579 VanDerWaalsContact O-N 3.14Å; I579-L727 HydrophobicContact CD1-CB 4.06Å; I579-L727 HydrophobicContact CD1-CD1 4.23Å; I579-L727 HydrophobicContact CD1-CD2 4.45Å; I579-L727 HydrophobicContact CD1-CG 4.44Å
580	C	88	Confident	87.6	Confident	13 Å²	13	23.7 Å²	23.7	9%	0.088	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	142.1	176.1	-70	0	0	0	0	112	I539 C576 P583	I539-C580 HydrophobicContact CB-CB 4.49Å; I539-C580 WeakPolarHBondContact O-CA 3.47Å; C576-C580 WeakPolarHBondContact O-CB 3.37Å; C576-C580 PolarHBondContact O-N 2.87Å; C576-C580 PolarHBondContact O-SG 3.15Å; C580-P583 HydrophobicContact CB-CB 3.87Å; C580-P583 HydrophobicContact CB-CG 4.24Å
581	E	83.6	Confident	87	Confident	119.5 Å²	119.5	28.8 Å²	28.8	56%	0.558	16%	0.162	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-69	-47.5	174.9	-68.8	172.5	168.7	0	0	112.4	I539 C540 G541	I539-E581 PolarHBondContact O-N 3.26Å; C540-E581 WeakPolarHBondContact CA-OE2 3.39Å; C540-E581 PolarHBondContact SG-OE1 2.95Å; G541-E581 PolarHBondContact N-OE2 3.37Å; G541-E581 VanDerWaalsContact N-OE2 3.08Å
582	T	85	Confident	86.5	Confident	76.5 Å²	76.5	35.8 Å²	35.8	47%	0.469	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	70.4	-179.3	50.2	0	0	0	0	111.7	G541 S542 T543	G541-T582 VanDerWaalsContact C-OG1 3.29Å; G541-T582 PolarHBondContact O-OG1 3.18Å; G541-T582 VanDerWaalsContact O-OG1 3.11Å; S542-T582 WeakPolarHBondContact CA-OG1 3.32Å; S542-T582 PolarHBondContact N-OG1 2.73Å; T543-T582 PolarHBondContact N-O 3.16Å; T543-T582 VanDerWaalsContact N-O 3.16Å
583	P	90.8	Very high	86.2	Confident	43.5 Å²	43.5	36.2 Å²	36.2	28%	0.282	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	139.5	179.7	30.7	-34.2	0	0	0	111.6	I545 T577 C580	I545-P583 HydrophobicContact CD1-CB 4.1Å; T577-P583 HydrophobicContact CG2-CB 4.02Å; T577-P583 HydrophobicContact CG2-CG 3.98Å; T577-P583 WeakPolarHBondContact O-CG 3.45Å; C580-P583 HydrophobicContact CB-CB 3.87Å; C580-P583 HydrophobicContact CB-CG 4.24Å
584	T	91.2	Very high	86.1	Confident	19 Å²	19	37.5 Å²	37.5	12%	0.117	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	106.5	160.1	-57	0	0	0	0	107.4	T543 L544 I545 Y586 K665 F667	T543-T584 PolarHBondContact O-N 3.13Å; L544-T584 WeakPolarHBondContact CA-O 3.44Å; L544-T584 HydrophobicContact CD1-CG2 4.17Å; L544-T584 WeakPolarHBondContact CD1-O 3.07Å; I545-T584 PolarHBondContact N-O 3.36Å; T584-Y586 HydrophobicContact CG2-CD2 4.44Å; T584-Y586 HydrophobicContact CG2-CE2 3.8Å; T584-K665 WeakPolarHBondContact OG1-CE 3.4Å; T584-K665 PolarHBondContact OG1-NZ 3.26Å; T584-F667 HydrophobicContact CG2-CE1 4.44Å; T584-F667 HydrophobicContact CG2-CZ 4.34Å
585	T	91.9	Very high	86.2	Confident	6 Å²	6	37.4 Å²	37.4	4%	0.037	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	125.9	-170	-51.3	0	0	0	0	112.2	I545 T577 I598	I545-T585 HydrophobicContact CB-CG2 4.02Å; I545-T585 HydrophobicContact CG2-CG2 4.05Å; I545-T585 CarbonylContact O-C 3.56Å; I545-T585 VanDerWaalsContact O-CA 3.3Å; I545-T585 WeakPolarHBondContact O-CA 3.22Å; T577-T585 WeakPolarHBondContact OG1-CG2 3.24Å; T577-T585 PolarHBondContact OG1-OG1 3.27Å; T585-I598 HydrophobicContact CG2-CB 4.12Å; T585-I598 HydrophobicContact CG2-CD1 4.01Å; T585-I598 HydrophobicContact CG2-CG2 4.34Å; T585-I598 PolarHBondContact O-N 3.06Å
586	Y	91.8	Very high	86.1	Confident	34.5 Å²	34.5	37.4 Å²	37.4	14%	0.135	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	147	172	-70.6	-86.5	0	0	0	111.1	L544 I545 C547 T584 L595 P597 V656	L544-Y586 HydrophobicContact CD1-CD2 3.92Å; L544-Y586 HydrophobicContact CD1-CE2 4.09Å; I545-Y586 PolarHBondContact O-N 3.16Å; C547-Y586 PolarHBondContact N-O 2.98Å; T584-Y586 HydrophobicContact CG2-CD2 4.44Å; T584-Y586 HydrophobicContact CG2-CE2 3.8Å; Y586-L595 HydrophobicContact CD1-CB 4.04Å; Y586-L595 HydrophobicContact CG-CB 4.44Å; Y586-L595 HydrophobicContact CG-CD1 4.45Å; Y586-P597 HydrophobicContact CD1-CG 4.29Å; Y586-P597 HydrophobicContact CE1-CB 4.4Å; Y586-P597 HydrophobicContact CE1-CG 3.84Å; Y586-V656 HydrophobicContact CD1-CG1 4.25Å; Y586-V656 HydrophobicContact CD1-CG2 4.45Å; Y586-V656 HydrophobicContact CD2-CG1 4.27Å; Y586-V656 HydrophobicContact CE1-CG1 3.78Å; Y586-V656 HydrophobicContact CE1-CG2 4.19Å; Y586-V656 HydrophobicContact CE2-CG1 3.94Å; Y586-V656 HydrophobicContact CG-CG1 4.38Å
587	V	89.6	Confident	86	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	132.4	179.1	-175.8	0	0	0	0	108.8	C547 F570 L595 T596 I598 V601 M641	C547-V587 HydrophobicContact CB-CG2 4.2Å; F570-V587 HydrophobicContact CD1-CG1 3.89Å; F570-V587 HydrophobicContact CE1-CG1 3.34Å; F570-V587 VanDerWaalsContact CE1-CG1 3.45Å; F570-V587 HydrophobicContact CE2-CG1 4.13Å; F570-V587 HydrophobicContact CZ-CG1 3.86Å; V587-L595 WeakPolarHBondContact O-CA 3.48Å; V587-T596 PolarHBondContact N-O 3.35Å; V587-T596 PolarHBondContact O-N 2.97Å; V587-I598 HydrophobicContact CG2-CB 4.29Å; V587-I598 HydrophobicContact CG2-CG1 4.24Å; V587-V601 HydrophobicContact CB-CG2 4.41Å; V587-V601 HydrophobicContact CG2-CG2 4.26Å; V587-M641 HydrophobicContact CG1-CE 4.47Å; V587-M641 HydrophobicContact CG1-CG 4.39Å; V587-M641 HydrophobicContact CG1-SD 4.28Å; V587-M641 HydrophobicContact CG2-CE 3.83Å; V587-M641 HydrophobicContact CG2-CG 4.42Å; V587-M641 HydrophobicContact CG2-SD 3.77Å
588	T	86.9	Confident	85.8	Confident	1.5 Å²	1.5	38.8 Å²	38.8	1%	0.009	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	130.9	174.2	63.3	0	0	0	0	110.7	I546 C547 S548 Y593 N594 L595 R645	I546-T588 HydrophobicContact CG2-CG2 4.46Å; C547-T588 PolarHBondContact O-N 3.4Å; C547-T588 PolarHBondContact O-OG1 3.23Å; S548-T588 WeakPolarHBondContact CA-OG1 3.37Å; S548-T588 PolarHBondContact OG-OG1 2.87Å; T588-Y593 HydrophobicContact CG2-CD1 3.83Å; T588-Y593 HydrophobicContact CG2-CE1 4.12Å; T588-N594 CarbonylContact C-O 3.51Å; T588-N594 WeakPolarHBondContact CA-O 3.34Å; T588-L595 HydrophobicContact CG2-CD2 3.77Å; T588-R645 WeakPolarHBondContact O-CD 3.46Å
589	V	83.2	Confident	85.4	Confident	10 Å²	10	41.3 Å²	41.3	6%	0.061	22%	0.215	C	C	.	.			trans	-88.3	-39.5	-179.9	167.8	0	0	0	0	111.6	N594 T596 R645	V589-N594 PolarHBondContact N-O 3.13Å; V589-T596 WeakPolarHBondContact CG2-OG1 3.27Å; V589-R645 WeakPolarHBondContact CG1-O 3.33Å; V589-R645 WeakPolarHBondContact O-CG 3.24Å
590	D	78.1	Confident	84.8	Confident	51 Å²	51	43.4 Å²	43.4	27%	0.273	23%	0.228	S	C	.	.	S	Bend	trans	-143	-179.7	-172.2	57.2	31.7	0	0	0	112.8	Q592 Y593 N594	D590-Q592 PolarHBondContact O-N 2.88Å; D590-Q592 WeakPolarHBondContact OD1-CA 3.25Å; D590-Q592 PolarHBondContact OD1-N 3.17Å; D590-Q592 VanDerWaalsContact OD1-N 3.09Å; D590-Y593 PolarHBondContact O-N 2.92Å; D590-Y593 PolarHBondContact OD1-N 3.24Å; D590-N594 WeakPolarHBondContact OD1-CB 3.35Å; D590-N594 PolarHBondContact OD1-N 3.07Å; D590-N594 PolarHBondContact OD1-ND2 2.87Å; D590-N594 WeakPolarHBondContact OD2-CB 3.41Å; D590-N594 PolarHBondContact OD2-ND2 3.05Å
591	D	73.7	Confident	84.2	Confident	106.5 Å²	106.5	43.1 Å²	43.1	57%	0.57	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-11	-179.4	-65.8	-41.2	0	0	0	113.4	K551 Y593	K551-D591 VanDerWaalsContact CE-OD1 3.27Å; K551-D591 WeakPolarHBondContact CE-OD1 3.27Å; K551-D591 PolarHBondContact NZ-O 3.09Å; D591-Y593 VanDerWaalsContact C-N 3.28Å
592	Q	75.9	Confident	83.7	Confident	148.5 Å²	148.5	40.5 Å²	40.5	69%	0.694	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.5	8.7	174.9	-65.6	178.6	-14.4	0	0	112.2	D590 N594	D590-Q592 PolarHBondContact O-N 2.88Å; D590-Q592 WeakPolarHBondContact OD1-CA 3.25Å; D590-Q592 PolarHBondContact OD1-N 3.17Å; D590-Q592 VanDerWaalsContact OD1-N 3.09Å; Q592-N594 PolarHBondContact O-N 3.14Å
593	Y	82.3	Confident	82.8	Confident	14.5 Å²	14.5	45.1 Å²	45.1	6%	0.057	23%	0.225	C	C	.	.			trans	60.4	29.4	-179.4	-81.3	-98	0	0	0	114.1	S548 T588 D590 D591 L595 I653 D675 H677	S548-Y593 PolarHBondContact OG-OH 3.41Å; T588-Y593 HydrophobicContact CG2-CD1 3.83Å; T588-Y593 HydrophobicContact CG2-CE1 4.12Å; D590-Y593 PolarHBondContact O-N 2.92Å; D590-Y593 PolarHBondContact OD1-N 3.24Å; D591-Y593 VanDerWaalsContact C-N 3.28Å; Y593-L595 WeakPolarHBondContact O-CG 3.32Å; Y593-L595 PolarHBondContact O-N 3.09Å; Y593-I653 HydrophobicContact CD1-CD1 4.27Å; Y593-D675 WeakPolarHBondContact CE1-O 3.39Å; Y593-D675 WeakPolarHBondContact OH-CA 3.43Å; Y593-D675 VanDerWaalsContact OH-CB 3.26Å; Y593-D675 WeakPolarHBondContact OH-CB 3.34Å; Y593-D675 PolarHBondContact OH-O 2.76Å; Y593-H677 HydrophobicContact CD1-CB 3.76Å; Y593-H677 HydrophobicContact CD2-CB 4.24Å; Y593-H677 AromaticContact CD2-CD2 3.24Å; Y593-H677 WeakPolarHBondContact CD2-CD2 3.38Å; Y593-H677 AromaticContact CD2-CG 3.9Å; Y593-H677 AromaticContact CD2-NE2 3.92Å; Y593-H677 HydrophobicContact CE1-CB 3.92Å; Y593-H677 HydrophobicContact CE2-CB 4.38Å; Y593-H677 AromaticContact CE2-CD2 3.7Å; Y593-H677 VanDerWaalsContact CE2-CD2 3.48Å; Y593-H677 WeakPolarHBondContact CE2-CD2 3.37Å; Y593-H677 HydrophobicContact CG-CB 3.92Å; Y593-H677 AromaticContact CG-CD2 3.55Å; Y593-H677 AromaticContact CG-CG 3.84Å
594	N	86.5	Confident	81	Confident	27.5 Å²	27.5	44.5 Å²	44.5	15%	0.147	23%	0.226	C	C	.	.			trans	-66.5	129.2	169.6	-66.8	-49	0	0	0	109.7	T588 V589 D590 Q592 S650 T651 S652	T588-N594 CarbonylContact C-O 3.51Å; T588-N594 WeakPolarHBondContact CA-O 3.34Å; V589-N594 PolarHBondContact N-O 3.13Å; D590-N594 WeakPolarHBondContact OD1-CB 3.35Å; D590-N594 PolarHBondContact OD1-N 3.07Å; D590-N594 PolarHBondContact OD1-ND2 2.87Å; D590-N594 WeakPolarHBondContact OD2-CB 3.41Å; D590-N594 PolarHBondContact OD2-ND2 3.05Å; Q592-N594 PolarHBondContact O-N 3.14Å; N594-S650 WeakPolarHBondContact CB-OG 3.07Å; N594-T651 CarbonylContact C-O 3.59Å; N594-T651 WeakPolarHBondContact CA-O 3.24Å; N594-S652 WeakPolarHBondContact OD1-CA 3.4Å
595	L	89.4	Confident	78.7	Confident	3 Å²	3	50 Å²	50	2%	0.016	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	144.6	-170.3	-63.4	179.6	0	0	0	111.5	I546 Y586 V587 T588 Y593 T651 I653 V656	I546-L595 HydrophobicContact CG2-CD2 4.27Å; Y586-L595 HydrophobicContact CD1-CB 4.04Å; Y586-L595 HydrophobicContact CG-CB 4.44Å; Y586-L595 HydrophobicContact CG-CD1 4.45Å; V587-L595 WeakPolarHBondContact O-CA 3.48Å; T588-L595 HydrophobicContact CG2-CD2 3.77Å; Y593-L595 WeakPolarHBondContact O-CG 3.32Å; Y593-L595 PolarHBondContact O-N 3.09Å; L595-T651 PolarHBondContact N-O 3.31Å; L595-T651 PolarHBondContact O-N 3.21Å; L595-I653 HydrophobicContact CD1-CB 4.42Å; L595-I653 HydrophobicContact CD1-CD1 4.42Å; L595-I653 HydrophobicContact CD1-CG1 4Å; L595-V656 HydrophobicContact CB-CG2 4.09Å; L595-V656 HydrophobicContact CD1-CB 4.16Å; L595-V656 HydrophobicContact CD1-CG1 4.06Å; L595-V656 HydrophobicContact CD1-CG2 4.28Å
596	T	87.8	Confident	76.3	Confident	1.5 Å²	1.5	58.2 Å²	58.2	1%	0.009	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	134.5	170.7	-57.9	0	0	0	0	109.5	V587 V589 I598 V600 V601 L648 R649	V587-T596 PolarHBondContact N-O 3.35Å; V587-T596 PolarHBondContact O-N 2.97Å; V589-T596 WeakPolarHBondContact CG2-OG1 3.27Å; T596-I598 PolarHBondContact O-N 3.3Å; T596-V600 HydrophobicContact CG2-CB 3.8Å; T596-V600 HydrophobicContact CG2-CG1 3.83Å; T596-V601 HydrophobicContact CG2-CG2 4.09Å; T596-L648 HydrophobicContact CG2-CB 4.42Å; T596-R649 PolarHBondContact OG1-O 3.48Å
597	P	87.5	Confident	73.6	Confident	43.5 Å²	43.5	62.3 Å²	62.3	28%	0.282	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	139.8	173.9	-20.1	29.9	0	0	0	111.4	Y586 E599 V600 V601	Y586-P597 HydrophobicContact CD1-CG 4.29Å; Y586-P597 HydrophobicContact CE1-CB 4.4Å; Y586-P597 HydrophobicContact CE1-CG 3.84Å; P597-E599 WeakPolarHBondContact CB-OE2 3.29Å; P597-E599 PolarHBondContact O-N 3.2Å; P597-E599 VanDerWaalsContact O-N 3.12Å; P597-V600 HydrophobicContact CB-CG2 4.22Å; P597-V600 HydrophobicContact CG-CG2 4.22Å; P597-V600 WeakPolarHBondContact O-CB 3.16Å; P597-V600 PolarHBondContact O-N 3.32Å; P597-V601 PolarHBondContact O-N 3.03Å
598	I	84.3	Confident	70.9	Confident	12 Å²	12	69.5 Å²	69.5	6%	0.062	36%	0.359	C	S	.	.	H	α-helix	trans	-57.2	-33.6	-178.1	-164	167.8	0	0	0	112.2	T577 T585 V587 T596 V600 V601 L602 M641	T577-I598 HydrophobicContact CG2-CD1 4.36Å; T585-I598 HydrophobicContact CG2-CB 4.12Å; T585-I598 HydrophobicContact CG2-CD1 4.01Å; T585-I598 HydrophobicContact CG2-CG2 4.34Å; T585-I598 PolarHBondContact O-N 3.06Å; V587-I598 HydrophobicContact CG2-CB 4.29Å; V587-I598 HydrophobicContact CG2-CG1 4.24Å; T596-I598 PolarHBondContact O-N 3.3Å; I598-V600 VanDerWaalsContact C-N 3.32Å; I598-V600 PolarHBondContact O-N 3.28Å; I598-V601 WeakPolarHBondContact O-CB 3.26Å; I598-V601 PolarHBondContact O-N 2.91Å; I598-V601 VanDerWaalsContact O-N 3.12Å; I598-L602 HydrophobicContact CG1-CD1 4.21Å; I598-L602 HydrophobicContact CG1-CG 4.31Å; I598-L602 WeakPolarHBondContact O-CG 3.38Å; I598-L602 PolarHBondContact O-N 2.88Å; I598-L602 VanDerWaalsContact O-N 3.08Å; I598-M641 HydrophobicContact CD1-CE 4.13Å; I598-M641 HydrophobicContact CD1-SD 4.28Å; I598-M641 HydrophobicContact CG1-SD 4.12Å
599	E	77.4	Confident	68.4	Low	113 Å²	113	75.5 Å²	75.5	53%	0.528	39%	0.391	S	S	.	.	H	α-helix	trans	-63.3	-33.7	179.5	-60.3	130.2	-164.1	0	0	112.6	P597 V601 L602 R603	P597-E599 WeakPolarHBondContact CB-OE2 3.29Å; P597-E599 PolarHBondContact O-N 3.2Å; P597-E599 VanDerWaalsContact O-N 3.12Å; E599-V601 VanDerWaalsContact C-N 3.28Å; E599-V601 PolarHBondContact O-N 2.83Å; E599-L602 PolarHBondContact O-N 3.23Å; E599-R603 WeakPolarHBondContact O-CB 3.35Å; E599-R603 WeakPolarHBondContact O-CG 3.19Å; E599-R603 PolarHBondContact O-N 3.07Å
600	V	76.2	Confident	66.1	Low	64.5 Å²	64.5	81.9 Å²	81.9	39%	0.391	43%	0.425	S	S	.	.	H	α-helix	trans	-70	-39.8	176.1	177	0	0	0	0	109.9	T596 P597 I598 L602 R603	T596-V600 HydrophobicContact CG2-CB 3.8Å; T596-V600 HydrophobicContact CG2-CG1 3.83Å; P597-V600 HydrophobicContact CB-CG2 4.22Å; P597-V600 HydrophobicContact CG-CG2 4.22Å; P597-V600 WeakPolarHBondContact O-CB 3.16Å; P597-V600 PolarHBondContact O-N 3.32Å; I598-V600 VanDerWaalsContact C-N 3.32Å; I598-V600 PolarHBondContact O-N 3.28Å; V600-L602 VanDerWaalsContact C-N 3.32Å; V600-L602 PolarHBondContact O-N 2.68Å; V600-R603 PolarHBondContact O-N 3.1Å
601	V	74.6	Confident	64	Low	6.33333 Å²	6.33333	88 Å²	88	4%	0.038	45%	0.451	C	S	.	.	H	α-helix	trans	-63	-39.8	176.7	-174.1	0	0	0	0	111.6	V587 T596 P597 I598 E599 R603 M641 R644 L648	V587-V601 HydrophobicContact CB-CG2 4.41Å; V587-V601 HydrophobicContact CG2-CG2 4.26Å; T596-V601 HydrophobicContact CG2-CG2 4.09Å; P597-V601 PolarHBondContact O-N 3.03Å; I598-V601 WeakPolarHBondContact O-CB 3.26Å; I598-V601 PolarHBondContact O-N 2.91Å; I598-V601 VanDerWaalsContact O-N 3.12Å; E599-V601 VanDerWaalsContact C-N 3.28Å; E599-V601 PolarHBondContact O-N 2.83Å; V601-R603 VanDerWaalsContact C-N 3.34Å; V601-M641 HydrophobicContact CB-CG 4.33Å; V601-M641 HydrophobicContact CB-SD 4.28Å; V601-M641 HydrophobicContact CG1-CB 4.14Å; V601-M641 HydrophobicContact CG1-CG 3.96Å; V601-M641 VanDerWaalsContact CG1-CG 3.42Å; V601-M641 HydrophobicContact CG1-SD 3.97Å; V601-R644 HydrophobicContact CG1-CB 4.33Å; V601-R644 VanDerWaalsContact O-CD 3.28Å; V601-R644 WeakPolarHBondContact O-CD 3.31Å; V601-R644 PolarHBondContact O-NH1 3.03Å; V601-L648 HydrophobicContact CB-CD1 4.06Å; V601-L648 HydrophobicContact CG1-CD1 3.97Å; V601-L648 HydrophobicContact CG2-CD1 3.74Å
602	L	73	Confident	62.3	Low	64.6667 Å²	64.6667	89.8 Å²	89.8	34%	0.339	46%	0.461	S	S	.	.	H	α-helix	trans	-81.9	-20.8	-178.1	-60.2	-179.5	0	0	0	113.5	I598 E599 V600 G604 M632 R637 Q640	I598-L602 HydrophobicContact CG1-CD1 4.21Å; I598-L602 HydrophobicContact CG1-CG 4.31Å; I598-L602 WeakPolarHBondContact O-CG 3.38Å; I598-L602 PolarHBondContact O-N 2.88Å; I598-L602 VanDerWaalsContact O-N 3.08Å; E599-L602 PolarHBondContact O-N 3.23Å; V600-L602 VanDerWaalsContact C-N 3.32Å; V600-L602 PolarHBondContact O-N 2.68Å; L602-G604 VanDerWaalsContact C-N 3.34Å; L602-G604 PolarHBondContact O-N 3.23Å; L602-M632 HydrophobicContact CB-CE 4.18Å; L602-M632 HydrophobicContact CD1-CE 4.22Å; L602-M632 HydrophobicContact CD2-CE 3.64Å; L602-M632 HydrophobicContact CG-CE 4.34Å; L602-R637 HydrophobicContact CD1-CG 4.08Å; L602-R637 HydrophobicContact CD2-CB 4.34Å; L602-R637 HydrophobicContact CD2-CG 4.26Å; L602-Q640 HydrophobicContact CD2-CB 4.34Å
603	R	66.7	Low	60.2	Low	175 Å²	175	91.9 Å²	91.9	66%	0.66	47%	0.468	S	S	*	.	S	Bend	trans	-73.6	69.6	175.9	-99.4	-178.2	-137.1	-144.4	5.8	111	E599 V600 V601 R644	E599-R603 WeakPolarHBondContact O-CB 3.35Å; E599-R603 WeakPolarHBondContact O-CG 3.19Å; E599-R603 PolarHBondContact O-N 3.07Å; V600-R603 PolarHBondContact O-N 3.1Å; V601-R603 VanDerWaalsContact C-N 3.34Å; R603-R644 PolarHBondContact O-NH1 3.38Å; R603-R644 PolarHBondContact O-NH2 3.45Å
604	G	52.6	Low	58	Low	30.3333 Å²	30.3333	98.7 Å²	98.7	31%	0.313	51%	0.505	S	S	.	.			trans	-37.5	129.3	175.3	0	0	0	0	0	113.6	L602 Q606	L602-G604 VanDerWaalsContact C-N 3.34Å; L602-G604 PolarHBondContact O-N 3.23Å; G604-Q606 PolarHBondContact O-N 3.15Å; G604-Q606 VanDerWaalsContact O-N 3.13Å
605	N	43.8	Very low	55.5	Low	134 Å²	134	102.7 Å²	102.7	72%	0.717	54%	0.535	S	S	*	.			trans	-37.4	97.1	171.9	-71.6	-0.3	0	0	0	111.2	T607 L608 R644	N605-T607 PolarHBondContact O-N 3.34Å; N605-L608 WeakPolarHBondContact ND2-CD1 3.2Å; N605-R644 PolarHBondContact OD1-NH2 2.9Å
606	Q	40	Very low	52.9	Low	178.333 Å²	178.333	110 Å²	110	83%	0.833	57%	0.574	S	S	*	*			trans	-87.5	71.5	160.6	-72.5	-179.8	-13.3	0	0	108.4	G604 L608	G604-Q606 PolarHBondContact O-N 3.15Å; G604-Q606 VanDerWaalsContact O-N 3.13Å; Q606-L608 PolarHBondContact O-N 3.43Å
607	T	35.3	Very low	50.1	Low	120.667 Å²	120.667	119.1 Å²	119.1	74%	0.74	61%	0.614	S	S	*	*	S	Bend	trans	-78.5	80.3	177.4	53.6	0	0	0	0	113.5	N605 N609	N605-T607 PolarHBondContact O-N 3.34Å; T607-N609 PolarHBondContact O-N 3.09Å
608	L	32.8	Very low	47.4	Very low	153 Å²	153	122 Å²	122	80%	0.801	64%	0.635	S	S	*	*			trans	-122.6	92.5	155.3	-111	125.4	0	0	0	109.8	N605 Q606	N605-L608 WeakPolarHBondContact ND2-CD1 3.2Å; Q606-L608 PolarHBondContact O-N 3.43Å
609	N	34.7	Very low	44.9	Very low	128.667 Å²	128.667	124.4 Å²	124.4	69%	0.688	66%	0.662	S	S	*	*			trans	-72.2	103.3	161.8	-68.4	0.4	0	0	0	109.7	T607 D612	T607-N609 PolarHBondContact O-N 3.09Å; N609-D612 PolarHBondContact ND2-OD2 3.39Å
610	N	35.1	Very low	42.6	Very low	142.667 Å²	142.667	130 Å²	130	76%	0.763	68%	0.678	S	S	*	*	S	Bend	trans	-169.2	76.2	145.4	-82.5	-1.7	0	0	0	113.3	D612	N610-D612 PolarHBondContact O-N 3.35Å
611	H	35.2	Very low	40.6	Very low	179 Å²	179	134.2 Å²	134.2	83%	0.829	69%	0.691	S	S	*	*			trans	-71.8	87	157.5	-72.1	-70.4	0	0	0	110.8
612	D	36.2	Very low	38.7	Very low	145 Å²	145	140.8 Å²	140.8	78%	0.775	72%	0.722	S	S	*	*			trans	-155	110.9	143	-89.1	-33	0	0	0	107.7	N609 N610 D614	N609-D612 PolarHBondContact ND2-OD2 3.39Å; N610-D612 PolarHBondContact O-N 3.35Å; D612-D614 PolarHBondContact O-N 2.89Å
613	K	33.1	Very low	36.7	Very low	192.333 Å²	192.333	143.9 Å²	143.9	84%	0.836	74%	0.739	S	S	*	*			trans	-78.2	102	174.8	-74.1	178.7	176.1	178.9	0	109.2
614	D	34.8	Very low	35.2	Very low	157.333 Å²	157.333	142.3 Å²	142.3	84%	0.841	74%	0.739	S	S	*	*			trans	-174.6	82.5	163.7	-66.6	-27.5	0	0	0	111.9	D612 D616	D612-D614 PolarHBondContact O-N 2.89Å; D614-D616 PolarHBondContact O-N 2.9Å
615	S	34.2	Very low	34.4	Very low	112 Å²	112	148.7 Å²	148.7	78%	0.783	75%	0.754	S	S	*	*			trans	-131.2	98.2	155.2	64.4	0	0	0	0	109.9	F617	S615-F617 VanDerWaalsContact C-N 3.27Å; S615-F617 PolarHBondContact O-N 3.05Å
616	D	35	Very low	33.9	Very low	155.667 Å²	155.667	151.4 Å²	151.4	83%	0.832	76%	0.755	S	S	*	*			trans	-83.5	80.2	162	-80	-34.9	0	0	0	114.5	D614 C618	D614-D616 PolarHBondContact O-N 2.9Å; D616-C618 PolarHBondContact O-N 2.78Å
617	F	29.7	Very low	33.9	Very low	192.667 Å²	192.667	147.5 Å²	147.5	85%	0.845	75%	0.747	S	S	*	*			trans	-141.7	60.2	154	-140.2	-97.3	0	0	0	115.2	S615	S615-F617 VanDerWaalsContact C-N 3.27Å; S615-F617 PolarHBondContact O-N 3.05Å
618	C	31.7	Very low	34.1	Very low	105.333 Å²	105.333	148.5 Å²	148.5	71%	0.712	74%	0.741	S	S	*	*			trans	-139.2	56.7	169.7	-139.3	0	0	0	0	113.4	D616 W620	D616-C618 PolarHBondContact O-N 2.78Å; C618-W620 VanDerWaalsContact C-N 3.27Å; C618-W620 PolarHBondContact O-N 3.19Å; C618-W620 VanDerWaalsContact O-N 3.17Å
619	G	31.1	Very low	34.7	Very low	61.3333 Å²	61.3333	148 Å²	148	63%	0.632	73%	0.729	S	S	*	*	S	Bend	trans	-58.7	10.1	155.7	0	0	0	0	0	113.8
620	W	28.7	Very low	35.3	Very low	230.667 Å²	230.667	151.3 Å²	151.3	87%	0.874	74%	0.737	S	S	*	*	S	Bend	trans	-69.6	18.7	177	-69.3	70.4	0	0	0	116.3	C618	C618-W620 VanDerWaalsContact C-N 3.27Å; C618-W620 PolarHBondContact O-N 3.19Å; C618-W620 VanDerWaalsContact O-N 3.17Å
621	K	33.4	Very low	36	Very low	153.667 Å²	153.667	149 Å²	149	67%	0.668	73%	0.732	S	S	*	*	H	α-helix	trans	-108.4	13.4	169.9	-76.9	-172.3	178.5	175.9	0	114	Y625	K621-Y625 VanDerWaalsContact O-CD2 3.27Å; K621-Y625 WeakPolarHBondContact O-CD2 3.43Å
622	Q	35.8	Very low	37.6	Very low	145 Å²	145	142.5 Å²	142.5	68%	0.678	70%	0.702	S	S	*	*	H	α-helix	trans	-80.4	-24.3	-177.5	-77.3	-173.2	0.9	0	0	114.3	Y625 R626	Q622-Y625 PolarHBondContact O-N 3.32Å; Q622-R626 PolarHBondContact O-N 2.88Å
623	N	31.7	Very low	39.5	Very low	130 Å²	130	136.3 Å²	136.3	70%	0.695	67%	0.673	S	S	*	*	H	α-helix	trans	-82.3	-32.8	-173.2	-77.4	-15.2	0	0	0	114.6	Y625 R626 S627	N623-Y625 VanDerWaalsContact C-N 3.3Å; N623-Y625 PolarHBondContact O-N 3.36Å; N623-R626 PolarHBondContact O-N 3.09Å; N623-S627 PolarHBondContact O-N 2.78Å; N623-S627 PolarHBondContact O-OG 2.85Å
624	E	34.9	Very low	41.8	Very low	141.667 Å²	141.667	127.7 Å²	127.7	66%	0.662	64%	0.636	S	S	*	*	H	α-helix	trans	-75.3	-27.9	177.2	-80.4	-168.5	134.5	0	0	113.8	R626 K628	E624-R626 VanDerWaalsContact C-N 3.34Å; E624-K628 PolarHBondContact O-N 3.04Å; E624-K628 VanDerWaalsContact O-N 3.14Å; E624-K628 IonicContact OE1-NZ 3.61Å
625	Y	35.7	Very low	44.2	Very low	162.667 Å²	162.667	121 Å²	121	64%	0.638	60%	0.6	S	S	*	*	H	α-helix	trans	-79.5	-20.6	-179.6	-87.9	-91.9	0	0	0	113.5	K621 Q622 N623 S627 K628 R629	K621-Y625 VanDerWaalsContact O-CD2 3.27Å; K621-Y625 WeakPolarHBondContact O-CD2 3.43Å; Q622-Y625 PolarHBondContact O-N 3.32Å; N623-Y625 VanDerWaalsContact C-N 3.3Å; N623-Y625 PolarHBondContact O-N 3.36Å; Y625-S627 VanDerWaalsContact C-N 3.28Å; Y625-S627 PolarHBondContact O-N 2.82Å; Y625-K628 PolarHBondContact O-N 2.92Å; Y625-R629 PolarHBondContact O-N 3.16Å
626	R	33.4	Very low	46.4	Very low	192 Å²	192	118.8 Å²	118.8	73%	0.725	58%	0.577	S	S	*	*	H	α-helix	trans	-69.2	-35	176.6	-116.8	177.8	176.8	176.6	-0.4	112	Q622 N623 E624 R629	Q622-R626 PolarHBondContact O-N 2.88Å; N623-R626 PolarHBondContact O-N 3.09Å; E624-R626 VanDerWaalsContact C-N 3.34Å; R626-R629 PolarHBondContact O-N 3.29Å
627	S	39	Very low	48.6	Very low	95.6667 Å²	95.6667	114.8 Å²	114.8	67%	0.669	55%	0.55	S	S	*	*	H	α-helix	trans	-72.6	-36.9	179.8	-62.2	0	0	0	0	113.4	N623 Y625 R629 K630 S631	N623-S627 PolarHBondContact O-N 2.78Å; N623-S627 PolarHBondContact O-OG 2.85Å; Y625-S627 VanDerWaalsContact C-N 3.28Å; Y625-S627 PolarHBondContact O-N 2.82Å; S627-R629 VanDerWaalsContact C-N 3.28Å; S627-R629 PolarHBondContact O-N 2.79Å; S627-K630 PolarHBondContact O-N 3.1Å; S627-S631 PolarHBondContact O-N 3.38Å
628	K	40.5	Very low	51.1	Low	143 Å²	143	105.7 Å²	105.7	62%	0.622	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-19.9	177.9	-83.1	178.2	177.4	168	0	114.5	E624 Y625 K630 S631	E624-K628 PolarHBondContact O-N 3.04Å; E624-K628 VanDerWaalsContact O-N 3.14Å; E624-K628 IonicContact OE1-NZ 3.61Å; Y625-K628 PolarHBondContact O-N 2.92Å; K628-K630 VanDerWaalsContact C-N 3.29Å; K628-K630 PolarHBondContact O-N 3.5Å; K628-S631 PolarHBondContact O-N 2.89Å; K628-S631 PolarHBondContact O-OG 3.28Å
629	R	44.2	Very low	53.5	Low	142.667 Å²	142.667	103.2 Å²	103.2	54%	0.538	49%	0.488	S	S	.	.	H	α-helix	trans	-71.2	-28.1	-180	-78.9	-173.4	-176.4	-178.2	3.7	114	Y625 R626 S627 S631 R637	Y625-R629 PolarHBondContact O-N 3.16Å; R626-R629 PolarHBondContact O-N 3.29Å; S627-R629 VanDerWaalsContact C-N 3.28Å; S627-R629 PolarHBondContact O-N 2.79Å; R629-S631 VanDerWaalsContact C-N 3.28Å; R629-S631 PolarHBondContact O-N 2.84Å; R629-R637 PolarHBondContact O-NH2 3.39Å; R629-R637 VanDerWaalsContact O-NH2 3.12Å
630	K	47.1	Very low	55.8	Low	197 Å²	197	102.5 Å²	102.5	86%	0.857	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-76.8	-20.2	-179.4	-85.6	-174.9	175.6	-179	0	113.8	S627 K628	S627-K630 PolarHBondContact O-N 3.1Å; K628-K630 VanDerWaalsContact C-N 3.29Å; K628-K630 PolarHBondContact O-N 3.5Å
631	S	51.3	Low	58.3	Low	94.6667 Å²	94.6667	91.7 Å²	91.7	66%	0.662	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	3.6	-174.8	85.8	0	0	0	0	115.3	S627 K628 R629 G633	S627-S631 PolarHBondContact O-N 3.38Å; K628-S631 PolarHBondContact O-N 2.89Å; K628-S631 PolarHBondContact O-OG 3.28Å; R629-S631 VanDerWaalsContact C-N 3.28Å; R629-S631 PolarHBondContact O-N 2.84Å; S631-G633 PolarHBondContact O-N 3.08Å
632	M	67.6	Low	60.6	Low	41.3333 Å²	41.3333	86.3 Å²	86.3	20%	0.204	40%	0.403	C	S	.	.			trans	-81.6	113.5	-175.8	-164.3	159.4	71.9	0	0	111.2	L602 E636 R637 Q640	L602-M632 HydrophobicContact CB-CE 4.18Å; L602-M632 HydrophobicContact CD1-CE 4.22Å; L602-M632 HydrophobicContact CD2-CE 3.64Å; L602-M632 HydrophobicContact CG-CE 4.34Å; M632-E636 HydrophobicContact CG-CB 3.89Å; M632-E636 HydrophobicContact CG-CG 3.9Å; M632-E636 HydrophobicContact SD-CB 4.24Å; M632-E636 HydrophobicContact SD-CG 4.06Å; M632-R637 HydrophobicContact CB-CG 4.46Å; M632-R637 HydrophobicContact CE-CB 4.48Å; M632-R637 HydrophobicContact CE-CG 3.76Å; M632-R637 HydrophobicContact CG-CG 4.23Å; M632-R637 PolarHBondContact O-NE 3.24Å; M632-R637 PolarHBondContact O-NH2 2.87Å; M632-Q640 VanDerWaalsContact SD-CD 3.56Å; M632-Q640 PolarHBondContact SD-NE2 3.14Å
633	G	76	Confident	62.7	Low	15 Å²	15	85.4 Å²	85.4	16%	0.155	40%	0.397	C	S	.	.			trans	-65.5	161	-178.7	0	0	0	0	0	114	E529 S631 L635 E636 R637	E529-G633 WeakPolarHBondContact OE1-CA 3.37Å; S631-G633 PolarHBondContact O-N 3.08Å; G633-L635 VanDerWaalsContact C-N 3.35Å; G633-L635 PolarHBondContact O-N 3.15Å; G633-L635 VanDerWaalsContact O-N 3.15Å; G633-E636 PolarHBondContact O-N 3.06Å; G633-E636 VanDerWaalsContact O-N 3.14Å; G633-R637 WeakPolarHBondContact O-CG 3.44Å; G633-R637 PolarHBondContact O-N 3.13Å; G633-R637 VanDerWaalsContact O-N 3.14Å
634	I	82.7	Confident	64.9	Low	13 Å²	13	82.7 Å²	82.7	7%	0.067	38%	0.377	C	S	.	.	H	α-helix	trans	-60.5	-39.6	-170.5	-91.9	171	0	0	0	112.5	L528 E529 M532 L571 A574 M575 E636 R637 T638	L528-I634 HydrophobicContact CD2-CB 4.13Å; L528-I634 HydrophobicContact CD2-CD1 4.1Å; L528-I634 HydrophobicContact CD2-CG2 3.8Å; L528-I634 HydrophobicContact CG-CG2 4.14Å; E529-I634 HydrophobicContact CG-CD1 3.95Å; E529-I634 HydrophobicContact CG-CG1 4.12Å; E529-I634 HydrophobicContact CG-CG2 4.45Å; E529-I634 PolarHBondContact OE1-N 3.06Å; E529-I634 VanDerWaalsContact OE1-N 3.09Å; M532-I634 HydrophobicContact CE-CD1 3.83Å; M532-I634 VanDerWaalsContact CE-CD1 3.41Å; M532-I634 HydrophobicContact SD-CD1 3.17Å; M532-I634 WeakPolarHBondContact SD-CD1 3.48Å; L571-I634 HydrophobicContact CD1-CG2 4.37Å; A574-I634 HydrophobicContact CB-CD1 4.35Å; A574-I634 HydrophobicContact CB-CG1 4.24Å; A574-I634 HydrophobicContact CB-CG2 4.22Å; M575-I634 HydrophobicContact CG-CG2 4.03Å; I634-E636 VanDerWaalsContact C-N 3.28Å; I634-E636 PolarHBondContact O-N 3.22Å; I634-R637 WeakPolarHBondContact O-CB 3.11Å; I634-R637 PolarHBondContact O-N 3.35Å; I634-T638 WeakPolarHBondContact O-CB 3.43Å; I634-T638 PolarHBondContact O-N 3.03Å; I634-T638 PolarHBondContact O-OG1 3.23Å; I634-T638 VanDerWaalsContact O-OG1 3.07Å
635	L	83.6	Confident	66.7	Low	16.6667 Å²	16.6667	77.4 Å²	77.4	9%	0.087	35%	0.351	C	S	.	.	H	α-helix	trans	-64.6	-39.2	178.5	-64.2	179.7	0	0	0	112.3	F454 F457 L528 L571 G633 T638 K639	F454-L635 HydrophobicContact CB-CD2 4.02Å; F454-L635 HydrophobicContact CD2-CD2 3.55Å; F454-L635 VanDerWaalsContact CD2-CD2 3.49Å; F454-L635 HydrophobicContact CD2-CG 4.45Å; F454-L635 HydrophobicContact CE2-CD2 4.18Å; F454-L635 HydrophobicContact CG-CD2 4.16Å; F457-L635 HydrophobicContact CB-CD1 3.69Å; F457-L635 HydrophobicContact CD1-CB 4.16Å; F457-L635 HydrophobicContact CD1-CD1 4.35Å; F457-L635 HydrophobicContact CD2-CB 4.08Å; F457-L635 HydrophobicContact CD2-CD1 3.74Å; F457-L635 HydrophobicContact CE1-CB 4.05Å; F457-L635 HydrophobicContact CE1-CD1 4.31Å; F457-L635 HydrophobicContact CE2-CB 3.94Å; F457-L635 HydrophobicContact CE2-CD1 4.05Å; F457-L635 HydrophobicContact CG-CB 4.17Å; F457-L635 HydrophobicContact CG-CD1 3.89Å; F457-L635 HydrophobicContact CZ-CB 3.91Å; F457-L635 HydrophobicContact CZ-CD1 4.03Å; L528-L635 HydrophobicContact CD1-CD2 3.95Å; L528-L635 HydrophobicContact CD1-CG 4.33Å; L528-L635 HydrophobicContact CD2-CD1 4.07Å; L528-L635 HydrophobicContact CD2-CD2 3.22Å; L528-L635 HydrophobicContact CD2-CG 3.52Å; L571-L635 HydrophobicContact CD1-CD2 3.82Å; G633-L635 VanDerWaalsContact C-N 3.35Å; G633-L635 PolarHBondContact O-N 3.15Å; G633-L635 VanDerWaalsContact O-N 3.15Å; L635-T638 PolarHBondContact O-N 2.89Å; L635-K639 WeakPolarHBondContact O-CB 3.43Å; L635-K639 PolarHBondContact O-N 2.86Å; L635-K639 VanDerWaalsContact O-N 3.14Å
636	E	81.2	Confident	68.5	Low	64.3333 Å²	64.3333	77.6 Å²	77.6	30%	0.301	36%	0.355	S	S	.	.	H	α-helix	trans	-71.6	-38.3	177.6	-167.7	61.4	-147.6	0	0	111	F457 K521 M632 G633 I634 T638 K639 Q640	F457-E636 HydrophobicContact CZ-CB 4.17Å; F457-E636 VanDerWaalsContact CZ-OE2 3.3Å; F457-E636 WeakPolarHBondContact CZ-OE2 3.38Å; K521-E636 VanDerWaalsContact CE-OE2 3.28Å; K521-E636 WeakPolarHBondContact CE-OE2 3.42Å; K521-E636 IonicContact NZ-OE2 2.7Å; K521-E636 PolarHBondContact NZ-OE2 2.84Å; M632-E636 HydrophobicContact CG-CB 3.89Å; M632-E636 HydrophobicContact CG-CG 3.9Å; M632-E636 HydrophobicContact SD-CB 4.24Å; M632-E636 HydrophobicContact SD-CG 4.06Å; G633-E636 PolarHBondContact O-N 3.06Å; G633-E636 VanDerWaalsContact O-N 3.14Å; I634-E636 VanDerWaalsContact C-N 3.28Å; I634-E636 PolarHBondContact O-N 3.22Å; E636-T638 PolarHBondContact O-N 3Å; E636-K639 VanDerWaalsContact CD-NZ 3.34Å; E636-K639 PolarHBondContact O-N 3.11Å; E636-K639 IonicContact OE1-NZ 3.06Å; E636-K639 PolarHBondContact OE1-NZ 2.98Å; E636-K639 WeakPolarHBondContact OE2-CD 3.38Å; E636-K639 IonicContact OE2-NZ 2.84Å; E636-K639 PolarHBondContact OE2-NZ 3.13Å; E636-Q640 WeakPolarHBondContact O-CG 3.4Å; E636-Q640 PolarHBondContact O-N 2.88Å
637	R	81.4	Confident	70.4	Confident	71.6667 Å²	71.6667	73 Å²	73	27%	0.27	35%	0.353	S	S	.	.	H	α-helix	trans	-57.5	-49.6	171.3	-72.2	-179.6	-148	176.7	-0.8	111.5	A574 L602 R629 M632 G633 I634 K639 Q640 M641	A574-R637 HydrophobicContact CB-CB 4.49Å; L602-R637 HydrophobicContact CD1-CG 4.08Å; L602-R637 HydrophobicContact CD2-CB 4.34Å; L602-R637 HydrophobicContact CD2-CG 4.26Å; R629-R637 PolarHBondContact O-NH2 3.39Å; R629-R637 VanDerWaalsContact O-NH2 3.12Å; M632-R637 HydrophobicContact CB-CG 4.46Å; M632-R637 HydrophobicContact CE-CB 4.48Å; M632-R637 HydrophobicContact CE-CG 3.76Å; M632-R637 HydrophobicContact CG-CG 4.23Å; M632-R637 PolarHBondContact O-NE 3.24Å; M632-R637 PolarHBondContact O-NH2 2.87Å; G633-R637 WeakPolarHBondContact O-CG 3.44Å; G633-R637 PolarHBondContact O-N 3.13Å; G633-R637 VanDerWaalsContact O-N 3.14Å; I634-R637 WeakPolarHBondContact O-CB 3.11Å; I634-R637 PolarHBondContact O-N 3.35Å; R637-K639 VanDerWaalsContact C-N 3.31Å; R637-K639 PolarHBondContact O-N 3.2Å; R637-Q640 PolarHBondContact O-N 3.2Å; R637-Q640 VanDerWaalsContact O-N 3.16Å; R637-M641 WeakPolarHBondContact O-CB 3.44Å; R637-M641 VanDerWaalsContact O-CG 3.26Å; R637-M641 WeakPolarHBondContact O-CG 3.35Å; R637-M641 PolarHBondContact O-N 3.05Å
638	T	83.1	Confident	72.1	Confident	3.33333 Å²	3.33333	70 Å²	70	2%	0.02	33%	0.329	C	S	.	.	H	α-helix	trans	-59.3	-42.3	178.3	-56.9	0	0	0	0	111.8	I567 F570 L571 I634 L635 E636 M641 Y642	I567-T638 HydrophobicContact CB-CG2 4.41Å; I567-T638 HydrophobicContact CG2-CG2 3.7Å; F570-T638 HydrophobicContact CB-CG2 3.88Å; L571-T638 HydrophobicContact CB-CG2 4.01Å; L571-T638 HydrophobicContact CD1-CG2 4.38Å; L571-T638 WeakPolarHBondContact CD1-OG1 3.18Å; I634-T638 WeakPolarHBondContact O-CB 3.43Å; I634-T638 PolarHBondContact O-N 3.03Å; I634-T638 PolarHBondContact O-OG1 3.23Å; I634-T638 VanDerWaalsContact O-OG1 3.07Å; L635-T638 PolarHBondContact O-N 2.89Å; E636-T638 PolarHBondContact O-N 3Å; T638-M641 WeakPolarHBondContact O-CB 3.27Å; T638-M641 PolarHBondContact O-N 3.18Å; T638-Y642 PolarHBondContact O-N 3.32Å
639	K	81.3	Confident	73.6	Confident	52.3333 Å²	52.3333	74.4 Å²	74.4	23%	0.228	34%	0.341	C	S	.	.	H	α-helix	trans	-65.6	-40.1	177.5	-174.1	175.6	175.5	-165.1	0	112.3	W103 D458 D461 I567 L635 E636 R637 Y642 K643	W103-K639 HydrophobicContact CD2-CD 4.45Å; W103-K639 HydrophobicContact CD2-CG 4.1Å; W103-K639 HydrophobicContact CE3-CG 4.45Å; W103-K639 HydrophobicContact CH2-CB 4.05Å; W103-K639 HydrophobicContact CH2-CG 4.21Å; W103-K639 HydrophobicContact CZ2-CB 4.04Å; W103-K639 HydrophobicContact CZ2-CD 3.86Å; W103-K639 HydrophobicContact CZ2-CG 3.85Å; W103-K639 HydrophobicContact CZ3-CG 4.49Å; D458-K639 IonicContact OD1-NZ 2.56Å; D458-K639 PolarHBondContact OD1-NZ 3.09Å; D461-K639 WeakPolarHBondContact OD2-CE 3.47Å; D461-K639 IonicContact OD2-NZ 3.95Å; D461-K639 PolarHBondContact OD2-NZ 3.32Å; I567-K639 HydrophobicContact CD1-CG 4.42Å; L635-K639 WeakPolarHBondContact O-CB 3.43Å; L635-K639 PolarHBondContact O-N 2.86Å; L635-K639 VanDerWaalsContact O-N 3.14Å; E636-K639 VanDerWaalsContact CD-NZ 3.34Å; E636-K639 PolarHBondContact O-N 3.11Å; E636-K639 IonicContact OE1-NZ 3.06Å; E636-K639 PolarHBondContact OE1-NZ 2.98Å; E636-K639 WeakPolarHBondContact OE2-CD 3.38Å; E636-K639 IonicContact OE2-NZ 2.84Å; E636-K639 PolarHBondContact OE2-NZ 3.13Å; R637-K639 VanDerWaalsContact C-N 3.31Å; R637-K639 PolarHBondContact O-N 3.2Å; K639-Y642 PolarHBondContact O-N 3.27Å; K639-K643 HydrophobicContact CG-CD 4.35Å; K639-K643 WeakPolarHBondContact O-CB 3.31Å; K639-K643 WeakPolarHBondContact O-CG 3.28Å; K639-K643 PolarHBondContact O-N 3.23Å; K639-K643 VanDerWaalsContact O-N 3.08Å
640	Q	79.8	Confident	75.2	Confident	46.6667 Å²	46.6667	70.1 Å²	70.1	22%	0.218	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-41.8	175.3	-73.1	-173.8	12.5	0	0	112.2	L602 M632 E636 R637 Y642 K643 R644	L602-Q640 HydrophobicContact CD2-CB 4.34Å; M632-Q640 VanDerWaalsContact SD-CD 3.56Å; M632-Q640 PolarHBondContact SD-NE2 3.14Å; E636-Q640 WeakPolarHBondContact O-CG 3.4Å; E636-Q640 PolarHBondContact O-N 2.88Å; R637-Q640 PolarHBondContact O-N 3.2Å; R637-Q640 VanDerWaalsContact O-N 3.16Å; Q640-Y642 VanDerWaalsContact C-N 3.33Å; Q640-Y642 PolarHBondContact O-N 2.89Å; Q640-K643 PolarHBondContact O-N 3Å; Q640-R644 WeakPolarHBondContact O-CB 3.43Å; Q640-R644 WeakPolarHBondContact O-CG 2.99Å; Q640-R644 PolarHBondContact O-N 2.88Å
641	M	80.9	Confident	76.8	Confident	2.66667 Å²	2.66667	62.8 Å²	62.8	1%	0.013	31%	0.305	C	S	.	.	H	α-helix	trans	-55.9	-48.4	173.5	-97.5	165.3	82.1	0	0	111	C547 F570 A574 V587 I598 V601 R637 T638 K643 R644 R645	C547-M641 HydrophobicContact CB-CE 4.1Å; F570-M641 HydrophobicContact CB-CB 4.22Å; F570-M641 HydrophobicContact CB-CE 3.9Å; F570-M641 HydrophobicContact CB-SD 4.37Å; F570-M641 HydrophobicContact CD1-CB 4.27Å; F570-M641 HydrophobicContact CD1-CE 3.7Å; F570-M641 HydrophobicContact CD1-CG 3.76Å; F570-M641 HydrophobicContact CD1-SD 4.3Å; F570-M641 HydrophobicContact CE1-CE 4.3Å; F570-M641 HydrophobicContact CE1-CG 3.99Å; F570-M641 HydrophobicContact CG-CB 4.25Å; F570-M641 HydrophobicContact CG-CE 3.84Å; A574-M641 HydrophobicContact CB-SD 4.03Å; V587-M641 HydrophobicContact CG1-CE 4.47Å; V587-M641 HydrophobicContact CG1-CG 4.39Å; V587-M641 HydrophobicContact CG1-SD 4.28Å; V587-M641 HydrophobicContact CG2-CE 3.83Å; V587-M641 HydrophobicContact CG2-CG 4.42Å; V587-M641 HydrophobicContact CG2-SD 3.77Å; I598-M641 HydrophobicContact CD1-CE 4.13Å; I598-M641 HydrophobicContact CD1-SD 4.28Å; I598-M641 HydrophobicContact CG1-SD 4.12Å; V601-M641 HydrophobicContact CB-CG 4.33Å; V601-M641 HydrophobicContact CB-SD 4.28Å; V601-M641 HydrophobicContact CG1-CB 4.14Å; V601-M641 HydrophobicContact CG1-CG 3.96Å; V601-M641 VanDerWaalsContact CG1-CG 3.42Å; V601-M641 HydrophobicContact CG1-SD 3.97Å; R637-M641 WeakPolarHBondContact O-CB 3.44Å; R637-M641 VanDerWaalsContact O-CG 3.26Å; R637-M641 WeakPolarHBondContact O-CG 3.35Å; R637-M641 PolarHBondContact O-N 3.05Å; T638-M641 WeakPolarHBondContact O-CB 3.27Å; T638-M641 PolarHBondContact O-N 3.18Å; M641-K643 PolarHBondContact O-N 3.39Å; M641-R644 PolarHBondContact O-N 2.72Å; M641-R645 VanDerWaalsContact O-CB 3.31Å; M641-R645 WeakPolarHBondContact O-CB 3.38Å; M641-R645 PolarHBondContact O-N 3.22Å
642	Y	80.3	Confident	78.4	Confident	42 Å²	42	60.2 Å²	60.2	17%	0.165	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-44.7	178.5	-174.5	-91	0	0	0	112.8	W103 A107 T549 Q566 I567 F570 T638 K639 Q640 R645	W103-Y642 AromaticContact CE3-CD1 3.73Å; W103-Y642 HydrophobicContact CE3-CD1 3.73Å; W103-Y642 HydrophobicContact CE3-CE1 4.36Å; W103-Y642 HydrophobicContact CE3-CG 4.3Å; W103-Y642 HydrophobicContact CZ3-CD1 4.08Å; W103-Y642 HydrophobicContact CZ3-CG 4.19Å; A107-Y642 WeakPolarHBondContact CA-OH 3.47Å; A107-Y642 HydrophobicContact CB-CE1 4.36Å; A107-Y642 WeakPolarHBondContact CB-OH 3.45Å; T549-Y642 HydrophobicContact CG2-CD2 4.23Å; T549-Y642 HydrophobicContact CG2-CE2 3.82Å; Q566-Y642 HydrophobicContact CB-CE2 4.16Å; Q566-Y642 WeakPolarHBondContact CB-OH 3.4Å; Q566-Y642 WeakPolarHBondContact O-CE2 3.28Å; Q566-Y642 PolarHBondContact OE1-OH 3.22Å; I567-Y642 HydrophobicContact CB-CD2 4.49Å; I567-Y642 HydrophobicContact CD1-CD1 4.07Å; I567-Y642 HydrophobicContact CD1-CG 4.2Å; I567-Y642 HydrophobicContact CG1-CD1 3.81Å; I567-Y642 HydrophobicContact CG1-CD2 3.72Å; I567-Y642 HydrophobicContact CG1-CE1 4.21Å; I567-Y642 HydrophobicContact CG1-CE2 4.12Å; I567-Y642 HydrophobicContact CG1-CG 3.57Å; I567-Y642 HydrophobicContact CG2-CD2 3.4Å; I567-Y642 VanDerWaalsContact CG2-CD2 3.4Å; I567-Y642 HydrophobicContact CG2-CE2 3.86Å; I567-Y642 HydrophobicContact CG2-CG 3.82Å; F570-Y642 AromaticContact CD2-CD2 3.98Å; F570-Y642 HydrophobicContact CD2-CD2 3.98Å; F570-Y642 AromaticContact CE2-CD2 3.8Å; F570-Y642 HydrophobicContact CE2-CD2 3.8Å; T638-Y642 PolarHBondContact O-N 3.32Å; K639-Y642 PolarHBondContact O-N 3.27Å; Q640-Y642 VanDerWaalsContact C-N 3.33Å; Q640-Y642 PolarHBondContact O-N 2.89Å; Y642-R645 VanDerWaalsContact CE2-CZ 3.45Å; Y642-R645 VanDerWaalsContact CG-NH1 3.28Å; Y642-R645 WeakPolarHBondContact O-CG 3.31Å; Y642-R645 PolarHBondContact O-NH1 3.18Å; Y642-R645 PolarHBondContact OH-NH2 2.97Å
643	K	80.3	Confident	79.3	Confident	126 Å²	126	58.6 Å²	58.6	55%	0.548	28%	0.279	S	S	.	.	H	α-helix	trans	-71.2	-42.7	-176.7	-74.8	-175.2	-178.7	-161.2	0	113.5	W103 K639 Q640 M641	W103-K643 HydrophobicContact CB-CD 4.1Å; W103-K643 HydrophobicContact CB-CG 4.01Å; W103-K643 HydrophobicContact CG-CD 4.38Å; W103-K643 HydrophobicContact CG-CG 4.41Å; K639-K643 HydrophobicContact CG-CD 4.35Å; K639-K643 WeakPolarHBondContact O-CB 3.31Å; K639-K643 WeakPolarHBondContact O-CG 3.28Å; K639-K643 PolarHBondContact O-N 3.23Å; K639-K643 VanDerWaalsContact O-N 3.08Å; Q640-K643 PolarHBondContact O-N 3Å; M641-K643 PolarHBondContact O-N 3.39Å
644	R	78	Confident	79.6	Confident	72 Å²	72	60.6 Å²	60.6	27%	0.272	29%	0.289	S	S	.	.	H	α-helix	trans	-85.7	-15.9	-172.1	-65.4	-176.1	110.3	179.8	3.5	113.7	V601 R603 N605 Q640 M641 K646 S647 L648	V601-R644 HydrophobicContact CG1-CB 4.33Å; V601-R644 VanDerWaalsContact O-CD 3.28Å; V601-R644 WeakPolarHBondContact O-CD 3.31Å; V601-R644 PolarHBondContact O-NH1 3.03Å; R603-R644 PolarHBondContact O-NH1 3.38Å; R603-R644 PolarHBondContact O-NH2 3.45Å; N605-R644 PolarHBondContact OD1-NH2 2.9Å; Q640-R644 WeakPolarHBondContact O-CB 3.43Å; Q640-R644 WeakPolarHBondContact O-CG 2.99Å; Q640-R644 PolarHBondContact O-N 2.88Å; M641-R644 PolarHBondContact O-N 2.72Å; R644-K646 VanDerWaalsContact C-N 3.26Å; R644-K646 PolarHBondContact O-N 3.13Å; R644-K646 VanDerWaalsContact O-N 3.09Å; R644-S647 PolarHBondContact O-N 3.08Å; R644-S647 PolarHBondContact O-OG 2.9Å; R644-S647 VanDerWaalsContact O-OG 3.09Å; R644-L648 HydrophobicContact CB-CD1 4.17Å; R644-L648 HydrophobicContact CB-CG 4.45Å; R644-L648 WeakPolarHBondContact O-CG 3.34Å
645	R	74.2	Confident	79.7	Confident	30 Å²	30	62.3 Å²	62.3	11%	0.113	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-48.2	-44.4	-173.5	73.3	-176.1	-172.3	-115.4	9.8	113.3	T588 V589 M641 Y642 S647 L648	T588-R645 WeakPolarHBondContact O-CD 3.46Å; V589-R645 WeakPolarHBondContact CG1-O 3.33Å; V589-R645 WeakPolarHBondContact O-CG 3.24Å; M641-R645 VanDerWaalsContact O-CB 3.31Å; M641-R645 WeakPolarHBondContact O-CB 3.38Å; M641-R645 PolarHBondContact O-N 3.22Å; Y642-R645 VanDerWaalsContact CE2-CZ 3.45Å; Y642-R645 VanDerWaalsContact CG-NH1 3.28Å; Y642-R645 WeakPolarHBondContact O-CG 3.31Å; Y642-R645 PolarHBondContact O-NH1 3.18Å; Y642-R645 PolarHBondContact OH-NH2 2.97Å; R645-S647 VanDerWaalsContact C-N 3.29Å; R645-S647 PolarHBondContact O-N 3.2Å; R645-L648 PolarHBondContact O-N 3.3Å; R645-L648 VanDerWaalsContact O-N 3.15Å
646	K	73.4	Confident	79.7	Confident	168.333 Å²	168.333	61.8 Å²	61.8	73%	0.732	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-68.2	-15	-176.5	-64.7	-170.5	177	-171.6	0	114.7	R644	R644-K646 VanDerWaalsContact C-N 3.26Å; R644-K646 PolarHBondContact O-N 3.13Å; R644-K646 VanDerWaalsContact O-N 3.09Å
647	S	73.2	Confident	79.9	Confident	95.3333 Å²	95.3333	59.6 Å²	59.6	67%	0.667	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-107.7	4.5	-175.6	69	0	0	0	0	114	R644 R645	R644-S647 PolarHBondContact O-N 3.08Å; R644-S647 PolarHBondContact O-OG 2.9Å; R644-S647 VanDerWaalsContact O-OG 3.09Å; R645-S647 VanDerWaalsContact C-N 3.29Å; R645-S647 PolarHBondContact O-N 3.2Å
648	L	73.6	Confident	79.8	Confident	32.6667 Å²	32.6667	60.3 Å²	60.3	17%	0.171	30%	0.295	C	S	.	.	S	Bend	trans	-97.8	150.8	-174.5	-67.3	168.1	0	0	0	111.4	T596 V601 R644 R645 S650	T596-L648 HydrophobicContact CG2-CB 4.42Å; V601-L648 HydrophobicContact CB-CD1 4.06Å; V601-L648 HydrophobicContact CG1-CD1 3.97Å; V601-L648 HydrophobicContact CG2-CD1 3.74Å; R644-L648 HydrophobicContact CB-CD1 4.17Å; R644-L648 HydrophobicContact CB-CG 4.45Å; R644-L648 WeakPolarHBondContact O-CG 3.34Å; R645-L648 PolarHBondContact O-N 3.3Å; R645-L648 VanDerWaalsContact O-N 3.15Å; L648-S650 PolarHBondContact O-N 3.23Å
649	R	72.7	Confident	79.7	Confident	234.333 Å²	234.333	64.2 Å²	64.2	88%	0.884	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-64.6	120.5	170.6	-101.2	-176.7	-180	179.1	0.4	109.1	T596	T596-R649 PolarHBondContact OG1-O 3.48Å
650	S	77.1	Confident	79.8	Confident	52.6667 Å²	52.6667	62.3 Å²	62.3	37%	0.368	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-98.4	154.5	-179.6	55.4	0	0	0	0	111.3	N594 L648	N594-S650 WeakPolarHBondContact CB-OG 3.07Å; L648-S650 PolarHBondContact O-N 3.23Å
651	T	81.9	Confident	79.7	Confident	43.3333 Å²	43.3333	63.1 Å²	63.1	27%	0.266	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-119.7	138.1	169.6	-53.3	0	0	0	0	107.4	N594 L595 T655 V656	N594-T651 CarbonylContact C-O 3.59Å; N594-T651 WeakPolarHBondContact CA-O 3.24Å; L595-T651 PolarHBondContact N-O 3.31Å; L595-T651 PolarHBondContact O-N 3.21Å; T651-T655 HydrophobicContact CG2-CG2 3.71Å; T651-V656 HydrophobicContact CG2-CG2 3.85Å
652	S	84.6	Confident	79.2	Confident	40.3333 Å²	40.3333	65.6 Å²	65.6	28%	0.282	33%	0.326	S	S	.	.			trans	-59.1	147.4	176.2	71.3	0	0	0	0	110.6	N594 T654 T655 V656	N594-S652 WeakPolarHBondContact OD1-CA 3.4Å; S652-T654 PolarHBondContact O-N 3.07Å; S652-T654 PolarHBondContact OG-OG1 3.08Å; S652-T655 PolarHBondContact O-N 3.15Å; S652-T655 VanDerWaalsContact O-N 3.16Å; S652-T655 WeakPolarHBondContact OG-CB 3.28Å; S652-T655 PolarHBondContact OG-N 3.2Å; S652-T655 PolarHBondContact OG-OG1 3.08Å; S652-T655 VanDerWaalsContact OG-OG1 3.05Å; S652-V656 WeakPolarHBondContact O-CG2 3.42Å; S652-V656 PolarHBondContact O-N 2.78Å; S652-V656 VanDerWaalsContact O-N 3.08Å
653	I	85.2	Confident	78.9	Confident	7 Å²	7	70.7 Å²	70.7	4%	0.036	35%	0.346	C	S	.	.	H	α-helix	trans	-57.1	-36.5	177.1	-173.7	161	0	0	0	111.7	Y593 L595 V656 V657 H677 E679 I680	Y593-I653 HydrophobicContact CD1-CD1 4.27Å; L595-I653 HydrophobicContact CD1-CB 4.42Å; L595-I653 HydrophobicContact CD1-CD1 4.42Å; L595-I653 HydrophobicContact CD1-CG1 4Å; I653-V656 PolarHBondContact O-N 3.38Å; I653-V657 HydrophobicContact CG1-CG2 4.44Å; I653-V657 WeakPolarHBondContact O-CB 3.43Å; I653-V657 WeakPolarHBondContact O-CG2 3.31Å; I653-V657 PolarHBondContact O-N 3.05Å; I653-H677 HydrophobicContact CD1-CB 3.88Å; I653-E679 VanDerWaalsContact C-OE2 3.28Å; I653-E679 HydrophobicContact CD1-CB 4.35Å; I653-E679 HydrophobicContact CG1-CB 4.28Å; I653-E679 HydrophobicContact CG2-CB 4.33Å; I653-E679 VanDerWaalsContact CG2-CD 3.49Å; I653-E679 HydrophobicContact CG2-CG 4.3Å; I653-E679 WeakPolarHBondContact CG2-OE2 3.25Å; I653-I680 HydrophobicContact CD1-CD1 3.87Å; I653-I680 HydrophobicContact CD1-CG1 3.64Å; I653-I680 HydrophobicContact CG1-CG1 4.44Å
654	T	83.4	Confident	78.4	Confident	57.3333 Å²	57.3333	71.9 Å²	71.9	35%	0.352	35%	0.347	S	S	.	.	H	α-helix	trans	-59.3	-51.5	176.5	-5.6	0	0	0	0	110.9	S652 V656 V657 E658 E679	S652-T654 PolarHBondContact O-N 3.07Å; S652-T654 PolarHBondContact OG-OG1 3.08Å; T654-V656 VanDerWaalsContact C-N 3.29Å; T654-V656 PolarHBondContact O-N 3.11Å; T654-V657 PolarHBondContact O-N 3.34Å; T654-V657 VanDerWaalsContact O-N 3.12Å; T654-E658 WeakPolarHBondContact CG2-OE1 3.49Å; T654-E658 WeakPolarHBondContact O-CB 3.3Å; T654-E658 VanDerWaalsContact O-CG 3.3Å; T654-E658 WeakPolarHBondContact O-CG 3.25Å; T654-E658 PolarHBondContact O-N 3.04Å; T654-E679 VanDerWaalsContact CA-OE2 3.24Å; T654-E679 WeakPolarHBondContact CA-OE2 3.24Å; T654-E679 HydrophobicContact CG2-CG 4.17Å; T654-E679 PolarHBondContact N-OE2 2.74Å; T654-E679 PolarHBondContact OG1-OE1 3.41Å; T654-E679 PolarHBondContact OG1-OE2 2.81Å; T654-E679 VanDerWaalsContact OG1-OE2 3.12Å
655	T	83.4	Confident	78.2	Confident	48.6667 Å²	48.6667	72.7 Å²	72.7	30%	0.299	35%	0.353	S	S	.	.	H	α-helix	trans	-65.5	-30.9	178.5	-56.9	0	0	0	0	112.6	T651 S652 E658 K659	T651-T655 HydrophobicContact CG2-CG2 3.71Å; S652-T655 PolarHBondContact O-N 3.15Å; S652-T655 VanDerWaalsContact O-N 3.16Å; S652-T655 WeakPolarHBondContact OG-CB 3.28Å; S652-T655 PolarHBondContact OG-N 3.2Å; S652-T655 PolarHBondContact OG-OG1 3.08Å; S652-T655 VanDerWaalsContact OG-OG1 3.05Å; T655-E658 WeakPolarHBondContact CA-OE2 3.3Å; T655-K659 WeakPolarHBondContact O-CB 3.38Å; T655-K659 VanDerWaalsContact O-CG 3.28Å; T655-K659 WeakPolarHBondContact O-CG 3.45Å; T655-K659 PolarHBondContact O-N 3.23Å; T655-K659 VanDerWaalsContact O-N 3.11Å
656	V	84.9	Confident	78.5	Confident	6.66667 Å²	6.66667	75.9 Å²	75.9	4%	0.04	37%	0.369	C	S	.	.	H	α-helix	trans	-68.5	-46.8	173.1	173.7	0	0	0	0	110.9	Y586 L595 T651 S652 I653 T654 E658 K659 L660	Y586-V656 HydrophobicContact CD1-CG1 4.25Å; Y586-V656 HydrophobicContact CD1-CG2 4.45Å; Y586-V656 HydrophobicContact CD2-CG1 4.27Å; Y586-V656 HydrophobicContact CE1-CG1 3.78Å; Y586-V656 HydrophobicContact CE1-CG2 4.19Å; Y586-V656 HydrophobicContact CE2-CG1 3.94Å; Y586-V656 HydrophobicContact CG-CG1 4.38Å; L595-V656 HydrophobicContact CB-CG2 4.09Å; L595-V656 HydrophobicContact CD1-CB 4.16Å; L595-V656 HydrophobicContact CD1-CG1 4.06Å; L595-V656 HydrophobicContact CD1-CG2 4.28Å; T651-V656 HydrophobicContact CG2-CG2 3.85Å; S652-V656 WeakPolarHBondContact O-CG2 3.42Å; S652-V656 PolarHBondContact O-N 2.78Å; S652-V656 VanDerWaalsContact O-N 3.08Å; I653-V656 PolarHBondContact O-N 3.38Å; T654-V656 VanDerWaalsContact C-N 3.29Å; T654-V656 PolarHBondContact O-N 3.11Å; V656-E658 VanDerWaalsContact C-N 3.3Å; V656-E658 PolarHBondContact O-N 3.3Å; V656-K659 WeakPolarHBondContact O-CB 3.37Å; V656-K659 PolarHBondContact O-N 3.35Å; V656-K659 VanDerWaalsContact O-N 3.17Å; V656-L660 HydrophobicContact CG1-CD1 4.46Å; V656-L660 WeakPolarHBondContact O-CG 3.36Å; V656-L660 PolarHBondContact O-N 3.22Å
657	V	84.5	Confident	79.2	Confident	18 Å²	18	68 Å²	68	11%	0.109	34%	0.335	C	S	.	.	H	α-helix	trans	-61	-43	176.9	167.7	0	0	0	0	111.1	I653 T654 K659 L660 Y661 Y683	I653-V657 HydrophobicContact CG1-CG2 4.44Å; I653-V657 WeakPolarHBondContact O-CB 3.43Å; I653-V657 WeakPolarHBondContact O-CG2 3.31Å; I653-V657 PolarHBondContact O-N 3.05Å; T654-V657 PolarHBondContact O-N 3.34Å; T654-V657 VanDerWaalsContact O-N 3.12Å; V657-K659 VanDerWaalsContact C-N 3.33Å; V657-K659 PolarHBondContact O-N 3.23Å; V657-L660 WeakPolarHBondContact O-CB 3.32Å; V657-L660 PolarHBondContact O-N 3.11Å; V657-L660 VanDerWaalsContact O-N 3.13Å; V657-Y661 HydrophobicContact CG1-CD2 3.82Å; V657-Y661 HydrophobicContact CG1-CE2 3.38Å; V657-Y661 VanDerWaalsContact CG1-CE2 3.5Å; V657-Y661 VanDerWaalsContact O-CD2 3.28Å; V657-Y661 WeakPolarHBondContact O-CD2 3.4Å; V657-Y661 PolarHBondContact O-N 3.01Å; V657-Y683 HydrophobicContact CG1-CD2 3.77Å; V657-Y683 HydrophobicContact CG1-CG 4.34Å; V657-Y683 HydrophobicContact CG2-CG 4.46Å
658	E	79.9	Confident	79.8	Confident	87.6667 Å²	87.6667	67.4 Å²	67.4	41%	0.41	32%	0.324	S	S	.	.	H	α-helix	trans	-58.3	-44.5	173.3	-73.4	169.5	-179.3	0	0	112.2	T654 T655 V656 L660 Y661 A662 Q1280	T654-E658 WeakPolarHBondContact CG2-OE1 3.49Å; T654-E658 WeakPolarHBondContact O-CB 3.3Å; T654-E658 VanDerWaalsContact O-CG 3.3Å; T654-E658 WeakPolarHBondContact O-CG 3.25Å; T654-E658 PolarHBondContact O-N 3.04Å; T655-E658 WeakPolarHBondContact CA-OE2 3.3Å; V656-E658 VanDerWaalsContact C-N 3.3Å; V656-E658 PolarHBondContact O-N 3.3Å; E658-L660 VanDerWaalsContact C-N 3.32Å; E658-L660 PolarHBondContact O-N 2.94Å; E658-Y661 PolarHBondContact O-N 3.09Å; E658-A662 VanDerWaalsContact O-CB 3.25Å; E658-A662 WeakPolarHBondContact O-CB 3.34Å; E658-A662 PolarHBondContact O-N 3.16Å; E658-Q1280 VanDerWaalsContact CD-CB 3.48Å; E658-Q1280 VanDerWaalsContact CD-O 3.31Å; E658-Q1280 HydrophobicContact CG-CB 3.56Å; E658-Q1280 HydrophobicContact CG-CG 3.64Å; E658-Q1280 WeakPolarHBondContact OE1-CA 3.36Å; E658-Q1280 WeakPolarHBondContact OE1-CB 3.4Å; E658-Q1280 WeakPolarHBondContact OE1-CG 3.48Å
659	K	80.4	Confident	80.6	Confident	84.6667 Å²	84.6667	66.4 Å²	66.4	37%	0.368	32%	0.318	S	S	.	.	H	α-helix	trans	-61.1	-43.5	173.5	-79.2	177.2	-179.8	-179.4	0	111.4	T655 V656 V657 Y661 A662 Y663 L1066	T655-K659 WeakPolarHBondContact O-CB 3.38Å; T655-K659 VanDerWaalsContact O-CG 3.28Å; T655-K659 WeakPolarHBondContact O-CG 3.45Å; T655-K659 PolarHBondContact O-N 3.23Å; T655-K659 VanDerWaalsContact O-N 3.11Å; V656-K659 WeakPolarHBondContact O-CB 3.37Å; V656-K659 PolarHBondContact O-N 3.35Å; V656-K659 VanDerWaalsContact O-N 3.17Å; V657-K659 VanDerWaalsContact C-N 3.33Å; V657-K659 PolarHBondContact O-N 3.23Å; K659-Y661 VanDerWaalsContact C-N 3.32Å; K659-Y661 PolarHBondContact O-N 3.16Å; K659-A662 WeakPolarHBondContact O-CB 3.47Å; K659-A662 PolarHBondContact O-N 3.18Å; K659-A662 VanDerWaalsContact O-N 3.09Å; K659-Y663 HydrophobicContact CB-CD2 4.09Å; K659-Y663 HydrophobicContact CB-CE2 3.94Å; K659-Y663 HydrophobicContact CD-CE2 4.42Å; K659-Y663 HydrophobicContact CG-CE2 4.2Å; K659-Y663 WeakPolarHBondContact O-CB 3.4Å; K659-Y663 WeakPolarHBondContact O-CD2 3.27Å; K659-Y663 PolarHBondContact O-N 3.18Å; K659-L1066 HydrophobicContact CG-CD2 4.34Å
660	L	83	Confident	81.5	Confident	11.3333 Å²	11.3333	55.3 Å²	55.3	6%	0.059	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-41.3	178.1	-67.6	177.7	0	0	0	111.8	L544 V656 V657 E658 R664 K665 F667 Y683	L544-L660 HydrophobicContact CD1-CD1 4.26Å; L544-L660 HydrophobicContact CD2-CD1 3.79Å; V656-L660 HydrophobicContact CG1-CD1 4.46Å; V656-L660 WeakPolarHBondContact O-CG 3.36Å; V656-L660 PolarHBondContact O-N 3.22Å; V657-L660 WeakPolarHBondContact O-CB 3.32Å; V657-L660 PolarHBondContact O-N 3.11Å; V657-L660 VanDerWaalsContact O-N 3.13Å; E658-L660 VanDerWaalsContact C-N 3.32Å; E658-L660 PolarHBondContact O-N 2.94Å; L660-R664 PolarHBondContact O-N 2.95Å; L660-K665 PolarHBondContact O-N 3.16Å; L660-F667 HydrophobicContact CD1-CE2 4.38Å; L660-F667 HydrophobicContact CD2-CE2 3.94Å; L660-F667 HydrophobicContact CD2-CZ 4.02Å; L660-Y683 HydrophobicContact CB-CE2 4.09Å; L660-Y683 HydrophobicContact CD1-CE1 4.31Å; L660-Y683 HydrophobicContact CD1-CE2 4.45Å
661	Y	78.9	Confident	82.2	Confident	63.6667 Å²	63.6667	52.8 Å²	52.8	25%	0.25	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-46.4	171.7	-72.1	-53.7	0	0	0	112.4	V657 E658 K659 Y663 R664 Y683 N686 I1145	V657-Y661 HydrophobicContact CG1-CD2 3.82Å; V657-Y661 HydrophobicContact CG1-CE2 3.38Å; V657-Y661 VanDerWaalsContact CG1-CE2 3.5Å; V657-Y661 VanDerWaalsContact O-CD2 3.28Å; V657-Y661 WeakPolarHBondContact O-CD2 3.4Å; V657-Y661 PolarHBondContact O-N 3.01Å; E658-Y661 PolarHBondContact O-N 3.09Å; K659-Y661 VanDerWaalsContact C-N 3.32Å; K659-Y661 PolarHBondContact O-N 3.16Å; Y661-Y663 VanDerWaalsContact C-N 3.34Å; Y661-Y663 PolarHBondContact O-N 3.12Å; Y661-R664 WeakPolarHBondContact O-CG 3.47Å; Y661-R664 PolarHBondContact O-N 3.18Å; Y661-R664 VanDerWaalsContact O-N 3.09Å; Y661-Y683 HydrophobicContact CD1-CD2 4.3Å; Y661-Y683 HydrophobicContact CD1-CE2 4.2Å; Y661-Y683 HydrophobicContact CD2-CD2 4.37Å; Y661-Y683 AromaticContact CE1-CD2 3.73Å; Y661-Y683 HydrophobicContact CE1-CD2 3.85Å; Y661-Y683 AromaticContact CE1-CE2 3.84Å; Y661-Y683 HydrophobicContact CE1-CE2 3.84Å; Y661-Y683 AromaticContact CE2-CD2 3.91Å; Y661-Y683 HydrophobicContact CE2-CD2 4.01Å; Y661-Y683 HydrophobicContact CE2-CE2 4.4Å; Y661-Y683 HydrophobicContact CG-CE2 4.37Å; Y661-Y683 AromaticContact CZ-CD2 3.55Å; Y661-Y683 VanDerWaalsContact CZ-CD2 3.46Å; Y661-Y683 AromaticContact CZ-CE2 3.99Å; Y661-Y683 WeakPolarHBondContact OH-CA 3.43Å; Y661-Y683 WeakPolarHBondContact OH-CD2 3.46Å; Y661-N686 HydrophobicContact CE1-CB 4.25Å; Y661-N686 WeakPolarHBondContact OH-CB 3.45Å; Y661-N686 PolarHBondContact OH-ND2 3.21Å; Y661-N686 VanDerWaalsContact OH-ND2 3.1Å; Y661-I1145 HydrophobicContact CD1-CD1 4.3Å
662	A	71.1	Confident	82.6	Confident	55.3333 Å²	55.3333	50.7 Å²	50.7	46%	0.457	25%	0.246	S	C	.	.	H	α-helix	trans	-61.1	-45.5	-178.8	0	0	0	0	0	111.7	E658 K659 R664 P1062 R1063 L1066	E658-A662 VanDerWaalsContact O-CB 3.25Å; E658-A662 WeakPolarHBondContact O-CB 3.34Å; E658-A662 PolarHBondContact O-N 3.16Å; K659-A662 WeakPolarHBondContact O-CB 3.47Å; K659-A662 PolarHBondContact O-N 3.18Å; K659-A662 VanDerWaalsContact O-N 3.09Å; A662-R664 VanDerWaalsContact C-N 3.28Å; A662-R664 PolarHBondContact O-N 2.93Å; A662-P1062 CarbonylContact O-C 3.53Å; A662-R1063 VanDerWaalsContact O-CA 3.28Å; A662-R1063 WeakPolarHBondContact O-CA 3.26Å; A662-R1063 WeakPolarHBondContact O-CB 3.28Å; A662-R1063 PolarHBondContact O-N 3.24Å; A662-L1066 HydrophobicContact CB-CB 4.06Å; A662-L1066 HydrophobicContact CB-CD2 3.56Å; A662-L1066 HydrophobicContact CB-CG 4.46Å
663	Y	73.4	Confident	82.8	Confident	150 Å²	150	48.9 Å²	48.9	59%	0.588	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-7	176.7	-67.6	-61.2	0	0	0	113.8	K659 Y661 K665 R1063	K659-Y663 HydrophobicContact CB-CD2 4.09Å; K659-Y663 HydrophobicContact CB-CE2 3.94Å; K659-Y663 HydrophobicContact CD-CE2 4.42Å; K659-Y663 HydrophobicContact CG-CE2 4.2Å; K659-Y663 WeakPolarHBondContact O-CB 3.4Å; K659-Y663 WeakPolarHBondContact O-CD2 3.27Å; K659-Y663 PolarHBondContact O-N 3.18Å; Y661-Y663 VanDerWaalsContact C-N 3.34Å; Y661-Y663 PolarHBondContact O-N 3.12Å; Y663-K665 PolarHBondContact O-N 3Å; Y663-K665 VanDerWaalsContact O-N 3.08Å; Y663-R1063 HydrophobicContact CD1-CG 3.7Å; Y663-R1063 HydrophobicContact CE1-CG 3.75Å; Y663-R1063 HydrophobicContact CG-CG 4.35Å
664	R	70.3	Confident	82.7	Confident	150 Å²	150	48.6 Å²	48.6	57%	0.566	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.7	36.5	-174.4	-64.4	-174.4	173.7	176.5	1.2	112.5	L660 Y661 A662 Q666 P1062	L660-R664 PolarHBondContact O-N 2.95Å; Y661-R664 WeakPolarHBondContact O-CG 3.47Å; Y661-R664 PolarHBondContact O-N 3.18Å; Y661-R664 VanDerWaalsContact O-N 3.09Å; A662-R664 VanDerWaalsContact C-N 3.28Å; A662-R664 PolarHBondContact O-N 2.93Å; R664-Q666 PolarHBondContact O-N 2.94Å; R664-P1062 HydrophobicContact CG-CG 4.14Å; R664-P1062 VanDerWaalsContact NE-CG 3.35Å
665	K	74	Confident	82.6	Confident	90 Å²	90	46.2 Å²	46.2	39%	0.391	22%	0.217	S	C	.	.			trans	-72.4	116.1	-175.4	-167.5	170.8	-172.9	-179.4	0	108.5	T584 L660 Y663 F667	T584-K665 WeakPolarHBondContact OG1-CE 3.4Å; T584-K665 PolarHBondContact OG1-NZ 3.26Å; L660-K665 PolarHBondContact O-N 3.16Å; Y663-K665 PolarHBondContact O-N 3Å; Y663-K665 VanDerWaalsContact O-N 3.08Å; K665-F667 HydrophobicContact CB-CE2 4.32Å; K665-F667 HydrophobicContact CB-CZ 4.38Å; K665-F667 HydrophobicContact CD-CE1 4.22Å; K665-F667 HydrophobicContact CD-CZ 3.79Å; K665-F667 HydrophobicContact CG-CE1 4.34Å; K665-F667 HydrophobicContact CG-CE2 4.29Å; K665-F667 HydrophobicContact CG-CZ 3.93Å; K665-F667 WeakPolarHBondContact O-CD2 3.29Å; K665-F667 WeakPolarHBondContact O-CE2 3.3Å
666	Q	79.7	Confident	82.6	Confident	96.6667 Å²	96.6667	44.4 Å²	44.4	45%	0.452	21%	0.206	S	C	.	.			trans	-80.5	140.9	178.3	-67.8	-178.4	-15.5	0	0	110.3	S542 R664 Y687 I691	S542-Q666 PolarHBondContact OG-O 3.17Å; S542-Q666 VanDerWaalsContact OG-O 3.12Å; R664-Q666 PolarHBondContact O-N 2.94Å; Q666-Y687 VanDerWaalsContact CA-OH 3.31Å; Q666-Y687 WeakPolarHBondContact CA-OH 3.43Å; Q666-Y687 WeakPolarHBondContact CB-OH 3.38Å; Q666-I691 HydrophobicContact CG-CG2 4.06Å
667	F	87.4	Confident	82.6	Confident	2.66667 Å²	2.66667	46.4 Å²	46.4	1%	0.012	22%	0.215	C	C	.	.			trans	-125.8	136.4	173.1	-62.9	-71.7	0	0	0	109	S542 L544 T584 L660 K665 Y687 L694	S542-F667 VanDerWaalsContact OG-CA 3.27Å; S542-F667 WeakPolarHBondContact OG-CA 3.42Å; L544-F667 HydrophobicContact CB-CD1 3.69Å; L544-F667 HydrophobicContact CB-CD2 4.1Å; L544-F667 HydrophobicContact CB-CE1 3.76Å; L544-F667 HydrophobicContact CB-CE2 4.16Å; L544-F667 HydrophobicContact CB-CG 3.85Å; L544-F667 HydrophobicContact CB-CZ 3.98Å; L544-F667 HydrophobicContact CD1-CE1 4.42Å; L544-F667 HydrophobicContact CD1-CZ 4.07Å; L544-F667 HydrophobicContact CD2-CD2 4.29Å; L544-F667 HydrophobicContact CD2-CE2 4.06Å; L544-F667 HydrophobicContact CD2-CZ 4.41Å; L544-F667 HydrophobicContact CG-CE2 4.46Å; L544-F667 HydrophobicContact CG-CZ 4.38Å; T584-F667 HydrophobicContact CG2-CE1 4.44Å; T584-F667 HydrophobicContact CG2-CZ 4.34Å; L660-F667 HydrophobicContact CD1-CE2 4.38Å; L660-F667 HydrophobicContact CD2-CE2 3.94Å; L660-F667 HydrophobicContact CD2-CZ 4.02Å; K665-F667 HydrophobicContact CB-CE2 4.32Å; K665-F667 HydrophobicContact CB-CZ 4.38Å; K665-F667 HydrophobicContact CD-CE1 4.22Å; K665-F667 HydrophobicContact CD-CZ 3.79Å; K665-F667 HydrophobicContact CG-CE1 4.34Å; K665-F667 HydrophobicContact CG-CE2 4.29Å; K665-F667 HydrophobicContact CG-CZ 3.93Å; K665-F667 WeakPolarHBondContact O-CD2 3.29Å; K665-F667 WeakPolarHBondContact O-CE2 3.3Å; F667-Y687 PolarHBondContact N-OH 3Å; F667-Y687 PolarHBondContact O-OH 2.9Å; F667-Y687 VanDerWaalsContact O-OH 3.12Å; F667-L694 HydrophobicContact CB-CD1 3.95Å; F667-L694 WeakPolarHBondContact O-CD1 3.33Å
668	D	86.2	Confident	82.6	Confident	83.3333 Å²	83.3333	49.6 Å²	49.6	45%	0.446	23%	0.227	S	C	.	.	S	Bend	trans	-80.1	-34	169.8	-57.1	-62.8	0	0	0	110.2	G541 S542 K695	G541-D668 WeakPolarHBondContact CA-OD2 3.29Å; S542-D668 PolarHBondContact N-OD2 2.87Å; S542-D668 PolarHBondContact O-N 2.86Å; S542-D668 PolarHBondContact OG-N 3.14Å; S542-D668 VanDerWaalsContact OG-N 3.09Å; S542-D668 PolarHBondContact OG-OD2 2.82Å; D668-K695 WeakPolarHBondContact O-CB 3.45Å; D668-K695 PolarHBondContact O-N 3.13Å; D668-K695 VanDerWaalsContact O-N 3.12Å
669	K	89.6	Confident	82.8	Confident	10.6667 Å²	10.6667	48.1 Å²	48.1	5%	0.046	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	141.5	-174.2	-59.9	173.2	-174.3	171.4	0	111.4	I539 C540 S542 T543 L544 K695 I730 A731	I539-K669 HydrophobicContact CG2-CD 4.19Å; C540-K669 PolarHBondContact O-NZ 2.84Å; C540-K669 VanDerWaalsContact O-NZ 3.1Å; S542-K669 PolarHBondContact O-N 3.04Å; S542-K669 VanDerWaalsContact O-N 3.15Å; T543-K669 CarbonylContact C-O 3.59Å; T543-K669 VanDerWaalsContact CA-O 3.32Å; T543-K669 WeakPolarHBondContact CA-O 3.22Å; T543-K669 HydrophobicContact CG2-CB 4Å; L544-K669 PolarHBondContact N-O 3.22Å; K669-K695 CarbonylContact C-O 3.55Å; K669-K695 WeakPolarHBondContact CA-O 3.36Å; K669-K695 HydrophobicContact CG-CB 4.18Å; K669-K695 HydrophobicContact CG-CD 4.45Å; K669-I730 PolarHBondContact NZ-O 3.04Å; K669-A731 PolarHBondContact NZ-O 3.37Å
670	I	91.9	Very high	83.2	Confident	0.666667 Å²	0.666667	44.3 Å²	44.3	0%	0.003	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	128.8	165.4	-143.6	-177.6	0	0	0	109.1	L544 V672 I680 Y683 V684 L694 K695 A696 I697 W716	L544-I670 HydrophobicContact CB-CB 4.4Å; L544-I670 HydrophobicContact CB-CG1 4.14Å; L544-I670 HydrophobicContact CD2-CD1 3.77Å; L544-I670 HydrophobicContact CD2-CG1 4.05Å; L544-I670 HydrophobicContact CG-CD1 4.36Å; L544-I670 HydrophobicContact CG-CG1 4.13Å; L544-I670 CarbonylContact O-C 3.5Å; L544-I670 WeakPolarHBondContact O-CA 3.34Å; I670-V672 HydrophobicContact CG2-CG2 4.28Å; I670-I680 HydrophobicContact CD1-CG2 3.68Å; I670-Y683 HydrophobicContact CD1-CD1 4.14Å; I670-Y683 HydrophobicContact CD1-CE1 4.01Å; I670-V684 HydrophobicContact CD1-CG2 3.93Å; I670-V684 HydrophobicContact CG2-CG2 3.96Å; I670-L694 HydrophobicContact CB-CD1 4.4Å; I670-L694 HydrophobicContact CB-CD2 4.42Å; I670-L694 HydrophobicContact CD1-CD1 4.2Å; I670-L694 HydrophobicContact CD1-CD2 3.32Å; I670-L694 HydrophobicContact CD1-CG 4.17Å; I670-L694 HydrophobicContact CG1-CD1 3.73Å; I670-L694 HydrophobicContact CG1-CD2 3.59Å; I670-L694 HydrophobicContact CG1-CG 3.88Å; I670-L694 HydrophobicContact CG2-CD1 4.31Å; I670-L694 HydrophobicContact CG2-CD2 3.88Å; I670-L694 HydrophobicContact CG2-CG 4.04Å; I670-K695 PolarHBondContact N-O 3.09Å; I670-A696 HydrophobicContact CG2-CB 3.64Å; I670-I697 PolarHBondContact O-N 3.14Å; I670-W716 HydrophobicContact CG2-CH2 4.47Å
671	V	91.5	Very high	83.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	117.8	-178.6	-173.9	0	0	0	0	109.2	T543 L544 I545 I546 F673 I697 I730	T543-V671 HydrophobicContact CG2-CG2 3.88Å; L544-V671 PolarHBondContact O-N 3.18Å; I545-V671 CarbonylContact C-O 3.59Å; I545-V671 WeakPolarHBondContact CA-O 3.32Å; I546-V671 PolarHBondContact N-O 3.48Å; V671-F673 HydrophobicContact CB-CE2 4.49Å; V671-F673 HydrophobicContact CG1-CD1 4.41Å; V671-F673 HydrophobicContact CG1-CD2 4.13Å; V671-F673 HydrophobicContact CG1-CE1 3.9Å; V671-F673 HydrophobicContact CG1-CE2 3.58Å; V671-F673 VanDerWaalsContact CG1-CE2 3.49Å; V671-F673 HydrophobicContact CG1-CG 4.48Å; V671-F673 HydrophobicContact CG1-CZ 3.46Å; V671-F673 VanDerWaalsContact CG1-CZ 3.5Å; V671-I697 WeakPolarHBondContact CA-O 3.35Å; V671-I697 HydrophobicContact CG1-CG2 4.36Å; V671-I697 HydrophobicContact CG2-CB 4.32Å; V671-I697 HydrophobicContact CG2-CD1 4.29Å; V671-I730 HydrophobicContact CG1-CD1 3.95Å; V671-I730 HydrophobicContact CG2-CD1 4.35Å; V671-I730 HydrophobicContact CG2-CG1 4.33Å; V671-I730 HydrophobicContact CG2-CG2 4.04Å
672	V	90.7	Very high	83.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	117.5	176	-175.8	0	0	0	0	108.8	I546 I670 D675 C676 I680 I697 G699 W716	I546-V672 HydrophobicContact CB-CG1 4.49Å; I546-V672 HydrophobicContact CB-CG2 4.36Å; I546-V672 HydrophobicContact CD1-CG2 4.49Å; I670-V672 HydrophobicContact CG2-CG2 4.28Å; V672-D675 WeakPolarHBondContact CG1-O 3.31Å; V672-C676 HydrophobicContact CG1-CB 4.32Å; V672-I680 HydrophobicContact CG2-CD1 4.36Å; V672-I680 HydrophobicContact CG2-CG2 3.97Å; V672-I697 PolarHBondContact N-O 3.11Å; V672-G699 PolarHBondContact O-N 3.16Å; V672-W716 HydrophobicContact CG2-CH2 4.26Å; V672-W716 HydrophobicContact CG2-CZ3 4.21Å
673	F	88.5	Confident	84.4	Confident	2.33333 Å²	2.33333	40.3 Å²	40.3	1%	0.01	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	117.9	173.2	-64.6	-66.9	0	0	0	110	I545 I546 S548 L572 C576 V671 L701 I726 L727 I730	I545-F673 HydrophobicContact CG2-CD2 4.14Å; I545-F673 HydrophobicContact CG2-CE2 4.07Å; I546-F673 PolarHBondContact O-N 3.3Å; S548-F673 WeakPolarHBondContact CA-O 3.44Å; S548-F673 WeakPolarHBondContact CB-O 3.3Å; S548-F673 PolarHBondContact N-O 3.33Å; L572-F673 HydrophobicContact CB-CD1 3.78Å; L572-F673 HydrophobicContact CB-CD2 4.12Å; L572-F673 HydrophobicContact CB-CE1 3.82Å; L572-F673 HydrophobicContact CB-CE2 4.16Å; L572-F673 HydrophobicContact CB-CG 3.92Å; L572-F673 HydrophobicContact CB-CZ 4.01Å; L572-F673 HydrophobicContact CD1-CD1 3.88Å; L572-F673 HydrophobicContact CD1-CE1 4.14Å; L572-F673 HydrophobicContact CG-CD1 4.34Å; L572-F673 HydrophobicContact CG-CE1 4.31Å; C576-F673 HydrophobicContact CB-CE2 3.77Å; C576-F673 HydrophobicContact CB-CZ 4.1Å; V671-F673 HydrophobicContact CB-CE2 4.49Å; V671-F673 HydrophobicContact CG1-CD1 4.41Å; V671-F673 HydrophobicContact CG1-CD2 4.13Å; V671-F673 HydrophobicContact CG1-CE1 3.9Å; V671-F673 HydrophobicContact CG1-CE2 3.58Å; V671-F673 VanDerWaalsContact CG1-CE2 3.49Å; V671-F673 HydrophobicContact CG1-CG 4.48Å; V671-F673 HydrophobicContact CG1-CZ 3.46Å; V671-F673 VanDerWaalsContact CG1-CZ 3.5Å; F673-L701 HydrophobicContact CB-CD1 4.45Å; F673-I726 HydrophobicContact CE1-CD1 4.11Å; F673-I726 HydrophobicContact CE1-CG2 4.28Å; F673-L727 HydrophobicContact CZ-CD2 4.16Å; F673-I730 HydrophobicContact CE1-CD1 4.31Å; F673-I730 HydrophobicContact CZ-CD1 4.01Å
674	G	83.1	Confident	85.1	Confident	0.333333 Å²	0.333333	33.2 Å²	33.2	0%	0.003	15%	0.151	C	C	.	.	S	Bend	trans	105.3	-150.5	-176.4	0	0	0	0	0	112	W698 G699	G674-W698 PolarHBondContact O-NE1 3.21Å; G674-G699 PolarHBondContact N-O 3Å; G674-G699 VanDerWaalsContact N-O 3.1Å
675	D	81.6	Confident	85.8	Confident	7.33333 Å²	7.33333	29 Å²	29	4%	0.039	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-72.9	141.9	-177.7	-54.8	-17.1	0	0	0	110.4	S550 K551 Y593 V672	S550-D675 VanDerWaalsContact CA-OD1 3.27Å; S550-D675 WeakPolarHBondContact CA-OD1 3.46Å; S550-D675 VanDerWaalsContact CB-OD1 3.27Å; S550-D675 WeakPolarHBondContact CB-OD1 3.31Å; S550-D675 PolarHBondContact OG-OD1 2.86Å; K551-D675 WeakPolarHBondContact CB-OD2 3.4Å; K551-D675 WeakPolarHBondContact CG-OD2 3.24Å; K551-D675 PolarHBondContact N-OD2 3.14Å; Y593-D675 WeakPolarHBondContact CE1-O 3.39Å; Y593-D675 WeakPolarHBondContact OH-CA 3.43Å; Y593-D675 VanDerWaalsContact OH-CB 3.26Å; Y593-D675 WeakPolarHBondContact OH-CB 3.34Å; Y593-D675 PolarHBondContact OH-O 2.76Å; V672-D675 WeakPolarHBondContact CG1-O 3.31Å
676	C	83.7	Confident	86.1	Confident	10.3333 Å²	10.3333	26.9 Å²	26.9	7%	0.07	13%	0.132	C	C	.	.	P	Polyproline II helix	trans	-103.3	123.1	-179.4	-165.3	0	0	0	0	110.7	V672 W698 W707 P708	V672-C676 HydrophobicContact CG1-CB 4.32Å; C676-W698 HydrophobicContact CB-CD2 4.35Å; C676-W698 HydrophobicContact CB-CG 4.34Å; C676-W707 HydrophobicContact CB-CZ3 4.24Å; C676-P708 WeakPolarHBondContact O-CG 3.08Å
677	H	84.9	Confident	86.3	Confident	48.6667 Å²	48.6667	22.6 Å²	22.6	23%	0.225	11%	0.112	C	C	.	.	P	Polyproline II helix	trans	-83.9	148.3	-179.6	-159.6	-101.4	0	0	0	111.6	Y593 I653 E679 I680 V681	Y593-H677 HydrophobicContact CD1-CB 3.76Å; Y593-H677 HydrophobicContact CD2-CB 4.24Å; Y593-H677 AromaticContact CD2-CD2 3.24Å; Y593-H677 WeakPolarHBondContact CD2-CD2 3.38Å; Y593-H677 AromaticContact CD2-CG 3.9Å; Y593-H677 AromaticContact CD2-NE2 3.92Å; Y593-H677 HydrophobicContact CE1-CB 3.92Å; Y593-H677 HydrophobicContact CE2-CB 4.38Å; Y593-H677 AromaticContact CE2-CD2 3.7Å; Y593-H677 VanDerWaalsContact CE2-CD2 3.48Å; Y593-H677 WeakPolarHBondContact CE2-CD2 3.37Å; Y593-H677 HydrophobicContact CG-CB 3.92Å; Y593-H677 AromaticContact CG-CD2 3.55Å; Y593-H677 AromaticContact CG-CG 3.84Å; I653-H677 HydrophobicContact CD1-CB 3.88Å; H677-E679 VanDerWaalsContact C-N 3.28Å; H677-E679 IonicContact CE1-OE1 2.99Å; H677-E679 PolarHBondContact CE1-OE1 2.91Å; H677-E679 IonicContact CE1-OE2 3.63Å; H677-E679 PolarHBondContact CE1-OE2 3.37Å; H677-E679 IonicContact CG-OE2 3.42Å; H677-E679 VanDerWaalsContact ND1-CD 3.3Å; H677-E679 PolarHBondContact ND1-N 3.24Å; H677-E679 IonicContact ND1-OE1 2.67Å; H677-E679 IonicContact ND1-OE2 3.48Å; H677-E679 PolarHBondContact ND1-OE2 3.31Å; H677-E679 IonicContact NE2-OE2 3.95Å; H677-E679 PolarHBondContact O-N 3Å; H677-I680 HydrophobicContact CB-CD1 4.16Å; H677-I680 HydrophobicContact CB-CG1 4.27Å; H677-I680 WeakPolarHBondContact O-CB 3.31Å; H677-I680 PolarHBondContact O-N 2.95Å; H677-I680 VanDerWaalsContact O-N 3.07Å; H677-V681 PolarHBondContact O-N 3.15Å
678	K	84.7	Confident	86.1	Confident	85 Å²	85	26 Å²	26	37%	0.37	13%	0.125	S	C	.	.	H	α-helix	trans	-53	-43.5	-178.3	178.1	178.3	175.4	-179.1	0	112.7	I680 V681 D682 P708	K678-I680 VanDerWaalsContact C-N 3.29Å; K678-I680 PolarHBondContact O-N 3.18Å; K678-V681 CarbonylContact O-C 3.54Å; K678-V681 WeakPolarHBondContact O-CA 3.36Å; K678-V681 WeakPolarHBondContact O-CB 3.44Å; K678-V681 PolarHBondContact O-N 3.13Å; K678-D682 WeakPolarHBondContact CE-OD2 3.42Å; K678-D682 PolarHBondContact O-N 3.1Å; K678-P708 HydrophobicContact CB-CB 4.36Å; K678-P708 HydrophobicContact CB-CG 4.43Å
679	E	84.6	Confident	85.6	Confident	58 Å²	58	25 Å²	25	27%	0.271	12%	0.122	S	C	.	.	H	α-helix	trans	-62.9	-28.7	-178.6	-73.4	110.4	162.3	0	0	112.9	I653 T654 H677 Y683	I653-E679 VanDerWaalsContact C-OE2 3.28Å; I653-E679 HydrophobicContact CD1-CB 4.35Å; I653-E679 HydrophobicContact CG1-CB 4.28Å; I653-E679 HydrophobicContact CG2-CB 4.33Å; I653-E679 VanDerWaalsContact CG2-CD 3.49Å; I653-E679 HydrophobicContact CG2-CG 4.3Å; I653-E679 WeakPolarHBondContact CG2-OE2 3.25Å; T654-E679 VanDerWaalsContact CA-OE2 3.24Å; T654-E679 WeakPolarHBondContact CA-OE2 3.24Å; T654-E679 HydrophobicContact CG2-CG 4.17Å; T654-E679 PolarHBondContact N-OE2 2.74Å; T654-E679 PolarHBondContact OG1-OE1 3.41Å; T654-E679 PolarHBondContact OG1-OE2 2.81Å; T654-E679 VanDerWaalsContact OG1-OE2 3.12Å; H677-E679 VanDerWaalsContact C-N 3.28Å; H677-E679 IonicContact CE1-OE1 2.99Å; H677-E679 PolarHBondContact CE1-OE1 2.91Å; H677-E679 IonicContact CE1-OE2 3.63Å; H677-E679 PolarHBondContact CE1-OE2 3.37Å; H677-E679 IonicContact CG-OE2 3.42Å; H677-E679 VanDerWaalsContact ND1-CD 3.3Å; H677-E679 PolarHBondContact ND1-N 3.24Å; H677-E679 IonicContact ND1-OE1 2.67Å; H677-E679 IonicContact ND1-OE2 3.48Å; H677-E679 PolarHBondContact ND1-OE2 3.31Å; H677-E679 IonicContact NE2-OE2 3.95Å; H677-E679 PolarHBondContact O-N 3Å; E679-Y683 VanDerWaalsContact O-CB 3.27Å; E679-Y683 WeakPolarHBondContact O-CB 3.28Å; E679-Y683 PolarHBondContact O-N 2.8Å
680	I	87.7	Confident	84.7	Confident	5 Å²	5	30.6 Å²	30.6	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-73.4	-39.6	173.7	-59.3	165.3	0	0	0	109.7	I546 I653 I670 V672 H677 K678 D682 Y683 V684 W716	I546-I680 HydrophobicContact CD1-CD1 3.55Å; I546-I680 VanDerWaalsContact CD1-CD1 3.47Å; I546-I680 HydrophobicContact CD1-CG1 3.88Å; I546-I680 HydrophobicContact CD1-CG2 4.17Å; I546-I680 HydrophobicContact CG2-CD1 4.23Å; I653-I680 HydrophobicContact CD1-CD1 3.87Å; I653-I680 HydrophobicContact CD1-CG1 3.64Å; I653-I680 HydrophobicContact CG1-CG1 4.44Å; I670-I680 HydrophobicContact CD1-CG2 3.68Å; V672-I680 HydrophobicContact CG2-CD1 4.36Å; V672-I680 HydrophobicContact CG2-CG2 3.97Å; H677-I680 HydrophobicContact CB-CD1 4.16Å; H677-I680 HydrophobicContact CB-CG1 4.27Å; H677-I680 WeakPolarHBondContact O-CB 3.31Å; H677-I680 PolarHBondContact O-N 2.95Å; H677-I680 VanDerWaalsContact O-N 3.07Å; K678-I680 VanDerWaalsContact C-N 3.29Å; K678-I680 PolarHBondContact O-N 3.18Å; I680-D682 VanDerWaalsContact C-N 3.34Å; I680-Y683 WeakPolarHBondContact O-CB 3.25Å; I680-Y683 PolarHBondContact O-N 3.36Å; I680-V684 WeakPolarHBondContact O-CG2 3.32Å; I680-V684 PolarHBondContact O-N 2.98Å; I680-W716 HydrophobicContact CG2-CH2 4.13Å
681	V	87.3	Confident	83.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.7	-46.5	176.3	-173.7	0	0	0	0	110.3	H677 K678 Y683 V684 I685 W707 P708 C711 W716	H677-V681 PolarHBondContact O-N 3.15Å; K678-V681 CarbonylContact O-C 3.54Å; K678-V681 WeakPolarHBondContact O-CA 3.36Å; K678-V681 WeakPolarHBondContact O-CB 3.44Å; K678-V681 PolarHBondContact O-N 3.13Å; V681-Y683 VanDerWaalsContact C-N 3.29Å; V681-Y683 PolarHBondContact O-N 3.03Å; V681-V684 PolarHBondContact O-N 3.2Å; V681-V684 VanDerWaalsContact O-N 3.12Å; V681-I685 HydrophobicContact CG1-CD1 4Å; V681-I685 VanDerWaalsContact O-CG1 3.25Å; V681-I685 WeakPolarHBondContact O-CG1 3.34Å; V681-I685 PolarHBondContact O-N 3.18Å; V681-W707 HydrophobicContact CB-CZ2 4.43Å; V681-W707 HydrophobicContact CG1-CH2 4.37Å; V681-W707 HydrophobicContact CG1-CZ2 3.87Å; V681-W707 HydrophobicContact CG2-CH2 3.87Å; V681-W707 HydrophobicContact CG2-CZ2 3.83Å; V681-W707 HydrophobicContact CG2-CZ3 4.42Å; V681-P708 HydrophobicContact CG2-CG 4.28Å; V681-C711 HydrophobicContact CB-CB 4.32Å; V681-C711 HydrophobicContact CG1-CB 3.63Å; V681-W716 HydrophobicContact CG2-CZ2 4.33Å
682	D	85.6	Confident	82.7	Confident	41.3333 Å²	41.3333	34 Å²	34	22%	0.221	17%	0.167	C	C	.	.	H	α-helix	trans	-61.9	-39.1	175.1	-65.7	-17.5	0	0	0	111.2	K678 I680 V684 I685 N686 M1147	K678-D682 WeakPolarHBondContact CE-OD2 3.42Å; K678-D682 PolarHBondContact O-N 3.1Å; I680-D682 VanDerWaalsContact C-N 3.34Å; D682-V684 PolarHBondContact O-N 3.12Å; D682-I685 PolarHBondContact O-N 3.32Å; D682-N686 VanDerWaalsContact O-CB 3.28Å; D682-N686 WeakPolarHBondContact O-CB 3.4Å; D682-N686 VanDerWaalsContact O-CG 3.26Å; D682-N686 PolarHBondContact O-N 3.1Å; D682-N686 PolarHBondContact O-ND2 2.9Å; D682-M1147 HydrophobicContact CB-CE 4.25Å
683	Y	86.6	Confident	82.1	Confident	4.66667 Å²	4.66667	40.2 Å²	40.2	2%	0.018	21%	0.207	C	C	.	.	H	α-helix	trans	-59.7	-45.4	173.3	175.7	-104.1	0	0	0	112.5	L544 V657 L660 Y661 I670 E679 I680 V681 N686 Y687	L544-Y683 HydrophobicContact CD2-CE1 4.1Å; V657-Y683 HydrophobicContact CG1-CD2 3.77Å; V657-Y683 HydrophobicContact CG1-CG 4.34Å; V657-Y683 HydrophobicContact CG2-CG 4.46Å; L660-Y683 HydrophobicContact CB-CE2 4.09Å; L660-Y683 HydrophobicContact CD1-CE1 4.31Å; L660-Y683 HydrophobicContact CD1-CE2 4.45Å; Y661-Y683 HydrophobicContact CD1-CD2 4.3Å; Y661-Y683 HydrophobicContact CD1-CE2 4.2Å; Y661-Y683 HydrophobicContact CD2-CD2 4.37Å; Y661-Y683 AromaticContact CE1-CD2 3.73Å; Y661-Y683 HydrophobicContact CE1-CD2 3.85Å; Y661-Y683 AromaticContact CE1-CE2 3.84Å; Y661-Y683 HydrophobicContact CE1-CE2 3.84Å; Y661-Y683 AromaticContact CE2-CD2 3.91Å; Y661-Y683 HydrophobicContact CE2-CD2 4.01Å; Y661-Y683 HydrophobicContact CE2-CE2 4.4Å; Y661-Y683 HydrophobicContact CG-CE2 4.37Å; Y661-Y683 AromaticContact CZ-CD2 3.55Å; Y661-Y683 VanDerWaalsContact CZ-CD2 3.46Å; Y661-Y683 AromaticContact CZ-CE2 3.99Å; Y661-Y683 WeakPolarHBondContact OH-CA 3.43Å; Y661-Y683 WeakPolarHBondContact OH-CD2 3.46Å; I670-Y683 HydrophobicContact CD1-CD1 4.14Å; I670-Y683 HydrophobicContact CD1-CE1 4.01Å; E679-Y683 VanDerWaalsContact O-CB 3.27Å; E679-Y683 WeakPolarHBondContact O-CB 3.28Å; E679-Y683 PolarHBondContact O-N 2.8Å; I680-Y683 WeakPolarHBondContact O-CB 3.25Å; I680-Y683 PolarHBondContact O-N 3.36Å; V681-Y683 VanDerWaalsContact C-N 3.29Å; V681-Y683 PolarHBondContact O-N 3.03Å; Y683-N686 PolarHBondContact O-N 2.9Å; Y683-Y687 HydrophobicContact CE1-CD2 4.27Å; Y683-Y687 HydrophobicContact CE2-CD2 4.44Å; Y683-Y687 AromaticContact CZ-CD2 3.87Å; Y683-Y687 VanDerWaalsContact O-CB 3.23Å; Y683-Y687 WeakPolarHBondContact O-CB 3.46Å; Y683-Y687 PolarHBondContact O-N 2.93Å; Y683-Y687 WeakPolarHBondContact OH-CD2 3.27Å
684	V	87.4	Confident	81.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.9	-42.6	178.7	169.9	0	0	0	0	111.9	I670 I680 V681 D682 N686 Y687 R688 L694 A696 W716	I670-V684 HydrophobicContact CD1-CG2 3.93Å; I670-V684 HydrophobicContact CG2-CG2 3.96Å; I680-V684 WeakPolarHBondContact O-CG2 3.32Å; I680-V684 PolarHBondContact O-N 2.98Å; V681-V684 PolarHBondContact O-N 3.2Å; V681-V684 VanDerWaalsContact O-N 3.12Å; D682-V684 PolarHBondContact O-N 3.12Å; V684-N686 PolarHBondContact O-N 3.44Å; V684-Y687 PolarHBondContact O-N 3.2Å; V684-R688 HydrophobicContact CG1-CG 4.5Å; V684-R688 WeakPolarHBondContact O-CB 3.38Å; V684-R688 WeakPolarHBondContact O-CG 3.45Å; V684-R688 PolarHBondContact O-N 3.09Å; V684-L694 HydrophobicContact CB-CD2 4.4Å; V684-L694 HydrophobicContact CG1-CD2 4.24Å; V684-L694 HydrophobicContact CG2-CD2 4Å; V684-A696 HydrophobicContact CG1-CB 3.67Å; V684-A696 HydrophobicContact CG2-CB 4.26Å; V684-W716 HydrophobicContact CB-CH2 4.5Å; V684-W716 HydrophobicContact CB-CZ2 3.73Å; V684-W716 HydrophobicContact CG1-CZ2 4.03Å; V684-W716 HydrophobicContact CG2-CH2 3.82Å; V684-W716 HydrophobicContact CG2-CZ2 3.42Å; V684-W716 VanDerWaalsContact CG2-CZ2 3.44Å
685	I	84.1	Confident	82	Confident	61 Å²	61	42.1 Å²	42.1	31%	0.313	22%	0.215	S	C	.	.	H	α-helix	trans	-60.1	-51.1	177.1	-68.4	166.3	0	0	0	109.5	V681 D682 Y687 R688 T689	V681-I685 HydrophobicContact CG1-CD1 4Å; V681-I685 VanDerWaalsContact O-CG1 3.25Å; V681-I685 WeakPolarHBondContact O-CG1 3.34Å; V681-I685 PolarHBondContact O-N 3.18Å; D682-I685 PolarHBondContact O-N 3.32Å; I685-Y687 VanDerWaalsContact C-N 3.28Å; I685-Y687 PolarHBondContact O-N 2.88Å; I685-R688 PolarHBondContact O-N 3.35Å; I685-R688 VanDerWaalsContact O-N 3.11Å; I685-T689 VanDerWaalsContact O-CB 3.32Å; I685-T689 WeakPolarHBondContact O-CB 3.48Å; I685-T689 PolarHBondContact O-N 3.2Å; I685-T689 VanDerWaalsContact O-N 3.09Å; I685-T689 PolarHBondContact O-OG1 3.04Å
686	N	81.7	Confident	82.3	Confident	46.3333 Å²	46.3333	41.7 Å²	41.7	25%	0.248	21%	0.213	C	C	.	.	H	α-helix	trans	-64.1	-40.7	178.1	-71	-23	0	0	0	111.9	Y661 D682 Y683 V684 R688 T689 Y690	Y661-N686 HydrophobicContact CE1-CB 4.25Å; Y661-N686 WeakPolarHBondContact OH-CB 3.45Å; Y661-N686 PolarHBondContact OH-ND2 3.21Å; Y661-N686 VanDerWaalsContact OH-ND2 3.1Å; D682-N686 VanDerWaalsContact O-CB 3.28Å; D682-N686 WeakPolarHBondContact O-CB 3.4Å; D682-N686 VanDerWaalsContact O-CG 3.26Å; D682-N686 PolarHBondContact O-N 3.1Å; D682-N686 PolarHBondContact O-ND2 2.9Å; Y683-N686 PolarHBondContact O-N 2.9Å; V684-N686 PolarHBondContact O-N 3.44Å; N686-R688 VanDerWaalsContact C-N 3.31Å; N686-R688 PolarHBondContact O-N 3.18Å; N686-T689 PolarHBondContact O-N 3.19Å; N686-T689 VanDerWaalsContact O-N 3.15Å; N686-Y690 HydrophobicContact CB-CD2 4.19Å; N686-Y690 HydrophobicContact CB-CE2 4.26Å; N686-Y690 WeakPolarHBondContact O-CB 3.36Å; N686-Y690 WeakPolarHBondContact O-CD2 3.3Å; N686-Y690 PolarHBondContact O-N 3.16Å
687	Y	83.7	Confident	82.5	Confident	7.33333 Å²	7.33333	41.3 Å²	41.3	3%	0.029	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-46.5	177.1	-170.9	-72.5	0	0	0	111.2	Q666 F667 Y683 V684 I685 T689 Y690 I691 G692 L694	Q666-Y687 VanDerWaalsContact CA-OH 3.31Å; Q666-Y687 WeakPolarHBondContact CA-OH 3.43Å; Q666-Y687 WeakPolarHBondContact CB-OH 3.38Å; F667-Y687 PolarHBondContact N-OH 3Å; F667-Y687 PolarHBondContact O-OH 2.9Å; F667-Y687 VanDerWaalsContact O-OH 3.12Å; Y683-Y687 HydrophobicContact CE1-CD2 4.27Å; Y683-Y687 HydrophobicContact CE2-CD2 4.44Å; Y683-Y687 AromaticContact CZ-CD2 3.87Å; Y683-Y687 VanDerWaalsContact O-CB 3.23Å; Y683-Y687 WeakPolarHBondContact O-CB 3.46Å; Y683-Y687 PolarHBondContact O-N 2.93Å; Y683-Y687 WeakPolarHBondContact OH-CD2 3.27Å; V684-Y687 PolarHBondContact O-N 3.2Å; I685-Y687 VanDerWaalsContact C-N 3.28Å; I685-Y687 PolarHBondContact O-N 2.88Å; Y687-T689 VanDerWaalsContact C-N 3.29Å; Y687-T689 PolarHBondContact O-N 3.32Å; Y687-Y690 PolarHBondContact O-N 3.09Å; Y687-I691 HydrophobicContact CD1-CB 4Å; Y687-I691 HydrophobicContact CD1-CG2 4.32Å; Y687-I691 HydrophobicContact CD2-CB 4.15Å; Y687-I691 HydrophobicContact CD2-CD1 3.51Å; Y687-I691 VanDerWaalsContact CD2-CD1 3.47Å; Y687-I691 HydrophobicContact CD2-CG1 4.27Å; Y687-I691 HydrophobicContact CD2-CG2 4.21Å; Y687-I691 HydrophobicContact CE1-CB 3.96Å; Y687-I691 HydrophobicContact CE1-CG2 3.76Å; Y687-I691 HydrophobicContact CE2-CB 4.09Å; Y687-I691 HydrophobicContact CE2-CD1 3.71Å; Y687-I691 HydrophobicContact CE2-CG1 4.42Å; Y687-I691 HydrophobicContact CE2-CG2 3.74Å; Y687-I691 HydrophobicContact CG-CB 4.1Å; Y687-I691 HydrophobicContact CG-CD1 4.11Å; Y687-I691 HydrophobicContact CG-CG1 4.16Å; Y687-I691 HydrophobicContact CG-CG2 4.29Å; Y687-I691 VanDerWaalsContact CZ-CG2 3.46Å; Y687-I691 VanDerWaalsContact O-CA 3.25Å; Y687-I691 WeakPolarHBondContact O-CA 3.41Å; Y687-I691 WeakPolarHBondContact O-CB 3.42Å; Y687-I691 PolarHBondContact O-N 3.15Å; Y687-G692 WeakPolarHBondContact CD1-O 3.29Å; Y687-G692 WeakPolarHBondContact CE1-O 3.43Å; Y687-G692 PolarHBondContact O-N 3.06Å; Y687-L694 HydrophobicContact CD1-CB 3.54Å; Y687-L694 VanDerWaalsContact CD1-CB 3.48Å; Y687-L694 HydrophobicContact CD1-CD1 4.24Å; Y687-L694 HydrophobicContact CD1-CD2 3.7Å; Y687-L694 HydrophobicContact CD1-CG 4.06Å; Y687-L694 HydrophobicContact CD2-CD2 4.44Å; Y687-L694 HydrophobicContact CE1-CB 3.78Å; Y687-L694 HydrophobicContact CE1-CD1 4.12Å; Y687-L694 HydrophobicContact CE1-CD2 4.3Å; Y687-L694 HydrophobicContact CE1-CG 4.29Å; Y687-L694 HydrophobicContact CG-CB 4.4Å; Y687-L694 HydrophobicContact CG-CD2 3.78Å
688	R	82.7	Confident	82.6	Confident	74.3333 Å²	74.3333	39.1 Å²	39.1	28%	0.281	20%	0.2	S	C	.	.	H	α-helix	trans	-64.6	-35	177.8	-74.3	175.6	174.3	169.7	-4.6	113.1	V684 I685 N686 G692 L694 A696 D714 G715	V684-R688 HydrophobicContact CG1-CG 4.5Å; V684-R688 WeakPolarHBondContact O-CB 3.38Å; V684-R688 WeakPolarHBondContact O-CG 3.45Å; V684-R688 PolarHBondContact O-N 3.09Å; I685-R688 PolarHBondContact O-N 3.35Å; I685-R688 VanDerWaalsContact O-N 3.11Å; N686-R688 VanDerWaalsContact C-N 3.31Å; N686-R688 PolarHBondContact O-N 3.18Å; R688-G692 WeakPolarHBondContact CA-O 3.23Å; R688-L694 HydrophobicContact CG-CB 4.07Å; R688-L694 VanDerWaalsContact CZ-O 3.29Å; R688-L694 PolarHBondContact NE-O 2.88Å; R688-L694 PolarHBondContact NH2-O 2.91Å; R688-A696 VanDerWaalsContact NH2-CB 3.3Å; R688-A696 VanDerWaalsContact NH2-N 3.19Å; R688-D714 PolarHBondContact NH1-O 2.78Å; R688-G715 VanDerWaalsContact NH1-C 3.32Å; R688-G715 PolarHBondContact NH1-O 3.09Å; R688-G715 PolarHBondContact NH2-O 3.29Å
689	T	75.4	Confident	82.6	Confident	62.6667 Å²	62.6667	35.1 Å²	35.1	38%	0.384	18%	0.183	S	C	.	.	H	α-helix	trans	-75	-37.3	-179.5	-53.4	0	0	0	0	111.8	I685 N686 Y687 Q1280	I685-T689 VanDerWaalsContact O-CB 3.32Å; I685-T689 WeakPolarHBondContact O-CB 3.48Å; I685-T689 PolarHBondContact O-N 3.2Å; I685-T689 VanDerWaalsContact O-N 3.09Å; I685-T689 PolarHBondContact O-OG1 3.04Å; N686-T689 PolarHBondContact O-N 3.19Å; N686-T689 VanDerWaalsContact O-N 3.15Å; Y687-T689 VanDerWaalsContact C-N 3.29Å; Y687-T689 PolarHBondContact O-N 3.32Å; T689-Q1280 HydrophobicContact CG2-CG 4.4Å; T689-Q1280 PolarHBondContact OG1-NE2 2.83Å; T689-Q1280 VanDerWaalsContact OG1-NE2 3.1Å
690	Y	70.3	Confident	82.5	Confident	127 Å²	127	32.4 Å²	32.4	50%	0.498	17%	0.171	S	C	.	.	H	α-helix	trans	-115.3	-22	-167.8	-61.4	-67.5	0	0	0	115.7	N686 Y687 I1145 P1146	N686-Y690 HydrophobicContact CB-CD2 4.19Å; N686-Y690 HydrophobicContact CB-CE2 4.26Å; N686-Y690 WeakPolarHBondContact O-CB 3.36Å; N686-Y690 WeakPolarHBondContact O-CD2 3.3Å; N686-Y690 PolarHBondContact O-N 3.16Å; Y687-Y690 PolarHBondContact O-N 3.09Å; Y690-I1145 HydrophobicContact CD1-CB 4.47Å; Y690-I1145 HydrophobicContact CD1-CG1 4.42Å; Y690-I1145 HydrophobicContact CD1-CG2 3.62Å; Y690-I1145 HydrophobicContact CD2-CB 4.23Å; Y690-I1145 HydrophobicContact CD2-CG2 2.83Å; Y690-I1145 HydrophobicContact CE1-CG2 3.77Å; Y690-I1145 HydrophobicContact CE2-CB 4.4Å; Y690-I1145 HydrophobicContact CE2-CG2 3Å; Y690-I1145 HydrophobicContact CG-CB 4.25Å; Y690-I1145 HydrophobicContact CG-CD1 4.32Å; Y690-I1145 HydrophobicContact CG-CG1 4.22Å; Y690-I1145 HydrophobicContact CG-CG2 3.16Å; Y690-I1145 VanDerWaalsContact CZ-CG2 3.49Å; Y690-P1146 HydrophobicContact CE1-CG 4.07Å; Y690-P1146 VanDerWaalsContact CZ-O 3.3Å; Y690-P1146 WeakPolarHBondContact OH-CG 3.47Å; Y690-P1146 PolarHBondContact OH-O 3.14Å
691	I	71.3	Confident	81.9	Confident	49.6667 Å²	49.6667	32.5 Å²	32.5	26%	0.255	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-48.1	-172.9	-58.5	-178.1	0	0	0	111.6	Q666 Y687	Q666-I691 HydrophobicContact CG-CG2 4.06Å; Y687-I691 HydrophobicContact CD1-CB 4Å; Y687-I691 HydrophobicContact CD1-CG2 4.32Å; Y687-I691 HydrophobicContact CD2-CB 4.15Å; Y687-I691 HydrophobicContact CD2-CD1 3.51Å; Y687-I691 VanDerWaalsContact CD2-CD1 3.47Å; Y687-I691 HydrophobicContact CD2-CG1 4.27Å; Y687-I691 HydrophobicContact CD2-CG2 4.21Å; Y687-I691 HydrophobicContact CE1-CB 3.96Å; Y687-I691 HydrophobicContact CE1-CG2 3.76Å; Y687-I691 HydrophobicContact CE2-CB 4.09Å; Y687-I691 HydrophobicContact CE2-CD1 3.71Å; Y687-I691 HydrophobicContact CE2-CG1 4.42Å; Y687-I691 HydrophobicContact CE2-CG2 3.74Å; Y687-I691 HydrophobicContact CG-CB 4.1Å; Y687-I691 HydrophobicContact CG-CD1 4.11Å; Y687-I691 HydrophobicContact CG-CG1 4.16Å; Y687-I691 HydrophobicContact CG-CG2 4.29Å; Y687-I691 VanDerWaalsContact CZ-CG2 3.46Å; Y687-I691 VanDerWaalsContact O-CA 3.25Å; Y687-I691 WeakPolarHBondContact O-CA 3.41Å; Y687-I691 WeakPolarHBondContact O-CB 3.42Å; Y687-I691 PolarHBondContact O-N 3.15Å
692	G	71	Confident	81.1	Confident	23 Å²	23	33.2 Å²	33.2	24%	0.237	18%	0.176	C	C	.	.			trans	153.7	-177.9	-178.3	0	0	0	0	0	113.4	Y687 R688 L694	Y687-G692 WeakPolarHBondContact CD1-O 3.29Å; Y687-G692 WeakPolarHBondContact CE1-O 3.43Å; Y687-G692 PolarHBondContact O-N 3.06Å; R688-G692 WeakPolarHBondContact CA-O 3.23Å; G692-L694 PolarHBondContact O-N 3.04Å
693	P	78.1	Confident	80.1	Confident	129.333 Å²	129.333	33.1 Å²	33.1	84%	0.84	18%	0.184	S	C	*	.			trans	-61.3	131.4	-179.5	26.6	-33.9	0	0	0	110.6
694	L	83.8	Confident	79.2	Confident	7 Å²	7	36 Å²	36	4%	0.037	20%	0.198	C	C	.	.			trans	-132	122.1	179	178.7	66.7	0	0	0	109	F667 I670 V684 Y687 R688 G692 A696	F667-L694 HydrophobicContact CB-CD1 3.95Å; F667-L694 WeakPolarHBondContact O-CD1 3.33Å; I670-L694 HydrophobicContact CB-CD1 4.4Å; I670-L694 HydrophobicContact CB-CD2 4.42Å; I670-L694 HydrophobicContact CD1-CD1 4.2Å; I670-L694 HydrophobicContact CD1-CD2 3.32Å; I670-L694 HydrophobicContact CD1-CG 4.17Å; I670-L694 HydrophobicContact CG1-CD1 3.73Å; I670-L694 HydrophobicContact CG1-CD2 3.59Å; I670-L694 HydrophobicContact CG1-CG 3.88Å; I670-L694 HydrophobicContact CG2-CD1 4.31Å; I670-L694 HydrophobicContact CG2-CD2 3.88Å; I670-L694 HydrophobicContact CG2-CG 4.04Å; V684-L694 HydrophobicContact CB-CD2 4.4Å; V684-L694 HydrophobicContact CG1-CD2 4.24Å; V684-L694 HydrophobicContact CG2-CD2 4Å; Y687-L694 HydrophobicContact CD1-CB 3.54Å; Y687-L694 VanDerWaalsContact CD1-CB 3.48Å; Y687-L694 HydrophobicContact CD1-CD1 4.24Å; Y687-L694 HydrophobicContact CD1-CD2 3.7Å; Y687-L694 HydrophobicContact CD1-CG 4.06Å; Y687-L694 HydrophobicContact CD2-CD2 4.44Å; Y687-L694 HydrophobicContact CE1-CB 3.78Å; Y687-L694 HydrophobicContact CE1-CD1 4.12Å; Y687-L694 HydrophobicContact CE1-CD2 4.3Å; Y687-L694 HydrophobicContact CE1-CG 4.29Å; Y687-L694 HydrophobicContact CG-CB 4.4Å; Y687-L694 HydrophobicContact CG-CD2 3.78Å; R688-L694 HydrophobicContact CG-CB 4.07Å; R688-L694 VanDerWaalsContact CZ-O 3.29Å; R688-L694 PolarHBondContact NE-O 2.88Å; R688-L694 PolarHBondContact NH2-O 2.91Å; G692-L694 PolarHBondContact O-N 3.04Å; L694-A696 PolarHBondContact O-N 3.15Å
695	K	84.9	Confident	78.1	Confident	35.3333 Å²	35.3333	40.9 Å²	40.9	15%	0.154	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	108.3	175	-169.8	174	-174.4	173.2	0	109	D668 K669 I670 I697 I717 E732 P733	D668-K695 WeakPolarHBondContact O-CB 3.45Å; D668-K695 PolarHBondContact O-N 3.13Å; D668-K695 VanDerWaalsContact O-N 3.12Å; K669-K695 CarbonylContact C-O 3.55Å; K669-K695 WeakPolarHBondContact CA-O 3.36Å; K669-K695 HydrophobicContact CG-CB 4.18Å; K669-K695 HydrophobicContact CG-CD 4.45Å; I670-K695 PolarHBondContact N-O 3.09Å; K695-I697 HydrophobicContact CD-CD1 4.42Å; K695-I697 HydrophobicContact CG-CD1 4.24Å; K695-I697 HydrophobicContact CG-CG1 4.36Å; K695-I717 HydrophobicContact CG-CD1 4.21Å; K695-E732 PolarHBondContact NZ-O 3.42Å; K695-E732 VanDerWaalsContact NZ-O 3.16Å; K695-P733 PolarHBondContact NZ-O 3.38Å
696	A	88.1	Confident	77.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	122.8	-177.3	0	0	0	0	0	110.9	I670 V684 R688 L694 W716 I717	I670-A696 HydrophobicContact CG2-CB 3.64Å; V684-A696 HydrophobicContact CG1-CB 3.67Å; V684-A696 HydrophobicContact CG2-CB 4.26Å; R688-A696 VanDerWaalsContact NH2-CB 3.3Å; R688-A696 VanDerWaalsContact NH2-N 3.19Å; L694-A696 PolarHBondContact O-N 3.15Å; A696-W716 HydrophobicContact CB-CD2 3.64Å; A696-W716 HydrophobicContact CB-CE3 3.7Å; A696-W716 HydrophobicContact CB-CG 4.21Å; A696-W716 HydrophobicContact CB-CH2 4.21Å; A696-W716 HydrophobicContact CB-CZ2 4.15Å; A696-W716 HydrophobicContact CB-CZ3 3.99Å; A696-W716 WeakPolarHBondContact O-CA 3.37Å; A696-I717 PolarHBondContact O-N 3.23Å
697	I	88.5	Confident	77.1	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	126.8	-172.9	-62.3	162.4	0	0	0	108.8	I670 V671 V672 K695 I717 F719 I726 I730	I670-I697 PolarHBondContact O-N 3.14Å; V671-I697 WeakPolarHBondContact CA-O 3.35Å; V671-I697 HydrophobicContact CG1-CG2 4.36Å; V671-I697 HydrophobicContact CG2-CB 4.32Å; V671-I697 HydrophobicContact CG2-CD1 4.29Å; V672-I697 PolarHBondContact N-O 3.11Å; K695-I697 HydrophobicContact CD-CD1 4.42Å; K695-I697 HydrophobicContact CG-CD1 4.24Å; K695-I697 HydrophobicContact CG-CG1 4.36Å; I697-I717 WeakPolarHBondContact CA-O 3.23Å; I697-I717 HydrophobicContact CG1-CB 4.34Å; I697-I717 HydrophobicContact CG1-CD1 4.33Å; I697-F719 HydrophobicContact CB-CE2 4.49Å; I697-F719 HydrophobicContact CG1-CE2 4.39Å; I697-F719 HydrophobicContact CG2-CD2 3.6Å; I697-F719 HydrophobicContact CG2-CE2 3.5Å; I697-F719 VanDerWaalsContact CG2-CE2 3.44Å; I697-I726 HydrophobicContact CG2-CD1 4.35Å; I697-I730 HydrophobicContact CD1-CB 4.38Å; I697-I730 HydrophobicContact CD1-CG1 3.93Å; I697-I730 HydrophobicContact CD1-CG2 4.18Å; I697-I730 HydrophobicContact CG2-CD1 4.24Å; I697-I730 HydrophobicContact CG2-CG1 4.32Å
698	W	87.9	Confident	76.7	Confident	2.66667 Å²	2.66667	39.5 Å²	39.5	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	114.7	177.2	177.5	39.7	0	0	0	111	G674 C676 N700 V706 W707 W716 I717 E718 F719	G674-W698 PolarHBondContact O-NE1 3.21Å; C676-W698 HydrophobicContact CB-CD2 4.35Å; C676-W698 HydrophobicContact CB-CG 4.34Å; W698-N700 HydrophobicContact CD2-CB 4.24Å; W698-N700 HydrophobicContact CE3-CB 4.39Å; W698-N700 HydrophobicContact CH2-CB 3.98Å; W698-N700 HydrophobicContact CZ2-CB 3.81Å; W698-N700 HydrophobicContact CZ3-CB 4.25Å; W698-N700 PolarHBondContact O-N 3.05Å; W698-V706 WeakPolarHBondContact CH2-O 3.36Å; W698-V706 WeakPolarHBondContact CZ2-O 3.34Å; W698-W707 HydrophobicContact CB-CZ3 4.41Å; W698-W707 AromaticContact CD2-CE3 3.84Å; W698-W707 HydrophobicContact CD2-CE3 3.93Å; W698-W707 AromaticContact CD2-CZ3 3.78Å; W698-W707 HydrophobicContact CD2-CZ3 3.78Å; W698-W707 AromaticContact CE3-CE3 3.39Å; W698-W707 HydrophobicContact CE3-CE3 3.39Å; W698-W707 VanDerWaalsContact CE3-CE3 3.45Å; W698-W707 AromaticContact CE3-CZ3 3.49Å; W698-W707 HydrophobicContact CE3-CZ3 3.49Å; W698-W707 VanDerWaalsContact CE3-CZ3 3.44Å; W698-W707 HydrophobicContact CG-CZ3 4.22Å; W698-W707 HydrophobicContact CH2-CB 4.21Å; W698-W707 AromaticContact CH2-CE3 3.88Å; W698-W707 HydrophobicContact CH2-CE3 3.93Å; W698-W707 HydrophobicContact CZ2-CE3 4.3Å; W698-W707 HydrophobicContact CZ3-CB 4.33Å; W698-W707 HydrophobicContact CZ3-CD2 4.34Å; W698-W707 AromaticContact CZ3-CE3 3.41Å; W698-W707 HydrophobicContact CZ3-CE3 3.41Å; W698-W707 VanDerWaalsContact CZ3-CE3 3.42Å; W698-W707 AromaticContact CZ3-CZ3 3.94Å; W698-W707 HydrophobicContact CZ3-CZ3 4.03Å; W698-W716 HydrophobicContact CB-CE3 3.8Å; W698-W716 HydrophobicContact CB-CZ3 4.08Å; W698-I717 PolarHBondContact N-O 3.07Å; W698-E718 HydrophobicContact CD2-CG 4.45Å; W698-E718 HydrophobicContact CE3-CB 4.25Å; W698-E718 HydrophobicContact CE3-CG 3.72Å; W698-E718 VanDerWaalsContact CZ3-CD 3.44Å; W698-E718 HydrophobicContact CZ3-CG 3.98Å; W698-E718 VanDerWaalsContact CZ3-OE1 3.3Å; W698-E718 WeakPolarHBondContact CZ3-OE1 3.41Å; W698-E718 CarbonylContact O-C 3.39Å; W698-E718 WeakPolarHBondContact O-CA 3.3Å; W698-F719 PolarHBondContact O-N 3.17Å
699	G	83.9	Confident	76	Confident	2.33333 Å²	2.33333	44.2 Å²	44.2	2%	0.024	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	91.1	170.5	0	0	0	0	0	110.9	V672 G674 L701 F719	V672-G699 PolarHBondContact O-N 3.16Å; G674-G699 PolarHBondContact N-O 3Å; G674-G699 VanDerWaalsContact N-O 3.1Å; G699-L701 WeakPolarHBondContact O-CG 3.31Å; G699-L701 PolarHBondContact O-N 3.16Å; G699-L701 VanDerWaalsContact O-N 3.11Å; G699-F719 CarbonylContact C-O 3.55Å
700	N	81.4	Confident	75.6	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	91.1	172.9	-178.4	-4	0	0	0	110.6	W698 S702 G703 E704 E718 F719 K720 G721	W698-N700 HydrophobicContact CD2-CB 4.24Å; W698-N700 HydrophobicContact CE3-CB 4.39Å; W698-N700 HydrophobicContact CH2-CB 3.98Å; W698-N700 HydrophobicContact CZ2-CB 3.81Å; W698-N700 HydrophobicContact CZ3-CB 4.25Å; W698-N700 PolarHBondContact O-N 3.05Å; N700-S702 VanDerWaalsContact C-N 3.33Å; N700-S702 PolarHBondContact O-N 2.78Å; N700-S702 PolarHBondContact OD1-N 3.11Å; N700-S702 PolarHBondContact OD1-OG 3.18Å; N700-G703 PolarHBondContact O-N 2.93Å; N700-G703 PolarHBondContact OD1-N 3.06Å; N700-G703 VanDerWaalsContact OD1-N 3.16Å; N700-E704 PolarHBondContact ND2-O 3.26Å; N700-E704 PolarHBondContact OD1-O 3.11Å; N700-E718 HydrophobicContact CB-CG 4.17Å; N700-E718 WeakPolarHBondContact CB-OE1 3.39Å; N700-E718 PolarHBondContact ND2-OE1 3.28Å; N700-F719 CarbonylContact C-O 3.56Å; N700-F719 WeakPolarHBondContact CA-O 3.37Å; N700-F719 PolarHBondContact N-O 3.16Å; N700-K720 HydrophobicContact CB-CG 4.27Å; N700-K720 CarbonylContact O-C 3.58Å; N700-K720 VanDerWaalsContact O-CA 3.32Å; N700-K720 WeakPolarHBondContact O-CA 3.44Å; N700-G721 PolarHBondContact O-N 3.29Å
701	L	77	Confident	75.4	Confident	6.66667 Å²	6.66667	39.4 Å²	39.4	4%	0.035	24%	0.237	C	C	.	.	S	Bend	trans	-78.1	-17.8	-177.2	-56.3	-178.9	0	0	0	113.7	L568 G569 L572 F673 G699 G703	L568-L701 HydrophobicContact CB-CD1 4.22Å; L568-L701 HydrophobicContact CD2-CD1 4.32Å; L568-L701 HydrophobicContact CD2-CD2 4.07Å; L568-L701 HydrophobicContact CG-CD1 4.22Å; L568-L701 HydrophobicContact CG-CD2 4.4Å; G569-L701 VanDerWaalsContact CA-CD1 3.44Å; G569-L701 VanDerWaalsContact N-CD1 3.32Å; L572-L701 HydrophobicContact CD1-CD1 4.33Å; L572-L701 HydrophobicContact CD1-CD2 3.77Å; F673-L701 HydrophobicContact CB-CD1 4.45Å; G699-L701 WeakPolarHBondContact O-CG 3.31Å; G699-L701 PolarHBondContact O-N 3.16Å; G699-L701 VanDerWaalsContact O-N 3.11Å; L701-G703 VanDerWaalsContact C-N 3.34Å
702	S	69.3	Low	75.5	Confident	14.3333 Å²	14.3333	39.7 Å²	39.7	10%	0.1	24%	0.244	C	C	.	.	S	Bend	trans	-76.6	-29.8	176.8	63.6	0	0	0	0	112	S550 Y552 N700 E704 V706	S550-S702 WeakPolarHBondContact OG-CB 3.26Å; Y552-S702 WeakPolarHBondContact O-CB 3.45Å; N700-S702 VanDerWaalsContact C-N 3.33Å; N700-S702 PolarHBondContact O-N 2.78Å; N700-S702 PolarHBondContact OD1-N 3.11Å; N700-S702 PolarHBondContact OD1-OG 3.18Å; S702-E704 PolarHBondContact O-N 3.02Å; S702-E704 PolarHBondContact OG-N 3.17Å; S702-E704 VanDerWaalsContact OG-N 3.17Å; S702-E704 PolarHBondContact OG-O 3.17Å; S702-V706 WeakPolarHBondContact OG-CG2 3.41Å
703	G	64.7	Low	75.6	Confident	39 Å²	39	41.8 Å²	41.8	40%	0.402	25%	0.246	S	C	.	.	S	Bend	trans	74.9	-1	-171.8	0	0	0	0	0	113.8	N700 L701	N700-G703 PolarHBondContact O-N 2.93Å; N700-G703 PolarHBondContact OD1-N 3.06Å; N700-G703 VanDerWaalsContact OD1-N 3.16Å; L701-G703 VanDerWaalsContact C-N 3.34Å
704	E	66.9	Low	75.3	Confident	66 Å²	66	41 Å²	41	31%	0.308	24%	0.235	S	C	.	.	S	Bend	trans	-94.5	145.9	173.2	-62.6	-169.8	165.2	0	0	109.5	N554 N700 S702 V706	N554-E704 WeakPolarHBondContact CB-OE1 3.36Å; N554-E704 PolarHBondContact ND2-OE1 2.88Å; N700-E704 PolarHBondContact ND2-O 3.26Å; N700-E704 PolarHBondContact OD1-O 3.11Å; S702-E704 PolarHBondContact O-N 3.02Å; S702-E704 PolarHBondContact OG-N 3.17Å; S702-E704 VanDerWaalsContact OG-N 3.17Å; S702-E704 PolarHBondContact OG-O 3.17Å; E704-V706 HydrophobicContact CB-CG2 4.05Å; E704-V706 PolarHBondContact O-N 3.34Å
705	D	64.9	Low	74.8	Confident	102 Å²	102	43.1 Å²	43.1	55%	0.545	26%	0.258	S	S	.	.			trans	-74	66.1	-179.9	-81.7	-55.5	0	0	0	111.9	W707 K713 K720	D705-W707 PolarHBondContact O-N 3.01Å; D705-W707 VanDerWaalsContact O-N 3.09Å; D705-K713 IonicContact OD1-NZ 3.18Å; D705-K713 PolarHBondContact OD1-NZ 3.13Å; D705-K720 VanDerWaalsContact OD1-CE 3.28Å; D705-K720 WeakPolarHBondContact OD1-CE 3.31Å; D705-K720 IonicContact OD1-NZ 3.14Å; D705-K720 PolarHBondContact OD1-NZ 3.19Å; D705-K720 IonicContact OD2-NZ 2.99Å; D705-K720 PolarHBondContact OD2-NZ 3.09Å
706	V	67.9	Low	74.8	Confident	38.6667 Å²	38.6667	42.6 Å²	42.6	23%	0.234	26%	0.255	C	S	.	.			trans	-92.1	79.7	177.5	-172.3	0	0	0	0	108.8	Y552 W698 S702 E704	Y552-V706 HydrophobicContact CD1-CG2 4.15Å; Y552-V706 HydrophobicContact CD2-CB 4.14Å; Y552-V706 HydrophobicContact CD2-CG1 3.69Å; Y552-V706 HydrophobicContact CD2-CG2 3.86Å; Y552-V706 VanDerWaalsContact CD2-CG2 3.49Å; Y552-V706 HydrophobicContact CE1-CG1 4.46Å; Y552-V706 HydrophobicContact CE1-CG2 4.48Å; Y552-V706 HydrophobicContact CE2-CB 4.31Å; Y552-V706 HydrophobicContact CE2-CG1 3.4Å; Y552-V706 HydrophobicContact CE2-CG2 4.09Å; Y552-V706 HydrophobicContact CG-CB 4.41Å; Y552-V706 HydrophobicContact CG-CG1 4.06Å; Y552-V706 HydrophobicContact CG-CG2 3.76Å; Y552-V706 VanDerWaalsContact CG-CG2 3.42Å; W698-V706 WeakPolarHBondContact CH2-O 3.36Å; W698-V706 WeakPolarHBondContact CZ2-O 3.34Å; S702-V706 WeakPolarHBondContact OG-CG2 3.41Å; E704-V706 HydrophobicContact CB-CG2 4.05Å; E704-V706 PolarHBondContact O-N 3.34Å
707	W	77.6	Confident	74.5	Confident	23.6667 Å²	23.6667	44.2 Å²	44.2	9%	0.09	26%	0.263	C	S	.	.			trans	-114	147.9	175.3	-174.2	-99.7	0	0	0	109.6	C676 V681 W698 D705 N709 C711 S712 K713 W716	C676-W707 HydrophobicContact CB-CZ3 4.24Å; V681-W707 HydrophobicContact CB-CZ2 4.43Å; V681-W707 HydrophobicContact CG1-CH2 4.37Å; V681-W707 HydrophobicContact CG1-CZ2 3.87Å; V681-W707 HydrophobicContact CG2-CH2 3.87Å; V681-W707 HydrophobicContact CG2-CZ2 3.83Å; V681-W707 HydrophobicContact CG2-CZ3 4.42Å; W698-W707 HydrophobicContact CB-CZ3 4.41Å; W698-W707 AromaticContact CD2-CE3 3.84Å; W698-W707 HydrophobicContact CD2-CE3 3.93Å; W698-W707 AromaticContact CD2-CZ3 3.78Å; W698-W707 HydrophobicContact CD2-CZ3 3.78Å; W698-W707 AromaticContact CE3-CE3 3.39Å; W698-W707 HydrophobicContact CE3-CE3 3.39Å; W698-W707 VanDerWaalsContact CE3-CE3 3.45Å; W698-W707 AromaticContact CE3-CZ3 3.49Å; W698-W707 HydrophobicContact CE3-CZ3 3.49Å; W698-W707 VanDerWaalsContact CE3-CZ3 3.44Å; W698-W707 HydrophobicContact CG-CZ3 4.22Å; W698-W707 HydrophobicContact CH2-CB 4.21Å; W698-W707 AromaticContact CH2-CE3 3.88Å; W698-W707 HydrophobicContact CH2-CE3 3.93Å; W698-W707 HydrophobicContact CZ2-CE3 4.3Å; W698-W707 HydrophobicContact CZ3-CB 4.33Å; W698-W707 HydrophobicContact CZ3-CD2 4.34Å; W698-W707 AromaticContact CZ3-CE3 3.41Å; W698-W707 HydrophobicContact CZ3-CE3 3.41Å; W698-W707 VanDerWaalsContact CZ3-CE3 3.42Å; W698-W707 AromaticContact CZ3-CZ3 3.94Å; W698-W707 HydrophobicContact CZ3-CZ3 4.03Å; D705-W707 PolarHBondContact O-N 3.01Å; D705-W707 VanDerWaalsContact O-N 3.09Å; W707-N709 PolarHBondContact O-N 3.15Å; W707-N709 VanDerWaalsContact O-N 3.1Å; W707-N709 PolarHBondContact O-OD1 3.08Å; W707-C711 VanDerWaalsContact CD1-O 3.26Å; W707-C711 PolarHBondContact NE1-O 3.06Å; W707-S712 WeakPolarHBondContact CZ2-O 3.43Å; W707-K713 HydrophobicContact CB-CD 4.46Å; W707-K713 HydrophobicContact CB-CG 4.46Å; W707-K713 HydrophobicContact CD2-CD 4.35Å; W707-K713 HydrophobicContact CD2-CG 3.63Å; W707-K713 VanDerWaalsContact CE2-CG 3.48Å; W707-K713 HydrophobicContact CE3-CG 4.27Å; W707-K713 HydrophobicContact CG-CD 4.29Å; W707-K713 VanDerWaalsContact CG-CE 3.41Å; W707-K713 HydrophobicContact CG-CG 3.77Å; W707-K713 HydrophobicContact CZ2-CG 4.08Å; W707-W716 HydrophobicContact CH2-CB 4.3Å; W707-W716 AromaticContact CH2-CD1 3.81Å; W707-W716 AromaticContact CH2-CD2 3.64Å; W707-W716 HydrophobicContact CH2-CD2 3.64Å; W707-W716 AromaticContact CH2-CE2 3.74Å; W707-W716 HydrophobicContact CH2-CE3 4.2Å; W707-W716 AromaticContact CH2-CG 3.68Å; W707-W716 HydrophobicContact CH2-CG 3.68Å; W707-W716 HydrophobicContact CH2-CZ2 4.35Å; W707-W716 AromaticContact CH2-NE1 3.85Å; W707-W716 AromaticContact CZ2-CD1 3.94Å; W707-W716 HydrophobicContact CZ2-CD2 4.46Å; W707-W716 HydrophobicContact CZ2-CG 4.34Å; W707-W716 HydrophobicContact CZ3-CD2 4.39Å; W707-W716 HydrophobicContact CZ3-CE3 4.48Å; W707-W716 HydrophobicContact CZ3-CG 4.47Å
708	P	74.2	Confident	74.1	Confident	24 Å²	24	46.5 Å²	46.5	16%	0.156	27%	0.274	C	S	.	.			trans	-57.9	115.6	174.8	-22.5	33.3	0	0	0	110.9	C676 K678 V681 S710 C711	C676-P708 WeakPolarHBondContact O-CG 3.08Å; K678-P708 HydrophobicContact CB-CB 4.36Å; K678-P708 HydrophobicContact CB-CG 4.43Å; V681-P708 HydrophobicContact CG2-CG 4.28Å; P708-S710 PolarHBondContact O-N 3.27Å; P708-C711 HydrophobicContact CB-CB 4.33Å; P708-C711 PolarHBondContact O-N 3.23Å
709	N	69.6	Low	73.6	Confident	173 Å²	173	47.7 Å²	47.7	93%	0.925	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-23.5	-174.9	-68.7	-10.3	0	0	0	114.3	W707	W707-N709 PolarHBondContact O-N 3.15Å; W707-N709 VanDerWaalsContact O-N 3.1Å; W707-N709 PolarHBondContact O-OD1 3.08Å
710	S	65.7	Low	73.1	Confident	74 Å²	74	51.7 Å²	51.7	52%	0.517	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-4.8	-179.4	60.1	0	0	0	0	114.7	P708 I1277	P708-S710 PolarHBondContact O-N 3.27Å; S710-I1277 WeakPolarHBondContact O-CD1 3.13Å
711	C	67.8	Low	72.4	Confident	15.6667 Å²	15.6667	52.8 Å²	52.8	11%	0.106	31%	0.308	C	S	.	.	S	Bend	trans	-121	137.6	-168.4	-58.3	0	0	0	0	111.7	V681 W707 P708	V681-C711 HydrophobicContact CB-CB 4.32Å; V681-C711 HydrophobicContact CG1-CB 3.63Å; W707-C711 VanDerWaalsContact CD1-O 3.26Å; W707-C711 PolarHBondContact NE1-O 3.06Å; P708-C711 HydrophobicContact CB-CB 4.33Å; P708-C711 PolarHBondContact O-N 3.23Å
712	S	72.4	Confident	72	Confident	55 Å²	55	54.5 Å²	54.5	39%	0.385	32%	0.32	S	S	.	.			trans	-69.8	144.1	171.2	-179.9	0	0	0	0	111	W707 D714	W707-S712 WeakPolarHBondContact CZ2-O 3.43Å; S712-D714 VanDerWaalsContact C-N 3.27Å; S712-D714 PolarHBondContact O-N 3.31Å; S712-D714 VanDerWaalsContact OG-CB 3.3Å; S712-D714 WeakPolarHBondContact OG-CB 3.34Å; S712-D714 PolarHBondContact OG-N 3.23Å; S712-D714 VanDerWaalsContact OG-N 3.15Å; S712-D714 PolarHBondContact OG-OD1 2.78Å; S712-D714 PolarHBondContact OG-OD2 3.12Å
713	K	73.9	Confident	72	Confident	67.3333 Å²	67.3333	56 Å²	56	29%	0.293	33%	0.328	S	S	.	.			trans	-80.7	-1.5	169.9	-73.9	-173.9	176.8	-170.8	0	112.5	D705 W707 G715 W716 E718	D705-K713 IonicContact OD1-NZ 3.18Å; D705-K713 PolarHBondContact OD1-NZ 3.13Å; W707-K713 HydrophobicContact CB-CD 4.46Å; W707-K713 HydrophobicContact CB-CG 4.46Å; W707-K713 HydrophobicContact CD2-CD 4.35Å; W707-K713 HydrophobicContact CD2-CG 3.63Å; W707-K713 VanDerWaalsContact CE2-CG 3.48Å; W707-K713 HydrophobicContact CE3-CG 4.27Å; W707-K713 HydrophobicContact CG-CD 4.29Å; W707-K713 VanDerWaalsContact CG-CE 3.41Å; W707-K713 HydrophobicContact CG-CG 3.77Å; W707-K713 HydrophobicContact CZ2-CG 4.08Å; K713-G715 PolarHBondContact O-N 3.31Å; K713-W716 WeakPolarHBondContact O-CB 3.16Å; K713-W716 PolarHBondContact O-N 3.12Å; K713-E718 IonicContact NZ-OE1 3.12Å; K713-E718 IonicContact NZ-OE2 2.88Å; K713-E718 PolarHBondContact NZ-OE2 2.95Å
714	D	71.5	Confident	72.4	Confident	112 Å²	112	54.7 Å²	54.7	60%	0.599	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	132	-172.9	-69.1	-33.7	0	0	0	112.9	R688 S712 W716 I1235	R688-D714 PolarHBondContact NH1-O 2.78Å; S712-D714 VanDerWaalsContact C-N 3.27Å; S712-D714 PolarHBondContact O-N 3.31Å; S712-D714 VanDerWaalsContact OG-CB 3.3Å; S712-D714 WeakPolarHBondContact OG-CB 3.34Å; S712-D714 PolarHBondContact OG-N 3.23Å; S712-D714 VanDerWaalsContact OG-N 3.15Å; S712-D714 PolarHBondContact OG-OD1 2.78Å; S712-D714 PolarHBondContact OG-OD2 3.12Å; D714-W716 VanDerWaalsContact C-N 3.27Å; D714-W716 PolarHBondContact O-N 3.41Å; D714-W716 VanDerWaalsContact O-N 3.15Å; D714-I1235 VanDerWaalsContact OD1-CD1 3.26Å; D714-I1235 WeakPolarHBondContact OD1-CD1 3.42Å; D714-I1235 WeakPolarHBondContact OD2-CG2 3.34Å
715	G	73.5	Confident	72.7	Confident	51 Å²	51	55.1 Å²	55.1	53%	0.526	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	3.3	-175.9	0	0	0	0	0	115.1	R688 K713	R688-G715 VanDerWaalsContact NH1-C 3.32Å; R688-G715 PolarHBondContact NH1-O 3.09Å; R688-G715 PolarHBondContact NH2-O 3.29Å; K713-G715 PolarHBondContact O-N 3.31Å
716	W	83.7	Confident	73.3	Confident	25 Å²	25	50.7 Å²	50.7	10%	0.095	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	135	168.6	-76	81.6	0	0	0	110.8	I670 V672 I680 V681 V684 A696 W698 W707 K713 D714 E718	I670-W716 HydrophobicContact CG2-CH2 4.47Å; V672-W716 HydrophobicContact CG2-CH2 4.26Å; V672-W716 HydrophobicContact CG2-CZ3 4.21Å; I680-W716 HydrophobicContact CG2-CH2 4.13Å; V681-W716 HydrophobicContact CG2-CZ2 4.33Å; V684-W716 HydrophobicContact CB-CH2 4.5Å; V684-W716 HydrophobicContact CB-CZ2 3.73Å; V684-W716 HydrophobicContact CG1-CZ2 4.03Å; V684-W716 HydrophobicContact CG2-CH2 3.82Å; V684-W716 HydrophobicContact CG2-CZ2 3.42Å; V684-W716 VanDerWaalsContact CG2-CZ2 3.44Å; A696-W716 HydrophobicContact CB-CD2 3.64Å; A696-W716 HydrophobicContact CB-CE3 3.7Å; A696-W716 HydrophobicContact CB-CG 4.21Å; A696-W716 HydrophobicContact CB-CH2 4.21Å; A696-W716 HydrophobicContact CB-CZ2 4.15Å; A696-W716 HydrophobicContact CB-CZ3 3.99Å; A696-W716 WeakPolarHBondContact O-CA 3.37Å; W698-W716 HydrophobicContact CB-CE3 3.8Å; W698-W716 HydrophobicContact CB-CZ3 4.08Å; W707-W716 HydrophobicContact CH2-CB 4.3Å; W707-W716 AromaticContact CH2-CD1 3.81Å; W707-W716 AromaticContact CH2-CD2 3.64Å; W707-W716 HydrophobicContact CH2-CD2 3.64Å; W707-W716 AromaticContact CH2-CE2 3.74Å; W707-W716 HydrophobicContact CH2-CE3 4.2Å; W707-W716 AromaticContact CH2-CG 3.68Å; W707-W716 HydrophobicContact CH2-CG 3.68Å; W707-W716 HydrophobicContact CH2-CZ2 4.35Å; W707-W716 AromaticContact CH2-NE1 3.85Å; W707-W716 AromaticContact CZ2-CD1 3.94Å; W707-W716 HydrophobicContact CZ2-CD2 4.46Å; W707-W716 HydrophobicContact CZ2-CG 4.34Å; W707-W716 HydrophobicContact CZ3-CD2 4.39Å; W707-W716 HydrophobicContact CZ3-CE3 4.48Å; W707-W716 HydrophobicContact CZ3-CG 4.47Å; K713-W716 WeakPolarHBondContact O-CB 3.16Å; K713-W716 PolarHBondContact O-N 3.12Å; D714-W716 VanDerWaalsContact C-N 3.27Å; D714-W716 PolarHBondContact O-N 3.41Å; D714-W716 VanDerWaalsContact O-N 3.15Å; W716-E718 PolarHBondContact O-N 3.06Å
717	I	81.6	Confident	73.9	Confident	33 Å²	33	49 Å²	49	17%	0.169	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	106.6	173.2	-55.4	168.1	0	0	0	107.9	K695 A696 I697 W698 F719 Y729	K695-I717 HydrophobicContact CG-CD1 4.21Å; A696-I717 PolarHBondContact O-N 3.23Å; I697-I717 WeakPolarHBondContact CA-O 3.23Å; I697-I717 HydrophobicContact CG1-CB 4.34Å; I697-I717 HydrophobicContact CG1-CD1 4.33Å; W698-I717 PolarHBondContact N-O 3.07Å; I717-F719 HydrophobicContact CB-CE2 4.4Å; I717-F719 HydrophobicContact CB-CZ 4.49Å; I717-F719 HydrophobicContact CG2-CD2 4.32Å; I717-F719 HydrophobicContact CG2-CE1 4.03Å; I717-F719 HydrophobicContact CG2-CE2 3.55Å; I717-F719 HydrophobicContact CG2-CZ 3.58Å; I717-F719 VanDerWaalsContact CG2-CZ 3.44Å; I717-Y729 HydrophobicContact CD1-CE1 4.05Å; I717-Y729 WeakPolarHBondContact CD1-OH 3.43Å; I717-Y729 HydrophobicContact CG2-CE1 3.93Å
718	E	81.2	Confident	73.9	Confident	49.6667 Å²	49.6667	52.4 Å²	52.4	23%	0.232	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	126.6	178.7	-176.3	177.5	-176.6	0	0	111.5	W698 N700 K713 W716 K720	W698-E718 HydrophobicContact CD2-CG 4.45Å; W698-E718 HydrophobicContact CE3-CB 4.25Å; W698-E718 HydrophobicContact CE3-CG 3.72Å; W698-E718 VanDerWaalsContact CZ3-CD 3.44Å; W698-E718 HydrophobicContact CZ3-CG 3.98Å; W698-E718 VanDerWaalsContact CZ3-OE1 3.3Å; W698-E718 WeakPolarHBondContact CZ3-OE1 3.41Å; W698-E718 CarbonylContact O-C 3.39Å; W698-E718 WeakPolarHBondContact O-CA 3.3Å; N700-E718 HydrophobicContact CB-CG 4.17Å; N700-E718 WeakPolarHBondContact CB-OE1 3.39Å; N700-E718 PolarHBondContact ND2-OE1 3.28Å; K713-E718 IonicContact NZ-OE1 3.12Å; K713-E718 IonicContact NZ-OE2 2.88Å; K713-E718 PolarHBondContact NZ-OE2 2.95Å; W716-E718 PolarHBondContact O-N 3.06Å; E718-K720 VanDerWaalsContact CD-CE 3.48Å; E718-K720 HydrophobicContact CG-CG 4.18Å; E718-K720 WeakPolarHBondContact OE1-CE 3.37Å; E718-K720 WeakPolarHBondContact OE1-CG 3.44Å; E718-K720 IonicContact OE1-NZ 3.05Å
719	F	76.5	Confident	74	Confident	27.6667 Å²	27.6667	53.6 Å²	53.6	12%	0.121	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	109.6	169.3	-65.3	-77.7	0	0	0	110.2	V165 I697 W698 G699 N700 I717 I726 Y729 I730	V165-F719 HydrophobicContact CG1-CD1 4.49Å; V165-F719 HydrophobicContact CG2-CD1 3.34Å; V165-F719 HydrophobicContact CG2-CE1 3.61Å; V165-F719 HydrophobicContact CG2-CG 4.21Å; I697-F719 HydrophobicContact CB-CE2 4.49Å; I697-F719 HydrophobicContact CG1-CE2 4.39Å; I697-F719 HydrophobicContact CG2-CD2 3.6Å; I697-F719 HydrophobicContact CG2-CE2 3.5Å; I697-F719 VanDerWaalsContact CG2-CE2 3.44Å; W698-F719 PolarHBondContact O-N 3.17Å; G699-F719 CarbonylContact C-O 3.55Å; N700-F719 CarbonylContact C-O 3.56Å; N700-F719 WeakPolarHBondContact CA-O 3.37Å; N700-F719 PolarHBondContact N-O 3.16Å; I717-F719 HydrophobicContact CB-CE2 4.4Å; I717-F719 HydrophobicContact CB-CZ 4.49Å; I717-F719 HydrophobicContact CG2-CD2 4.32Å; I717-F719 HydrophobicContact CG2-CE1 4.03Å; I717-F719 HydrophobicContact CG2-CE2 3.55Å; I717-F719 HydrophobicContact CG2-CZ 3.58Å; I717-F719 VanDerWaalsContact CG2-CZ 3.44Å; F719-I726 HydrophobicContact CB-CD1 3.63Å; F719-I726 VanDerWaalsContact CB-CD1 3.46Å; F719-I726 HydrophobicContact CB-CG1 4.09Å; F719-I726 HydrophobicContact CB-CG2 4.22Å; F719-I726 HydrophobicContact CD1-CB 4.31Å; F719-I726 HydrophobicContact CD1-CD1 4.21Å; F719-I726 HydrophobicContact CD1-CG1 3.97Å; F719-I726 HydrophobicContact CD1-CG2 4.3Å; F719-I726 HydrophobicContact CD2-CD1 3.46Å; F719-I726 VanDerWaalsContact CD2-CD1 3.46Å; F719-I726 HydrophobicContact CD2-CG1 3.73Å; F719-I726 HydrophobicContact CD2-CG2 3.62Å; F719-I726 HydrophobicContact CE1-CG1 4.04Å; F719-I726 HydrophobicContact CE2-CD1 4.22Å; F719-I726 HydrophobicContact CE2-CG1 4.02Å; F719-I726 HydrophobicContact CE2-CG2 4.02Å; F719-I726 HydrophobicContact CG-CB 4.37Å; F719-I726 HydrophobicContact CG-CD1 3.95Å; F719-I726 HydrophobicContact CG-CG1 3.89Å; F719-I726 HydrophobicContact CG-CG2 3.78Å; F719-I726 HydrophobicContact CZ-CG1 4.21Å; F719-I726 HydrophobicContact CZ-CG2 4.41Å; F719-Y729 HydrophobicContact CE1-CD1 4.13Å; F719-Y729 HydrophobicContact CE1-CE1 4.35Å; F719-Y729 HydrophobicContact CE1-CG 4.32Å; F719-Y729 AromaticContact CE2-CD1 3.66Å; F719-Y729 HydrophobicContact CE2-CD1 3.93Å; F719-Y729 AromaticContact CE2-CE1 3.92Å; F719-Y729 HydrophobicContact CE2-CE1 3.92Å; F719-Y729 HydrophobicContact CE2-CG 4.47Å; F719-Y729 AromaticContact CZ-CD1 3.22Å; F719-Y729 HydrophobicContact CZ-CD1 3.22Å; F719-Y729 HydrophobicContact CZ-CD2 4.39Å; F719-Y729 AromaticContact CZ-CE1 3.6Å; F719-Y729 HydrophobicContact CZ-CE1 3.6Å; F719-Y729 AromaticContact CZ-CG 3.75Å; F719-Y729 HydrophobicContact CZ-CG 3.75Å; F719-I730 HydrophobicContact CE2-CG1 4.44Å
720	K	74	Confident	74.5	Confident	88 Å²	88	45.4 Å²	45.4	38%	0.383	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	128.6	172.7	-67.7	-174.2	178.5	-179.7	0	111.2	V165 N700 D705 E718	V165-K720 HydrophobicContact CG1-CB 4.08Å; V165-K720 WeakPolarHBondContact CG1-O 3.3Å; N700-K720 HydrophobicContact CB-CG 4.27Å; N700-K720 CarbonylContact O-C 3.58Å; N700-K720 VanDerWaalsContact O-CA 3.32Å; N700-K720 WeakPolarHBondContact O-CA 3.44Å; D705-K720 VanDerWaalsContact OD1-CE 3.28Å; D705-K720 WeakPolarHBondContact OD1-CE 3.31Å; D705-K720 IonicContact OD1-NZ 3.14Å; D705-K720 PolarHBondContact OD1-NZ 3.19Å; D705-K720 IonicContact OD2-NZ 2.99Å; D705-K720 PolarHBondContact OD2-NZ 3.09Å; E718-K720 VanDerWaalsContact CD-CE 3.48Å; E718-K720 HydrophobicContact CG-CG 4.18Å; E718-K720 WeakPolarHBondContact OE1-CE 3.37Å; E718-K720 WeakPolarHBondContact OE1-CG 3.44Å; E718-K720 IonicContact OE1-NZ 3.05Å
721	G	67.2	Low	75.2	Confident	24 Å²	24	42.4 Å²	42.4	25%	0.247	23%	0.23	C	C	.	.	S	Bend	trans	98.1	-171.3	172.5	0	0	0	0	0	114.9	N700 T723	N700-G721 PolarHBondContact O-N 3.29Å; G721-T723 PolarHBondContact O-N 3.1Å
722	C	66.9	Low	75.5	Confident	42.3333 Å²	42.3333	43.2 Å²	43.2	29%	0.286	23%	0.233	S	C	.	.			trans	-114.9	59.6	-162.4	-51.7	0	0	0	0	112.5	L568	L568-C722 HydrophobicContact CD2-CB 3.49Å; L568-C722 VanDerWaalsContact CD2-CB 3.42Å; L568-C722 WeakPolarHBondContact CD2-SG 3.31Å
723	T	71.2	Confident	75.1	Confident	44.6667 Å²	44.6667	43.6 Å²	43.6	27%	0.274	23%	0.234	S	C	.	.			trans	-113.2	136.1	177	105.5	0	0	0	0	111.8	G721 Q725 I726	G721-T723 PolarHBondContact O-N 3.1Å; T723-Q725 VanDerWaalsContact C-N 3.27Å; T723-Q725 HydrophobicContact CG2-CB 4.41Å; T723-Q725 PolarHBondContact O-N 3.01Å; T723-Q725 PolarHBondContact OG1-N 3.24Å; T723-I726 HydrophobicContact CG2-CD1 3.97Å; T723-I726 HydrophobicContact CG2-CG1 3.76Å; T723-I726 VanDerWaalsContact O-CB 3.25Å; T723-I726 WeakPolarHBondContact O-CB 3.39Å; T723-I726 VanDerWaalsContact O-CD1 3.23Å; T723-I726 WeakPolarHBondContact O-CD1 3.27Å; T723-I726 WeakPolarHBondContact O-CG1 3.38Å; T723-I726 WeakPolarHBondContact O-CG2 3.28Å; T723-I726 PolarHBondContact O-N 3.13Å; T723-I726 VanDerWaalsContact O-N 3.16Å
724	D	72.7	Confident	74.6	Confident	12 Å²	12	44.8 Å²	44.8	6%	0.064	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-13.9	171.4	44.2	9.1	0	0	0	113.6	F449 P450 F451 M575 I726 L727	F449-D724 VanDerWaalsContact C-OD2 3.32Å; F449-D724 WeakPolarHBondContact CA-OD2 3.44Å; F449-D724 VanDerWaalsContact CB-CG 3.43Å; F449-D724 WeakPolarHBondContact CB-OD2 3.26Å; F449-D724 VanDerWaalsContact CD1-CG 3.5Å; F449-D724 WeakPolarHBondContact CD1-OD1 3.44Å; F449-D724 WeakPolarHBondContact CE1-OD1 3.49Å; F449-D724 VanDerWaalsContact CG-OD1 3.31Å; F449-D724 WeakPolarHBondContact CG-OD1 3.45Å; P450-D724 HydrophobicContact CB-CB 4.39Å; P450-D724 VanDerWaalsContact CB-OD2 3.25Å; P450-D724 WeakPolarHBondContact CB-OD2 3.44Å; P450-D724 WeakPolarHBondContact CD-OD2 3.48Å; P450-D724 HydrophobicContact CG-CB 4.38Å; P450-D724 WeakPolarHBondContact CG-OD2 3.44Å; F451-D724 WeakPolarHBondContact CA-OD2 3.45Å; F451-D724 HydrophobicContact CB-CB 4.3Å; F451-D724 WeakPolarHBondContact CB-OD2 3.32Å; F451-D724 HydrophobicContact CD1-CB 3.7Å; F451-D724 HydrophobicContact CD2-CB 3.73Å; F451-D724 HydrophobicContact CE1-CB 3.91Å; F451-D724 HydrophobicContact CE2-CB 3.93Å; F451-D724 HydrophobicContact CG-CB 3.62Å; F451-D724 VanDerWaalsContact CG-CG 3.45Å; F451-D724 VanDerWaalsContact CG-OD2 3.31Å; F451-D724 WeakPolarHBondContact CG-OD2 3.04Å; F451-D724 HydrophobicContact CZ-CB 4.03Å; F451-D724 PolarHBondContact N-OD2 3.13Å; M575-D724 HydrophobicContact CE-CB 4.4Å; D724-I726 PolarHBondContact O-N 3.03Å; D724-I726 VanDerWaalsContact O-N 3.14Å; D724-L727 WeakPolarHBondContact O-CB 3.36Å; D724-L727 PolarHBondContact O-N 3.05Å
725	Q	73.6	Confident	74.3	Confident	75 Å²	75	44.8 Å²	44.8	35%	0.35	24%	0.24	S	C	.	.	H	α-helix	trans	-56.3	-25.2	168.3	-73.5	-152.7	-23.2	0	0	112	F449 T723 L727 R728 Y729	F449-Q725 HydrophobicContact CD2-CG 4.37Å; F449-Q725 HydrophobicContact CE1-CB 4.46Å; F449-Q725 HydrophobicContact CE1-CG 4.05Å; F449-Q725 VanDerWaalsContact CE1-NE2 3.27Å; F449-Q725 HydrophobicContact CE2-CG 4.09Å; F449-Q725 HydrophobicContact CZ-CG 4.11Å; T723-Q725 VanDerWaalsContact C-N 3.27Å; T723-Q725 HydrophobicContact CG2-CB 4.41Å; T723-Q725 PolarHBondContact O-N 3.01Å; T723-Q725 PolarHBondContact OG1-N 3.24Å; Q725-L727 VanDerWaalsContact C-N 3.31Å; Q725-L727 PolarHBondContact O-N 3.05Å; Q725-L727 VanDerWaalsContact O-N 3.17Å; Q725-R728 WeakPolarHBondContact O-CB 3.36Å; Q725-R728 PolarHBondContact O-N 3.15Å; Q725-R728 VanDerWaalsContact O-N 3.1Å; Q725-Y729 WeakPolarHBondContact O-CD2 3.48Å; Q725-Y729 PolarHBondContact O-N 3.15Å
726	I	76.9	Confident	73.9	Confident	9 Å²	9	46.8 Å²	46.8	5%	0.046	24%	0.239	C	C	.	.	H	α-helix	trans	-54.9	-38.6	173.2	-93.1	169.2	0	0	0	111.2	L572 F673 I697 F719 T723 D724 R728 Y729 I730	L572-I726 HydrophobicContact CD2-CG2 4.12Å; F673-I726 HydrophobicContact CE1-CD1 4.11Å; F673-I726 HydrophobicContact CE1-CG2 4.28Å; I697-I726 HydrophobicContact CG2-CD1 4.35Å; F719-I726 HydrophobicContact CB-CD1 3.63Å; F719-I726 VanDerWaalsContact CB-CD1 3.46Å; F719-I726 HydrophobicContact CB-CG1 4.09Å; F719-I726 HydrophobicContact CB-CG2 4.22Å; F719-I726 HydrophobicContact CD1-CB 4.31Å; F719-I726 HydrophobicContact CD1-CD1 4.21Å; F719-I726 HydrophobicContact CD1-CG1 3.97Å; F719-I726 HydrophobicContact CD1-CG2 4.3Å; F719-I726 HydrophobicContact CD2-CD1 3.46Å; F719-I726 VanDerWaalsContact CD2-CD1 3.46Å; F719-I726 HydrophobicContact CD2-CG1 3.73Å; F719-I726 HydrophobicContact CD2-CG2 3.62Å; F719-I726 HydrophobicContact CE1-CG1 4.04Å; F719-I726 HydrophobicContact CE2-CD1 4.22Å; F719-I726 HydrophobicContact CE2-CG1 4.02Å; F719-I726 HydrophobicContact CE2-CG2 4.02Å; F719-I726 HydrophobicContact CG-CB 4.37Å; F719-I726 HydrophobicContact CG-CD1 3.95Å; F719-I726 HydrophobicContact CG-CG1 3.89Å; F719-I726 HydrophobicContact CG-CG2 3.78Å; F719-I726 HydrophobicContact CZ-CG1 4.21Å; F719-I726 HydrophobicContact CZ-CG2 4.41Å; T723-I726 HydrophobicContact CG2-CD1 3.97Å; T723-I726 HydrophobicContact CG2-CG1 3.76Å; T723-I726 VanDerWaalsContact O-CB 3.25Å; T723-I726 WeakPolarHBondContact O-CB 3.39Å; T723-I726 VanDerWaalsContact O-CD1 3.23Å; T723-I726 WeakPolarHBondContact O-CD1 3.27Å; T723-I726 WeakPolarHBondContact O-CG1 3.38Å; T723-I726 WeakPolarHBondContact O-CG2 3.28Å; T723-I726 PolarHBondContact O-N 3.13Å; T723-I726 VanDerWaalsContact O-N 3.16Å; D724-I726 PolarHBondContact O-N 3.03Å; D724-I726 VanDerWaalsContact O-N 3.14Å; I726-R728 VanDerWaalsContact C-N 3.29Å; I726-R728 PolarHBondContact O-N 3.1Å; I726-Y729 WeakPolarHBondContact O-CB 3.32Å; I726-Y729 PolarHBondContact O-N 3.24Å; I726-Y729 VanDerWaalsContact O-N 3.12Å; I726-I730 HydrophobicContact CD1-CD1 4.41Å; I726-I730 HydrophobicContact CG1-CD1 3.91Å; I726-I730 HydrophobicContact CG1-CG1 4.22Å; I726-I730 HydrophobicContact CG2-CD1 3.8Å; I726-I730 HydrophobicContact CG2-CG1 4.15Å; I726-I730 VanDerWaalsContact O-CG1 3.25Å; I726-I730 WeakPolarHBondContact O-CG1 3.2Å; I726-I730 PolarHBondContact O-N 3.27Å
727	L	81.1	Confident	73.1	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-33.5	179.7	-62.9	176	0	0	0	112.1	L536 L572 M575 C576 I579 F673 D724 Q725 Y729 I730 A731	L536-L727 HydrophobicContact CD1-CB 4.28Å; L536-L727 HydrophobicContact CD1-CD1 3.76Å; L536-L727 HydrophobicContact CD2-CB 4.34Å; L572-L727 HydrophobicContact CD2-CD1 4.5Å; L572-L727 HydrophobicContact CD2-CG 4.43Å; M575-L727 HydrophobicContact CB-CD1 3.99Å; M575-L727 HydrophobicContact CE-CD1 3.73Å; M575-L727 HydrophobicContact SD-CD1 4.18Å; C576-L727 HydrophobicContact CB-CD2 4.03Å; I579-L727 HydrophobicContact CD1-CB 4.06Å; I579-L727 HydrophobicContact CD1-CD1 4.23Å; I579-L727 HydrophobicContact CD1-CD2 4.45Å; I579-L727 HydrophobicContact CD1-CG 4.44Å; F673-L727 HydrophobicContact CZ-CD2 4.16Å; D724-L727 WeakPolarHBondContact O-CB 3.36Å; D724-L727 PolarHBondContact O-N 3.05Å; Q725-L727 VanDerWaalsContact C-N 3.31Å; Q725-L727 PolarHBondContact O-N 3.05Å; Q725-L727 VanDerWaalsContact O-N 3.17Å; L727-Y729 VanDerWaalsContact C-N 3.34Å; L727-I730 HydrophobicContact CD2-CD1 4.35Å; L727-I730 PolarHBondContact O-N 3.27Å; L727-A731 WeakPolarHBondContact O-CB 3.36Å; L727-A731 PolarHBondContact O-N 2.91Å; L727-A731 VanDerWaalsContact O-N 3.15Å
728	R	77.6	Confident	72.6	Confident	96 Å²	96	51.2 Å²	51.2	36%	0.362	26%	0.258	S	S	.	.	H	α-helix	trans	-66.6	-40.3	173.7	-142.2	-176.2	-179	174.8	-3.3	111.6	E202 F449 N535 L536 P537 Q725 I726 I730 A731 E732	E202-R728 PolarHBondContact O-NH1 3.01Å; E202-R728 PolarHBondContact O-NH2 2.87Å; F449-R728 HydrophobicContact CE1-CB 4.42Å; N535-R728 PolarHBondContact O-NE 3.28Å; N535-R728 PolarHBondContact O-NH2 3.34Å; L536-R728 HydrophobicContact CD2-CB 4.31Å; L536-R728 HydrophobicContact CD2-CG 3.99Å; P537-R728 HydrophobicContact CG-CB 4.26Å; P537-R728 HydrophobicContact CG-CG 4.09Å; Q725-R728 WeakPolarHBondContact O-CB 3.36Å; Q725-R728 PolarHBondContact O-N 3.15Å; Q725-R728 VanDerWaalsContact O-N 3.1Å; I726-R728 VanDerWaalsContact C-N 3.29Å; I726-R728 PolarHBondContact O-N 3.1Å; R728-I730 VanDerWaalsContact C-N 3.34Å; R728-A731 WeakPolarHBondContact O-CB 3.17Å; R728-A731 PolarHBondContact O-N 3.26Å; R728-E732 PolarHBondContact O-N 2.93Å
729	Y	76.4	Confident	72.2	Confident	49.3333 Å²	49.3333	51.2 Å²	51.2	19%	0.193	26%	0.26	C	S	.	.	H	α-helix	trans	-68.1	-37.6	176.2	-147	-87	0	0	0	112.5	S161 I164 I717 F719 Q725 I726 L727 A731 E732 L738	S161-Y729 VanDerWaalsContact CB-CE2 3.41Å; I164-Y729 HydrophobicContact CD1-CD2 4.44Å; I717-Y729 HydrophobicContact CD1-CE1 4.05Å; I717-Y729 WeakPolarHBondContact CD1-OH 3.43Å; I717-Y729 HydrophobicContact CG2-CE1 3.93Å; F719-Y729 HydrophobicContact CE1-CD1 4.13Å; F719-Y729 HydrophobicContact CE1-CE1 4.35Å; F719-Y729 HydrophobicContact CE1-CG 4.32Å; F719-Y729 AromaticContact CE2-CD1 3.66Å; F719-Y729 HydrophobicContact CE2-CD1 3.93Å; F719-Y729 AromaticContact CE2-CE1 3.92Å; F719-Y729 HydrophobicContact CE2-CE1 3.92Å; F719-Y729 HydrophobicContact CE2-CG 4.47Å; F719-Y729 AromaticContact CZ-CD1 3.22Å; F719-Y729 HydrophobicContact CZ-CD1 3.22Å; F719-Y729 HydrophobicContact CZ-CD2 4.39Å; F719-Y729 AromaticContact CZ-CE1 3.6Å; F719-Y729 HydrophobicContact CZ-CE1 3.6Å; F719-Y729 AromaticContact CZ-CG 3.75Å; F719-Y729 HydrophobicContact CZ-CG 3.75Å; Q725-Y729 WeakPolarHBondContact O-CD2 3.48Å; Q725-Y729 PolarHBondContact O-N 3.15Å; I726-Y729 WeakPolarHBondContact O-CB 3.32Å; I726-Y729 PolarHBondContact O-N 3.24Å; I726-Y729 VanDerWaalsContact O-N 3.12Å; L727-Y729 VanDerWaalsContact C-N 3.34Å; Y729-A731 VanDerWaalsContact C-N 3.26Å; Y729-A731 PolarHBondContact O-N 3.01Å; Y729-E732 HydrophobicContact CD2-CG 4.49Å; Y729-E732 WeakPolarHBondContact CD2-OE2 3.46Å; Y729-E732 VanDerWaalsContact CE2-OE2 3.3Å; Y729-E732 WeakPolarHBondContact CE2-OE2 3.43Å; Y729-E732 VanDerWaalsContact O-CB 3.3Å; Y729-E732 WeakPolarHBondContact O-CB 3.34Å; Y729-E732 PolarHBondContact O-N 3Å; Y729-L738 HydrophobicContact CD1-CD2 3.56Å; Y729-L738 HydrophobicContact CE1-CD2 3.97Å; Y729-L738 HydrophobicContact CE2-CD1 4.14Å; Y729-L738 HydrophobicContact CE2-CD2 4.36Å
730	I	80.3	Confident	72.1	Confident	0.333333 Å²	0.333333	54.9 Å²	54.9	0%	0.002	28%	0.277	C	S	.	.	H	α-helix	trans	-63.9	-32.1	175.4	-63.9	169.8	0	0	0	111	I539 K669 V671 F673 I697 F719 I726 L727 R728 E732	I539-I730 HydrophobicContact CD1-CB 4.17Å; I539-I730 HydrophobicContact CD1-CG2 3.71Å; I539-I730 HydrophobicContact CG1-CG2 4.27Å; I539-I730 HydrophobicContact CG2-CG2 4.1Å; K669-I730 PolarHBondContact NZ-O 3.04Å; V671-I730 HydrophobicContact CG1-CD1 3.95Å; V671-I730 HydrophobicContact CG2-CD1 4.35Å; V671-I730 HydrophobicContact CG2-CG1 4.33Å; V671-I730 HydrophobicContact CG2-CG2 4.04Å; F673-I730 HydrophobicContact CE1-CD1 4.31Å; F673-I730 HydrophobicContact CZ-CD1 4.01Å; I697-I730 HydrophobicContact CD1-CB 4.38Å; I697-I730 HydrophobicContact CD1-CG1 3.93Å; I697-I730 HydrophobicContact CD1-CG2 4.18Å; I697-I730 HydrophobicContact CG2-CD1 4.24Å; I697-I730 HydrophobicContact CG2-CG1 4.32Å; F719-I730 HydrophobicContact CE2-CG1 4.44Å; I726-I730 HydrophobicContact CD1-CD1 4.41Å; I726-I730 HydrophobicContact CG1-CD1 3.91Å; I726-I730 HydrophobicContact CG1-CG1 4.22Å; I726-I730 HydrophobicContact CG2-CD1 3.8Å; I726-I730 HydrophobicContact CG2-CG1 4.15Å; I726-I730 VanDerWaalsContact O-CG1 3.25Å; I726-I730 WeakPolarHBondContact O-CG1 3.2Å; I726-I730 PolarHBondContact O-N 3.27Å; L727-I730 HydrophobicContact CD2-CD1 4.35Å; L727-I730 PolarHBondContact O-N 3.27Å; R728-I730 VanDerWaalsContact C-N 3.34Å; I730-E732 VanDerWaalsContact C-N 3.33Å
731	A	79.8	Confident	72.1	Confident	11 Å²	11	55.7 Å²	55.7	9%	0.091	28%	0.278	C	S	.	.	H	α-helix	trans	-73.4	-22.5	177.5	0	0	0	0	0	113.7	P537 I539 K669 L727 R728 Y729	P537-A731 HydrophobicContact CB-CB 4.16Å; P537-A731 HydrophobicContact CG-CB 3.65Å; I539-A731 HydrophobicContact CG1-CB 3.83Å; K669-A731 PolarHBondContact NZ-O 3.37Å; L727-A731 WeakPolarHBondContact O-CB 3.36Å; L727-A731 PolarHBondContact O-N 2.91Å; L727-A731 VanDerWaalsContact O-N 3.15Å; R728-A731 WeakPolarHBondContact O-CB 3.17Å; R728-A731 PolarHBondContact O-N 3.26Å; Y729-A731 VanDerWaalsContact C-N 3.26Å; Y729-A731 PolarHBondContact O-N 3.01Å
732	E	74.5	Confident	72.6	Confident	33 Å²	33	57.9 Å²	57.9	15%	0.154	28%	0.283	C	S	.	.			trans	-62	132.6	179.5	-71.8	-152.6	-178.5	0	0	111.2	Y198 L203 K695 R728 Y729 I730 L738 R741	Y198-E732 PolarHBondContact OH-OE1 3.23Å; Y198-E732 PolarHBondContact OH-OE2 3.34Å; L203-E732 WeakPolarHBondContact CD2-OE1 3.44Å; K695-E732 PolarHBondContact NZ-O 3.42Å; K695-E732 VanDerWaalsContact NZ-O 3.16Å; R728-E732 PolarHBondContact O-N 2.93Å; Y729-E732 HydrophobicContact CD2-CG 4.49Å; Y729-E732 WeakPolarHBondContact CD2-OE2 3.46Å; Y729-E732 VanDerWaalsContact CE2-OE2 3.3Å; Y729-E732 WeakPolarHBondContact CE2-OE2 3.43Å; Y729-E732 VanDerWaalsContact O-CB 3.3Å; Y729-E732 WeakPolarHBondContact O-CB 3.34Å; Y729-E732 PolarHBondContact O-N 3Å; I730-E732 VanDerWaalsContact C-N 3.33Å; E732-L738 HydrophobicContact CB-CD2 4.11Å; E732-L738 HydrophobicContact CB-CG 4.42Å; E732-L738 HydrophobicContact CG-CD2 3.77Å; E732-L738 WeakPolarHBondContact OE2-CD2 3.22Å; E732-R741 IonicContact OE1-NH1 3.97Å
733	P	62.6	Low	73.1	Confident	63.6667 Å²	63.6667	61.1 Å²	61.1	41%	0.413	29%	0.294	S	S	.	.	S	Bend	trans	-67.4	-74	-175.5	10.4	-11.6	0	0	0	112.7	K695 K737	K695-P733 PolarHBondContact NZ-O 3.38Å; P733-K737 HydrophobicContact CB-CB 3.52Å; P733-K737 HydrophobicContact CB-CD 4.24Å; P733-K737 HydrophobicContact CG-CB 4.37Å; P733-K737 HydrophobicContact CG-CD 3.96Å
734	N	64.3	Low	73.4	Confident	93 Å²	93	63.4 Å²	63.4	50%	0.497	30%	0.302	S	S	.	.			trans	-100.1	151.7	-179.2	-67.4	-2.2	0	0	0	111.6	D736 K737 L738	N734-D736 VanDerWaalsContact C-N 3.28Å; N734-D736 HydrophobicContact CB-CB 4.45Å; N734-D736 PolarHBondContact O-N 2.97Å; N734-K737 PolarHBondContact O-N 3.48Å; N734-L738 PolarHBondContact O-N 2.85Å
735	E	64.5	Low	73.7	Confident	112 Å²	112	64.7 Å²	64.7	52%	0.523	31%	0.308	S	S	.	.	H	α-helix	trans	-59.2	-33.6	175.1	-69.8	-176.6	179.6	0	0	112	L154 K737 L738 L739	L154-E735 HydrophobicContact CD1-CB 4.32Å; L154-E735 HydrophobicContact CD2-CB 3.76Å; L154-E735 WeakPolarHBondContact CD2-O 3.34Å; E735-K737 VanDerWaalsContact C-N 3.32Å; E735-K737 PolarHBondContact O-N 2.99Å; E735-L738 WeakPolarHBondContact O-CA 3.38Å; E735-L738 VanDerWaalsContact O-CB 3.28Å; E735-L738 WeakPolarHBondContact O-CB 3.19Å; E735-L738 PolarHBondContact O-N 3.04Å; E735-L739 WeakPolarHBondContact O-CB 3.49Å; E735-L739 WeakPolarHBondContact O-CD1 3.5Å; E735-L739 PolarHBondContact O-N 3.12Å; E735-L739 VanDerWaalsContact O-N 3.12Å
736	D	64.8	Low	73.9	Confident	93 Å²	93	62.4 Å²	62.4	50%	0.497	30%	0.298	S	S	.	.	H	α-helix	trans	-60.3	-41.9	178.5	-58.6	-26.9	0	0	0	113.1	K150 N734 L738 L739 E740	K150-D736 WeakPolarHBondContact CE-OD1 3.48Å; K150-D736 IonicContact NZ-OD1 3.37Å; K150-D736 PolarHBondContact NZ-OD1 3.28Å; K150-D736 IonicContact NZ-OD2 3.76Å; K150-D736 PolarHBondContact NZ-OD2 3.47Å; N734-D736 VanDerWaalsContact C-N 3.28Å; N734-D736 HydrophobicContact CB-CB 4.45Å; N734-D736 PolarHBondContact O-N 2.97Å; D736-L738 VanDerWaalsContact C-N 3.3Å; D736-L738 PolarHBondContact O-N 3.38Å; D736-L739 CarbonylContact O-C 3.58Å; D736-L739 WeakPolarHBondContact O-CA 3.39Å; D736-L739 WeakPolarHBondContact O-CB 3.34Å; D736-L739 PolarHBondContact O-N 3.29Å; D736-L739 VanDerWaalsContact O-N 3.16Å; D736-E740 WeakPolarHBondContact O-CG 3.47Å; D736-E740 PolarHBondContact O-N 3.09Å
737	K	67.6	Low	74	Confident	120.667 Å²	120.667	68.2 Å²	68.2	53%	0.525	33%	0.325	S	S	.	.	H	α-helix	trans	-68.5	-28.9	176.6	-73.6	-170.3	176.8	-174.6	0	112.6	P733 N734 E735 R741	P733-K737 HydrophobicContact CB-CB 3.52Å; P733-K737 HydrophobicContact CB-CD 4.24Å; P733-K737 HydrophobicContact CG-CB 4.37Å; P733-K737 HydrophobicContact CG-CD 3.96Å; N734-K737 PolarHBondContact O-N 3.48Å; E735-K737 VanDerWaalsContact C-N 3.32Å; E735-K737 PolarHBondContact O-N 2.99Å; K737-R741 WeakPolarHBondContact O-CB 3.33Å; K737-R741 PolarHBondContact O-N 3.33Å
738	L	70.7	Confident	73.7	Confident	29 Å²	29	72.2 Å²	72.2	15%	0.152	35%	0.346	C	S	.	.	H	α-helix	trans	-70.2	-38.1	173.1	-100.5	138.2	0	0	0	110.6	I157 Y198 Y729 E732 N734 E735 D736 R741 I742	I157-L738 HydrophobicContact CG2-CD2 3.49Å; I157-L738 VanDerWaalsContact CG2-CD2 3.49Å; I157-L738 HydrophobicContact CG2-CG 4.16Å; Y198-L738 HydrophobicContact CE1-CD1 4.43Å; Y198-L738 HydrophobicContact CE2-CD1 4.02Å; Y198-L738 WeakPolarHBondContact OH-CD1 3.21Å; Y729-L738 HydrophobicContact CD1-CD2 3.56Å; Y729-L738 HydrophobicContact CE1-CD2 3.97Å; Y729-L738 HydrophobicContact CE2-CD1 4.14Å; Y729-L738 HydrophobicContact CE2-CD2 4.36Å; E732-L738 HydrophobicContact CB-CD2 4.11Å; E732-L738 HydrophobicContact CB-CG 4.42Å; E732-L738 HydrophobicContact CG-CD2 3.77Å; E732-L738 WeakPolarHBondContact OE2-CD2 3.22Å; N734-L738 PolarHBondContact O-N 2.85Å; E735-L738 WeakPolarHBondContact O-CA 3.38Å; E735-L738 VanDerWaalsContact O-CB 3.28Å; E735-L738 WeakPolarHBondContact O-CB 3.19Å; E735-L738 PolarHBondContact O-N 3.04Å; D736-L738 VanDerWaalsContact C-N 3.3Å; D736-L738 PolarHBondContact O-N 3.38Å; L738-R741 PolarHBondContact O-N 3.24Å; L738-I742 HydrophobicContact CD1-CD1 4.08Å; L738-I742 HydrophobicContact CD1-CG1 4.35Å; L738-I742 HydrophobicContact CG-CD1 4.06Å; L738-I742 WeakPolarHBondContact O-CD1 3.21Å; L738-I742 VanDerWaalsContact O-CG1 3.31Å; L738-I742 WeakPolarHBondContact O-CG1 3.42Å; L738-I742 PolarHBondContact O-N 3.27Å; L738-I742 VanDerWaalsContact O-N 3.08Å
739	L	73.9	Confident	73.7	Confident	49.3333 Å²	49.3333	72.5 Å²	72.5	26%	0.258	35%	0.348	S	S	.	.	H	α-helix	trans	-66.1	-49.4	175	-100.3	128.1	0	0	0	111.7	K150 K153 L154 I157 F191 E735 D736 R741 I742 E743	K150-L739 HydrophobicContact CG-CD2 3.71Å; K153-L739 HydrophobicContact CB-CD1 3.61Å; K153-L739 HydrophobicContact CD-CD1 3.66Å; K153-L739 HydrophobicContact CG-CD1 4.29Å; L154-L739 HydrophobicContact CD2-CB 3.99Å; L154-L739 HydrophobicContact CD2-CD2 4.24Å; L154-L739 HydrophobicContact CG-CD2 4.44Å; I157-L739 HydrophobicContact CD1-CB 4.18Å; I157-L739 HydrophobicContact CD1-CD1 3.79Å; F191-L739 HydrophobicContact CE2-CD1 3.81Å; F191-L739 HydrophobicContact CZ-CD1 3.74Å; E735-L739 WeakPolarHBondContact O-CB 3.49Å; E735-L739 WeakPolarHBondContact O-CD1 3.5Å; E735-L739 PolarHBondContact O-N 3.12Å; E735-L739 VanDerWaalsContact O-N 3.12Å; D736-L739 CarbonylContact O-C 3.58Å; D736-L739 WeakPolarHBondContact O-CA 3.39Å; D736-L739 WeakPolarHBondContact O-CB 3.34Å; D736-L739 PolarHBondContact O-N 3.29Å; D736-L739 VanDerWaalsContact O-N 3.16Å; L739-R741 VanDerWaalsContact C-N 3.3Å; L739-R741 PolarHBondContact O-N 2.96Å; L739-I742 CarbonylContact O-C 3.58Å; L739-I742 WeakPolarHBondContact O-CA 3.36Å; L739-I742 WeakPolarHBondContact O-CB 3.39Å; L739-I742 PolarHBondContact O-N 3.04Å; L739-I742 VanDerWaalsContact O-N 3.12Å; L739-E743 HydrophobicContact CD1-CG 4.41Å; L739-E743 WeakPolarHBondContact O-CG 3.39Å; L739-E743 PolarHBondContact O-N 3.07Å
740	E	74.4	Confident	73.5	Confident	105 Å²	105	73.2 Å²	73.2	49%	0.491	37%	0.369	S	S	.	.	H	α-helix	trans	-53.3	-46.9	174.1	-102.5	174.4	-176.5	0	0	110.8	D736 I742 E743 E744	D736-E740 WeakPolarHBondContact O-CG 3.47Å; D736-E740 PolarHBondContact O-N 3.09Å; E740-I742 VanDerWaalsContact C-N 3.3Å; E740-I742 PolarHBondContact O-N 3.06Å; E740-E743 CarbonylContact O-C 3.48Å; E740-E743 WeakPolarHBondContact O-CA 3.01Å; E740-E743 WeakPolarHBondContact O-CB 3.3Å; E740-E743 PolarHBondContact O-N 3.16Å; E740-E743 VanDerWaalsContact O-N 3.1Å; E740-E744 WeakPolarHBondContact O-CB 3.43Å; E740-E744 WeakPolarHBondContact O-CG 3.38Å; E740-E744 PolarHBondContact O-N 3.26Å
741	R	73.3	Confident	73.1	Confident	104.333 Å²	104.333	75.4 Å²	75.4	39%	0.394	38%	0.381	S	S	.	.	H	α-helix	trans	-62.2	-34.8	176.9	-173	178.1	-176.5	119.4	11.9	113.2	E202 E732 K737 L738 L739 I745 I748	E202-R741 IonicContact OE1-CZ 3.84Å; E202-R741 IonicContact OE1-NE 3.54Å; E202-R741 PolarHBondContact OE1-NE 3.39Å; E202-R741 IonicContact OE1-NH2 3.93Å; E202-R741 PolarHBondContact OE1-NH2 2.87Å; E202-R741 IonicContact OE2-CZ 2.64Å; E202-R741 IonicContact OE2-NE 3.91Å; E202-R741 PolarHBondContact OE2-NE 3.02Å; E202-R741 IonicContact OE2-NH2 2.8Å; E732-R741 IonicContact OE1-NH1 3.97Å; K737-R741 WeakPolarHBondContact O-CB 3.33Å; K737-R741 PolarHBondContact O-N 3.33Å; L738-R741 PolarHBondContact O-N 3.24Å; L739-R741 VanDerWaalsContact C-N 3.3Å; L739-R741 PolarHBondContact O-N 2.96Å; R741-I745 WeakPolarHBondContact O-CG1 3.47Å; R741-I745 PolarHBondContact O-N 3Å; R741-I748 HydrophobicContact CG-CD1 4.12Å
742	I	77.1	Confident	72.2	Confident	70.6667 Å²	70.6667	80.8 Å²	80.8	36%	0.362	41%	0.408	S	S	.	.	H	α-helix	trans	-73.4	-37.9	175.8	-70.1	165.8	0	0	0	110.4	I157 F191 K194 Y198 L738 L739 E740 E744 I745	I157-I742 HydrophobicContact CD1-CD1 3.7Å; I157-I742 HydrophobicContact CG1-CD1 3.68Å; I157-I742 HydrophobicContact CG2-CD1 4.29Å; F191-I742 HydrophobicContact CD2-CG2 4.3Å; F191-I742 HydrophobicContact CE2-CB 4.25Å; F191-I742 HydrophobicContact CE2-CG2 3.55Å; F191-I742 HydrophobicContact CZ-CG2 3.97Å; K194-I742 HydrophobicContact CB-CG2 4.24Å; K194-I742 WeakPolarHBondContact CB-O 3.38Å; Y198-I742 HydrophobicContact CD1-CD1 3.67Å; Y198-I742 HydrophobicContact CD1-CG1 4.08Å; Y198-I742 HydrophobicContact CD2-CD1 4.36Å; Y198-I742 HydrophobicContact CD2-CG1 3.94Å; Y198-I742 HydrophobicContact CE1-CD1 3.9Å; Y198-I742 HydrophobicContact CE2-CG1 4.42Å; Y198-I742 HydrophobicContact CG-CD1 3.92Å; Y198-I742 HydrophobicContact CG-CG1 3.78Å; L738-I742 HydrophobicContact CD1-CD1 4.08Å; L738-I742 HydrophobicContact CD1-CG1 4.35Å; L738-I742 HydrophobicContact CG-CD1 4.06Å; L738-I742 WeakPolarHBondContact O-CD1 3.21Å; L738-I742 VanDerWaalsContact O-CG1 3.31Å; L738-I742 WeakPolarHBondContact O-CG1 3.42Å; L738-I742 PolarHBondContact O-N 3.27Å; L738-I742 VanDerWaalsContact O-N 3.08Å; L739-I742 CarbonylContact O-C 3.58Å; L739-I742 WeakPolarHBondContact O-CA 3.36Å; L739-I742 WeakPolarHBondContact O-CB 3.39Å; L739-I742 PolarHBondContact O-N 3.04Å; L739-I742 VanDerWaalsContact O-N 3.12Å; E740-I742 VanDerWaalsContact C-N 3.3Å; E740-I742 PolarHBondContact O-N 3.06Å; I742-E744 VanDerWaalsContact C-N 3.32Å; I742-E744 PolarHBondContact O-N 3.43Å; I742-I745 HydrophobicContact CB-CD1 4.37Å; I742-I745 HydrophobicContact CG1-CD1 4.4Å; I742-I745 HydrophobicContact CG2-CD1 4.32Å; I742-I745 VanDerWaalsContact O-CB 3.29Å; I742-I745 WeakPolarHBondContact O-CB 3.28Å; I742-I745 WeakPolarHBondContact O-CG1 3.3Å; I742-I745 WeakPolarHBondContact O-CG2 3.47Å; I742-I745 PolarHBondContact O-N 3.34Å
743	E	77.7	Confident	71.1	Confident	110 Å²	110	87.3 Å²	87.3	51%	0.514	44%	0.436	S	S	.	.	H	α-helix	trans	-65.9	-35.1	176.3	-71.2	-177.3	168.9	0	0	111.8	K153 F191 K194 L739 E740 I745 N1222	K153-E743 IonicContact NZ-OE1 2.79Å; K153-E743 PolarHBondContact NZ-OE1 2.85Å; F191-E743 HydrophobicContact CD2-CG 4.29Å; F191-E743 HydrophobicContact CE2-CG 4.14Å; K194-E743 WeakPolarHBondContact CD-O 3.48Å; K194-E743 PolarHBondContact NZ-O 3.47Å; L739-E743 HydrophobicContact CD1-CG 4.41Å; L739-E743 WeakPolarHBondContact O-CG 3.39Å; L739-E743 PolarHBondContact O-N 3.07Å; E740-E743 CarbonylContact O-C 3.48Å; E740-E743 WeakPolarHBondContact O-CA 3.01Å; E740-E743 WeakPolarHBondContact O-CB 3.3Å; E740-E743 PolarHBondContact O-N 3.16Å; E740-E743 VanDerWaalsContact O-N 3.1Å; E743-I745 VanDerWaalsContact C-N 3.32Å; E743-I745 PolarHBondContact O-N 3.21Å; E743-N1222 WeakPolarHBondContact OE1-CB 3.18Å; E743-N1222 PolarHBondContact OE1-ND2 3.37Å
744	E	78.5	Confident	70.2	Confident	93.6667 Å²	93.6667	90.5 Å²	90.5	44%	0.438	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-1.4	176.9	-68	177.6	176.8	0	0	114	E740 I742 D746 E747 I748	E740-E744 WeakPolarHBondContact O-CB 3.43Å; E740-E744 WeakPolarHBondContact O-CG 3.38Å; E740-E744 PolarHBondContact O-N 3.26Å; I742-E744 VanDerWaalsContact C-N 3.32Å; I742-E744 PolarHBondContact O-N 3.43Å; E744-D746 VanDerWaalsContact C-N 3.26Å; E744-D746 PolarHBondContact O-N 2.96Å; E744-D746 VanDerWaalsContact O-N 3.16Å; E744-E747 WeakPolarHBondContact O-CA 3.41Å; E744-E747 WeakPolarHBondContact O-CB 3.34Å; E744-E747 PolarHBondContact O-N 2.79Å; E744-E747 VanDerWaalsContact O-N 3.12Å; E744-I748 HydrophobicContact CB-CD1 3.92Å; E744-I748 HydrophobicContact CB-CG1 4.27Å; E744-I748 WeakPolarHBondContact O-CB 3.12Å; E744-I748 WeakPolarHBondContact O-CD1 3.32Å; E744-I748 WeakPolarHBondContact O-CG1 3.42Å; E744-I748 PolarHBondContact O-N 3.21Å
745	I	78.4	Confident	69	Low	38 Å²	38	91.9 Å²	91.9	20%	0.195	46%	0.456	C	S	.	.	H	α-helix	trans	-58	-35.3	-174.5	-105.6	171	0	0	0	112.6	K194 L197 Y198 R741 I742 E743 E747 I748 Y749	K194-I745 HydrophobicContact CB-CG2 3.7Å; K194-I745 HydrophobicContact CD-CG2 4.38Å; K194-I745 HydrophobicContact CG-CG2 4.01Å; L197-I745 HydrophobicContact CB-CD1 4.49Å; L197-I745 HydrophobicContact CD2-CG1 4.14Å; L197-I745 HydrophobicContact CD2-CG2 4.15Å; L197-I745 HydrophobicContact CG-CD1 4.36Å; L197-I745 HydrophobicContact CG-CG1 4.44Å; Y198-I745 HydrophobicContact CD2-CD1 4.14Å; Y198-I745 HydrophobicContact CG-CD1 4.36Å; R741-I745 WeakPolarHBondContact O-CG1 3.47Å; R741-I745 PolarHBondContact O-N 3Å; I742-I745 HydrophobicContact CB-CD1 4.37Å; I742-I745 HydrophobicContact CG1-CD1 4.4Å; I742-I745 HydrophobicContact CG2-CD1 4.32Å; I742-I745 VanDerWaalsContact O-CB 3.29Å; I742-I745 WeakPolarHBondContact O-CB 3.28Å; I742-I745 WeakPolarHBondContact O-CG1 3.3Å; I742-I745 WeakPolarHBondContact O-CG2 3.47Å; I742-I745 PolarHBondContact O-N 3.34Å; E743-I745 VanDerWaalsContact C-N 3.32Å; E743-I745 PolarHBondContact O-N 3.21Å; I745-E747 VanDerWaalsContact C-N 3.3Å; I745-E747 PolarHBondContact O-N 3.25Å; I745-I748 PolarHBondContact O-N 2.84Å; I745-Y749 HydrophobicContact CB-CD2 4.44Å; I745-Y749 HydrophobicContact CD1-CD2 4.46Å; I745-Y749 HydrophobicContact CD1-CE2 4.06Å; I745-Y749 HydrophobicContact CG1-CD2 3.67Å; I745-Y749 HydrophobicContact CG1-CE2 3.64Å; I745-Y749 HydrophobicContact CG2-CD2 3.98Å; I745-Y749 HydrophobicContact CG2-CE2 4.43Å; I745-Y749 WeakPolarHBondContact O-CB 3.1Å; I745-Y749 VanDerWaalsContact O-CD2 3.28Å; I745-Y749 WeakPolarHBondContact O-CD2 3.29Å; I745-Y749 PolarHBondContact O-N 3.28Å; I745-Y749 VanDerWaalsContact O-N 3.13Å
746	D	77.8	Confident	67.6	Low	27.3333 Å²	27.3333	90.9 Å²	90.9	15%	0.146	46%	0.461	C	S	.	.	H	α-helix	trans	-67.3	-35.9	177.9	-35.9	-34	0	0	0	112.1	K194 K228 Y229 E744 Y749 G750 L751 F1183	K194-D746 VanDerWaalsContact CE-CG 3.49Å; K194-D746 WeakPolarHBondContact CE-OD1 3.44Å; K194-D746 VanDerWaalsContact CE-OD2 3.28Å; K194-D746 WeakPolarHBondContact CE-OD2 3.42Å; K194-D746 IonicContact NZ-OD1 3.52Å; K194-D746 PolarHBondContact NZ-OD1 3.42Å; K194-D746 IonicContact NZ-OD2 2.82Å; K194-D746 PolarHBondContact NZ-OD2 2.84Å; K228-D746 IonicContact NZ-OD2 3.67Å; K228-D746 PolarHBondContact NZ-OD2 2.91Å; Y229-D746 HydrophobicContact CE1-CB 4.01Å; Y229-D746 PolarHBondContact OH-OD2 2.88Å; E744-D746 VanDerWaalsContact C-N 3.26Å; E744-D746 PolarHBondContact O-N 2.96Å; E744-D746 VanDerWaalsContact O-N 3.16Å; D746-Y749 CarbonylContact O-C 3.58Å; D746-Y749 PolarHBondContact O-N 3.25Å; D746-G750 CarbonylContact O-C 3.51Å; D746-G750 WeakPolarHBondContact O-CA 3.12Å; D746-G750 PolarHBondContact O-N 3.05Å; D746-L751 HydrophobicContact CB-CB 4.16Å; D746-L751 PolarHBondContact O-N 3.02Å; D746-F1183 WeakPolarHBondContact OD2-CZ 3.35Å
747	E	78.7	Confident	66.2	Low	131.667 Å²	131.667	94.3 Å²	94.3	62%	0.615	47%	0.469	S	S	*	.	H	α-helix	trans	-72.1	-45.4	175.5	-54.1	-168.2	166.5	0	0	111.1	E744 I745 Y749 G750 K753	E744-E747 WeakPolarHBondContact O-CA 3.41Å; E744-E747 WeakPolarHBondContact O-CB 3.34Å; E744-E747 PolarHBondContact O-N 2.79Å; E744-E747 VanDerWaalsContact O-N 3.12Å; I745-E747 VanDerWaalsContact C-N 3.3Å; I745-E747 PolarHBondContact O-N 3.25Å; E747-Y749 VanDerWaalsContact C-N 3.28Å; E747-Y749 PolarHBondContact O-N 2.93Å; E747-Y749 VanDerWaalsContact O-N 3.11Å; E747-G750 PolarHBondContact O-N 3.25Å; E747-K753 WeakPolarHBondContact OE1-CE 3.45Å; E747-K753 IonicContact OE1-NZ 3.79Å; E747-K753 PolarHBondContact OE1-NZ 2.77Å
748	I	74.9	Confident	64.4	Low	85.6667 Å²	85.6667	95.8 Å²	95.8	44%	0.439	48%	0.477	S	S	.	.	H	α-helix	trans	-58	-35.9	178.5	-66.2	168.3	0	0	0	111.5	R741 E744 I745	R741-I748 HydrophobicContact CG-CD1 4.12Å; E744-I748 HydrophobicContact CB-CD1 3.92Å; E744-I748 HydrophobicContact CB-CG1 4.27Å; E744-I748 WeakPolarHBondContact O-CB 3.12Å; E744-I748 WeakPolarHBondContact O-CD1 3.32Å; E744-I748 WeakPolarHBondContact O-CG1 3.42Å; E744-I748 PolarHBondContact O-N 3.21Å; I745-I748 PolarHBondContact O-N 2.84Å
749	Y	77.3	Confident	62.5	Low	102.333 Å²	102.333	103.2 Å²	103.2	40%	0.401	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	6.2	-179.2	-67.7	-72	0	0	0	114.4	L197 R201 I745 D746 E747 L751	L197-Y749 HydrophobicContact CD2-CD2 3.97Å; L197-Y749 HydrophobicContact CG-CD2 4.39Å; R201-Y749 HydrophobicContact CB-CE1 4.08Å; R201-Y749 HydrophobicContact CB-CE2 3.8Å; R201-Y749 WeakPolarHBondContact CB-OH 3.44Å; R201-Y749 HydrophobicContact CG-CD2 4.48Å; R201-Y749 HydrophobicContact CG-CE1 4.15Å; R201-Y749 HydrophobicContact CG-CE2 4.15Å; I745-Y749 HydrophobicContact CB-CD2 4.44Å; I745-Y749 HydrophobicContact CD1-CD2 4.46Å; I745-Y749 HydrophobicContact CD1-CE2 4.06Å; I745-Y749 HydrophobicContact CG1-CD2 3.67Å; I745-Y749 HydrophobicContact CG1-CE2 3.64Å; I745-Y749 HydrophobicContact CG2-CD2 3.98Å; I745-Y749 HydrophobicContact CG2-CE2 4.43Å; I745-Y749 WeakPolarHBondContact O-CB 3.1Å; I745-Y749 VanDerWaalsContact O-CD2 3.28Å; I745-Y749 WeakPolarHBondContact O-CD2 3.29Å; I745-Y749 PolarHBondContact O-N 3.28Å; I745-Y749 VanDerWaalsContact O-N 3.13Å; D746-Y749 CarbonylContact O-C 3.58Å; D746-Y749 PolarHBondContact O-N 3.25Å; E747-Y749 VanDerWaalsContact C-N 3.28Å; E747-Y749 PolarHBondContact O-N 2.93Å; E747-Y749 VanDerWaalsContact O-N 3.11Å; Y749-L751 VanDerWaalsContact C-N 3.31Å; Y749-L751 PolarHBondContact O-N 3.14Å
750	G	71.5	Confident	60.4	Low	63 Å²	63	107.6 Å²	107.6	65%	0.649	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	41.9	175.3	0	0	0	0	0	114.7	D746 E747 N752	D746-G750 CarbonylContact O-C 3.51Å; D746-G750 WeakPolarHBondContact O-CA 3.12Å; D746-G750 PolarHBondContact O-N 3.05Å; E747-G750 PolarHBondContact O-N 3.25Å; G750-N752 VanDerWaalsContact C-N 3.32Å
751	L	72.8	Confident	58.3	Low	47.6667 Å²	47.6667	110.3 Å²	110.3	25%	0.25	55%	0.549	C	S	.	.			trans	-94	108.6	-177.1	-58.4	175.4	0	0	0	112.8	L197 K228 Y229 S232 D746 Y749 K753	L197-L751 HydrophobicContact CD2-CD1 3.44Å; L197-L751 VanDerWaalsContact CD2-CD1 3.44Å; K228-L751 WeakPolarHBondContact CE-O 3.35Å; K228-L751 HydrophobicContact CG-CB 4.17Å; Y229-L751 HydrophobicContact CD1-CD1 3.91Å; Y229-L751 HydrophobicContact CE1-CD1 4.13Å; S232-L751 VanDerWaalsContact OG-CD2 3.25Å; S232-L751 WeakPolarHBondContact OG-CD2 3.33Å; D746-L751 HydrophobicContact CB-CB 4.16Å; D746-L751 PolarHBondContact O-N 3.02Å; Y749-L751 VanDerWaalsContact C-N 3.31Å; Y749-L751 PolarHBondContact O-N 3.14Å; L751-K753 PolarHBondContact O-N 3.05Å
752	N	61.9	Low	56.1	Low	124 Å²	124	113.9 Å²	113.9	66%	0.663	57%	0.567	S	S	*	*			trans	-70.6	115.8	-178.1	-70.9	-9.5	0	0	0	112.8	G750 N754	G750-N752 VanDerWaalsContact C-N 3.32Å; N752-N754 VanDerWaalsContact C-N 3.32Å; N752-N754 PolarHBondContact O-N 2.91Å
753	K	50.7	Low	53.8	Low	170 Å²	170	116.9 Å²	116.9	74%	0.739	59%	0.589	S	S	*	*			trans	-92.1	30.2	175.3	-75.4	-173.6	177.1	-179.8	0	114.2	E747 L751 I755	E747-K753 WeakPolarHBondContact OE1-CE 3.45Å; E747-K753 IonicContact OE1-NZ 3.79Å; E747-K753 PolarHBondContact OE1-NZ 2.77Å; L751-K753 PolarHBondContact O-N 3.05Å; K753-I755 PolarHBondContact O-N 2.76Å
754	N	43.6	Very low	51.4	Low	130.667 Å²	130.667	121.1 Å²	121.1	70%	0.699	61%	0.606	S	S	*	*			trans	-83.9	98.6	178.2	-77.4	-8.1	0	0	0	112.5	N752 S756	N752-N754 VanDerWaalsContact C-N 3.32Å; N752-N754 PolarHBondContact O-N 2.91Å; N754-S756 PolarHBondContact O-N 3.49Å
755	I	39.5	Very low	49	Very low	122.333 Å²	122.333	122.7 Å²	122.7	63%	0.627	62%	0.622	S	S	*	*			trans	-82.9	105.5	169.6	-57.6	168.4	0	0	0	108.4	K753 Y757	K753-I755 PolarHBondContact O-N 2.76Å; I755-Y757 PolarHBondContact O-N 2.88Å; I755-Y757 VanDerWaalsContact O-N 3.16Å
756	S	33.6	Very low	46.5	Very low	91 Å²	91	129.8 Å²	129.8	64%	0.636	66%	0.655	S	S	*	*			trans	-85.9	116.5	170.8	93.1	0	0	0	0	108.5	N754 H758	N754-S756 PolarHBondContact O-N 3.49Å; S756-H758 PolarHBondContact O-N 3.24Å
757	Y	35.3	Very low	44.1	Very low	165 Å²	165	136.3 Å²	136.3	65%	0.647	68%	0.684	S	S	*	*			trans	-80.1	108.9	169.4	-91.9	-88.8	0	0	0	108.3	I755 F759	I755-Y757 PolarHBondContact O-N 2.88Å; I755-Y757 VanDerWaalsContact O-N 3.16Å; Y757-F759 PolarHBondContact O-N 2.67Å
758	H	30.6	Very low	41.7	Very low	150.667 Å²	150.667	137.1 Å²	137.1	70%	0.698	69%	0.693	S	S	*	*			trans	-75.2	101.7	174.4	-85.9	-77.8	0	0	0	109.1	S756 N760 K1185	S756-H758 PolarHBondContact O-N 3.24Å; H758-N760 VanDerWaalsContact C-N 3.27Å; H758-N760 PolarHBondContact O-N 3.49Å; H758-K1185 WeakPolarHBondContact NE2-CD 3.26Å; H758-K1185 PolarHBondContact NE2-NZ 2.75Å; H758-K1185 VanDerWaalsContact NE2-NZ 3.19Å
759	F	31.9	Very low	39.4	Very low	184.333 Å²	184.333	140.2 Å²	140.2	81%	0.808	71%	0.709	S	S	*	*			trans	-96.7	97.5	157.1	-86	-82	0	0	0	107.5	Y757 L761	Y757-F759 PolarHBondContact O-N 2.67Å; F759-L761 VanDerWaalsContact C-N 3.34Å; F759-L761 PolarHBondContact O-N 3.04Å
760	N	29	Very low	37	Very low	141.333 Å²	141.333	142.3 Å²	142.3	76%	0.756	73%	0.727	S	S	*	*			trans	-75.4	85	173.7	-105.4	-20.1	0	0	0	109.4	H758 K762	H758-N760 VanDerWaalsContact C-N 3.27Å; H758-N760 PolarHBondContact O-N 3.49Å; N760-K762 PolarHBondContact O-N 3.44Å
761	L	29.4	Very low	34.9	Very low	161.667 Å²	161.667	146.6 Å²	146.6	85%	0.846	74%	0.736	S	S	*	*			trans	-80.9	75.9	157.3	-87.3	155.8	0	0	0	107.4	F759 T763	F759-L761 VanDerWaalsContact C-N 3.34Å; F759-L761 PolarHBondContact O-N 3.04Å; L761-T763 PolarHBondContact O-N 3.32Å
762	K	28.8	Very low	32.7	Very low	180 Å²	180	149.2 Å²	149.2	78%	0.783	76%	0.758	S	S	*	*			trans	-111.7	90.8	164.9	-77	-172.1	177.4	179.6	0	108.7	N760 K764	N760-K762 PolarHBondContact O-N 3.44Å; K762-K764 VanDerWaalsContact C-N 3.32Å; K762-K764 PolarHBondContact O-N 3.47Å
763	T	27.2	Very low	31.1	Very low	134 Å²	134	150.6 Å²	150.6	82%	0.822	76%	0.763	S	S	*	*			trans	-80.3	121.9	151.4	31.9	0	0	0	0	108.6	L761 T765	L761-T763 PolarHBondContact O-N 3.32Å; T763-T765 VanDerWaalsContact C-N 3.27Å; T763-T765 PolarHBondContact O-N 3.02Å
764	K	28.7	Very low	29.8	Very low	198.333 Å²	198.333	149.6 Å²	149.6	86%	0.862	77%	0.766	S	S	*	*			trans	-108.8	100.9	161.1	-77.5	-174.3	175.3	-176.8	0	111	K762 Q766	K762-K764 VanDerWaalsContact C-N 3.32Å; K762-K764 PolarHBondContact O-N 3.47Å; K764-Q766 PolarHBondContact O-N 3.12Å
765	T	26.6	Very low	29.1	Very low	128.333 Å²	128.333	148.3 Å²	148.3	79%	0.787	76%	0.764	S	S	*	*			trans	-79.1	107.6	157.6	24.5	0	0	0	0	109.7	T763 E767	T763-T765 VanDerWaalsContact C-N 3.27Å; T763-T765 PolarHBondContact O-N 3.02Å; T765-E767 HydrophobicContact CG2-CG 4.31Å
766	Q	27.3	Very low	28.5	Very low	186 Å²	186	151.1 Å²	151.1	87%	0.869	77%	0.772	S	S	*	*			trans	-134.4	97	149.3	-91	-178.2	-21.7	0	0	105.2	K764	K764-Q766 PolarHBondContact O-N 3.12Å
767	E	26.9	Very low	28.1	Very low	164.333 Å²	164.333	154.3 Å²	154.3	77%	0.768	78%	0.777	S	S	*	*			trans	-54	111.6	138.9	-83.2	175.8	-177.6	0	0	110.5	T765	T765-E767 HydrophobicContact CG2-CG 4.31Å
768	N	27.2	Very low	27.7	Very low	148.667 Å²	148.667	153.6 Å²	153.6	80%	0.795	78%	0.784	S	S	*	*			trans	102.1	99.2	145.4	-66.7	-21.4	0	0	0	116.6
769	L	27.2	Very low	27.5	Very low	149.667 Å²	149.667	156.1 Å²	156.1	78%	0.784	79%	0.789	S	S	*	*			trans	-146.5	114.5	143.7	-98.3	123.4	0	0	0	114	N771	L769-N771 PolarHBondContact O-N 3.21Å
770	D	28	Very low	27.4	Very low	146.667 Å²	146.667	154 Å²	154	78%	0.784	78%	0.779	S	S	*	*			trans	-56.3	109.4	166.1	-73.7	-34.4	0	0	0	116.2	S772	D770-S772 VanDerWaalsContact C-N 3.27Å; D770-S772 PolarHBondContact O-N 3.04Å
771	N	26	Very low	27.5	Very low	154 Å²	154	157.3 Å²	157.3	82%	0.824	78%	0.781	S	S	*	*			trans	-44.4	91.7	159.3	-70.9	-27.9	0	0	0	114.2	L769 I773	L769-N771 PolarHBondContact O-N 3.21Å; N771-I773 PolarHBondContact O-N 2.91Å
772	S	26.8	Very low	27.9	Very low	102 Å²	102	152.4 Å²	152.4	71%	0.713	76%	0.76	S	S	*	*			trans	-135	109.7	149	57.7	0	0	0	0	110.8	D770 L774	D770-S772 VanDerWaalsContact C-N 3.27Å; D770-S772 PolarHBondContact O-N 3.04Å; S772-L774 PolarHBondContact O-N 3.24Å
773	I	27.8	Very low	28.7	Very low	153 Å²	153	145.2 Å²	145.2	79%	0.785	74%	0.737	S	S	*	*			trans	-40.3	111.8	164.1	-61.5	161.8	0	0	0	111.5	N771 P775	N771-I773 PolarHBondContact O-N 2.91Å; I773-P775 VanDerWaalsContact O-CD 3.29Å; I773-P775 WeakPolarHBondContact O-CD 3.37Å
774	L	24.4	Very low	29.9	Very low	150 Å²	150	142.6 Å²	142.6	79%	0.785	71%	0.712	S	S	*	*			trans	-53.7	126	169.4	-81.5	133.9	0	0	0	113.1	S772 K776	S772-L774 PolarHBondContact O-N 3.24Å; L774-K776 PolarHBondContact O-N 3.41Å
775	P	28.5	Very low	31.4	Very low	102.333 Å²	102.333	136.6 Å²	136.6	67%	0.665	69%	0.686	S	S	*	*			trans	-71.3	135.4	-179.8	17.5	-14.9	0	0	0	110.8	I773 H777	I773-P775 VanDerWaalsContact O-CD 3.29Å; I773-P775 WeakPolarHBondContact O-CD 3.37Å; P775-H777 PolarHBondContact O-N 2.91Å; P775-H777 VanDerWaalsContact O-N 3.08Å
776	K	27.2	Very low	33.3	Very low	181.667 Å²	181.667	133.2 Å²	133.2	79%	0.79	67%	0.667	S	S	*	*			trans	-58.9	109.1	176.9	-69.7	173.7	178.2	173.2	0	109.4	L774 D778	L774-K776 PolarHBondContact O-N 3.41Å; K776-D778 PolarHBondContact O-N 3.48Å
777	H	25.8	Very low	35.8	Very low	159 Å²	159	124.4 Å²	124.4	74%	0.736	63%	0.626	S	S	*	*			trans	-79.7	121.9	170.2	-85.9	-67	0	0	0	110.7	P775 Y779	P775-H777 PolarHBondContact O-N 2.91Å; P775-H777 VanDerWaalsContact O-N 3.08Å; H777-Y779 VanDerWaalsContact O-CD2 3.22Å; H777-Y779 WeakPolarHBondContact O-CD2 3.36Å; H777-Y779 PolarHBondContact O-N 3.39Å; H777-Y779 VanDerWaalsContact O-N 3.1Å
778	D	25.9	Very low	38.4	Very low	149 Å²	149	118.8 Å²	118.8	80%	0.797	60%	0.6	S	S	*	*			trans	-63	114	179.9	-71	-44.2	0	0	0	112.2	K776	K776-D778 PolarHBondContact O-N 3.48Å
779	Y	27.3	Very low	41.4	Very low	204.333 Å²	204.333	111.7 Å²	111.7	80%	0.801	56%	0.562	S	S	*	*			trans	-110.5	112.4	165.6	-71.8	-85.3	0	0	0	109.4	H777 R781	H777-Y779 VanDerWaalsContact O-CD2 3.22Å; H777-Y779 WeakPolarHBondContact O-CD2 3.36Å; H777-Y779 PolarHBondContact O-N 3.39Å; H777-Y779 VanDerWaalsContact O-N 3.1Å; Y779-R781 PolarHBondContact O-N 2.95Å
780	F	28.5	Very low	44.4	Very low	139.667 Å²	139.667	104.7 Å²	104.7	61%	0.613	53%	0.525	S	S	*	.			trans	36.6	103	149.6	-76.8	-96	0	0	0	114.2	S782 N1208 Q1212 Y1243	F780-S782 PolarHBondContact O-N 3.28Å; F780-N1208 WeakPolarHBondContact CE1-O 2.87Å; F780-N1208 HydrophobicContact CZ-CB 4.37Å; F780-N1208 WeakPolarHBondContact CZ-O 3.32Å; F780-Q1212 HydrophobicContact CB-CG 3.82Å; F780-Q1212 HydrophobicContact CD1-CB 3.47Å; F780-Q1212 VanDerWaalsContact CD1-CB 3.47Å; F780-Q1212 HydrophobicContact CD1-CG 3.05Å; F780-Q1212 VanDerWaalsContact CD2-NE2 3.29Å; F780-Q1212 HydrophobicContact CE1-CB 3.65Å; F780-Q1212 HydrophobicContact CE1-CG 3.58Å; F780-Q1212 VanDerWaalsContact CE1-OE1 3.31Å; F780-Q1212 VanDerWaalsContact CG-CD 3.44Å; F780-Q1212 HydrophobicContact CG-CG 3.73Å; F780-Y1243 HydrophobicContact CE2-CD1 4.29Å; F780-Y1243 HydrophobicContact CE2-CE1 4.32Å
781	R	31.2	Very low	47.3	Very low	211.667 Å²	211.667	97.8 Å²	97.8	80%	0.799	49%	0.488	S	S	*	.			trans	-71.3	105.8	169.1	-70.9	-179.6	-179.4	-171.2	-0.5	109.8	Y779 G783 I1145	Y779-R781 PolarHBondContact O-N 2.95Å; R781-G783 PolarHBondContact O-N 2.88Å; R781-I1145 HydrophobicContact CB-CD1 4.07Å
782	S	39	Very low	50.4	Low	57.6667 Å²	57.6667	90.5 Å²	90.5	40%	0.403	45%	0.449	S	S	.	.			trans	-81.4	118.5	150.6	53.4	0	0	0	0	107.7	F780 W784	F780-S782 PolarHBondContact O-N 3.28Å; S782-W784 VanDerWaalsContact C-N 3.35Å; S782-W784 PolarHBondContact O-N 2.99Å; S782-W784 PolarHBondContact OG-O 3.39Å
783	G	44.6	Very low	53.3	Low	28.6667 Å²	28.6667	85.9 Å²	85.9	30%	0.296	42%	0.417	S	S	.	.	S	Bend	trans	-27.3	-34.3	172.8	0	0	0	0	0	114.8	R781 K785 R822 S1144 N1213	R781-G783 PolarHBondContact O-N 2.88Å; G783-K785 PolarHBondContact O-N 2.77Å; G783-R822 VanDerWaalsContact O-CB 3.32Å; G783-R822 WeakPolarHBondContact O-CB 3.06Å; G783-R822 VanDerWaalsContact O-O 3.11Å; G783-S1144 PolarHBondContact N-OG 3.4Å; G783-N1213 PolarHBondContact N-OD1 2.94Å
784	W	52.7	Low	56	Low	79.6667 Å²	79.6667	79 Å²	79	30%	0.302	38%	0.382	S	S	.	.			trans	-79.4	114.1	-178.1	-68.1	90.3	0	0	0	113.1	S782 A818 L819 R822 H824 Y1054	S782-W784 VanDerWaalsContact C-N 3.35Å; S782-W784 PolarHBondContact O-N 2.99Å; S782-W784 PolarHBondContact OG-O 3.39Å; W784-A818 HydrophobicContact CH2-CB 3.84Å; W784-A818 WeakPolarHBondContact CH2-O 3.36Å; W784-A818 HydrophobicContact CZ3-CB 3.77Å; W784-L819 HydrophobicContact CH2-CB 4.48Å; W784-L819 HydrophobicContact CH2-CD2 3.55Å; W784-L819 HydrophobicContact CH2-CG 4.46Å; W784-L819 HydrophobicContact CZ2-CD2 4.44Å; W784-L819 HydrophobicContact CZ3-CD2 3.99Å; W784-R822 CarbonylContact C-O 3.57Å; W784-R822 WeakPolarHBondContact CA-O 3.24Å; W784-R822 HydrophobicContact CD2-CB 3.89Å; W784-R822 HydrophobicContact CD2-CG 4.36Å; W784-R822 VanDerWaalsContact CE3-C 3.48Å; W784-R822 VanDerWaalsContact CE3-CA 3.5Å; W784-R822 HydrophobicContact CE3-CB 4.1Å; W784-R822 HydrophobicContact CG-CB 4.23Å; W784-R822 HydrophobicContact CZ2-CB 4.36Å; W784-R822 HydrophobicContact CZ2-CG 4.29Å; W784-R822 HydrophobicContact CZ3-CB 4.43Å; W784-H824 AromaticContact CD2-NE2 3.75Å; W784-H824 AromaticContact CE3-CD2 3.78Å; W784-H824 AromaticContact CE3-CE1 3.82Å; W784-H824 AromaticContact CE3-NE2 3.59Å; W784-H824 AromaticContact CG-NE2 3.97Å; W784-Y1054 HydrophobicContact CZ2-CE1 4.2Å; W784-Y1054 AromaticContact NE1-CE1 3.99Å
785	K	59.8	Low	58.4	Low	72.6667 Å²	72.6667	76.8 Å²	76.8	32%	0.316	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	156.4	170	-57.5	177.1	-174.2	168.1	0	109.2	G783 R822 V823 H824 F1019 N1021	G783-K785 PolarHBondContact O-N 2.77Å; K785-R822 PolarHBondContact N-O 3.21Å; K785-V823 HydrophobicContact CB-CG1 4.29Å; K785-V823 HydrophobicContact CB-CG2 4.27Å; K785-V823 CarbonylContact O-C 3.54Å; K785-V823 VanDerWaalsContact O-CA 3.26Å; K785-V823 WeakPolarHBondContact O-CA 3.41Å; K785-V823 WeakPolarHBondContact O-CG1 3.44Å; K785-H824 PolarHBondContact O-N 2.95Å; K785-F1019 HydrophobicContact CB-CD1 3.99Å; K785-F1019 HydrophobicContact CB-CE1 3.93Å; K785-F1019 HydrophobicContact CD-CB 4.26Å; K785-F1019 HydrophobicContact CD-CD1 3.33Å; K785-F1019 VanDerWaalsContact CD-CD1 3.46Å; K785-F1019 HydrophobicContact CD-CE1 3.95Å; K785-F1019 HydrophobicContact CD-CG 4.22Å; K785-F1019 HydrophobicContact CG-CD1 4.29Å; K785-F1019 HydrophobicContact CG-CE1 4.49Å; K785-F1019 PolarHBondContact NZ-O 3.25Å; K785-N1021 PolarHBondContact NZ-OD1 2.95Å
786	C	66.2	Low	60.7	Low	57.3333 Å²	57.3333	79.4 Å²	79.4	39%	0.387	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	138.2	173.2	-171.6	0	0	0	0	108.6	H824 N826 S1236	C786-H824 CarbonylContact C-O 3.55Å; C786-H824 WeakPolarHBondContact CA-O 3.36Å; C786-N826 PolarHBondContact SG-ND2 2.89Å; C786-S1236 VanDerWaalsContact CB-OG 3.28Å; C786-S1236 WeakPolarHBondContact CB-OG 3.46Å
787	C	80	Confident	63.3	Low	0 Å²	0	70.8 Å²	70.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	117.8	177.1	-177	0	0	0	0	109.2	V823 H824 L825 N826 D856 L1015 F1019	C787-V823 HydrophobicContact CB-CG1 3.59Å; C787-V823 VanDerWaalsContact CB-CG1 3.48Å; C787-H824 PolarHBondContact N-O 3.19Å; C787-L825 HydrophobicContact CB-CD1 4.15Å; C787-N826 PolarHBondContact O-N 2.95Å; C787-D856 WeakPolarHBondContact CA-OD2 3.38Å; C787-L1015 HydrophobicContact CB-CD2 4.18Å; C787-L1015 VanDerWaalsContact SG-CD2 3.52Å; C787-F1019 HydrophobicContact CB-CE2 3.58Å; C787-F1019 HydrophobicContact CB-CZ 3.63Å
788	Q	83.2	Confident	66.2	Low	47 Å²	47	63.2 Å²	63.2	22%	0.22	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	117.3	173.1	-66.6	-170.9	-38.5	0	0	110.6	N826 I828 A854 D856 I857	Q788-N826 WeakPolarHBondContact CA-O 3.38Å; Q788-I828 HydrophobicContact CB-CD1 4.17Å; Q788-I828 HydrophobicContact CG-CD1 4.45Å; Q788-A854 PolarHBondContact OE1-O 3.18Å; Q788-D856 PolarHBondContact N-OD2 3.38Å; Q788-D856 PolarHBondContact O-N 3Å; Q788-I857 PolarHBondContact O-N 2.79Å
789	L	88.8	Confident	68.8	Low	0 Å²	0	57.9 Å²	57.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	104.1	176.8	-175.9	95.9	0	0	0	109.2	I791 V810 L825 N826 E827 I828 I857 V859 F1007 V1011	L789-I791 HydrophobicContact CD2-CD1 3.98Å; L789-I791 HydrophobicContact CD2-CG1 3.63Å; L789-V810 HydrophobicContact CD2-CG1 4.46Å; L789-V810 HydrophobicContact CD2-CG2 3.93Å; L789-L825 HydrophobicContact CB-CD1 3.95Å; L789-L825 HydrophobicContact CD1-CD1 4.28Å; L789-L825 HydrophobicContact CD2-CD1 4.4Å; L789-L825 HydrophobicContact CD2-CD2 4.43Å; L789-N826 PolarHBondContact N-O 3.11Å; L789-E827 HydrophobicContact CD2-CB 4.4Å; L789-E827 CarbonylContact O-C 3.55Å; L789-E827 VanDerWaalsContact O-CA 3.27Å; L789-E827 WeakPolarHBondContact O-CA 3.16Å; L789-I828 PolarHBondContact O-N 3.02Å; L789-I857 CarbonylContact C-O 3.57Å; L789-I857 WeakPolarHBondContact CA-O 3.36Å; L789-I857 HydrophobicContact CD1-CB 3.92Å; L789-I857 HydrophobicContact CD1-CD1 4.49Å; L789-I857 HydrophobicContact CD1-CG2 3.72Å; L789-I857 VanDerWaalsContact CD1-CG2 3.45Å; L789-V859 HydrophobicContact CD1-CG2 3.66Å; L789-V859 VanDerWaalsContact CD1-CG2 3.42Å; L789-V859 HydrophobicContact CD2-CG2 4.29Å; L789-V859 HydrophobicContact CG-CG2 4.01Å; L789-F1007 HydrophobicContact CD2-CZ 4.27Å; L789-V1011 HydrophobicContact CD1-CG1 4.23Å; L789-V1011 HydrophobicContact CD1-CG2 4.47Å
790	F	90.3	Very high	71.5	Confident	1.66667 Å²	1.66667	48.7 Å²	48.7	1%	0.007	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	127.8	178.3	-175.8	-96.6	0	0	0	110.6	I828 L830 Q851 A852 I857 F858 V859 E900	F790-I828 HydrophobicContact CD2-CB 3.89Å; F790-I828 HydrophobicContact CD2-CD1 4.47Å; F790-I828 HydrophobicContact CD2-CG2 3.68Å; F790-I828 HydrophobicContact CE2-CG2 4.01Å; F790-L830 HydrophobicContact CE2-CD1 3.79Å; F790-L830 HydrophobicContact CE2-CG 4.14Å; F790-L830 HydrophobicContact CZ-CD1 4.08Å; F790-Q851 HydrophobicContact CD2-CB 3.81Å; F790-Q851 HydrophobicContact CE2-CB 3.63Å; F790-Q851 HydrophobicContact CZ-CB 4.49Å; F790-A852 HydrophobicContact CD1-CB 4.4Å; F790-A852 HydrophobicContact CE1-CB 4.13Å; F790-A852 HydrophobicContact CZ-CB 4.41Å; F790-I857 PolarHBondContact N-O 3.4Å; F790-F858 HydrophobicContact CB-CD2 4.36Å; F790-F858 AromaticContact CD1-CD2 3.51Å; F790-F858 HydrophobicContact CD1-CD2 3.51Å; F790-F858 VanDerWaalsContact CD1-CD2 3.45Å; F790-F858 AromaticContact CD1-CE2 3.35Å; F790-F858 HydrophobicContact CD1-CE2 3.35Å; F790-F858 HydrophobicContact CD1-CZ 4.37Å; F790-F858 HydrophobicContact CE1-CD2 4.25Å; F790-F858 AromaticContact CE1-CE2 3.63Å; F790-F858 HydrophobicContact CE1-CE2 3.63Å; F790-F858 HydrophobicContact CE1-CZ 4.43Å; F790-F858 HydrophobicContact CG-CD2 4.33Å; F790-F858 HydrophobicContact CG-CE2 4.45Å; F790-V859 PolarHBondContact O-N 3.28Å; F790-E900 HydrophobicContact CE1-CG 4.42Å
791	I	89.6	Confident	74.4	Confident	1.66667 Å²	1.66667	42 Å²	42	1%	0.009	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	109.1	179.9	-55.9	171.7	0	0	0	108.7	L789 R802 L805 V810 E827 I828 V859 L861	L789-I791 HydrophobicContact CD2-CD1 3.98Å; L789-I791 HydrophobicContact CD2-CG1 3.63Å; I791-R802 HydrophobicContact CG2-CG 4.31Å; I791-R802 PolarHBondContact O-NH2 2.91Å; I791-L805 HydrophobicContact CD1-CB 4.34Å; I791-L805 HydrophobicContact CD1-CD1 4.2Å; I791-L805 HydrophobicContact CG2-CD1 4.07Å; I791-V810 HydrophobicContact CD1-CG2 4.49Å; I791-E827 HydrophobicContact CD1-CB 4.34Å; I791-I828 PolarHBondContact N-O 3.27Å; I791-I828 VanDerWaalsContact N-O 3.15Å; I791-V859 HydrophobicContact CG1-CB 4.49Å; I791-L861 HydrophobicContact CG2-CD1 4.38Å
792	S	90.6	Very high	76.9	Confident	1.33333 Å²	1.33333	32.1 Å²	32.1	1%	0.009	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	132.9	174.6	-176.6	0	0	0	0	110.5	F858 V859 L860 L861 E900	S792-F858 VanDerWaalsContact CB-CZ 3.43Å; S792-V859 PolarHBondContact N-O 3.37Å; S792-L860 CarbonylContact O-C 3.56Å; S792-L860 WeakPolarHBondContact O-CA 3.32Å; S792-L861 PolarHBondContact O-N 3.09Å; S792-E900 VanDerWaalsContact CB-OE2 3.3Å; S792-E900 WeakPolarHBondContact CB-OE2 3.3Å; S792-E900 PolarHBondContact OG-OE2 3.39Å
793	S	88.8	Confident	79	Confident	6 Å²	6	32.4 Å²	32.4	4%	0.042	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	163.2	172.3	78.5	0	0	0	0	110.1	F795 R802 L861	S793-F795 PolarHBondContact O-N 3.27Å; S793-R802 VanDerWaalsContact OG-CD 3.3Å; S793-R802 WeakPolarHBondContact OG-CD 3.33Å; S793-R802 PolarHBondContact OG-NE 3.19Å; S793-R802 PolarHBondContact OG-NH1 3.04Å; S793-R802 VanDerWaalsContact OG-NH1 3.09Å; S793-L861 WeakPolarHBondContact CA-O 3.24Å; S793-L861 WeakPolarHBondContact CB-O 3.28Å
794	T	83.9	Confident	80.8	Confident	8.33333 Å²	8.33333	32.9 Å²	32.9	5%	0.051	15%	0.153	C	C	.	.			trans	-67.8	131.6	160.3	44.3	0	0	0	0	109.6	D797 M798 R865 G867	T794-D797 WeakPolarHBondContact CB-OD1 3.26Å; T794-D797 VanDerWaalsContact OG1-CG 3.24Å; T794-D797 PolarHBondContact OG1-OD1 2.98Å; T794-D797 PolarHBondContact OG1-OD2 3.35Å; T794-M798 WeakPolarHBondContact O-CB 3.37Å; T794-R865 HydrophobicContact CG2-CB 4.2Å; T794-G867 VanDerWaalsContact CG2-CA 3.49Å
795	F	74.7	Confident	82.4	Confident	102.667 Å²	102.667	29.1 Å²	29.1	45%	0.45	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-40.1	-169.5	-70.1	-63.4	0	0	0	113.7	S793 D797 H799 R802 R831	S793-F795 PolarHBondContact O-N 3.27Å; F795-D797 VanDerWaalsContact C-N 3.33Å; F795-D797 PolarHBondContact O-N 3.43Å; F795-H799 PolarHBondContact O-CD2 3.47Å; F795-H799 PolarHBondContact O-CE1 3.3Å; F795-H799 VanDerWaalsContact O-CE1 3.22Å; F795-H799 PolarHBondContact O-ND1 3.29Å; F795-H799 PolarHBondContact O-NE2 3.13Å; F795-R802 VanDerWaalsContact CE1-NH1 3.31Å; F795-R831 HydrophobicContact CD1-CG 3.49Å; F795-R831 VanDerWaalsContact CD1-CG 3.48Å; F795-R831 HydrophobicContact CE1-CB 4.3Å; F795-R831 HydrophobicContact CE1-CG 3.32Å; F795-R831 HydrophobicContact CG-CG 4.23Å; F795-R831 HydrophobicContact CZ-CG 4.22Å
796	R	75.8	Confident	83.3	Confident	156.667 Å²	156.667	27 Å²	27	59%	0.591	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-38.3	-169.3	-71.9	-173.8	177.7	-172.4	1.7	113.4	H799 R865	R796-H799 PolarHBondContact O-CD2 3.17Å; R796-H799 PolarHBondContact O-ND1 3.18Å; R796-R865 VanDerWaalsContact CD-NH1 3.35Å
797	D	82.7	Confident	83.5	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.005	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-13	-170.6	61	-48.9	0	0	0	114.4	T794 F795 R865 R938 Y953 F954	T794-D797 WeakPolarHBondContact CB-OD1 3.26Å; T794-D797 VanDerWaalsContact OG1-CG 3.24Å; T794-D797 PolarHBondContact OG1-OD1 2.98Å; T794-D797 PolarHBondContact OG1-OD2 3.35Å; F795-D797 VanDerWaalsContact C-N 3.33Å; F795-D797 PolarHBondContact O-N 3.43Å; D797-R865 HydrophobicContact CB-CG 4.14Å; D797-R938 PolarHBondContact O-NH1 3.2Å; D797-R938 PolarHBondContact O-NH2 2.98Å; D797-R938 IonicContact OD2-NH2 3.31Å; D797-Y953 WeakPolarHBondContact CB-O 3.34Å; D797-F954 HydrophobicContact CB-CB 4.42Å; D797-F954 HydrophobicContact CB-CD1 3.88Å; D797-F954 HydrophobicContact CB-CG 4.45Å
798	M	86.1	Confident	83.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.156	C	C	.	.	S	Bend	trans	-118.8	21.2	-174.8	-61.9	-64.9	-158.5	0	0	113.8	T794 A800 E801 R802 L861 L862 R938 Y983	T794-M798 WeakPolarHBondContact O-CB 3.37Å; M798-A800 VanDerWaalsContact C-N 3.34Å; M798-A800 PolarHBondContact O-N 3.25Å; M798-E801 VanDerWaalsContact C-OE2 3.3Å; M798-E801 VanDerWaalsContact CA-OE2 3.27Å; M798-E801 WeakPolarHBondContact CA-OE2 3.35Å; M798-E801 HydrophobicContact CE-CB 4.42Å; M798-E801 HydrophobicContact CE-CG 3.93Å; M798-E801 HydrophobicContact SD-CB 4.42Å; M798-E801 VanDerWaalsContact SD-CD 3.58Å; M798-E801 HydrophobicContact SD-CG 4.11Å; M798-R802 WeakPolarHBondContact O-CG 3.44Å; M798-R802 PolarHBondContact O-N 3.14Å; M798-L861 HydrophobicContact CE-CB 3.97Å; M798-L861 HydrophobicContact CG-CB 4.4Å; M798-L861 HydrophobicContact SD-CB 4.39Å; M798-L862 WeakPolarHBondContact CE-O 3.36Å; M798-R938 HydrophobicContact CE-CB 4.1Å; M798-R938 PolarHBondContact SD-NH1 3.37Å; M798-Y983 WeakPolarHBondContact CE-OH 3.28Å
799	H	81.6	Confident	83.4	Confident	38.3333 Å²	38.3333	28.6 Å²	28.6	18%	0.177	15%	0.149	C	C	.	.	H	α-helix	trans	-64.8	-38.4	-177	30.3	-78.8	0	0	0	112.1	F795 R796 R802 D803 R831 P995 V996	F795-H799 PolarHBondContact O-CD2 3.47Å; F795-H799 PolarHBondContact O-CE1 3.3Å; F795-H799 VanDerWaalsContact O-CE1 3.22Å; F795-H799 PolarHBondContact O-ND1 3.29Å; F795-H799 PolarHBondContact O-NE2 3.13Å; R796-H799 PolarHBondContact O-CD2 3.17Å; R796-H799 PolarHBondContact O-ND1 3.18Å; H799-R802 PolarHBondContact O-N 3.02Å; H799-D803 VanDerWaalsContact O-CB 3.3Å; H799-D803 WeakPolarHBondContact O-CB 3.42Å; H799-D803 PolarHBondContact O-N 3.23Å; H799-R831 PolarHBondContact O-NH1 3.14Å; H799-P995 PolarHBondContact CE1-O 3Å; H799-P995 PolarHBondContact NE2-O 3.15Å; H799-P995 VanDerWaalsContact NE2-O 3.08Å; H799-V996 WeakPolarHBondContact NE2-CA 3.24Å
800	A	83.8	Confident	83.1	Confident	9.66667 Å²	9.66667	28.6 Å²	28.6	8%	0.08	15%	0.149	C	C	.	.	H	α-helix	trans	-64.3	-45.9	-179.2	0	0	0	0	0	112	M798 R802 D803 L804 V996 M997 L1000	M798-A800 VanDerWaalsContact C-N 3.34Å; M798-A800 PolarHBondContact O-N 3.25Å; A800-R802 PolarHBondContact O-N 3.33Å; A800-D803 PolarHBondContact O-N 2.94Å; A800-L804 WeakPolarHBondContact O-CB 3.18Å; A800-L804 PolarHBondContact O-N 3.15Å; A800-V996 HydrophobicContact CB-CG1 3.71Å; A800-M997 HydrophobicContact CB-CB 4.26Å; A800-M997 WeakPolarHBondContact CB-O 3.2Å; A800-L1000 HydrophobicContact CB-CD1 4.01Å
801	E	88.8	Confident	82.2	Confident	0.5 Å²	0.5	29.5 Å²	29.5	0%	0.002	16%	0.155	C	C	.	.	H	α-helix	trans	-63.5	-45.5	177.7	-64.8	87.3	160.2	0	0	110.8	M798 D803 L804 L805 L861 R938 Y983 L1000 F1003	M798-E801 VanDerWaalsContact C-OE2 3.3Å; M798-E801 VanDerWaalsContact CA-OE2 3.27Å; M798-E801 WeakPolarHBondContact CA-OE2 3.35Å; M798-E801 HydrophobicContact CE-CB 4.42Å; M798-E801 HydrophobicContact CE-CG 3.93Å; M798-E801 HydrophobicContact SD-CB 4.42Å; M798-E801 VanDerWaalsContact SD-CD 3.58Å; M798-E801 HydrophobicContact SD-CG 4.11Å; E801-D803 VanDerWaalsContact C-N 3.34Å; E801-D803 PolarHBondContact O-N 3.05Å; E801-L804 PolarHBondContact O-N 3.3Å; E801-L805 WeakPolarHBondContact O-CB 3.36Å; E801-L805 VanDerWaalsContact O-CG 3.29Å; E801-L805 WeakPolarHBondContact O-CG 3.29Å; E801-L805 PolarHBondContact O-N 2.98Å; E801-L861 HydrophobicContact CB-CD1 4.08Å; E801-R938 IonicContact OE1-CZ 3.51Å; E801-R938 IonicContact OE1-NH1 3.37Å; E801-R938 PolarHBondContact OE1-NH1 3.19Å; E801-R938 IonicContact OE2-NH1 3.58Å; E801-Y983 HydrophobicContact CG-CE2 4.29Å; E801-Y983 WeakPolarHBondContact CG-OH 3.37Å; E801-Y983 PolarHBondContact OE1-OH 3.49Å; E801-L1000 HydrophobicContact CG-CD1 4.02Å; E801-L1000 HydrophobicContact CG-CD2 4.03Å; E801-F1003 HydrophobicContact CB-CD1 4.41Å; E801-F1003 HydrophobicContact CB-CE1 3.92Å; E801-F1003 HydrophobicContact CB-CZ 4.17Å; E801-F1003 HydrophobicContact CG-CD1 4.34Å; E801-F1003 HydrophobicContact CG-CE1 4.32Å
802	R	84.9	Confident	81.4	Confident	3.75 Å²	3.75	30.1 Å²	30.1	1%	0.014	16%	0.16	C	C	.	.	H	α-helix	trans	-66.7	-35.3	176.6	-66.4	-178.4	94.4	126.7	1.3	112.6	I791 S793 F795 M798 H799 A800 L804 L805 C806 D829 R831 L861	I791-R802 HydrophobicContact CG2-CG 4.31Å; I791-R802 PolarHBondContact O-NH2 2.91Å; S793-R802 VanDerWaalsContact OG-CD 3.3Å; S793-R802 WeakPolarHBondContact OG-CD 3.33Å; S793-R802 PolarHBondContact OG-NE 3.19Å; S793-R802 PolarHBondContact OG-NH1 3.04Å; S793-R802 VanDerWaalsContact OG-NH1 3.09Å; F795-R802 VanDerWaalsContact CE1-NH1 3.31Å; M798-R802 WeakPolarHBondContact O-CG 3.44Å; M798-R802 PolarHBondContact O-N 3.14Å; H799-R802 PolarHBondContact O-N 3.02Å; A800-R802 PolarHBondContact O-N 3.33Å; R802-L804 VanDerWaalsContact C-N 3.34Å; R802-L805 WeakPolarHBondContact O-CB 3.17Å; R802-L805 PolarHBondContact O-N 3.11Å; R802-C806 WeakPolarHBondContact O-CB 3.27Å; R802-C806 PolarHBondContact O-N 3.22Å; R802-C806 PolarHBondContact O-SG 3.03Å; R802-C806 VanDerWaalsContact O-SG 3.34Å; R802-D829 IonicContact CZ-OD1 3.37Å; R802-D829 VanDerWaalsContact CZ-OD1 3.29Å; R802-D829 IonicContact NE-OD1 3.27Å; R802-D829 PolarHBondContact NE-OD1 3.02Å; R802-D829 IonicContact NE-OD2 3.35Å; R802-D829 PolarHBondContact NE-OD2 3.11Å; R802-D829 VanDerWaalsContact NH2-CG 3.32Å; R802-D829 IonicContact NH2-OD1 3.63Å; R802-D829 PolarHBondContact NH2-OD1 2.99Å; R802-D829 IonicContact NH2-OD2 3.82Å; R802-R831 VanDerWaalsContact C-NH2 3.26Å; R802-R831 VanDerWaalsContact CB-CZ 3.42Å; R802-R831 VanDerWaalsContact CB-NH2 3.33Å; R802-R831 PolarHBondContact O-NH2 2.99Å; R802-L861 HydrophobicContact CG-CD1 3.96Å
803	D	81.1	Confident	80.9	Confident	63.25 Å²	63.25	30.2 Å²	30.2	34%	0.338	16%	0.161	S	C	.	.	H	α-helix	trans	-67	-39.7	176.6	-73.4	-4.1	0	0	0	111.2	H799 A800 E801 G807 R831	H799-D803 VanDerWaalsContact O-CB 3.3Å; H799-D803 WeakPolarHBondContact O-CB 3.42Å; H799-D803 PolarHBondContact O-N 3.23Å; A800-D803 PolarHBondContact O-N 2.94Å; E801-D803 VanDerWaalsContact C-N 3.34Å; E801-D803 PolarHBondContact O-N 3.05Å; D803-G807 VanDerWaalsContact O-CA 3.28Å; D803-G807 WeakPolarHBondContact O-CA 3.18Å; D803-G807 PolarHBondContact O-N 3.15Å; D803-R831 IonicContact OD1-CZ 2.91Å; D803-R831 VanDerWaalsContact OD1-CZ 3.26Å; D803-R831 IonicContact OD1-NH1 3.04Å; D803-R831 PolarHBondContact OD1-NH1 3Å; D803-R831 IonicContact OD1-NH2 3.53Å; D803-R831 PolarHBondContact OD1-NH2 3.1Å
804	L	84.2	Confident	80.1	Confident	39.5 Å²	39.5	32.1 Å²	32.1	21%	0.207	17%	0.167	C	C	.	.	H	α-helix	trans	-62	-44.4	170.7	-178.1	64.6	0	0	0	111.6	A800 E801 R802 I808 L809 L1000 F1003	A800-L804 WeakPolarHBondContact O-CB 3.18Å; A800-L804 PolarHBondContact O-N 3.15Å; E801-L804 PolarHBondContact O-N 3.3Å; R802-L804 VanDerWaalsContact C-N 3.34Å; L804-I808 HydrophobicContact CD1-CB 4.27Å; L804-I808 HydrophobicContact CD1-CD1 4.01Å; L804-I808 HydrophobicContact CD1-CG1 4.47Å; L804-I808 WeakPolarHBondContact O-CA 3.32Å; L804-I808 WeakPolarHBondContact O-CB 3.34Å; L804-I808 PolarHBondContact O-N 3.1Å; L804-I808 VanDerWaalsContact O-N 3.11Å; L804-L809 HydrophobicContact CD1-CD1 4.4Å; L804-L809 HydrophobicContact CD1-CG 4.35Å; L804-L809 HydrophobicContact CD2-CD1 3.99Å; L804-L809 HydrophobicContact CG-CD1 3.71Å; L804-L809 HydrophobicContact CG-CG 4.02Å; L804-L809 PolarHBondContact O-N 3.17Å; L804-L1000 HydrophobicContact CD2-CB 3.64Å; L804-L1000 HydrophobicContact CD2-CD1 4.23Å; L804-L1000 HydrophobicContact CD2-CG 4.47Å; L804-F1003 HydrophobicContact CD2-CD1 3.98Å; L804-F1003 HydrophobicContact CD2-CE1 4.35Å
805	L	85.7	Confident	79.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.183	C	C	.	.	I	π-helix	trans	-60.2	-57.2	176.9	-73.1	178	0	0	0	112.3	I791 E801 R802 L809 V810 P811 L861 F1003 F1007	I791-L805 HydrophobicContact CD1-CB 4.34Å; I791-L805 HydrophobicContact CD1-CD1 4.2Å; I791-L805 HydrophobicContact CG2-CD1 4.07Å; E801-L805 WeakPolarHBondContact O-CB 3.36Å; E801-L805 VanDerWaalsContact O-CG 3.29Å; E801-L805 WeakPolarHBondContact O-CG 3.29Å; E801-L805 PolarHBondContact O-N 2.98Å; R802-L805 WeakPolarHBondContact O-CB 3.17Å; R802-L805 PolarHBondContact O-N 3.11Å; L805-L809 HydrophobicContact CD2-CB 4.38Å; L805-L809 HydrophobicContact CD2-CD1 3.84Å; L805-L809 HydrophobicContact CG-CD1 4.41Å; L805-L809 PolarHBondContact O-N 3.12Å; L805-V810 HydrophobicContact CB-CG2 4.46Å; L805-V810 VanDerWaalsContact O-CB 3.3Å; L805-V810 WeakPolarHBondContact O-CB 3.39Å; L805-V810 WeakPolarHBondContact O-CG2 3.4Å; L805-V810 PolarHBondContact O-N 3.16Å; L805-P811 WeakPolarHBondContact O-CD 3.46Å; L805-L861 HydrophobicContact CD1-CD1 3.77Å; L805-L861 HydrophobicContact CD1-CD2 4.29Å; L805-L861 HydrophobicContact CD1-CG 4.42Å; L805-F1003 HydrophobicContact CD1-CZ 4.08Å; L805-F1003 HydrophobicContact CD2-CE1 4.12Å; L805-F1003 HydrophobicContact CD2-CZ 3.9Å; L805-F1003 HydrophobicContact CG-CE1 4.06Å; L805-F1003 HydrophobicContact CG-CZ 3.93Å; L805-F1007 HydrophobicContact CD1-CE2 4.28Å; L805-F1007 HydrophobicContact CD2-CB 4.39Å; L805-F1007 HydrophobicContact CD2-CD1 3.43Å; L805-F1007 VanDerWaalsContact CD2-CD1 3.46Å; L805-F1007 HydrophobicContact CD2-CD2 3.44Å; L805-F1007 VanDerWaalsContact CD2-CD2 3.46Å; L805-F1007 HydrophobicContact CD2-CE1 3.37Å; L805-F1007 HydrophobicContact CD2-CE2 3.4Å; L805-F1007 VanDerWaalsContact CD2-CE2 3.44Å; L805-F1007 HydrophobicContact CD2-CG 3.47Å; L805-F1007 VanDerWaalsContact CD2-CG 3.45Å; L805-F1007 HydrophobicContact CD2-CZ 3.37Å; L805-F1007 VanDerWaalsContact CD2-CZ 3.41Å
806	C	78	Confident	78.7	Confident	29 Å²	29	35.5 Å²	35.5	20%	0.196	18%	0.182	C	C	.	.	I	π-helix	trans	-76.1	-32.5	-173.3	-66.6	0	0	0	0	112.7	R802 P811 D829	R802-C806 WeakPolarHBondContact O-CB 3.27Å; R802-C806 PolarHBondContact O-N 3.22Å; R802-C806 PolarHBondContact O-SG 3.03Å; R802-C806 VanDerWaalsContact O-SG 3.34Å; C806-P811 WeakPolarHBondContact O-CD 3.39Å; C806-P811 VanDerWaalsContact O-CG 3.26Å; C806-P811 WeakPolarHBondContact O-CG 3.37Å; C806-D829 PolarHBondContact SG-OD2 3.3Å
807	G	71.7	Confident	78.4	Confident	47.25 Å²	47.25	28.5 Å²	28.5	49%	0.487	16%	0.156	S	C	.	.	I	π-helix	trans	-81.1	-36.4	-178.1	0	0	0	0	0	113.8	D803	D803-G807 VanDerWaalsContact O-CA 3.28Å; D803-G807 WeakPolarHBondContact O-CA 3.18Å; D803-G807 PolarHBondContact O-N 3.15Å
808	I	76.7	Confident	77.6	Confident	77.75 Å²	77.75	28.6 Å²	28.6	40%	0.399	16%	0.157	S	C	.	.	I	π-helix	trans	-127.2	-57.1	-168.5	-56.6	-179.7	0	0	0	112.1	L804 P811 A812	L804-I808 HydrophobicContact CD1-CB 4.27Å; L804-I808 HydrophobicContact CD1-CD1 4.01Å; L804-I808 HydrophobicContact CD1-CG1 4.47Å; L804-I808 WeakPolarHBondContact O-CA 3.32Å; L804-I808 WeakPolarHBondContact O-CB 3.34Å; L804-I808 PolarHBondContact O-N 3.1Å; L804-I808 VanDerWaalsContact O-N 3.11Å; I808-P811 WeakPolarHBondContact O-CD 3.21Å; I808-A812 WeakPolarHBondContact O-CB 3.28Å; I808-A812 PolarHBondContact O-N 3.21Å
809	L	83.3	Confident	76.3	Confident	12 Å²	12	32.5 Å²	32.5	6%	0.063	18%	0.178	C	C	.	.	I	π-helix	trans	-74.2	-47	-165.4	-57.8	171.2	0	0	0	114	L804 L805 A812 L813 F1003 F1007 L1008	L804-L809 HydrophobicContact CD1-CD1 4.4Å; L804-L809 HydrophobicContact CD1-CG 4.35Å; L804-L809 HydrophobicContact CD2-CD1 3.99Å; L804-L809 HydrophobicContact CG-CD1 3.71Å; L804-L809 HydrophobicContact CG-CG 4.02Å; L804-L809 PolarHBondContact O-N 3.17Å; L805-L809 HydrophobicContact CD2-CB 4.38Å; L805-L809 HydrophobicContact CD2-CD1 3.84Å; L805-L809 HydrophobicContact CG-CD1 4.41Å; L805-L809 PolarHBondContact O-N 3.12Å; L809-A812 CarbonylContact O-C 3.34Å; L809-A812 WeakPolarHBondContact O-CA 3.23Å; L809-A812 WeakPolarHBondContact O-CB 3.39Å; L809-A812 PolarHBondContact O-N 3.15Å; L809-A812 VanDerWaalsContact O-N 3.12Å; L809-L813 WeakPolarHBondContact O-CG 3.39Å; L809-L813 PolarHBondContact O-N 3.2Å; L809-F1003 HydrophobicContact CD1-CD1 4.4Å; L809-F1003 HydrophobicContact CD1-CE1 4.14Å; L809-F1007 HydrophobicContact CB-CD1 3.89Å; L809-F1007 HydrophobicContact CB-CE1 3.97Å; L809-F1007 HydrophobicContact CD1-CB 4.42Å; L809-F1007 HydrophobicContact CD1-CD1 3.97Å; L809-F1007 HydrophobicContact CD1-CG 4.42Å; L809-F1007 HydrophobicContact CG-CD1 4.39Å; L809-L1008 HydrophobicContact CB-CD2 4.22Å; L809-L1008 HydrophobicContact CD2-CD1 4.01Å; L809-L1008 HydrophobicContact CD2-CD2 4.3Å; L809-L1008 HydrophobicContact CD2-CG 3.95Å
810	V	82	Confident	75.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.8	-44.2	176.5	175.9	0	0	0	0	111.2	L789 I791 L805 A812 L813 R814 L825 E827 F1007	L789-V810 HydrophobicContact CD2-CG1 4.46Å; L789-V810 HydrophobicContact CD2-CG2 3.93Å; I791-V810 HydrophobicContact CD1-CG2 4.49Å; L805-V810 HydrophobicContact CB-CG2 4.46Å; L805-V810 VanDerWaalsContact O-CB 3.3Å; L805-V810 WeakPolarHBondContact O-CB 3.39Å; L805-V810 WeakPolarHBondContact O-CG2 3.4Å; L805-V810 PolarHBondContact O-N 3.16Å; V810-A812 VanDerWaalsContact C-N 3.27Å; V810-A812 PolarHBondContact O-N 3.25Å; V810-L813 PolarHBondContact O-N 3.32Å; V810-L813 VanDerWaalsContact O-N 3.14Å; V810-R814 VanDerWaalsContact O-CB 3.24Å; V810-R814 WeakPolarHBondContact O-CB 3.29Å; V810-R814 PolarHBondContact O-N 3.04Å; V810-L825 HydrophobicContact CG1-CD2 4.06Å; V810-L825 HydrophobicContact CG1-CG 4.44Å; V810-E827 HydrophobicContact CG1-CB 4.04Å; V810-E827 HydrophobicContact CG1-CG 4.17Å; V810-E827 VanDerWaalsContact CG1-OE2 3.28Å; V810-E827 WeakPolarHBondContact CG1-OE2 3.34Å; V810-F1007 HydrophobicContact CG2-CE1 4.18Å; V810-F1007 HydrophobicContact CG2-CZ 4.06Å
811	P	72.8	Confident	74.5	Confident	20.25 Å²	20.25	35 Å²	35	13%	0.131	21%	0.207	C	C	.	.	H	α-helix	trans	-54.4	-38.8	168.9	-28.8	36.5	0	0	0	113.1	L805 C806 I808 R814 R815	L805-P811 WeakPolarHBondContact O-CD 3.46Å; C806-P811 WeakPolarHBondContact O-CD 3.39Å; C806-P811 VanDerWaalsContact O-CG 3.26Å; C806-P811 WeakPolarHBondContact O-CG 3.37Å; I808-P811 WeakPolarHBondContact O-CD 3.21Å; P811-R814 PolarHBondContact O-N 3.07Å; P811-R815 VanDerWaalsContact CB-NH1 3.29Å; P811-R815 VanDerWaalsContact O-CB 3.23Å; P811-R815 WeakPolarHBondContact O-CB 3.44Å; P811-R815 WeakPolarHBondContact O-CG 3.4Å; P811-R815 PolarHBondContact O-N 3.23Å; P811-R815 VanDerWaalsContact O-N 3.17Å; P811-R815 PolarHBondContact O-NH1 3.3Å
812	A	72.9	Confident	73.3	Confident	15.25 Å²	15.25	40.8 Å²	40.8	13%	0.126	23%	0.229	C	C	.	.	H	α-helix	trans	-67.6	-43.2	174.8	0	0	0	0	0	112.7	I808 L809 V810 R814 R815 N816 L1008	I808-A812 WeakPolarHBondContact O-CB 3.28Å; I808-A812 PolarHBondContact O-N 3.21Å; L809-A812 CarbonylContact O-C 3.34Å; L809-A812 WeakPolarHBondContact O-CA 3.23Å; L809-A812 WeakPolarHBondContact O-CB 3.39Å; L809-A812 PolarHBondContact O-N 3.15Å; L809-A812 VanDerWaalsContact O-N 3.12Å; V810-A812 VanDerWaalsContact C-N 3.27Å; V810-A812 PolarHBondContact O-N 3.25Å; A812-R814 VanDerWaalsContact C-N 3.3Å; A812-R814 PolarHBondContact O-N 3.28Å; A812-R815 WeakPolarHBondContact O-CB 3.48Å; A812-R815 PolarHBondContact O-N 3.17Å; A812-R815 VanDerWaalsContact O-N 3.09Å; A812-N816 VanDerWaalsContact O-CB 3.28Å; A812-N816 WeakPolarHBondContact O-CB 3.38Å; A812-N816 VanDerWaalsContact O-CG 3.26Å; A812-N816 PolarHBondContact O-N 3.09Å; A812-N816 VanDerWaalsContact O-N 3.13Å; A812-N816 PolarHBondContact O-ND2 2.82Å; A812-L1008 HydrophobicContact CB-CD2 4.3Å
813	L	79.3	Confident	72.3	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-61.7	-43.2	175	-78.8	165.4	0	0	0	112.7	L809 V810 R815 N816 V817 A818 L825 F1007 L1008 V1011 K1012 L1015	L809-L813 WeakPolarHBondContact O-CG 3.39Å; L809-L813 PolarHBondContact O-N 3.2Å; V810-L813 PolarHBondContact O-N 3.32Å; V810-L813 VanDerWaalsContact O-N 3.14Å; L813-R815 VanDerWaalsContact C-N 3.3Å; L813-R815 PolarHBondContact O-N 2.95Å; L813-N816 PolarHBondContact O-N 3.06Å; L813-V817 HydrophobicContact CD2-CG2 4.18Å; L813-V817 VanDerWaalsContact O-CB 3.3Å; L813-V817 WeakPolarHBondContact O-CB 3.43Å; L813-V817 WeakPolarHBondContact O-CG2 3.34Å; L813-V817 PolarHBondContact O-N 3.06Å; L813-A818 PolarHBondContact O-N 3.17Å; L813-A818 VanDerWaalsContact O-N 3.1Å; L813-L825 HydrophobicContact CB-CD2 3.87Å; L813-F1007 HydrophobicContact CD1-CD1 4.18Å; L813-F1007 HydrophobicContact CD1-CE1 3.41Å; L813-F1007 VanDerWaalsContact CD1-CE1 3.42Å; L813-F1007 HydrophobicContact CD1-CZ 4.01Å; L813-F1007 HydrophobicContact CG-CE1 4.38Å; L813-L1008 HydrophobicContact CD1-CD2 4.15Å; L813-L1008 HydrophobicContact CD2-CD2 3.99Å; L813-L1008 HydrophobicContact CD2-CG 3.92Å; L813-L1008 HydrophobicContact CG-CD2 3.59Å; L813-L1008 VanDerWaalsContact CG-CD2 3.47Å; L813-L1008 HydrophobicContact CG-CG 4.24Å; L813-V1011 HydrophobicContact CD1-CB 3.81Å; L813-V1011 HydrophobicContact CD1-CG1 3.7Å; L813-V1011 HydrophobicContact CD1-CG2 4.24Å; L813-V1011 HydrophobicContact CD2-CB 4.24Å; L813-V1011 HydrophobicContact CD2-CG1 4.4Å; L813-K1012 HydrophobicContact CD2-CB 4.25Å; L813-L1015 HydrophobicContact CD2-CD1 4.49Å
814	R	73.2	Confident	71.6	Confident	47 Å²	47	41.1 Å²	41.1	18%	0.177	23%	0.228	C	C	.	.	I	π-helix	trans	-56.5	-45.3	176.4	-153.1	-177.4	-86.7	130.7	17.1	110.5	V810 P811 A812 A818 L819 L825 E827 Y1229	V810-R814 VanDerWaalsContact O-CB 3.24Å; V810-R814 WeakPolarHBondContact O-CB 3.29Å; V810-R814 PolarHBondContact O-N 3.04Å; P811-R814 PolarHBondContact O-N 3.07Å; A812-R814 VanDerWaalsContact C-N 3.3Å; A812-R814 PolarHBondContact O-N 3.28Å; R814-A818 WeakPolarHBondContact O-CB 3.41Å; R814-A818 PolarHBondContact O-N 2.9Å; R814-A818 VanDerWaalsContact O-N 3.1Å; R814-L819 VanDerWaalsContact O-CG 3.3Å; R814-L819 WeakPolarHBondContact O-CG 3.3Å; R814-L819 PolarHBondContact O-N 3.06Å; R814-L819 VanDerWaalsContact O-N 3.15Å; R814-L825 HydrophobicContact CB-CB 4.35Å; R814-L825 HydrophobicContact CB-CD2 4.41Å; R814-L825 WeakPolarHBondContact CD-O 3.48Å; R814-L825 HydrophobicContact CG-CB 3.9Å; R814-L825 HydrophobicContact CG-CD2 4.05Å; R814-L825 HydrophobicContact CG-CG 4.23Å; R814-L825 VanDerWaalsContact CZ-O 3.29Å; R814-L825 PolarHBondContact NE-O 2.93Å; R814-L825 PolarHBondContact NH2-O 3.03Å; R814-E827 IonicContact CZ-OE1 3.2Å; R814-E827 IonicContact CZ-OE2 2.89Å; R814-E827 IonicContact NE-OE2 3.16Å; R814-E827 PolarHBondContact NE-OE2 3.1Å; R814-E827 IonicContact NH1-OE1 3.15Å; R814-E827 PolarHBondContact NH1-OE1 3.13Å; R814-E827 IonicContact NH1-OE2 3.24Å; R814-E827 PolarHBondContact NH1-OE2 3.27Å; R814-E827 VanDerWaalsContact NH2-CD 3.25Å; R814-E827 IonicContact NH2-OE1 3.09Å; R814-E827 PolarHBondContact NH2-OE1 3.08Å; R814-E827 VanDerWaalsContact NH2-OE1 3.14Å; R814-E827 IonicContact NH2-OE2 3.6Å; R814-E827 PolarHBondContact NH2-OE2 3.19Å; R814-Y1229 VanDerWaalsContact CD-CE1 3.42Å; R814-Y1229 WeakPolarHBondContact CD-OH 3.47Å; R814-Y1229 HydrophobicContact CG-CE1 4.44Å; R814-Y1229 WeakPolarHBondContact CG-OH 3.27Å
815	R	62.1	Low	71.2	Confident	100.75 Å²	100.75	39.3 Å²	39.3	38%	0.38	22%	0.219	S	C	.	.	I	π-helix	trans	-66.8	-52.6	178	-71.1	-176.8	-160.9	107.1	-5.9	112.4	P811 A812 L813 V817 A818 L819 Y1616 N1630	P811-R815 VanDerWaalsContact CB-NH1 3.29Å; P811-R815 VanDerWaalsContact O-CB 3.23Å; P811-R815 WeakPolarHBondContact O-CB 3.44Å; P811-R815 WeakPolarHBondContact O-CG 3.4Å; P811-R815 PolarHBondContact O-N 3.23Å; P811-R815 VanDerWaalsContact O-N 3.17Å; P811-R815 PolarHBondContact O-NH1 3.3Å; A812-R815 WeakPolarHBondContact O-CB 3.48Å; A812-R815 PolarHBondContact O-N 3.17Å; A812-R815 VanDerWaalsContact O-N 3.09Å; L813-R815 VanDerWaalsContact C-N 3.3Å; L813-R815 PolarHBondContact O-N 2.95Å; R815-V817 VanDerWaalsContact C-N 3.31Å; R815-V817 PolarHBondContact O-N 3.18Å; R815-A818 PolarHBondContact O-N 3.21Å; R815-L819 PolarHBondContact O-N 3.29Å; R815-L819 VanDerWaalsContact O-N 3.12Å; R815-Y1616 PolarHBondContact NH1-OH 3.49Å; R815-Y1616 PolarHBondContact NH2-OH 3.09Å; R815-N1630 PolarHBondContact NE-OD1 2.68Å; R815-N1630 PolarHBondContact NH2-ND2 2.89Å; R815-N1630 PolarHBondContact NH2-OD1 2.84Å
816	N	67	Low	70.7	Confident	80.75 Å²	80.75	41.3 Å²	41.3	43%	0.432	23%	0.229	S	C	.	.	I	π-helix	trans	-79.4	-28.9	-169.2	-64.6	-11.9	0	0	0	113.9	A812 L813 G820	A812-N816 VanDerWaalsContact O-CB 3.28Å; A812-N816 WeakPolarHBondContact O-CB 3.38Å; A812-N816 VanDerWaalsContact O-CG 3.26Å; A812-N816 PolarHBondContact O-N 3.09Å; A812-N816 VanDerWaalsContact O-N 3.13Å; A812-N816 PolarHBondContact O-ND2 2.82Å; L813-N816 PolarHBondContact O-N 3.06Å; N816-G820 PolarHBondContact O-N 3.44Å
817	V	68.4	Low	70.8	Confident	9.5 Å²	9.5	41.5 Å²	41.5	6%	0.058	23%	0.228	C	C	.	.	I	π-helix	trans	-115.2	-47	-171.6	-176.9	0	0	0	0	111.4	L813 R815 L819 G820 L821 R822 V823 K1012 L1015 L1016	L813-V817 HydrophobicContact CD2-CG2 4.18Å; L813-V817 VanDerWaalsContact O-CB 3.3Å; L813-V817 WeakPolarHBondContact O-CB 3.43Å; L813-V817 WeakPolarHBondContact O-CG2 3.34Å; L813-V817 PolarHBondContact O-N 3.06Å; R815-V817 VanDerWaalsContact C-N 3.31Å; R815-V817 PolarHBondContact O-N 3.18Å; V817-L819 VanDerWaalsContact C-N 3.33Å; V817-L819 PolarHBondContact O-N 3.18Å; V817-G820 PolarHBondContact O-N 2.89Å; V817-L821 HydrophobicContact CG1-CB 4.15Å; V817-L821 HydrophobicContact CG1-CD1 3.91Å; V817-L821 CarbonylContact O-C 3.39Å; V817-L821 WeakPolarHBondContact O-CA 3.47Å; V817-L821 WeakPolarHBondContact O-CB 3.25Å; V817-L821 PolarHBondContact O-N 3.07Å; V817-L821 VanDerWaalsContact O-N 3.09Å; V817-R822 PolarHBondContact O-N 3.26Å; V817-R822 VanDerWaalsContact O-N 3.14Å; V817-V823 HydrophobicContact CG1-CB 3.58Å; V817-V823 HydrophobicContact CG1-CG1 4.43Å; V817-V823 HydrophobicContact CG1-CG2 4.24Å; V817-V823 PolarHBondContact O-N 3.44Å; V817-K1012 HydrophobicContact CB-CG 4.41Å; V817-K1012 HydrophobicContact CG1-CB 4.45Å; V817-K1012 HydrophobicContact CG1-CG 4.08Å; V817-K1012 HydrophobicContact CG2-CB 3.96Å; V817-K1012 HydrophobicContact CG2-CD 3.85Å; V817-K1012 HydrophobicContact CG2-CG 3.61Å; V817-K1012 VanDerWaalsContact CG2-CG 3.48Å; V817-L1015 HydrophobicContact CB-CD1 4.25Å; V817-L1015 HydrophobicContact CG1-CB 3.99Å; V817-L1015 HydrophobicContact CG1-CD1 4.04Å; V817-L1015 HydrophobicContact CG2-CB 4.49Å; V817-L1015 HydrophobicContact CG2-CD1 3.7Å; V817-L1016 HydrophobicContact CG1-CG 4.45Å
818	A	65.8	Low	71	Confident	3.25 Å²	3.25	40 Å²	40	3%	0.027	21%	0.208	C	C	.	.	I	π-helix	trans	-65.9	-40.5	-176	0	0	0	0	0	111.6	W784 L813 R814 R815 G820 L821 R822 V823 L825 L1015	W784-A818 HydrophobicContact CH2-CB 3.84Å; W784-A818 WeakPolarHBondContact CH2-O 3.36Å; W784-A818 HydrophobicContact CZ3-CB 3.77Å; L813-A818 PolarHBondContact O-N 3.17Å; L813-A818 VanDerWaalsContact O-N 3.1Å; R814-A818 WeakPolarHBondContact O-CB 3.41Å; R814-A818 PolarHBondContact O-N 2.9Å; R814-A818 VanDerWaalsContact O-N 3.1Å; R815-A818 PolarHBondContact O-N 3.21Å; A818-G820 PolarHBondContact O-N 3.12Å; A818-L821 PolarHBondContact O-N 2.91Å; A818-R822 WeakPolarHBondContact O-CA 3.38Å; A818-R822 PolarHBondContact O-N 3.07Å; A818-R822 VanDerWaalsContact O-N 3.12Å; A818-V823 CarbonylContact C-O 3.58Å; A818-V823 HydrophobicContact CB-CB 4.33Å; A818-V823 VanDerWaalsContact CB-O 3.25Å; A818-V823 WeakPolarHBondContact CB-O 3.39Å; A818-V823 PolarHBondContact O-N 3.38Å; A818-V823 VanDerWaalsContact O-O 3.12Å; A818-L825 HydrophobicContact CB-CB 3.86Å; A818-L1015 HydrophobicContact CB-CD1 4.38Å
819	L	59.2	Low	71	Confident	82.25 Å²	82.25	36.9 Å²	36.9	43%	0.431	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-43.8	175.5	-73	172.7	0	0	0	112.6	W784 R814 R815 V817 L821 R822 E1051 E1632	W784-L819 HydrophobicContact CH2-CB 4.48Å; W784-L819 HydrophobicContact CH2-CD2 3.55Å; W784-L819 HydrophobicContact CH2-CG 4.46Å; W784-L819 HydrophobicContact CZ2-CD2 4.44Å; W784-L819 HydrophobicContact CZ3-CD2 3.99Å; R814-L819 VanDerWaalsContact O-CG 3.3Å; R814-L819 WeakPolarHBondContact O-CG 3.3Å; R814-L819 PolarHBondContact O-N 3.06Å; R814-L819 VanDerWaalsContact O-N 3.15Å; R815-L819 PolarHBondContact O-N 3.29Å; R815-L819 VanDerWaalsContact O-N 3.12Å; V817-L819 VanDerWaalsContact C-N 3.33Å; V817-L819 PolarHBondContact O-N 3.18Å; L819-L821 VanDerWaalsContact C-N 3.29Å; L819-L821 PolarHBondContact O-N 3.24Å; L819-R822 PolarHBondContact O-N 2.89Å; L819-R822 VanDerWaalsContact O-N 3.12Å; L819-E1051 WeakPolarHBondContact CD1-OE1 3.46Å; L819-E1632 HydrophobicContact CD2-CB 4.38Å; L819-E1632 HydrophobicContact CD2-CG 4.17Å
820	G	61.7	Low	70.4	Confident	66.75 Å²	66.75	37.5 Å²	37.5	69%	0.688	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-38.2	179.9	0	0	0	0	0	113.8	N816 V817 A818 R822	N816-G820 PolarHBondContact O-N 3.44Å; V817-G820 PolarHBondContact O-N 2.89Å; A818-G820 PolarHBondContact O-N 3.12Å; G820-R822 VanDerWaalsContact C-N 3.3Å; G820-R822 PolarHBondContact O-N 3.38Å
821	L	65.9	Low	69.6	Low	35.25 Å²	35.25	40 Å²	40	19%	0.185	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-3.4	179.2	-69.6	169.7	0	0	0	114.1	V817 A818 L819 V823 L1015 L1016 F1019 H1020	V817-L821 HydrophobicContact CG1-CB 4.15Å; V817-L821 HydrophobicContact CG1-CD1 3.91Å; V817-L821 CarbonylContact O-C 3.39Å; V817-L821 WeakPolarHBondContact O-CA 3.47Å; V817-L821 WeakPolarHBondContact O-CB 3.25Å; V817-L821 PolarHBondContact O-N 3.07Å; V817-L821 VanDerWaalsContact O-N 3.09Å; A818-L821 PolarHBondContact O-N 2.91Å; L819-L821 VanDerWaalsContact C-N 3.29Å; L819-L821 PolarHBondContact O-N 3.24Å; L821-V823 VanDerWaalsContact C-N 3.33Å; L821-V823 HydrophobicContact CB-CB 4.4Å; L821-V823 HydrophobicContact CB-CG2 3.73Å; L821-V823 PolarHBondContact O-N 2.56Å; L821-L1015 VanDerWaalsContact CD1-C 3.42Å; L821-L1015 HydrophobicContact CD1-CB 4.01Å; L821-L1015 WeakPolarHBondContact CD1-O 3.34Å; L821-L1016 HydrophobicContact CD1-CD2 4.03Å; L821-L1016 HydrophobicContact CD1-CG 4.38Å; L821-L1016 HydrophobicContact CD2-CD2 4Å; L821-L1016 HydrophobicContact CG-CD2 4.31Å; L821-F1019 HydrophobicContact CB-CB 4.26Å; L821-F1019 HydrophobicContact CD1-CB 4.36Å; L821-F1019 HydrophobicContact CD2-CB 4.34Å; L821-H1020 HydrophobicContact CD2-CB 4.32Å
822	R	62.4	Low	68.7	Low	122.25 Å²	122.25	42.7 Å²	42.7	46%	0.461	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	50.9	-168.2	-56	-179.7	-178.1	-169.8	0.1	110.7	G783 W784 K785 V817 A818 L819 G820	G783-R822 VanDerWaalsContact O-CB 3.32Å; G783-R822 WeakPolarHBondContact O-CB 3.06Å; G783-R822 VanDerWaalsContact O-O 3.11Å; W784-R822 CarbonylContact C-O 3.57Å; W784-R822 WeakPolarHBondContact CA-O 3.24Å; W784-R822 HydrophobicContact CD2-CB 3.89Å; W784-R822 HydrophobicContact CD2-CG 4.36Å; W784-R822 VanDerWaalsContact CE3-C 3.48Å; W784-R822 VanDerWaalsContact CE3-CA 3.5Å; W784-R822 HydrophobicContact CE3-CB 4.1Å; W784-R822 HydrophobicContact CG-CB 4.23Å; W784-R822 HydrophobicContact CZ2-CB 4.36Å; W784-R822 HydrophobicContact CZ2-CG 4.29Å; W784-R822 HydrophobicContact CZ3-CB 4.43Å; K785-R822 PolarHBondContact N-O 3.21Å; V817-R822 PolarHBondContact O-N 3.26Å; V817-R822 VanDerWaalsContact O-N 3.14Å; A818-R822 WeakPolarHBondContact O-CA 3.38Å; A818-R822 PolarHBondContact O-N 3.07Å; A818-R822 VanDerWaalsContact O-N 3.12Å; L819-R822 PolarHBondContact O-N 2.89Å; L819-R822 VanDerWaalsContact O-N 3.12Å; G820-R822 VanDerWaalsContact C-N 3.3Å; G820-R822 PolarHBondContact O-N 3.38Å
823	V	64.7	Low	67.6	Low	1.75 Å²	1.75	44.2 Å²	44.2	1%	0.011	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.7	177.3	-178.9	0	0	0	0	109.2	K785 C787 V817 A818 L821 L825 L1015 F1019	K785-V823 HydrophobicContact CB-CG1 4.29Å; K785-V823 HydrophobicContact CB-CG2 4.27Å; K785-V823 CarbonylContact O-C 3.54Å; K785-V823 VanDerWaalsContact O-CA 3.26Å; K785-V823 WeakPolarHBondContact O-CA 3.41Å; K785-V823 WeakPolarHBondContact O-CG1 3.44Å; C787-V823 HydrophobicContact CB-CG1 3.59Å; C787-V823 VanDerWaalsContact CB-CG1 3.48Å; V817-V823 HydrophobicContact CG1-CB 3.58Å; V817-V823 HydrophobicContact CG1-CG1 4.43Å; V817-V823 HydrophobicContact CG1-CG2 4.24Å; V817-V823 PolarHBondContact O-N 3.44Å; A818-V823 CarbonylContact C-O 3.58Å; A818-V823 HydrophobicContact CB-CB 4.33Å; A818-V823 VanDerWaalsContact CB-O 3.25Å; A818-V823 WeakPolarHBondContact CB-O 3.39Å; A818-V823 PolarHBondContact O-N 3.38Å; A818-V823 VanDerWaalsContact O-O 3.12Å; L821-V823 VanDerWaalsContact C-N 3.33Å; L821-V823 HydrophobicContact CB-CB 4.4Å; L821-V823 HydrophobicContact CB-CG2 3.73Å; L821-V823 PolarHBondContact O-N 2.56Å; V823-L825 PolarHBondContact O-N 3.2Å; V823-L1015 HydrophobicContact CG1-CD2 4.43Å; V823-F1019 HydrophobicContact CB-CD2 4.33Å; V823-F1019 HydrophobicContact CB-CE2 4.49Å; V823-F1019 HydrophobicContact CG1-CD2 3.98Å; V823-F1019 HydrophobicContact CG1-CE2 3.76Å; V823-F1019 HydrophobicContact CG1-CG 4.4Å; V823-F1019 HydrophobicContact CG1-CZ 4.1Å; V823-F1019 HydrophobicContact CG2-CB 3.69Å; V823-F1019 HydrophobicContact CG2-CD1 4.06Å; V823-F1019 HydrophobicContact CG2-CD2 3.6Å; V823-F1019 VanDerWaalsContact CG2-CD2 3.43Å; V823-F1019 HydrophobicContact CG2-CE1 4.36Å; V823-F1019 HydrophobicContact CG2-CE2 4.21Å; V823-F1019 HydrophobicContact CG2-CG 3.5Å; V823-F1019 VanDerWaalsContact CG2-CG 3.45Å; V823-F1019 HydrophobicContact CG2-CZ 4.33Å
824	H	66.7	Low	66.1	Low	71 Å²	71	45.6 Å²	45.6	33%	0.329	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	104.1	168.1	-156.3	-67.3	0	0	0	109.3	W784 K785 C786 C787 N826 Y1229 L1233	W784-H824 AromaticContact CD2-NE2 3.75Å; W784-H824 AromaticContact CE3-CD2 3.78Å; W784-H824 AromaticContact CE3-CE1 3.82Å; W784-H824 AromaticContact CE3-NE2 3.59Å; W784-H824 AromaticContact CG-NE2 3.97Å; K785-H824 PolarHBondContact O-N 2.95Å; C786-H824 CarbonylContact C-O 3.55Å; C786-H824 WeakPolarHBondContact CA-O 3.36Å; C787-H824 PolarHBondContact N-O 3.19Å; H824-N826 PolarHBondContact O-N 3.42Å; H824-Y1229 AromaticContact CE1-CD1 3.95Å; H824-Y1229 AromaticContact CE1-CE1 3.33Å; H824-Y1229 WeakPolarHBondContact CE1-CE1 3.39Å; H824-Y1229 AromaticContact ND1-CE1 3.73Å; H824-L1233 WeakPolarHBondContact CD2-CD1 3.11Å; H824-L1233 VanDerWaalsContact NE2-CD1 3.28Å; H824-L1233 WeakPolarHBondContact NE2-CD1 3.08Å
825	L	76.2	Confident	64.8	Low	1 Å²	1	46 Å²	46	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	116.7	176	-175.3	66.7	0	0	0	110	C787 L789 V810 L813 R814 A818 V823 L1015	C787-L825 HydrophobicContact CB-CD1 4.15Å; L789-L825 HydrophobicContact CB-CD1 3.95Å; L789-L825 HydrophobicContact CD1-CD1 4.28Å; L789-L825 HydrophobicContact CD2-CD1 4.4Å; L789-L825 HydrophobicContact CD2-CD2 4.43Å; V810-L825 HydrophobicContact CG1-CD2 4.06Å; V810-L825 HydrophobicContact CG1-CG 4.44Å; L813-L825 HydrophobicContact CB-CD2 3.87Å; R814-L825 HydrophobicContact CB-CB 4.35Å; R814-L825 HydrophobicContact CB-CD2 4.41Å; R814-L825 WeakPolarHBondContact CD-O 3.48Å; R814-L825 HydrophobicContact CG-CB 3.9Å; R814-L825 HydrophobicContact CG-CD2 4.05Å; R814-L825 HydrophobicContact CG-CG 4.23Å; R814-L825 VanDerWaalsContact CZ-O 3.29Å; R814-L825 PolarHBondContact NE-O 2.93Å; R814-L825 PolarHBondContact NH2-O 3.03Å; A818-L825 HydrophobicContact CB-CB 3.86Å; V823-L825 PolarHBondContact O-N 3.2Å; L825-L1015 HydrophobicContact CD1-CD1 4.12Å; L825-L1015 HydrophobicContact CD1-CD2 4.18Å; L825-L1015 HydrophobicContact CD2-CD1 4.32Å
826	N	74.4	Confident	63.8	Low	41.25 Å²	41.25	47.3 Å²	47.3	22%	0.221	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	111.3	178.8	-152.6	31.6	0	0	0	110.2	C786 C787 Q788 L789 H824	C786-N826 PolarHBondContact SG-ND2 2.89Å; C787-N826 PolarHBondContact O-N 2.95Å; Q788-N826 WeakPolarHBondContact CA-O 3.38Å; L789-N826 PolarHBondContact N-O 3.11Å; H824-N826 PolarHBondContact O-N 3.42Å
827	E	80.1	Confident	62.6	Low	34.25 Å²	34.25	47.3 Å²	47.3	16%	0.16	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	133.5	173.3	67.9	-71.5	-163.3	0	0	111.7	L789 I791 V810 R814	L789-E827 HydrophobicContact CD2-CB 4.4Å; L789-E827 CarbonylContact O-C 3.55Å; L789-E827 VanDerWaalsContact O-CA 3.27Å; L789-E827 WeakPolarHBondContact O-CA 3.16Å; I791-E827 HydrophobicContact CD1-CB 4.34Å; V810-E827 HydrophobicContact CG1-CB 4.04Å; V810-E827 HydrophobicContact CG1-CG 4.17Å; V810-E827 VanDerWaalsContact CG1-OE2 3.28Å; V810-E827 WeakPolarHBondContact CG1-OE2 3.34Å; R814-E827 IonicContact CZ-OE1 3.2Å; R814-E827 IonicContact CZ-OE2 2.89Å; R814-E827 IonicContact NE-OE2 3.16Å; R814-E827 PolarHBondContact NE-OE2 3.1Å; R814-E827 IonicContact NH1-OE1 3.15Å; R814-E827 PolarHBondContact NH1-OE1 3.13Å; R814-E827 IonicContact NH1-OE2 3.24Å; R814-E827 PolarHBondContact NH1-OE2 3.27Å; R814-E827 VanDerWaalsContact NH2-CD 3.25Å; R814-E827 IonicContact NH2-OE1 3.09Å; R814-E827 PolarHBondContact NH2-OE1 3.08Å; R814-E827 VanDerWaalsContact NH2-OE1 3.14Å; R814-E827 IonicContact NH2-OE2 3.6Å; R814-E827 PolarHBondContact NH2-OE2 3.19Å
828	I	76.4	Confident	61.7	Low	15.25 Å²	15.25	47.8 Å²	47.8	8%	0.078	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	98.6	173.1	-56.2	166.6	0	0	0	106.5	Q788 L789 F790 I791 L830 Q851	Q788-I828 HydrophobicContact CB-CD1 4.17Å; Q788-I828 HydrophobicContact CG-CD1 4.45Å; L789-I828 PolarHBondContact O-N 3.02Å; F790-I828 HydrophobicContact CD2-CB 3.89Å; F790-I828 HydrophobicContact CD2-CD1 4.47Å; F790-I828 HydrophobicContact CD2-CG2 3.68Å; F790-I828 HydrophobicContact CE2-CG2 4.01Å; I791-I828 PolarHBondContact N-O 3.27Å; I791-I828 VanDerWaalsContact N-O 3.15Å; I828-L830 HydrophobicContact CG2-CD2 4.02Å; I828-L830 HydrophobicContact CG2-CG 4.24Å; I828-Q851 HydrophobicContact CG2-CB 4.31Å; I828-Q851 HydrophobicContact CG2-CG 4.33Å
829	D	76.6	Confident	60.9	Low	13.25 Å²	13.25	51.2 Å²	51.2	7%	0.071	29%	0.285	C	S	.	.			trans	-108.9	102.3	170.2	-176.8	-6	0	0	0	108.7	R802 C806 R831 W832	R802-D829 IonicContact CZ-OD1 3.37Å; R802-D829 VanDerWaalsContact CZ-OD1 3.29Å; R802-D829 IonicContact NE-OD1 3.27Å; R802-D829 PolarHBondContact NE-OD1 3.02Å; R802-D829 IonicContact NE-OD2 3.35Å; R802-D829 PolarHBondContact NE-OD2 3.11Å; R802-D829 VanDerWaalsContact NH2-CG 3.32Å; R802-D829 IonicContact NH2-OD1 3.63Å; R802-D829 PolarHBondContact NH2-OD1 2.99Å; R802-D829 IonicContact NH2-OD2 3.82Å; C806-D829 PolarHBondContact SG-OD2 3.3Å; D829-R831 PolarHBondContact O-N 3.12Å; D829-R831 VanDerWaalsContact O-N 3.07Å; D829-R831 VanDerWaalsContact OD1-CB 3.28Å; D829-R831 WeakPolarHBondContact OD1-CB 3.24Å; D829-R831 VanDerWaalsContact OD1-CG 3.27Å; D829-R831 WeakPolarHBondContact OD1-CG 3.37Å; D829-R831 PolarHBondContact OD1-N 3.28Å; D829-R831 VanDerWaalsContact OD1-N 3.14Å; D829-R831 IonicContact OD1-NE 3.37Å; D829-R831 PolarHBondContact OD1-NE 3.21Å; D829-R831 IonicContact OD2-CZ 3.19Å; D829-R831 VanDerWaalsContact OD2-CZ 3.24Å; D829-R831 IonicContact OD2-NE 3.22Å; D829-R831 PolarHBondContact OD2-NE 3.24Å; D829-R831 VanDerWaalsContact OD2-NE 3.1Å; D829-R831 IonicContact OD2-NH2 3.21Å; D829-R831 PolarHBondContact OD2-NH2 3.19Å; D829-R831 VanDerWaalsContact OD2-NH2 3.1Å; D829-W832 PolarHBondContact O-N 2.83Å
830	L	70.8	Confident	60.5	Low	25 Å²	25	56.4 Å²	56.4	13%	0.131	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	4.8	-177	-65.5	180	0	0	0	114.5	F790 I828 W832 G833 V834 I847 C848 Q851	F790-L830 HydrophobicContact CE2-CD1 3.79Å; F790-L830 HydrophobicContact CE2-CG 4.14Å; F790-L830 HydrophobicContact CZ-CD1 4.08Å; I828-L830 HydrophobicContact CG2-CD2 4.02Å; I828-L830 HydrophobicContact CG2-CG 4.24Å; L830-W832 PolarHBondContact O-N 3.05Å; L830-W832 VanDerWaalsContact O-N 3.12Å; L830-G833 PolarHBondContact O-N 3.49Å; L830-V834 HydrophobicContact CB-CG2 4.45Å; L830-V834 HydrophobicContact CD2-CG2 4.34Å; L830-I847 HydrophobicContact CD1-CG2 4.28Å; L830-I847 HydrophobicContact CD2-CG2 4.18Å; L830-C848 HydrophobicContact CD1-CB 4.12Å; L830-C848 VanDerWaalsContact CD1-SG 3.59Å; L830-C848 WeakPolarHBondContact CD1-SG 3.18Å; L830-Q851 HydrophobicContact CD2-CG 4.41Å
831	R	65.6	Low	60.4	Low	52.5 Å²	52.5	57.4 Å²	57.4	20%	0.198	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.5	164.6	-70	-172.8	-71.9	167.7	9.3	112.2	F795 H799 R802 D803 D829 Y1490	F795-R831 HydrophobicContact CD1-CG 3.49Å; F795-R831 VanDerWaalsContact CD1-CG 3.48Å; F795-R831 HydrophobicContact CE1-CB 4.3Å; F795-R831 HydrophobicContact CE1-CG 3.32Å; F795-R831 HydrophobicContact CG-CG 4.23Å; F795-R831 HydrophobicContact CZ-CG 4.22Å; H799-R831 PolarHBondContact O-NH1 3.14Å; R802-R831 VanDerWaalsContact C-NH2 3.26Å; R802-R831 VanDerWaalsContact CB-CZ 3.42Å; R802-R831 VanDerWaalsContact CB-NH2 3.33Å; R802-R831 PolarHBondContact O-NH2 2.99Å; D803-R831 IonicContact OD1-CZ 2.91Å; D803-R831 VanDerWaalsContact OD1-CZ 3.26Å; D803-R831 IonicContact OD1-NH1 3.04Å; D803-R831 PolarHBondContact OD1-NH1 3Å; D803-R831 IonicContact OD1-NH2 3.53Å; D803-R831 PolarHBondContact OD1-NH2 3.1Å; D829-R831 PolarHBondContact O-N 3.12Å; D829-R831 VanDerWaalsContact O-N 3.07Å; D829-R831 VanDerWaalsContact OD1-CB 3.28Å; D829-R831 WeakPolarHBondContact OD1-CB 3.24Å; D829-R831 VanDerWaalsContact OD1-CG 3.27Å; D829-R831 WeakPolarHBondContact OD1-CG 3.37Å; D829-R831 PolarHBondContact OD1-N 3.28Å; D829-R831 VanDerWaalsContact OD1-N 3.14Å; D829-R831 IonicContact OD1-NE 3.37Å; D829-R831 PolarHBondContact OD1-NE 3.21Å; D829-R831 IonicContact OD2-CZ 3.19Å; D829-R831 VanDerWaalsContact OD2-CZ 3.24Å; D829-R831 IonicContact OD2-NE 3.22Å; D829-R831 PolarHBondContact OD2-NE 3.24Å; D829-R831 VanDerWaalsContact OD2-NE 3.1Å; D829-R831 IonicContact OD2-NH2 3.21Å; D829-R831 PolarHBondContact OD2-NH2 3.19Å; D829-R831 VanDerWaalsContact OD2-NH2 3.1Å; R831-Y1490 HydrophobicContact CB-CD2 3.44Å; R831-Y1490 VanDerWaalsContact CB-CD2 3.44Å; R831-Y1490 HydrophobicContact CB-CE2 3.54Å; R831-Y1490 WeakPolarHBondContact O-CB 3.27Å; R831-Y1490 VanDerWaalsContact O-CD2 3.24Å; R831-Y1490 WeakPolarHBondContact O-CD2 3.33Å
832	W	53.9	Low	60.2	Low	76.25 Å²	76.25	57.5 Å²	57.5	29%	0.289	29%	0.294	S	S	.	.	S	Bend	trans	-113.5	107.2	-179.4	-110.4	47.2	0	0	0	111.7	D829 L830 V834 K1451 L1484 Y1487 Y1490 L1493	D829-W832 PolarHBondContact O-N 2.83Å; L830-W832 PolarHBondContact O-N 3.05Å; L830-W832 VanDerWaalsContact O-N 3.12Å; W832-V834 VanDerWaalsContact C-N 3.28Å; W832-V834 PolarHBondContact O-N 3.36Å; W832-K1451 HydrophobicContact CD2-CD 4.42Å; W832-K1451 HydrophobicContact CD2-CG 4.06Å; W832-K1451 HydrophobicContact CE3-CB 3.93Å; W832-K1451 HydrophobicContact CE3-CD 3.63Å; W832-K1451 HydrophobicContact CE3-CG 3.6Å; W832-K1451 HydrophobicContact CH2-CD 4.1Å; W832-K1451 HydrophobicContact CZ3-CB 4.21Å; W832-K1451 HydrophobicContact CZ3-CD 3.22Å; W832-K1451 HydrophobicContact CZ3-CG 3.61Å; W832-L1484 VanDerWaalsContact CH2-C 3.43Å; W832-L1484 HydrophobicContact CH2-CB 4.14Å; W832-L1484 WeakPolarHBondContact CH2-O 3.44Å; W832-L1484 HydrophobicContact CZ2-CB 4.4Å; W832-L1484 WeakPolarHBondContact CZ2-O 3.38Å; W832-Y1487 VanDerWaalsContact CZ2-O 3.28Å; W832-Y1487 WeakPolarHBondContact CZ2-O 3.43Å; W832-Y1490 HydrophobicContact CB-CD1 4.12Å; W832-Y1490 HydrophobicContact CB-CD2 4.33Å; W832-Y1490 HydrophobicContact CB-CE1 3.79Å; W832-Y1490 HydrophobicContact CB-CE2 4.04Å; W832-Y1490 HydrophobicContact CB-CG 4.27Å; W832-Y1490 AromaticContact CD1-CD1 2.89Å; W832-Y1490 AromaticContact CD1-CE1 3.28Å; W832-Y1490 AromaticContact CD1-CG 3.33Å; W832-Y1490 AromaticContact CD2-CD1 3.56Å; W832-Y1490 HydrophobicContact CD2-CD1 3.56Å; W832-Y1490 HydrophobicContact CD2-CD2 4.35Å; W832-Y1490 AromaticContact CD2-CE1 3.06Å; W832-Y1490 HydrophobicContact CD2-CE1 3.06Å; W832-Y1490 AromaticContact CD2-CZ 3.77Å; W832-Y1490 AromaticContact CE2-CD1 3.41Å; W832-Y1490 VanDerWaalsContact CE2-CD1 3.41Å; W832-Y1490 AromaticContact CE2-CE1 3.29Å; W832-Y1490 HydrophobicContact CE3-CD1 4.48Å; W832-Y1490 HydrophobicContact CE3-CD2 4.23Å; W832-Y1490 AromaticContact CE3-CE1 3.59Å; W832-Y1490 HydrophobicContact CE3-CE1 3.59Å; W832-Y1490 AromaticContact CG-CD1 3.31Å; W832-Y1490 HydrophobicContact CG-CD1 3.31Å; W832-Y1490 HydrophobicContact CG-CD2 4.34Å; W832-Y1490 AromaticContact CG-CE1 3.12Å; W832-Y1490 HydrophobicContact CG-CE1 3.12Å; W832-Y1490 HydrophobicContact CG-CE2 4.22Å; W832-Y1490 AromaticContact CG-CG 3.84Å; W832-Y1490 HydrophobicContact CG-CG 3.84Å; W832-Y1490 AromaticContact CG-CZ 3.57Å; W832-Y1490 HydrophobicContact CH2-CD2 4.48Å; W832-Y1490 HydrophobicContact CZ2-CD1 4.3Å; W832-Y1490 HydrophobicContact CZ2-CE1 4.07Å; W832-Y1490 HydrophobicContact CZ3-CD2 4.27Å; W832-Y1490 HydrophobicContact CZ3-CE1 4.35Å; W832-Y1490 AromaticContact NE1-CD1 2.96Å; W832-Y1490 AromaticContact NE1-CE1 3.38Å; W832-Y1490 AromaticContact NE1-CG 3.82Å; W832-L1493 HydrophobicContact CZ2-CD1 3.79Å; W832-L1493 HydrophobicContact CZ2-CD2 4.45Å; W832-L1493 VanDerWaalsContact NE1-CD2 3.34Å
833	G	49.2	Very low	60.5	Low	47.25 Å²	47.25	56.6 Å²	56.6	49%	0.487	30%	0.295	S	S	.	.	S	Bend	trans	108.6	-8	175.7	0	0	0	0	0	116.2	L830	L830-G833 PolarHBondContact O-N 3.49Å
834	V	48.4	Very low	60.9	Low	31.75 Å²	31.75	57.2 Å²	57.2	19%	0.192	30%	0.3	C	S	.	.	S	Bend	trans	-103	112.7	173.1	-174.9	0	0	0	0	108.9	L830 W832 V838 T839 A844 I847	L830-V834 HydrophobicContact CB-CG2 4.45Å; L830-V834 HydrophobicContact CD2-CG2 4.34Å; W832-V834 VanDerWaalsContact C-N 3.28Å; W832-V834 PolarHBondContact O-N 3.36Å; V834-V838 HydrophobicContact CG1-CB 3.69Å; V834-V838 HydrophobicContact CG1-CG1 3.76Å; V834-T839 HydrophobicContact CB-CG2 4.49Å; V834-T839 HydrophobicContact CG1-CG2 4.14Å; V834-A844 HydrophobicContact CG1-CB 3.92Å; V834-A844 HydrophobicContact CG2-CB 4.35Å; V834-I847 HydrophobicContact CG2-CG2 4.34Å
835	P	45	Very low	61.5	Low	54.5 Å²	54.5	54.1 Å²	54.1	35%	0.354	29%	0.286	S	S	.	.			trans	-58	142.1	176.9	-20.3	29.7	0	0	0	111.6	P837 V838 T839	P835-P837 VanDerWaalsContact C-N 3.3Å; P835-P837 HydrophobicContact CB-CG 4.2Å; P835-P837 WeakPolarHBondContact O-CD 3.46Å; P835-P837 VanDerWaalsContact O-N 3.12Å; P835-V838 HydrophobicContact CB-CG2 4.08Å; P835-V838 HydrophobicContact CG-CG2 4.09Å; P835-V838 WeakPolarHBondContact O-CA 3.39Å; P835-V838 VanDerWaalsContact O-CB 3.28Å; P835-V838 WeakPolarHBondContact O-CB 3.44Å; P835-V838 PolarHBondContact O-N 3.01Å; P835-T839 PolarHBondContact O-N 3.29Å; P835-T839 PolarHBondContact O-OG1 3.33Å
836	E	41.1	Very low	61.8	Low	127.75 Å²	127.75	56.5 Å²	56.5	60%	0.597	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42	-41.2	175.8	-78.4	179.1	165.3	0	0	116	V838 T839 R1459	E836-V838 PolarHBondContact O-N 2.97Å; E836-T839 VanDerWaalsContact C-OG1 3.24Å; E836-T839 VanDerWaalsContact CA-OG1 3.3Å; E836-T839 WeakPolarHBondContact CA-OG1 3.18Å; E836-T839 PolarHBondContact O-N 2.95Å; E836-T839 VanDerWaalsContact O-N 3.17Å; E836-T839 PolarHBondContact O-OG1 3.04Å; E836-R1459 IonicContact OE2-CZ 2.81Å; E836-R1459 IonicContact OE2-NH1 2.6Å; E836-R1459 PolarHBondContact OE2-NH1 3.43Å
837	P	42.3	Very low	62	Low	81.75 Å²	81.75	57.1 Å²	57.1	53%	0.531	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-13.7	176.9	24.8	-34	0	0	0	114.4	P835 N841	P835-P837 VanDerWaalsContact C-N 3.3Å; P835-P837 HydrophobicContact CB-CG 4.2Å; P835-P837 WeakPolarHBondContact O-CD 3.46Å; P835-P837 VanDerWaalsContact O-N 3.12Å; P837-N841 PolarHBondContact O-ND2 3.23Å; P837-N841 VanDerWaalsContact O-ND2 3.12Å
838	V	50.2	Low	62.1	Low	20.5 Å²	20.5	56.1 Å²	56.1	12%	0.124	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-25.4	-179.8	-173.8	0	0	0	0	111.1	V834 P835 E836 Y840 N841 Q843 A844 I847	V834-V838 HydrophobicContact CG1-CB 3.69Å; V834-V838 HydrophobicContact CG1-CG1 3.76Å; P835-V838 HydrophobicContact CB-CG2 4.08Å; P835-V838 HydrophobicContact CG-CG2 4.09Å; P835-V838 WeakPolarHBondContact O-CA 3.39Å; P835-V838 VanDerWaalsContact O-CB 3.28Å; P835-V838 WeakPolarHBondContact O-CB 3.44Å; P835-V838 PolarHBondContact O-N 3.01Å; E836-V838 PolarHBondContact O-N 2.97Å; V838-Y840 VanDerWaalsContact C-N 3.27Å; V838-Y840 PolarHBondContact O-N 3.3Å; V838-Y840 VanDerWaalsContact O-N 3.13Å; V838-N841 PolarHBondContact O-N 3.15Å; V838-N841 VanDerWaalsContact O-N 3.14Å; V838-Q843 HydrophobicContact CG1-CB 3.8Å; V838-A844 HydrophobicContact CG1-CB 4.2Å; V838-A844 WeakPolarHBondContact O-CB 3.45Å; V838-I847 HydrophobicContact CG1-CD1 4.41Å
839	T	48.9	Very low	62.6	Low	73.75 Å²	73.75	55.4 Å²	55.4	45%	0.452	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.2	-174.5	12.1	0	0	0	0	115.1	V834 P835 E836	V834-T839 HydrophobicContact CB-CG2 4.49Å; V834-T839 HydrophobicContact CG1-CG2 4.14Å; P835-T839 PolarHBondContact O-N 3.29Å; P835-T839 PolarHBondContact O-OG1 3.33Å; E836-T839 VanDerWaalsContact C-OG1 3.24Å; E836-T839 VanDerWaalsContact CA-OG1 3.3Å; E836-T839 WeakPolarHBondContact CA-OG1 3.18Å; E836-T839 PolarHBondContact O-N 2.95Å; E836-T839 VanDerWaalsContact O-N 3.17Å; E836-T839 PolarHBondContact O-OG1 3.04Å
840	Y	50.8	Low	62.9	Low	191.5 Å²	191.5	57.8 Å²	57.8	75%	0.751	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	18.9	178.2	-63.1	-78.5	0	0	0	113.1	V838	V838-Y840 VanDerWaalsContact C-N 3.27Å; V838-Y840 PolarHBondContact O-N 3.3Å; V838-Y840 VanDerWaalsContact O-N 3.13Å
841	N	57.8	Low	63.4	Low	87.5 Å²	87.5	58.7 Å²	58.7	47%	0.468	31%	0.307	S	S	.	.	S	Bend	trans	-123.1	157.5	-177.2	-78.5	-30.7	0	0	0	111.4	P837 V838 Q843 A844	P837-N841 PolarHBondContact O-ND2 3.23Å; P837-N841 VanDerWaalsContact O-ND2 3.12Å; V838-N841 PolarHBondContact O-N 3.15Å; V838-N841 VanDerWaalsContact O-N 3.14Å; N841-Q843 PolarHBondContact O-N 3.12Å; N841-A844 PolarHBondContact O-N 3.22Å
842	S	63.1	Low	64.4	Low	38.5 Å²	38.5	56.2 Å²	56.2	27%	0.269	30%	0.298	S	S	.	.	H	α-helix	trans	-51.1	-21.9	175.1	57.9	0	0	0	0	114.6	L845 Q846 E874 L878	S842-L845 PolarHBondContact O-N 2.95Å; S842-Q846 WeakPolarHBondContact O-CB 3.29Å; S842-Q846 PolarHBondContact O-N 3.1Å; S842-Q846 VanDerWaalsContact O-N 3.11Å; S842-E874 WeakPolarHBondContact CB-O 3.43Å; S842-L878 WeakPolarHBondContact O-CD2 3.41Å
843	Q	69.3	Low	65.9	Low	103 Å²	103	53.6 Å²	53.6	48%	0.481	29%	0.293	S	S	.	.	H	α-helix	trans	-67.4	-36	174.2	-72.5	-178.7	-8.4	0	0	113.8	V838 N841 L845 Q846 I847	V838-Q843 HydrophobicContact CG1-CB 3.8Å; N841-Q843 PolarHBondContact O-N 3.12Å; Q843-L845 VanDerWaalsContact C-N 3.35Å; Q843-Q846 WeakPolarHBondContact O-CB 3.42Å; Q843-Q846 PolarHBondContact O-N 3Å; Q843-I847 VanDerWaalsContact O-CG1 3.29Å; Q843-I847 WeakPolarHBondContact O-CG1 3.21Å; Q843-I847 PolarHBondContact O-N 3.21Å
844	A	71.4	Confident	67.3	Low	14.5 Å²	14.5	53.3 Å²	53.3	12%	0.12	29%	0.285	C	S	.	.	H	α-helix	trans	-65.3	-45.4	176.1	0	0	0	0	0	110.9	V834 V838 N841 Q846 I847 C848	V834-A844 HydrophobicContact CG1-CB 3.92Å; V834-A844 HydrophobicContact CG2-CB 4.35Å; V838-A844 HydrophobicContact CG1-CB 4.2Å; V838-A844 WeakPolarHBondContact O-CB 3.45Å; N841-A844 PolarHBondContact O-N 3.22Å; A844-Q846 VanDerWaalsContact C-N 3.3Å; A844-Q846 PolarHBondContact O-N 3.24Å; A844-I847 PolarHBondContact O-N 3.06Å; A844-I847 VanDerWaalsContact O-N 3.17Å; A844-C848 WeakPolarHBondContact O-CB 3.44Å; A844-C848 PolarHBondContact O-N 3.15Å; A844-C848 VanDerWaalsContact O-N 3.17Å; A844-C848 PolarHBondContact O-SG 3.23Å; A844-C848 VanDerWaalsContact O-SG 3.38Å
845	L	80.7	Confident	69.1	Low	5.5 Å²	5.5	52.2 Å²	52.2	3%	0.029	28%	0.279	C	S	.	.	H	α-helix	trans	-56.5	-45.4	173.5	175.2	64.9	0	0	0	111	S842 Q843 I847 C848 L849 P870 E874 V875 L878 M896 M899	S842-L845 PolarHBondContact O-N 2.95Å; Q843-L845 VanDerWaalsContact C-N 3.35Å; L845-I847 PolarHBondContact O-N 2.93Å; L845-C848 PolarHBondContact O-N 2.85Å; L845-L849 HydrophobicContact CD1-CD1 3.78Å; L845-L849 HydrophobicContact CD1-CG 4.08Å; L845-L849 HydrophobicContact CG-CD1 4.02Å; L845-L849 WeakPolarHBondContact O-CB 3.38Å; L845-L849 VanDerWaalsContact O-CG 3.3Å; L845-L849 WeakPolarHBondContact O-CG 3.44Å; L845-L849 PolarHBondContact O-N 3.19Å; L845-L849 VanDerWaalsContact O-N 3.09Å; L845-P870 HydrophobicContact CD1-CG 4.35Å; L845-P870 HydrophobicContact CD2-CB 4.26Å; L845-P870 HydrophobicContact CD2-CG 4.4Å; L845-E874 HydrophobicContact CD2-CB 4.45Å; L845-V875 HydrophobicContact CD2-CB 4.37Å; L845-V875 HydrophobicContact CD2-CG2 3.93Å; L845-L878 HydrophobicContact CB-CD2 4.41Å; L845-L878 HydrophobicContact CD2-CD1 3.95Å; L845-L878 HydrophobicContact CD2-CD2 4.08Å; L845-L878 HydrophobicContact CD2-CG 4.16Å; L845-L878 HydrophobicContact CG-CD1 4.25Å; L845-L878 HydrophobicContact CG-CD2 4.04Å; L845-L878 HydrophobicContact CG-CG 4.47Å; L845-M896 VanDerWaalsContact CA-CE 3.48Å; L845-M896 HydrophobicContact CB-CE 4.08Å; L845-M896 HydrophobicContact CB-SD 4.19Å; L845-M896 HydrophobicContact CD1-CE 3.64Å; L845-M896 HydrophobicContact CD1-CG 4.21Å; L845-M896 HydrophobicContact CD1-SD 3.54Å; L845-M896 WeakPolarHBondContact CD1-SD 3.23Å; L845-M896 HydrophobicContact CG-CE 4.29Å; L845-M896 HydrophobicContact CG-SD 4.24Å; L845-M899 HydrophobicContact CD1-CE 3.92Å; L845-M899 HydrophobicContact CD1-SD 4.22Å; L845-M899 HydrophobicContact CD2-CE 4.37Å
846	Q	82.3	Confident	71	Confident	50.5 Å²	50.5	51.5 Å²	51.5	24%	0.236	27%	0.273	C	S	.	.	H	α-helix	trans	-57.4	-51.4	176	-176.4	-173.2	-14.6	0	0	112.2	S842 Q843 A844 C848 L849 E850 L878 P879 L882	S842-Q846 WeakPolarHBondContact O-CB 3.29Å; S842-Q846 PolarHBondContact O-N 3.1Å; S842-Q846 VanDerWaalsContact O-N 3.11Å; Q843-Q846 WeakPolarHBondContact O-CB 3.42Å; Q843-Q846 PolarHBondContact O-N 3Å; A844-Q846 VanDerWaalsContact C-N 3.3Å; A844-Q846 PolarHBondContact O-N 3.24Å; Q846-C848 PolarHBondContact O-N 3.22Å; Q846-L849 PolarHBondContact O-N 2.84Å; Q846-E850 HydrophobicContact CG-CG 4.36Å; Q846-E850 WeakPolarHBondContact CG-OE1 3.31Å; Q846-E850 PolarHBondContact NE2-OE1 3.29Å; Q846-E850 WeakPolarHBondContact O-CB 3.42Å; Q846-E850 VanDerWaalsContact O-CG 3.32Å; Q846-E850 WeakPolarHBondContact O-CG 3.44Å; Q846-E850 PolarHBondContact O-N 3.03Å; Q846-L878 HydrophobicContact CB-CD2 3.85Å; Q846-L878 HydrophobicContact CG-CD2 4.44Å; Q846-P879 HydrophobicContact CG-CG 4.4Å; Q846-L882 HydrophobicContact CB-CD2 4.32Å; Q846-L882 HydrophobicContact CG-CD2 3.85Å
847	I	77.6	Confident	73.3	Confident	54 Å²	54	45.4 Å²	45.4	28%	0.277	24%	0.244	S	C	.	.	H	α-helix	trans	-61.5	-46.5	-177.6	-67.9	165.6	0	0	0	110.7	L830 V834 V838 Q843 A844 L845 L849 E850 Q851	L830-I847 HydrophobicContact CD1-CG2 4.28Å; L830-I847 HydrophobicContact CD2-CG2 4.18Å; V834-I847 HydrophobicContact CG2-CG2 4.34Å; V838-I847 HydrophobicContact CG1-CD1 4.41Å; Q843-I847 VanDerWaalsContact O-CG1 3.29Å; Q843-I847 WeakPolarHBondContact O-CG1 3.21Å; Q843-I847 PolarHBondContact O-N 3.21Å; A844-I847 PolarHBondContact O-N 3.06Å; A844-I847 VanDerWaalsContact O-N 3.17Å; L845-I847 PolarHBondContact O-N 2.93Å; I847-L849 VanDerWaalsContact C-N 3.33Å; I847-L849 PolarHBondContact O-N 3.2Å; I847-E850 PolarHBondContact O-N 3.17Å; I847-Q851 HydrophobicContact CG2-CG 4.17Å; I847-Q851 WeakPolarHBondContact O-CB 3.45Å; I847-Q851 VanDerWaalsContact O-CG 3.27Å; I847-Q851 WeakPolarHBondContact O-CG 3.32Å; I847-Q851 PolarHBondContact O-N 3.19Å
848	C	82.2	Confident	75.7	Confident	14.5 Å²	14.5	41.6 Å²	41.6	10%	0.098	22%	0.219	C	C	.	.	H	α-helix	trans	-57.9	-47.2	178.9	-70.3	0	0	0	0	111.9	L830 A844 L845 Q846 Q851 A852 M896 E900	L830-C848 HydrophobicContact CD1-CB 4.12Å; L830-C848 VanDerWaalsContact CD1-SG 3.59Å; L830-C848 WeakPolarHBondContact CD1-SG 3.18Å; A844-C848 WeakPolarHBondContact O-CB 3.44Å; A844-C848 PolarHBondContact O-N 3.15Å; A844-C848 VanDerWaalsContact O-N 3.17Å; A844-C848 PolarHBondContact O-SG 3.23Å; A844-C848 VanDerWaalsContact O-SG 3.38Å; L845-C848 PolarHBondContact O-N 2.85Å; Q846-C848 PolarHBondContact O-N 3.22Å; C848-Q851 PolarHBondContact O-N 3.17Å; C848-A852 VanDerWaalsContact O-CB 3.27Å; C848-A852 WeakPolarHBondContact O-CB 3.3Å; C848-A852 PolarHBondContact O-N 3.16Å; C848-M896 HydrophobicContact CB-CE 3.62Å; C848-M896 HydrophobicContact CB-SD 4.46Å; C848-E900 HydrophobicContact CB-CG 4.23Å; C848-E900 VanDerWaalsContact CB-OE1 3.3Å; C848-E900 WeakPolarHBondContact CB-OE1 3.38Å; C848-E900 PolarHBondContact SG-OE1 3.07Å
849	L	87.1	Confident	77.7	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-68.1	-39.6	-179.9	-66.2	176.2	0	0	0	112.6	L845 Q846 I847 A852 A853 L878 L882 V886 M896 M899 M903	L845-L849 HydrophobicContact CD1-CD1 3.78Å; L845-L849 HydrophobicContact CD1-CG 4.08Å; L845-L849 HydrophobicContact CG-CD1 4.02Å; L845-L849 WeakPolarHBondContact O-CB 3.38Å; L845-L849 VanDerWaalsContact O-CG 3.3Å; L845-L849 WeakPolarHBondContact O-CG 3.44Å; L845-L849 PolarHBondContact O-N 3.19Å; L845-L849 VanDerWaalsContact O-N 3.09Å; Q846-L849 PolarHBondContact O-N 2.84Å; I847-L849 VanDerWaalsContact C-N 3.33Å; I847-L849 PolarHBondContact O-N 3.2Å; L849-A852 PolarHBondContact O-N 3.27Å; L849-A853 VanDerWaalsContact O-CB 3.29Å; L849-A853 WeakPolarHBondContact O-CB 3.31Å; L849-A853 PolarHBondContact O-N 3.07Å; L849-L878 HydrophobicContact CD1-CD1 3.93Å; L849-L882 HydrophobicContact CB-CD1 4.23Å; L849-L882 HydrophobicContact CB-CD2 4.14Å; L849-L882 HydrophobicContact CD1-CD2 4.26Å; L849-L882 HydrophobicContact CD1-CG 4.46Å; L849-V886 HydrophobicContact CD1-CG2 3.68Å; L849-M896 HydrophobicContact CG-CE 4.38Å; L849-M899 HydrophobicContact CD1-CE 4.23Å; L849-M899 HydrophobicContact CD2-CB 3.91Å; L849-M903 HydrophobicContact CB-CE 4.29Å; L849-M903 HydrophobicContact CB-CG 4.04Å; L849-M903 HydrophobicContact CD2-CB 4.22Å; L849-M903 HydrophobicContact CD2-CE 4.39Å; L849-M903 HydrophobicContact CD2-CG 4.16Å; L849-M903 HydrophobicContact CG-CG 4.26Å; L849-M903 WeakPolarHBondContact O-CG 3.37Å
850	E	83.2	Confident	79.8	Confident	63 Å²	63	37.1 Å²	37.1	29%	0.294	19%	0.192	S	C	.	.	H	α-helix	trans	-65.6	-42.9	176.5	-75.2	178.3	-179.2	0	0	111.9	Q846 I847 A853 A854 L882	Q846-E850 HydrophobicContact CG-CG 4.36Å; Q846-E850 WeakPolarHBondContact CG-OE1 3.31Å; Q846-E850 PolarHBondContact NE2-OE1 3.29Å; Q846-E850 WeakPolarHBondContact O-CB 3.42Å; Q846-E850 VanDerWaalsContact O-CG 3.32Å; Q846-E850 WeakPolarHBondContact O-CG 3.44Å; Q846-E850 PolarHBondContact O-N 3.03Å; I847-E850 PolarHBondContact O-N 3.17Å; E850-A853 PolarHBondContact O-N 3.19Å; E850-A854 VanDerWaalsContact O-CB 3.32Å; E850-A854 WeakPolarHBondContact O-CB 3.34Å; E850-A854 PolarHBondContact O-N 3.31Å; E850-L882 HydrophobicContact CG-CD1 4.41Å; E850-L882 HydrophobicContact CG-CD2 4.3Å
851	Q	82.2	Confident	81.7	Confident	43.25 Å²	43.25	28 Å²	28	20%	0.202	16%	0.156	C	C	.	.	H	α-helix	trans	-69.2	-39.4	177.1	-65	-55.5	-40.1	0	0	111.8	F790 I828 L830 I847 C848 A853 A854 S855	F790-Q851 HydrophobicContact CD2-CB 3.81Å; F790-Q851 HydrophobicContact CE2-CB 3.63Å; F790-Q851 HydrophobicContact CZ-CB 4.49Å; I828-Q851 HydrophobicContact CG2-CB 4.31Å; I828-Q851 HydrophobicContact CG2-CG 4.33Å; L830-Q851 HydrophobicContact CD2-CG 4.41Å; I847-Q851 HydrophobicContact CG2-CG 4.17Å; I847-Q851 WeakPolarHBondContact O-CB 3.45Å; I847-Q851 VanDerWaalsContact O-CG 3.27Å; I847-Q851 WeakPolarHBondContact O-CG 3.32Å; I847-Q851 PolarHBondContact O-N 3.19Å; C848-Q851 PolarHBondContact O-N 3.17Å; Q851-A853 VanDerWaalsContact C-N 3.33Å; Q851-A853 PolarHBondContact O-N 3.37Å; Q851-A854 PolarHBondContact O-N 3.3Å; Q851-S855 PolarHBondContact O-N 3.14Å; Q851-S855 VanDerWaalsContact O-N 3.08Å
852	A	85.8	Confident	83.3	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.2	-43.4	173.3	0	0	0	0	0	111.4	F790 C848 L849 A854 S855 F858 E900 M903	F790-A852 HydrophobicContact CD1-CB 4.4Å; F790-A852 HydrophobicContact CE1-CB 4.13Å; F790-A852 HydrophobicContact CZ-CB 4.41Å; C848-A852 VanDerWaalsContact O-CB 3.27Å; C848-A852 WeakPolarHBondContact O-CB 3.3Å; C848-A852 PolarHBondContact O-N 3.16Å; L849-A852 PolarHBondContact O-N 3.27Å; A852-A854 VanDerWaalsContact C-N 3.35Å; A852-A854 PolarHBondContact O-N 3.05Å; A852-S855 PolarHBondContact O-N 3.25Å; A852-S855 PolarHBondContact O-OG 3.1Å; A852-F858 HydrophobicContact CB-CD2 4.44Å; A852-F858 HydrophobicContact CB-CE2 3.99Å; A852-E900 HydrophobicContact CB-CB 4.18Å; A852-E900 HydrophobicContact CB-CG 4.37Å; A852-M903 HydrophobicContact CB-CB 4.43Å
853	A	84.7	Confident	84.5	Confident	22.75 Å²	22.75	22.2 Å²	22.2	19%	0.188	12%	0.122	C	C	.	.	H	α-helix	trans	-67.9	-33.2	177.1	0	0	0	0	0	113.6	L849 E850 Q851 M903 A907	L849-A853 VanDerWaalsContact O-CB 3.29Å; L849-A853 WeakPolarHBondContact O-CB 3.31Å; L849-A853 PolarHBondContact O-N 3.07Å; E850-A853 PolarHBondContact O-N 3.19Å; Q851-A853 VanDerWaalsContact C-N 3.33Å; Q851-A853 PolarHBondContact O-N 3.37Å; A853-M903 HydrophobicContact CB-CE 3.76Å; A853-M903 HydrophobicContact CB-CG 3.77Å; A853-M903 HydrophobicContact CB-SD 4.18Å; A853-A907 HydrophobicContact CB-CB 4.35Å; A853-A907 VanDerWaalsContact O-CB 3.26Å; A853-A907 WeakPolarHBondContact O-CB 3.41Å
854	A	79.9	Confident	85.4	Confident	40 Å²	40	18.4 Å²	18.4	33%	0.331	11%	0.105	S	C	.	.	H	α-helix	trans	-78.8	-22.3	-179.5	0	0	0	0	0	113.5	Q788 E850 Q851 A852	Q788-A854 PolarHBondContact OE1-O 3.18Å; E850-A854 VanDerWaalsContact O-CB 3.32Å; E850-A854 WeakPolarHBondContact O-CB 3.34Å; E850-A854 PolarHBondContact O-N 3.31Å; Q851-A854 PolarHBondContact O-N 3.3Å; A852-A854 VanDerWaalsContact C-N 3.35Å; A852-A854 PolarHBondContact O-N 3.05Å
855	S	85.2	Confident	86.2	Confident	9.5 Å²	9.5	19.4 Å²	19.4	7%	0.066	11%	0.106	C	C	.	.			trans	-57.2	146.8	-175.5	70.7	0	0	0	0	114.3	Q851 A852 K911	Q851-S855 PolarHBondContact O-N 3.14Å; Q851-S855 VanDerWaalsContact O-N 3.08Å; A852-S855 PolarHBondContact O-N 3.25Å; A852-S855 PolarHBondContact O-OG 3.1Å; S855-K911 PolarHBondContact O-NZ 3.22Å
856	D	84.8	Confident	86.5	Confident	39.75 Å²	39.75	19.4 Å²	19.4	21%	0.213	11%	0.106	C	C	.	.	S	Bend	trans	-92.2	-39.6	171.8	-68	-55	0	0	0	111.3	C787 Q788 K911 R932	C787-D856 WeakPolarHBondContact CA-OD2 3.38Å; Q788-D856 PolarHBondContact N-OD2 3.38Å; Q788-D856 PolarHBondContact O-N 3Å; D856-K911 IonicContact OD1-NZ 3.28Å; D856-K911 PolarHBondContact OD1-NZ 3.28Å; D856-R932 WeakPolarHBondContact O-CB 3.24Å; D856-R932 WeakPolarHBondContact O-CD 3.27Å; D856-R932 VanDerWaalsContact O-CG 3.28Å; D856-R932 WeakPolarHBondContact O-CG 3.37Å; D856-R932 PolarHBondContact O-NH1 3.18Å; D856-R932 IonicContact OD1-NH1 3.44Å; D856-R932 PolarHBondContact OD1-NH1 3Å
857	I	89.3	Confident	86.6	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	124.7	171.9	-57.8	175.4	0	0	0	108.1	Q788 L789 F790 V859 R932 V1011 L1014 L1015 L1018	Q788-I857 PolarHBondContact O-N 2.79Å; L789-I857 CarbonylContact C-O 3.57Å; L789-I857 WeakPolarHBondContact CA-O 3.36Å; L789-I857 HydrophobicContact CD1-CB 3.92Å; L789-I857 HydrophobicContact CD1-CD1 4.49Å; L789-I857 HydrophobicContact CD1-CG2 3.72Å; L789-I857 VanDerWaalsContact CD1-CG2 3.45Å; F790-I857 PolarHBondContact N-O 3.4Å; I857-V859 HydrophobicContact CG2-CG2 4.37Å; I857-R932 CarbonylContact C-O 3.55Å; I857-R932 VanDerWaalsContact CA-O 3.3Å; I857-R932 WeakPolarHBondContact CA-O 3.33Å; I857-V1011 HydrophobicContact CD1-CG1 4.38Å; I857-L1014 HydrophobicContact CD1-CB 4.12Å; I857-L1014 HydrophobicContact CG2-CD1 4.15Å; I857-L1015 HydrophobicContact CD1-CD2 3.85Å; I857-L1015 HydrophobicContact CD1-CG 4.17Å; I857-L1018 HydrophobicContact CD1-CD1 3.95Å; I857-L1018 HydrophobicContact CG1-CD1 3.68Å
858	F	92.3	Very high	86.9	Confident	1.5 Å²	1.5	19.3 Å²	19.3	1%	0.007	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	120.7	174.3	-173.6	-90.8	0	0	0	109.1	F790 S792 A852 L860 E900 Y901 A904 R932 I933 C934	F790-F858 HydrophobicContact CB-CD2 4.36Å; F790-F858 AromaticContact CD1-CD2 3.51Å; F790-F858 HydrophobicContact CD1-CD2 3.51Å; F790-F858 VanDerWaalsContact CD1-CD2 3.45Å; F790-F858 AromaticContact CD1-CE2 3.35Å; F790-F858 HydrophobicContact CD1-CE2 3.35Å; F790-F858 HydrophobicContact CD1-CZ 4.37Å; F790-F858 HydrophobicContact CE1-CD2 4.25Å; F790-F858 AromaticContact CE1-CE2 3.63Å; F790-F858 HydrophobicContact CE1-CE2 3.63Å; F790-F858 HydrophobicContact CE1-CZ 4.43Å; F790-F858 HydrophobicContact CG-CD2 4.33Å; F790-F858 HydrophobicContact CG-CE2 4.45Å; S792-F858 VanDerWaalsContact CB-CZ 3.43Å; A852-F858 HydrophobicContact CB-CD2 4.44Å; A852-F858 HydrophobicContact CB-CE2 3.99Å; F858-L860 HydrophobicContact CD1-CB 4.3Å; F858-L860 HydrophobicContact CE1-CB 3.84Å; F858-L860 HydrophobicContact CE1-CD1 4.38Å; F858-L860 HydrophobicContact CE1-CG 4.47Å; F858-E900 HydrophobicContact CE2-CB 4.1Å; F858-E900 HydrophobicContact CZ-CB 3.98Å; F858-Y901 HydrophobicContact CE1-CD2 4.31Å; F858-A904 HydrophobicContact CB-CB 4.01Å; F858-A904 HydrophobicContact CD1-CB 4.24Å; F858-A904 HydrophobicContact CD2-CB 3.42Å; F858-A904 VanDerWaalsContact CD2-CB 3.44Å; F858-A904 HydrophobicContact CE1-CB 4.49Å; F858-A904 HydrophobicContact CE2-CB 3.84Å; F858-A904 HydrophobicContact CG-CB 3.64Å; F858-A904 HydrophobicContact CZ-CB 4.4Å; F858-R932 PolarHBondContact N-O 2.94Å; F858-I933 HydrophobicContact CB-CG1 4.31Å; F858-I933 HydrophobicContact CB-CG2 4.49Å; F858-I933 HydrophobicContact CD1-CG2 4.11Å; F858-I933 WeakPolarHBondContact O-CA 3.38Å; F858-C934 PolarHBondContact O-N 3.37Å; F858-C934 PolarHBondContact O-SG 3.05Å; F858-C934 VanDerWaalsContact O-SG 3.35Å
859	V	92.4	Very high	87.1	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	118.9	176.7	-177.3	0	0	0	0	107.9	L789 F790 I791 S792 I857 L861 C934 F936 F1007	L789-V859 HydrophobicContact CD1-CG2 3.66Å; L789-V859 VanDerWaalsContact CD1-CG2 3.42Å; L789-V859 HydrophobicContact CD2-CG2 4.29Å; L789-V859 HydrophobicContact CG-CG2 4.01Å; F790-V859 PolarHBondContact O-N 3.28Å; I791-V859 HydrophobicContact CG1-CB 4.49Å; S792-V859 PolarHBondContact N-O 3.37Å; I857-V859 HydrophobicContact CG2-CG2 4.37Å; V859-L861 HydrophobicContact CG1-CD2 4.03Å; V859-L861 HydrophobicContact CG1-CG 4.47Å; V859-C934 CarbonylContact C-O 3.51Å; V859-C934 WeakPolarHBondContact CA-O 3.38Å; V859-F936 HydrophobicContact CG1-CD2 4.08Å; V859-F936 HydrophobicContact CG1-CE2 4.07Å; V859-F1007 HydrophobicContact CG1-CD2 4.44Å; V859-F1007 HydrophobicContact CG1-CE2 4.01Å; V859-F1007 HydrophobicContact CG2-CE2 4.04Å
860	L	93	Very high	87	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124	175.6	-177.7	60.3	0	0	0	110.4	S792 F858 L862 T897 Y901 C934 V935 F936 F968 I972	S792-L860 CarbonylContact O-C 3.56Å; S792-L860 WeakPolarHBondContact O-CA 3.32Å; F858-L860 HydrophobicContact CD1-CB 4.3Å; F858-L860 HydrophobicContact CE1-CB 3.84Å; F858-L860 HydrophobicContact CE1-CD1 4.38Å; F858-L860 HydrophobicContact CE1-CG 4.47Å; L860-L862 HydrophobicContact CD1-CD2 4.02Å; L860-L862 HydrophobicContact CD1-CG 4.4Å; L860-L862 HydrophobicContact CD2-CD1 4.02Å; L860-L862 HydrophobicContact CD2-CD2 4.24Å; L860-L862 HydrophobicContact CD2-CG 4.12Å; L860-L862 HydrophobicContact CG-CD1 4.39Å; L860-L862 HydrophobicContact CG-CD2 4.07Å; L860-L862 HydrophobicContact CG-CG 3.95Å; L860-T897 HydrophobicContact CD1-CG2 3.47Å; L860-T897 VanDerWaalsContact CD1-CG2 3.45Å; L860-Y901 HydrophobicContact CD2-CD2 4.01Å; L860-Y901 HydrophobicContact CD2-CG 4.46Å; L860-C934 PolarHBondContact N-O 3.21Å; L860-V935 HydrophobicContact CB-CB 4.39Å; L860-V935 HydrophobicContact CB-CG1 4.13Å; L860-V935 HydrophobicContact CB-CG2 4.01Å; L860-V935 HydrophobicContact CD2-CG1 4.08Å; L860-V935 HydrophobicContact CD2-CG2 4.17Å; L860-V935 HydrophobicContact CG-CG1 4.17Å; L860-V935 CarbonylContact O-C 3.51Å; L860-V935 VanDerWaalsContact O-CA 3.3Å; L860-V935 WeakPolarHBondContact O-CA 3.25Å; L860-F936 PolarHBondContact O-N 3.05Å; L860-F968 HydrophobicContact CD2-CE1 4.16Å; L860-F968 HydrophobicContact CD2-CZ 3.97Å; L860-I972 HydrophobicContact CD2-CD1 3.7Å
861	L	91.7	Very high	87.1	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	125.2	171.9	-44.5	175.2	0	0	0	109.2	I791 S792 S793 M798 E801 R802 L805 V859 F936 F1003	I791-L861 HydrophobicContact CG2-CD1 4.38Å; S792-L861 PolarHBondContact O-N 3.09Å; S793-L861 WeakPolarHBondContact CA-O 3.24Å; S793-L861 WeakPolarHBondContact CB-O 3.28Å; M798-L861 HydrophobicContact CE-CB 3.97Å; M798-L861 HydrophobicContact CG-CB 4.4Å; M798-L861 HydrophobicContact SD-CB 4.39Å; E801-L861 HydrophobicContact CB-CD1 4.08Å; R802-L861 HydrophobicContact CG-CD1 3.96Å; L805-L861 HydrophobicContact CD1-CD1 3.77Å; L805-L861 HydrophobicContact CD1-CD2 4.29Å; L805-L861 HydrophobicContact CD1-CG 4.42Å; V859-L861 HydrophobicContact CG1-CD2 4.03Å; V859-L861 HydrophobicContact CG1-CG 4.47Å; L861-F936 WeakPolarHBondContact CA-O 3.31Å; L861-F936 HydrophobicContact CD2-CB 3.89Å; L861-F936 HydrophobicContact CD2-CD2 3.97Å; L861-F936 HydrophobicContact CD2-CG 4.25Å; L861-F1003 HydrophobicContact CD1-CZ 4.49Å; L861-F1003 HydrophobicContact CD2-CE2 3.76Å; L861-F1003 HydrophobicContact CD2-CZ 3.84Å
862	L	90.4	Very high	87.2	Confident	3.75 Å²	3.75	26.6 Å²	26.6	2%	0.02	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130	179.9	-64.3	177.6	0	0	0	111.7	M798 L860 T897 V935 F936 I937 R938 F968 K969 I972	M798-L862 WeakPolarHBondContact CE-O 3.36Å; L860-L862 HydrophobicContact CD1-CD2 4.02Å; L860-L862 HydrophobicContact CD1-CG 4.4Å; L860-L862 HydrophobicContact CD2-CD1 4.02Å; L860-L862 HydrophobicContact CD2-CD2 4.24Å; L860-L862 HydrophobicContact CD2-CG 4.12Å; L860-L862 HydrophobicContact CG-CD1 4.39Å; L860-L862 HydrophobicContact CG-CD2 4.07Å; L860-L862 HydrophobicContact CG-CG 3.95Å; L862-T897 HydrophobicContact CD2-CG2 4.34Å; L862-V935 HydrophobicContact CD1-CG1 4.17Å; L862-V935 HydrophobicContact CG-CG1 4.46Å; L862-F936 PolarHBondContact N-O 3.21Å; L862-I937 HydrophobicContact CB-CG1 4.34Å; L862-I937 HydrophobicContact CD1-CD1 4.5Å; L862-I937 HydrophobicContact CD1-CG1 4.27Å; L862-I937 WeakPolarHBondContact O-CA 3.34Å; L862-R938 PolarHBondContact O-N 3.23Å; L862-R938 VanDerWaalsContact O-N 3.11Å; L862-F968 HydrophobicContact CD1-CD1 4.33Å; L862-F968 HydrophobicContact CD1-CE1 4.17Å; L862-F968 HydrophobicContact CD2-CD1 4.43Å; L862-F968 HydrophobicContact CD2-CE1 4.03Å; L862-K969 HydrophobicContact CD1-CG 4.35Å; L862-I972 HydrophobicContact CD1-CD1 3.44Å; L862-I972 VanDerWaalsContact CD1-CD1 3.43Å
863	G	88.1	Confident	87.1	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.186	C	C	.	.			trans	-110.3	-137.3	170.9	0	0	0	0	0	110.7	K969	G863-K969 VanDerWaalsContact O-CE 3.25Å; G863-K969 WeakPolarHBondContact O-CE 3.35Å; G863-K969 PolarHBondContact O-NZ 2.99Å
864	D	88.4	Confident	86.9	Confident	23.5 Å²	23.5	33.1 Å²	33.1	13%	0.126	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-108.7	17.3	179.3	-64.5	-41.8	0	0	0	112.7	S940 F954 E955 E956 L965 K969	D864-S940 PolarHBondContact OD1-OG 3.09Å; D864-S940 VanDerWaalsContact OD1-OG 3.11Å; D864-S940 WeakPolarHBondContact OD2-CA 3.46Å; D864-S940 WeakPolarHBondContact OD2-CB 3.25Å; D864-S940 PolarHBondContact OD2-OG 3.24Å; D864-F954 CarbonylContact C-O 3.56Å; D864-E955 HydrophobicContact CB-CG 4.45Å; D864-E956 WeakPolarHBondContact O-CB 3.38Å; D864-E956 PolarHBondContact O-N 3.26Å; D864-E956 VanDerWaalsContact O-N 3.07Å; D864-L965 VanDerWaalsContact C-CD2 3.47Å; D864-K969 IonicContact OD1-NZ 3.1Å; D864-K969 PolarHBondContact OD1-NZ 3.1Å
865	R	87.8	Confident	87.2	Confident	36.5 Å²	36.5	31.3 Å²	31.3	14%	0.138	17%	0.173	C	C	.	.			trans	-110	140.9	169.9	-60.4	-167.4	68.4	140	10.5	112.4	T794 R796 D797 H952 Y953 F954	T794-R865 HydrophobicContact CG2-CB 4.2Å; R796-R865 VanDerWaalsContact CD-NH1 3.35Å; D797-R865 HydrophobicContact CB-CG 4.14Å; R865-H952 PolarHBondContact NH1-O 3.09Å; R865-H952 VanDerWaalsContact NH1-O 3.12Å; R865-Y953 VanDerWaalsContact CD-O 3.25Å; R865-Y953 WeakPolarHBondContact CD-O 3.35Å; R865-Y953 PolarHBondContact NH1-O 3.02Å; R865-Y953 VanDerWaalsContact NH1-O 3.12Å; R865-F954 VanDerWaalsContact CG-O 3.29Å; R865-F954 WeakPolarHBondContact CG-O 3.3Å
866	Y	88.3	Confident	87.1	Confident	5.5 Å²	5.5	36.2 Å²	36.2	2%	0.022	20%	0.196	C	C	.	.			trans	-84.6	-29.6	178.4	-173.6	-124.6	0	0	0	113.1	I869 G893 S895 E898 E956 K961 R964 L965 F968	Y866-I869 HydrophobicContact CD1-CD1 4.26Å; Y866-I869 HydrophobicContact CD1-CG1 4.34Å; Y866-I869 HydrophobicContact CE1-CD1 4.06Å; Y866-I869 HydrophobicContact CE1-CG1 4.12Å; Y866-G893 PolarHBondContact OH-O 3.03Å; Y866-S895 VanDerWaalsContact O-CB 3.23Å; Y866-S895 WeakPolarHBondContact O-CB 3.35Å; Y866-S895 PolarHBondContact O-OG 3.21Å; Y866-S895 PolarHBondContact OH-N 3.16Å; Y866-E898 WeakPolarHBondContact CE2-OE2 3.32Å; Y866-E898 VanDerWaalsContact CZ-OE2 3.27Å; Y866-E898 PolarHBondContact OH-OE2 3.22Å; Y866-E956 PolarHBondContact N-OE2 3.38Å; Y866-K961 HydrophobicContact CD1-CB 4.07Å; Y866-K961 HydrophobicContact CD1-CD 4.47Å; Y866-K961 HydrophobicContact CD1-CG 4.05Å; Y866-K961 HydrophobicContact CG-CB 4.33Å; Y866-R964 HydrophobicContact CD1-CB 4.36Å; Y866-R964 HydrophobicContact CD2-CB 4.23Å; Y866-R964 HydrophobicContact CE1-CB 3.88Å; Y866-R964 HydrophobicContact CE1-CG 4.44Å; Y866-R964 HydrophobicContact CE2-CB 3.76Å; Y866-R964 HydrophobicContact CG-CB 4.4Å; Y866-R964 VanDerWaalsContact CZ-CB 3.48Å; Y866-L965 HydrophobicContact CD2-CB 3.89Å; Y866-L965 HydrophobicContact CD2-CD1 4.34Å; Y866-L965 HydrophobicContact CG-CB 4.39Å; Y866-F968 HydrophobicContact CE2-CB 4.48Å
867	G	84.6	Confident	87.1	Confident	16 Å²	16	37.1 Å²	37.1	17%	0.165	21%	0.21	C	C	.	.			trans	103.3	-169.8	177.7	0	0	0	0	0	114.5	T794	T794-G867 VanDerWaalsContact CG2-CA 3.49Å
868	C	82.6	Confident	86.9	Confident	86.75 Å²	86.75	37.5 Å²	37.5	59%	0.586	21%	0.212	S	C	*	.			trans	-79.4	133.9	178.9	-167.2	0	0	0	0	110.3	S895 M896	C868-S895 CarbonylContact O-C 3.56Å; C868-S895 VanDerWaalsContact O-CA 3.28Å; C868-S895 WeakPolarHBondContact O-CA 3.42Å; C868-S895 WeakPolarHBondContact O-CB 3.32Å; C868-M896 HydrophobicContact CB-CE 4.33Å; C868-M896 HydrophobicContact CB-CG 4.37Å; C868-M896 PolarHBondContact O-N 3.14Å
869	I	86.8	Confident	86.5	Confident	52.25 Å²	52.25	39.6 Å²	39.6	27%	0.268	23%	0.225	S	C	.	.			trans	-100.5	115.5	173.2	-63.8	172.7	0	0	0	106.3	Y866 G893 K961	Y866-I869 HydrophobicContact CD1-CD1 4.26Å; Y866-I869 HydrophobicContact CD1-CG1 4.34Å; Y866-I869 HydrophobicContact CE1-CD1 4.06Å; Y866-I869 HydrophobicContact CE1-CG1 4.12Å; I869-G893 WeakPolarHBondContact CD1-O 3.1Å; I869-K961 HydrophobicContact CD1-CD 4.47Å; I869-K961 HydrophobicContact CD1-CG 4.21Å
870	P	85.5	Confident	85.9	Confident	8.5 Å²	8.5	47.6 Å²	47.6	6%	0.055	26%	0.263	C	S	.	.			trans	-69	148.2	176.6	29.4	-32.5	0	0	0	110.7	L845 E874 V875 M894 M896 M899	L845-P870 HydrophobicContact CD1-CG 4.35Å; L845-P870 HydrophobicContact CD2-CB 4.26Å; L845-P870 HydrophobicContact CD2-CG 4.4Å; P870-E874 WeakPolarHBondContact CA-OE2 3.45Å; P870-E874 WeakPolarHBondContact CB-OE2 3.43Å; P870-V875 HydrophobicContact CB-CG2 4.24Å; P870-V875 HydrophobicContact CG-CG2 3.98Å; P870-M894 WeakPolarHBondContact CD-O 3.33Å; P870-M896 HydrophobicContact CB-SD 4.14Å; P870-M896 HydrophobicContact CG-CG 4.45Å; P870-M896 HydrophobicContact CG-SD 3.96Å; P870-M899 HydrophobicContact CG-SD 3.76Å
871	D	84.9	Confident	85.2	Confident	105.5 Å²	105.5	51.3 Å²	51.3	56%	0.564	29%	0.288	S	S	*	.			trans	-67.1	145.6	176.2	-80	-20	0	0	0	110	T873 E874 V875	D871-T873 PolarHBondContact O-N 3.01Å; D871-T873 VanDerWaalsContact O-N 3.12Å; D871-E874 HydrophobicContact CB-CG 4.11Å; D871-E874 PolarHBondContact N-OE2 3.25Å; D871-E874 WeakPolarHBondContact O-CA 3.47Å; D871-E874 WeakPolarHBondContact O-CB 3.44Å; D871-E874 PolarHBondContact O-N 3.11Å; D871-V875 PolarHBondContact O-N 3.17Å; D871-V875 VanDerWaalsContact O-N 3.17Å
872	E	84.3	Confident	84.9	Confident	107.75 Å²	107.75	51.7 Å²	51.7	50%	0.504	29%	0.291	S	S	.	.	H	α-helix	trans	-57	-32.5	179.2	-69.1	-174.5	179.6	0	0	112.2	E874 V875 M876 P892	E872-E874 VanDerWaalsContact C-N 3.31Å; E872-E874 PolarHBondContact O-N 2.94Å; E872-V875 PolarHBondContact O-N 3.17Å; E872-M876 WeakPolarHBondContact O-CB 3.36Å; E872-M876 WeakPolarHBondContact O-CG 3.36Å; E872-M876 PolarHBondContact O-N 3.17Å; E872-P892 VanDerWaalsContact OE1-CB 3.28Å; E872-P892 WeakPolarHBondContact OE1-CB 3.19Å; E872-P892 VanDerWaalsContact OE1-CG 3.28Å; E872-P892 WeakPolarHBondContact OE1-CG 3.43Å
873	T	83.4	Confident	84.7	Confident	105.5 Å²	105.5	53.2 Å²	53.2	65%	0.647	30%	0.299	S	S	*	.	H	α-helix	trans	-63.9	-34.9	175.3	50.2	0	0	0	0	112.7	D871 A877	D871-T873 PolarHBondContact O-N 3.01Å; D871-T873 VanDerWaalsContact O-N 3.12Å; T873-A877 VanDerWaalsContact O-CB 3.31Å; T873-A877 WeakPolarHBondContact O-CB 3.26Å; T873-A877 PolarHBondContact O-N 3.13Å; T873-A877 VanDerWaalsContact O-N 3.11Å
874	E	82.1	Confident	84.5	Confident	53.75 Å²	53.75	56.4 Å²	56.4	25%	0.251	32%	0.321	S	S	.	.	H	α-helix	trans	-71.2	-40.4	177.1	-63.4	179.1	152.8	0	0	111.2	S842 L845 P870 D871 E872 A877	S842-E874 WeakPolarHBondContact CB-O 3.43Å; L845-E874 HydrophobicContact CD2-CB 4.45Å; P870-E874 WeakPolarHBondContact CA-OE2 3.45Å; P870-E874 WeakPolarHBondContact CB-OE2 3.43Å; D871-E874 HydrophobicContact CB-CG 4.11Å; D871-E874 PolarHBondContact N-OE2 3.25Å; D871-E874 WeakPolarHBondContact O-CA 3.47Å; D871-E874 WeakPolarHBondContact O-CB 3.44Å; D871-E874 PolarHBondContact O-N 3.11Å; E872-E874 VanDerWaalsContact C-N 3.31Å; E872-E874 PolarHBondContact O-N 2.94Å; E874-A877 WeakPolarHBondContact O-CB 3.34Å; E874-A877 PolarHBondContact O-N 2.87Å
875	V	84.5	Confident	84.3	Confident	0.75 Å²	0.75	58.3 Å²	58.3	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-64.3	-44.5	176.1	-177.3	0	0	0	0	110.3	L845 P870 D871 E872 A877 L878 L883 V886 Y890 M899	L845-V875 HydrophobicContact CD2-CB 4.37Å; L845-V875 HydrophobicContact CD2-CG2 3.93Å; P870-V875 HydrophobicContact CB-CG2 4.24Å; P870-V875 HydrophobicContact CG-CG2 3.98Å; D871-V875 PolarHBondContact O-N 3.17Å; D871-V875 VanDerWaalsContact O-N 3.17Å; E872-V875 PolarHBondContact O-N 3.17Å; V875-A877 PolarHBondContact O-N 2.94Å; V875-L878 HydrophobicContact CG1-CD1 4.4Å; V875-L878 WeakPolarHBondContact O-CB 3.24Å; V875-L878 WeakPolarHBondContact O-CD1 3.48Å; V875-L878 VanDerWaalsContact O-CG 3.26Å; V875-L878 WeakPolarHBondContact O-CG 3.36Å; V875-L878 PolarHBondContact O-N 3.13Å; V875-L883 WeakPolarHBondContact O-CD1 3.28Å; V875-V886 HydrophobicContact CG1-CG1 4.04Å; V875-Y890 HydrophobicContact CB-CE1 4.42Å; V875-Y890 HydrophobicContact CB-CE2 4.47Å; V875-Y890 HydrophobicContact CG1-CD1 4.15Å; V875-Y890 HydrophobicContact CG1-CD2 4.29Å; V875-Y890 HydrophobicContact CG1-CE1 4.03Å; V875-Y890 HydrophobicContact CG1-CE2 4.17Å; V875-Y890 HydrophobicContact CG1-CG 4.27Å; V875-Y890 HydrophobicContact CG2-CE1 4.41Å; V875-Y890 HydrophobicContact CG2-CE2 3.85Å; V875-M899 HydrophobicContact CG1-CE 4.38Å; V875-M899 HydrophobicContact CG2-CE 4.29Å
876	M	84.5	Confident	84.3	Confident	112.5 Å²	112.5	56.5 Å²	56.5	55%	0.554	32%	0.322	S	S	*	.	H	α-helix	trans	-70	-16.3	177.8	-64	-63	167.7	0	0	113.4	E872 L878 L883	E872-M876 WeakPolarHBondContact O-CB 3.36Å; E872-M876 WeakPolarHBondContact O-CG 3.36Å; E872-M876 PolarHBondContact O-N 3.17Å; M876-L878 VanDerWaalsContact C-N 3.32Å; M876-L883 HydrophobicContact SD-CD1 4.41Å
877	A	84.3	Confident	84.2	Confident	60 Å²	60	59.9 Å²	59.9	50%	0.496	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-1.7	174.9	0	0	0	0	0	113.7	T873 E874 V875	T873-A877 VanDerWaalsContact O-CB 3.31Å; T873-A877 WeakPolarHBondContact O-CB 3.26Å; T873-A877 PolarHBondContact O-N 3.13Å; T873-A877 VanDerWaalsContact O-N 3.11Å; E874-A877 WeakPolarHBondContact O-CB 3.34Å; E874-A877 PolarHBondContact O-N 2.87Å; V875-A877 PolarHBondContact O-N 2.94Å
878	L	84.5	Confident	84.3	Confident	8.25 Å²	8.25	65.1 Å²	65.1	4%	0.043	36%	0.364	C	S	.	.	S	Bend	trans	-65.5	150.2	176.3	-68	174.6	0	0	0	111.8	S842 L845 Q846 L849 V875 M876 E880 L882 L883 V886	S842-L878 WeakPolarHBondContact O-CD2 3.41Å; L845-L878 HydrophobicContact CB-CD2 4.41Å; L845-L878 HydrophobicContact CD2-CD1 3.95Å; L845-L878 HydrophobicContact CD2-CD2 4.08Å; L845-L878 HydrophobicContact CD2-CG 4.16Å; L845-L878 HydrophobicContact CG-CD1 4.25Å; L845-L878 HydrophobicContact CG-CD2 4.04Å; L845-L878 HydrophobicContact CG-CG 4.47Å; Q846-L878 HydrophobicContact CB-CD2 3.85Å; Q846-L878 HydrophobicContact CG-CD2 4.44Å; L849-L878 HydrophobicContact CD1-CD1 3.93Å; V875-L878 HydrophobicContact CG1-CD1 4.4Å; V875-L878 WeakPolarHBondContact O-CB 3.24Å; V875-L878 WeakPolarHBondContact O-CD1 3.48Å; V875-L878 VanDerWaalsContact O-CG 3.26Å; V875-L878 WeakPolarHBondContact O-CG 3.36Å; V875-L878 PolarHBondContact O-N 3.13Å; M876-L878 VanDerWaalsContact C-N 3.32Å; L878-E880 PolarHBondContact O-N 3.17Å; L878-L882 HydrophobicContact CD1-CD2 4.39Å; L878-L882 HydrophobicContact CD2-CD2 4.12Å; L878-L883 HydrophobicContact CB-CB 4.32Å; L878-V886 HydrophobicContact CD1-CG2 4.17Å
879	P	83.6	Confident	84.6	Confident	45 Å²	45	62.1 Å²	62.1	29%	0.292	34%	0.341	S	S	.	.			trans	-55.2	140.8	174.8	-23	32.1	0	0	0	111.8	Q846 S881 L882 L883	Q846-P879 HydrophobicContact CG-CG 4.4Å; P879-S881 PolarHBondContact O-N 2.84Å; P879-L882 PolarHBondContact O-N 3.1Å; P879-L883 WeakPolarHBondContact O-CB 3.31Å; P879-L883 PolarHBondContact O-N 3.02Å
880	E	80.5	Confident	84.8	Confident	167.5 Å²	167.5	61.1 Å²	61.1	78%	0.783	33%	0.334	S	S	*	.	H	α-helix	trans	-50.5	-37	-174.2	-93.6	-179.3	175	0	0	113.8	L878 L882 S884	L878-E880 PolarHBondContact O-N 3.17Å; E880-L882 PolarHBondContact O-N 3.26Å; E880-S884 WeakPolarHBondContact O-CB 3.34Å; E880-S884 PolarHBondContact O-N 3.14Å; E880-S884 VanDerWaalsContact O-N 3.09Å
881	S	79.2	Confident	84.9	Confident	77 Å²	77	67.5 Å²	67.5	54%	0.538	36%	0.361	S	S	.	.	H	α-helix	trans	-62.4	-42.9	177.2	54.9	0	0	0	0	112.9	P879 S884	P879-S881 PolarHBondContact O-N 2.84Å; S881-S884 PolarHBondContact O-OG 3.21Å
882	L	83.5	Confident	85	Confident	10 Å²	10	66.1 Å²	66.1	5%	0.052	36%	0.358	C	S	.	.	H	α-helix	trans	-79.6	-41.6	-179.8	-173	64.6	0	0	0	110.6	Q846 L849 E850 L878 P879 E880 S884 E885 V886 M903	Q846-L882 HydrophobicContact CB-CD2 4.32Å; Q846-L882 HydrophobicContact CG-CD2 3.85Å; L849-L882 HydrophobicContact CB-CD1 4.23Å; L849-L882 HydrophobicContact CB-CD2 4.14Å; L849-L882 HydrophobicContact CD1-CD2 4.26Å; L849-L882 HydrophobicContact CD1-CG 4.46Å; E850-L882 HydrophobicContact CG-CD1 4.41Å; E850-L882 HydrophobicContact CG-CD2 4.3Å; L878-L882 HydrophobicContact CD1-CD2 4.39Å; L878-L882 HydrophobicContact CD2-CD2 4.12Å; P879-L882 PolarHBondContact O-N 3.1Å; E880-L882 PolarHBondContact O-N 3.26Å; L882-S884 VanDerWaalsContact C-N 3.27Å; L882-S884 PolarHBondContact O-N 3.22Å; L882-E885 PolarHBondContact O-N 3.24Å; L882-E885 VanDerWaalsContact O-N 3.11Å; L882-V886 HydrophobicContact CD1-CG2 4.45Å; L882-V886 HydrophobicContact CG-CG2 4.28Å; L882-V886 WeakPolarHBondContact O-CG2 3.34Å; L882-V886 PolarHBondContact O-N 2.89Å; L882-M903 HydrophobicContact CD1-CE 3.76Å; L882-M903 HydrophobicContact CG-CE 4.35Å
883	L	86.3	Confident	85	Confident	34.75 Å²	34.75	61.7 Å²	61.7	18%	0.182	34%	0.341	C	S	.	.	H	α-helix	trans	-55.6	-40.7	176.7	-175.4	61.3	0	0	0	111.4	V875 M876 L878 P879 E885 V886 C887	V875-L883 WeakPolarHBondContact O-CD1 3.28Å; M876-L883 HydrophobicContact SD-CD1 4.41Å; L878-L883 HydrophobicContact CB-CB 4.32Å; P879-L883 WeakPolarHBondContact O-CB 3.31Å; P879-L883 PolarHBondContact O-N 3.02Å; L883-E885 VanDerWaalsContact C-N 3.29Å; L883-E885 PolarHBondContact O-N 3.06Å; L883-V886 PolarHBondContact O-N 3.29Å; L883-C887 WeakPolarHBondContact O-CB 3.28Å; L883-C887 PolarHBondContact O-N 3.23Å; L883-C887 PolarHBondContact O-SG 3.35Å
884	S	84.4	Confident	85.4	Confident	66.75 Å²	66.75	57.1 Å²	57.1	47%	0.467	31%	0.313	S	S	.	.	H	α-helix	trans	-62	-32.1	177.4	96.1	0	0	0	0	114.1	E880 S881 L882 K888	E880-S884 WeakPolarHBondContact O-CB 3.34Å; E880-S884 PolarHBondContact O-N 3.14Å; E880-S884 VanDerWaalsContact O-N 3.09Å; S881-S884 PolarHBondContact O-OG 3.21Å; L882-S884 VanDerWaalsContact C-N 3.27Å; L882-S884 PolarHBondContact O-N 3.22Å; S884-K888 WeakPolarHBondContact O-CE 3.45Å
885	E	85	Confident	85.8	Confident	62.75 Å²	62.75	54.6 Å²	54.6	29%	0.293	30%	0.301	S	S	.	.	H	α-helix	trans	-79.5	-43.7	175.7	-66	-82.5	144.5	0	0	110.8	L882 L883 C887 K888 M903 Q906	L882-E885 PolarHBondContact O-N 3.24Å; L882-E885 VanDerWaalsContact O-N 3.11Å; L883-E885 VanDerWaalsContact C-N 3.29Å; L883-E885 PolarHBondContact O-N 3.06Å; E885-C887 PolarHBondContact O-N 3.19Å; E885-K888 VanDerWaalsContact O-CB 3.29Å; E885-K888 WeakPolarHBondContact O-CB 3.38Å; E885-K888 WeakPolarHBondContact O-CG 3.43Å; E885-K888 PolarHBondContact O-N 3.23Å; E885-K888 VanDerWaalsContact O-N 3.13Å; E885-K888 IonicContact OE1-NZ 3.28Å; E885-K888 PolarHBondContact OE1-NZ 3.09Å; E885-K888 IonicContact OE2-NZ 3.84Å; E885-K888 PolarHBondContact OE2-NZ 3.13Å; E885-M903 HydrophobicContact CB-CE 4.18Å; E885-M903 HydrophobicContact CB-SD 4.38Å; E885-Q906 PolarHBondContact O-OE1 3.14Å
886	V	87.2	Confident	85.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.6	-43.4	178.2	174.8	0	0	0	0	111.6	L849 V875 L878 L882 L883 K888 F889 Y890 M899 M903	L849-V886 HydrophobicContact CD1-CG2 3.68Å; V875-V886 HydrophobicContact CG1-CG1 4.04Å; L878-V886 HydrophobicContact CD1-CG2 4.17Å; L882-V886 HydrophobicContact CD1-CG2 4.45Å; L882-V886 HydrophobicContact CG-CG2 4.28Å; L882-V886 WeakPolarHBondContact O-CG2 3.34Å; L882-V886 PolarHBondContact O-N 2.89Å; L883-V886 PolarHBondContact O-N 3.29Å; V886-K888 PolarHBondContact O-N 3.31Å; V886-F889 HydrophobicContact CB-CZ 4.46Å; V886-F889 HydrophobicContact CG1-CZ 4.43Å; V886-F889 HydrophobicContact CG2-CZ 4.35Å; V886-F889 WeakPolarHBondContact O-CD1 3.22Å; V886-F889 PolarHBondContact O-N 2.86Å; V886-F889 VanDerWaalsContact O-N 3.09Å; V886-Y890 HydrophobicContact CG1-CD2 4.43Å; V886-Y890 HydrophobicContact CG1-CG 4.18Å; V886-Y890 VanDerWaalsContact O-CB 3.23Å; V886-Y890 WeakPolarHBondContact O-CB 3.32Å; V886-Y890 PolarHBondContact O-N 3.15Å; V886-M899 HydrophobicContact CG1-CE 3.77Å; V886-M903 HydrophobicContact CG2-CE 3.53Å; V886-M903 VanDerWaalsContact CG2-CE 3.48Å; V886-M903 HydrophobicContact CG2-SD 4.09Å
887	C	87.4	Confident	86.2	Confident	76.25 Å²	76.25	51.3 Å²	51.3	52%	0.515	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-15.8	178.1	-74.5	0	0	0	0	114.3	L883 E885 F889	L883-C887 WeakPolarHBondContact O-CB 3.28Å; L883-C887 PolarHBondContact O-N 3.23Å; L883-C887 PolarHBondContact O-SG 3.35Å; E885-C887 PolarHBondContact O-N 3.19Å; C887-F889 VanDerWaalsContact C-N 3.3Å; C887-F889 PolarHBondContact O-N 3.17Å
888	K	86.4	Confident	86.6	Confident	126 Å²	126	49.4 Å²	49.4	55%	0.548	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-22.4	177.1	-63.8	173.9	-171.7	167.9	0	113.2	S884 E885 V886 Q906	S884-K888 WeakPolarHBondContact O-CE 3.45Å; E885-K888 VanDerWaalsContact O-CB 3.29Å; E885-K888 WeakPolarHBondContact O-CB 3.38Å; E885-K888 WeakPolarHBondContact O-CG 3.43Å; E885-K888 PolarHBondContact O-N 3.23Å; E885-K888 VanDerWaalsContact O-N 3.13Å; E885-K888 IonicContact OE1-NZ 3.28Å; E885-K888 PolarHBondContact OE1-NZ 3.09Å; E885-K888 IonicContact OE2-NZ 3.84Å; E885-K888 PolarHBondContact OE2-NZ 3.13Å; V886-K888 PolarHBondContact O-N 3.31Å; K888-Q906 VanDerWaalsContact CB-NE2 3.33Å
889	F	88.5	Confident	86.9	Confident	23 Å²	23	49 Å²	49	10%	0.101	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132	-23.5	-176.4	64.1	-95.1	0	0	0	113.8	V886 C887 K891 M894 M899 H902 M903 Q906	V886-F889 HydrophobicContact CB-CZ 4.46Å; V886-F889 HydrophobicContact CG1-CZ 4.43Å; V886-F889 HydrophobicContact CG2-CZ 4.35Å; V886-F889 WeakPolarHBondContact O-CD1 3.22Å; V886-F889 PolarHBondContact O-N 2.86Å; V886-F889 VanDerWaalsContact O-N 3.09Å; C887-F889 VanDerWaalsContact C-N 3.3Å; C887-F889 PolarHBondContact O-N 3.17Å; F889-K891 PolarHBondContact O-N 3.16Å; F889-M894 HydrophobicContact CD2-SD 4.34Å; F889-M894 VanDerWaalsContact O-CE 3.28Å; F889-M894 WeakPolarHBondContact O-CE 3.34Å; F889-M899 HydrophobicContact CE2-CB 4.25Å; F889-M899 HydrophobicContact CE2-CG 4.42Å; F889-H902 HydrophobicContact CB-CB 4.29Å; F889-H902 HydrophobicContact CD1-CB 4.14Å; F889-H902 HydrophobicContact CD2-CB 3.27Å; F889-H902 AromaticContact CD2-CD2 3.9Å; F889-H902 AromaticContact CD2-CG 3.73Å; F889-H902 HydrophobicContact CE1-CB 4.24Å; F889-H902 HydrophobicContact CE2-CB 3.44Å; F889-H902 VanDerWaalsContact CE2-CB 3.47Å; F889-H902 HydrophobicContact CG-CB 3.65Å; F889-H902 HydrophobicContact CZ-CB 3.91Å; F889-M903 HydrophobicContact CE1-CE 4.14Å; F889-M903 HydrophobicContact CE1-CG 4.03Å; F889-M903 HydrophobicContact CE1-SD 4.02Å; F889-M903 WeakPolarHBondContact CE1-SD 3.39Å; F889-M903 HydrophobicContact CZ-CB 4.29Å; F889-M903 HydrophobicContact CZ-CE 4.21Å; F889-M903 HydrophobicContact CZ-CG 3.68Å; F889-M903 HydrophobicContact CZ-SD 4.07Å; F889-Q906 VanDerWaalsContact CD1-CD 3.49Å; F889-Q906 HydrophobicContact CD1-CG 4.45Å; F889-Q906 VanDerWaalsContact CD1-NE2 3.32Å
890	Y	90.3	Very high	87.3	Confident	30.75 Å²	30.75	47.5 Å²	47.5	12%	0.121	25%	0.253	C	S	.	.			trans	-59.9	130.7	-174	178.3	-105.4	0	0	0	112.4	V875 V886 M894 M899	V875-Y890 HydrophobicContact CB-CE1 4.42Å; V875-Y890 HydrophobicContact CB-CE2 4.47Å; V875-Y890 HydrophobicContact CG1-CD1 4.15Å; V875-Y890 HydrophobicContact CG1-CD2 4.29Å; V875-Y890 HydrophobicContact CG1-CE1 4.03Å; V875-Y890 HydrophobicContact CG1-CE2 4.17Å; V875-Y890 HydrophobicContact CG1-CG 4.27Å; V875-Y890 HydrophobicContact CG2-CE1 4.41Å; V875-Y890 HydrophobicContact CG2-CE2 3.85Å; V886-Y890 HydrophobicContact CG1-CD2 4.43Å; V886-Y890 HydrophobicContact CG1-CG 4.18Å; V886-Y890 VanDerWaalsContact O-CB 3.23Å; V886-Y890 WeakPolarHBondContact O-CB 3.32Å; V886-Y890 PolarHBondContact O-N 3.15Å; Y890-M894 HydrophobicContact CD2-CB 4.47Å; Y890-M894 HydrophobicContact CD2-SD 4.43Å; Y890-M894 HydrophobicContact CE2-CB 4.46Å; Y890-M899 HydrophobicContact CD2-CE 3.76Å; Y890-M899 HydrophobicContact CD2-CG 4.39Å; Y890-M899 HydrophobicContact CD2-SD 3.95Å; Y890-M899 HydrophobicContact CE2-CE 4.09Å; Y890-M899 HydrophobicContact CE2-SD 3.92Å
891	K	88.1	Confident	87.8	Confident	143.5 Å²	143.5	39.5 Å²	39.5	62%	0.624	22%	0.215	S	C	*	.			trans	-123.8	140.7	168	-63	178.1	-176.3	173.7	0	108.3	F889 G893 M894	F889-K891 PolarHBondContact O-N 3.16Å; K891-G893 PolarHBondContact O-N 3.02Å; K891-G893 VanDerWaalsContact O-N 3.16Å; K891-M894 HydrophobicContact CB-CE 4.02Å; K891-M894 HydrophobicContact CB-CG 4.37Å; K891-M894 HydrophobicContact CB-SD 4.34Å; K891-M894 HydrophobicContact CD-CE 4.22Å; K891-M894 HydrophobicContact CG-CE 4.03Å; K891-M894 PolarHBondContact N-SD 3.29Å; K891-M894 WeakPolarHBondContact O-CB 3.23Å; K891-M894 VanDerWaalsContact O-CG 3.3Å; K891-M894 WeakPolarHBondContact O-CG 3.4Å; K891-M894 PolarHBondContact O-N 3.12Å; K891-M894 VanDerWaalsContact O-N 3.15Å
892	P	86.2	Confident	88.4	Confident	76.75 Å²	76.75	36.7 Å²	36.7	50%	0.498	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.7	127.6	173.4	-34.5	39.5	0	0	0	113.4	E872 R964	E872-P892 VanDerWaalsContact OE1-CB 3.28Å; E872-P892 WeakPolarHBondContact OE1-CB 3.19Å; E872-P892 VanDerWaalsContact OE1-CG 3.28Å; E872-P892 WeakPolarHBondContact OE1-CG 3.43Å; P892-R964 PolarHBondContact O-NH1 3.01Å; P892-R964 VanDerWaalsContact O-NH1 3.13Å; P892-R964 PolarHBondContact O-NH2 3.1Å
893	G	86.2	Confident	88.8	Confident	14.75 Å²	14.75	36.5 Å²	36.5	15%	0.152	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	8.1	178.4	0	0	0	0	0	116.1	Y866 I869 K891 R964	Y866-G893 PolarHBondContact OH-O 3.03Å; I869-G893 WeakPolarHBondContact CD1-O 3.1Å; K891-G893 PolarHBondContact O-N 3.02Å; K891-G893 VanDerWaalsContact O-N 3.16Å; G893-R964 VanDerWaalsContact C-NH1 3.29Å; G893-R964 PolarHBondContact O-NH1 3.3Å; G893-R964 VanDerWaalsContact O-NH1 3.15Å
894	M	91.5	Very high	88.9	Confident	9.75 Å²	9.75	35.1 Å²	35.1	5%	0.048	19%	0.186	C	C	.	.			trans	-62	137.9	167.9	-79.6	179.5	165.6	0	0	110.6	P870 F889 Y890 K891 E898 M899	P870-M894 WeakPolarHBondContact CD-O 3.33Å; F889-M894 HydrophobicContact CD2-SD 4.34Å; F889-M894 VanDerWaalsContact O-CE 3.28Å; F889-M894 WeakPolarHBondContact O-CE 3.34Å; Y890-M894 HydrophobicContact CD2-CB 4.47Å; Y890-M894 HydrophobicContact CD2-SD 4.43Å; Y890-M894 HydrophobicContact CE2-CB 4.46Å; K891-M894 HydrophobicContact CB-CE 4.02Å; K891-M894 HydrophobicContact CB-CG 4.37Å; K891-M894 HydrophobicContact CB-SD 4.34Å; K891-M894 HydrophobicContact CD-CE 4.22Å; K891-M894 HydrophobicContact CG-CE 4.03Å; K891-M894 PolarHBondContact N-SD 3.29Å; K891-M894 WeakPolarHBondContact O-CB 3.23Å; K891-M894 VanDerWaalsContact O-CG 3.3Å; K891-M894 WeakPolarHBondContact O-CG 3.4Å; K891-M894 PolarHBondContact O-N 3.12Å; K891-M894 VanDerWaalsContact O-N 3.15Å; M894-E898 HydrophobicContact CG-CG 4.39Å; M894-M899 HydrophobicContact CB-CG 3.95Å; M894-M899 HydrophobicContact CB-SD 4.49Å
895	S	90	Very high	89.1	Confident	0.5 Å²	0.5	35.2 Å²	35.2	0%	0.003	18%	0.176	C	C	.	.			trans	-74.1	156.2	173	75	0	0	0	0	111.6	Y866 C868 T897 E898 M899	Y866-S895 VanDerWaalsContact O-CB 3.23Å; Y866-S895 WeakPolarHBondContact O-CB 3.35Å; Y866-S895 PolarHBondContact O-OG 3.21Å; Y866-S895 PolarHBondContact OH-N 3.16Å; C868-S895 CarbonylContact O-C 3.56Å; C868-S895 VanDerWaalsContact O-CA 3.28Å; C868-S895 WeakPolarHBondContact O-CA 3.42Å; C868-S895 WeakPolarHBondContact O-CB 3.32Å; S895-T897 VanDerWaalsContact C-N 3.25Å; S895-T897 PolarHBondContact O-N 2.94Å; S895-E898 PolarHBondContact O-N 3Å; S895-E898 VanDerWaalsContact O-N 3.11Å; S895-E898 PolarHBondContact OG-N 2.99Å; S895-M899 WeakPolarHBondContact O-CG 3.39Å; S895-M899 PolarHBondContact O-N 3.21Å
896	M	87.4	Confident	89.1	Confident	34 Å²	34	34.4 Å²	34.4	17%	0.167	17%	0.172	C	C	.	.	H	α-helix	trans	-49.8	-45.1	173.3	-126.3	-61.3	-60.8	0	0	112.1	L845 C848 L849 C868 P870 E898 M899 E900	L845-M896 VanDerWaalsContact CA-CE 3.48Å; L845-M896 HydrophobicContact CB-CE 4.08Å; L845-M896 HydrophobicContact CB-SD 4.19Å; L845-M896 HydrophobicContact CD1-CE 3.64Å; L845-M896 HydrophobicContact CD1-CG 4.21Å; L845-M896 HydrophobicContact CD1-SD 3.54Å; L845-M896 WeakPolarHBondContact CD1-SD 3.23Å; L845-M896 HydrophobicContact CG-CE 4.29Å; L845-M896 HydrophobicContact CG-SD 4.24Å; C848-M896 HydrophobicContact CB-CE 3.62Å; C848-M896 HydrophobicContact CB-SD 4.46Å; L849-M896 HydrophobicContact CG-CE 4.38Å; C868-M896 HydrophobicContact CB-CE 4.33Å; C868-M896 HydrophobicContact CB-CG 4.37Å; C868-M896 PolarHBondContact O-N 3.14Å; P870-M896 HydrophobicContact CB-SD 4.14Å; P870-M896 HydrophobicContact CG-CG 4.45Å; P870-M896 HydrophobicContact CG-SD 3.96Å; M896-E898 PolarHBondContact O-N 3.32Å; M896-M899 WeakPolarHBondContact O-CB 3.29Å; M896-M899 PolarHBondContact O-N 3.23Å; M896-E900 HydrophobicContact CE-CG 4.19Å; M896-E900 WeakPolarHBondContact O-CG 3.27Å; M896-E900 PolarHBondContact O-N 3.17Å
897	T	89.5	Confident	89	Confident	9.5 Å²	9.5	35 Å²	35	6%	0.058	18%	0.177	C	C	.	.	H	α-helix	trans	-64	-39.8	178.9	-53.5	0	0	0	0	112.2	L860 L862 S895 E900 Y901	L860-T897 HydrophobicContact CD1-CG2 3.47Å; L860-T897 VanDerWaalsContact CD1-CG2 3.45Å; L862-T897 HydrophobicContact CD2-CG2 4.34Å; S895-T897 VanDerWaalsContact C-N 3.25Å; S895-T897 PolarHBondContact O-N 2.94Å; T897-E900 PolarHBondContact O-N 3.09Å; T897-Y901 PolarHBondContact O-N 2.94Å; T897-Y901 VanDerWaalsContact O-N 3.12Å
898	E	92.5	Very high	88.7	Confident	19.75 Å²	19.75	31.5 Å²	31.5	9%	0.092	15%	0.154	C	C	.	.	H	α-helix	trans	-67.5	-39.2	173.8	179.2	172.4	176.2	0	0	111.6	Y866 M894 S895 M896 Y901 H902 F968	Y866-E898 WeakPolarHBondContact CE2-OE2 3.32Å; Y866-E898 VanDerWaalsContact CZ-OE2 3.27Å; Y866-E898 PolarHBondContact OH-OE2 3.22Å; M894-E898 HydrophobicContact CG-CG 4.39Å; S895-E898 PolarHBondContact O-N 3Å; S895-E898 VanDerWaalsContact O-N 3.11Å; S895-E898 PolarHBondContact OG-N 2.99Å; M896-E898 PolarHBondContact O-N 3.32Å; E898-Y901 WeakPolarHBondContact O-CB 3.44Å; E898-Y901 PolarHBondContact O-N 3.34Å; E898-H902 PolarHBondContact O-CD2 3.07Å; E898-H902 VanDerWaalsContact O-CD2 3.26Å; E898-H902 PolarHBondContact O-N 2.94Å; E898-H902 IonicContact OE1-NE2 3.22Å; E898-F968 HydrophobicContact CB-CD1 4.47Å; E898-F968 HydrophobicContact CB-CD2 4.36Å; E898-F968 HydrophobicContact CB-CE1 4.32Å; E898-F968 HydrophobicContact CB-CE2 4.13Å; E898-F968 HydrophobicContact CB-CG 4.5Å; E898-F968 HydrophobicContact CB-CZ 4.1Å; E898-F968 HydrophobicContact CG-CD2 3.84Å; E898-F968 HydrophobicContact CG-CE2 3.78Å; E898-F968 HydrophobicContact CG-CG 4.4Å; E898-F968 HydrophobicContact CG-CZ 4.27Å
899	M	91.1	Very high	88.4	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64.9	-41.2	175.5	-64.8	176.1	67.7	0	0	112.2	L845 L849 P870 V875 V886 F889 Y890 M894 S895 M896 Y901 H902 M903	L845-M899 HydrophobicContact CD1-CE 3.92Å; L845-M899 HydrophobicContact CD1-SD 4.22Å; L845-M899 HydrophobicContact CD2-CE 4.37Å; L849-M899 HydrophobicContact CD1-CE 4.23Å; L849-M899 HydrophobicContact CD2-CB 3.91Å; P870-M899 HydrophobicContact CG-SD 3.76Å; V875-M899 HydrophobicContact CG1-CE 4.38Å; V875-M899 HydrophobicContact CG2-CE 4.29Å; V886-M899 HydrophobicContact CG1-CE 3.77Å; F889-M899 HydrophobicContact CE2-CB 4.25Å; F889-M899 HydrophobicContact CE2-CG 4.42Å; Y890-M899 HydrophobicContact CD2-CE 3.76Å; Y890-M899 HydrophobicContact CD2-CG 4.39Å; Y890-M899 HydrophobicContact CD2-SD 3.95Å; Y890-M899 HydrophobicContact CE2-CE 4.09Å; Y890-M899 HydrophobicContact CE2-SD 3.92Å; M894-M899 HydrophobicContact CB-CG 3.95Å; M894-M899 HydrophobicContact CB-SD 4.49Å; S895-M899 WeakPolarHBondContact O-CG 3.39Å; S895-M899 PolarHBondContact O-N 3.21Å; M896-M899 WeakPolarHBondContact O-CB 3.29Å; M896-M899 PolarHBondContact O-N 3.23Å; M899-Y901 VanDerWaalsContact C-N 3.35Å; M899-H902 PolarHBondContact O-N 2.97Å; M899-M903 WeakPolarHBondContact O-CB 3.43Å; M899-M903 WeakPolarHBondContact O-CG 3.39Å; M899-M903 PolarHBondContact O-N 3.17Å
900	E	91.6	Very high	87.8	Confident	13.25 Å²	13.25	29 Å²	29	6%	0.062	15%	0.152	C	C	.	.	H	α-helix	trans	-58.9	-45.5	173.9	-74.7	171.6	176.8	0	0	111.5	F790 S792 C848 A852 F858 M896 T897 H902 M903 A904	F790-E900 HydrophobicContact CE1-CG 4.42Å; S792-E900 VanDerWaalsContact CB-OE2 3.3Å; S792-E900 WeakPolarHBondContact CB-OE2 3.3Å; S792-E900 PolarHBondContact OG-OE2 3.39Å; C848-E900 HydrophobicContact CB-CG 4.23Å; C848-E900 VanDerWaalsContact CB-OE1 3.3Å; C848-E900 WeakPolarHBondContact CB-OE1 3.38Å; C848-E900 PolarHBondContact SG-OE1 3.07Å; A852-E900 HydrophobicContact CB-CB 4.18Å; A852-E900 HydrophobicContact CB-CG 4.37Å; F858-E900 HydrophobicContact CE2-CB 4.1Å; F858-E900 HydrophobicContact CZ-CB 3.98Å; M896-E900 HydrophobicContact CE-CG 4.19Å; M896-E900 WeakPolarHBondContact O-CG 3.27Å; M896-E900 PolarHBondContact O-N 3.17Å; T897-E900 PolarHBondContact O-N 3.09Å; E900-H902 PolarHBondContact O-N 2.77Å; E900-M903 PolarHBondContact O-N 3.14Å; E900-A904 WeakPolarHBondContact O-CB 3.45Å; E900-A904 PolarHBondContact O-N 3.19Å
901	Y	92.7	Very high	86.9	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.2	-48.2	176.1	172.2	-96.3	0	0	0	111.9	F858 L860 T897 E898 M899 M903 A904 R905 I933 V935 F968 L971 I972 D975 V977	F858-Y901 HydrophobicContact CE1-CD2 4.31Å; L860-Y901 HydrophobicContact CD2-CD2 4.01Å; L860-Y901 HydrophobicContact CD2-CG 4.46Å; T897-Y901 PolarHBondContact O-N 2.94Å; T897-Y901 VanDerWaalsContact O-N 3.12Å; E898-Y901 WeakPolarHBondContact O-CB 3.44Å; E898-Y901 PolarHBondContact O-N 3.34Å; M899-Y901 VanDerWaalsContact C-N 3.35Å; Y901-M903 VanDerWaalsContact C-N 3.31Å; Y901-M903 PolarHBondContact O-N 3.11Å; Y901-A904 PolarHBondContact O-N 3.17Å; Y901-R905 VanDerWaalsContact O-CB 3.3Å; Y901-R905 WeakPolarHBondContact O-CB 3.25Å; Y901-R905 PolarHBondContact O-N 3.07Å; Y901-I933 HydrophobicContact CD2-CG2 4.34Å; Y901-I933 HydrophobicContact CE2-CD1 4.45Å; Y901-I933 HydrophobicContact CE2-CG2 3.97Å; Y901-V935 HydrophobicContact CE2-CG2 4.38Å; Y901-F968 AromaticContact CD1-CE2 3.69Å; Y901-F968 HydrophobicContact CD1-CE2 3.69Å; Y901-F968 HydrophobicContact CD1-CZ 4.15Å; Y901-F968 HydrophobicContact CE1-CE2 4.3Å; Y901-F968 AromaticContact CG-CE2 3.98Å; Y901-F968 HydrophobicContact CG-CE2 4Å; Y901-F968 AromaticContact CG-CZ 3.94Å; Y901-F968 HydrophobicContact CG-CZ 3.96Å; Y901-L971 HydrophobicContact CD1-CD2 4.31Å; Y901-L971 HydrophobicContact CE1-CD2 3.72Å; Y901-I972 HydrophobicContact CE1-CG1 4.39Å; Y901-I972 HydrophobicContact CE2-CG1 4.19Å; Y901-D975 VanDerWaalsContact OH-CB 3.25Å; Y901-D975 WeakPolarHBondContact OH-CB 3.28Å; Y901-D975 PolarHBondContact OH-OD2 3.15Å; Y901-V977 HydrophobicContact CE2-CG1 4.44Å; Y901-V977 HydrophobicContact CE2-CG2 4.23Å; Y901-V977 WeakPolarHBondContact OH-CG1 3.25Å; Y901-V977 WeakPolarHBondContact OH-CG2 3.41Å
902	H	91.6	Very high	85.9	Confident	18 Å²	18	25.1 Å²	25.1	8%	0.083	14%	0.136	C	C	.	.	H	α-helix	trans	-63.4	-37.8	179	-80.6	-57.1	0	0	0	112.6	F889 E898 M899 E900 R905 Q906	F889-H902 HydrophobicContact CB-CB 4.29Å; F889-H902 HydrophobicContact CD1-CB 4.14Å; F889-H902 HydrophobicContact CD2-CB 3.27Å; F889-H902 AromaticContact CD2-CD2 3.9Å; F889-H902 AromaticContact CD2-CG 3.73Å; F889-H902 HydrophobicContact CE1-CB 4.24Å; F889-H902 HydrophobicContact CE2-CB 3.44Å; F889-H902 VanDerWaalsContact CE2-CB 3.47Å; F889-H902 HydrophobicContact CG-CB 3.65Å; F889-H902 HydrophobicContact CZ-CB 3.91Å; E898-H902 PolarHBondContact O-CD2 3.07Å; E898-H902 VanDerWaalsContact O-CD2 3.26Å; E898-H902 PolarHBondContact O-N 2.94Å; E898-H902 IonicContact OE1-NE2 3.22Å; M899-H902 PolarHBondContact O-N 2.97Å; E900-H902 PolarHBondContact O-N 2.77Å; H902-R905 PolarHBondContact O-N 3.26Å; H902-Q906 WeakPolarHBondContact O-CB 3.39Å; H902-Q906 WeakPolarHBondContact O-CG 3.34Å; H902-Q906 PolarHBondContact O-N 3.12Å
903	M	90.6	Very high	84.9	Confident	6.75 Å²	6.75	24.3 Å²	24.3	3%	0.033	13%	0.131	C	C	.	.	H	α-helix	trans	-64.9	-46.8	175.2	-151.3	42.7	101.5	0	0	111.7	L849 A852 A853 L882 E885 V886 F889 M899 E900 Y901 R905 Q906 A907	L849-M903 HydrophobicContact CB-CE 4.29Å; L849-M903 HydrophobicContact CB-CG 4.04Å; L849-M903 HydrophobicContact CD2-CB 4.22Å; L849-M903 HydrophobicContact CD2-CE 4.39Å; L849-M903 HydrophobicContact CD2-CG 4.16Å; L849-M903 HydrophobicContact CG-CG 4.26Å; L849-M903 WeakPolarHBondContact O-CG 3.37Å; A852-M903 HydrophobicContact CB-CB 4.43Å; A853-M903 HydrophobicContact CB-CE 3.76Å; A853-M903 HydrophobicContact CB-CG 3.77Å; A853-M903 HydrophobicContact CB-SD 4.18Å; L882-M903 HydrophobicContact CD1-CE 3.76Å; L882-M903 HydrophobicContact CG-CE 4.35Å; E885-M903 HydrophobicContact CB-CE 4.18Å; E885-M903 HydrophobicContact CB-SD 4.38Å; V886-M903 HydrophobicContact CG2-CE 3.53Å; V886-M903 VanDerWaalsContact CG2-CE 3.48Å; V886-M903 HydrophobicContact CG2-SD 4.09Å; F889-M903 HydrophobicContact CE1-CE 4.14Å; F889-M903 HydrophobicContact CE1-CG 4.03Å; F889-M903 HydrophobicContact CE1-SD 4.02Å; F889-M903 WeakPolarHBondContact CE1-SD 3.39Å; F889-M903 HydrophobicContact CZ-CB 4.29Å; F889-M903 HydrophobicContact CZ-CE 4.21Å; F889-M903 HydrophobicContact CZ-CG 3.68Å; F889-M903 HydrophobicContact CZ-SD 4.07Å; M899-M903 WeakPolarHBondContact O-CB 3.43Å; M899-M903 WeakPolarHBondContact O-CG 3.39Å; M899-M903 PolarHBondContact O-N 3.17Å; E900-M903 PolarHBondContact O-N 3.14Å; Y901-M903 VanDerWaalsContact C-N 3.31Å; Y901-M903 PolarHBondContact O-N 3.11Å; M903-R905 VanDerWaalsContact C-N 3.31Å; M903-R905 PolarHBondContact O-N 3.15Å; M903-Q906 PolarHBondContact O-N 3.14Å; M903-A907 WeakPolarHBondContact O-CB 3.2Å; M903-A907 PolarHBondContact O-N 3.07Å
904	A	89.1	Confident	83.7	Confident	5.25 Å²	5.25	28.3 Å²	28.3	4%	0.043	15%	0.148	C	C	.	.	H	α-helix	trans	-61.7	-39.9	176.3	0	0	0	0	0	111.9	F858 E900 Y901 A907 A908 I933	F858-A904 HydrophobicContact CB-CB 4.01Å; F858-A904 HydrophobicContact CD1-CB 4.24Å; F858-A904 HydrophobicContact CD2-CB 3.42Å; F858-A904 VanDerWaalsContact CD2-CB 3.44Å; F858-A904 HydrophobicContact CE1-CB 4.49Å; F858-A904 HydrophobicContact CE2-CB 3.84Å; F858-A904 HydrophobicContact CG-CB 3.64Å; F858-A904 HydrophobicContact CZ-CB 4.4Å; E900-A904 WeakPolarHBondContact O-CB 3.45Å; E900-A904 PolarHBondContact O-N 3.19Å; Y901-A904 PolarHBondContact O-N 3.17Å; A904-A907 PolarHBondContact O-N 2.83Å; A904-A908 WeakPolarHBondContact O-CB 3.4Å; A904-A908 PolarHBondContact O-N 3.25Å; A904-I933 HydrophobicContact CB-CD1 4.37Å
905	R	88.3	Confident	82.2	Confident	69.25 Å²	69.25	33.6 Å²	33.6	26%	0.261	17%	0.173	S	C	.	.	H	α-helix	trans	-62.7	-46.3	175	-177.4	-179.1	173.2	-124.3	3.3	112.1	Y901 H902 M903 A907 A908 I909 I929 I933 D975	Y901-R905 VanDerWaalsContact O-CB 3.3Å; Y901-R905 WeakPolarHBondContact O-CB 3.25Å; Y901-R905 PolarHBondContact O-N 3.07Å; H902-R905 PolarHBondContact O-N 3.26Å; M903-R905 VanDerWaalsContact C-N 3.31Å; M903-R905 PolarHBondContact O-N 3.15Å; R905-A907 VanDerWaalsContact C-N 3.32Å; R905-A907 PolarHBondContact O-N 2.86Å; R905-A908 WeakPolarHBondContact O-CB 3.21Å; R905-A908 PolarHBondContact O-N 3.1Å; R905-I909 HydrophobicContact CG-CD1 4.09Å; R905-I909 WeakPolarHBondContact O-CD1 3.27Å; R905-I909 VanDerWaalsContact O-CG1 3.29Å; R905-I909 WeakPolarHBondContact O-CG1 3.41Å; R905-I909 PolarHBondContact O-N 3.1Å; R905-I929 HydrophobicContact CG-CD1 4.15Å; R905-I929 HydrophobicContact CG-CG1 4.43Å; R905-I933 HydrophobicContact CB-CD1 4.08Å; R905-D975 WeakPolarHBondContact CD-OD2 3.34Å; R905-D975 IonicContact CZ-OD1 3.75Å; R905-D975 VanDerWaalsContact CZ-OD1 3.28Å; R905-D975 IonicContact CZ-OD2 3.74Å; R905-D975 IonicContact NE-OD1 3.07Å; R905-D975 PolarHBondContact NE-OD1 3.3Å; R905-D975 IonicContact NE-OD2 3.35Å; R905-D975 PolarHBondContact NE-OD2 3.04Å; R905-D975 VanDerWaalsContact NE-OD2 3.15Å; R905-D975 IonicContact NH1-OD1 2.73Å; R905-D975 PolarHBondContact NH1-OD1 2.69Å; R905-D975 VanDerWaalsContact NH1-OD1 3.1Å; R905-D975 IonicContact NH1-OD2 3.15Å; R905-D975 PolarHBondContact NH1-OD2 2.84Å; R905-D975 IonicContact NH2-OD1 3.15Å; R905-D975 PolarHBondContact NH2-OD1 3.31Å; R905-D975 IonicContact NH2-OD2 3.49Å
906	Q	85.4	Confident	80.7	Confident	45 Å²	45	36.6 Å²	36.6	21%	0.21	19%	0.186	C	C	.	.	H	α-helix	trans	-63.3	-40.9	175.6	-75.4	-169.2	-7.8	0	0	112	E885 K888 F889 H902 M903 A908 I909 S910	E885-Q906 PolarHBondContact O-OE1 3.14Å; K888-Q906 VanDerWaalsContact CB-NE2 3.33Å; F889-Q906 VanDerWaalsContact CD1-CD 3.49Å; F889-Q906 HydrophobicContact CD1-CG 4.45Å; F889-Q906 VanDerWaalsContact CD1-NE2 3.32Å; H902-Q906 WeakPolarHBondContact O-CB 3.39Å; H902-Q906 WeakPolarHBondContact O-CG 3.34Å; H902-Q906 PolarHBondContact O-N 3.12Å; M903-Q906 PolarHBondContact O-N 3.14Å; Q906-A908 VanDerWaalsContact C-N 3.3Å; Q906-A908 PolarHBondContact O-N 3.24Å; Q906-I909 PolarHBondContact O-N 3.04Å; Q906-S910 VanDerWaalsContact O-CB 3.31Å; Q906-S910 WeakPolarHBondContact O-CB 3.34Å; Q906-S910 PolarHBondContact O-N 3.05Å
907	A	84.2	Confident	79.4	Confident	12.75 Å²	12.75	39 Å²	39	11%	0.105	19%	0.194	C	C	.	.	H	α-helix	trans	-62.3	-41.1	174.7	0	0	0	0	0	111.7	A853 M903 A904 R905 S910 K911	A853-A907 HydrophobicContact CB-CB 4.35Å; A853-A907 VanDerWaalsContact O-CB 3.26Å; A853-A907 WeakPolarHBondContact O-CB 3.41Å; M903-A907 WeakPolarHBondContact O-CB 3.2Å; M903-A907 PolarHBondContact O-N 3.07Å; A904-A907 PolarHBondContact O-N 2.83Å; R905-A907 VanDerWaalsContact C-N 3.32Å; R905-A907 PolarHBondContact O-N 2.86Å; A907-S910 PolarHBondContact O-N 3.11Å; A907-S910 PolarHBondContact O-OG 3.11Å; A907-K911 WeakPolarHBondContact O-CG 3.37Å; A907-K911 PolarHBondContact O-N 2.89Å
908	A	82.4	Confident	77.9	Confident	2.75 Å²	2.75	48.4 Å²	48.4	2%	0.023	23%	0.228	C	C	.	.	H	α-helix	trans	-60.6	-48.9	175.1	0	0	0	0	0	111.8	A904 R905 Q906 S910 K911 I929 R932	A904-A908 WeakPolarHBondContact O-CB 3.4Å; A904-A908 PolarHBondContact O-N 3.25Å; R905-A908 WeakPolarHBondContact O-CB 3.21Å; R905-A908 PolarHBondContact O-N 3.1Å; Q906-A908 VanDerWaalsContact C-N 3.3Å; Q906-A908 PolarHBondContact O-N 3.24Å; A908-S910 VanDerWaalsContact C-N 3.3Å; A908-S910 PolarHBondContact O-N 3.04Å; A908-K911 PolarHBondContact O-N 2.98Å; A908-K911 VanDerWaalsContact O-N 3.13Å; A908-I929 HydrophobicContact CB-CG1 4.39Å; A908-R932 HydrophobicContact CB-CB 4.3Å; A908-R932 PolarHBondContact O-NH1 2.99Å; A908-R932 VanDerWaalsContact O-NH1 3.12Å
909	I	80.5	Confident	76.2	Confident	39 Å²	39	53.9 Å²	53.9	20%	0.2	25%	0.254	C	S	.	.	H	α-helix	trans	-62.5	-37.3	177.2	-65.5	164.9	0	0	0	111.2	R905 Q906 K911 V912 R917 F925 I929	R905-I909 HydrophobicContact CG-CD1 4.09Å; R905-I909 WeakPolarHBondContact O-CD1 3.27Å; R905-I909 VanDerWaalsContact O-CG1 3.29Å; R905-I909 WeakPolarHBondContact O-CG1 3.41Å; R905-I909 PolarHBondContact O-N 3.1Å; Q906-I909 PolarHBondContact O-N 3.04Å; I909-K911 PolarHBondContact O-N 2.91Å; I909-K911 VanDerWaalsContact O-N 3.17Å; I909-V912 WeakPolarHBondContact O-CB 3.33Å; I909-V912 PolarHBondContact O-N 3.06Å; I909-V912 VanDerWaalsContact O-N 3.08Å; I909-R917 VanDerWaalsContact O-CZ 3.25Å; I909-R917 PolarHBondContact O-NE 3.2Å; I909-R917 VanDerWaalsContact O-NE 3.09Å; I909-R917 PolarHBondContact O-NH2 2.8Å; I909-F925 HydrophobicContact CB-CE2 4.5Å; I909-F925 HydrophobicContact CD1-CE2 4.26Å; I909-F925 HydrophobicContact CD1-CZ 3.85Å; I909-F925 HydrophobicContact CG1-CD1 4.4Å; I909-F925 HydrophobicContact CG1-CE2 3.89Å; I909-F925 HydrophobicContact CG1-CZ 3.87Å; I909-F925 HydrophobicContact CG2-CD1 4.03Å; I909-F925 HydrophobicContact CG2-CE1 3.9Å; I909-F925 HydrophobicContact CG2-CE2 3.92Å; I909-I929 HydrophobicContact CD1-CD1 4.33Å; I909-I929 HydrophobicContact CG1-CD1 4.15Å; I909-I929 HydrophobicContact CG1-CG1 4.32Å
910	S	75.7	Confident	74.5	Confident	58.5 Å²	58.5	61.5 Å²	61.5	41%	0.409	29%	0.289	S	S	.	.	H	α-helix	trans	-66	-17.9	180	82.7	0	0	0	0	113.9	Q906 A907 A908 V912 R917	Q906-S910 VanDerWaalsContact O-CB 3.31Å; Q906-S910 WeakPolarHBondContact O-CB 3.34Å; Q906-S910 PolarHBondContact O-N 3.05Å; A907-S910 PolarHBondContact O-N 3.11Å; A907-S910 PolarHBondContact O-OG 3.11Å; A908-S910 VanDerWaalsContact C-N 3.3Å; A908-S910 PolarHBondContact O-N 3.04Å; S910-V912 VanDerWaalsContact C-N 3.34Å; S910-R917 VanDerWaalsContact C-NH2 3.28Å; S910-R917 VanDerWaalsContact CA-NH2 3.34Å; S910-R917 PolarHBondContact O-NH2 3.3Å
911	K	70.6	Confident	72.8	Confident	84.5 Å²	84.5	65.5 Å²	65.5	37%	0.367	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-8.5	175.8	-58.2	-173.7	-160.1	171.4	0	112.9	S855 D856 A907 A908 I909 R932	S855-K911 PolarHBondContact O-NZ 3.22Å; D856-K911 IonicContact OD1-NZ 3.28Å; D856-K911 PolarHBondContact OD1-NZ 3.28Å; A907-K911 WeakPolarHBondContact O-CG 3.37Å; A907-K911 PolarHBondContact O-N 2.89Å; A908-K911 PolarHBondContact O-N 2.98Å; A908-K911 VanDerWaalsContact O-N 3.13Å; I909-K911 PolarHBondContact O-N 2.91Å; I909-K911 VanDerWaalsContact O-N 3.17Å; K911-R932 VanDerWaalsContact CG-NH1 3.26Å
912	V	67.6	Low	71.2	Confident	6.5 Å²	6.5	69.2 Å²	69.2	4%	0.039	33%	0.334	C	S	.	.	S	Bend	trans	-72.9	133.8	173.2	179.9	0	0	0	0	109.9	I909 S910 E916 R917 F925 A928	I909-V912 WeakPolarHBondContact O-CB 3.33Å; I909-V912 PolarHBondContact O-N 3.06Å; I909-V912 VanDerWaalsContact O-N 3.08Å; S910-V912 VanDerWaalsContact C-N 3.34Å; V912-E916 HydrophobicContact CG1-CB 3.85Å; V912-E916 WeakPolarHBondContact CG1-OE2 3.5Å; V912-R917 HydrophobicContact CB-CG 4.2Å; V912-R917 HydrophobicContact CG1-CG 4.14Å; V912-R917 VanDerWaalsContact O-CZ 3.23Å; V912-R917 PolarHBondContact O-NE 2.97Å; V912-R917 PolarHBondContact O-NH2 3.16Å; V912-F925 HydrophobicContact CB-CD1 4.47Å; V912-F925 HydrophobicContact CB-CE1 4.43Å; V912-F925 HydrophobicContact CG1-CD1 4.31Å; V912-F925 HydrophobicContact CG1-CE1 4.16Å; V912-F925 HydrophobicContact CG2-CD1 4.17Å; V912-A928 HydrophobicContact CG2-CB 3.38Å; V912-A928 VanDerWaalsContact CG2-CB 3.42Å
913	P	63.7	Low	69.8	Low	60.5 Å²	60.5	74.4 Å²	74.4	39%	0.393	36%	0.361	S	S	.	.			trans	-53.3	142.3	177.3	-27.3	35.5	0	0	0	113.4	H915 E916 R917	P913-H915 WeakPolarHBondContact CB-CE1 3.41Å; P913-H915 WeakPolarHBondContact CB-ND1 3.45Å; P913-H915 PolarHBondContact O-N 3.28Å; P913-H915 VanDerWaalsContact O-N 3.11Å; P913-E916 PolarHBondContact O-N 3.04Å; P913-E916 VanDerWaalsContact O-N 3.11Å; P913-R917 PolarHBondContact O-N 3.16Å; P913-R917 VanDerWaalsContact O-N 3.09Å
914	I	61.2	Low	68.6	Low	99.75 Å²	99.75	75.1 Å²	75.1	51%	0.512	37%	0.367	S	S	.	.	H	α-helix	trans	-57.8	-32.9	-173.2	-66.7	167.5	0	0	0	112.6	R917 R918	I914-R917 PolarHBondContact O-N 3.15Å; I914-R918 HydrophobicContact CG2-CG 4.48Å; I914-R918 WeakPolarHBondContact O-CG 3.47Å; I914-R918 PolarHBondContact O-N 3.1Å; I914-R918 VanDerWaalsContact O-N 3.14Å
915	H	60.5	Low	67.6	Low	121 Å²	121	76.8 Å²	76.8	56%	0.56	37%	0.373	S	S	*	.	H	α-helix	trans	-68	-38.5	-179.1	59.6	-87.8	0	0	0	112.4	P913 R917 R918 Q919	P913-H915 WeakPolarHBondContact CB-CE1 3.41Å; P913-H915 WeakPolarHBondContact CB-ND1 3.45Å; P913-H915 PolarHBondContact O-N 3.28Å; P913-H915 VanDerWaalsContact O-N 3.11Å; H915-R917 VanDerWaalsContact C-N 3.33Å; H915-R918 PolarHBondContact O-N 3.12Å; H915-Q919 WeakPolarHBondContact O-CG 3.4Å; H915-Q919 PolarHBondContact O-N 3.2Å
916	E	59.3	Low	66.9	Low	62.25 Å²	62.25	76.8 Å²	76.8	29%	0.291	38%	0.376	S	S	.	.	H	α-helix	trans	-71	-34.7	174.8	-68.1	177.6	-167.8	0	0	111.7	V912 P913 R918 Q919 S924	V912-E916 HydrophobicContact CG1-CB 3.85Å; V912-E916 WeakPolarHBondContact CG1-OE2 3.5Å; P913-E916 PolarHBondContact O-N 3.04Å; P913-E916 VanDerWaalsContact O-N 3.11Å; E916-R918 VanDerWaalsContact C-N 3.31Å; E916-R918 PolarHBondContact O-N 3.02Å; E916-Q919 PolarHBondContact O-N 3.26Å; E916-S924 WeakPolarHBondContact OE2-CB 3.39Å; E916-S924 PolarHBondContact OE2-OG 3.29Å
917	R	59.4	Low	66.3	Low	85 Å²	85	79.8 Å²	79.8	32%	0.321	39%	0.39	S	S	.	.	H	α-helix	trans	-62.7	-35.4	177.2	-69.2	-169.4	-129.4	167.7	4.7	113.6	I909 S910 V912 P913 I914 H915 Q919 Q920 F925	I909-R917 VanDerWaalsContact O-CZ 3.25Å; I909-R917 PolarHBondContact O-NE 3.2Å; I909-R917 VanDerWaalsContact O-NE 3.09Å; I909-R917 PolarHBondContact O-NH2 2.8Å; S910-R917 VanDerWaalsContact C-NH2 3.28Å; S910-R917 VanDerWaalsContact CA-NH2 3.34Å; S910-R917 PolarHBondContact O-NH2 3.3Å; V912-R917 HydrophobicContact CB-CG 4.2Å; V912-R917 HydrophobicContact CG1-CG 4.14Å; V912-R917 VanDerWaalsContact O-CZ 3.23Å; V912-R917 PolarHBondContact O-NE 2.97Å; V912-R917 PolarHBondContact O-NH2 3.16Å; P913-R917 PolarHBondContact O-N 3.16Å; P913-R917 VanDerWaalsContact O-N 3.09Å; I914-R917 PolarHBondContact O-N 3.15Å; H915-R917 VanDerWaalsContact C-N 3.33Å; R917-Q919 VanDerWaalsContact C-N 3.29Å; R917-Q919 PolarHBondContact O-N 2.98Å; R917-Q920 PolarHBondContact O-N 3.25Å; R917-F925 HydrophobicContact CB-CE1 4.25Å; R917-F925 HydrophobicContact CB-CZ 4.03Å; R917-F925 HydrophobicContact CG-CE1 3.72Å; R917-F925 HydrophobicContact CG-CZ 3.97Å; R917-F925 WeakPolarHBondContact O-CZ 3.39Å
918	R	58.8	Low	65.8	Low	207 Å²	207	80 Å²	80	78%	0.781	39%	0.391	S	S	*	.	H	α-helix	trans	-71.5	-25.9	-179.2	-74.4	-178.8	179.1	173.6	0.7	112.7	I914 H915 E916 Q920	I914-R918 HydrophobicContact CG2-CG 4.48Å; I914-R918 WeakPolarHBondContact O-CG 3.47Å; I914-R918 PolarHBondContact O-N 3.1Å; I914-R918 VanDerWaalsContact O-N 3.14Å; H915-R918 PolarHBondContact O-N 3.12Å; E916-R918 VanDerWaalsContact C-N 3.31Å; E916-R918 PolarHBondContact O-N 3.02Å; R918-Q920 PolarHBondContact O-N 3.21Å
919	Q	55.8	Low	65.7	Low	135.75 Å²	135.75	80 Å²	80	63%	0.634	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	17.2	179.3	-68	-179.9	0.2	0	0	111.8	H915 E916 R917 N921 T922	H915-Q919 WeakPolarHBondContact O-CG 3.4Å; H915-Q919 PolarHBondContact O-N 3.2Å; E916-Q919 PolarHBondContact O-N 3.26Å; R917-Q919 VanDerWaalsContact C-N 3.29Å; R917-Q919 PolarHBondContact O-N 2.98Å; Q919-N921 HydrophobicContact CB-CB 4.5Å; Q919-N921 PolarHBondContact O-N 2.99Å; Q919-N921 VanDerWaalsContact O-N 3.09Å; Q919-T922 WeakPolarHBondContact CB-OG1 3.47Å; Q919-T922 PolarHBondContact O-N 3.29Å; Q919-T922 PolarHBondContact O-OG1 3.15Å
920	Q	55.3	Low	65.7	Low	157.75 Å²	157.75	84.3 Å²	84.3	74%	0.737	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	27.5	21.3	-176.1	-70.1	-177	-11	0	0	113.1	R917 R918 T922	R917-Q920 PolarHBondContact O-N 3.25Å; R918-Q920 PolarHBondContact O-N 3.21Å; Q920-T922 VanDerWaalsContact C-N 3.28Å; Q920-T922 PolarHBondContact O-N 2.89Å
921	N	55.4	Low	65.9	Low	97.25 Å²	97.25	83.4 Å²	83.4	52%	0.52	40%	0.395	S	S	.	.			trans	-79.3	79.3	-179.5	-117.4	-4.3	0	0	0	109.8	Q919 I923 S924	Q919-N921 HydrophobicContact CB-CB 4.5Å; Q919-N921 PolarHBondContact O-N 2.99Å; Q919-N921 VanDerWaalsContact O-N 3.09Å; N921-I923 PolarHBondContact O-N 2.82Å; N921-I923 VanDerWaalsContact O-N 3.08Å; N921-S924 PolarHBondContact O-N 3.04Å; N921-S924 VanDerWaalsContact O-N 3.07Å; N921-S924 PolarHBondContact O-OG 3.14Å
922	T	59.2	Low	66.5	Low	78.5 Å²	78.5	81.8 Å²	81.8	48%	0.482	39%	0.387	S	S	.	.	H	α-helix	trans	-63.6	-26.7	-175	16.3	0	0	0	0	111.8	Q919 Q920 S924 F925 H926	Q919-T922 WeakPolarHBondContact CB-OG1 3.47Å; Q919-T922 PolarHBondContact O-N 3.29Å; Q919-T922 PolarHBondContact O-OG1 3.15Å; Q920-T922 VanDerWaalsContact C-N 3.28Å; Q920-T922 PolarHBondContact O-N 2.89Å; T922-S924 PolarHBondContact O-N 3.07Å; T922-F925 WeakPolarHBondContact O-CB 3.41Å; T922-F925 PolarHBondContact O-N 3.18Å; T922-H926 PolarHBondContact O-CD2 3.28Å; T922-H926 PolarHBondContact O-N 3.09Å; T922-H926 VanDerWaalsContact O-N 3.1Å
923	I	63.1	Low	67.6	Low	126.75 Å²	126.75	81.5 Å²	81.5	65%	0.65	39%	0.385	S	S	*	.	H	α-helix	trans	-57	-45.8	179.2	-60.8	166.3	0	0	0	111.5	N921 F925 H926 E927	N921-I923 PolarHBondContact O-N 2.82Å; N921-I923 VanDerWaalsContact O-N 3.08Å; I923-F925 VanDerWaalsContact C-N 3.3Å; I923-F925 PolarHBondContact O-N 3.17Å; I923-H926 PolarHBondContact O-N 3.23Å; I923-E927 VanDerWaalsContact O-CB 3.28Å; I923-E927 WeakPolarHBondContact O-CB 3.26Å; I923-E927 PolarHBondContact O-N 3.12Å; I923-E927 VanDerWaalsContact O-N 3.08Å
924	S	64.7	Low	68.8	Low	22.75 Å²	22.75	78.6 Å²	78.6	16%	0.159	37%	0.366	C	S	.	.	H	α-helix	trans	-63.9	-34.4	180	89.9	0	0	0	0	112.9	E916 N921 T922 E927 A928	E916-S924 WeakPolarHBondContact OE2-CB 3.39Å; E916-S924 PolarHBondContact OE2-OG 3.29Å; N921-S924 PolarHBondContact O-N 3.04Å; N921-S924 VanDerWaalsContact O-N 3.07Å; N921-S924 PolarHBondContact O-OG 3.14Å; T922-S924 PolarHBondContact O-N 3.07Å; S924-E927 PolarHBondContact O-N 2.97Å; S924-A928 WeakPolarHBondContact O-CB 3.3Å; S924-A928 PolarHBondContact O-N 3.15Å; S924-A928 VanDerWaalsContact O-N 3.07Å
925	F	69.3	Low	70.2	Confident	41.25 Å²	41.25	73.9 Å²	73.9	18%	0.181	34%	0.342	C	S	.	.	H	α-helix	trans	-67.4	-48.6	177.3	-89.4	-63.1	0	0	0	111.9	I909 V912 R917 T922 I923 E927 A928 I929	I909-F925 HydrophobicContact CB-CE2 4.5Å; I909-F925 HydrophobicContact CD1-CE2 4.26Å; I909-F925 HydrophobicContact CD1-CZ 3.85Å; I909-F925 HydrophobicContact CG1-CD1 4.4Å; I909-F925 HydrophobicContact CG1-CE2 3.89Å; I909-F925 HydrophobicContact CG1-CZ 3.87Å; I909-F925 HydrophobicContact CG2-CD1 4.03Å; I909-F925 HydrophobicContact CG2-CE1 3.9Å; I909-F925 HydrophobicContact CG2-CE2 3.92Å; V912-F925 HydrophobicContact CB-CD1 4.47Å; V912-F925 HydrophobicContact CB-CE1 4.43Å; V912-F925 HydrophobicContact CG1-CD1 4.31Å; V912-F925 HydrophobicContact CG1-CE1 4.16Å; V912-F925 HydrophobicContact CG2-CD1 4.17Å; R917-F925 HydrophobicContact CB-CE1 4.25Å; R917-F925 HydrophobicContact CB-CZ 4.03Å; R917-F925 HydrophobicContact CG-CE1 3.72Å; R917-F925 HydrophobicContact CG-CZ 3.97Å; R917-F925 WeakPolarHBondContact O-CZ 3.39Å; T922-F925 WeakPolarHBondContact O-CB 3.41Å; T922-F925 PolarHBondContact O-N 3.18Å; I923-F925 VanDerWaalsContact C-N 3.3Å; I923-F925 PolarHBondContact O-N 3.17Å; F925-E927 VanDerWaalsContact C-N 3.28Å; F925-E927 PolarHBondContact O-N 2.98Å; F925-A928 PolarHBondContact O-N 3.04Å; F925-I929 HydrophobicContact CD1-CD1 4.36Å; F925-I929 HydrophobicContact CE1-CD1 3.83Å; F925-I929 HydrophobicContact CZ-CD1 4.13Å; F925-I929 WeakPolarHBondContact O-CD1 3.5Å; F925-I929 VanDerWaalsContact O-CG1 3.28Å; F925-I929 WeakPolarHBondContact O-CG1 3.28Å; F925-I929 PolarHBondContact O-N 2.97Å
926	H	72.3	Confident	71.7	Confident	67.25 Å²	67.25	68.2 Å²	68.2	31%	0.311	32%	0.316	S	S	.	.	H	α-helix	trans	-64.6	-36.9	177.4	-75.6	-70.2	0	0	0	111.7	T922 I923 I929 R930 N974 D975	T922-H926 PolarHBondContact O-CD2 3.28Å; T922-H926 PolarHBondContact O-N 3.09Å; T922-H926 VanDerWaalsContact O-N 3.1Å; I923-H926 PolarHBondContact O-N 3.23Å; H926-I929 PolarHBondContact O-N 2.97Å; H926-R930 WeakPolarHBondContact O-CB 3.37Å; H926-R930 VanDerWaalsContact O-CG 3.25Å; H926-R930 WeakPolarHBondContact O-CG 3.36Å; H926-R930 PolarHBondContact O-N 3.23Å; H926-N974 PolarHBondContact CE1-O 3.44Å; H926-D975 PolarHBondContact CE1-O 3.29Å; H926-D975 PolarHBondContact ND1-O 3.37Å
927	E	73.6	Confident	73.2	Confident	109.25 Å²	109.25	65.4 Å²	65.4	51%	0.511	30%	0.303	S	S	.	.	H	α-helix	trans	-66.6	-43.3	177.7	-168.5	168.6	-166	0	0	112.3	I923 S924 F925 I929 R930 L931	I923-E927 VanDerWaalsContact O-CB 3.28Å; I923-E927 WeakPolarHBondContact O-CB 3.26Å; I923-E927 PolarHBondContact O-N 3.12Å; I923-E927 VanDerWaalsContact O-N 3.08Å; S924-E927 PolarHBondContact O-N 2.97Å; F925-E927 VanDerWaalsContact C-N 3.28Å; F925-E927 PolarHBondContact O-N 2.98Å; E927-I929 VanDerWaalsContact C-N 3.28Å; E927-I929 PolarHBondContact O-N 3Å; E927-R930 PolarHBondContact O-N 3.2Å; E927-L931 HydrophobicContact CG-CD1 4.23Å; E927-L931 HydrophobicContact CG-CG 4.38Å; E927-L931 WeakPolarHBondContact O-CB 3.43Å; E927-L931 VanDerWaalsContact O-CG 3.28Å; E927-L931 WeakPolarHBondContact O-CG 3.35Å; E927-L931 PolarHBondContact O-N 3.37Å
928	A	73.4	Confident	74.6	Confident	16.75 Å²	16.75	61.4 Å²	61.4	14%	0.138	29%	0.288	C	S	.	.	H	α-helix	trans	-61.8	-35.7	176.1	0	0	0	0	0	113.1	V912 S924 F925 R932	V912-A928 HydrophobicContact CG2-CB 3.38Å; V912-A928 VanDerWaalsContact CG2-CB 3.42Å; S924-A928 WeakPolarHBondContact O-CB 3.3Å; S924-A928 PolarHBondContact O-N 3.15Å; S924-A928 VanDerWaalsContact O-N 3.07Å; F925-A928 PolarHBondContact O-N 3.04Å; A928-R932 WeakPolarHBondContact O-CG 3.34Å
929	I	80	Confident	75.9	Confident	3.75 Å²	3.75	53.9 Å²	53.9	2%	0.019	26%	0.263	C	S	.	.	H	α-helix	trans	-70.5	-47.1	174.2	-66.3	169	0	0	0	110.1	R905 A908 I909 F925 H926 E927 L931 R932 I933 V977	R905-I929 HydrophobicContact CG-CD1 4.15Å; R905-I929 HydrophobicContact CG-CG1 4.43Å; A908-I929 HydrophobicContact CB-CG1 4.39Å; I909-I929 HydrophobicContact CD1-CD1 4.33Å; I909-I929 HydrophobicContact CG1-CD1 4.15Å; I909-I929 HydrophobicContact CG1-CG1 4.32Å; F925-I929 HydrophobicContact CD1-CD1 4.36Å; F925-I929 HydrophobicContact CE1-CD1 3.83Å; F925-I929 HydrophobicContact CZ-CD1 4.13Å; F925-I929 WeakPolarHBondContact O-CD1 3.5Å; F925-I929 VanDerWaalsContact O-CG1 3.28Å; F925-I929 WeakPolarHBondContact O-CG1 3.28Å; F925-I929 PolarHBondContact O-N 2.97Å; H926-I929 PolarHBondContact O-N 2.97Å; E927-I929 VanDerWaalsContact C-N 3.28Å; E927-I929 PolarHBondContact O-N 3Å; I929-L931 PolarHBondContact O-N 3.29Å; I929-R932 PolarHBondContact O-N 3.13Å; I929-I933 HydrophobicContact CG2-CB 4.37Å; I929-I933 HydrophobicContact CG2-CD1 4.15Å; I929-I933 HydrophobicContact CG2-CG1 4.3Å; I929-I933 PolarHBondContact O-N 3.08Å; I929-V977 HydrophobicContact CB-CG1 4.43Å; I929-V977 HydrophobicContact CG2-CG1 3.47Å; I929-V977 VanDerWaalsContact CG2-CG1 3.42Å; I929-V977 HydrophobicContact CG2-CG2 3.73Å
930	R	79.9	Confident	77.2	Confident	127.5 Å²	127.5	50.5 Å²	50.5	48%	0.481	25%	0.254	S	S	.	.	H	α-helix	trans	-61.3	-26.4	178.2	-78.8	176.7	174.6	175.7	-0.7	114.3	H926 E927 R932 G976 I978 L1014	H926-R930 WeakPolarHBondContact O-CB 3.37Å; H926-R930 VanDerWaalsContact O-CG 3.25Å; H926-R930 WeakPolarHBondContact O-CG 3.36Å; H926-R930 PolarHBondContact O-N 3.23Å; E927-R930 PolarHBondContact O-N 3.2Å; R930-R932 VanDerWaalsContact C-N 3.31Å; R930-R932 PolarHBondContact O-N 2.99Å; R930-G976 WeakPolarHBondContact CD-O 3.5Å; R930-G976 WeakPolarHBondContact CG-O 3.37Å; R930-G976 PolarHBondContact NE-O 3.03Å; R930-I978 HydrophobicContact CB-CG1 4.41Å; R930-I978 HydrophobicContact CG-CG1 4.47Å; R930-I978 VanDerWaalsContact O-CD1 3.29Å; R930-I978 WeakPolarHBondContact O-CD1 3.29Å; R930-L1014 VanDerWaalsContact O-CD2 3.24Å; R930-L1014 WeakPolarHBondContact O-CD2 3.33Å
931	L	80.7	Confident	78.5	Confident	39.75 Å²	39.75	45.2 Å²	45.2	21%	0.208	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-9.3	176.9	-74.7	170.2	0	0	0	113.3	E927 I929 L1014 R1017 L1018	E927-L931 HydrophobicContact CG-CD1 4.23Å; E927-L931 HydrophobicContact CG-CG 4.38Å; E927-L931 WeakPolarHBondContact O-CB 3.43Å; E927-L931 VanDerWaalsContact O-CG 3.28Å; E927-L931 WeakPolarHBondContact O-CG 3.35Å; E927-L931 PolarHBondContact O-N 3.37Å; I929-L931 PolarHBondContact O-N 3.29Å; L931-L1014 WeakPolarHBondContact O-CD2 3.37Å; L931-R1017 HydrophobicContact CD2-CB 3.59Å; L931-R1017 VanDerWaalsContact CD2-CB 3.49Å; L931-R1017 HydrophobicContact CD2-CG 4.38Å; L931-R1017 VanDerWaalsContact CD2-NH1 3.32Å; L931-L1018 HydrophobicContact CB-CD2 4.21Å; L931-L1018 WeakPolarHBondContact O-CD1 3.35Å; L931-L1018 WeakPolarHBondContact O-CD2 3.41Å; L931-L1018 WeakPolarHBondContact O-CG 3.32Å
932	R	83.7	Confident	79.7	Confident	50.5 Å²	50.5	40.9 Å²	40.9	19%	0.191	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.5	-22	-171.8	-63.6	-169.7	179.9	-152.2	5.4	114.8	D856 I857 F858 A908 K911 A928 I929 R930	D856-R932 WeakPolarHBondContact O-CB 3.24Å; D856-R932 WeakPolarHBondContact O-CD 3.27Å; D856-R932 VanDerWaalsContact O-CG 3.28Å; D856-R932 WeakPolarHBondContact O-CG 3.37Å; D856-R932 PolarHBondContact O-NH1 3.18Å; D856-R932 IonicContact OD1-NH1 3.44Å; D856-R932 PolarHBondContact OD1-NH1 3Å; I857-R932 CarbonylContact C-O 3.55Å; I857-R932 VanDerWaalsContact CA-O 3.3Å; I857-R932 WeakPolarHBondContact CA-O 3.33Å; F858-R932 PolarHBondContact N-O 2.94Å; A908-R932 HydrophobicContact CB-CB 4.3Å; A908-R932 PolarHBondContact O-NH1 2.99Å; A908-R932 VanDerWaalsContact O-NH1 3.12Å; K911-R932 VanDerWaalsContact CG-NH1 3.26Å; A928-R932 WeakPolarHBondContact O-CG 3.34Å; I929-R932 PolarHBondContact O-N 3.13Å; R930-R932 VanDerWaalsContact C-N 3.31Å; R930-R932 PolarHBondContact O-N 2.99Å
933	I	89.4	Confident	80.7	Confident	1.75 Å²	1.75	37.9 Å²	37.9	1%	0.009	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.3	-176.1	-53.8	-171.5	0	0	0	109.3	F858 Y901 A904 R905 I929 V935 V977 I978	F858-I933 HydrophobicContact CB-CG1 4.31Å; F858-I933 HydrophobicContact CB-CG2 4.49Å; F858-I933 HydrophobicContact CD1-CG2 4.11Å; F858-I933 WeakPolarHBondContact O-CA 3.38Å; Y901-I933 HydrophobicContact CD2-CG2 4.34Å; Y901-I933 HydrophobicContact CE2-CD1 4.45Å; Y901-I933 HydrophobicContact CE2-CG2 3.97Å; A904-I933 HydrophobicContact CB-CD1 4.37Å; R905-I933 HydrophobicContact CB-CD1 4.08Å; I929-I933 HydrophobicContact CG2-CB 4.37Å; I929-I933 HydrophobicContact CG2-CD1 4.15Å; I929-I933 HydrophobicContact CG2-CG1 4.3Å; I929-I933 PolarHBondContact O-N 3.08Å; I933-V935 HydrophobicContact CG2-CG2 4.25Å; I933-V977 HydrophobicContact CB-CB 4.43Å; I933-V977 HydrophobicContact CB-CG1 3.92Å; I933-V977 HydrophobicContact CG2-CB 4.13Å; I933-V977 HydrophobicContact CG2-CG1 3.76Å; I933-V977 HydrophobicContact CG2-CG2 4.37Å; I933-V977 WeakPolarHBondContact O-CG1 3.32Å; I933-I978 PolarHBondContact O-N 3.11Å
934	C	89.6	Confident	81.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.9	171.9	57.3	0	0	0	0	110.6	F858 V859 L860 F936 I978 V979 T1010 L1014	F858-C934 PolarHBondContact O-N 3.37Å; F858-C934 PolarHBondContact O-SG 3.05Å; F858-C934 VanDerWaalsContact O-SG 3.35Å; V859-C934 CarbonylContact C-O 3.51Å; V859-C934 WeakPolarHBondContact CA-O 3.38Å; L860-C934 PolarHBondContact N-O 3.21Å; C934-F936 HydrophobicContact CB-CE2 4.22Å; C934-I978 CarbonylContact C-O 3.55Å; C934-I978 VanDerWaalsContact CA-O 3.31Å; C934-I978 WeakPolarHBondContact CA-O 3.24Å; C934-I978 HydrophobicContact CB-CB 4.42Å; C934-V979 HydrophobicContact CB-CG2 3.69Å; C934-T1010 HydrophobicContact CB-CG2 4.11Å; C934-L1014 HydrophobicContact CB-CD1 4.11Å
935	V	91.3	Very high	82.2	Confident	0.25 Å²	0.25	43.6 Å²	43.6	0%	0.002	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133	-176.2	-172.9	0	0	0	0	109.8	L860 L862 Y901 I933 I937 I972 V977 I978 V979 S980	L860-V935 HydrophobicContact CB-CB 4.39Å; L860-V935 HydrophobicContact CB-CG1 4.13Å; L860-V935 HydrophobicContact CB-CG2 4.01Å; L860-V935 HydrophobicContact CD2-CG1 4.08Å; L860-V935 HydrophobicContact CD2-CG2 4.17Å; L860-V935 HydrophobicContact CG-CG1 4.17Å; L860-V935 CarbonylContact O-C 3.51Å; L860-V935 VanDerWaalsContact O-CA 3.3Å; L860-V935 WeakPolarHBondContact O-CA 3.25Å; L862-V935 HydrophobicContact CD1-CG1 4.17Å; L862-V935 HydrophobicContact CG-CG1 4.46Å; Y901-V935 HydrophobicContact CE2-CG2 4.38Å; I933-V935 HydrophobicContact CG2-CG2 4.25Å; V935-I937 HydrophobicContact CG1-CD1 4.32Å; V935-I937 HydrophobicContact CG1-CG1 4.07Å; V935-I972 HydrophobicContact CB-CG2 4.1Å; V935-I972 HydrophobicContact CG1-CD1 4.42Å; V935-I972 HydrophobicContact CG1-CG2 4.07Å; V935-I972 HydrophobicContact CG2-CG2 3.79Å; V935-V977 HydrophobicContact CB-CG1 4.48Å; V935-V977 HydrophobicContact CG2-CB 4.42Å; V935-V977 HydrophobicContact CG2-CG1 3.67Å; V935-V977 HydrophobicContact CG2-CG2 3.83Å; V935-V977 PolarHBondContact N-O 3.45Å; V935-V977 VanDerWaalsContact N-O 3.09Å; V935-I978 PolarHBondContact N-O 2.99Å; V935-V979 HydrophobicContact CB-CG1 4.1Å; V935-V979 HydrophobicContact CB-CG2 4.32Å; V935-V979 HydrophobicContact CG1-CG1 4.37Å; V935-V979 HydrophobicContact CG2-CG2 4.48Å; V935-V979 CarbonylContact O-C 3.56Å; V935-V979 VanDerWaalsContact O-CA 3.31Å; V935-V979 WeakPolarHBondContact O-CA 3.18Å; V935-V979 PolarHBondContact O-N 3.15Å; V935-S980 PolarHBondContact O-N 3Å
936	F	91.7	Very high	82.9	Confident	0.75 Å²	0.75	41.9 Å²	41.9	0%	0.003	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	123.1	175.6	-60.5	-92.9	0	0	0	108.9	V859 L860 L861 L862 C934 V979 S980 Y983 F1003 Q1006 F1007 T1010	V859-F936 HydrophobicContact CG1-CD2 4.08Å; V859-F936 HydrophobicContact CG1-CE2 4.07Å; L860-F936 PolarHBondContact O-N 3.05Å; L861-F936 WeakPolarHBondContact CA-O 3.31Å; L861-F936 HydrophobicContact CD2-CB 3.89Å; L861-F936 HydrophobicContact CD2-CD2 3.97Å; L861-F936 HydrophobicContact CD2-CG 4.25Å; L862-F936 PolarHBondContact N-O 3.21Å; C934-F936 HydrophobicContact CB-CE2 4.22Å; F936-V979 HydrophobicContact CD1-CG1 4.5Å; F936-V979 HydrophobicContact CE1-CB 4.05Å; F936-V979 HydrophobicContact CE1-CG1 3.68Å; F936-V979 HydrophobicContact CZ-CB 4.13Å; F936-V979 HydrophobicContact CZ-CG1 3.88Å; F936-S980 VanDerWaalsContact CD1-CB 3.47Å; F936-Y983 HydrophobicContact CB-CD1 4.45Å; F936-Y983 HydrophobicContact CB-CE1 3.99Å; F936-F1003 HydrophobicContact CB-CD2 4.21Å; F936-F1003 HydrophobicContact CB-CE2 3.84Å; F936-F1003 AromaticContact CD1-CD2 3.93Å; F936-F1003 HydrophobicContact CD1-CD2 4.04Å; F936-F1003 AromaticContact CD1-CE2 3.93Å; F936-F1003 HydrophobicContact CD1-CE2 3.97Å; F936-F1003 HydrophobicContact CD2-CE2 4.35Å; F936-F1003 HydrophobicContact CG-CD2 4.24Å; F936-F1003 AromaticContact CG-CE2 3.79Å; F936-F1003 HydrophobicContact CG-CE2 3.79Å; F936-Q1006 HydrophobicContact CE1-CB 4.3Å; F936-F1007 HydrophobicContact CD2-CD2 4.5Å; F936-F1007 HydrophobicContact CE1-CB 4.13Å; F936-F1007 AromaticContact CE2-CD2 3.77Å; F936-F1007 HydrophobicContact CE2-CD2 3.77Å; F936-F1007 HydrophobicContact CE2-CE2 4.46Å; F936-F1007 HydrophobicContact CZ-CB 4.05Å; F936-F1007 AromaticContact CZ-CD2 3.84Å; F936-F1007 HydrophobicContact CZ-CD2 3.84Å; F936-F1007 HydrophobicContact CZ-CG 4.42Å; F936-T1010 HydrophobicContact CZ-CG2 4.3Å
937	I	89.8	Confident	83.5	Confident	3.5 Å²	3.5	41.5 Å²	41.5	2%	0.018	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.6	-178.1	-55.6	179.2	0	0	0	108.5	L862 V935 K969 I978 V979 S980 Y981 N982 Y983	L862-I937 HydrophobicContact CB-CG1 4.34Å; L862-I937 HydrophobicContact CD1-CD1 4.5Å; L862-I937 HydrophobicContact CD1-CG1 4.27Å; L862-I937 WeakPolarHBondContact O-CA 3.34Å; V935-I937 HydrophobicContact CG1-CD1 4.32Å; V935-I937 HydrophobicContact CG1-CG1 4.07Å; I937-K969 HydrophobicContact CD1-CG 4.34Å; I937-I978 HydrophobicContact CD1-CD1 3.88Å; I937-I978 HydrophobicContact CD1-CG1 4.33Å; I937-I978 HydrophobicContact CD1-CG2 4.48Å; I937-V979 HydrophobicContact CD1-CG1 3.84Å; I937-V979 HydrophobicContact CG1-CG1 4.3Å; I937-S980 PolarHBondContact N-O 3.23Å; I937-Y981 HydrophobicContact CB-CD1 4.37Å; I937-Y981 HydrophobicContact CB-CD2 4.45Å; I937-Y981 HydrophobicContact CD1-CD1 3.62Å; I937-Y981 HydrophobicContact CD1-CD2 3.94Å; I937-Y981 HydrophobicContact CD1-CE1 3.36Å; I937-Y981 HydrophobicContact CD1-CE2 3.99Å; I937-Y981 HydrophobicContact CG1-CD1 4.5Å; I937-N982 VanDerWaalsContact O-CA 3.3Å; I937-N982 WeakPolarHBondContact O-CA 3.32Å; I937-N982 PolarHBondContact O-N 3.16Å; I937-Y983 VanDerWaalsContact O-CD1 3.3Å; I937-Y983 WeakPolarHBondContact O-CD1 3.31Å; I937-Y983 WeakPolarHBondContact O-CE1 3.41Å; I937-Y983 PolarHBondContact O-N 3.07Å
938	R	89.6	Confident	83.9	Confident	1 Å²	1	42 Å²	42	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	140.3	175.6	-173.8	167	65	-154.8	1.2	110.3	D797 M798 E801 L862 S940 Y983 A985	D797-R938 PolarHBondContact O-NH1 3.2Å; D797-R938 PolarHBondContact O-NH2 2.98Å; D797-R938 IonicContact OD2-NH2 3.31Å; M798-R938 HydrophobicContact CE-CB 4.1Å; M798-R938 PolarHBondContact SD-NH1 3.37Å; E801-R938 IonicContact OE1-CZ 3.51Å; E801-R938 IonicContact OE1-NH1 3.37Å; E801-R938 PolarHBondContact OE1-NH1 3.19Å; E801-R938 IonicContact OE2-NH1 3.58Å; L862-R938 PolarHBondContact O-N 3.23Å; L862-R938 VanDerWaalsContact O-N 3.11Å; R938-S940 PolarHBondContact O-N 3.06Å; R938-Y983 HydrophobicContact CB-CE1 4.16Å; R938-Y983 HydrophobicContact CB-CE2 3.99Å; R938-Y983 HydrophobicContact CG-CD2 4.48Å; R938-Y983 HydrophobicContact CG-CE2 3.95Å; R938-A985 HydrophobicContact CG-CB 4.22Å
939	D	86.6	Confident	84.3	Confident	50.5 Å²	50.5	49.3 Å²	49.3	27%	0.27	26%	0.255	S	S	.	.			trans	-66.2	129.5	174.5	-169.1	4.3	0	0	0	110.8	A941 S942 N982 Y983	D939-A941 PolarHBondContact O-N 2.93Å; D939-A941 PolarHBondContact OD1-N 3.11Å; D939-A941 VanDerWaalsContact OD1-N 3.08Å; D939-A941 WeakPolarHBondContact OD2-CB 3.33Å; D939-S942 WeakPolarHBondContact O-CB 3.24Å; D939-S942 PolarHBondContact O-N 3.1Å; D939-S942 PolarHBondContact O-OG 3.17Å; D939-N982 HydrophobicContact CB-CB 3.93Å; D939-Y983 WeakPolarHBondContact CB-O 3.29Å; D939-Y983 PolarHBondContact N-O 3.36Å
940	S	83.3	Confident	84.5	Confident	62.75 Å²	62.75	50.6 Å²	50.6	44%	0.439	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-64.4	-22.3	177.4	-61	0	0	0	0	112.2	D864 R938 S942 M943	D864-S940 PolarHBondContact OD1-OG 3.09Å; D864-S940 VanDerWaalsContact OD1-OG 3.11Å; D864-S940 WeakPolarHBondContact OD2-CA 3.46Å; D864-S940 WeakPolarHBondContact OD2-CB 3.25Å; D864-S940 PolarHBondContact OD2-OG 3.24Å; R938-S940 PolarHBondContact O-N 3.06Å; S940-S942 PolarHBondContact O-N 2.98Å; S940-S942 VanDerWaalsContact O-N 3.16Å; S940-M943 WeakPolarHBondContact O-CB 3.4Å; S940-M943 WeakPolarHBondContact O-CG 3.24Å; S940-M943 PolarHBondContact O-N 3.17Å; S940-M943 VanDerWaalsContact O-N 3.14Å
941	A	82.3	Confident	84.6	Confident	47.25 Å²	47.25	47.1 Å²	47.1	39%	0.39	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-62.4	-20	171.9	0	0	0	0	0	113.2	D939 M943 E944	D939-A941 PolarHBondContact O-N 2.93Å; D939-A941 PolarHBondContact OD1-N 3.11Å; D939-A941 VanDerWaalsContact OD1-N 3.08Å; D939-A941 WeakPolarHBondContact OD2-CB 3.33Å; A941-M943 PolarHBondContact O-N 3.24Å; A941-M943 VanDerWaalsContact O-N 3.08Å; A941-E944 WeakPolarHBondContact O-CG 3.19Å; A941-E944 PolarHBondContact O-N 3.13Å
942	S	80.9	Confident	84.7	Confident	7.25 Å²	7.25	48.8 Å²	48.8	5%	0.051	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-60.8	-16.1	175	-53.4	0	0	0	0	113.2	D939 S940 A985	D939-S942 WeakPolarHBondContact O-CB 3.24Å; D939-S942 PolarHBondContact O-N 3.1Å; D939-S942 PolarHBondContact O-OG 3.17Å; S940-S942 PolarHBondContact O-N 2.98Å; S940-S942 VanDerWaalsContact O-N 3.16Å; S942-A985 WeakPolarHBondContact CA-O 3.19Å; S942-A985 WeakPolarHBondContact CB-O 3.32Å; S942-A985 PolarHBondContact OG-N 3.15Å; S942-A985 VanDerWaalsContact OG-N 3.09Å; S942-A985 PolarHBondContact OG-O 3.21Å
943	M	79.6	Confident	84.5	Confident	15.75 Å²	15.75	49.2 Å²	49.2	8%	0.078	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-82.9	-13.8	-178.7	-61.1	-56.2	98.2	0	0	114	S940 A941 N945 V946 F954 E955 M997	S940-M943 WeakPolarHBondContact O-CB 3.4Å; S940-M943 WeakPolarHBondContact O-CG 3.24Å; S940-M943 PolarHBondContact O-N 3.17Å; S940-M943 VanDerWaalsContact O-N 3.14Å; A941-M943 PolarHBondContact O-N 3.24Å; A941-M943 VanDerWaalsContact O-N 3.08Å; M943-N945 VanDerWaalsContact C-N 3.26Å; M943-N945 PolarHBondContact O-N 3.23Å; M943-V946 HydrophobicContact CE-CB 3.98Å; M943-V946 HydrophobicContact CE-CG1 4.21Å; M943-V946 HydrophobicContact CE-CG2 3.69Å; M943-V946 PolarHBondContact O-N 3.09Å; M943-V946 VanDerWaalsContact O-N 3.14Å; M943-V946 HydrophobicContact SD-CG2 4.4Å; M943-F954 HydrophobicContact CE-CB 3.78Å; M943-F954 HydrophobicContact CE-CD2 3.87Å; M943-F954 HydrophobicContact CE-CG 3.81Å; M943-F954 HydrophobicContact SD-CB 3.6Å; M943-F954 VanDerWaalsContact SD-CB 3.59Å; M943-F954 WeakPolarHBondContact SD-CB 3.49Å; M943-F954 HydrophobicContact SD-CG 4.24Å; M943-E955 HydrophobicContact CG-CG 4.42Å; M943-M997 HydrophobicContact CE-CE 3.6Å; M943-M997 HydrophobicContact CE-SD 4.27Å; M943-M997 HydrophobicContact SD-CE 4.01Å
944	E	79.5	Confident	84.3	Confident	158.5 Å²	158.5	49.2 Å²	49.2	74%	0.741	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-33.9	-174.8	-71	-177.1	177.3	0	0	113.1	A941	A941-E944 WeakPolarHBondContact O-CG 3.19Å; A941-E944 PolarHBondContact O-N 3.13Å
945	N	79.8	Confident	84	Confident	110.75 Å²	110.75	52.5 Å²	52.5	59%	0.592	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	1.3	-177.8	-65.9	-37.9	0	0	0	114	M943	M943-N945 VanDerWaalsContact C-N 3.26Å; M943-N945 PolarHBondContact O-N 3.23Å
946	V	84.7	Confident	83.7	Confident	4.5 Å²	4.5	53.5 Å²	53.5	3%	0.027	28%	0.278	C	S	.	.	S	Bend	trans	-83.5	126.1	179.1	-178.8	0	0	0	0	109.3	M943 D948 L950 K951 F954 F987 M997	M943-V946 HydrophobicContact CE-CB 3.98Å; M943-V946 HydrophobicContact CE-CG1 4.21Å; M943-V946 HydrophobicContact CE-CG2 3.69Å; M943-V946 PolarHBondContact O-N 3.09Å; M943-V946 VanDerWaalsContact O-N 3.14Å; M943-V946 HydrophobicContact SD-CG2 4.4Å; V946-D948 PolarHBondContact O-N 3.1Å; V946-L950 HydrophobicContact CG1-CB 4.1Å; V946-K951 HydrophobicContact CB-CG 4.32Å; V946-K951 HydrophobicContact CG1-CG 4.08Å; V946-K951 VanDerWaalsContact O-CE 3.27Å; V946-K951 WeakPolarHBondContact O-CE 3.31Å; V946-F954 HydrophobicContact CG1-CD2 4Å; V946-F954 HydrophobicContact CG1-CE2 4.1Å; V946-F954 HydrophobicContact CG2-CD2 4.43Å; V946-F954 HydrophobicContact CG2-CE2 4.5Å; V946-F987 HydrophobicContact CG2-CB 4.02Å; V946-F987 HydrophobicContact CG2-CD2 4.37Å; V946-F987 HydrophobicContact CG2-CG 4.39Å; V946-M997 HydrophobicContact CG2-CE 3.83Å; V946-M997 HydrophobicContact CG2-SD 4.45Å
947	P	84.5	Confident	83.2	Confident	59.25 Å²	59.25	60.2 Å²	60.2	39%	0.385	30%	0.304	S	S	.	.			trans	-54.8	138.9	174.9	-25.7	34.4	0	0	0	112.1	E949 L950 K951 F987	P947-E949 PolarHBondContact O-N 3.11Å; P947-E949 VanDerWaalsContact O-N 3.1Å; P947-L950 HydrophobicContact CB-CD1 4.38Å; P947-L950 HydrophobicContact CB-CG 4.5Å; P947-L950 HydrophobicContact CG-CD1 4.2Å; P947-L950 WeakPolarHBondContact O-CA 3.41Å; P947-L950 PolarHBondContact O-N 3.25Å; P947-K951 PolarHBondContact O-N 3.05Å; P947-K951 VanDerWaalsContact O-N 3.16Å; P947-F987 HydrophobicContact CG-CD1 4.41Å; P947-F987 HydrophobicContact CG-CE1 4Å; P947-F987 HydrophobicContact CG-CZ 4.45Å
948	D	82.2	Confident	83	Confident	120.75 Å²	120.75	63.1 Å²	63.1	65%	0.646	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-35.1	-174.6	-71.8	-36.5	0	0	0	113.4	V946 L950 K951	V946-D948 PolarHBondContact O-N 3.1Å; D948-L950 PolarHBondContact O-N 3.11Å; D948-K951 PolarHBondContact O-N 3.07Å; D948-K951 VanDerWaalsContact OD1-CE 3.25Å; D948-K951 WeakPolarHBondContact OD1-CE 3.32Å; D948-K951 IonicContact OD1-NZ 3.47Å; D948-K951 PolarHBondContact OD1-NZ 2.99Å
949	E	81.7	Confident	82.9	Confident	169.75 Å²	169.75	67.9 Å²	67.9	79%	0.793	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-28.8	176.9	-61.5	178.3	-176.5	0	0	112.9	P947 H952	P947-E949 PolarHBondContact O-N 3.11Å; P947-E949 VanDerWaalsContact O-N 3.1Å; E949-H952 PolarHBondContact O-CD2 3.3Å; E949-H952 PolarHBondContact O-CE1 3.25Å; E949-H952 VanDerWaalsContact O-CE1 3.26Å; E949-H952 PolarHBondContact O-ND1 2.99Å
950	L	83.6	Confident	83	Confident	30 Å²	30	71 Å²	71	16%	0.157	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-9.2	-175.8	-61.6	174.8	0	0	0	113.1	V946 P947 D948 H952 Y953 F987 L990 P995	V946-L950 HydrophobicContact CG1-CB 4.1Å; P947-L950 HydrophobicContact CB-CD1 4.38Å; P947-L950 HydrophobicContact CB-CG 4.5Å; P947-L950 HydrophobicContact CG-CD1 4.2Å; P947-L950 WeakPolarHBondContact O-CA 3.41Å; P947-L950 PolarHBondContact O-N 3.25Å; D948-L950 PolarHBondContact O-N 3.11Å; L950-H952 PolarHBondContact O-N 3.31Å; L950-H952 VanDerWaalsContact O-N 3.13Å; L950-Y953 HydrophobicContact CD2-CD2 4.29Å; L950-Y953 HydrophobicContact CD2-CE2 4.15Å; L950-Y953 WeakPolarHBondContact O-CB 3.37Å; L950-Y953 PolarHBondContact O-N 3.32Å; L950-F987 HydrophobicContact CD1-CE2 4.24Å; L950-F987 HydrophobicContact CD1-CZ 3.76Å; L950-L990 HydrophobicContact CD1-CD1 4.4Å; L950-L990 HydrophobicContact CD1-CD2 4.09Å; L950-L990 HydrophobicContact CD1-CG 4.41Å; L950-L990 HydrophobicContact CD2-CD2 4.31Å; L950-P995 HydrophobicContact CB-CB 4.42Å; L950-P995 HydrophobicContact CD1-CB 4.31Å
951	K	82.9	Confident	83.2	Confident	54.5 Å²	54.5	70.5 Å²	70.5	24%	0.237	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-56.4	-30.8	179.9	-76.3	-176.8	178.1	167.4	0	113.2	V946 P947 D948 Y953 F954 E955	V946-K951 HydrophobicContact CB-CG 4.32Å; V946-K951 HydrophobicContact CG1-CG 4.08Å; V946-K951 VanDerWaalsContact O-CE 3.27Å; V946-K951 WeakPolarHBondContact O-CE 3.31Å; P947-K951 PolarHBondContact O-N 3.05Å; P947-K951 VanDerWaalsContact O-N 3.16Å; D948-K951 PolarHBondContact O-N 3.07Å; D948-K951 VanDerWaalsContact OD1-CE 3.25Å; D948-K951 WeakPolarHBondContact OD1-CE 3.32Å; D948-K951 IonicContact OD1-NZ 3.47Å; D948-K951 PolarHBondContact OD1-NZ 2.99Å; K951-Y953 PolarHBondContact O-N 3Å; K951-Y953 VanDerWaalsContact O-N 3.1Å; K951-F954 PolarHBondContact O-N 3.23Å; K951-E955 PolarHBondContact O-N 3.25Å
952	H	81.5	Confident	83.5	Confident	75.75 Å²	75.75	72.2 Å²	72.2	35%	0.351	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-60.7	-19.6	177.2	78.7	-76.6	0	0	0	115.1	R865 E949 L950 F954 Y957	R865-H952 PolarHBondContact NH1-O 3.09Å; R865-H952 VanDerWaalsContact NH1-O 3.12Å; E949-H952 PolarHBondContact O-CD2 3.3Å; E949-H952 PolarHBondContact O-CE1 3.25Å; E949-H952 VanDerWaalsContact O-CE1 3.26Å; E949-H952 PolarHBondContact O-ND1 2.99Å; L950-H952 PolarHBondContact O-N 3.31Å; L950-H952 VanDerWaalsContact O-N 3.13Å; H952-F954 VanDerWaalsContact C-N 3.33Å; H952-Y957 VanDerWaalsContact CA-CE2 3.5Å; H952-Y957 WeakPolarHBondContact CA-OH 3.27Å; H952-Y957 HydrophobicContact CB-CD2 4.47Å; H952-Y957 HydrophobicContact CB-CE2 3.42Å; H952-Y957 VanDerWaalsContact CB-CE2 3.4Å; H952-Y957 WeakPolarHBondContact CB-OH 3.32Å; H952-Y957 PolarHBondContact N-OH 3.23Å
953	Y	80.7	Confident	83.9	Confident	59.25 Å²	59.25	76.9 Å²	76.9	23%	0.232	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-72.9	-30.6	174.2	-77.7	-89.6	0	0	0	111.8	D797 R865 L950 K951 Y994 P995	D797-Y953 WeakPolarHBondContact CB-O 3.34Å; R865-Y953 VanDerWaalsContact CD-O 3.25Å; R865-Y953 WeakPolarHBondContact CD-O 3.35Å; R865-Y953 PolarHBondContact NH1-O 3.02Å; R865-Y953 VanDerWaalsContact NH1-O 3.12Å; L950-Y953 HydrophobicContact CD2-CD2 4.29Å; L950-Y953 HydrophobicContact CD2-CE2 4.15Å; L950-Y953 WeakPolarHBondContact O-CB 3.37Å; L950-Y953 PolarHBondContact O-N 3.32Å; K951-Y953 PolarHBondContact O-N 3Å; K951-Y953 VanDerWaalsContact O-N 3.1Å; Y953-Y994 HydrophobicContact CE1-CD1 4.32Å; Y953-Y994 HydrophobicContact CE1-CE1 4.42Å; Y953-P995 HydrophobicContact CD1-CG 3.96Å; Y953-P995 HydrophobicContact CD2-CG 3.75Å; Y953-P995 HydrophobicContact CE1-CG 4.33Å; Y953-P995 HydrophobicContact CE2-CG 4.35Å; Y953-P995 HydrophobicContact CG-CG 3.52Å; Y953-P995 VanDerWaalsContact CG-CG 3.48Å
954	F	84.5	Confident	84.4	Confident	1 Å²	1	79.7 Å²	79.7	0%	0.004	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-24.8	-169.5	-58.3	-79.1	0	0	0	115.2	D797 D864 R865 M943 V946 K951 H952 P995 M997	D797-F954 HydrophobicContact CB-CB 4.42Å; D797-F954 HydrophobicContact CB-CD1 3.88Å; D797-F954 HydrophobicContact CB-CG 4.45Å; D864-F954 CarbonylContact C-O 3.56Å; R865-F954 VanDerWaalsContact CG-O 3.29Å; R865-F954 WeakPolarHBondContact CG-O 3.3Å; M943-F954 HydrophobicContact CE-CB 3.78Å; M943-F954 HydrophobicContact CE-CD2 3.87Å; M943-F954 HydrophobicContact CE-CG 3.81Å; M943-F954 HydrophobicContact SD-CB 3.6Å; M943-F954 VanDerWaalsContact SD-CB 3.59Å; M943-F954 WeakPolarHBondContact SD-CB 3.49Å; M943-F954 HydrophobicContact SD-CG 4.24Å; V946-F954 HydrophobicContact CG1-CD2 4Å; V946-F954 HydrophobicContact CG1-CE2 4.1Å; V946-F954 HydrophobicContact CG2-CD2 4.43Å; V946-F954 HydrophobicContact CG2-CE2 4.5Å; K951-F954 PolarHBondContact O-N 3.23Å; H952-F954 VanDerWaalsContact C-N 3.33Å; F954-P995 HydrophobicContact CE2-CB 3.7Å; F954-P995 HydrophobicContact CE2-CG 3.79Å; F954-P995 HydrophobicContact CZ-CB 3.82Å; F954-P995 HydrophobicContact CZ-CG 3.93Å; F954-P995 WeakPolarHBondContact CZ-O 3.4Å; F954-M997 HydrophobicContact CD1-CE 3.75Å; F954-M997 HydrophobicContact CD1-CG 4.42Å; F954-M997 HydrophobicContact CD1-SD 4.38Å; F954-M997 HydrophobicContact CD2-CE 4.26Å; F954-M997 HydrophobicContact CE1-CE 3.98Å; F954-M997 HydrophobicContact CE1-CG 3.76Å; F954-M997 HydrophobicContact CE1-SD 4.25Å; F954-M997 HydrophobicContact CE2-CE 4.23Å; F954-M997 HydrophobicContact CG-CE 4.02Å; F954-M997 HydrophobicContact CZ-CE 3.97Å; F954-M997 HydrophobicContact CZ-CG 4.21Å; F954-M997 HydrophobicContact CZ-SD 4.31Å
955	E	83.9	Confident	85	Confident	70.25 Å²	70.25	72.3 Å²	72.3	33%	0.328	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-113.7	147.7	-177.2	-148.4	-178.9	175.7	0	0	112.3	D864 M943 K951	D864-E955 HydrophobicContact CB-CG 4.45Å; M943-E955 HydrophobicContact CG-CG 4.42Å; K951-E955 PolarHBondContact O-N 3.25Å
956	E	83.8	Confident	85.4	Confident	19.5 Å²	19.5	70.6 Å²	70.6	9%	0.091	34%	0.336	C	S	.	.			trans	-90.5	119.9	172.7	-164.4	69.7	-118.5	0	0	111.7	D864 Y866 D958 K961 R962	D864-E956 WeakPolarHBondContact O-CB 3.38Å; D864-E956 PolarHBondContact O-N 3.26Å; D864-E956 VanDerWaalsContact O-N 3.07Å; Y866-E956 PolarHBondContact N-OE2 3.38Å; E956-D958 HydrophobicContact CG-CB 4.33Å; E956-K961 HydrophobicContact CG-CB 3.58Å; E956-K961 HydrophobicContact CG-CD 4.01Å; E956-K961 HydrophobicContact CG-CG 4.46Å; E956-K961 VanDerWaalsContact OE1-CD 3.22Å; E956-K961 WeakPolarHBondContact OE1-CD 3.39Å; E956-K961 IonicContact OE1-NZ 3.05Å; E956-K961 PolarHBondContact OE1-NZ 3.29Å; E956-R962 PolarHBondContact O-NE 3.17Å; E956-R962 PolarHBondContact O-NH2 3.23Å
957	Y	81.3	Confident	85.7	Confident	141.5 Å²	141.5	73 Å²	73	56%	0.555	36%	0.356	S	S	*	.			trans	-77.7	-26.5	176.9	-68.2	-76.4	0	0	0	113.6	H952 N959 R962	H952-Y957 VanDerWaalsContact CA-CE2 3.5Å; H952-Y957 WeakPolarHBondContact CA-OH 3.27Å; H952-Y957 HydrophobicContact CB-CD2 4.47Å; H952-Y957 HydrophobicContact CB-CE2 3.42Å; H952-Y957 VanDerWaalsContact CB-CE2 3.4Å; H952-Y957 WeakPolarHBondContact CB-OH 3.32Å; H952-Y957 PolarHBondContact N-OH 3.23Å; Y957-N959 PolarHBondContact O-N 3.21Å; Y957-R962 VanDerWaalsContact C-NH2 3.3Å; Y957-R962 PolarHBondContact O-NH2 3.04Å
958	D	86.5	Confident	86	Confident	65.5 Å²	65.5	70.4 Å²	70.4	35%	0.35	34%	0.338	S	S	.	.			trans	-71.6	115	-179	-176.8	-8.7	0	0	0	110.6	E956 E960 K961 R962	E956-D958 HydrophobicContact CG-CB 4.33Å; D958-E960 VanDerWaalsContact C-N 3.27Å; D958-E960 PolarHBondContact O-N 3.14Å; D958-E960 WeakPolarHBondContact OD1-CB 3.47Å; D958-E960 PolarHBondContact OD1-N 3.15Å; D958-K961 HydrophobicContact CB-CB 4.1Å; D958-K961 HydrophobicContact CB-CD 4.03Å; D958-K961 HydrophobicContact CB-CG 4.1Å; D958-K961 PolarHBondContact O-N 3.29Å; D958-K961 WeakPolarHBondContact OD2-CE 3.43Å; D958-K961 WeakPolarHBondContact OD2-CG 3.43Å; D958-R962 WeakPolarHBondContact O-CB 3.35Å; D958-R962 PolarHBondContact O-N 2.96Å
959	N	87.4	Confident	86.3	Confident	102.25 Å²	102.25	65.2 Å²	65.2	55%	0.547	31%	0.31	S	S	.	.	H	α-helix	trans	-58.6	-35.4	179.7	-72.7	-22.4	0	0	0	112.3	Y957 R962 N963	Y957-N959 PolarHBondContact O-N 3.21Å; N959-R962 PolarHBondContact O-N 3.09Å; N959-R962 PolarHBondContact OD1-NH1 2.8Å; N959-R962 PolarHBondContact OD1-NH2 2.83Å; N959-N963 WeakPolarHBondContact O-CB 3.37Å; N959-N963 VanDerWaalsContact O-CG 3.22Å; N959-N963 PolarHBondContact O-N 3.03Å; N959-N963 PolarHBondContact O-ND2 3.24Å
960	E	87.8	Confident	86.5	Confident	114.25 Å²	114.25	62.8 Å²	62.8	53%	0.534	30%	0.299	S	S	.	.	H	α-helix	trans	-67.5	-47.8	179.5	-150.3	-172.8	164.9	0	0	110.6	D958 R962 N963 R964	D958-E960 VanDerWaalsContact C-N 3.27Å; D958-E960 PolarHBondContact O-N 3.14Å; D958-E960 WeakPolarHBondContact OD1-CB 3.47Å; D958-E960 PolarHBondContact OD1-N 3.15Å; E960-R962 VanDerWaalsContact C-N 3.33Å; E960-R962 PolarHBondContact O-N 3.07Å; E960-N963 PolarHBondContact O-N 3.14Å; E960-R964 WeakPolarHBondContact O-CG 3.32Å; E960-R964 PolarHBondContact O-N 3.26Å; E960-R964 IonicContact OE1-CZ 3.01Å; E960-R964 VanDerWaalsContact OE1-CZ 3.26Å; E960-R964 IonicContact OE1-NE 3.02Å; E960-R964 PolarHBondContact OE1-NE 2.95Å; E960-R964 IonicContact OE1-NH2 3.3Å; E960-R964 PolarHBondContact OE1-NH2 3.09Å
961	K	88.4	Confident	86.7	Confident	52.5 Å²	52.5	64 Å²	64	23%	0.228	31%	0.305	C	S	.	.	H	α-helix	trans	-64.3	-37.3	176.9	-68.9	-177.5	-169	177	0	112.4	Y866 I869 E956 D958 R964 L965	Y866-K961 HydrophobicContact CD1-CB 4.07Å; Y866-K961 HydrophobicContact CD1-CD 4.47Å; Y866-K961 HydrophobicContact CD1-CG 4.05Å; Y866-K961 HydrophobicContact CG-CB 4.33Å; I869-K961 HydrophobicContact CD1-CD 4.47Å; I869-K961 HydrophobicContact CD1-CG 4.21Å; E956-K961 HydrophobicContact CG-CB 3.58Å; E956-K961 HydrophobicContact CG-CD 4.01Å; E956-K961 HydrophobicContact CG-CG 4.46Å; E956-K961 VanDerWaalsContact OE1-CD 3.22Å; E956-K961 WeakPolarHBondContact OE1-CD 3.39Å; E956-K961 IonicContact OE1-NZ 3.05Å; E956-K961 PolarHBondContact OE1-NZ 3.29Å; D958-K961 HydrophobicContact CB-CB 4.1Å; D958-K961 HydrophobicContact CB-CD 4.03Å; D958-K961 HydrophobicContact CB-CG 4.1Å; D958-K961 PolarHBondContact O-N 3.29Å; D958-K961 WeakPolarHBondContact OD2-CE 3.43Å; D958-K961 WeakPolarHBondContact OD2-CG 3.43Å; K961-R964 PolarHBondContact O-N 3.27Å; K961-L965 WeakPolarHBondContact O-CB 3.29Å; K961-L965 PolarHBondContact O-N 2.93Å
962	R	88	Confident	86.9	Confident	83.75 Å²	83.75	61.4 Å²	61.4	32%	0.316	29%	0.294	S	S	.	.	H	α-helix	trans	-63.1	-43.1	174.9	-165.2	178.7	-33.1	113.4	7.3	111.5	E956 Y957 D958 N959 E960 L965 N966	E956-R962 PolarHBondContact O-NE 3.17Å; E956-R962 PolarHBondContact O-NH2 3.23Å; Y957-R962 VanDerWaalsContact C-NH2 3.3Å; Y957-R962 PolarHBondContact O-NH2 3.04Å; D958-R962 WeakPolarHBondContact O-CB 3.35Å; D958-R962 PolarHBondContact O-N 2.96Å; N959-R962 PolarHBondContact O-N 3.09Å; N959-R962 PolarHBondContact OD1-NH1 2.8Å; N959-R962 PolarHBondContact OD1-NH2 2.83Å; E960-R962 VanDerWaalsContact C-N 3.33Å; E960-R962 PolarHBondContact O-N 3.07Å; R962-L965 PolarHBondContact O-N 3.12Å; R962-N966 WeakPolarHBondContact O-CB 3.39Å; R962-N966 VanDerWaalsContact O-CG 3.3Å; R962-N966 PolarHBondContact O-N 3.11Å; R962-N966 PolarHBondContact O-ND2 3.23Å
963	N	90.2	Very high	86.9	Confident	106 Å²	106	64 Å²	64	57%	0.567	30%	0.301	S	S	*	.	H	α-helix	trans	-63.8	-41.2	174.8	-70.9	-19	0	0	0	111.8	N959 E960 N966 A967	N959-N963 WeakPolarHBondContact O-CB 3.37Å; N959-N963 VanDerWaalsContact O-CG 3.22Å; N959-N963 PolarHBondContact O-N 3.03Å; N959-N963 PolarHBondContact O-ND2 3.24Å; E960-N963 PolarHBondContact O-N 3.14Å; N963-N966 PolarHBondContact O-N 3.15Å; N963-A967 WeakPolarHBondContact O-CB 3.39Å; N963-A967 PolarHBondContact O-N 3.23Å
964	R	90.5	Very high	86.9	Confident	74.25 Å²	74.25	67.5 Å²	67.5	28%	0.28	32%	0.323	S	S	.	.	H	α-helix	trans	-65.1	-40.9	174.7	-70.7	178.5	-178.3	-128.1	2.4	112.4	Y866 P892 G893 E960 K961 N966 A967 F968	Y866-R964 HydrophobicContact CD1-CB 4.36Å; Y866-R964 HydrophobicContact CD2-CB 4.23Å; Y866-R964 HydrophobicContact CE1-CB 3.88Å; Y866-R964 HydrophobicContact CE1-CG 4.44Å; Y866-R964 HydrophobicContact CE2-CB 3.76Å; Y866-R964 HydrophobicContact CG-CB 4.4Å; Y866-R964 VanDerWaalsContact CZ-CB 3.48Å; P892-R964 PolarHBondContact O-NH1 3.01Å; P892-R964 VanDerWaalsContact O-NH1 3.13Å; P892-R964 PolarHBondContact O-NH2 3.1Å; G893-R964 VanDerWaalsContact C-NH1 3.29Å; G893-R964 PolarHBondContact O-NH1 3.3Å; G893-R964 VanDerWaalsContact O-NH1 3.15Å; E960-R964 WeakPolarHBondContact O-CG 3.32Å; E960-R964 PolarHBondContact O-N 3.26Å; E960-R964 IonicContact OE1-CZ 3.01Å; E960-R964 VanDerWaalsContact OE1-CZ 3.26Å; E960-R964 IonicContact OE1-NE 3.02Å; E960-R964 PolarHBondContact OE1-NE 2.95Å; E960-R964 IonicContact OE1-NH2 3.3Å; E960-R964 PolarHBondContact OE1-NH2 3.09Å; K961-R964 PolarHBondContact O-N 3.27Å; R964-N966 VanDerWaalsContact C-N 3.34Å; R964-N966 PolarHBondContact O-N 3.08Å; R964-A967 PolarHBondContact O-N 3.24Å; R964-F968 VanDerWaalsContact O-CB 3.29Å; R964-F968 WeakPolarHBondContact O-CB 3.35Å; R964-F968 PolarHBondContact O-N 3.09Å
965	L	90.5	Very high	86.5	Confident	3.25 Å²	3.25	68.1 Å²	68.1	2%	0.017	33%	0.327	C	S	.	.	H	α-helix	trans	-61.6	-43.6	174.4	178.5	62.6	0	0	0	111.3	D864 Y866 K961 R962 F968 K969	D864-L965 VanDerWaalsContact C-CD2 3.47Å; Y866-L965 HydrophobicContact CD2-CB 3.89Å; Y866-L965 HydrophobicContact CD2-CD1 4.34Å; Y866-L965 HydrophobicContact CG-CB 4.39Å; K961-L965 WeakPolarHBondContact O-CB 3.29Å; K961-L965 PolarHBondContact O-N 2.93Å; R962-L965 PolarHBondContact O-N 3.12Å; L965-F968 PolarHBondContact O-N 3.11Å; L965-K969 HydrophobicContact CD1-CG 4.4Å; L965-K969 HydrophobicContact CG-CD 4.39Å; L965-K969 WeakPolarHBondContact O-CB 3.39Å; L965-K969 WeakPolarHBondContact O-CG 3.32Å; L965-K969 PolarHBondContact O-N 3.15Å
966	N	89.4	Confident	85.8	Confident	75.75 Å²	75.75	65.6 Å²	65.6	41%	0.405	32%	0.32	S	S	.	.	H	α-helix	trans	-63.8	-44.9	176.4	-72.1	-21	0	0	0	111.4	R962 N963 R964 F968 K969 E970	R962-N966 WeakPolarHBondContact O-CB 3.39Å; R962-N966 VanDerWaalsContact O-CG 3.3Å; R962-N966 PolarHBondContact O-N 3.11Å; R962-N966 PolarHBondContact O-ND2 3.23Å; N963-N966 PolarHBondContact O-N 3.15Å; R964-N966 VanDerWaalsContact C-N 3.34Å; R964-N966 PolarHBondContact O-N 3.08Å; N966-F968 VanDerWaalsContact C-N 3.28Å; N966-F968 PolarHBondContact O-N 2.99Å; N966-K969 PolarHBondContact O-N 3.24Å; N966-E970 WeakPolarHBondContact O-CG 3.38Å; N966-E970 PolarHBondContact O-N 3.05Å
967	A	89.6	Confident	85.3	Confident	54.75 Å²	54.75	65.2 Å²	65.2	45%	0.452	32%	0.318	S	S	.	.	H	α-helix	trans	-61	-36.9	173.9	0	0	0	0	0	112.2	N963 R964 E970 L971	N963-A967 WeakPolarHBondContact O-CB 3.39Å; N963-A967 PolarHBondContact O-N 3.23Å; R964-A967 PolarHBondContact O-N 3.24Å; A967-E970 PolarHBondContact O-N 2.82Å; A967-L971 WeakPolarHBondContact O-CB 3.43Å; A967-L971 PolarHBondContact O-N 3.09Å
968	F	91	Very high	84.7	Confident	3.25 Å²	3.25	60.5 Å²	60.5	1%	0.014	30%	0.302	C	S	.	.	H	α-helix	trans	-69.8	-43.3	176.1	-177	-133.8	0	0	0	112	L860 L862 Y866 E898 Y901 R964 L965 N966 E970 L971 I972	L860-F968 HydrophobicContact CD2-CE1 4.16Å; L860-F968 HydrophobicContact CD2-CZ 3.97Å; L862-F968 HydrophobicContact CD1-CD1 4.33Å; L862-F968 HydrophobicContact CD1-CE1 4.17Å; L862-F968 HydrophobicContact CD2-CD1 4.43Å; L862-F968 HydrophobicContact CD2-CE1 4.03Å; Y866-F968 HydrophobicContact CE2-CB 4.48Å; E898-F968 HydrophobicContact CB-CD1 4.47Å; E898-F968 HydrophobicContact CB-CD2 4.36Å; E898-F968 HydrophobicContact CB-CE1 4.32Å; E898-F968 HydrophobicContact CB-CE2 4.13Å; E898-F968 HydrophobicContact CB-CG 4.5Å; E898-F968 HydrophobicContact CB-CZ 4.1Å; E898-F968 HydrophobicContact CG-CD2 3.84Å; E898-F968 HydrophobicContact CG-CE2 3.78Å; E898-F968 HydrophobicContact CG-CG 4.4Å; E898-F968 HydrophobicContact CG-CZ 4.27Å; Y901-F968 AromaticContact CD1-CE2 3.69Å; Y901-F968 HydrophobicContact CD1-CE2 3.69Å; Y901-F968 HydrophobicContact CD1-CZ 4.15Å; Y901-F968 HydrophobicContact CE1-CE2 4.3Å; Y901-F968 AromaticContact CG-CE2 3.98Å; Y901-F968 HydrophobicContact CG-CE2 4Å; Y901-F968 AromaticContact CG-CZ 3.94Å; Y901-F968 HydrophobicContact CG-CZ 3.96Å; R964-F968 VanDerWaalsContact O-CB 3.29Å; R964-F968 WeakPolarHBondContact O-CB 3.35Å; R964-F968 PolarHBondContact O-N 3.09Å; L965-F968 PolarHBondContact O-N 3.11Å; N966-F968 VanDerWaalsContact C-N 3.28Å; N966-F968 PolarHBondContact O-N 2.99Å; F968-E970 VanDerWaalsContact C-N 3.3Å; F968-E970 PolarHBondContact O-N 3.26Å; F968-L971 WeakPolarHBondContact O-CB 3.24Å; F968-L971 PolarHBondContact O-N 3.17Å; F968-I972 HydrophobicContact CD1-CD1 4.08Å; F968-I972 HydrophobicContact CD2-CD1 4.12Å; F968-I972 HydrophobicContact CD2-CG1 4.29Å; F968-I972 HydrophobicContact CE1-CD1 3.78Å; F968-I972 HydrophobicContact CE2-CD1 3.79Å; F968-I972 HydrophobicContact CE2-CG1 4Å; F968-I972 HydrophobicContact CG-CD1 4.25Å; F968-I972 HydrophobicContact CZ-CD1 3.63Å; F968-I972 HydrophobicContact CZ-CG1 4.3Å; F968-I972 VanDerWaalsContact O-CG1 3.23Å; F968-I972 WeakPolarHBondContact O-CG1 3.2Å; F968-I972 PolarHBondContact O-N 3.16Å
969	K	88.8	Confident	83.9	Confident	13 Å²	13	58.8 Å²	58.8	6%	0.057	30%	0.295	C	S	.	.	H	α-helix	trans	-59.3	-40.4	172.2	-73.5	179.2	179.5	-179.5	0	110.9	L862 G863 D864 I937 L965 N966 R973	L862-K969 HydrophobicContact CD1-CG 4.35Å; G863-K969 VanDerWaalsContact O-CE 3.25Å; G863-K969 WeakPolarHBondContact O-CE 3.35Å; G863-K969 PolarHBondContact O-NZ 2.99Å; D864-K969 IonicContact OD1-NZ 3.1Å; D864-K969 PolarHBondContact OD1-NZ 3.1Å; I937-K969 HydrophobicContact CD1-CG 4.34Å; L965-K969 HydrophobicContact CD1-CG 4.4Å; L965-K969 HydrophobicContact CG-CD 4.39Å; L965-K969 WeakPolarHBondContact O-CB 3.39Å; L965-K969 WeakPolarHBondContact O-CG 3.32Å; L965-K969 PolarHBondContact O-N 3.15Å; N966-K969 PolarHBondContact O-N 3.24Å; K969-R973 WeakPolarHBondContact O-CB 3.22Å; K969-R973 VanDerWaalsContact O-CG 3.26Å; K969-R973 WeakPolarHBondContact O-CG 3.28Å; K969-R973 PolarHBondContact O-N 3.06Å; K969-R973 VanDerWaalsContact O-N 3.12Å
970	E	87.3	Confident	83.1	Confident	118.5 Å²	118.5	54.7 Å²	54.7	55%	0.554	27%	0.274	S	S	*	.	H	α-helix	trans	-66.3	-41.5	173.8	-75.2	-177	171.2	0	0	112.9	N966 A967 F968 I972 R973 N974	N966-E970 WeakPolarHBondContact O-CG 3.38Å; N966-E970 PolarHBondContact O-N 3.05Å; A967-E970 PolarHBondContact O-N 2.82Å; F968-E970 VanDerWaalsContact C-N 3.3Å; F968-E970 PolarHBondContact O-N 3.26Å; E970-I972 VanDerWaalsContact C-N 3.34Å; E970-I972 PolarHBondContact O-N 3.2Å; E970-R973 WeakPolarHBondContact O-CB 3.31Å; E970-R973 PolarHBondContact O-N 2.95Å; E970-N974 PolarHBondContact O-N 3.02Å; E970-N974 VanDerWaalsContact O-N 3.14Å; E970-N974 PolarHBondContact O-ND2 3.12Å
971	L	87.4	Confident	82.2	Confident	56 Å²	56	55.4 Å²	55.4	29%	0.293	27%	0.273	S	S	.	.	H	α-helix	trans	-59.5	-47.2	175.9	-175.8	154.2	0	0	0	111.1	Y901 A967 F968 R973 N974 D975	Y901-L971 HydrophobicContact CD1-CD2 4.31Å; Y901-L971 HydrophobicContact CE1-CD2 3.72Å; A967-L971 WeakPolarHBondContact O-CB 3.43Å; A967-L971 PolarHBondContact O-N 3.09Å; F968-L971 WeakPolarHBondContact O-CB 3.24Å; F968-L971 PolarHBondContact O-N 3.17Å; L971-R973 VanDerWaalsContact C-N 3.31Å; L971-R973 PolarHBondContact O-N 3.35Å; L971-N974 PolarHBondContact O-N 3.32Å; L971-N974 VanDerWaalsContact O-N 3.1Å; L971-D975 VanDerWaalsContact CD2-OD2 3.25Å; L971-D975 WeakPolarHBondContact CD2-OD2 3.27Å; L971-D975 WeakPolarHBondContact O-CB 3.31Å; L971-D975 PolarHBondContact O-N 3.14Å
972	I	86.6	Confident	81.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-40.1	178.7	-69.3	166.1	0	0	0	111.3	L860 L862 Y901 V935 F968 E970 N974 D975 G976 V977 I978 V979	L860-I972 HydrophobicContact CD2-CD1 3.7Å; L862-I972 HydrophobicContact CD1-CD1 3.44Å; L862-I972 VanDerWaalsContact CD1-CD1 3.43Å; Y901-I972 HydrophobicContact CE1-CG1 4.39Å; Y901-I972 HydrophobicContact CE2-CG1 4.19Å; V935-I972 HydrophobicContact CB-CG2 4.1Å; V935-I972 HydrophobicContact CG1-CD1 4.42Å; V935-I972 HydrophobicContact CG1-CG2 4.07Å; V935-I972 HydrophobicContact CG2-CG2 3.79Å; F968-I972 HydrophobicContact CD1-CD1 4.08Å; F968-I972 HydrophobicContact CD2-CD1 4.12Å; F968-I972 HydrophobicContact CD2-CG1 4.29Å; F968-I972 HydrophobicContact CE1-CD1 3.78Å; F968-I972 HydrophobicContact CE2-CD1 3.79Å; F968-I972 HydrophobicContact CE2-CG1 4Å; F968-I972 HydrophobicContact CG-CD1 4.25Å; F968-I972 HydrophobicContact CZ-CD1 3.63Å; F968-I972 HydrophobicContact CZ-CG1 4.3Å; F968-I972 VanDerWaalsContact O-CG1 3.23Å; F968-I972 WeakPolarHBondContact O-CG1 3.2Å; F968-I972 PolarHBondContact O-N 3.16Å; E970-I972 VanDerWaalsContact C-N 3.34Å; E970-I972 PolarHBondContact O-N 3.2Å; I972-N974 PolarHBondContact O-N 3.06Å; I972-D975 PolarHBondContact O-N 2.95Å; I972-G976 PolarHBondContact O-N 3.24Å; I972-G976 VanDerWaalsContact O-N 3.13Å; I972-V977 HydrophobicContact CB-CG2 4.47Å; I972-V977 HydrophobicContact CG2-CG2 3.63Å; I972-V977 VanDerWaalsContact CG2-CG2 3.48Å; I972-I978 HydrophobicContact CG2-CD1 4.16Å; I972-I978 HydrophobicContact CG2-CG1 3.55Å; I972-V979 HydrophobicContact CG2-CG2 3.83Å
973	R	82.4	Confident	81.5	Confident	129.25 Å²	129.25	52.6 Å²	52.6	49%	0.488	27%	0.266	S	S	.	.	H	α-helix	trans	-59.8	-38.2	175.6	-93.2	172.9	-172.6	133.3	-0.3	111.8	K969 E970 L971 G976 I978 Y981	K969-R973 WeakPolarHBondContact O-CB 3.22Å; K969-R973 VanDerWaalsContact O-CG 3.26Å; K969-R973 WeakPolarHBondContact O-CG 3.28Å; K969-R973 PolarHBondContact O-N 3.06Å; K969-R973 VanDerWaalsContact O-N 3.12Å; E970-R973 WeakPolarHBondContact O-CB 3.31Å; E970-R973 PolarHBondContact O-N 2.95Å; L971-R973 VanDerWaalsContact C-N 3.31Å; L971-R973 PolarHBondContact O-N 3.35Å; R973-G976 WeakPolarHBondContact O-CA 3.32Å; R973-G976 PolarHBondContact O-N 3.44Å; R973-G976 VanDerWaalsContact O-N 3.12Å; R973-I978 HydrophobicContact CB-CD1 3.72Å; R973-I978 HydrophobicContact CG-CD1 4.14Å; R973-Y981 WeakPolarHBondContact CA-OH 3.31Å; R973-Y981 HydrophobicContact CG-CE1 3.73Å; R973-Y981 VanDerWaalsContact CG-CZ 3.47Å; R973-Y981 WeakPolarHBondContact CG-OH 3.28Å
974	N	80.2	Confident	81.2	Confident	132 Å²	132	49.7 Å²	49.7	71%	0.706	25%	0.254	S	S	*	.	H	α-helix	trans	-81	-23	-179	-66.7	-24	0	0	0	113.6	H926 E970 L971 I972 G976	H926-N974 PolarHBondContact CE1-O 3.44Å; E970-N974 PolarHBondContact O-N 3.02Å; E970-N974 VanDerWaalsContact O-N 3.14Å; E970-N974 PolarHBondContact O-ND2 3.12Å; L971-N974 PolarHBondContact O-N 3.32Å; L971-N974 VanDerWaalsContact O-N 3.1Å; I972-N974 PolarHBondContact O-N 3.06Å; N974-G976 VanDerWaalsContact C-N 3.3Å; N974-G976 PolarHBondContact O-N 3.07Å
975	D	75.5	Confident	81	Confident	15.25 Å²	15.25	46.3 Å²	46.3	8%	0.082	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-7.6	-177	-119.9	11.1	0	0	0	113.4	Y901 R905 H926 L971 I972 V977	Y901-D975 VanDerWaalsContact OH-CB 3.25Å; Y901-D975 WeakPolarHBondContact OH-CB 3.28Å; Y901-D975 PolarHBondContact OH-OD2 3.15Å; R905-D975 WeakPolarHBondContact CD-OD2 3.34Å; R905-D975 IonicContact CZ-OD1 3.75Å; R905-D975 VanDerWaalsContact CZ-OD1 3.28Å; R905-D975 IonicContact CZ-OD2 3.74Å; R905-D975 IonicContact NE-OD1 3.07Å; R905-D975 PolarHBondContact NE-OD1 3.3Å; R905-D975 IonicContact NE-OD2 3.35Å; R905-D975 PolarHBondContact NE-OD2 3.04Å; R905-D975 VanDerWaalsContact NE-OD2 3.15Å; R905-D975 IonicContact NH1-OD1 2.73Å; R905-D975 PolarHBondContact NH1-OD1 2.69Å; R905-D975 VanDerWaalsContact NH1-OD1 3.1Å; R905-D975 IonicContact NH1-OD2 3.15Å; R905-D975 PolarHBondContact NH1-OD2 2.84Å; R905-D975 IonicContact NH2-OD1 3.15Å; R905-D975 PolarHBondContact NH2-OD1 3.31Å; R905-D975 IonicContact NH2-OD2 3.49Å; H926-D975 PolarHBondContact CE1-O 3.29Å; H926-D975 PolarHBondContact ND1-O 3.37Å; L971-D975 VanDerWaalsContact CD2-OD2 3.25Å; L971-D975 WeakPolarHBondContact CD2-OD2 3.27Å; L971-D975 WeakPolarHBondContact O-CB 3.31Å; L971-D975 PolarHBondContact O-N 3.14Å; I972-D975 PolarHBondContact O-N 2.95Å; D975-V977 VanDerWaalsContact C-N 3.3Å; D975-V977 HydrophobicContact CB-CG1 4.39Å; D975-V977 HydrophobicContact CB-CG2 4.11Å; D975-V977 PolarHBondContact O-N 3.19Å
976	G	68.4	Low	80.7	Confident	17.25 Å²	17.25	51 Å²	51	18%	0.178	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	18.2	175.2	0	0	0	0	0	114.6	R930 I972 R973 N974	R930-G976 WeakPolarHBondContact CD-O 3.5Å; R930-G976 WeakPolarHBondContact CG-O 3.37Å; R930-G976 PolarHBondContact NE-O 3.03Å; I972-G976 PolarHBondContact O-N 3.24Å; I972-G976 VanDerWaalsContact O-N 3.13Å; R973-G976 WeakPolarHBondContact O-CA 3.32Å; R973-G976 PolarHBondContact O-N 3.44Å; R973-G976 VanDerWaalsContact O-N 3.12Å; N974-G976 VanDerWaalsContact C-N 3.3Å; N974-G976 PolarHBondContact O-N 3.07Å
977	V	73.6	Confident	80.5	Confident	10.75 Å²	10.75	49.7 Å²	49.7	7%	0.065	26%	0.255	C	S	.	.			trans	-74.9	150.7	177.6	-118.9	0	0	0	0	111.8	Y901 I929 I933 V935 I972 D975 V979	Y901-V977 HydrophobicContact CE2-CG1 4.44Å; Y901-V977 HydrophobicContact CE2-CG2 4.23Å; Y901-V977 WeakPolarHBondContact OH-CG1 3.25Å; Y901-V977 WeakPolarHBondContact OH-CG2 3.41Å; I929-V977 HydrophobicContact CB-CG1 4.43Å; I929-V977 HydrophobicContact CG2-CG1 3.47Å; I929-V977 VanDerWaalsContact CG2-CG1 3.42Å; I929-V977 HydrophobicContact CG2-CG2 3.73Å; I933-V977 HydrophobicContact CB-CB 4.43Å; I933-V977 HydrophobicContact CB-CG1 3.92Å; I933-V977 HydrophobicContact CG2-CB 4.13Å; I933-V977 HydrophobicContact CG2-CG1 3.76Å; I933-V977 HydrophobicContact CG2-CG2 4.37Å; I933-V977 WeakPolarHBondContact O-CG1 3.32Å; V935-V977 HydrophobicContact CB-CG1 4.48Å; V935-V977 HydrophobicContact CG2-CB 4.42Å; V935-V977 HydrophobicContact CG2-CG1 3.67Å; V935-V977 HydrophobicContact CG2-CG2 3.83Å; V935-V977 PolarHBondContact N-O 3.45Å; V935-V977 VanDerWaalsContact N-O 3.09Å; I972-V977 HydrophobicContact CB-CG2 4.47Å; I972-V977 HydrophobicContact CG2-CG2 3.63Å; I972-V977 VanDerWaalsContact CG2-CG2 3.48Å; D975-V977 VanDerWaalsContact C-N 3.3Å; D975-V977 HydrophobicContact CB-CG1 4.39Å; D975-V977 HydrophobicContact CB-CG2 4.11Å; D975-V977 PolarHBondContact O-N 3.19Å; V977-V979 HydrophobicContact CG2-CG2 3.62Å; V977-V979 PolarHBondContact O-N 3.31Å; V977-V979 VanDerWaalsContact O-N 3.16Å
978	I	69.1	Low	80.2	Confident	42 Å²	42	52.7 Å²	52.7	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	110.7	172.3	-56.7	178.9	0	0	0	108.1	R930 I933 C934 V935 I937 I972 R973 Y981 T1010 L1014	R930-I978 HydrophobicContact CB-CG1 4.41Å; R930-I978 HydrophobicContact CG-CG1 4.47Å; R930-I978 VanDerWaalsContact O-CD1 3.29Å; R930-I978 WeakPolarHBondContact O-CD1 3.29Å; I933-I978 PolarHBondContact O-N 3.11Å; C934-I978 CarbonylContact C-O 3.55Å; C934-I978 VanDerWaalsContact CA-O 3.31Å; C934-I978 WeakPolarHBondContact CA-O 3.24Å; C934-I978 HydrophobicContact CB-CB 4.42Å; V935-I978 PolarHBondContact N-O 2.99Å; I937-I978 HydrophobicContact CD1-CD1 3.88Å; I937-I978 HydrophobicContact CD1-CG1 4.33Å; I937-I978 HydrophobicContact CD1-CG2 4.48Å; I972-I978 HydrophobicContact CG2-CD1 4.16Å; I972-I978 HydrophobicContact CG2-CG1 3.55Å; R973-I978 HydrophobicContact CB-CD1 3.72Å; R973-I978 HydrophobicContact CG-CD1 4.14Å; I978-Y981 HydrophobicContact CD1-CD2 4.01Å; I978-Y981 HydrophobicContact CD1-CE2 4.35Å; I978-Y981 HydrophobicContact CG2-CD2 4.04Å; I978-Y981 HydrophobicContact CG2-CG 4.5Å; I978-T1010 HydrophobicContact CD1-CG2 4.49Å; I978-T1010 HydrophobicContact CG2-CG2 3.84Å; I978-L1014 HydrophobicContact CD1-CD2 3.84Å; I978-L1014 HydrophobicContact CD1-CG 4.32Å
979	V	68.9	Low	79.8	Confident	31.5 Å²	31.5	53.7 Å²	53.7	19%	0.191	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	110.9	176.9	-176.5	0	0	0	0	109.1	C934 V935 F936 I937 I972 V977 Y981 T1010	C934-V979 HydrophobicContact CB-CG2 3.69Å; V935-V979 HydrophobicContact CB-CG1 4.1Å; V935-V979 HydrophobicContact CB-CG2 4.32Å; V935-V979 HydrophobicContact CG1-CG1 4.37Å; V935-V979 HydrophobicContact CG2-CG2 4.48Å; V935-V979 CarbonylContact O-C 3.56Å; V935-V979 VanDerWaalsContact O-CA 3.31Å; V935-V979 WeakPolarHBondContact O-CA 3.18Å; V935-V979 PolarHBondContact O-N 3.15Å; F936-V979 HydrophobicContact CD1-CG1 4.5Å; F936-V979 HydrophobicContact CE1-CB 4.05Å; F936-V979 HydrophobicContact CE1-CG1 3.68Å; F936-V979 HydrophobicContact CZ-CB 4.13Å; F936-V979 HydrophobicContact CZ-CG1 3.88Å; I937-V979 HydrophobicContact CD1-CG1 3.84Å; I937-V979 HydrophobicContact CG1-CG1 4.3Å; I972-V979 HydrophobicContact CG2-CG2 3.83Å; V977-V979 HydrophobicContact CG2-CG2 3.62Å; V977-V979 PolarHBondContact O-N 3.31Å; V977-V979 VanDerWaalsContact O-N 3.16Å; V979-Y981 HydrophobicContact CB-CD2 4.13Å; V979-Y981 HydrophobicContact CB-CE1 4.29Å; V979-Y981 HydrophobicContact CB-CE2 3.47Å; V979-Y981 VanDerWaalsContact CB-CE2 3.47Å; V979-Y981 WeakPolarHBondContact CB-OH 3.27Å; V979-Y981 HydrophobicContact CG1-CD1 3.97Å; V979-Y981 HydrophobicContact CG1-CD2 3.85Å; V979-Y981 HydrophobicContact CG1-CE1 3.67Å; V979-Y981 HydrophobicContact CG1-CE2 3.43Å; V979-Y981 VanDerWaalsContact CG1-CE2 3.43Å; V979-Y981 HydrophobicContact CG1-CG 4.07Å; V979-Y981 WeakPolarHBondContact CG1-OH 3.4Å; V979-Y981 HydrophobicContact CG2-CE2 4.3Å; V979-Y981 WeakPolarHBondContact CG2-OH 3.5Å; V979-Y981 WeakPolarHBondContact O-CE2 2.82Å; V979-T1010 HydrophobicContact CB-CG2 4.41Å; V979-T1010 HydrophobicContact CG1-CG2 3.74Å; V979-T1010 WeakPolarHBondContact CG1-OG1 3.12Å; V979-T1010 HydrophobicContact CG2-CG2 3.77Å
980	S	70.7	Confident	79.3	Confident	16 Å²	16	57.7 Å²	57.7	11%	0.112	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	118.4	168.9	-158.1	0	0	0	0	108.6	V935 F936 I937 Q1006	V935-S980 PolarHBondContact O-N 3Å; F936-S980 VanDerWaalsContact CD1-CB 3.47Å; I937-S980 PolarHBondContact N-O 3.23Å; S980-Q1006 WeakPolarHBondContact OG-CB 3.31Å; S980-Q1006 PolarHBondContact OG-OE1 3.1Å
981	Y	69.8	Low	78.3	Confident	128.75 Å²	128.75	56.8 Å²	56.8	51%	0.505	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	131.4	-177.7	-82.9	-85.3	0	0	0	110.4	I937 R973 I978 V979 Y983	I937-Y981 HydrophobicContact CB-CD1 4.37Å; I937-Y981 HydrophobicContact CB-CD2 4.45Å; I937-Y981 HydrophobicContact CD1-CD1 3.62Å; I937-Y981 HydrophobicContact CD1-CD2 3.94Å; I937-Y981 HydrophobicContact CD1-CE1 3.36Å; I937-Y981 HydrophobicContact CD1-CE2 3.99Å; I937-Y981 HydrophobicContact CG1-CD1 4.5Å; R973-Y981 WeakPolarHBondContact CA-OH 3.31Å; R973-Y981 HydrophobicContact CG-CE1 3.73Å; R973-Y981 VanDerWaalsContact CG-CZ 3.47Å; R973-Y981 WeakPolarHBondContact CG-OH 3.28Å; I978-Y981 HydrophobicContact CD1-CD2 4.01Å; I978-Y981 HydrophobicContact CD1-CE2 4.35Å; I978-Y981 HydrophobicContact CG2-CD2 4.04Å; I978-Y981 HydrophobicContact CG2-CG 4.5Å; V979-Y981 HydrophobicContact CB-CD2 4.13Å; V979-Y981 HydrophobicContact CB-CE1 4.29Å; V979-Y981 HydrophobicContact CB-CE2 3.47Å; V979-Y981 VanDerWaalsContact CB-CE2 3.47Å; V979-Y981 WeakPolarHBondContact CB-OH 3.27Å; V979-Y981 HydrophobicContact CG1-CD1 3.97Å; V979-Y981 HydrophobicContact CG1-CD2 3.85Å; V979-Y981 HydrophobicContact CG1-CE1 3.67Å; V979-Y981 HydrophobicContact CG1-CE2 3.43Å; V979-Y981 VanDerWaalsContact CG1-CE2 3.43Å; V979-Y981 HydrophobicContact CG1-CG 4.07Å; V979-Y981 WeakPolarHBondContact CG1-OH 3.4Å; V979-Y981 HydrophobicContact CG2-CE2 4.3Å; V979-Y981 WeakPolarHBondContact CG2-OH 3.5Å; V979-Y981 WeakPolarHBondContact O-CE2 2.82Å; Y981-Y983 PolarHBondContact O-N 2.96Å; Y981-Y983 VanDerWaalsContact O-N 3.17Å
982	N	75.8	Confident	77.1	Confident	76.75 Å²	76.75	59.9 Å²	59.9	41%	0.41	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	52	53.4	161.7	-57.5	-4.5	0	0	0	114.9	I937 D939	I937-N982 VanDerWaalsContact O-CA 3.3Å; I937-N982 WeakPolarHBondContact O-CA 3.32Å; I937-N982 PolarHBondContact O-N 3.16Å; D939-N982 HydrophobicContact CB-CB 3.93Å
983	Y	86.9	Confident	76.2	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	140.9	167.5	66	-92.9	0	0	0	109.7	M798 E801 F936 I937 R938 D939 Y981 L1000 F1003	M798-Y983 WeakPolarHBondContact CE-OH 3.28Å; E801-Y983 HydrophobicContact CG-CE2 4.29Å; E801-Y983 WeakPolarHBondContact CG-OH 3.37Å; E801-Y983 PolarHBondContact OE1-OH 3.49Å; F936-Y983 HydrophobicContact CB-CD1 4.45Å; F936-Y983 HydrophobicContact CB-CE1 3.99Å; I937-Y983 VanDerWaalsContact O-CD1 3.3Å; I937-Y983 WeakPolarHBondContact O-CD1 3.31Å; I937-Y983 WeakPolarHBondContact O-CE1 3.41Å; I937-Y983 PolarHBondContact O-N 3.07Å; R938-Y983 HydrophobicContact CB-CE1 4.16Å; R938-Y983 HydrophobicContact CB-CE2 3.99Å; R938-Y983 HydrophobicContact CG-CD2 4.48Å; R938-Y983 HydrophobicContact CG-CE2 3.95Å; D939-Y983 WeakPolarHBondContact CB-O 3.29Å; D939-Y983 PolarHBondContact N-O 3.36Å; Y981-Y983 PolarHBondContact O-N 2.96Å; Y981-Y983 VanDerWaalsContact O-N 3.17Å; Y983-L1000 HydrophobicContact CD2-CD2 4.34Å; Y983-L1000 HydrophobicContact CE2-CD2 4.08Å; Y983-F1003 HydrophobicContact CD1-CB 4.29Å; Y983-F1003 AromaticContact CD1-CD2 3.89Å; Y983-F1003 HydrophobicContact CD1-CD2 4.02Å; Y983-F1003 HydrophobicContact CD1-CG 4.37Å; Y983-F1003 HydrophobicContact CD2-CB 3.62Å; Y983-F1003 HydrophobicContact CD2-CD2 4.41Å; Y983-F1003 HydrophobicContact CD2-CG 4.3Å; Y983-F1003 AromaticContact CE1-CD2 3.78Å; Y983-F1003 HydrophobicContact CE1-CD2 3.78Å; Y983-F1003 HydrophobicContact CE1-CE2 4.38Å; Y983-F1003 HydrophobicContact CE1-CG 4.39Å; Y983-F1003 HydrophobicContact CE2-CB 3.95Å; Y983-F1003 HydrophobicContact CE2-CD2 4.23Å; Y983-F1003 HydrophobicContact CE2-CG 4.16Å; Y983-F1003 HydrophobicContact CG-CB 3.84Å; Y983-F1003 HydrophobicContact CG-CD2 4.35Å; Y983-F1003 HydrophobicContact CG-CG 4.38Å; Y983-F1003 AromaticContact CZ-CD2 3.88Å
984	S	83.5	Confident	75.6	Confident	45.25 Å²	45.25	66.1 Å²	66.1	32%	0.316	35%	0.345	S	S	.	.			trans	-77.3	142.2	178.3	60.5	0	0	0	0	111.5	E1002	S984-E1002 PolarHBondContact N-OE2 3.15Å; S984-E1002 VanDerWaalsContact N-OE2 3.14Å; S984-E1002 PolarHBondContact OG-OE2 3.22Å
985	A	85.7	Confident	75.7	Confident	3.25 Å²	3.25	59.9 Å²	59.9	3%	0.027	31%	0.312	C	S	.	.			trans	-137.6	151.3	169.5	0	0	0	0	0	109.2	R938 S942 M997 L1000	R938-A985 HydrophobicContact CG-CB 4.22Å; S942-A985 WeakPolarHBondContact CA-O 3.19Å; S942-A985 WeakPolarHBondContact CB-O 3.32Å; S942-A985 PolarHBondContact OG-N 3.15Å; S942-A985 VanDerWaalsContact OG-N 3.09Å; S942-A985 PolarHBondContact OG-O 3.21Å; A985-M997 HydrophobicContact CB-CB 4.28Å; A985-M997 HydrophobicContact CB-CE 3.66Å; A985-L1000 HydrophobicContact CB-CD2 3.82Å
986	Q	84.7	Confident	75.9	Confident	101.75 Å²	101.75	60.2 Å²	60.2	48%	0.475	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	140.7	179.3	-67.2	-178.3	-1.3	0	0	110.4	N988 M997 G998 N999	Q986-N988 PolarHBondContact O-N 3.29Å; Q986-M997 CarbonylContact O-C 3.52Å; Q986-M997 WeakPolarHBondContact O-CA 3.47Å; Q986-G998 PolarHBondContact N-O 3.09Å; Q986-G998 PolarHBondContact O-N 3.02Å; Q986-N999 HydrophobicContact CB-CB 4.21Å; Q986-N999 HydrophobicContact CG-CB 4.2Å
987	F	85.4	Confident	76.7	Confident	47.5 Å²	47.5	59.6 Å²	59.6	21%	0.208	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	123.6	174.5	-179.5	-112.7	0	0	0	110.8	V946 P947 L950 G989 P995 M997	V946-F987 HydrophobicContact CG2-CB 4.02Å; V946-F987 HydrophobicContact CG2-CD2 4.37Å; V946-F987 HydrophobicContact CG2-CG 4.39Å; P947-F987 HydrophobicContact CG-CD1 4.41Å; P947-F987 HydrophobicContact CG-CE1 4Å; P947-F987 HydrophobicContact CG-CZ 4.45Å; L950-F987 HydrophobicContact CD1-CE2 4.24Å; L950-F987 HydrophobicContact CD1-CZ 3.76Å; F987-G989 VanDerWaalsContact CE2-O 3.32Å; F987-G989 WeakPolarHBondContact CE2-O 3.44Å; F987-G989 VanDerWaalsContact CZ-CA 3.47Å; F987-P995 HydrophobicContact CE2-CB 3.73Å; F987-M997 HydrophobicContact CB-SD 4.43Å
988	N	81.7	Confident	77.1	Confident	118.75 Å²	118.75	59.5 Å²	59.5	64%	0.635	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.9	21.6	-174.1	-160.7	26.9	0	0	0	112.8	Q986 V996	Q986-N988 PolarHBondContact O-N 3.29Å; N988-V996 PolarHBondContact N-O 3.06Å
989	G	82.8	Confident	77.8	Confident	24 Å²	24	61.3 Å²	61.3	25%	0.247	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	91.3	-160.1	177.7	0	0	0	0	0	114.6	F987 V996	F987-G989 VanDerWaalsContact CE2-O 3.32Å; F987-G989 WeakPolarHBondContact CE2-O 3.44Å; F987-G989 VanDerWaalsContact CZ-CA 3.47Å; G989-V996 PolarHBondContact O-N 3.1Å
990	L	78	Confident	78.6	Confident	97 Å²	97	60.5 Å²	60.5	51%	0.508	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.4	-176.8	-68.1	154.9	0	0	0	110.1	L950 Y994 P995	L950-L990 HydrophobicContact CD1-CD1 4.4Å; L950-L990 HydrophobicContact CD1-CD2 4.09Å; L950-L990 HydrophobicContact CD1-CG 4.41Å; L950-L990 HydrophobicContact CD2-CD2 4.31Å; L990-Y994 CarbonylContact C-O 3.56Å; L990-Y994 VanDerWaalsContact CA-O 3.3Å; L990-Y994 WeakPolarHBondContact CA-O 3.28Å; L990-P995 HydrophobicContact CD2-CB 4.19Å
991	I	66.8	Low	79.2	Confident	99.75 Å²	99.75	64.6 Å²	64.6	51%	0.512	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	116.4	169.8	-57.8	-176.9	0	0	0	107.6	D993 Y994 V996	I991-D993 VanDerWaalsContact C-N 3.31Å; I991-D993 PolarHBondContact O-N 3.26Å; I991-Y994 PolarHBondContact N-O 3.11Å; I991-Y994 PolarHBondContact O-N 2.92Å; I991-Y994 VanDerWaalsContact O-N 3.08Å; I991-V996 HydrophobicContact CB-CG2 3.84Å; I991-V996 HydrophobicContact CD1-CB 4.34Å; I991-V996 HydrophobicContact CD1-CG1 4.29Å; I991-V996 HydrophobicContact CD1-CG2 3.91Å; I991-V996 HydrophobicContact CG1-CB 4.37Å; I991-V996 HydrophobicContact CG1-CG2 3.76Å
992	N	61.8	Low	79.9	Confident	121.25 Å²	121.25	62.3 Å²	62.3	65%	0.648	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	47.1	-174.9	-58.7	-35.1	0	0	0	113.1	Y994	N992-Y994 VanDerWaalsContact O-CD2 3.24Å; N992-Y994 WeakPolarHBondContact O-CD2 3.35Å; N992-Y994 PolarHBondContact O-N 3.24Å; N992-Y994 VanDerWaalsContact O-N 3.15Å
993	D	67.7	Low	80.5	Confident	140.25 Å²	140.25	58.6 Å²	58.6	75%	0.75	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	6.9	-177.5	-51.9	-38.1	0	0	0	115.8	I991	I991-D993 VanDerWaalsContact C-N 3.31Å; I991-D993 PolarHBondContact O-N 3.26Å
994	Y	71.4	Confident	80.5	Confident	118.25 Å²	118.25	58.8 Å²	58.8	46%	0.464	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	132.5	171.9	-74.9	-85.8	0	0	0	111.4	Y953 L990 I991 N992 V996	Y953-Y994 HydrophobicContact CE1-CD1 4.32Å; Y953-Y994 HydrophobicContact CE1-CE1 4.42Å; L990-Y994 CarbonylContact C-O 3.56Å; L990-Y994 VanDerWaalsContact CA-O 3.3Å; L990-Y994 WeakPolarHBondContact CA-O 3.28Å; I991-Y994 PolarHBondContact N-O 3.11Å; I991-Y994 PolarHBondContact O-N 2.92Å; I991-Y994 VanDerWaalsContact O-N 3.08Å; N992-Y994 VanDerWaalsContact O-CD2 3.24Å; N992-Y994 WeakPolarHBondContact O-CD2 3.35Å; N992-Y994 PolarHBondContact O-N 3.24Å; N992-Y994 VanDerWaalsContact O-N 3.15Å; Y994-V996 WeakPolarHBondContact O-CG2 3.38Å
995	P	80.5	Confident	80.5	Confident	2 Å²	2	60 Å²	60	1%	0.013	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	130.1	179.8	29.8	-33.7	0	0	0	110.9	H799 L950 Y953 F954 F987 L990	H799-P995 PolarHBondContact CE1-O 3Å; H799-P995 PolarHBondContact NE2-O 3.15Å; H799-P995 VanDerWaalsContact NE2-O 3.08Å; L950-P995 HydrophobicContact CB-CB 4.42Å; L950-P995 HydrophobicContact CD1-CB 4.31Å; Y953-P995 HydrophobicContact CD1-CG 3.96Å; Y953-P995 HydrophobicContact CD2-CG 3.75Å; Y953-P995 HydrophobicContact CE1-CG 4.33Å; Y953-P995 HydrophobicContact CE2-CG 4.35Å; Y953-P995 HydrophobicContact CG-CG 3.52Å; Y953-P995 VanDerWaalsContact CG-CG 3.48Å; F954-P995 HydrophobicContact CE2-CB 3.7Å; F954-P995 HydrophobicContact CE2-CG 3.79Å; F954-P995 HydrophobicContact CZ-CB 3.82Å; F954-P995 HydrophobicContact CZ-CG 3.93Å; F954-P995 WeakPolarHBondContact CZ-O 3.4Å; F987-P995 HydrophobicContact CE2-CB 3.73Å; L990-P995 HydrophobicContact CD2-CB 4.19Å
996	V	80.9	Confident	80.5	Confident	21.75 Å²	21.75	62.2 Å²	62.2	13%	0.132	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	139.4	-172.7	-174.5	0	0	0	0	111.4	H799 A800 N988 G989 I991 Y994	H799-V996 WeakPolarHBondContact NE2-CA 3.24Å; A800-V996 HydrophobicContact CB-CG1 3.71Å; N988-V996 PolarHBondContact N-O 3.06Å; G989-V996 PolarHBondContact O-N 3.1Å; I991-V996 HydrophobicContact CB-CG2 3.84Å; I991-V996 HydrophobicContact CD1-CB 4.34Å; I991-V996 HydrophobicContact CD1-CG1 4.29Å; I991-V996 HydrophobicContact CD1-CG2 3.91Å; I991-V996 HydrophobicContact CG1-CB 4.37Å; I991-V996 HydrophobicContact CG1-CG2 3.76Å; Y994-V996 WeakPolarHBondContact O-CG2 3.38Å
997	M	84.3	Confident	80.8	Confident	4.75 Å²	4.75	57.4 Å²	57.4	2%	0.023	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	142.7	170.4	-64.1	-60.7	-137.8	0	0	111	A800 M943 V946 F954 A985 Q986 F987	A800-M997 HydrophobicContact CB-CB 4.26Å; A800-M997 WeakPolarHBondContact CB-O 3.2Å; M943-M997 HydrophobicContact CE-CE 3.6Å; M943-M997 HydrophobicContact CE-SD 4.27Å; M943-M997 HydrophobicContact SD-CE 4.01Å; V946-M997 HydrophobicContact CG2-CE 3.83Å; V946-M997 HydrophobicContact CG2-SD 4.45Å; F954-M997 HydrophobicContact CD1-CE 3.75Å; F954-M997 HydrophobicContact CD1-CG 4.42Å; F954-M997 HydrophobicContact CD1-SD 4.38Å; F954-M997 HydrophobicContact CD2-CE 4.26Å; F954-M997 HydrophobicContact CE1-CE 3.98Å; F954-M997 HydrophobicContact CE1-CG 3.76Å; F954-M997 HydrophobicContact CE1-SD 4.25Å; F954-M997 HydrophobicContact CE2-CE 4.23Å; F954-M997 HydrophobicContact CG-CE 4.02Å; F954-M997 HydrophobicContact CZ-CE 3.97Å; F954-M997 HydrophobicContact CZ-CG 4.21Å; F954-M997 HydrophobicContact CZ-SD 4.31Å; A985-M997 HydrophobicContact CB-CB 4.28Å; A985-M997 HydrophobicContact CB-CE 3.66Å; Q986-M997 CarbonylContact O-C 3.52Å; Q986-M997 WeakPolarHBondContact O-CA 3.47Å; F987-M997 HydrophobicContact CB-SD 4.43Å
998	G	83.2	Confident	80.8	Confident	10 Å²	10	57.3 Å²	57.3	10%	0.103	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	-169	175.8	0	0	0	0	0	111.8	Q986 L1000	Q986-G998 PolarHBondContact N-O 3.09Å; Q986-G998 PolarHBondContact O-N 3.02Å; G998-L1000 VanDerWaalsContact C-N 3.31Å; G998-L1000 PolarHBondContact O-N 3.12Å
999	N	83.8	Confident	81	Confident	78.75 Å²	78.75	54.5 Å²	54.5	42%	0.421	30%	0.301	S	S	.	.			trans	57.9	38.1	-174.2	-157.7	43.2	0	0	0	113.5	Q986 D1001	Q986-N999 HydrophobicContact CB-CB 4.21Å; Q986-N999 HydrophobicContact CG-CB 4.2Å; N999-D1001 VanDerWaalsContact C-N 3.26Å; N999-D1001 PolarHBondContact O-N 3.09Å
1000	L	86	Confident	81.1	Confident	14.25 Å²	14.25	54.6 Å²	54.6	8%	0.075	30%	0.297	C	S	.	.			trans	-87.1	19.1	-174.4	-63.3	175.9	0	0	0	113.5	A800 E801 L804 Y983 A985 G998 E1002 F1003 G1004	A800-L1000 HydrophobicContact CB-CD1 4.01Å; E801-L1000 HydrophobicContact CG-CD1 4.02Å; E801-L1000 HydrophobicContact CG-CD2 4.03Å; L804-L1000 HydrophobicContact CD2-CB 3.64Å; L804-L1000 HydrophobicContact CD2-CD1 4.23Å; L804-L1000 HydrophobicContact CD2-CG 4.47Å; Y983-L1000 HydrophobicContact CD2-CD2 4.34Å; Y983-L1000 HydrophobicContact CE2-CD2 4.08Å; A985-L1000 HydrophobicContact CB-CD2 3.82Å; G998-L1000 VanDerWaalsContact C-N 3.31Å; G998-L1000 PolarHBondContact O-N 3.12Å; L1000-E1002 VanDerWaalsContact C-N 3.32Å; L1000-E1002 PolarHBondContact O-N 3.21Å; L1000-F1003 HydrophobicContact CB-CB 4.48Å; L1000-F1003 HydrophobicContact CB-CD1 4.46Å; L1000-F1003 WeakPolarHBondContact O-CB 3.24Å; L1000-F1003 PolarHBondContact O-N 3.22Å; L1000-G1004 PolarHBondContact O-N 3.21Å
1001	D	82.1	Confident	81.5	Confident	103.2 Å²	103.2	50 Å²	50	55%	0.552	27%	0.273	S	S	*	.	H	α-helix	trans	-65	-39	-175.3	-62.4	-40.6	0	0	0	111.8	N999 G1004 S1005	N999-D1001 VanDerWaalsContact C-N 3.26Å; N999-D1001 PolarHBondContact O-N 3.09Å; D1001-G1004 PolarHBondContact O-N 3.25Å; D1001-S1005 WeakPolarHBondContact O-CB 3.38Å; D1001-S1005 PolarHBondContact O-N 3.12Å; D1001-S1005 PolarHBondContact O-OG 3.11Å
1002	E	84.8	Confident	82.4	Confident	78.8 Å²	78.8	50.1 Å²	50.1	37%	0.368	27%	0.27	S	S	.	.	H	α-helix	trans	-61.2	-49.6	174.9	-175	-176.2	-175.8	0	0	111	S984 L1000 G1004 S1005 Q1006	S984-E1002 PolarHBondContact N-OE2 3.15Å; S984-E1002 VanDerWaalsContact N-OE2 3.14Å; S984-E1002 PolarHBondContact OG-OE2 3.22Å; L1000-E1002 VanDerWaalsContact C-N 3.32Å; L1000-E1002 PolarHBondContact O-N 3.21Å; E1002-G1004 VanDerWaalsContact C-N 3.33Å; E1002-G1004 PolarHBondContact O-N 3.32Å; E1002-S1005 PolarHBondContact O-N 2.83Å; E1002-S1005 PolarHBondContact O-OG 3.08Å; E1002-Q1006 WeakPolarHBondContact O-CB 3.39Å; E1002-Q1006 VanDerWaalsContact O-CG 3.25Å; E1002-Q1006 WeakPolarHBondContact O-CG 3.32Å; E1002-Q1006 PolarHBondContact O-N 3.12Å; E1002-Q1006 PolarHBondContact OE1-NE2 3.18Å
1003	F	88.6	Confident	83.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-57.7	-47	175.3	166.6	-107.1	0	0	0	111.6	E801 L804 L805 L809 L861 F936 Y983 L1000 S1005 Q1006 F1007	E801-F1003 HydrophobicContact CB-CD1 4.41Å; E801-F1003 HydrophobicContact CB-CE1 3.92Å; E801-F1003 HydrophobicContact CB-CZ 4.17Å; E801-F1003 HydrophobicContact CG-CD1 4.34Å; E801-F1003 HydrophobicContact CG-CE1 4.32Å; L804-F1003 HydrophobicContact CD2-CD1 3.98Å; L804-F1003 HydrophobicContact CD2-CE1 4.35Å; L805-F1003 HydrophobicContact CD1-CZ 4.08Å; L805-F1003 HydrophobicContact CD2-CE1 4.12Å; L805-F1003 HydrophobicContact CD2-CZ 3.9Å; L805-F1003 HydrophobicContact CG-CE1 4.06Å; L805-F1003 HydrophobicContact CG-CZ 3.93Å; L809-F1003 HydrophobicContact CD1-CD1 4.4Å; L809-F1003 HydrophobicContact CD1-CE1 4.14Å; L861-F1003 HydrophobicContact CD1-CZ 4.49Å; L861-F1003 HydrophobicContact CD2-CE2 3.76Å; L861-F1003 HydrophobicContact CD2-CZ 3.84Å; F936-F1003 HydrophobicContact CB-CD2 4.21Å; F936-F1003 HydrophobicContact CB-CE2 3.84Å; F936-F1003 AromaticContact CD1-CD2 3.93Å; F936-F1003 HydrophobicContact CD1-CD2 4.04Å; F936-F1003 AromaticContact CD1-CE2 3.93Å; F936-F1003 HydrophobicContact CD1-CE2 3.97Å; F936-F1003 HydrophobicContact CD2-CE2 4.35Å; F936-F1003 HydrophobicContact CG-CD2 4.24Å; F936-F1003 AromaticContact CG-CE2 3.79Å; F936-F1003 HydrophobicContact CG-CE2 3.79Å; Y983-F1003 HydrophobicContact CD1-CB 4.29Å; Y983-F1003 AromaticContact CD1-CD2 3.89Å; Y983-F1003 HydrophobicContact CD1-CD2 4.02Å; Y983-F1003 HydrophobicContact CD1-CG 4.37Å; Y983-F1003 HydrophobicContact CD2-CB 3.62Å; Y983-F1003 HydrophobicContact CD2-CD2 4.41Å; Y983-F1003 HydrophobicContact CD2-CG 4.3Å; Y983-F1003 AromaticContact CE1-CD2 3.78Å; Y983-F1003 HydrophobicContact CE1-CD2 3.78Å; Y983-F1003 HydrophobicContact CE1-CE2 4.38Å; Y983-F1003 HydrophobicContact CE1-CG 4.39Å; Y983-F1003 HydrophobicContact CE2-CB 3.95Å; Y983-F1003 HydrophobicContact CE2-CD2 4.23Å; Y983-F1003 HydrophobicContact CE2-CG 4.16Å; Y983-F1003 HydrophobicContact CG-CB 3.84Å; Y983-F1003 HydrophobicContact CG-CD2 4.35Å; Y983-F1003 HydrophobicContact CG-CG 4.38Å; Y983-F1003 AromaticContact CZ-CD2 3.88Å; L1000-F1003 HydrophobicContact CB-CB 4.48Å; L1000-F1003 HydrophobicContact CB-CD1 4.46Å; L1000-F1003 WeakPolarHBondContact O-CB 3.24Å; L1000-F1003 PolarHBondContact O-N 3.22Å; F1003-S1005 PolarHBondContact O-N 3.22Å; F1003-Q1006 PolarHBondContact O-N 3.04Å; F1003-F1007 VanDerWaalsContact O-CB 3.27Å; F1003-F1007 WeakPolarHBondContact O-CB 3.39Å; F1003-F1007 PolarHBondContact O-N 2.93Å
1004	G	86	Confident	84.2	Confident	5 Å²	5	40 Å²	40	5%	0.052	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-43.7	-179.7	0	0	0	0	0	113	L1000 D1001 E1002 F1007 L1008	L1000-G1004 PolarHBondContact O-N 3.21Å; D1001-G1004 PolarHBondContact O-N 3.25Å; E1002-G1004 VanDerWaalsContact C-N 3.33Å; E1002-G1004 PolarHBondContact O-N 3.32Å; G1004-F1007 PolarHBondContact O-N 3.32Å; G1004-L1008 WeakPolarHBondContact O-CB 3.39Å; G1004-L1008 VanDerWaalsContact O-CG 3.3Å; G1004-L1008 WeakPolarHBondContact O-CG 3.49Å; G1004-L1008 PolarHBondContact O-N 3.12Å; G1004-L1008 VanDerWaalsContact O-N 3.12Å
1005	S	84.7	Confident	84.8	Confident	70.4 Å²	70.4	34.4 Å²	34.4	49%	0.492	20%	0.198	S	C	.	.	H	α-helix	trans	-64.9	-45.6	177.7	-46.3	0	0	0	0	112	D1001 E1002 F1003 F1007 L1008 A1009	D1001-S1005 WeakPolarHBondContact O-CB 3.38Å; D1001-S1005 PolarHBondContact O-N 3.12Å; D1001-S1005 PolarHBondContact O-OG 3.11Å; E1002-S1005 PolarHBondContact O-N 2.83Å; E1002-S1005 PolarHBondContact O-OG 3.08Å; F1003-S1005 PolarHBondContact O-N 3.22Å; S1005-F1007 PolarHBondContact O-N 2.86Å; S1005-L1008 PolarHBondContact O-N 3.33Å; S1005-A1009 WeakPolarHBondContact O-CB 3.29Å; S1005-A1009 PolarHBondContact O-N 3.18Å; S1005-A1009 VanDerWaalsContact O-N 3.13Å
1006	Q	86.2	Confident	84.8	Confident	49 Å²	49	37.4 Å²	37.4	23%	0.229	21%	0.213	C	C	.	.	H	α-helix	trans	-64.8	-41.4	177.8	-71.6	175.3	3.1	0	0	112	F936 S980 E1002 F1003 T1010	F936-Q1006 HydrophobicContact CE1-CB 4.3Å; S980-Q1006 WeakPolarHBondContact OG-CB 3.31Å; S980-Q1006 PolarHBondContact OG-OE1 3.1Å; E1002-Q1006 WeakPolarHBondContact O-CB 3.39Å; E1002-Q1006 VanDerWaalsContact O-CG 3.25Å; E1002-Q1006 WeakPolarHBondContact O-CG 3.32Å; E1002-Q1006 PolarHBondContact O-N 3.12Å; E1002-Q1006 PolarHBondContact OE1-NE2 3.18Å; F1003-Q1006 PolarHBondContact O-N 3.04Å; Q1006-T1010 VanDerWaalsContact O-CB 3.28Å; Q1006-T1010 WeakPolarHBondContact O-CB 3.31Å; Q1006-T1010 PolarHBondContact O-N 3.15Å; Q1006-T1010 PolarHBondContact O-OG1 3.13Å
1007	F	89.5	Confident	84.7	Confident	1 Å²	1	42 Å²	42	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-61.1	-50.4	176.3	174.9	-94.9	0	0	0	111.7	L789 L805 L809 V810 L813 V859 F936 F1003 G1004 S1005 A1009 T1010 V1011	L789-F1007 HydrophobicContact CD2-CZ 4.27Å; L805-F1007 HydrophobicContact CD1-CE2 4.28Å; L805-F1007 HydrophobicContact CD2-CB 4.39Å; L805-F1007 HydrophobicContact CD2-CD1 3.43Å; L805-F1007 VanDerWaalsContact CD2-CD1 3.46Å; L805-F1007 HydrophobicContact CD2-CD2 3.44Å; L805-F1007 VanDerWaalsContact CD2-CD2 3.46Å; L805-F1007 HydrophobicContact CD2-CE1 3.37Å; L805-F1007 HydrophobicContact CD2-CE2 3.4Å; L805-F1007 VanDerWaalsContact CD2-CE2 3.44Å; L805-F1007 HydrophobicContact CD2-CG 3.47Å; L805-F1007 VanDerWaalsContact CD2-CG 3.45Å; L805-F1007 HydrophobicContact CD2-CZ 3.37Å; L805-F1007 VanDerWaalsContact CD2-CZ 3.41Å; L809-F1007 HydrophobicContact CB-CD1 3.89Å; L809-F1007 HydrophobicContact CB-CE1 3.97Å; L809-F1007 HydrophobicContact CD1-CB 4.42Å; L809-F1007 HydrophobicContact CD1-CD1 3.97Å; L809-F1007 HydrophobicContact CD1-CG 4.42Å; L809-F1007 HydrophobicContact CG-CD1 4.39Å; V810-F1007 HydrophobicContact CG2-CE1 4.18Å; V810-F1007 HydrophobicContact CG2-CZ 4.06Å; L813-F1007 HydrophobicContact CD1-CD1 4.18Å; L813-F1007 HydrophobicContact CD1-CE1 3.41Å; L813-F1007 VanDerWaalsContact CD1-CE1 3.42Å; L813-F1007 HydrophobicContact CD1-CZ 4.01Å; L813-F1007 HydrophobicContact CG-CE1 4.38Å; V859-F1007 HydrophobicContact CG1-CD2 4.44Å; V859-F1007 HydrophobicContact CG1-CE2 4.01Å; V859-F1007 HydrophobicContact CG2-CE2 4.04Å; F936-F1007 HydrophobicContact CD2-CD2 4.5Å; F936-F1007 HydrophobicContact CE1-CB 4.13Å; F936-F1007 AromaticContact CE2-CD2 3.77Å; F936-F1007 HydrophobicContact CE2-CD2 3.77Å; F936-F1007 HydrophobicContact CE2-CE2 4.46Å; F936-F1007 HydrophobicContact CZ-CB 4.05Å; F936-F1007 AromaticContact CZ-CD2 3.84Å; F936-F1007 HydrophobicContact CZ-CD2 3.84Å; F936-F1007 HydrophobicContact CZ-CG 4.42Å; F1003-F1007 VanDerWaalsContact O-CB 3.27Å; F1003-F1007 WeakPolarHBondContact O-CB 3.39Å; F1003-F1007 PolarHBondContact O-N 2.93Å; G1004-F1007 PolarHBondContact O-N 3.32Å; S1005-F1007 PolarHBondContact O-N 2.86Å; F1007-A1009 PolarHBondContact O-N 3.13Å; F1007-T1010 PolarHBondContact O-N 3.03Å; F1007-V1011 HydrophobicContact CD1-CG2 4.48Å; F1007-V1011 HydrophobicContact CD2-CG2 3.96Å; F1007-V1011 HydrophobicContact CE1-CG2 4.26Å; F1007-V1011 HydrophobicContact CE2-CG2 3.54Å; F1007-V1011 VanDerWaalsContact CE2-CG2 3.5Å; F1007-V1011 HydrophobicContact CG-CG2 4.44Å; F1007-V1011 HydrophobicContact CZ-CB 4.41Å; F1007-V1011 HydrophobicContact CZ-CG2 3.71Å; F1007-V1011 WeakPolarHBondContact O-CB 3.48Å; F1007-V1011 WeakPolarHBondContact O-CG2 3.18Å; F1007-V1011 PolarHBondContact O-N 3.09Å
1008	L	85.4	Confident	84.4	Confident	44.4 Å²	44.4	43.8 Å²	43.8	23%	0.232	24%	0.238	C	C	.	.	H	α-helix	trans	-60.3	-47.2	180	-106.7	169	0	0	0	111.3	L809 A812 L813 G1004 S1005 T1010 K1012	L809-L1008 HydrophobicContact CB-CD2 4.22Å; L809-L1008 HydrophobicContact CD2-CD1 4.01Å; L809-L1008 HydrophobicContact CD2-CD2 4.3Å; L809-L1008 HydrophobicContact CD2-CG 3.95Å; A812-L1008 HydrophobicContact CB-CD2 4.3Å; L813-L1008 HydrophobicContact CD1-CD2 4.15Å; L813-L1008 HydrophobicContact CD2-CD2 3.99Å; L813-L1008 HydrophobicContact CD2-CG 3.92Å; L813-L1008 HydrophobicContact CG-CD2 3.59Å; L813-L1008 VanDerWaalsContact CG-CD2 3.47Å; L813-L1008 HydrophobicContact CG-CG 4.24Å; G1004-L1008 WeakPolarHBondContact O-CB 3.39Å; G1004-L1008 VanDerWaalsContact O-CG 3.3Å; G1004-L1008 WeakPolarHBondContact O-CG 3.49Å; G1004-L1008 PolarHBondContact O-N 3.12Å; G1004-L1008 VanDerWaalsContact O-N 3.12Å; S1005-L1008 PolarHBondContact O-N 3.33Å; L1008-T1010 VanDerWaalsContact C-N 3.32Å; L1008-T1010 PolarHBondContact O-N 3.11Å; L1008-K1012 WeakPolarHBondContact O-CB 3.39Å; L1008-K1012 PolarHBondContact O-N 2.92Å
1009	A	85.4	Confident	83.9	Confident	60.2 Å²	60.2	45 Å²	45	50%	0.498	24%	0.24	S	C	.	.	H	α-helix	trans	-60.5	-44.7	178.4	0	0	0	0	0	112.1	S1005 F1007 S1013	S1005-A1009 WeakPolarHBondContact O-CB 3.29Å; S1005-A1009 PolarHBondContact O-N 3.18Å; S1005-A1009 VanDerWaalsContact O-N 3.13Å; F1007-A1009 PolarHBondContact O-N 3.13Å; A1009-S1013 VanDerWaalsContact O-CB 3.26Å; A1009-S1013 WeakPolarHBondContact O-CB 3.32Å; A1009-S1013 PolarHBondContact O-N 3.14Å
1010	T	86.5	Confident	83	Confident	25.6 Å²	25.6	46.7 Å²	46.7	16%	0.157	25%	0.245	C	C	.	.	H	α-helix	trans	-68.5	-50.6	-177	-58.2	0	0	0	0	111.9	C934 F936 I978 V979 Q1006 F1007 L1008 K1012 S1013 L1014	C934-T1010 HydrophobicContact CB-CG2 4.11Å; F936-T1010 HydrophobicContact CZ-CG2 4.3Å; I978-T1010 HydrophobicContact CD1-CG2 4.49Å; I978-T1010 HydrophobicContact CG2-CG2 3.84Å; V979-T1010 HydrophobicContact CB-CG2 4.41Å; V979-T1010 HydrophobicContact CG1-CG2 3.74Å; V979-T1010 WeakPolarHBondContact CG1-OG1 3.12Å; V979-T1010 HydrophobicContact CG2-CG2 3.77Å; Q1006-T1010 VanDerWaalsContact O-CB 3.28Å; Q1006-T1010 WeakPolarHBondContact O-CB 3.31Å; Q1006-T1010 PolarHBondContact O-N 3.15Å; Q1006-T1010 PolarHBondContact O-OG1 3.13Å; F1007-T1010 PolarHBondContact O-N 3.03Å; L1008-T1010 VanDerWaalsContact C-N 3.32Å; L1008-T1010 PolarHBondContact O-N 3.11Å; T1010-K1012 VanDerWaalsContact C-N 3.31Å; T1010-K1012 PolarHBondContact O-N 2.93Å; T1010-S1013 WeakPolarHBondContact O-CB 3.41Å; T1010-S1013 PolarHBondContact O-N 3.31Å; T1010-S1013 VanDerWaalsContact O-N 3.12Å; T1010-L1014 HydrophobicContact CG2-CD1 4.16Å; T1010-L1014 HydrophobicContact CG2-CG 4.43Å; T1010-L1014 WeakPolarHBondContact O-CG 3.42Å; T1010-L1014 PolarHBondContact O-N 3.19Å
1011	V	86.9	Confident	81.4	Confident	1.2 Å²	1.2	50.9 Å²	50.9	1%	0.007	27%	0.268	C	S	.	.	H	α-helix	trans	-69.4	-34.7	-178.9	-179.2	0	0	0	0	111.1	L789 L813 I857 F1007 S1013 L1014 L1015	L789-V1011 HydrophobicContact CD1-CG1 4.23Å; L789-V1011 HydrophobicContact CD1-CG2 4.47Å; L813-V1011 HydrophobicContact CD1-CB 3.81Å; L813-V1011 HydrophobicContact CD1-CG1 3.7Å; L813-V1011 HydrophobicContact CD1-CG2 4.24Å; L813-V1011 HydrophobicContact CD2-CB 4.24Å; L813-V1011 HydrophobicContact CD2-CG1 4.4Å; I857-V1011 HydrophobicContact CD1-CG1 4.38Å; F1007-V1011 HydrophobicContact CD1-CG2 4.48Å; F1007-V1011 HydrophobicContact CD2-CG2 3.96Å; F1007-V1011 HydrophobicContact CE1-CG2 4.26Å; F1007-V1011 HydrophobicContact CE2-CG2 3.54Å; F1007-V1011 VanDerWaalsContact CE2-CG2 3.5Å; F1007-V1011 HydrophobicContact CG-CG2 4.44Å; F1007-V1011 HydrophobicContact CZ-CB 4.41Å; F1007-V1011 HydrophobicContact CZ-CG2 3.71Å; F1007-V1011 WeakPolarHBondContact O-CB 3.48Å; F1007-V1011 WeakPolarHBondContact O-CG2 3.18Å; F1007-V1011 PolarHBondContact O-N 3.09Å; V1011-S1013 VanDerWaalsContact C-N 3.34Å; V1011-S1013 PolarHBondContact O-N 3.28Å; V1011-L1014 PolarHBondContact O-N 3.11Å; V1011-L1015 HydrophobicContact CG1-CD1 4.08Å; V1011-L1015 HydrophobicContact CG1-CG 4.24Å; V1011-L1015 WeakPolarHBondContact O-CB 3.28Å; V1011-L1015 VanDerWaalsContact O-CG 3.27Å; V1011-L1015 WeakPolarHBondContact O-CG 3.31Å; V1011-L1015 PolarHBondContact O-N 3.09Å
1012	K	84.3	Confident	79.4	Confident	101.8 Å²	101.8	52.8 Å²	52.8	44%	0.443	28%	0.278	S	S	.	.	H	α-helix	trans	-58	-48.6	170.5	179	174	-179.7	-175.6	0	111.3	L813 V817 L1008 T1010 L1014 L1015 L1016	L813-K1012 HydrophobicContact CD2-CB 4.25Å; V817-K1012 HydrophobicContact CB-CG 4.41Å; V817-K1012 HydrophobicContact CG1-CB 4.45Å; V817-K1012 HydrophobicContact CG1-CG 4.08Å; V817-K1012 HydrophobicContact CG2-CB 3.96Å; V817-K1012 HydrophobicContact CG2-CD 3.85Å; V817-K1012 HydrophobicContact CG2-CG 3.61Å; V817-K1012 VanDerWaalsContact CG2-CG 3.48Å; L1008-K1012 WeakPolarHBondContact O-CB 3.39Å; L1008-K1012 PolarHBondContact O-N 2.92Å; T1010-K1012 VanDerWaalsContact C-N 3.31Å; T1010-K1012 PolarHBondContact O-N 2.93Å; K1012-L1014 VanDerWaalsContact C-N 3.32Å; K1012-L1014 PolarHBondContact O-N 3.22Å; K1012-L1015 PolarHBondContact O-N 3.17Å; K1012-L1016 HydrophobicContact CG-CD1 4.09Å; K1012-L1016 WeakPolarHBondContact O-CB 3.45Å; K1012-L1016 VanDerWaalsContact O-CG 3.29Å; K1012-L1016 WeakPolarHBondContact O-CG 3.35Å; K1012-L1016 PolarHBondContact O-N 3.25Å; K1012-L1016 VanDerWaalsContact O-N 3.08Å
1013	S	83.4	Confident	77.2	Confident	49.6 Å²	49.6	55.8 Å²	55.8	35%	0.347	30%	0.297	S	S	.	.	H	α-helix	trans	-60.2	-40	176.2	173.7	0	0	0	0	112.6	A1009 T1010 V1011 L1016 R1017	A1009-S1013 VanDerWaalsContact O-CB 3.26Å; A1009-S1013 WeakPolarHBondContact O-CB 3.32Å; A1009-S1013 PolarHBondContact O-N 3.14Å; T1010-S1013 WeakPolarHBondContact O-CB 3.41Å; T1010-S1013 PolarHBondContact O-N 3.31Å; T1010-S1013 VanDerWaalsContact O-N 3.12Å; V1011-S1013 VanDerWaalsContact C-N 3.34Å; V1011-S1013 PolarHBondContact O-N 3.28Å; S1013-L1016 PolarHBondContact O-N 2.97Å; S1013-R1017 WeakPolarHBondContact O-CB 3.33Å; S1013-R1017 WeakPolarHBondContact O-CG 3.39Å; S1013-R1017 PolarHBondContact O-N 3.16Å; S1013-R1017 PolarHBondContact O-NE 3.28Å; S1013-R1017 PolarHBondContact OG-NE 3.14Å; S1013-R1017 PolarHBondContact OG-NH2 3.22Å; S1013-R1017 VanDerWaalsContact OG-NH2 3.09Å
1014	L	84.7	Confident	74.7	Confident	0.8 Å²	0.8	62.3 Å²	62.3	0%	0.004	33%	0.331	C	S	.	.	H	α-helix	trans	-66.6	-45.3	177.1	-72.5	169.7	0	0	0	112.3	I857 R930 L931 C934 I978 T1010 V1011 K1012 L1016 R1017 L1018	I857-L1014 HydrophobicContact CD1-CB 4.12Å; I857-L1014 HydrophobicContact CG2-CD1 4.15Å; R930-L1014 VanDerWaalsContact O-CD2 3.24Å; R930-L1014 WeakPolarHBondContact O-CD2 3.33Å; L931-L1014 WeakPolarHBondContact O-CD2 3.37Å; C934-L1014 HydrophobicContact CB-CD1 4.11Å; I978-L1014 HydrophobicContact CD1-CD2 3.84Å; I978-L1014 HydrophobicContact CD1-CG 4.32Å; T1010-L1014 HydrophobicContact CG2-CD1 4.16Å; T1010-L1014 HydrophobicContact CG2-CG 4.43Å; T1010-L1014 WeakPolarHBondContact O-CG 3.42Å; T1010-L1014 PolarHBondContact O-N 3.19Å; V1011-L1014 PolarHBondContact O-N 3.11Å; K1012-L1014 VanDerWaalsContact C-N 3.32Å; K1012-L1014 PolarHBondContact O-N 3.22Å; L1014-L1016 VanDerWaalsContact C-N 3.33Å; L1014-L1016 PolarHBondContact O-N 3.24Å; L1014-R1017 PolarHBondContact O-N 3.11Å; L1014-L1018 VanDerWaalsContact O-CB 3.31Å; L1014-L1018 WeakPolarHBondContact O-CB 3.28Å; L1014-L1018 VanDerWaalsContact O-CG 3.3Å; L1014-L1018 WeakPolarHBondContact O-CG 3.37Å; L1014-L1018 PolarHBondContact O-N 3.24Å
1015	L	82.6	Confident	72	Confident	0.8 Å²	0.8	69.3 Å²	69.3	0%	0.004	37%	0.367	C	S	.	.	H	α-helix	trans	-61.5	-43.6	177.3	-73.2	171.7	0	0	0	111.4	C787 L813 V817 A818 L821 V823 L825 I857 V1011 K1012 R1017 L1018 F1019	C787-L1015 HydrophobicContact CB-CD2 4.18Å; C787-L1015 VanDerWaalsContact SG-CD2 3.52Å; L813-L1015 HydrophobicContact CD2-CD1 4.49Å; V817-L1015 HydrophobicContact CB-CD1 4.25Å; V817-L1015 HydrophobicContact CG1-CB 3.99Å; V817-L1015 HydrophobicContact CG1-CD1 4.04Å; V817-L1015 HydrophobicContact CG2-CB 4.49Å; V817-L1015 HydrophobicContact CG2-CD1 3.7Å; A818-L1015 HydrophobicContact CB-CD1 4.38Å; L821-L1015 VanDerWaalsContact CD1-C 3.42Å; L821-L1015 HydrophobicContact CD1-CB 4.01Å; L821-L1015 WeakPolarHBondContact CD1-O 3.34Å; V823-L1015 HydrophobicContact CG1-CD2 4.43Å; L825-L1015 HydrophobicContact CD1-CD1 4.12Å; L825-L1015 HydrophobicContact CD1-CD2 4.18Å; L825-L1015 HydrophobicContact CD2-CD1 4.32Å; I857-L1015 HydrophobicContact CD1-CD2 3.85Å; I857-L1015 HydrophobicContact CD1-CG 4.17Å; V1011-L1015 HydrophobicContact CG1-CD1 4.08Å; V1011-L1015 HydrophobicContact CG1-CG 4.24Å; V1011-L1015 WeakPolarHBondContact O-CB 3.28Å; V1011-L1015 VanDerWaalsContact O-CG 3.27Å; V1011-L1015 WeakPolarHBondContact O-CG 3.31Å; V1011-L1015 PolarHBondContact O-N 3.09Å; K1012-L1015 PolarHBondContact O-N 3.17Å; L1015-R1017 PolarHBondContact O-N 3.3Å; L1015-L1018 PolarHBondContact O-N 3.05Å; L1015-F1019 HydrophobicContact CD2-CD2 4.05Å; L1015-F1019 HydrophobicContact CD2-CE2 3.88Å; L1015-F1019 WeakPolarHBondContact O-CB 3.35Å; L1015-F1019 VanDerWaalsContact O-CD2 3.32Å; L1015-F1019 WeakPolarHBondContact O-CD2 3.4Å; L1015-F1019 PolarHBondContact O-N 3.02Å; L1015-F1019 VanDerWaalsContact O-N 3.09Å
1016	L	81.1	Confident	69.3	Low	63.4 Å²	63.4	71.1 Å²	71.1	33%	0.332	38%	0.376	S	S	.	.	H	α-helix	trans	-58.1	-54	173.2	-70.3	166.7	0	0	0	110	V817 L821 K1012 S1013 L1014 L1018 F1019 H1020	V817-L1016 HydrophobicContact CG1-CG 4.45Å; L821-L1016 HydrophobicContact CD1-CD2 4.03Å; L821-L1016 HydrophobicContact CD1-CG 4.38Å; L821-L1016 HydrophobicContact CD2-CD2 4Å; L821-L1016 HydrophobicContact CG-CD2 4.31Å; K1012-L1016 HydrophobicContact CG-CD1 4.09Å; K1012-L1016 WeakPolarHBondContact O-CB 3.45Å; K1012-L1016 VanDerWaalsContact O-CG 3.29Å; K1012-L1016 WeakPolarHBondContact O-CG 3.35Å; K1012-L1016 PolarHBondContact O-N 3.25Å; K1012-L1016 VanDerWaalsContact O-N 3.08Å; S1013-L1016 PolarHBondContact O-N 2.97Å; L1014-L1016 VanDerWaalsContact C-N 3.33Å; L1014-L1016 PolarHBondContact O-N 3.24Å; L1016-L1018 VanDerWaalsContact C-N 3.34Å; L1016-L1018 PolarHBondContact O-N 3.1Å; L1016-F1019 CarbonylContact O-C 3.17Å; L1016-F1019 PolarHBondContact O-N 3.11Å; L1016-F1019 VanDerWaalsContact O-N 3.15Å; L1016-H1020 WeakPolarHBondContact O-CA 3.36Å; L1016-H1020 WeakPolarHBondContact O-CB 3.36Å; L1016-H1020 PolarHBondContact O-N 3.16Å
1017	R	79.3	Confident	66.4	Low	118 Å²	118	74 Å²	74	45%	0.445	40%	0.399	S	S	.	.	H	α-helix	trans	-63.4	-34.1	-178.8	-73.5	-177.2	-74	152.6	-4.6	114.7	L931 S1013 L1014 L1015 F1019	L931-R1017 HydrophobicContact CD2-CB 3.59Å; L931-R1017 VanDerWaalsContact CD2-CB 3.49Å; L931-R1017 HydrophobicContact CD2-CG 4.38Å; L931-R1017 VanDerWaalsContact CD2-NH1 3.32Å; S1013-R1017 WeakPolarHBondContact O-CB 3.33Å; S1013-R1017 WeakPolarHBondContact O-CG 3.39Å; S1013-R1017 PolarHBondContact O-N 3.16Å; S1013-R1017 PolarHBondContact O-NE 3.28Å; S1013-R1017 PolarHBondContact OG-NE 3.14Å; S1013-R1017 PolarHBondContact OG-NH2 3.22Å; S1013-R1017 VanDerWaalsContact OG-NH2 3.09Å; L1014-R1017 PolarHBondContact O-N 3.11Å; L1015-R1017 PolarHBondContact O-N 3.3Å; R1017-F1019 VanDerWaalsContact C-N 3.3Å; R1017-F1019 PolarHBondContact O-N 2.75Å
1018	L	77.2	Confident	63.5	Low	43.4 Å²	43.4	80.7 Å²	80.7	23%	0.227	43%	0.433	C	S	.	.	H	α-helix	trans	-76.4	-29.9	179.8	-75.4	173.8	0	0	0	113.1	I857 L931 L1014 L1015 L1016	I857-L1018 HydrophobicContact CD1-CD1 3.95Å; I857-L1018 HydrophobicContact CG1-CD1 3.68Å; L931-L1018 HydrophobicContact CB-CD2 4.21Å; L931-L1018 WeakPolarHBondContact O-CD1 3.35Å; L931-L1018 WeakPolarHBondContact O-CD2 3.41Å; L931-L1018 WeakPolarHBondContact O-CG 3.32Å; L1014-L1018 VanDerWaalsContact O-CB 3.31Å; L1014-L1018 WeakPolarHBondContact O-CB 3.28Å; L1014-L1018 VanDerWaalsContact O-CG 3.3Å; L1014-L1018 WeakPolarHBondContact O-CG 3.37Å; L1014-L1018 PolarHBondContact O-N 3.24Å; L1015-L1018 PolarHBondContact O-N 3.05Å; L1016-L1018 VanDerWaalsContact C-N 3.34Å; L1016-L1018 PolarHBondContact O-N 3.1Å
1019	F	73.4	Confident	60.6	Low	36.4 Å²	36.4	87.6 Å²	87.6	16%	0.16	46%	0.458	C	S	.	.	H	α-helix	trans	-125.5	-9.9	-167.4	-59.9	-66.1	0	0	0	115.7	K785 C787 L821 V823 L1015 L1016 R1017 N1021	K785-F1019 HydrophobicContact CB-CD1 3.99Å; K785-F1019 HydrophobicContact CB-CE1 3.93Å; K785-F1019 HydrophobicContact CD-CB 4.26Å; K785-F1019 HydrophobicContact CD-CD1 3.33Å; K785-F1019 VanDerWaalsContact CD-CD1 3.46Å; K785-F1019 HydrophobicContact CD-CE1 3.95Å; K785-F1019 HydrophobicContact CD-CG 4.22Å; K785-F1019 HydrophobicContact CG-CD1 4.29Å; K785-F1019 HydrophobicContact CG-CE1 4.49Å; K785-F1019 PolarHBondContact NZ-O 3.25Å; C787-F1019 HydrophobicContact CB-CE2 3.58Å; C787-F1019 HydrophobicContact CB-CZ 3.63Å; L821-F1019 HydrophobicContact CB-CB 4.26Å; L821-F1019 HydrophobicContact CD1-CB 4.36Å; L821-F1019 HydrophobicContact CD2-CB 4.34Å; V823-F1019 HydrophobicContact CB-CD2 4.33Å; V823-F1019 HydrophobicContact CB-CE2 4.49Å; V823-F1019 HydrophobicContact CG1-CD2 3.98Å; V823-F1019 HydrophobicContact CG1-CE2 3.76Å; V823-F1019 HydrophobicContact CG1-CG 4.4Å; V823-F1019 HydrophobicContact CG1-CZ 4.1Å; V823-F1019 HydrophobicContact CG2-CB 3.69Å; V823-F1019 HydrophobicContact CG2-CD1 4.06Å; V823-F1019 HydrophobicContact CG2-CD2 3.6Å; V823-F1019 VanDerWaalsContact CG2-CD2 3.43Å; V823-F1019 HydrophobicContact CG2-CE1 4.36Å; V823-F1019 HydrophobicContact CG2-CE2 4.21Å; V823-F1019 HydrophobicContact CG2-CG 3.5Å; V823-F1019 VanDerWaalsContact CG2-CG 3.45Å; V823-F1019 HydrophobicContact CG2-CZ 4.33Å; L1015-F1019 HydrophobicContact CD2-CD2 4.05Å; L1015-F1019 HydrophobicContact CD2-CE2 3.88Å; L1015-F1019 WeakPolarHBondContact O-CB 3.35Å; L1015-F1019 VanDerWaalsContact O-CD2 3.32Å; L1015-F1019 WeakPolarHBondContact O-CD2 3.4Å; L1015-F1019 PolarHBondContact O-N 3.02Å; L1015-F1019 VanDerWaalsContact O-N 3.09Å; L1016-F1019 CarbonylContact O-C 3.17Å; L1016-F1019 PolarHBondContact O-N 3.11Å; L1016-F1019 VanDerWaalsContact O-N 3.15Å; R1017-F1019 VanDerWaalsContact C-N 3.3Å; R1017-F1019 PolarHBondContact O-N 2.75Å; F1019-N1021 PolarHBondContact O-N 2.82Å
1020	H	65.4	Low	57.9	Low	113.8 Å²	113.8	91.4 Å²	91.4	53%	0.527	47%	0.47	S	S	.	.			trans	-67	127.6	173.7	-153	-58.9	0	0	0	109.5	L821 L1016	L821-H1020 HydrophobicContact CD2-CB 4.32Å; L1016-H1020 WeakPolarHBondContact O-CA 3.36Å; L1016-H1020 WeakPolarHBondContact O-CB 3.36Å; L1016-H1020 PolarHBondContact O-N 3.16Å
1021	N	51	Low	55	Low	102.6 Å²	102.6	97 Å²	97	55%	0.549	50%	0.498	S	S	.	.			trans	-97.8	118.3	176.1	-72.4	-26.7	0	0	0	108.4	K785 F1019 N1023 D1024	K785-N1021 PolarHBondContact NZ-OD1 2.95Å; F1019-N1021 PolarHBondContact O-N 2.82Å; N1021-N1023 PolarHBondContact O-N 3.19Å; N1021-D1024 PolarHBondContact O-N 2.78Å
1022	D	41.8	Very low	52.2	Low	142.6 Å²	142.6	104.2 Å²	104.2	76%	0.763	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	18.3	174.8	-72.5	-27.3	0	0	0	114.4
1023	N	38.1	Very low	49.5	Very low	141.4 Å²	141.4	107.4 Å²	107.4	76%	0.756	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	4.4	-175.7	-83	-18.1	0	0	0	115.2	N1021	N1021-N1023 PolarHBondContact O-N 3.19Å
1024	D	36	Very low	46.7	Very low	136.6 Å²	136.6	111.9 Å²	111.9	73%	0.73	57%	0.573	S	S	*	*			trans	-105.5	54.7	176.1	-71.2	-26.1	0	0	0	111.7	N1021 T1026	N1021-D1024 PolarHBondContact O-N 2.78Å; D1024-T1026 PolarHBondContact O-N 3.03Å
1025	N	28.7	Very low	43.9	Very low	151.6 Å²	151.6	119.1 Å²	119.1	81%	0.811	61%	0.611	S	S	*	*			trans	-76.3	65.2	167.7	-87.8	-19.6	0	0	0	111.6
1026	T	27.7	Very low	41.1	Very low	109.4 Å²	109.4	123.8 Å²	123.8	67%	0.671	64%	0.641	S	S	*	*			trans	-125.7	102.5	159.2	50.8	0	0	0	0	109	D1024 I1028	D1024-T1026 PolarHBondContact O-N 3.03Å; T1026-I1028 PolarHBondContact O-N 2.98Å; T1026-I1028 VanDerWaalsContact O-N 3.1Å
1027	P	25.9	Very low	38.4	Very low	109.2 Å²	109.2	126.8 Å²	126.8	71%	0.709	66%	0.662	S	S	*	*			trans	-73.2	110.5	174.4	24.5	-20.9	0	0	0	107.9	Y1029	P1027-Y1029 HydrophobicContact CB-CD2 3.95Å; P1027-Y1029 HydrophobicContact CB-CE2 3.92Å; P1027-Y1029 HydrophobicContact CG-CD2 4.37Å; P1027-Y1029 HydrophobicContact CG-CE2 4.41Å; P1027-Y1029 PolarHBondContact O-N 2.94Å; P1027-Y1029 VanDerWaalsContact O-N 3.09Å
1028	I	27.9	Very low	35.9	Very low	141.4 Å²	141.4	126.6 Å²	126.6	73%	0.725	67%	0.674	S	S	*	*			trans	-88.8	85.6	168.6	-56.6	174.5	0	0	0	106.9	T1026 N1030	T1026-I1028 PolarHBondContact O-N 2.98Å; T1026-I1028 VanDerWaalsContact O-N 3.1Å; I1028-N1030 HydrophobicContact CG2-CB 4.33Å; I1028-N1030 PolarHBondContact O-N 2.94Å
1029	Y	26.3	Very low	33.5	Very low	189.6 Å²	189.6	127.8 Å²	127.8	74%	0.744	69%	0.691	S	S	*	*			trans	-72.4	100.5	157.9	-80.8	-84.9	0	0	0	107.3	P1027 D1640	P1027-Y1029 HydrophobicContact CB-CD2 3.95Å; P1027-Y1029 HydrophobicContact CB-CE2 3.92Å; P1027-Y1029 HydrophobicContact CG-CD2 4.37Å; P1027-Y1029 HydrophobicContact CG-CE2 4.41Å; P1027-Y1029 PolarHBondContact O-N 2.94Å; P1027-Y1029 VanDerWaalsContact O-N 3.09Å; Y1029-D1640 PolarHBondContact OH-OD2 2.6Å
1030	N	26.9	Very low	31.3	Very low	141.2 Å²	141.2	132.9 Å²	132.9	76%	0.755	72%	0.72	S	S	*	*			trans	-105.2	122.7	153.6	-84.3	-16.5	0	0	0	108.1	I1028 D1032	I1028-N1030 HydrophobicContact CG2-CB 4.33Å; I1028-N1030 PolarHBondContact O-N 2.94Å; N1030-D1032 VanDerWaalsContact C-N 3.27Å; N1030-D1032 PolarHBondContact O-N 3.1Å
1031	N	27	Very low	29.5	Very low	142 Å²	142	135.3 Å²	135.3	76%	0.759	73%	0.729	S	S	*	*			trans	-43.1	75.4	175.4	-64.8	-19.9	0	0	0	113.9
1032	D	28	Very low	28.6	Very low	152.6 Å²	152.6	135.4 Å²	135.4	82%	0.816	74%	0.737	S	S	*	*			trans	-139.3	100.8	150.4	-87	-30.9	0	0	0	109	N1030 N1034	N1030-D1032 VanDerWaalsContact C-N 3.27Å; N1030-D1032 PolarHBondContact O-N 3.1Å; D1032-N1034 PolarHBondContact O-N 3.23Å
1033	H	26.7	Very low	28.4	Very low	170 Å²	170	132.8 Å²	132.8	79%	0.787	72%	0.723	S	S	*	*			trans	-54.8	113.6	168.9	-69.8	-77.2	0	0	0	111.1
1034	N	26	Very low	28.7	Very low	143.8 Å²	143.8	129.9 Å²	129.9	77%	0.769	71%	0.707	S	S	*	*			trans	136.2	86.7	170.8	-62.4	-37	0	0	0	112.8	D1032 K1041	D1032-N1034 PolarHBondContact O-N 3.23Å; N1034-K1041 VanDerWaalsContact CB-NZ 3.26Å; N1034-K1041 PolarHBondContact O-NZ 3.41Å
1035	L	24.2	Very low	29.2	Very low	151.4 Å²	151.4	125.7 Å²	125.7	79%	0.793	69%	0.687	S	S	*	*			trans	-97.3	122.4	159.2	-97.1	117.1	0	0	0	110.5	V1037	L1035-V1037 PolarHBondContact O-N 2.9Å
1036	P	24.2	Very low	30.2	Very low	98.4 Å²	98.4	120.9 Å²	120.9	64%	0.639	66%	0.66	S	S	*	*			trans	-79.8	119.7	179.2	30.7	-27.7	0	0	0	110	T1038 K1041	P1036-T1038 VanDerWaalsContact C-N 3.26Å; P1036-T1038 WeakPolarHBondContact CB-OG1 3.39Å; P1036-T1038 PolarHBondContact O-N 3.09Å; P1036-K1041 HydrophobicContact CB-CB 4.29Å; P1036-K1041 HydrophobicContact CB-CD 4.15Å; P1036-K1041 HydrophobicContact CG-CB 3.59Å; P1036-K1041 HydrophobicContact CG-CD 3.75Å; P1036-K1041 HydrophobicContact CG-CG 4.26Å
1037	V	24.4	Very low	31.3	Very low	128.2 Å²	128.2	120.6 Å²	120.6	78%	0.777	65%	0.651	S	S	*	*			trans	-51.4	80.8	165	-175.9	0	0	0	0	109.7	L1035 A1039 L1233	L1035-V1037 PolarHBondContact O-N 2.9Å; V1037-A1039 PolarHBondContact O-N 2.88Å; V1037-A1039 VanDerWaalsContact O-N 3.17Å; V1037-L1233 HydrophobicContact CB-CD1 4.1Å; V1037-L1233 HydrophobicContact CG1-CD1 4Å; V1037-L1233 WeakPolarHBondContact O-CD1 3.28Å; V1037-L1233 WeakPolarHBondContact O-CD2 3.17Å; V1037-L1233 WeakPolarHBondContact O-CG 3.17Å
1038	T	26.4	Very low	32.6	Very low	112.8 Å²	112.8	117.3 Å²	117.3	69%	0.692	63%	0.626	S	S	*	*			trans	-99.3	110.3	165.9	43.9	0	0	0	0	110.2	P1036 N1040 L1233	P1036-T1038 VanDerWaalsContact C-N 3.26Å; P1036-T1038 WeakPolarHBondContact CB-OG1 3.39Å; P1036-T1038 PolarHBondContact O-N 3.09Å; T1038-N1040 PolarHBondContact O-N 3.43Å; T1038-L1233 HydrophobicContact CG2-CD2 4.28Å
1039	A	27.1	Very low	33.9	Very low	69.6 Å²	69.6	111.1 Å²	111.1	58%	0.575	59%	0.594	S	S	*	*			trans	-48.2	113.8	171	0	0	0	0	0	114.1	V1037 K1041 L1230 L1233	V1037-A1039 PolarHBondContact O-N 2.88Å; V1037-A1039 VanDerWaalsContact O-N 3.17Å; A1039-K1041 VanDerWaalsContact C-N 3.35Å; A1039-K1041 PolarHBondContact O-N 2.91Å; A1039-L1230 HydrophobicContact CB-CD2 3.41Å; A1039-L1230 VanDerWaalsContact CB-CD2 3.41Å; A1039-L1233 HydrophobicContact CB-CB 3.21Å; A1039-L1233 HydrophobicContact CB-CD1 3.53Å; A1039-L1233 HydrophobicContact CB-CD2 4.41Å; A1039-L1233 HydrophobicContact CB-CG 3.83Å
1040	N	26.8	Very low	35.2	Very low	143 Å²	143	107.1 Å²	107.1	77%	0.765	58%	0.578	S	S	*	*			trans	112.3	46.4	167.5	-68.7	-20.7	0	0	0	117.2	T1038 S1042 L1230	T1038-N1040 PolarHBondContact O-N 3.43Å; N1040-S1042 PolarHBondContact O-N 2.92Å; N1040-L1230 HydrophobicContact CB-CD1 3.65Å; N1040-L1230 HydrophobicContact CB-CD2 3.47Å; N1040-L1230 VanDerWaalsContact CB-CD2 3.47Å; N1040-L1230 HydrophobicContact CB-CG 4.16Å; N1040-L1230 WeakPolarHBondContact ND2-CD1 3.43Å; N1040-L1230 WeakPolarHBondContact ND2-CD2 3.4Å
1041	K	29	Very low	36.5	Very low	164.8 Å²	164.8	103.9 Å²	103.9	72%	0.717	56%	0.558	S	S	*	*			trans	-107.1	109.8	153.5	-82.2	-179.3	178.6	174	0	108.4	N1034 P1036 A1039 L1043	N1034-K1041 VanDerWaalsContact CB-NZ 3.26Å; N1034-K1041 PolarHBondContact O-NZ 3.41Å; P1036-K1041 HydrophobicContact CB-CB 4.29Å; P1036-K1041 HydrophobicContact CB-CD 4.15Å; P1036-K1041 HydrophobicContact CG-CB 3.59Å; P1036-K1041 HydrophobicContact CG-CD 3.75Å; P1036-K1041 HydrophobicContact CG-CG 4.26Å; A1039-K1041 VanDerWaalsContact C-N 3.35Å; A1039-K1041 PolarHBondContact O-N 2.91Å; K1041-L1043 VanDerWaalsContact C-N 3.34Å; K1041-L1043 PolarHBondContact O-N 2.97Å; K1041-L1043 VanDerWaalsContact O-N 3.1Å
1042	S	32.5	Very low	37.9	Very low	104.2 Å²	104.2	100 Å²	100	73%	0.729	53%	0.533	S	S	*	.			trans	-49.9	107.7	164.9	52.8	0	0	0	0	109.1	N1040 N1044	N1040-S1042 PolarHBondContact O-N 2.92Å; S1042-N1044 VanDerWaalsContact C-N 3.29Å; S1042-N1044 PolarHBondContact O-N 2.91Å
1043	L	36.2	Very low	39.4	Very low	87.8 Å²	87.8	93.1 Å²	93.1	46%	0.46	50%	0.497	S	S	.	.			trans	-50.8	116.6	171.6	-125.2	109.2	0	0	0	106.8	K1041 T1045 F1048 Y1052 R1633	K1041-L1043 VanDerWaalsContact C-N 3.34Å; K1041-L1043 PolarHBondContact O-N 2.97Å; K1041-L1043 VanDerWaalsContact O-N 3.1Å; L1043-T1045 VanDerWaalsContact C-N 3.29Å; L1043-T1045 PolarHBondContact O-N 3.16Å; L1043-T1045 VanDerWaalsContact O-N 3.12Å; L1043-F1048 HydrophobicContact CB-CB 4.45Å; L1043-F1048 HydrophobicContact CB-CE2 3.9Å; L1043-F1048 HydrophobicContact CD2-CB 4.09Å; L1043-F1048 VanDerWaalsContact CD2-CB 3.49Å; L1043-F1048 HydrophobicContact CD2-CD2 4.25Å; L1043-F1048 HydrophobicContact CD2-CE1 4.5Å; L1043-F1048 HydrophobicContact CD2-CE2 3.29Å; L1043-F1048 HydrophobicContact CD2-CG 4.28Å; L1043-F1048 HydrophobicContact CD2-CZ 3.24Å; L1043-F1048 HydrophobicContact CG-CE2 4.17Å; L1043-Y1052 HydrophobicContact CD2-CE2 4.06Å; L1043-R1633 VanDerWaalsContact CD1-CD 3.44Å; L1043-R1633 HydrophobicContact CD1-CG 3.91Å; L1043-R1633 VanDerWaalsContact CD1-NH2 3.31Å; L1043-R1633 VanDerWaalsContact CG-NH1 3.33Å; L1043-R1633 VanDerWaalsContact CG-NH2 3.25Å
1044	N	45.7	Very low	41	Very low	80 Å²	80	88.2 Å²	88.2	43%	0.428	47%	0.472	S	S	.	.			trans	-63.2	109.4	-178.6	-153.1	-12.5	0	0	0	106.3	S1042 I1046 E1047 F1048 I1190	S1042-N1044 VanDerWaalsContact C-N 3.29Å; S1042-N1044 PolarHBondContact O-N 2.91Å; N1044-I1046 CarbonylContact O-C 3.54Å; N1044-I1046 PolarHBondContact O-N 3.11Å; N1044-I1046 WeakPolarHBondContact OD1-CB 3.45Å; N1044-I1046 WeakPolarHBondContact OD1-CG1 3.41Å; N1044-I1046 PolarHBondContact OD1-N 3.37Å; N1044-E1047 HydrophobicContact CB-CB 4.23Å; N1044-E1047 HydrophobicContact CB-CG 4.13Å; N1044-E1047 VanDerWaalsContact ND2-CD 3.3Å; N1044-E1047 PolarHBondContact ND2-OE1 3.42Å; N1044-E1047 WeakPolarHBondContact O-CA 3.42Å; N1044-E1047 WeakPolarHBondContact O-CB 3.43Å; N1044-E1047 PolarHBondContact O-N 3.1Å; N1044-F1048 VanDerWaalsContact O-CD2 3.27Å; N1044-F1048 WeakPolarHBondContact O-CD2 3.46Å; N1044-F1048 PolarHBondContact O-N 3.17Å; N1044-F1048 VanDerWaalsContact O-N 3.15Å; N1044-I1190 HydrophobicContact CB-CD1 4.45Å; N1044-I1190 WeakPolarHBondContact OD1-CD1 3.31Å
1045	T	46.4	Very low	42.5	Very low	48.6 Å²	48.6	83.2 Å²	83.2	30%	0.298	45%	0.448	S	S	.	.	H	α-helix	trans	-52.5	-28.2	-173.5	-35.3	0	0	0	0	112	L1043 F1048 L1049 I1188 I1190 I1218 T1300	L1043-T1045 VanDerWaalsContact C-N 3.29Å; L1043-T1045 PolarHBondContact O-N 3.16Å; L1043-T1045 VanDerWaalsContact O-N 3.12Å; T1045-F1048 WeakPolarHBondContact O-CB 3.26Å; T1045-F1048 PolarHBondContact O-N 3.14Å; T1045-L1049 HydrophobicContact CG2-CD1 4Å; T1045-L1049 HydrophobicContact CG2-CG 4.26Å; T1045-L1049 VanDerWaalsContact O-CB 3.29Å; T1045-L1049 WeakPolarHBondContact O-CB 3.24Å; T1045-L1049 WeakPolarHBondContact O-CD1 3.33Å; T1045-L1049 WeakPolarHBondContact O-CG 3.32Å; T1045-L1049 PolarHBondContact O-N 3.19Å; T1045-I1188 WeakPolarHBondContact CB-O 3.3Å; T1045-I1188 HydrophobicContact CG2-CB 3.32Å; T1045-I1188 HydrophobicContact CG2-CG2 3.1Å; T1045-I1188 WeakPolarHBondContact CG2-O 3.32Å; T1045-I1188 PolarHBondContact OG1-O 2.94Å; T1045-I1190 HydrophobicContact CG2-CD1 3.58Å; T1045-I1190 HydrophobicContact CG2-CG1 3.45Å; T1045-I1190 VanDerWaalsContact CG2-CG1 3.45Å; T1045-I1218 HydrophobicContact CG2-CD1 3.09Å; T1045-I1218 WeakPolarHBondContact OG1-CD1 3.49Å; T1045-T1300 HydrophobicContact CG2-CG2 3.68Å
1046	I	49	Very low	44.1	Very low	51.2 Å²	51.2	76.7 Å²	76.7	26%	0.263	42%	0.416	S	S	.	.	H	α-helix	trans	-63.2	-44.4	173.7	-57.7	173.7	0	0	0	112.5	N1044 F1048 L1049 R1050 I1134 I1137 H1186 I1188 L1216	N1044-I1046 CarbonylContact O-C 3.54Å; N1044-I1046 PolarHBondContact O-N 3.11Å; N1044-I1046 WeakPolarHBondContact OD1-CB 3.45Å; N1044-I1046 WeakPolarHBondContact OD1-CG1 3.41Å; N1044-I1046 PolarHBondContact OD1-N 3.37Å; I1046-F1048 VanDerWaalsContact C-N 3.29Å; I1046-L1049 PolarHBondContact O-N 2.97Å; I1046-R1050 HydrophobicContact CG2-CG 4.39Å; I1046-R1050 VanDerWaalsContact O-CB 3.24Å; I1046-R1050 WeakPolarHBondContact O-CB 3.37Å; I1046-R1050 VanDerWaalsContact O-CG 3.3Å; I1046-R1050 WeakPolarHBondContact O-CG 3.26Å; I1046-R1050 PolarHBondContact O-N 3.06Å; I1046-I1134 HydrophobicContact CG2-CD1 4.42Å; I1046-I1137 HydrophobicContact CD1-CD1 4.17Å; I1046-I1137 HydrophobicContact CD1-CG2 3.73Å; I1046-I1137 HydrophobicContact CG1-CD1 3.7Å; I1046-I1137 HydrophobicContact CG1-CG2 4.33Å; I1046-H1186 HydrophobicContact CD1-CB 4.33Å; I1046-H1186 WeakPolarHBondContact CD1-O 3.12Å; I1046-I1188 HydrophobicContact CD1-CB 3.75Å; I1046-I1188 HydrophobicContact CD1-CD1 3.56Å; I1046-I1188 HydrophobicContact CD1-CG1 4.23Å; I1046-I1188 HydrophobicContact CD1-CG2 3.35Å; I1046-I1188 HydrophobicContact CG1-CD1 4Å; I1046-L1216 HydrophobicContact CD1-CB 4.12Å; I1046-L1216 HydrophobicContact CD1-CD2 4.15Å; I1046-L1216 HydrophobicContact CG1-CB 4.29Å; I1046-L1216 HydrophobicContact CG1-CD2 3.38Å; I1046-L1216 HydrophobicContact CG1-CG 4.42Å
1047	E	51.1	Low	45.9	Very low	103.2 Å²	103.2	72.2 Å²	72.2	48%	0.482	39%	0.387	S	S	.	.	H	α-helix	trans	-65.6	-42.5	176.6	-73.7	175.6	168.8	0	0	110.6	N1044 L1049 R1050 E1051	N1044-E1047 HydrophobicContact CB-CB 4.23Å; N1044-E1047 HydrophobicContact CB-CG 4.13Å; N1044-E1047 VanDerWaalsContact ND2-CD 3.3Å; N1044-E1047 PolarHBondContact ND2-OE1 3.42Å; N1044-E1047 WeakPolarHBondContact O-CA 3.42Å; N1044-E1047 WeakPolarHBondContact O-CB 3.43Å; N1044-E1047 PolarHBondContact O-N 3.1Å; E1047-L1049 VanDerWaalsContact C-N 3.26Å; E1047-L1049 PolarHBondContact O-N 2.83Å; E1047-R1050 WeakPolarHBondContact O-CB 3.42Å; E1047-R1050 PolarHBondContact O-N 3.16Å; E1047-R1050 VanDerWaalsContact O-N 3.14Å; E1047-E1051 VanDerWaalsContact O-CB 3.27Å; E1047-E1051 WeakPolarHBondContact O-CB 3.38Å; E1047-E1051 WeakPolarHBondContact O-CG 3.41Å; E1047-E1051 PolarHBondContact O-N 2.97Å
1048	F	52.1	Low	47.7	Very low	40.4 Å²	40.4	68.5 Å²	68.5	18%	0.177	37%	0.366	C	S	.	.	H	α-helix	trans	-57.5	-49.8	174	-168.7	-92.1	0	0	0	112	L1043 N1044 T1045 I1046 R1050 E1051 Y1052 V1053 I1190 L1217 I1291 F1293 I1299 T1300 L1302 R1633	L1043-F1048 HydrophobicContact CB-CB 4.45Å; L1043-F1048 HydrophobicContact CB-CE2 3.9Å; L1043-F1048 HydrophobicContact CD2-CB 4.09Å; L1043-F1048 VanDerWaalsContact CD2-CB 3.49Å; L1043-F1048 HydrophobicContact CD2-CD2 4.25Å; L1043-F1048 HydrophobicContact CD2-CE1 4.5Å; L1043-F1048 HydrophobicContact CD2-CE2 3.29Å; L1043-F1048 HydrophobicContact CD2-CG 4.28Å; L1043-F1048 HydrophobicContact CD2-CZ 3.24Å; L1043-F1048 HydrophobicContact CG-CE2 4.17Å; N1044-F1048 VanDerWaalsContact O-CD2 3.27Å; N1044-F1048 WeakPolarHBondContact O-CD2 3.46Å; N1044-F1048 PolarHBondContact O-N 3.17Å; N1044-F1048 VanDerWaalsContact O-N 3.15Å; T1045-F1048 WeakPolarHBondContact O-CB 3.26Å; T1045-F1048 PolarHBondContact O-N 3.14Å; I1046-F1048 VanDerWaalsContact C-N 3.29Å; F1048-R1050 VanDerWaalsContact C-N 3.27Å; F1048-R1050 PolarHBondContact O-N 2.99Å; F1048-E1051 PolarHBondContact O-N 3.02Å; F1048-Y1052 HydrophobicContact CB-CD2 3.98Å; F1048-Y1052 HydrophobicContact CB-CE2 4.04Å; F1048-Y1052 HydrophobicContact CD1-CD2 4.01Å; F1048-Y1052 AromaticContact CD2-CD2 3.63Å; F1048-Y1052 HydrophobicContact CD2-CD2 3.63Å; F1048-Y1052 AromaticContact CD2-CE2 3.3Å; F1048-Y1052 HydrophobicContact CD2-CE2 3.3Å; F1048-Y1052 HydrophobicContact CD2-CG 4.29Å; F1048-Y1052 HydrophobicContact CE1-CD2 4.07Å; F1048-Y1052 AromaticContact CE2-CD2 3.23Å; F1048-Y1052 HydrophobicContact CE2-CD2 3.96Å; F1048-Y1052 AromaticContact CE2-CE2 3.71Å; F1048-Y1052 HydrophobicContact CE2-CE2 3.71Å; F1048-Y1052 HydrophobicContact CE2-CG 4.22Å; F1048-Y1052 AromaticContact CG-CD2 3.48Å; F1048-Y1052 HydrophobicContact CG-CD2 3.97Å; F1048-Y1052 VanDerWaalsContact CG-CD2 3.48Å; F1048-Y1052 AromaticContact CG-CE2 3.86Å; F1048-Y1052 HydrophobicContact CG-CE2 3.86Å; F1048-Y1052 AromaticContact CZ-CD2 3.66Å; F1048-Y1052 HydrophobicContact CZ-CD2 3.66Å; F1048-Y1052 HydrophobicContact CZ-CG 4.29Å; F1048-Y1052 VanDerWaalsContact O-CB 3.29Å; F1048-Y1052 WeakPolarHBondContact O-CB 3.37Å; F1048-Y1052 WeakPolarHBondContact O-CD2 3.2Å; F1048-Y1052 PolarHBondContact O-N 3.2Å; F1048-Y1052 VanDerWaalsContact O-N 3.16Å; F1048-V1053 HydrophobicContact CD1-CG2 4.19Å; F1048-V1053 HydrophobicContact CE1-CG2 3.87Å; F1048-V1053 HydrophobicContact CZ-CG2 3.97Å; F1048-V1053 PolarHBondContact O-N 2.85Å; F1048-I1190 HydrophobicContact CB-CD1 3.77Å; F1048-I1190 HydrophobicContact CD1-CD1 4.33Å; F1048-I1190 HydrophobicContact CD2-CD1 4.1Å; F1048-I1190 HydrophobicContact CG-CD1 3.76Å; F1048-L1217 HydrophobicContact CD1-CD1 4.48Å; F1048-L1217 HydrophobicContact CD1-CD2 3.68Å; F1048-L1217 HydrophobicContact CD2-CD2 4.06Å; F1048-L1217 HydrophobicContact CE1-CD1 3.53Å; F1048-L1217 HydrophobicContact CE1-CD2 3.21Å; F1048-L1217 HydrophobicContact CE1-CG 3.96Å; F1048-L1217 HydrophobicContact CE2-CD2 3.61Å; F1048-L1217 HydrophobicContact CG-CD2 4.15Å; F1048-L1217 HydrophobicContact CZ-CD1 3.85Å; F1048-L1217 HydrophobicContact CZ-CD2 3.21Å; F1048-L1217 HydrophobicContact CZ-CG 4.16Å; F1048-I1291 HydrophobicContact CD1-CG2 4.36Å; F1048-I1291 HydrophobicContact CE1-CG2 3.64Å; F1048-F1293 HydrophobicContact CE1-CE2 4.29Å; F1048-F1293 HydrophobicContact CZ-CD2 4.17Å; F1048-F1293 HydrophobicContact CZ-CE2 4.06Å; F1048-I1299 HydrophobicContact CD2-CG2 3.71Å; F1048-I1299 HydrophobicContact CE1-CB 4.3Å; F1048-I1299 HydrophobicContact CE1-CG2 4.23Å; F1048-I1299 HydrophobicContact CE2-CB 4.03Å; F1048-I1299 HydrophobicContact CE2-CD1 4.08Å; F1048-I1299 HydrophobicContact CE2-CG2 3.21Å; F1048-I1299 HydrophobicContact CG-CG2 4.42Å; F1048-I1299 HydrophobicContact CZ-CB 3.77Å; F1048-I1299 HydrophobicContact CZ-CD1 3.59Å; F1048-I1299 HydrophobicContact CZ-CG1 4.25Å; F1048-I1299 HydrophobicContact CZ-CG2 3.51Å; F1048-T1300 HydrophobicContact CB-CG2 4.11Å; F1048-T1300 HydrophobicContact CD1-CG2 3.86Å; F1048-T1300 VanDerWaalsContact CD1-CG2 3.43Å; F1048-T1300 HydrophobicContact CE1-CG2 4.03Å; F1048-T1300 HydrophobicContact CG-CG2 3.82Å; F1048-L1302 HydrophobicContact CD2-CD1 4.34Å; F1048-L1302 HydrophobicContact CE1-CD1 4.49Å; F1048-L1302 HydrophobicContact CE2-CD1 3.5Å; F1048-L1302 VanDerWaalsContact CE2-CD1 3.42Å; F1048-L1302 HydrophobicContact CE2-CD2 3.68Å; F1048-L1302 HydrophobicContact CE2-CG 4.28Å; F1048-L1302 HydrophobicContact CZ-CD1 3.22Å; F1048-L1302 HydrophobicContact CZ-CD2 3.79Å; F1048-R1633 VanDerWaalsContact CD1-NH1 3.32Å
1049	L	54.8	Low	49.4	Very low	9.4 Å²	9.4	65.7 Å²	65.7	5%	0.049	36%	0.355	C	S	.	.	I	π-helix	trans	-64.7	-38.2	179.6	-73.6	167.6	0	0	0	111.7	T1045 I1046 E1047 Y1052 V1053 Y1054 S1130 T1133 I1134 I1137 I1188 I1215 L1216 F1293 L1297	T1045-L1049 HydrophobicContact CG2-CD1 4Å; T1045-L1049 HydrophobicContact CG2-CG 4.26Å; T1045-L1049 VanDerWaalsContact O-CB 3.29Å; T1045-L1049 WeakPolarHBondContact O-CB 3.24Å; T1045-L1049 WeakPolarHBondContact O-CD1 3.33Å; T1045-L1049 WeakPolarHBondContact O-CG 3.32Å; T1045-L1049 PolarHBondContact O-N 3.19Å; I1046-L1049 PolarHBondContact O-N 2.97Å; E1047-L1049 VanDerWaalsContact C-N 3.26Å; E1047-L1049 PolarHBondContact O-N 2.83Å; L1049-Y1052 PolarHBondContact O-N 3.12Å; L1049-V1053 HydrophobicContact CD2-CB 4.3Å; L1049-V1053 HydrophobicContact CD2-CG2 4.04Å; L1049-V1053 CarbonylContact O-C 3.32Å; L1049-V1053 WeakPolarHBondContact O-CB 3.29Å; L1049-V1053 WeakPolarHBondContact O-CG2 3.37Å; L1049-V1053 PolarHBondContact O-N 3.14Å; L1049-Y1054 WeakPolarHBondContact O-CB 3.46Å; L1049-Y1054 PolarHBondContact O-N 3.21Å; L1049-S1130 WeakPolarHBondContact CD2-OG 3.35Å; L1049-T1133 HydrophobicContact CD1-CG2 3.6Å; L1049-T1133 HydrophobicContact CD2-CG2 3.48Å; L1049-T1133 VanDerWaalsContact CD2-CG2 3.48Å; L1049-I1134 HydrophobicContact CB-CD1 4.05Å; L1049-I1134 HydrophobicContact CB-CG1 4.14Å; L1049-I1137 HydrophobicContact CD1-CD1 3.28Å; L1049-I1137 HydrophobicContact CD1-CG1 4.27Å; L1049-I1137 HydrophobicContact CD2-CD1 3.89Å; L1049-I1137 HydrophobicContact CG-CD1 3.95Å; L1049-I1188 HydrophobicContact CD1-CD1 3.37Å; L1049-I1188 HydrophobicContact CD1-CG2 4.29Å; L1049-I1215 HydrophobicContact CD1-CB 4.15Å; L1049-I1215 HydrophobicContact CD1-CD1 3.6Å; L1049-I1215 HydrophobicContact CD1-CG1 4.43Å; L1049-I1215 HydrophobicContact CD1-CG2 4.06Å; L1049-I1215 HydrophobicContact CD2-CG2 4.02Å; L1049-L1216 HydrophobicContact CD1-CD2 3.96Å; L1049-F1293 HydrophobicContact CD2-CE2 4.09Å; L1049-F1293 HydrophobicContact CD2-CZ 3.9Å; L1049-L1297 HydrophobicContact CD2-CD1 4.23Å
1050	R	55.1	Low	51.2	Low	105.8 Å²	105.8	63.2 Å²	63.2	40%	0.399	33%	0.332	S	S	.	.	I	π-helix	trans	-67.5	-46.5	177.1	-115.4	-179.1	-166.9	-173.5	-1.1	112.2	I1046 E1047 F1048 Y1052 V1053 Y1054 S1055 I1134 E1138 I1235	I1046-R1050 HydrophobicContact CG2-CG 4.39Å; I1046-R1050 VanDerWaalsContact O-CB 3.24Å; I1046-R1050 WeakPolarHBondContact O-CB 3.37Å; I1046-R1050 VanDerWaalsContact O-CG 3.3Å; I1046-R1050 WeakPolarHBondContact O-CG 3.26Å; I1046-R1050 PolarHBondContact O-N 3.06Å; E1047-R1050 WeakPolarHBondContact O-CB 3.42Å; E1047-R1050 PolarHBondContact O-N 3.16Å; E1047-R1050 VanDerWaalsContact O-N 3.14Å; F1048-R1050 VanDerWaalsContact C-N 3.27Å; F1048-R1050 PolarHBondContact O-N 2.99Å; R1050-Y1052 VanDerWaalsContact C-N 3.34Å; R1050-Y1052 PolarHBondContact O-N 2.93Å; R1050-V1053 PolarHBondContact O-N 2.98Å; R1050-Y1054 HydrophobicContact CB-CD2 3.83Å; R1050-Y1054 HydrophobicContact CB-CE2 3.92Å; R1050-Y1054 HydrophobicContact CG-CD2 4.36Å; R1050-Y1054 HydrophobicContact CG-CE2 4Å; R1050-Y1054 WeakPolarHBondContact O-CA 3.06Å; R1050-Y1054 VanDerWaalsContact O-CB 3.28Å; R1050-Y1054 WeakPolarHBondContact O-CB 3.33Å; R1050-Y1054 WeakPolarHBondContact O-CD2 3.17Å; R1050-Y1054 PolarHBondContact O-N 3.04Å; R1050-S1055 PolarHBondContact O-OG 3.32Å; R1050-I1134 HydrophobicContact CB-CD1 4.07Å; R1050-I1134 HydrophobicContact CB-CG1 4.5Å; R1050-I1134 HydrophobicContact CG-CD1 4.07Å; R1050-I1134 HydrophobicContact CG-CG2 4.46Å; R1050-E1138 IonicContact CZ-OE1 3.03Å; R1050-E1138 IonicContact CZ-OE2 3.73Å; R1050-E1138 IonicContact NE-OE1 3.31Å; R1050-E1138 PolarHBondContact NE-OE1 3.05Å; R1050-E1138 VanDerWaalsContact NE-OE1 3.14Å; R1050-E1138 IonicContact NE-OE2 2.94Å; R1050-E1138 IonicContact NH1-OE1 3.41Å; R1050-E1138 PolarHBondContact NH1-OE1 3.44Å; R1050-E1138 IonicContact NH2-OE1 3.46Å; R1050-E1138 PolarHBondContact NH2-OE1 2.87Å; R1050-E1138 IonicContact NH2-OE2 2.65Å; R1050-E1138 PolarHBondContact NH2-OE2 3.15Å; R1050-I1235 WeakPolarHBondContact O-CD1 3.4Å
1051	E	53.6	Low	53	Low	74.6 Å²	74.6	57 Å²	57	35%	0.349	30%	0.301	S	S	.	.	I	π-helix	trans	-71.2	-40.4	-176.7	-106.3	178	-179.7	0	0	111.7	L819 E1047 F1048 S1055 I1235 R1633	L819-E1051 WeakPolarHBondContact CD1-OE1 3.46Å; E1047-E1051 VanDerWaalsContact O-CB 3.27Å; E1047-E1051 WeakPolarHBondContact O-CB 3.38Å; E1047-E1051 WeakPolarHBondContact O-CG 3.41Å; E1047-E1051 PolarHBondContact O-N 2.97Å; F1048-E1051 PolarHBondContact O-N 3.02Å; E1051-S1055 VanDerWaalsContact O-CB 3.28Å; E1051-S1055 WeakPolarHBondContact O-CB 3.24Å; E1051-S1055 PolarHBondContact O-N 3.12Å; E1051-S1055 PolarHBondContact O-OG 2.96Å; E1051-I1235 WeakPolarHBondContact O-CD1 3.41Å; E1051-R1633 IonicContact OE1-NH2 2.86Å; E1051-R1633 PolarHBondContact OE1-NH2 2.63Å; E1051-R1633 IonicContact OE2-CZ 3.7Å; E1051-R1633 VanDerWaalsContact OE2-CZ 3.3Å; E1051-R1633 IonicContact OE2-NH1 3.28Å; E1051-R1633 PolarHBondContact OE2-NH1 2.71Å; E1051-R1633 IonicContact OE2-NH2 3.56Å; E1051-R1633 PolarHBondContact OE2-NH2 3.48Å
1052	Y	57.2	Low	54.9	Low	61.2 Å²	61.2	52.1 Å²	52.1	24%	0.24	29%	0.286	C	S	.	.	I	π-helix	trans	-87.6	-51	-174.9	-98.7	-87.4	0	0	0	112.8	L1043 F1048 L1049 R1050 S1055 A1056 T1126 L1297 I1299 T1300 L1302	L1043-Y1052 HydrophobicContact CD2-CE2 4.06Å; F1048-Y1052 HydrophobicContact CB-CD2 3.98Å; F1048-Y1052 HydrophobicContact CB-CE2 4.04Å; F1048-Y1052 HydrophobicContact CD1-CD2 4.01Å; F1048-Y1052 AromaticContact CD2-CD2 3.63Å; F1048-Y1052 HydrophobicContact CD2-CD2 3.63Å; F1048-Y1052 AromaticContact CD2-CE2 3.3Å; F1048-Y1052 HydrophobicContact CD2-CE2 3.3Å; F1048-Y1052 HydrophobicContact CD2-CG 4.29Å; F1048-Y1052 HydrophobicContact CE1-CD2 4.07Å; F1048-Y1052 AromaticContact CE2-CD2 3.23Å; F1048-Y1052 HydrophobicContact CE2-CD2 3.96Å; F1048-Y1052 AromaticContact CE2-CE2 3.71Å; F1048-Y1052 HydrophobicContact CE2-CE2 3.71Å; F1048-Y1052 HydrophobicContact CE2-CG 4.22Å; F1048-Y1052 AromaticContact CG-CD2 3.48Å; F1048-Y1052 HydrophobicContact CG-CD2 3.97Å; F1048-Y1052 VanDerWaalsContact CG-CD2 3.48Å; F1048-Y1052 AromaticContact CG-CE2 3.86Å; F1048-Y1052 HydrophobicContact CG-CE2 3.86Å; F1048-Y1052 AromaticContact CZ-CD2 3.66Å; F1048-Y1052 HydrophobicContact CZ-CD2 3.66Å; F1048-Y1052 HydrophobicContact CZ-CG 4.29Å; F1048-Y1052 VanDerWaalsContact O-CB 3.29Å; F1048-Y1052 WeakPolarHBondContact O-CB 3.37Å; F1048-Y1052 WeakPolarHBondContact O-CD2 3.2Å; F1048-Y1052 PolarHBondContact O-N 3.2Å; F1048-Y1052 VanDerWaalsContact O-N 3.16Å; L1049-Y1052 PolarHBondContact O-N 3.12Å; R1050-Y1052 VanDerWaalsContact C-N 3.34Å; R1050-Y1052 PolarHBondContact O-N 2.93Å; Y1052-S1055 WeakPolarHBondContact O-CB 3.32Å; Y1052-S1055 PolarHBondContact O-N 3.37Å; Y1052-S1055 PolarHBondContact O-OG 2.8Å; Y1052-A1056 WeakPolarHBondContact O-CB 3.08Å; Y1052-A1056 PolarHBondContact O-N 3.17Å; Y1052-T1126 HydrophobicContact CE1-CG2 4.25Å; Y1052-L1297 HydrophobicContact CD1-CD2 4.49Å; Y1052-L1297 HydrophobicContact CD2-CD2 4.39Å; Y1052-L1297 HydrophobicContact CE1-CD2 4.07Å; Y1052-L1297 HydrophobicContact CE2-CD2 3.96Å; Y1052-I1299 HydrophobicContact CD2-CB 4.04Å; Y1052-I1299 HydrophobicContact CD2-CD1 3.89Å; Y1052-I1299 HydrophobicContact CD2-CG1 4.5Å; Y1052-I1299 HydrophobicContact CD2-CG2 4.24Å; Y1052-I1299 HydrophobicContact CE2-CD1 3.95Å; Y1052-T1300 HydrophobicContact CD1-CG2 3.74Å; Y1052-T1300 WeakPolarHBondContact CD1-OG1 3.14Å; Y1052-T1300 HydrophobicContact CE1-CG2 3.94Å; Y1052-T1300 WeakPolarHBondContact CE1-O 3.33Å; Y1052-T1300 HydrophobicContact CG-CG2 3.64Å; Y1052-L1302 HydrophobicContact CD1-CB 3.96Å; Y1052-L1302 HydrophobicContact CD1-CD1 4.17Å; Y1052-L1302 HydrophobicContact CE1-CB 4.3Å; Y1052-L1302 HydrophobicContact CE1-CD1 4.24Å
1053	V	59.9	Low	56.9	Low	7.4 Å²	7.4	51.2 Å²	51.2	5%	0.045	27%	0.267	C	S	.	.	I	π-helix	trans	-73.9	-41.3	-175	-179.5	0	0	0	0	111.6	F1048 L1049 R1050 S1055 A1056 A1057 T1127 S1130 A1131 T1133 I1134 I1291 F1293	F1048-V1053 HydrophobicContact CD1-CG2 4.19Å; F1048-V1053 HydrophobicContact CE1-CG2 3.87Å; F1048-V1053 HydrophobicContact CZ-CG2 3.97Å; F1048-V1053 PolarHBondContact O-N 2.85Å; L1049-V1053 HydrophobicContact CD2-CB 4.3Å; L1049-V1053 HydrophobicContact CD2-CG2 4.04Å; L1049-V1053 CarbonylContact O-C 3.32Å; L1049-V1053 WeakPolarHBondContact O-CB 3.29Å; L1049-V1053 WeakPolarHBondContact O-CG2 3.37Å; L1049-V1053 PolarHBondContact O-N 3.14Å; R1050-V1053 PolarHBondContact O-N 2.98Å; V1053-S1055 VanDerWaalsContact C-N 3.29Å; V1053-S1055 PolarHBondContact O-N 3.27Å; V1053-A1056 PolarHBondContact O-N 3.14Å; V1053-A1057 HydrophobicContact CB-CB 4.45Å; V1053-A1057 HydrophobicContact CG1-CB 3.38Å; V1053-A1057 VanDerWaalsContact O-CB 3.29Å; V1053-A1057 WeakPolarHBondContact O-CB 3.29Å; V1053-A1057 PolarHBondContact O-N 3.08Å; V1053-T1127 HydrophobicContact CG1-CG2 3.82Å; V1053-S1130 VanDerWaalsContact CG1-CB 3.44Å; V1053-A1131 HydrophobicContact CG1-CB 3.98Å; V1053-A1131 HydrophobicContact CG2-CB 4.43Å; V1053-T1133 HydrophobicContact CG1-CG2 4.17Å; V1053-I1134 HydrophobicContact CB-CD1 3.92Å; V1053-I1134 HydrophobicContact CG1-CD1 4.01Å; V1053-I1134 HydrophobicContact CG1-CG1 4.1Å; V1053-I1134 HydrophobicContact CG2-CD1 3.82Å; V1053-I1291 HydrophobicContact CG2-CD1 4.38Å; V1053-F1293 HydrophobicContact CG2-CE2 4.18Å; V1053-F1293 HydrophobicContact CG2-CZ 4.04Å
1054	Y	60	Low	58.8	Low	67 Å²	67	47.9 Å²	47.9	26%	0.263	25%	0.249	S	C	.	.	H	α-helix	trans	-62.6	-41.6	179.7	-154.2	-88.5	0	0	0	111.8	W784 L1049 R1050 A1056 A1057 C1058 L1065 A1131 I1134 S1135 W1141 S1144 I1235 I1238 R1281	W784-Y1054 HydrophobicContact CZ2-CE1 4.2Å; W784-Y1054 AromaticContact NE1-CE1 3.99Å; L1049-Y1054 WeakPolarHBondContact O-CB 3.46Å; L1049-Y1054 PolarHBondContact O-N 3.21Å; R1050-Y1054 HydrophobicContact CB-CD2 3.83Å; R1050-Y1054 HydrophobicContact CB-CE2 3.92Å; R1050-Y1054 HydrophobicContact CG-CD2 4.36Å; R1050-Y1054 HydrophobicContact CG-CE2 4Å; R1050-Y1054 WeakPolarHBondContact O-CA 3.06Å; R1050-Y1054 VanDerWaalsContact O-CB 3.28Å; R1050-Y1054 WeakPolarHBondContact O-CB 3.33Å; R1050-Y1054 WeakPolarHBondContact O-CD2 3.17Å; R1050-Y1054 PolarHBondContact O-N 3.04Å; Y1054-A1056 VanDerWaalsContact C-N 3.32Å; Y1054-A1056 PolarHBondContact O-N 3.2Å; Y1054-A1057 WeakPolarHBondContact O-CB 3.17Å; Y1054-A1057 PolarHBondContact O-N 3.2Å; Y1054-C1058 VanDerWaalsContact CD1-SG 3.57Å; Y1054-C1058 WeakPolarHBondContact CD1-SG 3.38Å; Y1054-C1058 VanDerWaalsContact CE1-SG 3.56Å; Y1054-C1058 WeakPolarHBondContact CE1-SG 3.42Å; Y1054-C1058 WeakPolarHBondContact O-CB 3.35Å; Y1054-C1058 PolarHBondContact O-N 3.07Å; Y1054-C1058 PolarHBondContact O-SG 3.14Å; Y1054-C1058 VanDerWaalsContact O-SG 3.33Å; Y1054-L1065 HydrophobicContact CE2-CD2 4.17Å; Y1054-A1131 HydrophobicContact CD2-CB 3.91Å; Y1054-I1134 HydrophobicContact CD2-CB 3.91Å; Y1054-I1134 HydrophobicContact CD2-CD1 4.02Å; Y1054-I1134 HydrophobicContact CD2-CG1 4.39Å; Y1054-I1134 HydrophobicContact CD2-CG2 3.97Å; Y1054-I1134 HydrophobicContact CE2-CD1 4.38Å; Y1054-I1134 HydrophobicContact CE2-CG2 4.34Å; Y1054-I1134 HydrophobicContact CG-CB 4.29Å; Y1054-I1134 HydrophobicContact CG-CD1 4.34Å; Y1054-I1134 HydrophobicContact CG-CG2 3.98Å; Y1054-S1135 WeakPolarHBondContact CE2-OG 3.49Å; Y1054-W1141 HydrophobicContact CD2-CE3 4.34Å; Y1054-W1141 HydrophobicContact CE2-CB 4.22Å; Y1054-W1141 AromaticContact CE2-CE3 3.78Å; Y1054-W1141 HydrophobicContact CE2-CE3 3.99Å; Y1054-S1144 PolarHBondContact OH-OG 3.46Å; Y1054-I1235 HydrophobicContact CD1-CG1 4.23Å; Y1054-I1238 HydrophobicContact CE1-CD1 4.18Å; Y1054-R1281 PolarHBondContact OH-NH1 3.49Å
1055	S	56.5	Low	60.3	Low	38.4 Å²	38.4	44.3 Å²	44.3	27%	0.269	23%	0.23	S	C	.	.	H	α-helix	trans	-62.2	-43	175.7	-91.4	0	0	0	0	112.7	R1050 E1051 Y1052 V1053 C1058 A1059 S1231 A1232 I1235	R1050-S1055 PolarHBondContact O-OG 3.32Å; E1051-S1055 VanDerWaalsContact O-CB 3.28Å; E1051-S1055 WeakPolarHBondContact O-CB 3.24Å; E1051-S1055 PolarHBondContact O-N 3.12Å; E1051-S1055 PolarHBondContact O-OG 2.96Å; Y1052-S1055 WeakPolarHBondContact O-CB 3.32Å; Y1052-S1055 PolarHBondContact O-N 3.37Å; Y1052-S1055 PolarHBondContact O-OG 2.8Å; V1053-S1055 VanDerWaalsContact C-N 3.29Å; V1053-S1055 PolarHBondContact O-N 3.27Å; S1055-C1058 PolarHBondContact O-N 3.36Å; S1055-A1059 WeakPolarHBondContact O-CB 3.38Å; S1055-A1059 PolarHBondContact O-N 2.95Å; S1055-S1231 VanDerWaalsContact CB-OG 3.24Å; S1055-S1231 WeakPolarHBondContact CB-OG 3.03Å; S1055-S1231 WeakPolarHBondContact OG-CA 3.3Å; S1055-S1231 WeakPolarHBondContact OG-CB 2.83Å; S1055-S1231 PolarHBondContact OG-O 3.31Å; S1055-S1231 PolarHBondContact OG-OG 3.37Å; S1055-A1232 PolarHBondContact OG-N 3.34Å; S1055-I1235 WeakPolarHBondContact OG-CD1 3.43Å
1056	A	58.7	Low	61.9	Low	14.2 Å²	14.2	43.9 Å²	43.9	12%	0.117	23%	0.225	C	C	.	.	H	α-helix	trans	-74.1	-39.4	179.8	0	0	0	0	0	112.3	Y1052 V1053 Y1054 C1058 A1059 I1060 T1127 S1130 L1297	Y1052-A1056 WeakPolarHBondContact O-CB 3.08Å; Y1052-A1056 PolarHBondContact O-N 3.17Å; V1053-A1056 PolarHBondContact O-N 3.14Å; Y1054-A1056 VanDerWaalsContact C-N 3.32Å; Y1054-A1056 PolarHBondContact O-N 3.2Å; A1056-C1058 VanDerWaalsContact C-N 3.33Å; A1056-C1058 PolarHBondContact O-N 3.41Å; A1056-A1059 WeakPolarHBondContact O-CB 3.4Å; A1056-A1059 PolarHBondContact O-N 3.05Å; A1056-I1060 HydrophobicContact CB-CD1 4.21Å; A1056-I1060 VanDerWaalsContact O-CB 3.26Å; A1056-I1060 WeakPolarHBondContact O-CB 3.43Å; A1056-I1060 WeakPolarHBondContact O-CD1 3.43Å; A1056-I1060 VanDerWaalsContact O-CG1 3.26Å; A1056-I1060 WeakPolarHBondContact O-CG1 3.23Å; A1056-I1060 PolarHBondContact O-N 3.25Å; A1056-T1127 HydrophobicContact CB-CG2 3.58Å; A1056-T1127 WeakPolarHBondContact O-CA 3.41Å; A1056-T1127 WeakPolarHBondContact O-CB 3.5Å; A1056-T1127 VanDerWaalsContact O-CG2 3.3Å; A1056-T1127 WeakPolarHBondContact O-CG2 3.25Å; A1056-T1127 PolarHBondContact O-OG1 2.93Å; A1056-T1127 VanDerWaalsContact O-OG1 3.1Å; A1056-S1130 WeakPolarHBondContact CB-OG 3.39Å; A1056-L1297 HydrophobicContact CB-CD2 4.39Å
1057	A	60.9	Low	63.3	Low	4.4 Å²	4.4	43.8 Å²	43.8	4%	0.036	22%	0.224	C	C	.	.	H	α-helix	trans	-67.6	-37.8	178.7	0	0	0	0	0	113	V1053 Y1054 A1059 I1060 G1061 L1065 T1127 A1131 I1134 W1141	V1053-A1057 HydrophobicContact CB-CB 4.45Å; V1053-A1057 HydrophobicContact CG1-CB 3.38Å; V1053-A1057 VanDerWaalsContact O-CB 3.29Å; V1053-A1057 WeakPolarHBondContact O-CB 3.29Å; V1053-A1057 PolarHBondContact O-N 3.08Å; Y1054-A1057 WeakPolarHBondContact O-CB 3.17Å; Y1054-A1057 PolarHBondContact O-N 3.2Å; A1057-A1059 PolarHBondContact O-N 3.16Å; A1057-A1059 VanDerWaalsContact O-N 3.13Å; A1057-I1060 WeakPolarHBondContact O-CB 3.36Å; A1057-I1060 VanDerWaalsContact O-CG2 3.26Å; A1057-I1060 WeakPolarHBondContact O-CG2 3.35Å; A1057-I1060 PolarHBondContact O-N 3.22Å; A1057-I1060 VanDerWaalsContact O-N 3.09Å; A1057-G1061 CarbonylContact O-C 3.27Å; A1057-G1061 VanDerWaalsContact O-C 3.3Å; A1057-G1061 PolarHBondContact O-N 2.93Å; A1057-G1061 VanDerWaalsContact O-N 3.16Å; A1057-L1065 HydrophobicContact CB-CD2 4.16Å; A1057-T1127 HydrophobicContact CB-CG2 4.25Å; A1057-A1131 HydrophobicContact CB-CB 4.1Å; A1057-I1134 HydrophobicContact CB-CB 4.48Å; A1057-I1134 HydrophobicContact CB-CD1 3.31Å; A1057-I1134 VanDerWaalsContact CB-CD1 3.43Å; A1057-I1134 HydrophobicContact CB-CG1 3.96Å; A1057-W1141 HydrophobicContact CB-CH2 4.05Å; A1057-W1141 HydrophobicContact CB-CZ2 4.38Å; A1057-W1141 HydrophobicContact CB-CZ3 4.07Å
1058	C	61.9	Low	64.7	Low	50.8 Å²	50.8	39.1 Å²	39.1	34%	0.343	20%	0.202	S	C	.	.	H	α-helix	trans	-63.9	-22.4	177.6	-71.5	0	0	0	0	113.5	Y1054 S1055 A1056 I1060 T1234 I1238 R1281	Y1054-C1058 VanDerWaalsContact CD1-SG 3.57Å; Y1054-C1058 WeakPolarHBondContact CD1-SG 3.38Å; Y1054-C1058 VanDerWaalsContact CE1-SG 3.56Å; Y1054-C1058 WeakPolarHBondContact CE1-SG 3.42Å; Y1054-C1058 WeakPolarHBondContact O-CB 3.35Å; Y1054-C1058 PolarHBondContact O-N 3.07Å; Y1054-C1058 PolarHBondContact O-SG 3.14Å; Y1054-C1058 VanDerWaalsContact O-SG 3.33Å; S1055-C1058 PolarHBondContact O-N 3.36Å; A1056-C1058 VanDerWaalsContact C-N 3.33Å; A1056-C1058 PolarHBondContact O-N 3.41Å; C1058-I1060 VanDerWaalsContact C-N 3.28Å; C1058-I1060 PolarHBondContact O-N 3.07Å; C1058-T1234 HydrophobicContact CB-CG2 3.62Å; C1058-I1238 HydrophobicContact CB-CD1 3.78Å; C1058-I1238 WeakPolarHBondContact SG-CD1 3.41Å; C1058-R1281 PolarHBondContact SG-NH2 3.49Å
1059	A	61.9	Low	66.1	Low	54 Å²	54	37.3 Å²	37.3	45%	0.446	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-20.6	179.5	0	0	0	0	0	113.5	S1055 A1056 A1057 T1127 A1440 A1441 S1444	S1055-A1059 WeakPolarHBondContact O-CB 3.38Å; S1055-A1059 PolarHBondContact O-N 2.95Å; A1056-A1059 WeakPolarHBondContact O-CB 3.4Å; A1056-A1059 PolarHBondContact O-N 3.05Å; A1057-A1059 PolarHBondContact O-N 3.16Å; A1057-A1059 VanDerWaalsContact O-N 3.13Å; A1059-T1127 HydrophobicContact CB-CG2 4.12Å; A1059-A1440 WeakPolarHBondContact O-CB 3.11Å; A1059-A1441 WeakPolarHBondContact O-CA 3.33Å; A1059-A1441 PolarHBondContact O-N 3.33Å; A1059-S1444 WeakPolarHBondContact CB-OG 3.31Å
1060	I	65.4	Low	67.4	Low	17.6 Å²	17.6	41.4 Å²	41.4	9%	0.09	21%	0.213	C	C	.	.			trans	-81.9	111.5	-171.5	-122.6	169.3	0	0	0	112.5	A1056 A1057 C1058 H1064 L1065 V1068 T1127 Y1128 A1131 W1141 Y1142 L1433 E1437 A1441 P1474	A1056-I1060 HydrophobicContact CB-CD1 4.21Å; A1056-I1060 VanDerWaalsContact O-CB 3.26Å; A1056-I1060 WeakPolarHBondContact O-CB 3.43Å; A1056-I1060 WeakPolarHBondContact O-CD1 3.43Å; A1056-I1060 VanDerWaalsContact O-CG1 3.26Å; A1056-I1060 WeakPolarHBondContact O-CG1 3.23Å; A1056-I1060 PolarHBondContact O-N 3.25Å; A1057-I1060 WeakPolarHBondContact O-CB 3.36Å; A1057-I1060 VanDerWaalsContact O-CG2 3.26Å; A1057-I1060 WeakPolarHBondContact O-CG2 3.35Å; A1057-I1060 PolarHBondContact O-N 3.22Å; A1057-I1060 VanDerWaalsContact O-N 3.09Å; C1058-I1060 VanDerWaalsContact C-N 3.28Å; C1058-I1060 PolarHBondContact O-N 3.07Å; I1060-H1064 HydrophobicContact CD1-CB 4.25Å; I1060-H1064 HydrophobicContact CG1-CB 3.86Å; I1060-L1065 HydrophobicContact CD1-CB 4.05Å; I1060-L1065 HydrophobicContact CD1-CD1 4.34Å; I1060-L1065 HydrophobicContact CG1-CB 4.23Å; I1060-L1065 HydrophobicContact CG2-CB 3.95Å; I1060-L1065 HydrophobicContact CG2-CD1 4.39Å; I1060-L1065 HydrophobicContact CG2-CD2 4.17Å; I1060-L1065 HydrophobicContact CG2-CG 4.37Å; I1060-V1068 HydrophobicContact CD1-CG1 4.38Å; I1060-T1127 HydrophobicContact CB-CG2 3.63Å; I1060-T1127 HydrophobicContact CD1-CG2 4.48Å; I1060-T1127 HydrophobicContact CG1-CG2 4.12Å; I1060-T1127 VanDerWaalsContact N-CG2 3.3Å; I1060-Y1128 HydrophobicContact CD1-CD1 3.76Å; I1060-Y1128 HydrophobicContact CD1-CD2 4.34Å; I1060-Y1128 HydrophobicContact CD1-CE1 4.31Å; I1060-Y1128 HydrophobicContact CD1-CG 4.32Å; I1060-A1131 HydrophobicContact CB-CB 4.05Å; I1060-A1131 HydrophobicContact CD1-CB 3.55Å; I1060-A1131 VanDerWaalsContact CD1-CB 3.4Å; I1060-A1131 HydrophobicContact CG1-CB 4.35Å; I1060-A1131 HydrophobicContact CG2-CB 3.73Å; I1060-W1141 HydrophobicContact CG2-CH2 4.33Å; I1060-Y1142 HydrophobicContact CG2-CE2 4.3Å; I1060-L1433 HydrophobicContact CG2-CD1 4.27Å; I1060-L1433 HydrophobicContact CG2-CD2 4.04Å; I1060-L1433 WeakPolarHBondContact O-CD2 3.27Å; I1060-E1437 VanDerWaalsContact O-CB 3.3Å; I1060-E1437 WeakPolarHBondContact O-CB 3.24Å; I1060-E1437 WeakPolarHBondContact O-CG 3.48Å; I1060-A1441 HydrophobicContact CG1-CB 4.28Å; I1060-A1441 HydrophobicContact CG2-CB 3.82Å; I1060-P1474 HydrophobicContact CD1-CB 4.15Å; I1060-P1474 HydrophobicContact CG2-CB 4.13Å; I1060-P1474 HydrophobicContact CG2-CG 3.72Å
1061	G	65.3	Low	68.7	Low	12.8 Å²	12.8	37 Å²	37	13%	0.132	20%	0.2	C	C	.	.			trans	-100.2	123.5	172.2	0	0	0	0	0	112.4	A1057 R1063 H1064 L1065	A1057-G1061 CarbonylContact O-C 3.27Å; A1057-G1061 VanDerWaalsContact O-C 3.3Å; A1057-G1061 PolarHBondContact O-N 2.93Å; A1057-G1061 VanDerWaalsContact O-N 3.16Å; G1061-R1063 VanDerWaalsContact C-N 3.28Å; G1061-R1063 PolarHBondContact O-N 3.07Å; G1061-R1063 VanDerWaalsContact O-N 3.15Å; G1061-H1064 WeakPolarHBondContact O-CB 3.37Å; G1061-H1064 PolarHBondContact O-N 2.79Å; G1061-H1064 VanDerWaalsContact O-N 3.12Å; G1061-L1065 PolarHBondContact O-N 3.19Å; G1061-L1065 VanDerWaalsContact O-N 3.1Å
1062	P	68.9	Low	70.1	Confident	60.2 Å²	60.2	33.5 Å²	33.5	39%	0.391	18%	0.183	S	C	.	.	H	α-helix	trans	-59	-30.9	178.9	3.4	-6.7	0	0	0	113.6	A662 R664 L1066 Y1142	A662-P1062 CarbonylContact O-C 3.53Å; R664-P1062 HydrophobicContact CG-CG 4.14Å; R664-P1062 VanDerWaalsContact NE-CG 3.35Å; P1062-L1066 VanDerWaalsContact O-CB 3.26Å; P1062-L1066 WeakPolarHBondContact O-CB 3.4Å; P1062-L1066 PolarHBondContact O-N 3.13Å; P1062-L1066 VanDerWaalsContact O-N 3.12Å; P1062-Y1142 HydrophobicContact CG-CE1 4.45Å; P1062-Y1142 WeakPolarHBondContact CG-OH 3.21Å
1063	R	75.2	Confident	71.3	Confident	85.4 Å²	85.4	34.3 Å²	34.3	32%	0.322	19%	0.192	S	C	.	.	H	α-helix	trans	-64.7	-51.9	175.5	-177.9	-179	79.3	111.8	-7.8	111.7	A662 Y663 G1061 L1065 L1066 E1067 S1431 G1432 E1437	A662-R1063 VanDerWaalsContact O-CA 3.28Å; A662-R1063 WeakPolarHBondContact O-CA 3.26Å; A662-R1063 WeakPolarHBondContact O-CB 3.28Å; A662-R1063 PolarHBondContact O-N 3.24Å; Y663-R1063 HydrophobicContact CD1-CG 3.7Å; Y663-R1063 HydrophobicContact CE1-CG 3.75Å; Y663-R1063 HydrophobicContact CG-CG 4.35Å; G1061-R1063 VanDerWaalsContact C-N 3.28Å; G1061-R1063 PolarHBondContact O-N 3.07Å; G1061-R1063 VanDerWaalsContact O-N 3.15Å; R1063-L1065 VanDerWaalsContact C-N 3.29Å; R1063-L1065 PolarHBondContact O-N 3.01Å; R1063-L1066 WeakPolarHBondContact O-CB 3.44Å; R1063-L1066 PolarHBondContact O-N 3.06Å; R1063-L1066 VanDerWaalsContact O-N 3.1Å; R1063-E1067 HydrophobicContact CG-CG 4.44Å; R1063-E1067 WeakPolarHBondContact CG-OE1 3.34Å; R1063-E1067 IonicContact CZ-OE1 3.14Å; R1063-E1067 IonicContact NE-OE1 3.61Å; R1063-E1067 PolarHBondContact NE-OE1 3.03Å; R1063-E1067 IonicContact NH1-OE1 3.35Å; R1063-E1067 PolarHBondContact NH1-OE1 3.04Å; R1063-E1067 IonicContact NH1-OE2 3.04Å; R1063-E1067 IonicContact NH2-OE1 2.79Å; R1063-E1067 WeakPolarHBondContact O-CB 3.43Å; R1063-E1067 VanDerWaalsContact O-CG 3.31Å; R1063-E1067 WeakPolarHBondContact O-CG 3.37Å; R1063-E1067 PolarHBondContact O-N 2.92Å; R1063-S1431 PolarHBondContact NH1-OG 3.37Å; R1063-S1431 PolarHBondContact NH2-OG 3.17Å; R1063-G1432 PolarHBondContact NH2-O 2.97Å; R1063-E1437 WeakPolarHBondContact CB-OE1 3.24Å; R1063-E1437 IonicContact CZ-OE1 3.35Å; R1063-E1437 IonicContact CZ-OE2 3.97Å; R1063-E1437 IonicContact NE-OE1 3.52Å; R1063-E1437 PolarHBondContact NE-OE1 3.4Å; R1063-E1437 IonicContact NE-OE2 3.58Å; R1063-E1437 IonicContact NH2-OE1 3.45Å; R1063-E1437 IonicContact NH2-OE2 3.2Å; R1063-E1437 PolarHBondContact NH2-OE2 2.95Å
1064	H	76	Confident	72.3	Confident	19.8 Å²	19.8	35.8 Å²	35.8	9%	0.092	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-38	179.2	-63.3	130.5	0	0	0	112	I1060 G1061 L1066 E1067 V1068 Y1128 S1431 E1437	I1060-H1064 HydrophobicContact CD1-CB 4.25Å; I1060-H1064 HydrophobicContact CG1-CB 3.86Å; G1061-H1064 WeakPolarHBondContact O-CB 3.37Å; G1061-H1064 PolarHBondContact O-N 2.79Å; G1061-H1064 VanDerWaalsContact O-N 3.12Å; H1064-L1066 VanDerWaalsContact C-N 3.34Å; H1064-E1067 IonicContact CD2-OE2 3.5Å; H1064-E1067 PolarHBondContact O-N 3.08Å; H1064-V1068 VanDerWaalsContact O-CG2 3.27Å; H1064-V1068 WeakPolarHBondContact O-CG2 3.37Å; H1064-V1068 PolarHBondContact O-N 2.99Å; H1064-V1068 VanDerWaalsContact O-N 3.13Å; H1064-Y1128 HydrophobicContact CB-CD1 4.21Å; H1064-Y1128 HydrophobicContact CB-CE1 3.76Å; H1064-Y1128 VanDerWaalsContact CB-CE1 3.45Å; H1064-Y1128 HydrophobicContact CB-CE2 3.91Å; H1064-Y1128 VanDerWaalsContact CB-CZ 3.4Å; H1064-Y1128 WeakPolarHBondContact CB-OH 3.35Å; H1064-Y1128 AromaticContact CD2-CZ 3.88Å; H1064-Y1128 PolarHBondContact CD2-OH 3.18Å; H1064-Y1128 AromaticContact CG-CE2 3.96Å; H1064-Y1128 AromaticContact CG-CZ 3.89Å; H1064-Y1128 AromaticContact ND1-CZ 3.79Å; H1064-Y1128 PolarHBondContact ND1-OH 3.07Å; H1064-Y1128 VanDerWaalsContact ND1-OH 3.08Å; H1064-S1431 PolarHBondContact CE1-O 3.18Å; H1064-S1431 PolarHBondContact NE2-O 2.84Å; H1064-S1431 VanDerWaalsContact NE2-O 3.12Å; H1064-S1431 PolarHBondContact NE2-OG 3.05Å; H1064-S1431 VanDerWaalsContact NE2-OG 3.16Å; H1064-E1437 IonicContact CE1-OE1 2.99Å; H1064-E1437 IonicContact CE1-OE2 3.15Å; H1064-E1437 IonicContact NE2-OE2 3.65Å
1065	L	77.3	Confident	73.3	Confident	4.2 Å²	4.2	32.7 Å²	32.7	2%	0.022	19%	0.191	C	C	.	.	H	α-helix	trans	-62.4	-46.8	173.3	-178.7	56.1	0	0	0	111.5	Y1054 A1057 I1060 G1061 R1063 E1067 V1068 E1069 Y1128 A1131 W1141 Y1142 R1281	Y1054-L1065 HydrophobicContact CE2-CD2 4.17Å; A1057-L1065 HydrophobicContact CB-CD2 4.16Å; I1060-L1065 HydrophobicContact CD1-CB 4.05Å; I1060-L1065 HydrophobicContact CD1-CD1 4.34Å; I1060-L1065 HydrophobicContact CG1-CB 4.23Å; I1060-L1065 HydrophobicContact CG2-CB 3.95Å; I1060-L1065 HydrophobicContact CG2-CD1 4.39Å; I1060-L1065 HydrophobicContact CG2-CD2 4.17Å; I1060-L1065 HydrophobicContact CG2-CG 4.37Å; G1061-L1065 PolarHBondContact O-N 3.19Å; G1061-L1065 VanDerWaalsContact O-N 3.1Å; R1063-L1065 VanDerWaalsContact C-N 3.29Å; R1063-L1065 PolarHBondContact O-N 3.01Å; L1065-E1067 VanDerWaalsContact C-N 3.32Å; L1065-E1067 PolarHBondContact O-N 2.86Å; L1065-V1068 HydrophobicContact CD1-CG1 4.29Å; L1065-V1068 VanDerWaalsContact O-CG1 3.27Å; L1065-V1068 WeakPolarHBondContact O-CG1 3.31Å; L1065-V1068 PolarHBondContact O-N 3.11Å; L1065-E1069 HydrophobicContact CD1-CG 4.19Å; L1065-E1069 HydrophobicContact CG-CG 4.3Å; L1065-E1069 WeakPolarHBondContact O-CB 3.37Å; L1065-E1069 VanDerWaalsContact O-CG 3.3Å; L1065-E1069 WeakPolarHBondContact O-CG 3.41Å; L1065-E1069 PolarHBondContact O-N 3.21Å; L1065-E1069 VanDerWaalsContact O-N 3.09Å; L1065-Y1128 HydrophobicContact CB-CD1 4.4Å; L1065-A1131 HydrophobicContact CD1-CB 3.75Å; L1065-A1131 HydrophobicContact CD2-CB 4.41Å; L1065-W1141 HydrophobicContact CD1-CZ2 4.05Å; L1065-W1141 HydrophobicContact CD2-CH2 4.05Å; L1065-W1141 HydrophobicContact CD2-CZ2 3.98Å; L1065-Y1142 HydrophobicContact CD2-CD1 3.42Å; L1065-Y1142 VanDerWaalsContact CD2-CD1 3.42Å; L1065-Y1142 HydrophobicContact CD2-CD2 4.05Å; L1065-Y1142 HydrophobicContact CD2-CE1 3.79Å; L1065-Y1142 HydrophobicContact CD2-CE2 4.03Å; L1065-Y1142 HydrophobicContact CD2-CG 3.34Å; L1065-R1281 VanDerWaalsContact CG-NH1 3.27Å
1066	L	78.1	Confident	74.4	Confident	39.6 Å²	39.6	33.2 Å²	33.2	21%	0.207	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-41.2	176.7	-175.9	67.3	0	0	0	111.9	K659 A662 P1062 R1063 H1064 V1068 E1069 Q1070 R1281	K659-L1066 HydrophobicContact CG-CD2 4.34Å; A662-L1066 HydrophobicContact CB-CB 4.06Å; A662-L1066 HydrophobicContact CB-CD2 3.56Å; A662-L1066 HydrophobicContact CB-CG 4.46Å; P1062-L1066 VanDerWaalsContact O-CB 3.26Å; P1062-L1066 WeakPolarHBondContact O-CB 3.4Å; P1062-L1066 PolarHBondContact O-N 3.13Å; P1062-L1066 VanDerWaalsContact O-N 3.12Å; R1063-L1066 WeakPolarHBondContact O-CB 3.44Å; R1063-L1066 PolarHBondContact O-N 3.06Å; R1063-L1066 VanDerWaalsContact O-N 3.1Å; H1064-L1066 VanDerWaalsContact C-N 3.34Å; L1066-V1068 PolarHBondContact O-N 3.15Å; L1066-E1069 PolarHBondContact O-N 3.08Å; L1066-Q1070 HydrophobicContact CD1-CG 4.29Å; L1066-Q1070 HydrophobicContact CG-CG 4.35Å; L1066-Q1070 VanDerWaalsContact O-CB 3.31Å; L1066-Q1070 WeakPolarHBondContact O-CB 3.34Å; L1066-Q1070 VanDerWaalsContact O-CG 3.24Å; L1066-Q1070 WeakPolarHBondContact O-CG 3.38Å; L1066-Q1070 PolarHBondContact O-N 3.13Å; L1066-R1281 HydrophobicContact CD1-CG 4.21Å
1067	E	80.1	Confident	75.4	Confident	48.8 Å²	48.8	36.8 Å²	36.8	23%	0.228	21%	0.206	C	C	.	.	H	α-helix	trans	-60.2	-45.2	176.9	-75.6	171.2	-171.4	0	0	111.7	R1063 H1064 L1065 Q1070 A1071 Y1128 I1190 L1428	R1063-E1067 HydrophobicContact CG-CG 4.44Å; R1063-E1067 WeakPolarHBondContact CG-OE1 3.34Å; R1063-E1067 IonicContact CZ-OE1 3.14Å; R1063-E1067 IonicContact NE-OE1 3.61Å; R1063-E1067 PolarHBondContact NE-OE1 3.03Å; R1063-E1067 IonicContact NH1-OE1 3.35Å; R1063-E1067 PolarHBondContact NH1-OE1 3.04Å; R1063-E1067 IonicContact NH1-OE2 3.04Å; R1063-E1067 IonicContact NH2-OE1 2.79Å; R1063-E1067 WeakPolarHBondContact O-CB 3.43Å; R1063-E1067 VanDerWaalsContact O-CG 3.31Å; R1063-E1067 WeakPolarHBondContact O-CG 3.37Å; R1063-E1067 PolarHBondContact O-N 2.92Å; H1064-E1067 IonicContact CD2-OE2 3.5Å; H1064-E1067 PolarHBondContact O-N 3.08Å; L1065-E1067 VanDerWaalsContact C-N 3.32Å; L1065-E1067 PolarHBondContact O-N 2.86Å; E1067-Q1070 PolarHBondContact O-N 3.46Å; E1067-A1071 VanDerWaalsContact O-CB 3.26Å; E1067-A1071 WeakPolarHBondContact O-CB 3.3Å; E1067-A1071 PolarHBondContact O-N 3.3Å; E1067-Y1128 PolarHBondContact OE2-OH 3.43Å; E1067-I1190 HydrophobicContact CG-CD1 4.4Å; E1067-L1428 HydrophobicContact CB-CD1 4.34Å
1068	V	80	Confident	76.3	Confident	4.2 Å²	4.2	41 Å²	41	3%	0.025	22%	0.221	C	C	.	.	H	α-helix	trans	-68.7	-40.1	178.1	135.3	0	0	0	0	111.9	I1060 H1064 L1065 L1066 A1071 F1072 L1115 I1117 Y1128 L1132 L1428	I1060-V1068 HydrophobicContact CD1-CG1 4.38Å; H1064-V1068 VanDerWaalsContact O-CG2 3.27Å; H1064-V1068 WeakPolarHBondContact O-CG2 3.37Å; H1064-V1068 PolarHBondContact O-N 2.99Å; H1064-V1068 VanDerWaalsContact O-N 3.13Å; L1065-V1068 HydrophobicContact CD1-CG1 4.29Å; L1065-V1068 VanDerWaalsContact O-CG1 3.27Å; L1065-V1068 WeakPolarHBondContact O-CG1 3.31Å; L1065-V1068 PolarHBondContact O-N 3.11Å; L1066-V1068 PolarHBondContact O-N 3.15Å; V1068-A1071 PolarHBondContact O-N 3.25Å; V1068-F1072 WeakPolarHBondContact O-CB 3.26Å; V1068-F1072 PolarHBondContact O-N 3.12Å; V1068-L1115 HydrophobicContact CG2-CD2 4.44Å; V1068-I1117 HydrophobicContact CG1-CD1 3.99Å; V1068-I1117 HydrophobicContact CG2-CD1 4.08Å; V1068-Y1128 HydrophobicContact CB-CD1 3.88Å; V1068-Y1128 HydrophobicContact CB-CE1 4.22Å; V1068-Y1128 HydrophobicContact CG1-CD1 4.41Å; V1068-Y1128 HydrophobicContact CG2-CD1 3.78Å; V1068-Y1128 HydrophobicContact CG2-CE1 3.67Å; V1068-Y1128 HydrophobicContact CG2-CG 4.39Å; V1068-L1132 HydrophobicContact CG1-CB 4.18Å; V1068-L1132 HydrophobicContact CG1-CD1 4.2Å; V1068-L1132 HydrophobicContact CG1-CD2 3.84Å; V1068-L1132 HydrophobicContact CG1-CG 4.23Å; V1068-L1132 HydrophobicContact CG2-CB 4.05Å; V1068-L1132 HydrophobicContact CG2-CD1 4.44Å; V1068-L1132 HydrophobicContact CG2-CD2 4.09Å; V1068-L1132 HydrophobicContact CG2-CG 4.42Å; V1068-L1428 HydrophobicContact CB-CD2 4.14Å; V1068-L1428 HydrophobicContact CG2-CD2 3.65Å; V1068-L1428 VanDerWaalsContact CG2-CD2 3.46Å
1069	E	80.8	Confident	77.1	Confident	4.2 Å²	4.2	38.7 Å²	38.7	2%	0.02	21%	0.206	C	C	.	.	H	α-helix	trans	-63.8	-44.3	176	-75.2	-178.4	163.7	0	0	111.8	L1065 L1066 A1071 F1072 N1073 L1132 S1135 R1281 P1282 F1284	L1065-E1069 HydrophobicContact CD1-CG 4.19Å; L1065-E1069 HydrophobicContact CG-CG 4.3Å; L1065-E1069 WeakPolarHBondContact O-CB 3.37Å; L1065-E1069 VanDerWaalsContact O-CG 3.3Å; L1065-E1069 WeakPolarHBondContact O-CG 3.41Å; L1065-E1069 PolarHBondContact O-N 3.21Å; L1065-E1069 VanDerWaalsContact O-N 3.09Å; L1066-E1069 PolarHBondContact O-N 3.08Å; E1069-A1071 VanDerWaalsContact C-N 3.32Å; E1069-F1072 PolarHBondContact O-N 3.01Å; E1069-N1073 WeakPolarHBondContact O-CB 3.47Å; E1069-N1073 PolarHBondContact O-N 3.17Å; E1069-N1073 VanDerWaalsContact O-N 3.09Å; E1069-L1132 HydrophobicContact CG-CD1 4.42Å; E1069-S1135 VanDerWaalsContact OE1-CB 3.23Å; E1069-S1135 WeakPolarHBondContact OE1-CB 3.4Å; E1069-S1135 PolarHBondContact OE1-OG 3.28Å; E1069-R1281 IonicContact OE1-CZ 3.79Å; E1069-R1281 IonicContact OE1-NE 3.95Å; E1069-R1281 PolarHBondContact OE1-NE 3.31Å; E1069-R1281 IonicContact OE1-NH1 2.9Å; E1069-R1281 PolarHBondContact OE1-NH1 3.2Å; E1069-R1281 VanDerWaalsContact OE1-NH1 3.12Å; E1069-R1281 IonicContact OE1-NH2 3.57Å; E1069-R1281 PolarHBondContact OE1-NH2 2.86Å; E1069-R1281 WeakPolarHBondContact OE2-CD 3.47Å; E1069-R1281 WeakPolarHBondContact OE2-CG 3.33Å; E1069-R1281 IonicContact OE2-CZ 2.93Å; E1069-R1281 IonicContact OE2-NE 3.45Å; E1069-R1281 PolarHBondContact OE2-NE 3.38Å; E1069-R1281 IonicContact OE2-NH1 3.16Å; E1069-R1281 PolarHBondContact OE2-NH1 2.81Å; E1069-R1281 IonicContact OE2-NH2 3.44Å; E1069-P1282 HydrophobicContact CB-CG 3.72Å; E1069-F1284 HydrophobicContact CB-CE2 4.18Å; E1069-F1284 HydrophobicContact CB-CZ 3.83Å; E1069-F1284 HydrophobicContact CG-CE2 3.95Å; E1069-F1284 HydrophobicContact CG-CZ 4.06Å; E1069-F1284 VanDerWaalsContact O-CZ 3.28Å; E1069-F1284 WeakPolarHBondContact O-CZ 3.27Å
1070	Q	82.6	Confident	77.9	Confident	94.6 Å²	94.6	42.5 Å²	42.5	44%	0.442	21%	0.209	S	C	.	.	H	α-helix	trans	-65.4	-41.7	175.6	-74.1	177	-5.7	0	0	111.8	L1066 E1067 F1072 N1073 S1074	L1066-Q1070 HydrophobicContact CD1-CG 4.29Å; L1066-Q1070 HydrophobicContact CG-CG 4.35Å; L1066-Q1070 VanDerWaalsContact O-CB 3.31Å; L1066-Q1070 WeakPolarHBondContact O-CB 3.34Å; L1066-Q1070 VanDerWaalsContact O-CG 3.24Å; L1066-Q1070 WeakPolarHBondContact O-CG 3.38Å; L1066-Q1070 PolarHBondContact O-N 3.13Å; E1067-Q1070 PolarHBondContact O-N 3.46Å; Q1070-F1072 VanDerWaalsContact C-N 3.34Å; Q1070-F1072 PolarHBondContact O-N 2.89Å; Q1070-N1073 WeakPolarHBondContact O-CB 3.43Å; Q1070-N1073 PolarHBondContact O-N 3.11Å; Q1070-N1073 VanDerWaalsContact O-N 3.15Å; Q1070-S1074 WeakPolarHBondContact O-CB 3.21Å; Q1070-S1074 PolarHBondContact O-N 2.91Å; Q1070-S1074 PolarHBondContact O-OG 3.11Å; Q1070-S1074 VanDerWaalsContact O-OG 3.09Å
1071	A	81.7	Confident	78.5	Confident	13.8 Å²	13.8	48.5 Å²	48.5	11%	0.114	23%	0.23	C	C	.	.	H	α-helix	trans	-60.5	-45	176.2	0	0	0	0	0	111.1	E1067 V1068 E1069 N1073 S1074 L1075 L1115 L1428	E1067-A1071 VanDerWaalsContact O-CB 3.26Å; E1067-A1071 WeakPolarHBondContact O-CB 3.3Å; E1067-A1071 PolarHBondContact O-N 3.3Å; V1068-A1071 PolarHBondContact O-N 3.25Å; E1069-A1071 VanDerWaalsContact C-N 3.32Å; A1071-N1073 VanDerWaalsContact C-N 3.31Å; A1071-N1073 PolarHBondContact O-N 3.17Å; A1071-S1074 WeakPolarHBondContact CA-OG 3.38Å; A1071-S1074 PolarHBondContact O-N 3.08Å; A1071-S1074 PolarHBondContact O-OG 3.24Å; A1071-L1075 PolarHBondContact O-N 3Å; A1071-L1115 HydrophobicContact CB-CD1 3.83Å; A1071-L1115 HydrophobicContact CB-CD2 4.33Å; A1071-L1428 HydrophobicContact CB-CB 4.34Å; A1071-L1428 HydrophobicContact CB-CD1 4.34Å; A1071-L1428 HydrophobicContact CB-CD2 4.07Å; A1071-L1428 HydrophobicContact CB-CG 4.43Å
1072	F	83.5	Confident	79.1	Confident	1.8 Å²	1.8	48.3 Å²	48.3	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-62.4	-40	175.2	-170.6	-88.3	0	0	0	112.3	V1068 E1069 Q1070 S1074 L1075 L1115 L1132 L1136 F1284 H1287 A1378 R1404 V1406	V1068-F1072 WeakPolarHBondContact O-CB 3.26Å; V1068-F1072 PolarHBondContact O-N 3.12Å; E1069-F1072 PolarHBondContact O-N 3.01Å; Q1070-F1072 VanDerWaalsContact C-N 3.34Å; Q1070-F1072 PolarHBondContact O-N 2.89Å; F1072-S1074 VanDerWaalsContact C-N 3.3Å; F1072-S1074 PolarHBondContact O-N 3.02Å; F1072-L1075 HydrophobicContact CD2-CD1 3.8Å; F1072-L1075 HydrophobicContact CE2-CD1 4.11Å; F1072-L1075 HydrophobicContact CG-CD1 4.26Å; F1072-L1075 VanDerWaalsContact O-CB 3.27Å; F1072-L1075 WeakPolarHBondContact O-CB 3.39Å; F1072-L1075 WeakPolarHBondContact O-CD1 3.19Å; F1072-L1075 WeakPolarHBondContact O-CG 3.19Å; F1072-L1075 PolarHBondContact O-N 3.16Å; F1072-L1115 HydrophobicContact CB-CD2 4.25Å; F1072-L1115 HydrophobicContact CD2-CD2 4.33Å; F1072-L1132 HydrophobicContact CB-CD1 3.95Å; F1072-L1132 HydrophobicContact CB-CD2 4.43Å; F1072-L1132 HydrophobicContact CD2-CD1 4.3Å; F1072-L1132 HydrophobicContact CD2-CD2 3.98Å; F1072-L1132 HydrophobicContact CD2-CG 4.44Å; F1072-L1132 HydrophobicContact CE2-CD2 4.49Å; F1072-L1132 HydrophobicContact CG-CD1 4.13Å; F1072-L1132 HydrophobicContact CG-CD2 4.42Å; F1072-L1136 HydrophobicContact CD1-CD2 3.75Å; F1072-L1136 HydrophobicContact CD2-CD1 4.45Å; F1072-L1136 HydrophobicContact CE1-CD1 4.36Å; F1072-L1136 HydrophobicContact CE1-CD2 3.31Å; F1072-L1136 VanDerWaalsContact CE1-CD2 3.42Å; F1072-L1136 HydrophobicContact CE1-CG 4.45Å; F1072-L1136 HydrophobicContact CE2-CD1 3.96Å; F1072-L1136 HydrophobicContact CE2-CD2 4.36Å; F1072-L1136 HydrophobicContact CG-CD2 4.43Å; F1072-L1136 HydrophobicContact CZ-CD1 3.85Å; F1072-L1136 HydrophobicContact CZ-CD2 3.65Å; F1072-L1136 VanDerWaalsContact CZ-CD2 3.5Å; F1072-L1136 HydrophobicContact CZ-CG 4.39Å; F1072-F1284 HydrophobicContact CB-CE1 4.33Å; F1072-F1284 HydrophobicContact CB-CZ 4.36Å; F1072-F1284 AromaticContact CD1-CD1 3.8Å; F1072-F1284 HydrophobicContact CD1-CD1 3.8Å; F1072-F1284 AromaticContact CD1-CE1 3.57Å; F1072-F1284 HydrophobicContact CD1-CE1 3.57Å; F1072-F1284 VanDerWaalsContact CD1-CE1 3.49Å; F1072-F1284 HydrophobicContact CD1-CZ 4.34Å; F1072-F1284 HydrophobicContact CE1-CD1 4.19Å; F1072-F1284 HydrophobicContact CE1-CE1 4.36Å; F1072-F1284 HydrophobicContact CG-CE1 4.37Å; F1072-H1287 AromaticContact CE1-CE1 3.79Å; F1072-H1287 AromaticContact CE1-NE2 3.84Å; F1072-H1287 AromaticContact CZ-NE2 3.81Å; F1072-A1378 HydrophobicContact CE2-CB 4.5Å; F1072-A1378 HydrophobicContact CZ-CB 4.31Å; F1072-R1404 VanDerWaalsContact CE1-NH1 3.3Å; F1072-R1404 HydrophobicContact CE2-CB 4.46Å; F1072-R1404 HydrophobicContact CZ-CB 4.47Å; F1072-R1404 PolarHBondContact O-NH1 3.19Å; F1072-V1406 HydrophobicContact CD2-CG2 3.85Å; F1072-V1406 HydrophobicContact CE2-CG2 3.81Å
1073	N	81.8	Confident	79.5	Confident	77.4 Å²	77.4	47.6 Å²	47.6	41%	0.414	22%	0.219	S	C	.	.	H	α-helix	trans	-65.7	-35.5	177	-132.3	22.5	0	0	0	112.7	E1069 Q1070 A1071 L1075 T1076 P1282 F1284	E1069-N1073 WeakPolarHBondContact O-CB 3.47Å; E1069-N1073 PolarHBondContact O-N 3.17Å; E1069-N1073 VanDerWaalsContact O-N 3.09Å; Q1070-N1073 WeakPolarHBondContact O-CB 3.43Å; Q1070-N1073 PolarHBondContact O-N 3.11Å; Q1070-N1073 VanDerWaalsContact O-N 3.15Å; A1071-N1073 VanDerWaalsContact C-N 3.31Å; A1071-N1073 PolarHBondContact O-N 3.17Å; N1073-L1075 PolarHBondContact O-N 2.97Å; N1073-T1076 PolarHBondContact O-OG1 3.4Å; N1073-P1282 HydrophobicContact CB-CB 4.24Å; N1073-P1282 HydrophobicContact CB-CG 4.42Å; N1073-P1282 WeakPolarHBondContact ND2-CB 3.47Å; N1073-F1284 HydrophobicContact CB-CE1 4.22Å; N1073-F1284 VanDerWaalsContact OD1-CD1 3.22Å; N1073-F1284 WeakPolarHBondContact OD1-CD1 3.36Å; N1073-F1284 WeakPolarHBondContact OD1-CE1 3.12Å
1074	S	82	Confident	79.5	Confident	38.6 Å²	38.6	47.2 Å²	47.2	27%	0.27	22%	0.223	S	C	.	.	H	α-helix	trans	-71.1	-12.9	178.5	69.5	0	0	0	0	114.5	Q1070 A1071 F1072 T1076 E1077 R1078 Q1426	Q1070-S1074 WeakPolarHBondContact O-CB 3.21Å; Q1070-S1074 PolarHBondContact O-N 2.91Å; Q1070-S1074 PolarHBondContact O-OG 3.11Å; Q1070-S1074 VanDerWaalsContact O-OG 3.09Å; A1071-S1074 WeakPolarHBondContact CA-OG 3.38Å; A1071-S1074 PolarHBondContact O-N 3.08Å; A1071-S1074 PolarHBondContact O-OG 3.24Å; F1072-S1074 VanDerWaalsContact C-N 3.3Å; F1072-S1074 PolarHBondContact O-N 3.02Å; S1074-T1076 VanDerWaalsContact C-N 3.26Å; S1074-T1076 PolarHBondContact O-N 2.92Å; S1074-T1076 VanDerWaalsContact O-N 3.15Å; S1074-E1077 WeakPolarHBondContact O-CB 3.36Å; S1074-E1077 PolarHBondContact O-N 3.26Å; S1074-E1077 VanDerWaalsContact O-N 3.09Å; S1074-R1078 WeakPolarHBondContact O-CB 3.46Å; S1074-R1078 VanDerWaalsContact O-CG 3.3Å; S1074-R1078 WeakPolarHBondContact O-CG 3.42Å; S1074-R1078 PolarHBondContact O-N 3.04Å; S1074-R1078 VanDerWaalsContact O-N 3.12Å; S1074-Q1426 PolarHBondContact OG-NE2 2.91Å; S1074-Q1426 PolarHBondContact OG-OE1 3.31Å; S1074-Q1426 VanDerWaalsContact OG-OE1 3.09Å
1075	L	81.7	Confident	79.5	Confident	2.2 Å²	2.2	49.1 Å²	49.1	1%	0.012	24%	0.236	C	C	.	.	H	α-helix	trans	-57.4	-37	178.6	-77.2	-178	0	0	0	113.3	A1071 F1072 N1073 E1077 R1078 G1079 S1113 L1115 R1404 Q1426	A1071-L1075 PolarHBondContact O-N 3Å; F1072-L1075 HydrophobicContact CD2-CD1 3.8Å; F1072-L1075 HydrophobicContact CE2-CD1 4.11Å; F1072-L1075 HydrophobicContact CG-CD1 4.26Å; F1072-L1075 VanDerWaalsContact O-CB 3.27Å; F1072-L1075 WeakPolarHBondContact O-CB 3.39Å; F1072-L1075 WeakPolarHBondContact O-CD1 3.19Å; F1072-L1075 WeakPolarHBondContact O-CG 3.19Å; F1072-L1075 PolarHBondContact O-N 3.16Å; N1073-L1075 PolarHBondContact O-N 2.97Å; L1075-E1077 VanDerWaalsContact C-N 3.31Å; L1075-E1077 PolarHBondContact O-N 3.47Å; L1075-R1078 WeakPolarHBondContact O-CB 3.38Å; L1075-R1078 PolarHBondContact O-N 3.08Å; L1075-R1078 VanDerWaalsContact O-N 3.13Å; L1075-G1079 PolarHBondContact O-N 3.23Å; L1075-S1113 VanDerWaalsContact CB-OG 3.27Å; L1075-S1113 WeakPolarHBondContact CB-OG 3.32Å; L1075-S1113 PolarHBondContact O-OG 3.27Å; L1075-L1115 HydrophobicContact CD1-CB 3.89Å; L1075-L1115 HydrophobicContact CD1-CD2 4.35Å; L1075-L1115 HydrophobicContact CD2-CB 3.96Å; L1075-L1115 HydrophobicContact CG-CB 4.31Å; L1075-R1404 HydrophobicContact CD1-CB 4.39Å; L1075-R1404 HydrophobicContact CD1-CG 4.46Å; L1075-Q1426 HydrophobicContact CD2-CB 4.01Å
1076	T	78.9	Confident	79.3	Confident	48.4 Å²	48.4	51.6 Å²	51.6	30%	0.297	25%	0.245	S	C	.	.	H	α-helix	trans	-61.5	-41.3	177.9	-44.2	0	0	0	0	111.3	N1073 S1074 G1079 R1080 C1110 R1404	N1073-T1076 PolarHBondContact O-OG1 3.4Å; S1074-T1076 VanDerWaalsContact C-N 3.26Å; S1074-T1076 PolarHBondContact O-N 2.92Å; S1074-T1076 VanDerWaalsContact O-N 3.15Å; T1076-G1079 PolarHBondContact O-N 3.39Å; T1076-R1080 PolarHBondContact O-N 3.14Å; T1076-R1080 VanDerWaalsContact O-N 3.09Å; T1076-C1110 PolarHBondContact O-SG 3.49Å; T1076-R1404 PolarHBondContact OG1-NH2 3.09Å
1077	E	78.3	Confident	79	Confident	90.4 Å²	90.4	50.8 Å²	50.8	42%	0.422	24%	0.244	S	C	.	.	H	α-helix	trans	-71.6	-38.2	177.8	-157.8	101.3	-175.4	0	0	111.4	S1074 L1075 G1079 R1080 R1081	S1074-E1077 WeakPolarHBondContact O-CB 3.36Å; S1074-E1077 PolarHBondContact O-N 3.26Å; S1074-E1077 VanDerWaalsContact O-N 3.09Å; L1075-E1077 VanDerWaalsContact C-N 3.31Å; L1075-E1077 PolarHBondContact O-N 3.47Å; E1077-G1079 VanDerWaalsContact C-N 3.32Å; E1077-G1079 PolarHBondContact O-N 3.16Å; E1077-R1080 PolarHBondContact O-N 3.2Å; E1077-R1080 IonicContact OE2-CZ 3.79Å; E1077-R1080 IonicContact OE2-NH1 3.36Å; E1077-R1080 PolarHBondContact OE2-NH1 3.18Å; E1077-R1081 WeakPolarHBondContact O-CG 3.46Å; E1077-R1081 PolarHBondContact O-N 3.04Å; E1077-R1081 VanDerWaalsContact O-N 3.11Å; E1077-R1081 IonicContact OE1-CZ 2.78Å; E1077-R1081 IonicContact OE1-NE 3.31Å; E1077-R1081 PolarHBondContact OE1-NE 2.84Å; E1077-R1081 IonicContact OE1-NH1 2.59Å; E1077-R1081 PolarHBondContact OE1-NH1 3.09Å; E1077-R1081 IonicContact OE1-NH2 3.53Å; E1077-R1081 PolarHBondContact OE1-NH2 3.16Å; E1077-R1081 IonicContact OE2-CZ 3.07Å; E1077-R1081 IonicContact OE2-NH1 2.75Å; E1077-R1081 IonicContact OE2-NH2 3.91Å; E1077-R1081 PolarHBondContact OE2-NH2 3.36Å
1078	R	80.4	Confident	78.7	Confident	93 Å²	93	52.5 Å²	52.5	35%	0.351	25%	0.254	S	S	.	.	H	α-helix	trans	-61.8	-43	174.4	-159.5	76.7	173.1	178.2	0	111.8	S1074 L1075 R1080 R1081 A1082 I1423 C1425 Q1426	S1074-R1078 WeakPolarHBondContact O-CB 3.46Å; S1074-R1078 VanDerWaalsContact O-CG 3.3Å; S1074-R1078 WeakPolarHBondContact O-CG 3.42Å; S1074-R1078 PolarHBondContact O-N 3.04Å; S1074-R1078 VanDerWaalsContact O-N 3.12Å; L1075-R1078 WeakPolarHBondContact O-CB 3.38Å; L1075-R1078 PolarHBondContact O-N 3.08Å; L1075-R1078 VanDerWaalsContact O-N 3.13Å; R1078-R1080 VanDerWaalsContact C-N 3.34Å; R1078-R1080 PolarHBondContact O-N 2.96Å; R1078-R1081 PolarHBondContact O-N 2.98Å; R1078-A1082 WeakPolarHBondContact O-CB 3.46Å; R1078-A1082 PolarHBondContact O-N 3.14Å; R1078-I1423 PolarHBondContact NE-O 2.96Å; R1078-I1423 VanDerWaalsContact NE-O 3.09Å; R1078-I1423 PolarHBondContact NH1-O 3Å; R1078-I1423 PolarHBondContact NH2-O 3.31Å; R1078-I1423 VanDerWaalsContact NH2-O 3.13Å; R1078-C1425 VanDerWaalsContact CZ-O 3.26Å; R1078-C1425 PolarHBondContact NE-O 3.28Å; R1078-C1425 PolarHBondContact NH2-O 3.18Å; R1078-Q1426 HydrophobicContact CG-CB 4.35Å
1079	G	79.1	Confident	78.1	Confident	1.8 Å²	1.8	56.8 Å²	56.8	2%	0.019	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-41.8	175.8	0	0	0	0	0	113	L1075 T1076 E1077 R1081 A1082 H1083 C1110 D1111	L1075-G1079 PolarHBondContact O-N 3.23Å; T1076-G1079 PolarHBondContact O-N 3.39Å; E1077-G1079 VanDerWaalsContact C-N 3.32Å; E1077-G1079 PolarHBondContact O-N 3.16Å; G1079-R1081 VanDerWaalsContact C-N 3.34Å; G1079-R1081 PolarHBondContact O-N 2.98Å; G1079-A1082 PolarHBondContact O-N 3.34Å; G1079-H1083 WeakPolarHBondContact O-CB 3.37Å; G1079-H1083 PolarHBondContact O-N 3.07Å; G1079-C1110 VanDerWaalsContact C-SG 3.6Å; G1079-D1111 WeakPolarHBondContact CA-O 3.25Å; G1079-D1111 PolarHBondContact O-N 3.07Å; G1079-D1111 VanDerWaalsContact O-N 3.15Å
1080	R	78.3	Confident	77.4	Confident	133 Å²	133	58.8 Å²	58.8	50%	0.502	29%	0.288	S	S	.	.	H	α-helix	trans	-62.7	-43.1	173.3	-85	-177.8	-158.7	155.6	-2.9	112.4	T1076 E1077 R1078 H1083 L1084 C1110	T1076-R1080 PolarHBondContact O-N 3.14Å; T1076-R1080 VanDerWaalsContact O-N 3.09Å; E1077-R1080 PolarHBondContact O-N 3.2Å; E1077-R1080 IonicContact OE2-CZ 3.79Å; E1077-R1080 IonicContact OE2-NH1 3.36Å; E1077-R1080 PolarHBondContact OE2-NH1 3.18Å; R1078-R1080 VanDerWaalsContact C-N 3.34Å; R1078-R1080 PolarHBondContact O-N 2.96Å; R1080-H1083 WeakPolarHBondContact O-CB 3.43Å; R1080-H1083 PolarHBondContact O-N 3.15Å; R1080-L1084 WeakPolarHBondContact O-CB 3.19Å; R1080-L1084 WeakPolarHBondContact O-CG 3.43Å; R1080-L1084 PolarHBondContact O-N 3.13Å; R1080-C1110 HydrophobicContact CG-CB 3.97Å; R1080-C1110 PolarHBondContact N-SG 3.23Å; R1080-C1110 VanDerWaalsContact N-SG 3.43Å
1081	R	77.9	Confident	76.3	Confident	144 Å²	144	57.5 Å²	57.5	54%	0.543	29%	0.287	S	S	.	.	H	α-helix	trans	-64.1	-43.6	178	-70.3	174.5	146.5	149	3.8	111.6	E1077 R1078 G1079 H1083 L1084 T1085	E1077-R1081 WeakPolarHBondContact O-CG 3.46Å; E1077-R1081 PolarHBondContact O-N 3.04Å; E1077-R1081 VanDerWaalsContact O-N 3.11Å; E1077-R1081 IonicContact OE1-CZ 2.78Å; E1077-R1081 IonicContact OE1-NE 3.31Å; E1077-R1081 PolarHBondContact OE1-NE 2.84Å; E1077-R1081 IonicContact OE1-NH1 2.59Å; E1077-R1081 PolarHBondContact OE1-NH1 3.09Å; E1077-R1081 IonicContact OE1-NH2 3.53Å; E1077-R1081 PolarHBondContact OE1-NH2 3.16Å; E1077-R1081 IonicContact OE2-CZ 3.07Å; E1077-R1081 IonicContact OE2-NH1 2.75Å; E1077-R1081 IonicContact OE2-NH2 3.91Å; E1077-R1081 PolarHBondContact OE2-NH2 3.36Å; R1078-R1081 PolarHBondContact O-N 2.98Å; G1079-R1081 VanDerWaalsContact C-N 3.34Å; G1079-R1081 PolarHBondContact O-N 2.98Å; R1081-H1083 VanDerWaalsContact C-N 3.33Å; R1081-H1083 PolarHBondContact O-N 3.11Å; R1081-L1084 PolarHBondContact O-N 3.2Å; R1081-T1085 WeakPolarHBondContact O-CB 3.41Å; R1081-T1085 PolarHBondContact O-N 3.18Å; R1081-T1085 PolarHBondContact O-OG1 3.15Å; R1081-T1085 VanDerWaalsContact O-OG1 3.05Å
1082	A	77.6	Confident	75.1	Confident	9.8 Å²	9.8	62.8 Å²	62.8	8%	0.081	31%	0.309	C	S	.	.	H	α-helix	trans	-61.3	-43.3	176.1	0	0	0	0	0	111.6	R1078 G1079 L1084 T1085 R1086 I1423 D1424	R1078-A1082 WeakPolarHBondContact O-CB 3.46Å; R1078-A1082 PolarHBondContact O-N 3.14Å; G1079-A1082 PolarHBondContact O-N 3.34Å; A1082-L1084 PolarHBondContact O-N 2.84Å; A1082-T1085 PolarHBondContact O-N 3.17Å; A1082-R1086 WeakPolarHBondContact O-CG 3.41Å; A1082-R1086 PolarHBondContact O-N 3.2Å; A1082-I1423 HydrophobicContact CB-CG2 4.1Å; A1082-D1424 HydrophobicContact CB-CB 4.05Å
1083	H	77.7	Confident	73.6	Confident	45 Å²	45	67.9 Å²	67.9	21%	0.208	34%	0.337	C	S	.	.	H	α-helix	trans	-59.3	-49.4	175.1	-173	78.2	0	0	0	112.1	G1079 R1080 R1081 T1085 R1086 A1087 N1106 G1109 D1111	G1079-H1083 WeakPolarHBondContact O-CB 3.37Å; G1079-H1083 PolarHBondContact O-N 3.07Å; R1080-H1083 WeakPolarHBondContact O-CB 3.43Å; R1080-H1083 PolarHBondContact O-N 3.15Å; R1081-H1083 VanDerWaalsContact C-N 3.33Å; R1081-H1083 PolarHBondContact O-N 3.11Å; H1083-T1085 VanDerWaalsContact C-N 3.31Å; H1083-T1085 PolarHBondContact O-N 3.17Å; H1083-R1086 PolarHBondContact O-N 3.22Å; H1083-R1086 VanDerWaalsContact O-N 3.11Å; H1083-A1087 WeakPolarHBondContact O-CB 3.34Å; H1083-A1087 PolarHBondContact O-N 3.09Å; H1083-N1106 PolarHBondContact NE2-O 3.18Å; H1083-G1109 VanDerWaalsContact CD2-C 3.43Å; H1083-G1109 VanDerWaalsContact CD2-CA 3.47Å; H1083-G1109 WeakPolarHBondContact CD2-CA 3.4Å; H1083-G1109 PolarHBondContact CD2-O 3.19Å; H1083-G1109 VanDerWaalsContact CG-C 3.46Å; H1083-G1109 VanDerWaalsContact NE2-CA 3.33Å; H1083-G1109 WeakPolarHBondContact NE2-CA 3.41Å; H1083-G1109 PolarHBondContact NE2-N 2.85Å; H1083-D1111 VanDerWaalsContact CA-OD2 3.28Å; H1083-D1111 WeakPolarHBondContact CA-OD2 3.26Å; H1083-D1111 HydrophobicContact CB-CB 4.36Å; H1083-D1111 WeakPolarHBondContact CB-OD2 3.37Å; H1083-D1111 IonicContact CE1-OD1 3.16Å; H1083-D1111 IonicContact CG-OD1 3.29Å; H1083-D1111 IonicContact CG-OD2 3.54Å; H1083-D1111 PolarHBondContact N-OD2 3.18Å; H1083-D1111 VanDerWaalsContact N-OD2 3.13Å; H1083-D1111 IonicContact ND1-OD1 3.51Å; H1083-D1111 PolarHBondContact ND1-OD1 3.16Å; H1083-D1111 IonicContact ND1-OD2 3Å; H1083-D1111 PolarHBondContact ND1-OD2 3.48Å
1084	L	75.2	Confident	72	Confident	77.2 Å²	77.2	70.3 Å²	70.3	40%	0.404	34%	0.343	S	S	.	.	H	α-helix	trans	-59.9	-42.9	177.4	-86.7	167.7	0	0	0	111.8	R1080 R1081 A1082 R1086 A1087 I1088 L1107	R1080-L1084 WeakPolarHBondContact O-CB 3.19Å; R1080-L1084 WeakPolarHBondContact O-CG 3.43Å; R1080-L1084 PolarHBondContact O-N 3.13Å; R1081-L1084 PolarHBondContact O-N 3.2Å; A1082-L1084 PolarHBondContact O-N 2.84Å; L1084-R1086 VanDerWaalsContact C-N 3.34Å; L1084-R1086 PolarHBondContact O-N 3.24Å; L1084-A1087 PolarHBondContact O-N 3.28Å; L1084-I1088 HydrophobicContact CD2-CD1 3.46Å; L1084-I1088 VanDerWaalsContact CD2-CD1 3.46Å; L1084-I1088 HydrophobicContact CD2-CG1 4.08Å; L1084-I1088 WeakPolarHBondContact O-CB 3.24Å; L1084-I1088 WeakPolarHBondContact O-CD1 3.37Å; L1084-I1088 VanDerWaalsContact O-CG1 3.23Å; L1084-I1088 WeakPolarHBondContact O-CG1 3.4Å; L1084-I1088 PolarHBondContact O-N 3.19Å; L1084-L1107 HydrophobicContact CD2-CB 4.38Å; L1084-L1107 HydrophobicContact CD2-CD2 4.39Å; L1084-L1107 WeakPolarHBondContact CD2-O 3.39Å
1085	T	75.7	Confident	70.4	Confident	58.6 Å²	58.6	75.9 Å²	75.9	36%	0.36	37%	0.369	S	S	.	.	H	α-helix	trans	-61.2	-44.2	176.7	-54.6	0	0	0	0	111.5	R1081 A1082 H1083 I1088 Q1089 I1423	R1081-T1085 WeakPolarHBondContact O-CB 3.41Å; R1081-T1085 PolarHBondContact O-N 3.18Å; R1081-T1085 PolarHBondContact O-OG1 3.15Å; R1081-T1085 VanDerWaalsContact O-OG1 3.05Å; A1082-T1085 PolarHBondContact O-N 3.17Å; H1083-T1085 VanDerWaalsContact C-N 3.31Å; H1083-T1085 PolarHBondContact O-N 3.17Å; T1085-I1088 PolarHBondContact O-N 3.24Å; T1085-Q1089 WeakPolarHBondContact O-CB 3.22Å; T1085-Q1089 VanDerWaalsContact O-CG 3.29Å; T1085-Q1089 WeakPolarHBondContact O-CG 3.35Å; T1085-Q1089 PolarHBondContact O-N 3.09Å; T1085-Q1089 VanDerWaalsContact O-N 3.08Å; T1085-I1423 HydrophobicContact CG2-CD1 4.14Å; T1085-I1423 HydrophobicContact CG2-CG2 4.22Å
1086	R	74.4	Confident	68.7	Low	56.8 Å²	56.8	80.1 Å²	80.1	21%	0.214	40%	0.399	C	S	.	.	H	α-helix	trans	-66.4	-39.8	176.2	-71.4	-176.9	-121.9	-161	1.2	112.3	A1082 H1083 L1084 I1088 Q1089 S1090 Y1103 D1111 Q1397 D1424	A1082-R1086 WeakPolarHBondContact O-CG 3.41Å; A1082-R1086 PolarHBondContact O-N 3.2Å; H1083-R1086 PolarHBondContact O-N 3.22Å; H1083-R1086 VanDerWaalsContact O-N 3.11Å; L1084-R1086 VanDerWaalsContact C-N 3.34Å; L1084-R1086 PolarHBondContact O-N 3.24Å; R1086-I1088 VanDerWaalsContact C-N 3.33Å; R1086-I1088 PolarHBondContact O-N 2.88Å; R1086-Q1089 PolarHBondContact O-N 3.25Å; R1086-S1090 WeakPolarHBondContact O-CB 3.37Å; R1086-S1090 PolarHBondContact O-N 3.21Å; R1086-S1090 PolarHBondContact O-OG 2.87Å; R1086-Y1103 HydrophobicContact CB-CE1 4.48Å; R1086-Y1103 WeakPolarHBondContact CD-OH 3.44Å; R1086-Y1103 PolarHBondContact NE-OH 2.78Å; R1086-D1111 WeakPolarHBondContact CD-OD2 3.5Å; R1086-D1111 IonicContact CZ-OD2 3.15Å; R1086-D1111 IonicContact NE-OD2 3.33Å; R1086-D1111 PolarHBondContact NE-OD2 3.14Å; R1086-D1111 IonicContact NH1-OD2 3.59Å; R1086-D1111 PolarHBondContact NH1-OD2 3.17Å; R1086-D1111 VanDerWaalsContact NH2-CB 3.31Å; R1086-D1111 IonicContact NH2-OD1 3.9Å; R1086-D1111 IonicContact NH2-OD2 2.98Å; R1086-D1111 PolarHBondContact NH2-OD2 3.26Å; R1086-Q1397 VanDerWaalsContact CZ-O 3.22Å; R1086-Q1397 PolarHBondContact NH1-O 3.22Å; R1086-Q1397 PolarHBondContact NH2-O 3.05Å; R1086-D1424 IonicContact NH2-OD2 3.27Å; R1086-D1424 PolarHBondContact NH2-OD2 2.97Å
1087	A	72.2	Confident	67	Low	23.4 Å²	23.4	82.8 Å²	82.8	19%	0.193	42%	0.415	C	S	.	.	H	α-helix	trans	-61.9	-45.4	176.2	0	0	0	0	0	111.2	H1083 L1084 Q1089 S1090 T1091	H1083-A1087 WeakPolarHBondContact O-CB 3.34Å; H1083-A1087 PolarHBondContact O-N 3.09Å; L1084-A1087 PolarHBondContact O-N 3.28Å; A1087-Q1089 PolarHBondContact O-N 3.18Å; A1087-S1090 WeakPolarHBondContact O-CA 3.49Å; A1087-S1090 WeakPolarHBondContact O-CB 3.15Å; A1087-S1090 PolarHBondContact O-N 3.31Å; A1087-S1090 VanDerWaalsContact O-N 3.08Å; A1087-S1090 PolarHBondContact O-OG 3.09Å; A1087-T1091 WeakPolarHBondContact O-CG2 3.48Å; A1087-T1091 PolarHBondContact O-N 3.12Å; A1087-T1091 VanDerWaalsContact O-N 3.1Å; A1087-T1091 PolarHBondContact O-OG1 2.99Å
1088	I	72.1	Confident	65	Low	84.6 Å²	84.6	87.1 Å²	87.1	43%	0.434	44%	0.435	S	S	.	.	H	α-helix	trans	-60.9	-48.4	176.1	-68	164.5	0	0	0	110.9	L1084 T1085 R1086 S1090 T1091 E1092	L1084-I1088 HydrophobicContact CD2-CD1 3.46Å; L1084-I1088 VanDerWaalsContact CD2-CD1 3.46Å; L1084-I1088 HydrophobicContact CD2-CG1 4.08Å; L1084-I1088 WeakPolarHBondContact O-CB 3.24Å; L1084-I1088 WeakPolarHBondContact O-CD1 3.37Å; L1084-I1088 VanDerWaalsContact O-CG1 3.23Å; L1084-I1088 WeakPolarHBondContact O-CG1 3.4Å; L1084-I1088 PolarHBondContact O-N 3.19Å; T1085-I1088 PolarHBondContact O-N 3.24Å; R1086-I1088 VanDerWaalsContact C-N 3.33Å; R1086-I1088 PolarHBondContact O-N 2.88Å; I1088-S1090 VanDerWaalsContact C-N 3.27Å; I1088-S1090 PolarHBondContact O-N 3.3Å; I1088-T1091 VanDerWaalsContact CA-OG1 3.3Å; I1088-T1091 WeakPolarHBondContact CA-OG1 3.4Å; I1088-T1091 PolarHBondContact O-N 3.13Å; I1088-T1091 VanDerWaalsContact O-N 3.09Å; I1088-T1091 PolarHBondContact O-OG1 3.17Å; I1088-E1092 HydrophobicContact CG2-CG 4.37Å; I1088-E1092 PolarHBondContact O-N 3.17Å
1089	Q	68.8	Low	62.9	Low	94.8 Å²	94.8	89.1 Å²	89.1	44%	0.443	45%	0.453	S	S	.	.	H	α-helix	trans	-59.2	-36.7	176.5	-74.2	175	-15.4	0	0	112.3	T1085 R1086 A1087 T1091 E1092 N1093	T1085-Q1089 WeakPolarHBondContact O-CB 3.22Å; T1085-Q1089 VanDerWaalsContact O-CG 3.29Å; T1085-Q1089 WeakPolarHBondContact O-CG 3.35Å; T1085-Q1089 PolarHBondContact O-N 3.09Å; T1085-Q1089 VanDerWaalsContact O-N 3.08Å; R1086-Q1089 PolarHBondContact O-N 3.25Å; A1087-Q1089 PolarHBondContact O-N 3.18Å; Q1089-T1091 VanDerWaalsContact C-N 3.33Å; Q1089-E1092 PolarHBondContact O-N 3.06Å; Q1089-N1093 WeakPolarHBondContact O-CB 3.48Å; Q1089-N1093 PolarHBondContact O-N 3.04Å; Q1089-N1093 PolarHBondContact O-ND2 3.26Å
1090	S	65.5	Low	60.7	Low	46.4 Å²	46.4	96.7 Å²	96.7	32%	0.324	49%	0.493	S	S	.	.	H	α-helix	trans	-70.2	-33.3	176.3	80.4	0	0	0	0	113	R1086 A1087 I1088 K1094	R1086-S1090 WeakPolarHBondContact O-CB 3.37Å; R1086-S1090 PolarHBondContact O-N 3.21Å; R1086-S1090 PolarHBondContact O-OG 2.87Å; A1087-S1090 WeakPolarHBondContact O-CA 3.49Å; A1087-S1090 WeakPolarHBondContact O-CB 3.15Å; A1087-S1090 PolarHBondContact O-N 3.31Å; A1087-S1090 VanDerWaalsContact O-N 3.08Å; A1087-S1090 PolarHBondContact O-OG 3.09Å; I1088-S1090 VanDerWaalsContact C-N 3.27Å; I1088-S1090 PolarHBondContact O-N 3.3Å; S1090-K1094 WeakPolarHBondContact O-CB 3.39Å; S1090-K1094 VanDerWaalsContact O-CG 3.23Å; S1090-K1094 WeakPolarHBondContact O-CG 3.39Å; S1090-K1094 PolarHBondContact O-N 3.22Å; S1090-K1094 VanDerWaalsContact O-N 3.09Å
1091	T	59.9	Low	58.8	Low	67.2 Å²	67.2	94.8 Å²	94.8	41%	0.412	50%	0.5	S	S	.	.	H	α-helix	trans	-74.7	-36.1	176.6	48.8	0	0	0	0	112.6	A1087 I1088 Q1089 N1093 K1094 L1095 T1105	A1087-T1091 WeakPolarHBondContact O-CG2 3.48Å; A1087-T1091 PolarHBondContact O-N 3.12Å; A1087-T1091 VanDerWaalsContact O-N 3.1Å; A1087-T1091 PolarHBondContact O-OG1 2.99Å; I1088-T1091 VanDerWaalsContact CA-OG1 3.3Å; I1088-T1091 WeakPolarHBondContact CA-OG1 3.4Å; I1088-T1091 PolarHBondContact O-N 3.13Å; I1088-T1091 VanDerWaalsContact O-N 3.09Å; I1088-T1091 PolarHBondContact O-OG1 3.17Å; Q1089-T1091 VanDerWaalsContact C-N 3.33Å; T1091-N1093 VanDerWaalsContact C-N 3.3Å; T1091-N1093 PolarHBondContact O-N 3.31Å; T1091-K1094 PolarHBondContact O-N 3.07Å; T1091-L1095 PolarHBondContact O-N 3.13Å; T1091-L1095 VanDerWaalsContact O-N 3.09Å; T1091-T1105 HydrophobicContact CG2-CG2 4.39Å
1092	E	56	Low	56.7	Low	124.8 Å²	124.8	93.8 Å²	93.8	58%	0.583	52%	0.515	S	S	*	.	H	α-helix	trans	-65.5	-39.2	174.5	-73.1	179.4	167.6	0	0	111.7	I1088 Q1089 K1094 L1095 S1096	I1088-E1092 HydrophobicContact CG2-CG 4.37Å; I1088-E1092 PolarHBondContact O-N 3.17Å; Q1089-E1092 PolarHBondContact O-N 3.06Å; E1092-K1094 VanDerWaalsContact C-N 3.32Å; E1092-K1094 PolarHBondContact O-N 3.11Å; E1092-L1095 PolarHBondContact O-N 3.14Å; E1092-S1096 PolarHBondContact O-OG 3.01Å
1093	N	52	Low	54.7	Low	108.6 Å²	108.6	100.6 Å²	100.6	58%	0.581	54%	0.54	S	S	*	.	H	α-helix	trans	-71.1	-27.2	176.1	-74.8	-15.7	0	0	0	113.4	Q1089 T1091 L1095 S1096 V1097	Q1089-N1093 WeakPolarHBondContact O-CB 3.48Å; Q1089-N1093 PolarHBondContact O-N 3.04Å; Q1089-N1093 PolarHBondContact O-ND2 3.26Å; T1091-N1093 VanDerWaalsContact C-N 3.3Å; T1091-N1093 PolarHBondContact O-N 3.31Å; N1093-L1095 VanDerWaalsContact C-N 3.28Å; N1093-L1095 PolarHBondContact O-N 2.97Å; N1093-S1096 PolarHBondContact O-N 3.08Å; N1093-S1096 VanDerWaalsContact O-N 3.07Å; N1093-S1096 PolarHBondContact O-OG 3.22Å; N1093-S1096 VanDerWaalsContact O-OG 3.11Å; N1093-V1097 PolarHBondContact O-N 2.94Å
1094	K	47.6	Very low	52.9	Low	127.4 Å²	127.4	103.6 Å²	103.6	55%	0.554	56%	0.564	S	S	*	*	H	α-helix	trans	-77.9	-21	177	-80	179.8	178.4	179.9	0	113.8	S1090 T1091 E1092 S1096 V1097	S1090-K1094 WeakPolarHBondContact O-CB 3.39Å; S1090-K1094 VanDerWaalsContact O-CG 3.23Å; S1090-K1094 WeakPolarHBondContact O-CG 3.39Å; S1090-K1094 PolarHBondContact O-N 3.22Å; S1090-K1094 VanDerWaalsContact O-N 3.09Å; T1091-K1094 PolarHBondContact O-N 3.07Å; E1092-K1094 VanDerWaalsContact C-N 3.32Å; E1092-K1094 PolarHBondContact O-N 3.11Å; K1094-S1096 VanDerWaalsContact C-N 3.31Å; K1094-S1096 PolarHBondContact O-N 2.99Å; K1094-S1096 VanDerWaalsContact O-N 3.1Å; K1094-V1097 PolarHBondContact O-N 3.16Å
1095	L	48.3	Very low	51.2	Low	156.6 Å²	156.6	104.6 Å²	104.6	82%	0.82	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-12.2	174.7	-76.5	159.9	0	0	0	113.2	T1091 E1092 N1093	T1091-L1095 PolarHBondContact O-N 3.13Å; T1091-L1095 VanDerWaalsContact O-N 3.09Å; E1092-L1095 PolarHBondContact O-N 3.14Å; N1093-L1095 VanDerWaalsContact C-N 3.28Å; N1093-L1095 PolarHBondContact O-N 2.97Å
1096	S	46.2	Very low	49.7	Very low	91.2 Å²	91.2	107.7 Å²	107.7	64%	0.638	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-11.5	-180	57.4	0	0	0	0	115.2	E1092 N1093 K1094	E1092-S1096 PolarHBondContact O-OG 3.01Å; N1093-S1096 PolarHBondContact O-N 3.08Å; N1093-S1096 VanDerWaalsContact O-N 3.07Å; N1093-S1096 PolarHBondContact O-OG 3.22Å; N1093-S1096 VanDerWaalsContact O-OG 3.11Å; K1094-S1096 VanDerWaalsContact C-N 3.31Å; K1094-S1096 PolarHBondContact O-N 2.99Å; K1094-S1096 VanDerWaalsContact O-N 3.1Å
1097	V	42.8	Very low	48.4	Very low	105.2 Å²	105.2	111 Å²	111	64%	0.638	61%	0.608	S	S	*	*			trans	-132.9	102.9	-179.5	-173.6	0	0	0	0	110.4	N1093 K1094 N1099	N1093-V1097 PolarHBondContact O-N 2.94Å; K1094-V1097 PolarHBondContact O-N 3.16Å; V1097-N1099 VanDerWaalsContact C-N 3.31Å; V1097-N1099 HydrophobicContact CG1-CB 4.23Å; V1097-N1099 PolarHBondContact O-N 3.14Å
1098	Q	36.5	Very low	47.4	Very low	179.4 Å²	179.4	118.7 Å²	118.7	84%	0.838	64%	0.641	S	S	*	*			trans	-67	120.9	168.1	-70.8	-178.9	-8.8	0	0	109.9
1099	N	36.2	Very low	46.8	Very low	136 Å²	136	116 Å²	116	73%	0.727	63%	0.633	S	S	*	*			trans	122.8	114.5	157.2	-69	-26.4	0	0	0	115.7	V1097 S1101	V1097-N1099 VanDerWaalsContact C-N 3.31Å; V1097-N1099 HydrophobicContact CG1-CB 4.23Å; V1097-N1099 PolarHBondContact O-N 3.14Å; N1099-S1101 PolarHBondContact O-N 3.1Å
1100	N	33.7	Very low	46.8	Very low	160.4 Å²	160.4	113.2 Å²	113.2	86%	0.858	62%	0.623	S	S	*	*			trans	65.1	98.9	150.1	-67	-21.4	0	0	0	116.6
1101	S	37.5	Very low	47.3	Very low	93.4 Å²	93.4	111.9 Å²	111.9	65%	0.653	61%	0.613	S	S	*	*			trans	-176.1	123	139	56.1	0	0	0	0	112.1	N1099 Y1103	N1099-S1101 PolarHBondContact O-N 3.1Å; S1101-Y1103 PolarHBondContact O-N 3.14Å; S1101-Y1103 VanDerWaalsContact O-N 3.08Å
1102	S	34.7	Very low	48.1	Very low	122.2 Å²	122.2	109 Å²	109	86%	0.855	60%	0.596	S	S	*	*			trans	-71.7	92.6	-177.4	46.8	0	0	0	0	111.8
1103	Y	35.3	Very low	49.4	Very low	153.8 Å²	153.8	103.3 Å²	103.3	60%	0.603	57%	0.57	S	S	*	*			trans	-101.5	130	160.2	-86.2	-80.3	0	0	0	109	R1086 S1101 T1105 I1398	R1086-Y1103 HydrophobicContact CB-CE1 4.48Å; R1086-Y1103 WeakPolarHBondContact CD-OH 3.44Å; R1086-Y1103 PolarHBondContact NE-OH 2.78Å; S1101-Y1103 PolarHBondContact O-N 3.14Å; S1101-Y1103 VanDerWaalsContact O-N 3.08Å; Y1103-T1105 PolarHBondContact O-N 2.98Å; Y1103-T1105 VanDerWaalsContact O-N 3.08Å; Y1103-I1398 HydrophobicContact CD2-CD1 4.14Å; Y1103-I1398 HydrophobicContact CE2-CD1 3.21Å; Y1103-I1398 HydrophobicContact CE2-CG1 3.75Å; Y1103-I1398 WeakPolarHBondContact OH-CG1 3.22Å; Y1103-I1398 WeakPolarHBondContact OH-CG2 3.49Å
1104	P	39.7	Very low	51	Low	108.2 Å²	108.2	98.5 Å²	98.5	70%	0.703	54%	0.544	S	S	*	.			trans	-67.5	112.4	-179.8	26.5	-31.1	0	0	0	109.7	N1106	P1104-N1106 PolarHBondContact O-N 3.17Å
1105	T	40	Very low	52.8	Low	97 Å²	97	92.7 Å²	92.7	60%	0.595	52%	0.519	S	S	*	.			trans	-73.7	63.3	173	48.5	0	0	0	0	110.7	T1091 Y1103 L1107	T1091-T1105 HydrophobicContact CG2-CG2 4.39Å; Y1103-T1105 PolarHBondContact O-N 2.98Å; Y1103-T1105 VanDerWaalsContact O-N 3.08Å; T1105-L1107 PolarHBondContact O-N 3.27Å
1106	N	44.1	Very low	54.6	Low	123.8 Å²	123.8	85.9 Å²	85.9	66%	0.662	48%	0.483	S	S	*	.			trans	-84.8	84.4	173.7	-103.4	-3.4	0	0	0	110.4	H1083 P1104 Q1108 G1109	H1083-N1106 PolarHBondContact NE2-O 3.18Å; P1104-N1106 PolarHBondContact O-N 3.17Å; N1106-Q1108 VanDerWaalsContact C-N 3.26Å; N1106-Q1108 PolarHBondContact O-N 3.07Å; N1106-Q1108 VanDerWaalsContact O-N 3.11Å; N1106-Q1108 PolarHBondContact OD1-N 2.78Å; N1106-Q1108 VanDerWaalsContact OD1-N 3.1Å; N1106-G1109 PolarHBondContact O-N 3.43Å
1107	L	48.3	Very low	56.3	Low	126.4 Å²	126.4	81.8 Å²	81.8	66%	0.662	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	8.2	173.4	-81.3	133.4	0	0	0	113.7	L1084 T1105 G1109	L1084-L1107 HydrophobicContact CD2-CB 4.38Å; L1084-L1107 HydrophobicContact CD2-CD2 4.39Å; L1084-L1107 WeakPolarHBondContact CD2-O 3.39Å; T1105-L1107 PolarHBondContact O-N 3.27Å; L1107-G1109 PolarHBondContact O-N 3.42Å
1108	Q	50.6	Low	58.2	Low	186 Å²	186	78.2 Å²	78.2	87%	0.869	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	26.3	-179.3	-72.2	-176.3	-14.2	0	0	113	N1106	N1106-Q1108 VanDerWaalsContact C-N 3.26Å; N1106-Q1108 PolarHBondContact O-N 3.07Å; N1106-Q1108 VanDerWaalsContact O-N 3.11Å; N1106-Q1108 PolarHBondContact OD1-N 2.78Å; N1106-Q1108 VanDerWaalsContact OD1-N 3.1Å
1109	G	58.6	Low	60.1	Low	26.8 Å²	26.8	70.1 Å²	70.1	28%	0.276	40%	0.398	S	S	.	.			trans	-92.9	171.4	175.6	0	0	0	0	0	115.4	H1083 N1106 L1107	H1083-G1109 VanDerWaalsContact CD2-C 3.43Å; H1083-G1109 VanDerWaalsContact CD2-CA 3.47Å; H1083-G1109 WeakPolarHBondContact CD2-CA 3.4Å; H1083-G1109 PolarHBondContact CD2-O 3.19Å; H1083-G1109 VanDerWaalsContact CG-C 3.46Å; H1083-G1109 VanDerWaalsContact NE2-CA 3.33Å; H1083-G1109 WeakPolarHBondContact NE2-CA 3.41Å; H1083-G1109 PolarHBondContact NE2-N 2.85Å; N1106-G1109 PolarHBondContact O-N 3.43Å; L1107-G1109 PolarHBondContact O-N 3.42Å
1110	C	69.2	Low	61.8	Low	35.6 Å²	35.6	66.5 Å²	66.5	24%	0.241	38%	0.383	C	S	.	.			trans	-137.5	123.8	177.5	-165	0	0	0	0	108.4	T1076 G1079 R1080 K1401	T1076-C1110 PolarHBondContact O-SG 3.49Å; G1079-C1110 VanDerWaalsContact C-SG 3.6Å; R1080-C1110 HydrophobicContact CG-CB 3.97Å; R1080-C1110 PolarHBondContact N-SG 3.23Å; R1080-C1110 VanDerWaalsContact N-SG 3.43Å; C1110-K1401 HydrophobicContact CB-CB 4.32Å; C1110-K1401 WeakPolarHBondContact O-CA 3.18Å; C1110-K1401 WeakPolarHBondContact O-CB 3.24Å
1111	D	76.3	Confident	63.7	Low	20.8 Å²	20.8	61.8 Å²	61.8	11%	0.111	36%	0.358	C	S	.	.			trans	-89.8	148.8	171.3	-65.1	-18.4	0	0	0	109.5	G1079 H1083 R1086	G1079-D1111 WeakPolarHBondContact CA-O 3.25Å; G1079-D1111 PolarHBondContact O-N 3.07Å; G1079-D1111 VanDerWaalsContact O-N 3.15Å; H1083-D1111 VanDerWaalsContact CA-OD2 3.28Å; H1083-D1111 WeakPolarHBondContact CA-OD2 3.26Å; H1083-D1111 HydrophobicContact CB-CB 4.36Å; H1083-D1111 WeakPolarHBondContact CB-OD2 3.37Å; H1083-D1111 IonicContact CE1-OD1 3.16Å; H1083-D1111 IonicContact CG-OD1 3.29Å; H1083-D1111 IonicContact CG-OD2 3.54Å; H1083-D1111 PolarHBondContact N-OD2 3.18Å; H1083-D1111 VanDerWaalsContact N-OD2 3.13Å; H1083-D1111 IonicContact ND1-OD1 3.51Å; H1083-D1111 PolarHBondContact ND1-OD1 3.16Å; H1083-D1111 IonicContact ND1-OD2 3Å; H1083-D1111 PolarHBondContact ND1-OD2 3.48Å; R1086-D1111 WeakPolarHBondContact CD-OD2 3.5Å; R1086-D1111 IonicContact CZ-OD2 3.15Å; R1086-D1111 IonicContact NE-OD2 3.33Å; R1086-D1111 PolarHBondContact NE-OD2 3.14Å; R1086-D1111 IonicContact NH1-OD2 3.59Å; R1086-D1111 PolarHBondContact NH1-OD2 3.17Å; R1086-D1111 VanDerWaalsContact NH2-CB 3.31Å; R1086-D1111 IonicContact NH2-OD1 3.9Å; R1086-D1111 IonicContact NH2-OD2 2.98Å; R1086-D1111 PolarHBondContact NH2-OD2 3.26Å
1112	G	77.4	Confident	65.2	Low	4.4 Å²	4.4	59.2 Å²	59.2	5%	0.045	35%	0.345	C	S	.	.			trans	-65	165	163.3	0	0	0	0	0	111	L1399 P1400 V1403	G1112-L1399 PolarHBondContact N-O 3.19Å; G1112-P1400 WeakPolarHBondContact CA-O 3.31Å; G1112-P1400 PolarHBondContact N-O 3.27Å; G1112-V1403 VanDerWaalsContact CA-O 3.27Å; G1112-V1403 WeakPolarHBondContact CA-O 3.33Å
1113	S	82.5	Confident	67.2	Low	5.2 Å²	5.2	54.2 Å²	54.2	4%	0.036	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	158.6	-175.4	51.2	0	0	0	0	112.2	L1075 R1404 F1405 D1424	L1075-S1113 VanDerWaalsContact CB-OG 3.27Å; L1075-S1113 WeakPolarHBondContact CB-OG 3.32Å; L1075-S1113 PolarHBondContact O-OG 3.27Å; S1113-R1404 WeakPolarHBondContact O-CA 3.39Å; S1113-F1405 PolarHBondContact O-N 3.2Å; S1113-F1405 VanDerWaalsContact O-N 3.09Å; S1113-D1424 WeakPolarHBondContact CA-O 3.21Å; S1113-D1424 VanDerWaalsContact CB-O 3.3Å; S1113-D1424 WeakPolarHBondContact CB-O 3.3Å
1114	I	85.1	Confident	69	Low	9.6 Å²	9.6	47.8 Å²	47.8	5%	0.049	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.5	-174.7	-56.7	157.8	0	0	0	108.6	L1395 L1399 F1405 L1407 D1424 C1425 Q1426	I1114-L1395 HydrophobicContact CD1-CD2 3.61Å; I1114-L1395 HydrophobicContact CD1-CG 4.44Å; I1114-L1395 HydrophobicContact CG1-CD2 4.36Å; I1114-L1399 HydrophobicContact CD1-CD1 4.3Å; I1114-L1399 HydrophobicContact CG1-CD1 3.78Å; I1114-F1405 CarbonylContact C-O 3.53Å; I1114-F1405 WeakPolarHBondContact CA-O 3.28Å; I1114-F1405 HydrophobicContact CB-CB 4.45Å; I1114-F1405 HydrophobicContact CG1-CB 4.12Å; I1114-F1405 HydrophobicContact CG2-CB 4.22Å; I1114-L1407 HydrophobicContact CG2-CD1 3.9Å; I1114-L1407 HydrophobicContact CG2-CG 4.25Å; I1114-D1424 PolarHBondContact N-O 3.17Å; I1114-C1425 HydrophobicContact CB-CB 4.36Å; I1114-C1425 CarbonylContact O-C 3.56Å; I1114-C1425 WeakPolarHBondContact O-CA 3.48Å; I1114-Q1426 PolarHBondContact O-N 2.93Å
1115	L	85.9	Confident	70.8	Confident	5.2 Å²	5.2	43.3 Å²	43.3	3%	0.027	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	117.1	166.2	179.5	61.8	0	0	0	109	V1068 A1071 F1072 L1075 I1117 L1132 F1405 V1406 L1407 Q1426 L1428	V1068-L1115 HydrophobicContact CG2-CD2 4.44Å; A1071-L1115 HydrophobicContact CB-CD1 3.83Å; A1071-L1115 HydrophobicContact CB-CD2 4.33Å; F1072-L1115 HydrophobicContact CB-CD2 4.25Å; F1072-L1115 HydrophobicContact CD2-CD2 4.33Å; L1075-L1115 HydrophobicContact CD1-CB 3.89Å; L1075-L1115 HydrophobicContact CD1-CD2 4.35Å; L1075-L1115 HydrophobicContact CD2-CB 3.96Å; L1075-L1115 HydrophobicContact CG-CB 4.31Å; L1115-I1117 HydrophobicContact CD2-CD1 4.33Å; L1115-I1117 HydrophobicContact CD2-CG1 4.33Å; L1115-I1117 HydrophobicContact CG-CG1 4.07Å; L1115-L1132 HydrophobicContact CD2-CD2 4.2Å; L1115-F1405 PolarHBondContact N-O 3.07Å; L1115-V1406 HydrophobicContact CB-CB 4.48Å; L1115-V1406 HydrophobicContact CB-CG1 4.27Å; L1115-V1406 HydrophobicContact CB-CG2 4.28Å; L1115-V1406 HydrophobicContact CD2-CG1 4.06Å; L1115-V1406 HydrophobicContact CD2-CG2 4.46Å; L1115-V1406 HydrophobicContact CG-CG1 4.26Å; L1115-V1406 CarbonylContact O-C 3.48Å; L1115-V1406 VanDerWaalsContact O-CA 3.29Å; L1115-V1406 WeakPolarHBondContact O-CA 3.42Å; L1115-L1407 PolarHBondContact O-N 3.35Å; L1115-Q1426 HydrophobicContact CD1-CG 4.42Å; L1115-L1428 HydrophobicContact CD1-CB 4.13Å
1116	L	85.6	Confident	72.4	Confident	12.8 Å²	12.8	40.4 Å²	40.4	7%	0.067	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	113.9	177.3	-178.9	65.3	0	0	0	109.7	V1118 L1407 C1409 A1416 L1419 Q1426 L1427 L1428	L1116-V1118 HydrophobicContact CD1-CG1 4.36Å; L1116-V1118 HydrophobicContact CD1-CG2 4.31Å; L1116-V1118 HydrophobicContact CD2-CG1 4.1Å; L1116-V1118 HydrophobicContact CD2-CG2 3.92Å; L1116-V1118 HydrophobicContact CG-CG1 3.89Å; L1116-V1118 HydrophobicContact CG-CG2 3.68Å; L1116-L1407 CarbonylContact C-O 3.53Å; L1116-L1407 WeakPolarHBondContact CA-O 3.37Å; L1116-L1407 HydrophobicContact CD1-CB 4.12Å; L1116-C1409 HydrophobicContact CD1-CB 4.21Å; L1116-C1409 VanDerWaalsContact CD1-SG 3.52Å; L1116-A1416 HydrophobicContact CD2-CB 4.38Å; L1116-L1419 HydrophobicContact CD1-CD1 3.84Å; L1116-L1419 HydrophobicContact CD2-CB 3.86Å; L1116-L1419 HydrophobicContact CD2-CD1 4.44Å; L1116-Q1426 PolarHBondContact N-O 3.21Å; L1116-L1427 HydrophobicContact CB-CD1 4.32Å; L1116-L1427 HydrophobicContact CD2-CD1 4.01Å; L1116-L1427 HydrophobicContact CG-CD1 4.17Å; L1116-L1427 CarbonylContact O-C 3.55Å; L1116-L1427 WeakPolarHBondContact O-CA 3.5Å; L1116-L1428 PolarHBondContact O-N 3.35Å
1117	I	83.3	Confident	73.9	Confident	5.6 Å²	5.6	36 Å²	36	3%	0.029	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	112.2	177.9	-55.1	178.6	0	0	0	109	V1068 L1115 K1125 Y1128 L1129 V1406 L1407 T1408 C1409 L1428 V1430	V1068-I1117 HydrophobicContact CG1-CD1 3.99Å; V1068-I1117 HydrophobicContact CG2-CD1 4.08Å; L1115-I1117 HydrophobicContact CD2-CD1 4.33Å; L1115-I1117 HydrophobicContact CD2-CG1 4.33Å; L1115-I1117 HydrophobicContact CG-CG1 4.07Å; I1117-K1125 HydrophobicContact CG2-CB 4.48Å; I1117-K1125 HydrophobicContact CG2-CG 4.24Å; I1117-Y1128 HydrophobicContact CG2-CD1 4.22Å; I1117-Y1128 HydrophobicContact CG2-CG 4.39Å; I1117-L1129 HydrophobicContact CD1-CD1 4.48Å; I1117-V1406 HydrophobicContact CD1-CG1 3.83Å; I1117-V1406 HydrophobicContact CG1-CG1 4.3Å; I1117-L1407 PolarHBondContact N-O 3.06Å; I1117-T1408 HydrophobicContact CB-CG2 4.01Å; I1117-T1408 HydrophobicContact CD1-CG2 4.4Å; I1117-T1408 HydrophobicContact CG2-CG2 4.35Å; I1117-T1408 CarbonylContact O-C 3.59Å; I1117-T1408 VanDerWaalsContact O-CA 3.25Å; I1117-T1408 WeakPolarHBondContact O-CA 3.38Å; I1117-C1409 PolarHBondContact O-N 3.11Å; I1117-L1428 CarbonylContact C-O 3.45Å; I1117-L1428 WeakPolarHBondContact CA-O 3.39Å; I1117-L1428 HydrophobicContact CG1-CB 4.49Å; I1117-L1428 HydrophobicContact CG1-CD2 4.38Å; I1117-V1430 HydrophobicContact CG2-CG2 3.61Å
1118	V	81.7	Confident	75.3	Confident	29 Å²	29	30.5 Å²	30.5	18%	0.176	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	145.2	-176.2	-134.6	0	0	0	0	111.1	L1116 C1409 A1416 L1427 L1428 T1429 V1430	L1116-V1118 HydrophobicContact CD1-CG1 4.36Å; L1116-V1118 HydrophobicContact CD1-CG2 4.31Å; L1116-V1118 HydrophobicContact CD2-CG1 4.1Å; L1116-V1118 HydrophobicContact CD2-CG2 3.92Å; L1116-V1118 HydrophobicContact CG-CG1 3.89Å; L1116-V1118 HydrophobicContact CG-CG2 3.68Å; V1118-C1409 WeakPolarHBondContact CA-O 3.35Å; V1118-A1416 HydrophobicContact CG1-CB 4.12Å; V1118-A1416 HydrophobicContact CG2-CB 4.42Å; V1118-L1427 HydrophobicContact CB-CD1 3.99Å; V1118-L1427 HydrophobicContact CG1-CD1 3.74Å; V1118-L1427 HydrophobicContact CG2-CD1 3.39Å; V1118-L1427 HydrophobicContact CG2-CG 4.23Å; V1118-L1428 PolarHBondContact N-O 2.99Å; V1118-T1429 HydrophobicContact CG2-CG2 3.47Å; V1118-T1429 VanDerWaalsContact CG2-CG2 3.47Å; V1118-T1429 CarbonylContact O-C 3.55Å; V1118-T1429 WeakPolarHBondContact O-CA 3.4Å; V1118-V1430 PolarHBondContact O-N 2.97Å
1119	G	76.3	Confident	76.6	Confident	10.4 Å²	10.4	21.8 Å²	21.8	11%	0.107	15%	0.15	C	C	.	.			trans	-177.7	163.1	175.9	0	0	0	0	0	111.7	K1125	G1119-K1125 PolarHBondContact O-NZ 3.13Å; G1119-K1125 VanDerWaalsContact O-NZ 3.09Å
1120	S	73.2	Confident	77.3	Confident	60.2 Å²	60.2	20.5 Å²	20.5	42%	0.421	14%	0.137	S	C	.	.			trans	-60	162.9	175.1	59.4	0	0	0	0	111.6	G1122 S1123 K1125	S1120-G1122 PolarHBondContact O-N 3.13Å; S1120-S1123 VanDerWaalsContact O-CB 3.28Å; S1120-S1123 WeakPolarHBondContact O-CB 3.35Å; S1120-S1123 PolarHBondContact O-N 3.19Å; S1120-S1123 VanDerWaalsContact O-N 3.14Å; S1120-S1123 PolarHBondContact O-OG 3.13Å; S1120-K1125 PolarHBondContact O-NZ 3.24Å; S1120-K1125 VanDerWaalsContact O-NZ 3.14Å
1121	N	72	Confident	77.5	Confident	62.4 Å²	62.4	18.8 Å²	18.8	33%	0.334	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	141.9	171.9	-64.2	-24.9	0	0	0	110	S1123 E1673	N1121-S1123 VanDerWaalsContact C-N 3.26Å; N1121-S1123 PolarHBondContact O-N 3.23Å; N1121-S1123 VanDerWaalsContact O-N 3.09Å; N1121-E1673 HydrophobicContact CB-CB 4.42Å; N1121-E1673 VanDerWaalsContact CB-CD 3.43Å; N1121-E1673 HydrophobicContact CB-CG 4.1Å; N1121-E1673 VanDerWaalsContact CB-OE1 3.22Å; N1121-E1673 WeakPolarHBondContact CB-OE1 3.36Å; N1121-E1673 PolarHBondContact ND2-OE1 2.88Å
1122	G	70.4	Confident	77.6	Confident	37 Å²	37	17.8 Å²	17.8	38%	0.381	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	1.5	-176.1	0	0	0	0	0	116.2	S1120 G1124 I1473 P1474 L1475	S1120-G1122 PolarHBondContact O-N 3.13Å; G1122-G1124 VanDerWaalsContact C-N 3.29Å; G1122-G1124 PolarHBondContact O-N 3.2Å; G1122-I1473 VanDerWaalsContact O-CG2 3.32Å; G1122-I1473 WeakPolarHBondContact O-CG2 3.38Å; G1122-P1474 VanDerWaalsContact O-CD 3.3Å; G1122-P1474 WeakPolarHBondContact O-CD 3.23Å; G1122-L1475 PolarHBondContact O-N 3.08Å
1123	S	75.3	Confident	77.5	Confident	18.8 Å²	18.8	17.7 Å²	17.7	13%	0.131	12%	0.118	C	C	.	.	S	Bend	trans	-71.2	-7	-179.4	70.8	0	0	0	0	115.1	S1120 N1121 K1125	S1120-S1123 VanDerWaalsContact O-CB 3.28Å; S1120-S1123 WeakPolarHBondContact O-CB 3.35Å; S1120-S1123 PolarHBondContact O-N 3.19Å; S1120-S1123 VanDerWaalsContact O-N 3.14Å; S1120-S1123 PolarHBondContact O-OG 3.13Å; N1121-S1123 VanDerWaalsContact C-N 3.26Å; N1121-S1123 PolarHBondContact O-N 3.23Å; N1121-S1123 VanDerWaalsContact O-N 3.09Å; S1123-K1125 WeakPolarHBondContact OG-CG 3.36Å
1124	G	73.3	Confident	77	Confident	18.2 Å²	18.2	17.8 Å²	17.8	19%	0.188	12%	0.119	C	C	.	.	S	Bend	trans	94	16.9	180	0	0	0	0	0	115.7	G1122 T1126 T1127 Y1128	G1122-G1124 VanDerWaalsContact C-N 3.29Å; G1122-G1124 PolarHBondContact O-N 3.2Å; G1124-T1126 VanDerWaalsContact C-N 3.32Å; G1124-T1126 PolarHBondContact O-N 3.18Å; G1124-T1126 VanDerWaalsContact O-N 3.16Å; G1124-T1127 WeakPolarHBondContact O-CA 3.4Å; G1124-T1127 VanDerWaalsContact O-CB 3.26Å; G1124-T1127 WeakPolarHBondContact O-CB 3.27Å; G1124-T1127 PolarHBondContact O-N 3.05Å; G1124-T1127 VanDerWaalsContact O-N 3.08Å; G1124-Y1128 WeakPolarHBondContact O-CD2 3.37Å; G1124-Y1128 PolarHBondContact O-N 3.17Å; G1124-Y1128 VanDerWaalsContact O-N 3.09Å
1125	K	77.4	Confident	76.3	Confident	13.2 Å²	13.2	17.6 Å²	17.6	6%	0.057	12%	0.118	C	C	.	.	H	α-helix	trans	-49.1	-48.3	177.7	-61.9	-174.1	-66.8	-78.4	0	113.2	I1117 G1119 S1120 S1123 T1127 Y1128 L1129 D1383 T1408 C1409 V1430	I1117-K1125 HydrophobicContact CG2-CB 4.48Å; I1117-K1125 HydrophobicContact CG2-CG 4.24Å; G1119-K1125 PolarHBondContact O-NZ 3.13Å; G1119-K1125 VanDerWaalsContact O-NZ 3.09Å; S1120-K1125 PolarHBondContact O-NZ 3.24Å; S1120-K1125 VanDerWaalsContact O-NZ 3.14Å; S1123-K1125 WeakPolarHBondContact OG-CG 3.36Å; K1125-T1127 VanDerWaalsContact C-N 3.29Å; K1125-T1127 PolarHBondContact O-N 3.32Å; K1125-Y1128 VanDerWaalsContact O-CB 3.31Å; K1125-Y1128 WeakPolarHBondContact O-CB 3.35Å; K1125-Y1128 PolarHBondContact O-N 3.07Å; K1125-Y1128 VanDerWaalsContact O-N 3.12Å; K1125-L1129 WeakPolarHBondContact O-CB 3.47Å; K1125-L1129 PolarHBondContact O-N 3.3Å; K1125-L1129 VanDerWaalsContact O-N 3.09Å; K1125-D1383 WeakPolarHBondContact CE-OD1 3.19Å; K1125-T1408 HydrophobicContact CB-CG2 4.24Å; K1125-C1409 WeakPolarHBondContact CD-O 3.37Å; K1125-C1409 WeakPolarHBondContact CE-O 3.3Å; K1125-V1430 HydrophobicContact CG-CG2 4.3Å
1126	T	75	Confident	75.7	Confident	37.6 Å²	37.6	17.5 Å²	17.5	23%	0.231	12%	0.118	C	C	.	.	H	α-helix	trans	-58.5	-39.1	176.4	-48.3	0	0	0	0	112.2	Y1052 G1124 L1129 S1130 F1293 L1297 D1382	Y1052-T1126 HydrophobicContact CE1-CG2 4.25Å; G1124-T1126 VanDerWaalsContact C-N 3.32Å; G1124-T1126 PolarHBondContact O-N 3.18Å; G1124-T1126 VanDerWaalsContact O-N 3.16Å; T1126-L1129 PolarHBondContact O-N 2.91Å; T1126-S1130 VanDerWaalsContact O-CB 3.26Å; T1126-S1130 WeakPolarHBondContact O-CB 3.41Å; T1126-S1130 PolarHBondContact O-N 2.94Å; T1126-S1130 PolarHBondContact O-OG 3.12Å; T1126-F1293 HydrophobicContact CG2-CD1 4.04Å; T1126-F1293 HydrophobicContact CG2-CE1 3.82Å; T1126-L1297 HydrophobicContact CG2-CD2 3.85Å; T1126-D1382 VanDerWaalsContact CB-OD2 3.29Å; T1126-D1382 WeakPolarHBondContact CB-OD2 3.34Å; T1126-D1382 VanDerWaalsContact CG2-OD2 3.29Å; T1126-D1382 WeakPolarHBondContact CG2-OD2 3.33Å; T1126-D1382 PolarHBondContact OG1-OD1 3.13Å; T1126-D1382 PolarHBondContact OG1-OD2 3.17Å
1127	T	74.1	Confident	74.7	Confident	30 Å²	30	18.9 Å²	18.9	18%	0.184	13%	0.125	C	C	.	.	H	α-helix	trans	-65.4	-43.4	176.1	-57.5	0	0	0	0	111.5	V1053 A1056 A1057 A1059 I1060 G1124 K1125 L1129 S1130 A1131	V1053-T1127 HydrophobicContact CG1-CG2 3.82Å; A1056-T1127 HydrophobicContact CB-CG2 3.58Å; A1056-T1127 WeakPolarHBondContact O-CA 3.41Å; A1056-T1127 WeakPolarHBondContact O-CB 3.5Å; A1056-T1127 VanDerWaalsContact O-CG2 3.3Å; A1056-T1127 WeakPolarHBondContact O-CG2 3.25Å; A1056-T1127 PolarHBondContact O-OG1 2.93Å; A1056-T1127 VanDerWaalsContact O-OG1 3.1Å; A1057-T1127 HydrophobicContact CB-CG2 4.25Å; A1059-T1127 HydrophobicContact CB-CG2 4.12Å; I1060-T1127 HydrophobicContact CB-CG2 3.63Å; I1060-T1127 HydrophobicContact CD1-CG2 4.48Å; I1060-T1127 HydrophobicContact CG1-CG2 4.12Å; I1060-T1127 VanDerWaalsContact N-CG2 3.3Å; G1124-T1127 WeakPolarHBondContact O-CA 3.4Å; G1124-T1127 VanDerWaalsContact O-CB 3.26Å; G1124-T1127 WeakPolarHBondContact O-CB 3.27Å; G1124-T1127 PolarHBondContact O-N 3.05Å; G1124-T1127 VanDerWaalsContact O-N 3.08Å; K1125-T1127 VanDerWaalsContact C-N 3.29Å; K1125-T1127 PolarHBondContact O-N 3.32Å; T1127-L1129 VanDerWaalsContact C-N 3.29Å; T1127-L1129 PolarHBondContact O-N 2.93Å; T1127-S1130 WeakPolarHBondContact O-CB 3.36Å; T1127-S1130 PolarHBondContact O-N 3.12Å; T1127-A1131 VanDerWaalsContact O-CB 3.26Å; T1127-A1131 WeakPolarHBondContact O-CB 3.12Å; T1127-A1131 PolarHBondContact O-N 3.08Å
1128	Y	77.9	Confident	73.8	Confident	12.6 Å²	12.6	22 Å²	22	5%	0.049	14%	0.139	C	C	.	.	H	α-helix	trans	-63.3	-43.8	175.6	-76.9	-86.9	0	0	0	112.3	I1060 H1064 L1065 E1067 V1068 I1117 G1124 K1125 S1130 A1131 L1132 L1428 V1430	I1060-Y1128 HydrophobicContact CD1-CD1 3.76Å; I1060-Y1128 HydrophobicContact CD1-CD2 4.34Å; I1060-Y1128 HydrophobicContact CD1-CE1 4.31Å; I1060-Y1128 HydrophobicContact CD1-CG 4.32Å; H1064-Y1128 HydrophobicContact CB-CD1 4.21Å; H1064-Y1128 HydrophobicContact CB-CE1 3.76Å; H1064-Y1128 VanDerWaalsContact CB-CE1 3.45Å; H1064-Y1128 HydrophobicContact CB-CE2 3.91Å; H1064-Y1128 VanDerWaalsContact CB-CZ 3.4Å; H1064-Y1128 WeakPolarHBondContact CB-OH 3.35Å; H1064-Y1128 AromaticContact CD2-CZ 3.88Å; H1064-Y1128 PolarHBondContact CD2-OH 3.18Å; H1064-Y1128 AromaticContact CG-CE2 3.96Å; H1064-Y1128 AromaticContact CG-CZ 3.89Å; H1064-Y1128 AromaticContact ND1-CZ 3.79Å; H1064-Y1128 PolarHBondContact ND1-OH 3.07Å; H1064-Y1128 VanDerWaalsContact ND1-OH 3.08Å; L1065-Y1128 HydrophobicContact CB-CD1 4.4Å; E1067-Y1128 PolarHBondContact OE2-OH 3.43Å; V1068-Y1128 HydrophobicContact CB-CD1 3.88Å; V1068-Y1128 HydrophobicContact CB-CE1 4.22Å; V1068-Y1128 HydrophobicContact CG1-CD1 4.41Å; V1068-Y1128 HydrophobicContact CG2-CD1 3.78Å; V1068-Y1128 HydrophobicContact CG2-CE1 3.67Å; V1068-Y1128 HydrophobicContact CG2-CG 4.39Å; I1117-Y1128 HydrophobicContact CG2-CD1 4.22Å; I1117-Y1128 HydrophobicContact CG2-CG 4.39Å; G1124-Y1128 WeakPolarHBondContact O-CD2 3.37Å; G1124-Y1128 PolarHBondContact O-N 3.17Å; G1124-Y1128 VanDerWaalsContact O-N 3.09Å; K1125-Y1128 VanDerWaalsContact O-CB 3.31Å; K1125-Y1128 WeakPolarHBondContact O-CB 3.35Å; K1125-Y1128 PolarHBondContact O-N 3.07Å; K1125-Y1128 VanDerWaalsContact O-N 3.12Å; Y1128-S1130 VanDerWaalsContact C-N 3.34Å; Y1128-A1131 PolarHBondContact O-N 3.11Å; Y1128-L1132 WeakPolarHBondContact O-CB 3.34Å; Y1128-L1132 PolarHBondContact O-N 2.92Å; Y1128-L1428 HydrophobicContact CD1-CD2 4.26Å; Y1128-L1428 HydrophobicContact CE1-CD2 4.35Å; Y1128-V1430 HydrophobicContact CD1-CG2 4.47Å; Y1128-V1430 HydrophobicContact CD2-CG1 4.24Å; Y1128-V1430 HydrophobicContact CD2-CG2 4.31Å; Y1128-V1430 HydrophobicContact CE1-CG2 4.39Å; Y1128-V1430 HydrophobicContact CE2-CB 4.37Å; Y1128-V1430 HydrophobicContact CE2-CG1 3.66Å; Y1128-V1430 HydrophobicContact CE2-CG2 4.04Å; Y1128-V1430 HydrophobicContact CG-CG2 4.37Å
1129	L	78	Confident	72.5	Confident	1.8 Å²	1.8	22.9 Å²	22.9	1%	0.009	15%	0.146	C	C	.	.	H	α-helix	trans	-65.5	-43.3	178.1	-168.4	145.2	0	0	0	111.4	I1117 K1125 T1126 T1127 A1131 L1132 T1133 I1291 F1293 L1380 D1382 V1406 T1408	I1117-L1129 HydrophobicContact CD1-CD1 4.48Å; K1125-L1129 WeakPolarHBondContact O-CB 3.47Å; K1125-L1129 PolarHBondContact O-N 3.3Å; K1125-L1129 VanDerWaalsContact O-N 3.09Å; T1126-L1129 PolarHBondContact O-N 2.91Å; T1127-L1129 VanDerWaalsContact C-N 3.29Å; T1127-L1129 PolarHBondContact O-N 2.93Å; L1129-A1131 PolarHBondContact O-N 3.23Å; L1129-L1132 PolarHBondContact O-N 3.07Å; L1129-T1133 VanDerWaalsContact O-CB 3.31Å; L1129-T1133 WeakPolarHBondContact O-CB 3.35Å; L1129-T1133 PolarHBondContact O-N 3.07Å; L1129-T1133 PolarHBondContact O-OG1 3.02Å; L1129-I1291 HydrophobicContact CD2-CD1 3.43Å; L1129-I1291 VanDerWaalsContact CD2-CD1 3.46Å; L1129-I1291 HydrophobicContact CD2-CG1 3.99Å; L1129-F1293 HydrophobicContact CD2-CE1 3.9Å; L1129-F1293 HydrophobicContact CD2-CZ 4.12Å; L1129-L1380 HydrophobicContact CD1-CB 4.27Å; L1129-L1380 HydrophobicContact CD2-CB 4.28Å; L1129-L1380 HydrophobicContact CD2-CD2 4.32Å; L1129-L1380 HydrophobicContact CG-CB 4.34Å; L1129-L1380 HydrophobicContact CG-CD2 4.25Å; L1129-D1382 HydrophobicContact CD1-CB 4.23Å; L1129-D1382 HydrophobicContact CD2-CB 4.4Å; L1129-V1406 HydrophobicContact CD1-CG1 4.46Å; L1129-T1408 HydrophobicContact CB-CG2 4.09Å; L1129-T1408 HydrophobicContact CD1-CG2 3.51Å; L1129-T1408 VanDerWaalsContact CD1-CG2 3.45Å; L1129-T1408 HydrophobicContact CG-CG2 4.42Å
1130	S	74.1	Confident	71.3	Confident	0.4 Å²	0.4	26.2 Å²	26.2	0%	0.003	16%	0.162	C	C	.	.	H	α-helix	trans	-61.7	-44.1	175.7	-59.9	0	0	0	0	111.8	L1049 V1053 A1056 T1126 T1127 Y1128 L1132 T1133 I1134	L1049-S1130 WeakPolarHBondContact CD2-OG 3.35Å; V1053-S1130 VanDerWaalsContact CG1-CB 3.44Å; A1056-S1130 WeakPolarHBondContact CB-OG 3.39Å; T1126-S1130 VanDerWaalsContact O-CB 3.26Å; T1126-S1130 WeakPolarHBondContact O-CB 3.41Å; T1126-S1130 PolarHBondContact O-N 2.94Å; T1126-S1130 PolarHBondContact O-OG 3.12Å; T1127-S1130 WeakPolarHBondContact O-CB 3.36Å; T1127-S1130 PolarHBondContact O-N 3.12Å; Y1128-S1130 VanDerWaalsContact C-N 3.34Å; S1130-L1132 PolarHBondContact O-N 3.43Å; S1130-T1133 VanDerWaalsContact O-CB 3.27Å; S1130-T1133 WeakPolarHBondContact O-CB 3.43Å; S1130-T1133 PolarHBondContact O-N 3.22Å; S1130-I1134 VanDerWaalsContact O-CG1 3.24Å; S1130-I1134 WeakPolarHBondContact O-CG1 3.33Å; S1130-I1134 PolarHBondContact O-N 3.26Å; S1130-I1134 VanDerWaalsContact O-N 3.07Å
1131	A	73.5	Confident	70.2	Confident	0.2 Å²	0.2	25.5 Å²	25.5	0%	0.002	15%	0.15	C	C	.	.	H	α-helix	trans	-68.1	-41.1	178.7	0	0	0	0	0	112.6	V1053 Y1054 A1057 I1060 L1065 T1127 Y1128 L1129 T1133 I1134 S1135 W1141	V1053-A1131 HydrophobicContact CG1-CB 3.98Å; V1053-A1131 HydrophobicContact CG2-CB 4.43Å; Y1054-A1131 HydrophobicContact CD2-CB 3.91Å; A1057-A1131 HydrophobicContact CB-CB 4.1Å; I1060-A1131 HydrophobicContact CB-CB 4.05Å; I1060-A1131 HydrophobicContact CD1-CB 3.55Å; I1060-A1131 VanDerWaalsContact CD1-CB 3.4Å; I1060-A1131 HydrophobicContact CG1-CB 4.35Å; I1060-A1131 HydrophobicContact CG2-CB 3.73Å; L1065-A1131 HydrophobicContact CD1-CB 3.75Å; L1065-A1131 HydrophobicContact CD2-CB 4.41Å; T1127-A1131 VanDerWaalsContact O-CB 3.26Å; T1127-A1131 WeakPolarHBondContact O-CB 3.12Å; T1127-A1131 PolarHBondContact O-N 3.08Å; Y1128-A1131 PolarHBondContact O-N 3.11Å; L1129-A1131 PolarHBondContact O-N 3.23Å; A1131-T1133 VanDerWaalsContact C-N 3.31Å; A1131-T1133 PolarHBondContact O-N 3.18Å; A1131-I1134 PolarHBondContact O-N 3.2Å; A1131-I1134 VanDerWaalsContact O-N 3.11Å; A1131-S1135 PolarHBondContact O-N 3.23Å; A1131-S1135 PolarHBondContact O-OG 3.17Å; A1131-W1141 HydrophobicContact CB-CH2 4.15Å; A1131-W1141 HydrophobicContact CB-CZ2 4.09Å; A1131-W1141 WeakPolarHBondContact O-CZ2 3.38Å
1132	L	78.5	Confident	68.9	Low	0 Å²	0	26 Å²	26	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.9	-42.4	173.2	178.6	64.7	0	0	0	111	V1068 E1069 F1072 L1115 Y1128 L1129 S1130 I1134 S1135 L1136 F1284 L1380 V1406	V1068-L1132 HydrophobicContact CG1-CB 4.18Å; V1068-L1132 HydrophobicContact CG1-CD1 4.2Å; V1068-L1132 HydrophobicContact CG1-CD2 3.84Å; V1068-L1132 HydrophobicContact CG1-CG 4.23Å; V1068-L1132 HydrophobicContact CG2-CB 4.05Å; V1068-L1132 HydrophobicContact CG2-CD1 4.44Å; V1068-L1132 HydrophobicContact CG2-CD2 4.09Å; V1068-L1132 HydrophobicContact CG2-CG 4.42Å; E1069-L1132 HydrophobicContact CG-CD1 4.42Å; F1072-L1132 HydrophobicContact CB-CD1 3.95Å; F1072-L1132 HydrophobicContact CB-CD2 4.43Å; F1072-L1132 HydrophobicContact CD2-CD1 4.3Å; F1072-L1132 HydrophobicContact CD2-CD2 3.98Å; F1072-L1132 HydrophobicContact CD2-CG 4.44Å; F1072-L1132 HydrophobicContact CE2-CD2 4.49Å; F1072-L1132 HydrophobicContact CG-CD1 4.13Å; F1072-L1132 HydrophobicContact CG-CD2 4.42Å; L1115-L1132 HydrophobicContact CD2-CD2 4.2Å; Y1128-L1132 WeakPolarHBondContact O-CB 3.34Å; Y1128-L1132 PolarHBondContact O-N 2.92Å; L1129-L1132 PolarHBondContact O-N 3.07Å; S1130-L1132 PolarHBondContact O-N 3.43Å; L1132-I1134 VanDerWaalsContact C-N 3.29Å; L1132-I1134 PolarHBondContact O-N 3.04Å; L1132-S1135 WeakPolarHBondContact O-CB 3.39Å; L1132-S1135 PolarHBondContact O-N 3.36Å; L1132-S1135 VanDerWaalsContact O-N 3.13Å; L1132-L1136 HydrophobicContact CD1-CD1 4.4Å; L1132-L1136 HydrophobicContact CD1-CD2 4.48Å; L1132-L1136 HydrophobicContact CD1-CG 4.23Å; L1132-L1136 HydrophobicContact CG-CD1 4.09Å; L1132-L1136 HydrophobicContact CG-CG 4.34Å; L1132-L1136 VanDerWaalsContact O-CG 3.3Å; L1132-L1136 WeakPolarHBondContact O-CG 3.39Å; L1132-L1136 PolarHBondContact O-N 3.07Å; L1132-F1284 HydrophobicContact CD1-CZ 4.47Å; L1132-L1380 HydrophobicContact CD2-CD2 4.49Å; L1132-V1406 HydrophobicContact CD2-CB 4.45Å; L1132-V1406 HydrophobicContact CD2-CG1 4.1Å; L1132-V1406 HydrophobicContact CD2-CG2 4.08Å
1133	T	74.2	Confident	67.5	Low	1 Å²	1	30.1 Å²	30.1	1%	0.006	16%	0.155	C	C	.	.	H	α-helix	trans	-55.9	-47.4	176.8	-57.6	0	0	0	0	111.1	L1049 V1053 L1129 S1130 A1131 S1135 L1136 I1137 L1216 I1289 I1291 L1380	L1049-T1133 HydrophobicContact CD1-CG2 3.6Å; L1049-T1133 HydrophobicContact CD2-CG2 3.48Å; L1049-T1133 VanDerWaalsContact CD2-CG2 3.48Å; V1053-T1133 HydrophobicContact CG1-CG2 4.17Å; L1129-T1133 VanDerWaalsContact O-CB 3.31Å; L1129-T1133 WeakPolarHBondContact O-CB 3.35Å; L1129-T1133 PolarHBondContact O-N 3.07Å; L1129-T1133 PolarHBondContact O-OG1 3.02Å; S1130-T1133 VanDerWaalsContact O-CB 3.27Å; S1130-T1133 WeakPolarHBondContact O-CB 3.43Å; S1130-T1133 PolarHBondContact O-N 3.22Å; A1131-T1133 VanDerWaalsContact C-N 3.31Å; A1131-T1133 PolarHBondContact O-N 3.18Å; T1133-S1135 VanDerWaalsContact C-N 3.34Å; T1133-S1135 PolarHBondContact O-N 3.16Å; T1133-L1136 PolarHBondContact O-N 2.92Å; T1133-I1137 HydrophobicContact CG2-CD1 3.95Å; T1133-I1137 VanDerWaalsContact O-CD1 3.26Å; T1133-I1137 WeakPolarHBondContact O-CD1 3.33Å; T1133-I1137 VanDerWaalsContact O-CG1 3.26Å; T1133-I1137 WeakPolarHBondContact O-CG1 3.4Å; T1133-I1137 PolarHBondContact O-N 3.24Å; T1133-I1137 VanDerWaalsContact O-N 3.14Å; T1133-L1216 HydrophobicContact CG2-CD1 3.34Å; T1133-I1289 HydrophobicContact CG2-CD1 4.17Å; T1133-I1289 HydrophobicContact CG2-CG2 4.2Å; T1133-I1289 WeakPolarHBondContact O-CD1 3.29Å; T1133-I1291 HydrophobicContact CG2-CD1 4.12Å; T1133-I1291 VanDerWaalsContact OG1-CD1 3.31Å; T1133-I1291 WeakPolarHBondContact OG1-CD1 3.21Å; T1133-L1380 WeakPolarHBondContact OG1-CD2 3.41Å
1134	I	71.5	Confident	65.6	Low	8.4 Å²	8.4	32.3 Å²	32.3	4%	0.043	17%	0.17	C	C	.	.	H	α-helix	trans	-65.4	-40.8	177.4	-58.6	-145.1	0	0	0	111.1	I1046 L1049 R1050 V1053 Y1054 A1057 S1130 A1131 L1132 L1136 I1137 E1138 W1141	I1046-I1134 HydrophobicContact CG2-CD1 4.42Å; L1049-I1134 HydrophobicContact CB-CD1 4.05Å; L1049-I1134 HydrophobicContact CB-CG1 4.14Å; R1050-I1134 HydrophobicContact CB-CD1 4.07Å; R1050-I1134 HydrophobicContact CB-CG1 4.5Å; R1050-I1134 HydrophobicContact CG-CD1 4.07Å; R1050-I1134 HydrophobicContact CG-CG2 4.46Å; V1053-I1134 HydrophobicContact CB-CD1 3.92Å; V1053-I1134 HydrophobicContact CG1-CD1 4.01Å; V1053-I1134 HydrophobicContact CG1-CG1 4.1Å; V1053-I1134 HydrophobicContact CG2-CD1 3.82Å; Y1054-I1134 HydrophobicContact CD2-CB 3.91Å; Y1054-I1134 HydrophobicContact CD2-CD1 4.02Å; Y1054-I1134 HydrophobicContact CD2-CG1 4.39Å; Y1054-I1134 HydrophobicContact CD2-CG2 3.97Å; Y1054-I1134 HydrophobicContact CE2-CD1 4.38Å; Y1054-I1134 HydrophobicContact CE2-CG2 4.34Å; Y1054-I1134 HydrophobicContact CG-CB 4.29Å; Y1054-I1134 HydrophobicContact CG-CD1 4.34Å; Y1054-I1134 HydrophobicContact CG-CG2 3.98Å; A1057-I1134 HydrophobicContact CB-CB 4.48Å; A1057-I1134 HydrophobicContact CB-CD1 3.31Å; A1057-I1134 VanDerWaalsContact CB-CD1 3.43Å; A1057-I1134 HydrophobicContact CB-CG1 3.96Å; S1130-I1134 VanDerWaalsContact O-CG1 3.24Å; S1130-I1134 WeakPolarHBondContact O-CG1 3.33Å; S1130-I1134 PolarHBondContact O-N 3.26Å; S1130-I1134 VanDerWaalsContact O-N 3.07Å; A1131-I1134 PolarHBondContact O-N 3.2Å; A1131-I1134 VanDerWaalsContact O-N 3.11Å; L1132-I1134 VanDerWaalsContact C-N 3.29Å; L1132-I1134 PolarHBondContact O-N 3.04Å; I1134-L1136 VanDerWaalsContact C-N 3.3Å; I1134-L1136 PolarHBondContact O-N 3.02Å; I1134-I1137 HydrophobicContact CD1-CD1 4.48Å; I1134-I1137 PolarHBondContact O-N 2.97Å; I1134-I1137 VanDerWaalsContact O-N 3.12Å; I1134-E1138 HydrophobicContact CG2-CG 4.18Å; I1134-E1138 PolarHBondContact O-N 3.32Å; I1134-W1141 VanDerWaalsContact C-CD1 3.43Å; I1134-W1141 HydrophobicContact CB-CD2 4.07Å; I1134-W1141 HydrophobicContact CB-CE3 4.45Å; I1134-W1141 HydrophobicContact CB-CG 4.03Å; I1134-W1141 HydrophobicContact CB-CZ2 4.33Å; I1134-W1141 HydrophobicContact CD1-CE3 4.37Å; I1134-W1141 HydrophobicContact CD1-CZ3 4.46Å; I1134-W1141 HydrophobicContact CG2-CB 3.63Å; I1134-W1141 VanDerWaalsContact CG2-CD1 3.44Å; I1134-W1141 HydrophobicContact CG2-CD2 3.51Å; I1134-W1141 VanDerWaalsContact CG2-CD2 3.47Å; I1134-W1141 HydrophobicContact CG2-CE3 4.05Å; I1134-W1141 HydrophobicContact CG2-CG 3.32Å; I1134-W1141 VanDerWaalsContact CG2-CG 3.4Å
1135	S	72.1	Confident	63.6	Low	5 Å²	5	35 Å²	35	4%	0.035	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-33.3	176.2	-67.9	0	0	0	0	113.7	Y1054 E1069 A1131 L1132 T1133 I1137 E1138 S1139 W1141 R1281	Y1054-S1135 WeakPolarHBondContact CE2-OG 3.49Å; E1069-S1135 VanDerWaalsContact OE1-CB 3.23Å; E1069-S1135 WeakPolarHBondContact OE1-CB 3.4Å; E1069-S1135 PolarHBondContact OE1-OG 3.28Å; A1131-S1135 PolarHBondContact O-N 3.23Å; A1131-S1135 PolarHBondContact O-OG 3.17Å; L1132-S1135 WeakPolarHBondContact O-CB 3.39Å; L1132-S1135 PolarHBondContact O-N 3.36Å; L1132-S1135 VanDerWaalsContact O-N 3.13Å; T1133-S1135 VanDerWaalsContact C-N 3.34Å; T1133-S1135 PolarHBondContact O-N 3.16Å; S1135-I1137 VanDerWaalsContact C-N 3.32Å; S1135-E1138 CarbonylContact O-C 3.57Å; S1135-S1139 PolarHBondContact O-N 2.79Å; S1135-W1141 VanDerWaalsContact CA-NE1 3.32Å; S1135-W1141 VanDerWaalsContact N-NE1 3.17Å; S1135-W1141 PolarHBondContact OG-NE1 3.05Å; S1135-R1281 PolarHBondContact OG-NH2 2.62Å
1136	L	72.1	Confident	61.4	Low	3.2 Å²	3.2	38.5 Å²	38.5	2%	0.017	20%	0.204	C	C	.	.	H	α-helix	trans	-76.4	-26.3	177.3	-67.6	175.3	0	0	0	113.2	F1072 L1132 T1133 I1134 F1284 H1287 I1289 A1378	F1072-L1136 HydrophobicContact CD1-CD2 3.75Å; F1072-L1136 HydrophobicContact CD2-CD1 4.45Å; F1072-L1136 HydrophobicContact CE1-CD1 4.36Å; F1072-L1136 HydrophobicContact CE1-CD2 3.31Å; F1072-L1136 VanDerWaalsContact CE1-CD2 3.42Å; F1072-L1136 HydrophobicContact CE1-CG 4.45Å; F1072-L1136 HydrophobicContact CE2-CD1 3.96Å; F1072-L1136 HydrophobicContact CE2-CD2 4.36Å; F1072-L1136 HydrophobicContact CG-CD2 4.43Å; F1072-L1136 HydrophobicContact CZ-CD1 3.85Å; F1072-L1136 HydrophobicContact CZ-CD2 3.65Å; F1072-L1136 VanDerWaalsContact CZ-CD2 3.5Å; F1072-L1136 HydrophobicContact CZ-CG 4.39Å; L1132-L1136 HydrophobicContact CD1-CD1 4.4Å; L1132-L1136 HydrophobicContact CD1-CD2 4.48Å; L1132-L1136 HydrophobicContact CD1-CG 4.23Å; L1132-L1136 HydrophobicContact CG-CD1 4.09Å; L1132-L1136 HydrophobicContact CG-CG 4.34Å; L1132-L1136 VanDerWaalsContact O-CG 3.3Å; L1132-L1136 WeakPolarHBondContact O-CG 3.39Å; L1132-L1136 PolarHBondContact O-N 3.07Å; T1133-L1136 PolarHBondContact O-N 2.92Å; I1134-L1136 VanDerWaalsContact C-N 3.3Å; I1134-L1136 PolarHBondContact O-N 3.02Å; L1136-F1284 HydrophobicContact CD2-CB 4.04Å; L1136-F1284 HydrophobicContact CD2-CD1 4.01Å; L1136-F1284 HydrophobicContact CD2-CD2 4.14Å; L1136-F1284 HydrophobicContact CD2-CE1 4.37Å; L1136-F1284 HydrophobicContact CD2-CG 3.78Å; L1136-H1287 PolarHBondContact O-N 2.89Å; L1136-I1289 HydrophobicContact CB-CD1 3.48Å; L1136-I1289 VanDerWaalsContact CB-CD1 3.47Å; L1136-I1289 HydrophobicContact CB-CG1 4.45Å; L1136-I1289 HydrophobicContact CD1-CD1 4.23Å; L1136-I1289 HydrophobicContact CG-CD1 4.47Å; L1136-A1378 HydrophobicContact CD1-CB 4.28Å
1137	I	65.3	Low	59.2	Low	41.4 Å²	41.4	42.5 Å²	42.5	21%	0.212	22%	0.221	C	C	.	.	H	α-helix	trans	-84.8	-46.2	177.9	-62.1	163.6	0	0	0	110.7	I1046 L1049 T1133 I1134 S1135 S1139 I1215 L1216 I1289	I1046-I1137 HydrophobicContact CD1-CD1 4.17Å; I1046-I1137 HydrophobicContact CD1-CG2 3.73Å; I1046-I1137 HydrophobicContact CG1-CD1 3.7Å; I1046-I1137 HydrophobicContact CG1-CG2 4.33Å; L1049-I1137 HydrophobicContact CD1-CD1 3.28Å; L1049-I1137 HydrophobicContact CD1-CG1 4.27Å; L1049-I1137 HydrophobicContact CD2-CD1 3.89Å; L1049-I1137 HydrophobicContact CG-CD1 3.95Å; T1133-I1137 HydrophobicContact CG2-CD1 3.95Å; T1133-I1137 VanDerWaalsContact O-CD1 3.26Å; T1133-I1137 WeakPolarHBondContact O-CD1 3.33Å; T1133-I1137 VanDerWaalsContact O-CG1 3.26Å; T1133-I1137 WeakPolarHBondContact O-CG1 3.4Å; T1133-I1137 PolarHBondContact O-N 3.24Å; T1133-I1137 VanDerWaalsContact O-N 3.14Å; I1134-I1137 HydrophobicContact CD1-CD1 4.48Å; I1134-I1137 PolarHBondContact O-N 2.97Å; I1134-I1137 VanDerWaalsContact O-N 3.12Å; S1135-I1137 VanDerWaalsContact C-N 3.32Å; I1137-S1139 PolarHBondContact O-N 3.16Å; I1137-I1215 HydrophobicContact CB-CD1 4.26Å; I1137-I1215 HydrophobicContact CD1-CD1 3.41Å; I1137-I1215 VanDerWaalsContact CD1-CD1 3.41Å; I1137-I1215 HydrophobicContact CD1-CG1 3.83Å; I1137-I1215 HydrophobicContact CG1-CD1 3.53Å; I1137-I1215 HydrophobicContact CG1-CG1 3.85Å; I1137-I1215 HydrophobicContact CG2-CD1 3.68Å; I1137-L1216 HydrophobicContact CD1-CB 4.19Å; I1137-L1216 HydrophobicContact CD1-CD1 4.17Å; I1137-L1216 HydrophobicContact CD1-CD2 4.39Å; I1137-L1216 HydrophobicContact CD1-CG 4.47Å; I1137-I1289 HydrophobicContact CD1-CD1 4.16Å; I1137-I1289 HydrophobicContact CG1-CD1 3.53Å; I1137-I1289 VanDerWaalsContact CG1-CD1 3.47Å; I1137-I1289 HydrophobicContact CG1-CG1 4.35Å
1138	E	64.1	Low	57.1	Low	72 Å²	72	46.1 Å²	46.1	34%	0.336	24%	0.239	S	C	.	.			trans	-120.2	94	-173.7	-68.5	-167.3	159.7	0	0	111.3	R1050 I1134 S1135 N1140 W1141	R1050-E1138 IonicContact CZ-OE1 3.03Å; R1050-E1138 IonicContact CZ-OE2 3.73Å; R1050-E1138 IonicContact NE-OE1 3.31Å; R1050-E1138 PolarHBondContact NE-OE1 3.05Å; R1050-E1138 VanDerWaalsContact NE-OE1 3.14Å; R1050-E1138 IonicContact NE-OE2 2.94Å; R1050-E1138 IonicContact NH1-OE1 3.41Å; R1050-E1138 PolarHBondContact NH1-OE1 3.44Å; R1050-E1138 IonicContact NH2-OE1 3.46Å; R1050-E1138 PolarHBondContact NH2-OE1 2.87Å; R1050-E1138 IonicContact NH2-OE2 2.65Å; R1050-E1138 PolarHBondContact NH2-OE2 3.15Å; I1134-E1138 HydrophobicContact CG2-CG 4.18Å; I1134-E1138 PolarHBondContact O-N 3.32Å; S1135-E1138 CarbonylContact O-C 3.57Å; E1138-N1140 PolarHBondContact O-N 3.2Å; E1138-N1140 VanDerWaalsContact O-N 3.16Å; E1138-W1141 HydrophobicContact CB-CB 3.96Å; E1138-W1141 VanDerWaalsContact O-CD1 3.25Å; E1138-W1141 PolarHBondContact O-N 3.37Å; E1138-W1141 WeakPolarHBondContact OE2-CB 3.32Å
1139	S	55	Low	55	Low	46.8 Å²	46.8	52.6 Å²	52.6	33%	0.327	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-10	179.6	55.6	0	0	0	0	115	S1135 I1137 Y1142 R1281 F1284	S1135-S1139 PolarHBondContact O-N 2.79Å; I1137-S1139 PolarHBondContact O-N 3.16Å; S1139-Y1142 VanDerWaalsContact O-CE1 3.28Å; S1139-Y1142 WeakPolarHBondContact O-CE1 3.23Å; S1139-R1281 PolarHBondContact O-NH1 3.22Å; S1139-F1284 WeakPolarHBondContact CB-O 3.43Å
1140	N	50.2	Low	53	Low	80.4 Å²	80.4	56.8 Å²	56.8	43%	0.43	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	15.1	-174.6	-72.8	-50.1	0	0	0	114.6	E1138 Y1142 K1143	E1138-N1140 PolarHBondContact O-N 3.2Å; E1138-N1140 VanDerWaalsContact O-N 3.16Å; N1140-Y1142 PolarHBondContact O-N 3.15Å; N1140-Y1142 VanDerWaalsContact O-N 3.09Å; N1140-K1143 HydrophobicContact CB-CB 4.46Å; N1140-K1143 HydrophobicContact CB-CD 4.13Å; N1140-K1143 HydrophobicContact CB-CG 4.32Å; N1140-K1143 WeakPolarHBondContact O-CA 3.34Å; N1140-K1143 WeakPolarHBondContact O-CB 3.36Å; N1140-K1143 WeakPolarHBondContact O-CG 3.17Å; N1140-K1143 PolarHBondContact O-N 3.34Å; N1140-K1143 WeakPolarHBondContact OD1-CD 3.41Å; N1140-K1143 VanDerWaalsContact OD1-CE 3.31Å; N1140-K1143 WeakPolarHBondContact OD1-CE 3.4Å; N1140-K1143 PolarHBondContact OD1-NZ 3.18Å
1141	W	49.1	Very low	51.1	Low	45.8 Å²	45.8	61.3 Å²	61.3	17%	0.173	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-60.5	-29.5	-176.9	73.3	-89.1	0	0	0	113.7	Y1054 A1057 I1060 L1065 A1131 I1134 S1135 E1138 K1143 S1144 I1145	Y1054-W1141 HydrophobicContact CD2-CE3 4.34Å; Y1054-W1141 HydrophobicContact CE2-CB 4.22Å; Y1054-W1141 AromaticContact CE2-CE3 3.78Å; Y1054-W1141 HydrophobicContact CE2-CE3 3.99Å; A1057-W1141 HydrophobicContact CB-CH2 4.05Å; A1057-W1141 HydrophobicContact CB-CZ2 4.38Å; A1057-W1141 HydrophobicContact CB-CZ3 4.07Å; I1060-W1141 HydrophobicContact CG2-CH2 4.33Å; L1065-W1141 HydrophobicContact CD1-CZ2 4.05Å; L1065-W1141 HydrophobicContact CD2-CH2 4.05Å; L1065-W1141 HydrophobicContact CD2-CZ2 3.98Å; A1131-W1141 HydrophobicContact CB-CH2 4.15Å; A1131-W1141 HydrophobicContact CB-CZ2 4.09Å; A1131-W1141 WeakPolarHBondContact O-CZ2 3.38Å; I1134-W1141 VanDerWaalsContact C-CD1 3.43Å; I1134-W1141 HydrophobicContact CB-CD2 4.07Å; I1134-W1141 HydrophobicContact CB-CE3 4.45Å; I1134-W1141 HydrophobicContact CB-CG 4.03Å; I1134-W1141 HydrophobicContact CB-CZ2 4.33Å; I1134-W1141 HydrophobicContact CD1-CE3 4.37Å; I1134-W1141 HydrophobicContact CD1-CZ3 4.46Å; I1134-W1141 HydrophobicContact CG2-CB 3.63Å; I1134-W1141 VanDerWaalsContact CG2-CD1 3.44Å; I1134-W1141 HydrophobicContact CG2-CD2 3.51Å; I1134-W1141 VanDerWaalsContact CG2-CD2 3.47Å; I1134-W1141 HydrophobicContact CG2-CE3 4.05Å; I1134-W1141 HydrophobicContact CG2-CG 3.32Å; I1134-W1141 VanDerWaalsContact CG2-CG 3.4Å; S1135-W1141 VanDerWaalsContact CA-NE1 3.32Å; S1135-W1141 VanDerWaalsContact N-NE1 3.17Å; S1135-W1141 PolarHBondContact OG-NE1 3.05Å; E1138-W1141 HydrophobicContact CB-CB 3.96Å; E1138-W1141 VanDerWaalsContact O-CD1 3.25Å; E1138-W1141 PolarHBondContact O-N 3.37Å; E1138-W1141 WeakPolarHBondContact OE2-CB 3.32Å; W1141-K1143 PolarHBondContact O-N 3.12Å; W1141-K1143 VanDerWaalsContact O-N 3.1Å; W1141-S1144 WeakPolarHBondContact CA-OG 3.14Å; W1141-S1144 PolarHBondContact O-N 3.19Å; W1141-S1144 VanDerWaalsContact O-N 3.11Å; W1141-S1144 PolarHBondContact O-OG 2.94Å; W1141-I1145 HydrophobicContact CE3-CD1 4.3Å; W1141-I1145 HydrophobicContact CZ3-CD1 4.08Å; W1141-I1145 PolarHBondContact O-N 2.88Å
1142	Y	45.4	Very low	49.2	Very low	71.8 Å²	71.8	67.1 Å²	67.1	28%	0.282	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-75.7	-0.9	176.3	107.2	-92.4	0	0	0	112.4	I1060 P1062 L1065 S1139 N1140 S1144 I1145	I1060-Y1142 HydrophobicContact CG2-CE2 4.3Å; P1062-Y1142 HydrophobicContact CG-CE1 4.45Å; P1062-Y1142 WeakPolarHBondContact CG-OH 3.21Å; L1065-Y1142 HydrophobicContact CD2-CD1 3.42Å; L1065-Y1142 VanDerWaalsContact CD2-CD1 3.42Å; L1065-Y1142 HydrophobicContact CD2-CD2 4.05Å; L1065-Y1142 HydrophobicContact CD2-CE1 3.79Å; L1065-Y1142 HydrophobicContact CD2-CE2 4.03Å; L1065-Y1142 HydrophobicContact CD2-CG 3.34Å; S1139-Y1142 VanDerWaalsContact O-CE1 3.28Å; S1139-Y1142 WeakPolarHBondContact O-CE1 3.23Å; N1140-Y1142 PolarHBondContact O-N 3.15Å; N1140-Y1142 VanDerWaalsContact O-N 3.09Å; Y1142-S1144 VanDerWaalsContact C-N 3.31Å; Y1142-S1144 PolarHBondContact O-N 2.99Å; Y1142-S1144 VanDerWaalsContact O-N 3.15Å; Y1142-I1145 WeakPolarHBondContact O-CB 3.27Å; Y1142-I1145 VanDerWaalsContact O-CD1 3.27Å; Y1142-I1145 WeakPolarHBondContact O-CD1 3.34Å; Y1142-I1145 VanDerWaalsContact O-CG1 3.25Å; Y1142-I1145 WeakPolarHBondContact O-CG1 3.5Å
1143	K	41.2	Very low	47.2	Very low	123.6 Å²	123.6	72.6 Å²	72.6	54%	0.537	37%	0.373	S	S	.	.			trans	-78.4	22.1	174.8	-68.9	-179.1	179.7	162.6	0	111.8	N1140 W1141 I1145 L1237	N1140-K1143 HydrophobicContact CB-CB 4.46Å; N1140-K1143 HydrophobicContact CB-CD 4.13Å; N1140-K1143 HydrophobicContact CB-CG 4.32Å; N1140-K1143 WeakPolarHBondContact O-CA 3.34Å; N1140-K1143 WeakPolarHBondContact O-CB 3.36Å; N1140-K1143 WeakPolarHBondContact O-CG 3.17Å; N1140-K1143 PolarHBondContact O-N 3.34Å; N1140-K1143 WeakPolarHBondContact OD1-CD 3.41Å; N1140-K1143 VanDerWaalsContact OD1-CE 3.31Å; N1140-K1143 WeakPolarHBondContact OD1-CE 3.4Å; N1140-K1143 PolarHBondContact OD1-NZ 3.18Å; W1141-K1143 PolarHBondContact O-N 3.12Å; W1141-K1143 VanDerWaalsContact O-N 3.1Å; K1143-I1145 VanDerWaalsContact C-N 3.32Å; K1143-I1145 PolarHBondContact O-N 3.05Å; K1143-L1237 HydrophobicContact CB-CD2 4.09Å; K1143-L1237 HydrophobicContact CD-CD2 3.82Å; K1143-L1237 HydrophobicContact CG-CD2 3.97Å
1144	S	34.7	Very low	45.3	Very low	64.6 Å²	64.6	79.3 Å²	79.3	45%	0.452	40%	0.402	S	S	.	.			trans	-86.9	37	168.7	49.6	0	0	0	0	112	G783 Y1054 W1141 Y1142	G783-S1144 PolarHBondContact N-OG 3.4Å; Y1054-S1144 PolarHBondContact OH-OG 3.46Å; W1141-S1144 WeakPolarHBondContact CA-OG 3.14Å; W1141-S1144 PolarHBondContact O-N 3.19Å; W1141-S1144 VanDerWaalsContact O-N 3.11Å; W1141-S1144 PolarHBondContact O-OG 2.94Å; Y1142-S1144 VanDerWaalsContact C-N 3.31Å; Y1142-S1144 PolarHBondContact O-N 2.99Å; Y1142-S1144 VanDerWaalsContact O-N 3.15Å
1145	I	32.2	Very low	43.4	Very low	74.8 Å²	74.8	85.6 Å²	85.6	38%	0.384	43%	0.429	S	S	.	.	S	Bend	trans	-61.9	122.2	153.5	-62.8	169.9	0	0	0	108.6	Y661 Y690 R781 W1141 Y1142 K1143 M1147 L1216	Y661-I1145 HydrophobicContact CD1-CD1 4.3Å; Y690-I1145 HydrophobicContact CD1-CB 4.47Å; Y690-I1145 HydrophobicContact CD1-CG1 4.42Å; Y690-I1145 HydrophobicContact CD1-CG2 3.62Å; Y690-I1145 HydrophobicContact CD2-CB 4.23Å; Y690-I1145 HydrophobicContact CD2-CG2 2.83Å; Y690-I1145 HydrophobicContact CE1-CG2 3.77Å; Y690-I1145 HydrophobicContact CE2-CB 4.4Å; Y690-I1145 HydrophobicContact CE2-CG2 3Å; Y690-I1145 HydrophobicContact CG-CB 4.25Å; Y690-I1145 HydrophobicContact CG-CD1 4.32Å; Y690-I1145 HydrophobicContact CG-CG1 4.22Å; Y690-I1145 HydrophobicContact CG-CG2 3.16Å; Y690-I1145 VanDerWaalsContact CZ-CG2 3.49Å; R781-I1145 HydrophobicContact CB-CD1 4.07Å; W1141-I1145 HydrophobicContact CE3-CD1 4.3Å; W1141-I1145 HydrophobicContact CZ3-CD1 4.08Å; W1141-I1145 PolarHBondContact O-N 2.88Å; Y1142-I1145 WeakPolarHBondContact O-CB 3.27Å; Y1142-I1145 VanDerWaalsContact O-CD1 3.27Å; Y1142-I1145 WeakPolarHBondContact O-CD1 3.34Å; Y1142-I1145 VanDerWaalsContact O-CG1 3.25Å; Y1142-I1145 WeakPolarHBondContact O-CG1 3.5Å; K1143-I1145 VanDerWaalsContact C-N 3.32Å; K1143-I1145 PolarHBondContact O-N 3.05Å; I1145-M1147 PolarHBondContact O-N 3.14Å; I1145-M1147 VanDerWaalsContact O-N 3.12Å; I1145-L1216 HydrophobicContact CG2-CD1 3.79Å
1146	P	30.4	Very low	41.6	Very low	86.6 Å²	86.6	87.9 Å²	87.9	56%	0.562	45%	0.449	S	S	*	.			trans	-67.9	105.6	-170.8	17.2	-20.9	0	0	0	112.5	Y690 N1148 C1214 I1215 L1216	Y690-P1146 HydrophobicContact CE1-CG 4.07Å; Y690-P1146 VanDerWaalsContact CZ-O 3.3Å; Y690-P1146 WeakPolarHBondContact OH-CG 3.47Å; Y690-P1146 PolarHBondContact OH-O 3.14Å; P1146-N1148 PolarHBondContact O-N 3.33Å; P1146-C1214 VanDerWaalsContact CB-CA 3.43Å; P1146-C1214 HydrophobicContact CB-CB 3.38Å; P1146-C1214 WeakPolarHBondContact CB-O 3.33Å; P1146-C1214 VanDerWaalsContact CG-CA 3.47Å; P1146-C1214 HydrophobicContact CG-CB 3.07Å; P1146-C1214 VanDerWaalsContact CG-O 3.26Å; P1146-C1214 WeakPolarHBondContact CG-O 3.18Å; P1146-I1215 WeakPolarHBondContact CG-O 3.21Å; P1146-L1216 HydrophobicContact CG-CB 4.26Å; P1146-L1216 VanDerWaalsContact CG-N 3.33Å; P1146-L1216 WeakPolarHBondContact O-CB 3.27Å; P1146-L1216 PolarHBondContact O-N 3.15Å
1147	M	28.5	Very low	39.9	Very low	122.8 Å²	122.8	92 Å²	92	61%	0.605	48%	0.475	S	S	*	.			trans	-73.5	128.1	167.9	-90	-125.5	151	0	0	109.8	D682 I1145 K1149 L1230 L1233 L1237	D682-M1147 HydrophobicContact CB-CE 4.25Å; I1145-M1147 PolarHBondContact O-N 3.14Å; I1145-M1147 VanDerWaalsContact O-N 3.12Å; M1147-K1149 VanDerWaalsContact C-N 3.29Å; M1147-K1149 PolarHBondContact O-N 3.12Å; M1147-K1149 VanDerWaalsContact O-N 3.11Å; M1147-L1230 HydrophobicContact CE-CD2 3.51Å; M1147-L1233 HydrophobicContact CE-CB 3.93Å; M1147-L1233 HydrophobicContact CE-CD2 3.43Å; M1147-L1233 VanDerWaalsContact CE-CD2 3.43Å; M1147-L1233 HydrophobicContact CE-CG 4.24Å; M1147-L1233 HydrophobicContact CG-CD2 3.81Å; M1147-L1233 HydrophobicContact SD-CD2 3.76Å; M1147-L1233 HydrophobicContact SD-CG 4.5Å; M1147-L1237 HydrophobicContact CG-CD1 3.68Å; M1147-L1237 HydrophobicContact SD-CD1 3.23Å; M1147-L1237 WeakPolarHBondContact SD-CD1 3.42Å
1148	N	29.9	Very low	38.3	Very low	104 Å²	104	97.4 Å²	97.4	56%	0.556	50%	0.496	S	S	*	.			trans	-62.1	103.7	-177.9	-149.6	-11.9	0	0	0	111	P1146 T1150 I1151	P1146-N1148 PolarHBondContact O-N 3.33Å; N1148-T1150 PolarHBondContact O-N 3.21Å; N1148-T1150 VanDerWaalsContact O-N 3.14Å; N1148-T1150 WeakPolarHBondContact OD1-CB 3.33Å; N1148-T1150 PolarHBondContact OD1-N 3.26Å; N1148-T1150 PolarHBondContact OD1-OG1 3.16Å; N1148-T1150 VanDerWaalsContact OD1-OG1 3.08Å; N1148-I1151 HydrophobicContact CB-CD1 4.28Å; N1148-I1151 HydrophobicContact CB-CG1 4.43Å; N1148-I1151 PolarHBondContact O-N 3.31Å
1149	K	35	Very low	36.7	Very low	150.4 Å²	150.4	100 Å²	100	65%	0.654	51%	0.512	S	S	*	.	H	α-helix	trans	-59.2	-12.8	179.5	-86.6	-178	175.1	177.7	0	114	M1147 I1151 Q1152 N1153	M1147-K1149 VanDerWaalsContact C-N 3.29Å; M1147-K1149 PolarHBondContact O-N 3.12Å; M1147-K1149 VanDerWaalsContact O-N 3.11Å; K1149-I1151 VanDerWaalsContact C-N 3.27Å; K1149-I1151 PolarHBondContact O-N 2.89Å; K1149-Q1152 PolarHBondContact O-N 3.39Å; K1149-N1153 PolarHBondContact O-N 2.88Å
1150	T	35.5	Very low	35.7	Very low	89.8 Å²	89.8	104.4 Å²	104.4	55%	0.551	53%	0.532	S	S	*	.	H	α-helix	trans	-68.9	-22.1	178.7	-11.4	0	0	0	0	113.6	N1148 K1154	N1148-T1150 PolarHBondContact O-N 3.21Å; N1148-T1150 VanDerWaalsContact O-N 3.14Å; N1148-T1150 WeakPolarHBondContact OD1-CB 3.33Å; N1148-T1150 PolarHBondContact OD1-N 3.26Å; N1148-T1150 PolarHBondContact OD1-OG1 3.16Å; N1148-T1150 VanDerWaalsContact OD1-OG1 3.08Å; T1150-K1154 VanDerWaalsContact O-CD 3.32Å; T1150-K1154 WeakPolarHBondContact O-CD 3.32Å; T1150-K1154 WeakPolarHBondContact O-CG 3.36Å; T1150-K1154 PolarHBondContact O-N 3.08Å
1151	I	35.5	Very low	34.9	Very low	93.8 Å²	93.8	104.8 Å²	104.8	48%	0.481	54%	0.541	S	S	.	.	H	α-helix	trans	-86.5	-35.1	179.8	-60.7	176	0	0	0	111.5	N1148 K1149 N1153 K1154 F1155	N1148-I1151 HydrophobicContact CB-CD1 4.28Å; N1148-I1151 HydrophobicContact CB-CG1 4.43Å; N1148-I1151 PolarHBondContact O-N 3.31Å; K1149-I1151 VanDerWaalsContact C-N 3.27Å; K1149-I1151 PolarHBondContact O-N 2.89Å; I1151-N1153 VanDerWaalsContact C-N 3.33Å; I1151-N1153 PolarHBondContact O-N 3.1Å; I1151-K1154 PolarHBondContact O-N 3.15Å; I1151-F1155 HydrophobicContact CG2-CD2 3.92Å; I1151-F1155 HydrophobicContact CG2-CE2 4.08Å; I1151-F1155 VanDerWaalsContact O-CD2 3.29Å; I1151-F1155 WeakPolarHBondContact O-CD2 3.33Å; I1151-F1155 PolarHBondContact O-N 3.04Å; I1151-F1155 VanDerWaalsContact O-N 3.12Å
1152	Q	32.9	Very low	34.1	Very low	122.6 Å²	122.6	109.3 Å²	109.3	57%	0.573	57%	0.567	S	S	*	*	H	α-helix	trans	-67	-37.2	177.6	-81.1	-179.4	-17.7	0	0	112.8	K1149 K1154 F1155 A1156 T1234	K1149-Q1152 PolarHBondContact O-N 3.39Å; Q1152-K1154 PolarHBondContact O-N 3.04Å; Q1152-F1155 PolarHBondContact O-N 2.92Å; Q1152-A1156 VanDerWaalsContact O-CB 3.3Å; Q1152-A1156 WeakPolarHBondContact O-CB 3.34Å; Q1152-A1156 PolarHBondContact O-N 2.89Å; Q1152-T1234 HydrophobicContact CG-CG2 4.28Å
1153	N	36.5	Very low	33.3	Very low	116.8 Å²	116.8	109 Å²	109	63%	0.625	59%	0.586	S	S	*	*	H	α-helix	trans	-75.3	-21.7	-179.8	-74.1	-5.1	0	0	0	113.6	K1149 I1151 F1155 A1156 T1157	K1149-N1153 PolarHBondContact O-N 2.88Å; I1151-N1153 VanDerWaalsContact C-N 3.33Å; I1151-N1153 PolarHBondContact O-N 3.1Å; N1153-F1155 VanDerWaalsContact C-N 3.29Å; N1153-F1155 PolarHBondContact O-N 3.17Å; N1153-A1156 PolarHBondContact O-N 2.83Å; N1153-T1157 WeakPolarHBondContact O-CG2 3.27Å; N1153-T1157 PolarHBondContact O-N 3.21Å; N1153-T1157 PolarHBondContact O-OG1 3.11Å; N1153-T1157 VanDerWaalsContact O-OG1 3.08Å
1154	K	34.7	Very low	32.8	Very low	141.2 Å²	141.2	107.9 Å²	107.9	61%	0.614	59%	0.594	S	S	*	*	H	α-helix	trans	-82.8	-22.7	174.8	-88.2	-177.3	173.8	178.4	0	113.7	T1150 I1151 Q1152 T1157 I1188	T1150-K1154 VanDerWaalsContact O-CD 3.32Å; T1150-K1154 WeakPolarHBondContact O-CD 3.32Å; T1150-K1154 WeakPolarHBondContact O-CG 3.36Å; T1150-K1154 PolarHBondContact O-N 3.08Å; I1151-K1154 PolarHBondContact O-N 3.15Å; Q1152-K1154 PolarHBondContact O-N 3.04Å; K1154-T1157 PolarHBondContact O-OG1 3.09Å; K1154-I1188 HydrophobicContact CB-CG2 4.01Å; K1154-I1188 HydrophobicContact CD-CB 4.49Å; K1154-I1188 HydrophobicContact CD-CG2 4.35Å; K1154-I1188 WeakPolarHBondContact CD-O 3.39Å; K1154-I1188 WeakPolarHBondContact CE-O 3.33Å; K1154-I1188 PolarHBondContact NZ-O 2.86Å
1155	F	31	Very low	32.4	Very low	139.4 Å²	139.4	113.9 Å²	113.9	61%	0.611	61%	0.612	S	S	*	*	H	α-helix	trans	-87.1	-32.9	175.6	-90.3	-85.1	0	0	0	112.9	I1151 Q1152 N1153 T1157 K1158 L1159 I1188	I1151-F1155 HydrophobicContact CG2-CD2 3.92Å; I1151-F1155 HydrophobicContact CG2-CE2 4.08Å; I1151-F1155 VanDerWaalsContact O-CD2 3.29Å; I1151-F1155 WeakPolarHBondContact O-CD2 3.33Å; I1151-F1155 PolarHBondContact O-N 3.04Å; I1151-F1155 VanDerWaalsContact O-N 3.12Å; Q1152-F1155 PolarHBondContact O-N 2.92Å; N1153-F1155 VanDerWaalsContact C-N 3.29Å; N1153-F1155 PolarHBondContact O-N 3.17Å; F1155-T1157 VanDerWaalsContact C-N 3.3Å; F1155-T1157 PolarHBondContact O-N 3.41Å; F1155-K1158 PolarHBondContact O-N 3.03Å; F1155-K1158 VanDerWaalsContact O-N 3.13Å; F1155-L1159 PolarHBondContact O-N 3.1Å; F1155-L1159 VanDerWaalsContact O-N 3.1Å; F1155-I1188 HydrophobicContact CE2-CD1 4.39Å; F1155-I1188 HydrophobicContact CZ-CD1 4.46Å
1156	A	35.3	Very low	32.2	Very low	54.8 Å²	54.8	118.6 Å²	118.6	45%	0.453	64%	0.635	S	S	.	*	H	α-helix	trans	-70.3	-30.8	177.6	0	0	0	0	0	113.2	Q1152 N1153 K1158 L1159 N1160	Q1152-A1156 VanDerWaalsContact O-CB 3.3Å; Q1152-A1156 WeakPolarHBondContact O-CB 3.34Å; Q1152-A1156 PolarHBondContact O-N 2.89Å; N1153-A1156 PolarHBondContact O-N 2.83Å; A1156-K1158 VanDerWaalsContact C-N 3.31Å; A1156-K1158 PolarHBondContact O-N 3.38Å; A1156-L1159 PolarHBondContact O-N 3.1Å; A1156-N1160 WeakPolarHBondContact O-CB 3.34Å; A1156-N1160 PolarHBondContact O-N 2.87Å; A1156-N1160 VanDerWaalsContact O-N 3.12Å; A1156-N1160 PolarHBondContact O-ND2 2.73Å
1157	T	36	Very low	32	Very low	89 Å²	89	121.3 Å²	121.3	55%	0.546	64%	0.644	S	S	.	*	H	α-helix	trans	-78.7	-17.4	178.3	45.9	0	0	0	0	113.6	N1153 K1154 F1155 L1159 N1160 S1161 H1191	N1153-T1157 WeakPolarHBondContact O-CG2 3.27Å; N1153-T1157 PolarHBondContact O-N 3.21Å; N1153-T1157 PolarHBondContact O-OG1 3.11Å; N1153-T1157 VanDerWaalsContact O-OG1 3.08Å; K1154-T1157 PolarHBondContact O-OG1 3.09Å; F1155-T1157 VanDerWaalsContact C-N 3.3Å; F1155-T1157 PolarHBondContact O-N 3.41Å; T1157-L1159 VanDerWaalsContact C-N 3.35Å; T1157-N1160 PolarHBondContact O-N 3.3Å; T1157-S1161 PolarHBondContact O-N 2.72Å; T1157-S1161 PolarHBondContact O-OG 2.99Å; T1157-H1191 WeakPolarHBondContact CB-O 3.29Å; T1157-H1191 WeakPolarHBondContact CG2-O 3.45Å
1158	K	31.1	Very low	32	Very low	154.8 Å²	154.8	122.5 Å²	122.5	67%	0.673	65%	0.653	S	S	*	*	H	α-helix	trans	-95.2	-13	179.2	-143	170.7	-172.5	178.2	0	113.7	F1155 A1156 S1161 I1162	F1155-K1158 PolarHBondContact O-N 3.03Å; F1155-K1158 VanDerWaalsContact O-N 3.13Å; A1156-K1158 VanDerWaalsContact C-N 3.31Å; A1156-K1158 PolarHBondContact O-N 3.38Å; K1158-S1161 PolarHBondContact O-OG 3.08Å; K1158-S1161 VanDerWaalsContact O-OG 3.11Å; K1158-I1162 WeakPolarHBondContact O-CD1 3.36Å; K1158-I1162 WeakPolarHBondContact O-CG1 3.33Å
1159	L	30.9	Very low	31.8	Very low	127.2 Å²	127.2	122.9 Å²	122.9	67%	0.666	66%	0.664	S	S	*	*	H	α-helix	trans	-93	-24.6	174.4	-99.1	148.8	0	0	0	112.9	F1155 A1156 T1157 S1161 I1162 G1163	F1155-L1159 PolarHBondContact O-N 3.1Å; F1155-L1159 VanDerWaalsContact O-N 3.1Å; A1156-L1159 PolarHBondContact O-N 3.1Å; T1157-L1159 VanDerWaalsContact C-N 3.35Å; L1159-S1161 VanDerWaalsContact C-N 3.27Å; L1159-S1161 PolarHBondContact O-N 3.03Å; L1159-I1162 PolarHBondContact O-N 3Å; L1159-I1162 VanDerWaalsContact O-N 3.16Å; L1159-G1163 PolarHBondContact O-N 3.38Å
1160	N	33.2	Very low	31.3	Very low	138 Å²	138	123.8 Å²	123.8	74%	0.738	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-3.5	174.6	-73.4	-16	0	0	0	113.1	A1156 T1157 I1162 G1163	A1156-N1160 WeakPolarHBondContact O-CB 3.34Å; A1156-N1160 PolarHBondContact O-N 2.87Å; A1156-N1160 VanDerWaalsContact O-N 3.12Å; A1156-N1160 PolarHBondContact O-ND2 2.73Å; T1157-N1160 PolarHBondContact O-N 3.3Å; N1160-I1162 VanDerWaalsContact C-N 3.35Å; N1160-I1162 PolarHBondContact O-N 3.19Å; N1160-G1163 PolarHBondContact O-N 2.83Å
1161	S	33.9	Very low	30.9	Very low	89.6 Å²	89.6	126 Å²	126	63%	0.627	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	10.3	170.4	57.6	0	0	0	0	115.4	T1157 K1158 L1159	T1157-S1161 PolarHBondContact O-N 2.72Å; T1157-S1161 PolarHBondContact O-OG 2.99Å; K1158-S1161 PolarHBondContact O-OG 3.08Å; K1158-S1161 VanDerWaalsContact O-OG 3.11Å; L1159-S1161 VanDerWaalsContact C-N 3.27Å; L1159-S1161 PolarHBondContact O-N 3.03Å
1162	I	31.9	Very low	30.5	Very low	138.8 Å²	138.8	130 Å²	130	71%	0.712	70%	0.697	S	S	*	*	S	Bend	trans	-121.8	4.4	171.9	-65.3	167.5	0	0	0	110.3	K1158 L1159 N1160 S1164 F1165	K1158-I1162 WeakPolarHBondContact O-CD1 3.36Å; K1158-I1162 WeakPolarHBondContact O-CG1 3.33Å; L1159-I1162 PolarHBondContact O-N 3Å; L1159-I1162 VanDerWaalsContact O-N 3.16Å; N1160-I1162 VanDerWaalsContact C-N 3.35Å; N1160-I1162 PolarHBondContact O-N 3.19Å; I1162-S1164 PolarHBondContact O-N 3.14Å; I1162-S1164 VanDerWaalsContact O-N 3.11Å; I1162-F1165 PolarHBondContact O-N 3.28Å
1163	G	29.6	Very low	30.1	Very low	66.8 Å²	66.8	128.9 Å²	128.9	69%	0.689	70%	0.703	S	S	*	*			trans	-90.7	16.1	-177.1	0	0	0	0	0	116.1	L1159 N1160 F1165	L1159-G1163 PolarHBondContact O-N 3.38Å; N1160-G1163 PolarHBondContact O-N 2.83Å; G1163-F1165 PolarHBondContact O-N 3.24Å
1164	S	29.6	Very low	29.6	Very low	100.6 Å²	100.6	132.3 Å²	132.3	70%	0.703	71%	0.712	S	S	*	*			trans	-79.8	31.5	178.1	96.9	0	0	0	0	116.7	I1162	I1162-S1164 PolarHBondContact O-N 3.14Å; I1162-S1164 VanDerWaalsContact O-N 3.11Å
1165	F	27.9	Very low	29.2	Very low	190.2 Å²	190.2	132.8 Å²	132.8	83%	0.834	72%	0.721	S	S	*	*	S	Bend	trans	-139.4	77.3	168.1	-95.6	-88	0	0	0	113.5	I1162 G1163	I1162-F1165 PolarHBondContact O-N 3.28Å; G1163-F1165 PolarHBondContact O-N 3.24Å
1166	M	26.1	Very low	28.9	Very low	173.8 Å²	173.8	133.4 Å²	133.4	86%	0.856	73%	0.729	S	S	*	*			trans	172	81	154.2	-83.9	-146.3	168.1	0	0	113.6	D1168	M1166-D1168 VanDerWaalsContact C-N 3.3Å; M1166-D1168 PolarHBondContact O-N 3.31Å
1167	N	27	Very low	28.4	Very low	142.8 Å²	142.8	136.4 Å²	136.4	76%	0.764	74%	0.742	S	S	*	*			trans	-77.1	114.6	143.5	-73.8	-7.7	0	0	0	112.7
1168	D	28.1	Very low	27.8	Very low	148.8 Å²	148.8	137.1 Å²	137.1	80%	0.796	75%	0.75	S	S	*	*			trans	106.6	122.1	130.1	-72.7	-24.3	0	0	0	117.6	M1166 M1170	M1166-D1168 VanDerWaalsContact C-N 3.3Å; M1166-D1168 PolarHBondContact O-N 3.31Å; D1168-M1170 PolarHBondContact O-N 3.3Å
1169	S	26.4	Very low	27.5	Very low	111.2 Å²	111.2	138.9 Å²	138.9	78%	0.778	76%	0.761	S	S	*	*			trans	70.4	113.4	154.2	68.4	0	0	0	0	118.5
1170	M	25.1	Very low	27.2	Very low	169.2 Å²	169.2	142.9 Å²	142.9	83%	0.833	77%	0.767	S	S	*	*			trans	129.5	121.1	135.5	-102.4	165.5	124.5	0	0	116.4	D1168 H1172	D1168-M1170 PolarHBondContact O-N 3.3Å; M1170-H1172 PolarHBondContact O-N 3.4Å
1171	D	27	Very low	26.8	Very low	136.8 Å²	136.8	141.9 Å²	141.9	73%	0.732	77%	0.769	S	S	*	*			trans	29.6	112.7	149.2	-77.1	-28.4	0	0	0	116.5	S1173	D1171-S1173 PolarHBondContact O-N 3.49Å
1172	H	26.5	Very low	26.3	Very low	177.6 Å²	177.6	144.5 Å²	144.5	82%	0.822	77%	0.774	S	S	*	*			trans	-78.4	88.5	147.1	-90.2	-63.2	0	0	0	114.6	M1170 K1174	M1170-H1172 PolarHBondContact O-N 3.4Å; H1172-K1174 VanDerWaalsContact C-N 3.33Å; H1172-K1174 PolarHBondContact O-N 3.27Å
1173	S	25	Very low	26	Very low	99.6 Å²	99.6	146.5 Å²	146.5	70%	0.697	78%	0.778	S	S	*	*			trans	-155	93.2	152.3	67.8	0	0	0	0	114.9	D1171	D1171-S1173 PolarHBondContact O-N 3.49Å
1174	K	25.7	Very low	25.8	Very low	187.8 Å²	187.8	147.8 Å²	147.8	82%	0.817	77%	0.772	S	S	*	*	S	Bend	trans	152.3	111.4	160	-79.1	174	-176.9	176.5	0	114.7	H1172	H1172-K1174 VanDerWaalsContact C-N 3.33Å; H1172-K1174 PolarHBondContact O-N 3.27Å
1175	L	25.1	Very low	25.5	Very low	151.6 Å²	151.6	151.4 Å²	151.4	79%	0.794	78%	0.775	S	S	*	*			trans	144	96.7	162.6	-89.7	126.4	0	0	0	112
1176	I	25.5	Very low	25.4	Very low	151.6 Å²	151.6	149.4 Å²	149.4	78%	0.777	77%	0.768	S	S	*	*				-161.6	109.1	118.7	-60.1	174.8	0	0	0	111.5	S1178	I1176-S1178 PolarHBondContact O-N 3.38Å
1177	T	24.4	Very low	25.4	Very low	119.4 Å²	119.4	147.7 Å²	147.7	73%	0.733	76%	0.758	S	S	*	*			trans	-166.3	114.8	151	49.4	0	0	0	0	112.9	Q1179	T1177-Q1179 PolarHBondContact O-N 3.17Å
1178	S	24.2	Very low	25.4	Very low	102.2 Å²	102.2	144.5 Å²	144.5	72%	0.715	74%	0.74	S	S	*	*			trans	77.3	98.4	133.7	68	0	0	0	0	115.1	I1176	I1176-S1178 PolarHBondContact O-N 3.38Å
1179	Q	25.4	Very low	25.3	Very low	193 Å²	193	142 Å²	142	90%	0.902	73%	0.726	S	S	*	*			trans	-137.4	101.6	135.6	-78.7	-174.6	-1.8	0	0	109.5	T1177	T1177-Q1179 PolarHBondContact O-N 3.17Å
1180	R	23.4	Very low	25.3	Very low	212.2 Å²	212.2	140.9 Å²	140.9	80%	0.801	71%	0.711	S	S	*	*			trans	-93.5	138.7	172.7	-75.2	174.3	177.8	-179.1	-0.8	108.8	I1182	R1180-I1182 PolarHBondContact O-N 3.39Å
1181	P	24.7	Very low	25.3	Very low	117 Å²	117	137.8 Å²	137.8	76%	0.76	69%	0.694	S	S	*	*			trans	-82.1	124.2	166.8	30	-29.1	0	0	0	109.3	F1183	P1181-F1183 PolarHBondContact O-N 3.16Å
1182	I	24.3	Very low	25.2	Very low	144 Å²	144	138.9 Å²	138.9	74%	0.738	69%	0.692	S	S	*	*			trans	-61.8	114.8	165.2	-63.7	163.3	0	0	0	107.8	R1180 V1184	R1180-I1182 PolarHBondContact O-N 3.39Å; I1182-V1184 HydrophobicContact CB-CG2 4.42Å; I1182-V1184 HydrophobicContact CG2-CG2 4.03Å; I1182-V1184 WeakPolarHBondContact O-CG2 3.39Å; I1182-V1184 PolarHBondContact O-N 2.95Å
1183	F	24.5	Very low	25.2	Very low	180.2 Å²	180.2	134.4 Å²	134.4	79%	0.79	68%	0.68	S	S	*	*			trans	-65.3	112.9	165.9	-83.8	-95.3	0	0	0	109.2	D746 P1181 K1185	D746-F1183 WeakPolarHBondContact OD2-CZ 3.35Å; P1181-F1183 PolarHBondContact O-N 3.16Å; F1183-K1185 VanDerWaalsContact C-N 3.26Å; F1183-K1185 PolarHBondContact O-N 2.62Å
1184	V	25.6	Very low	25.1	Very low	94 Å²	94	136.3 Å²	136.3	57%	0.57	68%	0.682	S	S	*	*			trans	-89	112	169.9	-179.2	0	0	0	0	107.9	I1182 H1186	I1182-V1184 HydrophobicContact CB-CG2 4.42Å; I1182-V1184 HydrophobicContact CG2-CG2 4.03Å; I1182-V1184 WeakPolarHBondContact O-CG2 3.39Å; I1182-V1184 PolarHBondContact O-N 2.95Å; V1184-H1186 VanDerWaalsContact C-N 3.26Å; V1184-H1186 PolarHBondContact O-N 3.16Å; V1184-H1186 VanDerWaalsContact O-N 3.15Å; V1184-H1186 PolarHBondContact O-ND1 3.01Å
1185	K	23.6	Very low	25	Very low	177.2 Å²	177.2	131 Å²	131	77%	0.77	68%	0.681	S	S	*	*			trans	-62.5	107.9	170.6	-90.3	178.2	171.5	177.7	0	108.6	H758 F1183 Q1187	H758-K1185 WeakPolarHBondContact NE2-CD 3.26Å; H758-K1185 PolarHBondContact NE2-NZ 2.75Å; H758-K1185 VanDerWaalsContact NE2-NZ 3.19Å; F1183-K1185 VanDerWaalsContact C-N 3.26Å; F1183-K1185 PolarHBondContact O-N 2.62Å; K1185-Q1187 VanDerWaalsContact C-N 3.3Å; K1185-Q1187 PolarHBondContact O-N 2.89Å; K1185-Q1187 VanDerWaalsContact O-N 3.09Å
1186	H	26.7	Very low	24.9	Very low	146.6 Å²	146.6	131.3 Å²	131.3	68%	0.679	68%	0.683	S	S	*	*			trans	-87.6	100.4	164	-79.8	67.6	0	0	0	109.6	I1046 V1184 I1188 N1213	I1046-H1186 HydrophobicContact CD1-CB 4.33Å; I1046-H1186 WeakPolarHBondContact CD1-O 3.12Å; V1184-H1186 VanDerWaalsContact C-N 3.26Å; V1184-H1186 PolarHBondContact O-N 3.16Å; V1184-H1186 VanDerWaalsContact O-N 3.15Å; V1184-H1186 PolarHBondContact O-ND1 3.01Å; H1186-I1188 HydrophobicContact CB-CD1 4.11Å; H1186-I1188 HydrophobicContact CB-CG1 3.98Å; H1186-I1188 PolarHBondContact O-N 3.38Å; H1186-N1213 WeakPolarHBondContact CD2-CB 3.44Å; H1186-N1213 PolarHBondContact CD2-ND2 2.66Å; H1186-N1213 PolarHBondContact NE2-ND2 3.25Å
1187	Q	24.6	Very low	24.8	Very low	139 Å²	139	129 Å²	129	65%	0.65	68%	0.68	S	S	*	*			trans	-88	107.8	175.3	-124	169	-7.4	0	0	108.4	K1185 I1210	K1185-Q1187 VanDerWaalsContact C-N 3.3Å; K1185-Q1187 PolarHBondContact O-N 2.89Å; K1185-Q1187 VanDerWaalsContact O-N 3.09Å; Q1187-I1210 HydrophobicContact CB-CG2 3.42Å; Q1187-I1210 VanDerWaalsContact CB-CG2 3.42Å; Q1187-I1210 HydrophobicContact CG-CG2 4.4Å; Q1187-I1210 VanDerWaalsContact OE1-CG2 3.3Å
1188	I	28	Very low	24.9	Very low	74.6 Å²	74.6	130.1 Å²	130.1	38%	0.383	68%	0.68	S	S	.	*			trans	-106	118.6	170.6	-61.3	174.1	0	0	0	107	T1045 I1046 L1049 K1154 F1155 H1186 I1190 I1215 L1216	T1045-I1188 WeakPolarHBondContact CB-O 3.3Å; T1045-I1188 HydrophobicContact CG2-CB 3.32Å; T1045-I1188 HydrophobicContact CG2-CG2 3.1Å; T1045-I1188 WeakPolarHBondContact CG2-O 3.32Å; T1045-I1188 PolarHBondContact OG1-O 2.94Å; I1046-I1188 HydrophobicContact CD1-CB 3.75Å; I1046-I1188 HydrophobicContact CD1-CD1 3.56Å; I1046-I1188 HydrophobicContact CD1-CG1 4.23Å; I1046-I1188 HydrophobicContact CD1-CG2 3.35Å; I1046-I1188 HydrophobicContact CG1-CD1 4Å; L1049-I1188 HydrophobicContact CD1-CD1 3.37Å; L1049-I1188 HydrophobicContact CD1-CG2 4.29Å; K1154-I1188 HydrophobicContact CB-CG2 4.01Å; K1154-I1188 HydrophobicContact CD-CB 4.49Å; K1154-I1188 HydrophobicContact CD-CG2 4.35Å; K1154-I1188 WeakPolarHBondContact CD-O 3.39Å; K1154-I1188 WeakPolarHBondContact CE-O 3.33Å; K1154-I1188 PolarHBondContact NZ-O 2.86Å; F1155-I1188 HydrophobicContact CE2-CD1 4.39Å; F1155-I1188 HydrophobicContact CZ-CD1 4.46Å; H1186-I1188 HydrophobicContact CB-CD1 4.11Å; H1186-I1188 HydrophobicContact CB-CG1 3.98Å; H1186-I1188 PolarHBondContact O-N 3.38Å; I1188-I1190 HydrophobicContact CG2-CD1 4.45Å; I1188-I1190 HydrophobicContact CG2-CG1 4.08Å; I1188-I1190 PolarHBondContact O-N 3.45Å; I1188-I1215 HydrophobicContact CD1-CD1 3.71Å; I1188-I1215 HydrophobicContact CG1-CD1 4.37Å; I1188-I1215 VanDerWaalsContact CG2-C 3.49Å; I1188-I1215 HydrophobicContact CG2-CB 3.58Å; I1188-I1215 HydrophobicContact CG2-CG2 4.36Å; I1188-I1215 WeakPolarHBondContact CG2-O 3.37Å; I1188-L1216 HydrophobicContact CG2-CB 4.35Å
1189	L	24.8	Very low	24.9	Very low	97.6 Å²	97.6	131.6 Å²	131.6	51%	0.511	69%	0.685	S	S	.	*			trans	-83.3	113.4	178.8	-138.6	98.4	0	0	0	109.2	Y143 H1191 L1211 L1216 L1318 I1321	Y143-L1189 HydrophobicContact CD2-CD1 3.67Å; Y143-L1189 HydrophobicContact CD2-CD2 4.06Å; Y143-L1189 HydrophobicContact CD2-CG 4.35Å; Y143-L1189 HydrophobicContact CE2-CB 4.23Å; Y143-L1189 HydrophobicContact CE2-CD1 3.81Å; Y143-L1189 HydrophobicContact CE2-CD2 4.43Å; Y143-L1189 HydrophobicContact CE2-CG 4.38Å; Y143-L1189 HydrophobicContact CG-CD2 4.29Å; L1189-H1191 WeakPolarHBondContact CD2-CD2 3.46Å; L1189-H1191 VanDerWaalsContact CD2-NE2 3.25Å; L1189-H1191 WeakPolarHBondContact CD2-NE2 3.41Å; L1189-H1191 PolarHBondContact O-N 3.38Å; L1189-H1191 VanDerWaalsContact O-N 3.16Å; L1189-L1211 HydrophobicContact CD1-CD2 3.45Å; L1189-L1211 VanDerWaalsContact CD1-CD2 3.45Å; L1189-L1216 HydrophobicContact CB-CD1 3.56Å; L1189-L1216 HydrophobicContact CD2-CD1 4.47Å; L1189-L1216 WeakPolarHBondContact O-CD1 3.36Å; L1189-L1318 HydrophobicContact CD2-CD2 4.39Å; L1189-I1321 HydrophobicContact CD2-CD1 4.23Å; L1189-I1321 HydrophobicContact CD2-CG2 4.18Å
1190	I	26.8	Very low	24.8	Very low	88 Å²	88	125.6 Å²	125.6	45%	0.451	67%	0.674	S	S	.	*			trans	-80.2	105.9	154.9	-58	174.2	0	0	0	108.6	N1044 T1045 F1048 E1067 I1188 F1192 L1217	N1044-I1190 HydrophobicContact CB-CD1 4.45Å; N1044-I1190 WeakPolarHBondContact OD1-CD1 3.31Å; T1045-I1190 HydrophobicContact CG2-CD1 3.58Å; T1045-I1190 HydrophobicContact CG2-CG1 3.45Å; T1045-I1190 VanDerWaalsContact CG2-CG1 3.45Å; F1048-I1190 HydrophobicContact CB-CD1 3.77Å; F1048-I1190 HydrophobicContact CD1-CD1 4.33Å; F1048-I1190 HydrophobicContact CD2-CD1 4.1Å; F1048-I1190 HydrophobicContact CG-CD1 3.76Å; E1067-I1190 HydrophobicContact CG-CD1 4.4Å; I1188-I1190 HydrophobicContact CG2-CD1 4.45Å; I1188-I1190 HydrophobicContact CG2-CG1 4.08Å; I1188-I1190 PolarHBondContact O-N 3.45Å; I1190-F1192 HydrophobicContact CB-CE2 4.25Å; I1190-F1192 HydrophobicContact CG2-CD2 3.91Å; I1190-F1192 HydrophobicContact CG2-CE2 3.66Å; I1190-F1192 HydrophobicContact CG2-CG 4.33Å; I1190-F1192 HydrophobicContact CG2-CZ 4.23Å; I1190-F1192 PolarHBondContact O-N 3.17Å; I1190-L1217 HydrophobicContact CD1-CD2 4.31Å; I1190-L1217 HydrophobicContact CG1-CD2 4.36Å
1191	H	24.7	Very low	25.1	Very low	104.6 Å²	104.6	121.8 Å²	121.8	48%	0.484	67%	0.669	S	S	.	*			trans	-99.9	112.3	164.9	-112	-48.3	0	0	0	110.4	T1157 L1189 L1217 L1318	T1157-H1191 WeakPolarHBondContact CB-O 3.29Å; T1157-H1191 WeakPolarHBondContact CG2-O 3.45Å; L1189-H1191 WeakPolarHBondContact CD2-CD2 3.46Å; L1189-H1191 VanDerWaalsContact CD2-NE2 3.25Å; L1189-H1191 WeakPolarHBondContact CD2-NE2 3.41Å; L1189-H1191 PolarHBondContact O-N 3.38Å; L1189-H1191 VanDerWaalsContact O-N 3.16Å; H1191-L1217 HydrophobicContact CB-CD1 4.14Å; H1191-L1217 HydrophobicContact CB-CD2 4.16Å; H1191-L1217 HydrophobicContact CB-CG 4.18Å; H1191-L1217 VanDerWaalsContact O-CD2 3.26Å; H1191-L1217 WeakPolarHBondContact O-CD2 3.38Å; H1191-L1318 HydrophobicContact CB-CD2 3.99Å
1192	F	26.2	Very low	25.3	Very low	159.4 Å²	159.4	120.6 Å²	120.6	70%	0.699	66%	0.662	S	S	*	*			trans	-85	122.7	159.1	-83.4	-89.1	0	0	0	112.7	I1190 N1194	I1190-F1192 HydrophobicContact CB-CE2 4.25Å; I1190-F1192 HydrophobicContact CG2-CD2 3.91Å; I1190-F1192 HydrophobicContact CG2-CE2 3.66Å; I1190-F1192 HydrophobicContact CG2-CG 4.33Å; I1190-F1192 HydrophobicContact CG2-CZ 4.23Å; I1190-F1192 PolarHBondContact O-N 3.17Å; F1192-N1194 VanDerWaalsContact C-N 3.25Å; F1192-N1194 PolarHBondContact O-N 2.99Å
1193	C	24.9	Very low	25.4	Very low	82 Å²	82	118.3 Å²	118.3	55%	0.554	66%	0.659	S	S	*	*			trans	-73.7	113.6	169.7	-66.7	0	0	0	0	111.4	L1318	C1193-L1318 WeakPolarHBondContact SG-CD2 3.31Å; C1193-L1318 WeakPolarHBondContact SG-CG 3.47Å
1194	N	23.9	Very low	25.6	Very low	140 Å²	140	115.4 Å²	115.4	75%	0.749	65%	0.651	S	S	*	*			trans	-106.7	119.7	149.7	-73	-17.2	0	0	0	108.9	F1192 L1196 T1227	F1192-N1194 VanDerWaalsContact C-N 3.25Å; F1192-N1194 PolarHBondContact O-N 2.99Å; N1194-L1196 PolarHBondContact O-N 3.3Å; N1194-T1227 WeakPolarHBondContact ND2-CG2 3.41Å
1195	G	23.6	Very low	26	Very low	77.2 Å²	77.2	119.6 Å²	119.6	80%	0.796	66%	0.662	S	S	*	*			trans	-69.1	74.3	156.4	0	0	0	0	0	113.6
1196	L	23.3	Very low	26.3	Very low	158.2 Å²	158.2	118.9 Å²	118.9	83%	0.828	66%	0.659	S	S	*	*			trans	-132.8	117.5	154.9	-112.5	104.3	0	0	0	109.8	N1194 I1198	N1194-L1196 PolarHBondContact O-N 3.3Å; L1196-I1198 PolarHBondContact O-N 3.14Å; L1196-I1198 VanDerWaalsContact O-N 3.13Å
1197	S	23.2	Very low	26.5	Very low	103 Å²	103	115.9 Å²	115.9	72%	0.72	65%	0.647	S	S	*	*			trans	-65.8	125.5	172.3	51.7	0	0	0	0	111.1	T1199	S1197-T1199 VanDerWaalsContact C-N 3.28Å; S1197-T1199 PolarHBondContact O-N 3.17Å
1198	I	26.1	Very low	26.8	Very low	142.6 Å²	142.6	115.1 Å²	115.1	73%	0.731	65%	0.647	S	S	*	*			trans	-117	91.4	158.8	-62.5	170.4	0	0	0	108.2	L1196 L1201	L1196-I1198 PolarHBondContact O-N 3.14Å; L1196-I1198 VanDerWaalsContact O-N 3.13Å; I1198-L1201 HydrophobicContact CG2-CD1 3.99Å
1199	T	24.1	Very low	26.9	Very low	133.8 Å²	133.8	118.6 Å²	118.6	82%	0.821	66%	0.662	S	S	*	*			trans	-67.8	113.2	158.2	52.3	0	0	0	0	111.5	S1197	S1197-T1199 VanDerWaalsContact C-N 3.28Å; S1197-T1199 PolarHBondContact O-N 3.17Å
1200	G	24.5	Very low	27.3	Very low	65.4 Å²	65.4	117.1 Å²	117.1	67%	0.674	65%	0.654	S	S	*	*			trans	148.8	69.6	164.5	0	0	0	0	0	116.8
1201	L	28.6	Very low	27.5	Very low	132.6 Å²	132.6	116.2 Å²	116.2	69%	0.694	65%	0.65	S	S	*	*			trans	-95.8	138.9	155.7	-93	109.2	0	0	0	113.6	I1198 S1203 Y1229	I1198-L1201 HydrophobicContact CG2-CD1 3.99Å; L1201-S1203 PolarHBondContact O-N 3.13Å; L1201-Y1229 HydrophobicContact CD2-CE1 3.97Å; L1201-Y1229 WeakPolarHBondContact CD2-OH 3.46Å
1202	P	28.3	Very low	27.9	Very low	93.4 Å²	93.4	117.8 Å²	117.8	61%	0.606	66%	0.657	S	S	*	*			trans	-89.1	146.5	-160	28.1	-23.6	0	0	0	113.1	N1204 K1206 L1207 I1210	P1202-N1204 VanDerWaalsContact C-N 3.29Å; P1202-N1204 PolarHBondContact O-N 3.07Å; P1202-K1206 HydrophobicContact CB-CB 3.99Å; P1202-K1206 HydrophobicContact CB-CD 4.18Å; P1202-L1207 HydrophobicContact CG-CD2 4.46Å; P1202-L1207 HydrophobicContact CG-CG 4.25Å; P1202-I1210 HydrophobicContact CB-CD1 4.48Å; P1202-I1210 HydrophobicContact CG-CD1 3.79Å
1203	S	28.3	Very low	28.2	Very low	95.8 Å²	95.8	113.9 Å²	113.9	67%	0.67	64%	0.644	S	S	*	*			trans	-24.8	108.9	164.5	46	0	0	0	0	116	L1201 K1205 K1206 L1207	L1201-S1203 PolarHBondContact O-N 3.13Å; S1203-K1205 PolarHBondContact O-N 3.34Å; S1203-K1205 VanDerWaalsContact O-N 3.13Å; S1203-K1206 CarbonylContact O-C 3.5Å; S1203-K1206 VanDerWaalsContact O-CA 3.28Å; S1203-K1206 WeakPolarHBondContact O-CA 3.06Å; S1203-K1206 WeakPolarHBondContact O-CB 3.42Å; S1203-K1206 PolarHBondContact O-N 3.35Å; S1203-L1207 PolarHBondContact O-N 2.92Å
1204	N	28.8	Very low	28.9	Very low	118.6 Å²	118.6	111.9 Å²	111.9	63%	0.634	63%	0.63	S	S	*	*			trans	-124.4	108.3	154.3	-100.3	-22.8	0	0	0	114.1	P1202 K1206 L1207 N1208	P1202-N1204 VanDerWaalsContact C-N 3.29Å; P1202-N1204 PolarHBondContact O-N 3.07Å; N1204-K1206 PolarHBondContact O-N 2.95Å; N1204-L1207 PolarHBondContact O-N 3.14Å; N1204-N1208 PolarHBondContact O-N 3.3Å
1205	K	32	Very low	29.7	Very low	181 Å²	181	108.4 Å²	108.4	79%	0.787	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.5	-12.8	177.4	-77.4	-177.3	173.4	-178.3	0	116.7	S1203 L1207 N1208 E1209	S1203-K1205 PolarHBondContact O-N 3.34Å; S1203-K1205 VanDerWaalsContact O-N 3.13Å; K1205-L1207 VanDerWaalsContact C-N 3.29Å; K1205-L1207 PolarHBondContact O-N 3.25Å; K1205-N1208 PolarHBondContact O-N 3.21Å; K1205-E1209 WeakPolarHBondContact O-CB 3.46Å; K1205-E1209 VanDerWaalsContact O-CD 3.29Å; K1205-E1209 WeakPolarHBondContact O-CG 3.35Å; K1205-E1209 PolarHBondContact O-N 3.27Å
1206	K	31.2	Very low	30.6	Very low	164 Å²	164	106.7 Å²	106.7	71%	0.713	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-13.6	178.3	-101.3	-179.4	175.6	179.3	0	115.5	P1202 S1203 N1204 N1208 E1209 I1210	P1202-K1206 HydrophobicContact CB-CB 3.99Å; P1202-K1206 HydrophobicContact CB-CD 4.18Å; S1203-K1206 CarbonylContact O-C 3.5Å; S1203-K1206 VanDerWaalsContact O-CA 3.28Å; S1203-K1206 WeakPolarHBondContact O-CA 3.06Å; S1203-K1206 WeakPolarHBondContact O-CB 3.42Å; S1203-K1206 PolarHBondContact O-N 3.35Å; N1204-K1206 PolarHBondContact O-N 2.95Å; K1206-N1208 PolarHBondContact O-N 3.35Å; K1206-E1209 WeakPolarHBondContact CA-OE2 3.37Å; K1206-E1209 PolarHBondContact O-N 2.73Å; K1206-I1210 HydrophobicContact CB-CD1 4.17Å; K1206-I1210 WeakPolarHBondContact O-CB 3.34Å; K1206-I1210 VanDerWaalsContact O-CD1 3.24Å; K1206-I1210 WeakPolarHBondContact O-CD1 3.11Å; K1206-I1210 WeakPolarHBondContact O-CG1 3.38Å; K1206-I1210 PolarHBondContact O-N 2.71Å
1207	L	30.6	Very low	31.5	Very low	84 Å²	84	101.9 Å²	101.9	44%	0.44	56%	0.558	S	S	.	*	H	α-helix	trans	-82.9	-25.4	-177.2	-102.2	154.1	0	0	0	113.8	P1202 S1203 N1204 K1205 E1209 I1210 L1211	P1202-L1207 HydrophobicContact CG-CD2 4.46Å; P1202-L1207 HydrophobicContact CG-CG 4.25Å; S1203-L1207 PolarHBondContact O-N 2.92Å; N1204-L1207 PolarHBondContact O-N 3.14Å; K1205-L1207 VanDerWaalsContact C-N 3.29Å; K1205-L1207 PolarHBondContact O-N 3.25Å; L1207-E1209 VanDerWaalsContact C-N 3.32Å; L1207-E1209 PolarHBondContact O-N 2.94Å; L1207-I1210 HydrophobicContact CD2-CD1 4.16Å; L1207-I1210 WeakPolarHBondContact O-CB 3.14Å; L1207-I1210 PolarHBondContact O-N 3.11Å; L1207-I1210 VanDerWaalsContact O-N 3.07Å; L1207-L1211 HydrophobicContact CB-CD1 4.17Å; L1207-L1211 HydrophobicContact CD2-CD1 3.68Å; L1207-L1211 VanDerWaalsContact CD2-CD1 3.42Å; L1207-L1211 HydrophobicContact CD2-CD2 4.28Å; L1207-L1211 HydrophobicContact CD2-CG 3.84Å; L1207-L1211 HydrophobicContact CG-CD1 4.41Å; L1207-L1211 WeakPolarHBondContact O-CB 3.47Å; L1207-L1211 WeakPolarHBondContact O-CG 3.39Å; L1207-L1211 PolarHBondContact O-N 2.93Å; L1207-L1211 VanDerWaalsContact O-N 3.16Å
1208	N	29.9	Very low	32.5	Very low	121.4 Å²	121.4	98.1 Å²	98.1	65%	0.649	53%	0.529	S	S	*	.	H	α-helix	trans	-75.8	-23.3	-178.5	-77.3	-5.7	0	0	0	113.7	F780 N1204 K1205 K1206 I1210 L1211 Q1212	F780-N1208 WeakPolarHBondContact CE1-O 2.87Å; F780-N1208 HydrophobicContact CZ-CB 4.37Å; F780-N1208 WeakPolarHBondContact CZ-O 3.32Å; N1204-N1208 PolarHBondContact O-N 3.3Å; K1205-N1208 PolarHBondContact O-N 3.21Å; K1206-N1208 PolarHBondContact O-N 3.35Å; N1208-I1210 VanDerWaalsContact C-N 3.3Å; N1208-I1210 PolarHBondContact O-N 2.81Å; N1208-L1211 CarbonylContact O-C 3.54Å; N1208-L1211 PolarHBondContact O-N 3.41Å; N1208-Q1212 WeakPolarHBondContact O-CG 3.49Å; N1208-Q1212 PolarHBondContact O-N 2.8Å
1209	E	31.5	Very low	33.3	Very low	148.8 Å²	148.8	93.4 Å²	93.4	70%	0.695	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-20.6	173.9	-75	175.5	161.9	0	0	113.1	K1205 K1206 L1207 L1211 Q1212	K1205-E1209 WeakPolarHBondContact O-CB 3.46Å; K1205-E1209 VanDerWaalsContact O-CD 3.29Å; K1205-E1209 WeakPolarHBondContact O-CG 3.35Å; K1205-E1209 PolarHBondContact O-N 3.27Å; K1206-E1209 WeakPolarHBondContact CA-OE2 3.37Å; K1206-E1209 PolarHBondContact O-N 2.73Å; L1207-E1209 VanDerWaalsContact C-N 3.32Å; L1207-E1209 PolarHBondContact O-N 2.94Å; E1209-L1211 PolarHBondContact O-N 2.92Å; E1209-Q1212 WeakPolarHBondContact O-CB 3.39Å; E1209-Q1212 PolarHBondContact O-N 3.13Å
1210	I	32.8	Very low	34.2	Very low	65.2 Å²	65.2	88 Å²	88	33%	0.334	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-20.6	-176.2	-66.1	166.8	0	0	0	112	Q1187 P1202 K1206 L1207 N1208 Q1212 L1216 Q1426	Q1187-I1210 HydrophobicContact CB-CG2 3.42Å; Q1187-I1210 VanDerWaalsContact CB-CG2 3.42Å; Q1187-I1210 HydrophobicContact CG-CG2 4.4Å; Q1187-I1210 VanDerWaalsContact OE1-CG2 3.3Å; P1202-I1210 HydrophobicContact CB-CD1 4.48Å; P1202-I1210 HydrophobicContact CG-CD1 3.79Å; K1206-I1210 HydrophobicContact CB-CD1 4.17Å; K1206-I1210 WeakPolarHBondContact O-CB 3.34Å; K1206-I1210 VanDerWaalsContact O-CD1 3.24Å; K1206-I1210 WeakPolarHBondContact O-CD1 3.11Å; K1206-I1210 WeakPolarHBondContact O-CG1 3.38Å; K1206-I1210 PolarHBondContact O-N 2.71Å; L1207-I1210 HydrophobicContact CD2-CD1 4.16Å; L1207-I1210 WeakPolarHBondContact O-CB 3.14Å; L1207-I1210 PolarHBondContact O-N 3.11Å; L1207-I1210 VanDerWaalsContact O-N 3.07Å; N1208-I1210 VanDerWaalsContact C-N 3.3Å; N1208-I1210 PolarHBondContact O-N 2.81Å; I1210-Q1212 PolarHBondContact O-N 3.12Å; I1210-Q1212 VanDerWaalsContact O-N 3.1Å; I1210-L1216 HydrophobicContact CG2-CD1 3.93Å; I1210-L1216 HydrophobicContact CG2-CD2 4.25Å; I1210-Q1426 HydrophobicContact CB-CG 4.11Å; I1210-Q1426 HydrophobicContact CG1-CG 3.74Å; I1210-Q1426 HydrophobicContact CG2-CG 4.12Å
1211	L	31.5	Very low	34.8	Very low	70 Å²	70	88.1 Å²	88.1	37%	0.366	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	7.5	-172.7	-72.7	169	0	0	0	115.7	L1189 L1207 N1208 E1209 N1213 F1284 N1325 R1404	L1189-L1211 HydrophobicContact CD1-CD2 3.45Å; L1189-L1211 VanDerWaalsContact CD1-CD2 3.45Å; L1207-L1211 HydrophobicContact CB-CD1 4.17Å; L1207-L1211 HydrophobicContact CD2-CD1 3.68Å; L1207-L1211 VanDerWaalsContact CD2-CD1 3.42Å; L1207-L1211 HydrophobicContact CD2-CD2 4.28Å; L1207-L1211 HydrophobicContact CD2-CG 3.84Å; L1207-L1211 HydrophobicContact CG-CD1 4.41Å; L1207-L1211 WeakPolarHBondContact O-CB 3.47Å; L1207-L1211 WeakPolarHBondContact O-CG 3.39Å; L1207-L1211 PolarHBondContact O-N 2.93Å; L1207-L1211 VanDerWaalsContact O-N 3.16Å; N1208-L1211 CarbonylContact O-C 3.54Å; N1208-L1211 PolarHBondContact O-N 3.41Å; E1209-L1211 PolarHBondContact O-N 2.92Å; L1211-N1213 VanDerWaalsContact C-N 3.26Å; L1211-N1213 PolarHBondContact O-N 3.19Å; L1211-N1213 VanDerWaalsContact O-N 3.09Å; L1211-F1284 HydrophobicContact CD1-CD1 3.81Å; L1211-F1284 HydrophobicContact CD1-CE1 3.59Å; L1211-N1325 HydrophobicContact CD1-CB 3.88Å; L1211-R1404 PolarHBondContact O-NE 3.45Å; L1211-R1404 PolarHBondContact O-NH2 2.98Å
1212	Q	31.7	Very low	35.3	Very low	137.6 Å²	137.6	87.5 Å²	87.5	64%	0.643	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	2.2	178.9	-98.1	177.7	-1.4	0	0	113.6	F780 N1208 E1209 I1210	F780-Q1212 HydrophobicContact CB-CG 3.82Å; F780-Q1212 HydrophobicContact CD1-CB 3.47Å; F780-Q1212 VanDerWaalsContact CD1-CB 3.47Å; F780-Q1212 HydrophobicContact CD1-CG 3.05Å; F780-Q1212 VanDerWaalsContact CD2-NE2 3.29Å; F780-Q1212 HydrophobicContact CE1-CB 3.65Å; F780-Q1212 HydrophobicContact CE1-CG 3.58Å; F780-Q1212 VanDerWaalsContact CE1-OE1 3.31Å; F780-Q1212 VanDerWaalsContact CG-CD 3.44Å; F780-Q1212 HydrophobicContact CG-CG 3.73Å; N1208-Q1212 WeakPolarHBondContact O-CG 3.49Å; N1208-Q1212 PolarHBondContact O-N 2.8Å; E1209-Q1212 WeakPolarHBondContact O-CB 3.39Å; E1209-Q1212 PolarHBondContact O-N 3.13Å; I1210-Q1212 PolarHBondContact O-N 3.12Å; I1210-Q1212 VanDerWaalsContact O-N 3.1Å
1213	N	34.1	Very low	35.8	Very low	76.4 Å²	76.4	85.2 Å²	85.2	41%	0.409	46%	0.46	S	S	.	.	S	Bend	trans	-143	88.9	178.1	-64.6	-42.1	0	0	0	115.2	G783 H1186 L1211 K1286 Q1426	G783-N1213 PolarHBondContact N-OD1 2.94Å; H1186-N1213 WeakPolarHBondContact CD2-CB 3.44Å; H1186-N1213 PolarHBondContact CD2-ND2 2.66Å; H1186-N1213 PolarHBondContact NE2-ND2 3.25Å; L1211-N1213 VanDerWaalsContact C-N 3.26Å; L1211-N1213 PolarHBondContact O-N 3.19Å; L1211-N1213 VanDerWaalsContact O-N 3.09Å; N1213-K1286 PolarHBondContact OD1-NZ 3.21Å; N1213-Q1426 HydrophobicContact CB-CB 4.32Å; N1213-Q1426 PolarHBondContact ND2-OE1 3.1Å
1214	C	38.1	Very low	36.4	Very low	41 Å²	41	83.1 Å²	83.1	28%	0.277	45%	0.445	S	S	.	.			trans	-103.8	115.7	174.5	-69.7	0	0	0	0	112.5	P1146 K1286 L1399 R1404 F1405 D1424	P1146-C1214 VanDerWaalsContact CB-CA 3.43Å; P1146-C1214 HydrophobicContact CB-CB 3.38Å; P1146-C1214 WeakPolarHBondContact CB-O 3.33Å; P1146-C1214 VanDerWaalsContact CG-CA 3.47Å; P1146-C1214 HydrophobicContact CG-CB 3.07Å; P1146-C1214 VanDerWaalsContact CG-O 3.26Å; P1146-C1214 WeakPolarHBondContact CG-O 3.18Å; C1214-K1286 VanDerWaalsContact SG-CD 3.59Å; C1214-K1286 WeakPolarHBondContact SG-CE 3.41Å; C1214-K1286 VanDerWaalsContact SG-CG 3.52Å; C1214-L1399 HydrophobicContact CB-CB 3.67Å; C1214-L1399 HydrophobicContact CB-CD1 3.6Å; C1214-L1399 HydrophobicContact CB-CG 4.27Å; C1214-R1404 CarbonylContact O-C 3.11Å; C1214-R1404 WeakPolarHBondContact O-CA 3.21Å; C1214-F1405 PolarHBondContact O-N 3.02Å; C1214-D1424 HydrophobicContact CB-CB 4.33Å; C1214-D1424 PolarHBondContact N-O 3.43Å
1215	I	42.4	Very low	36.8	Very low	65.6 Å²	65.6	79.2 Å²	79.2	34%	0.336	43%	0.433	S	S	.	.			trans	-101.8	130.4	164.9	-60.9	161.9	0	0	0	109.5	L1049 I1137 P1146 I1188 L1217 I1289 Q1322 L1395 L1399 F1405 L1407 D1424 C1425 Q1426	L1049-I1215 HydrophobicContact CD1-CB 4.15Å; L1049-I1215 HydrophobicContact CD1-CD1 3.6Å; L1049-I1215 HydrophobicContact CD1-CG1 4.43Å; L1049-I1215 HydrophobicContact CD1-CG2 4.06Å; L1049-I1215 HydrophobicContact CD2-CG2 4.02Å; I1137-I1215 HydrophobicContact CB-CD1 4.26Å; I1137-I1215 HydrophobicContact CD1-CD1 3.41Å; I1137-I1215 VanDerWaalsContact CD1-CD1 3.41Å; I1137-I1215 HydrophobicContact CD1-CG1 3.83Å; I1137-I1215 HydrophobicContact CG1-CD1 3.53Å; I1137-I1215 HydrophobicContact CG1-CG1 3.85Å; I1137-I1215 HydrophobicContact CG2-CD1 3.68Å; P1146-I1215 WeakPolarHBondContact CG-O 3.21Å; I1188-I1215 HydrophobicContact CD1-CD1 3.71Å; I1188-I1215 HydrophobicContact CG1-CD1 4.37Å; I1188-I1215 VanDerWaalsContact CG2-C 3.49Å; I1188-I1215 HydrophobicContact CG2-CB 3.58Å; I1188-I1215 HydrophobicContact CG2-CG2 4.36Å; I1188-I1215 WeakPolarHBondContact CG2-O 3.37Å; I1215-L1217 HydrophobicContact CG2-CD1 3.98Å; I1215-L1217 HydrophobicContact CG2-CG 4.47Å; I1215-L1217 PolarHBondContact O-N 3.09Å; I1215-I1289 WeakPolarHBondContact CA-O 3.19Å; I1215-I1289 HydrophobicContact CG1-CB 4.4Å; I1215-I1289 PolarHBondContact O-N 3.19Å; I1215-Q1322 HydrophobicContact CD1-CG 3.9Å; I1215-L1395 HydrophobicContact CD1-CD2 4.05Å; I1215-L1399 HydrophobicContact CD1-CD1 4.04Å; I1215-L1399 HydrophobicContact CG1-CD1 3.66Å; I1215-F1405 CarbonylContact C-O 3.31Å; I1215-F1405 WeakPolarHBondContact CA-O 3.39Å; I1215-F1405 HydrophobicContact CG1-CB 4.36Å; I1215-F1405 HydrophobicContact CG2-CB 4.35Å; I1215-L1407 HydrophobicContact CG2-CD1 3.99Å; I1215-D1424 PolarHBondContact N-O 3.42Å; I1215-C1425 HydrophobicContact CB-CB 4.23Å; I1215-C1425 HydrophobicContact CG2-CB 4.49Å; I1215-C1425 CarbonylContact O-C 3.24Å; I1215-C1425 WeakPolarHBondContact O-CA 3.38Å; I1215-Q1426 PolarHBondContact O-N 2.91Å
1216	L	41.7	Very low	37.3	Very low	42.2 Å²	42.2	74.3 Å²	74.3	22%	0.221	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	113.6	175.1	-174.4	71.1	0	0	0	109	I1046 L1049 T1133 I1137 I1145 P1146 I1188 L1189 I1210 I1218 L1233 I1289 L1290 I1291 L1318 F1405 V1406 L1407 L1428	I1046-L1216 HydrophobicContact CD1-CB 4.12Å; I1046-L1216 HydrophobicContact CD1-CD2 4.15Å; I1046-L1216 HydrophobicContact CG1-CB 4.29Å; I1046-L1216 HydrophobicContact CG1-CD2 3.38Å; I1046-L1216 HydrophobicContact CG1-CG 4.42Å; L1049-L1216 HydrophobicContact CD1-CD2 3.96Å; T1133-L1216 HydrophobicContact CG2-CD1 3.34Å; I1137-L1216 HydrophobicContact CD1-CB 4.19Å; I1137-L1216 HydrophobicContact CD1-CD1 4.17Å; I1137-L1216 HydrophobicContact CD1-CD2 4.39Å; I1137-L1216 HydrophobicContact CD1-CG 4.47Å; I1145-L1216 HydrophobicContact CG2-CD1 3.79Å; P1146-L1216 HydrophobicContact CG-CB 4.26Å; P1146-L1216 VanDerWaalsContact CG-N 3.33Å; P1146-L1216 WeakPolarHBondContact O-CB 3.27Å; P1146-L1216 PolarHBondContact O-N 3.15Å; I1188-L1216 HydrophobicContact CG2-CB 4.35Å; L1189-L1216 HydrophobicContact CB-CD1 3.56Å; L1189-L1216 HydrophobicContact CD2-CD1 4.47Å; L1189-L1216 WeakPolarHBondContact O-CD1 3.36Å; I1210-L1216 HydrophobicContact CG2-CD1 3.93Å; I1210-L1216 HydrophobicContact CG2-CD2 4.25Å; L1216-I1218 HydrophobicContact CD2-CD1 4.12Å; L1216-I1218 HydrophobicContact CD2-CG1 4.2Å; L1216-I1218 HydrophobicContact CG-CG1 4.3Å; L1216-L1233 HydrophobicContact CD2-CD2 4.18Å; L1216-I1289 HydrophobicContact CD1-CG2 4.28Å; L1216-I1289 PolarHBondContact N-O 3.18Å; L1216-L1290 HydrophobicContact CB-CG 4.32Å; L1216-L1290 HydrophobicContact CD2-CD2 4.3Å; L1216-L1290 WeakPolarHBondContact O-CA 3.28Å; L1216-I1291 HydrophobicContact CD1-CG2 3.66Å; L1216-I1291 HydrophobicContact CG-CG2 4.38Å; L1216-I1291 PolarHBondContact O-N 2.71Å; L1216-I1291 VanDerWaalsContact O-N 3.12Å; L1216-L1318 HydrophobicContact CD1-CD1 4.5Å; L1216-L1318 HydrophobicContact CD1-CD2 3.59Å; L1216-L1318 HydrophobicContact CD1-CG 4.45Å; L1216-L1318 HydrophobicContact CD2-CB 3.38Å; L1216-L1318 HydrophobicContact CD2-CD1 3.82Å; L1216-L1318 HydrophobicContact CD2-CD2 3.71Å; L1216-L1318 HydrophobicContact CD2-CG 3.77Å; L1216-L1318 HydrophobicContact CG-CB 4.11Å; L1216-L1318 HydrophobicContact CG-CD1 3.62Å; L1216-L1318 HydrophobicContact CG-CD2 3.6Å; L1216-L1318 HydrophobicContact CG-CG 3.92Å; L1216-F1405 PolarHBondContact N-O 3.02Å; L1216-V1406 HydrophobicContact CB-CG1 4.46Å; L1216-V1406 HydrophobicContact CB-CG2 4.4Å; L1216-V1406 HydrophobicContact CD2-CG1 4.16Å; L1216-V1406 HydrophobicContact CD2-CG2 4.44Å; L1216-V1406 HydrophobicContact CG-CG1 4.2Å; L1216-V1406 CarbonylContact O-C 3.51Å; L1216-V1406 VanDerWaalsContact O-CA 3.3Å; L1216-V1406 WeakPolarHBondContact O-CA 3.37Å; L1216-L1407 PolarHBondContact O-N 2.81Å; L1216-L1428 HydrophobicContact CD1-CB 4Å
1217	L	41.8	Very low	37.7	Very low	56.6 Å²	56.6	70.5 Å²	70.5	30%	0.296	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	114.5	-177.8	-159.4	113	0	0	0	109.9	F1048 I1190 H1191 I1215 V1219 I1289 I1291 F1293 L1302 L1318 L1407 C1409 A1416 L1419 Q1426 L1427 L1428	F1048-L1217 HydrophobicContact CD1-CD1 4.48Å; F1048-L1217 HydrophobicContact CD1-CD2 3.68Å; F1048-L1217 HydrophobicContact CD2-CD2 4.06Å; F1048-L1217 HydrophobicContact CE1-CD1 3.53Å; F1048-L1217 HydrophobicContact CE1-CD2 3.21Å; F1048-L1217 HydrophobicContact CE1-CG 3.96Å; F1048-L1217 HydrophobicContact CE2-CD2 3.61Å; F1048-L1217 HydrophobicContact CG-CD2 4.15Å; F1048-L1217 HydrophobicContact CZ-CD1 3.85Å; F1048-L1217 HydrophobicContact CZ-CD2 3.21Å; F1048-L1217 HydrophobicContact CZ-CG 4.16Å; I1190-L1217 HydrophobicContact CD1-CD2 4.31Å; I1190-L1217 HydrophobicContact CG1-CD2 4.36Å; H1191-L1217 HydrophobicContact CB-CD1 4.14Å; H1191-L1217 HydrophobicContact CB-CD2 4.16Å; H1191-L1217 HydrophobicContact CB-CG 4.18Å; H1191-L1217 VanDerWaalsContact O-CD2 3.26Å; H1191-L1217 WeakPolarHBondContact O-CD2 3.38Å; I1215-L1217 HydrophobicContact CG2-CD1 3.98Å; I1215-L1217 HydrophobicContact CG2-CG 4.47Å; I1215-L1217 PolarHBondContact O-N 3.09Å; L1217-V1219 HydrophobicContact CD1-CG2 3.99Å; L1217-V1219 HydrophobicContact CD2-CG2 3.64Å; L1217-V1219 VanDerWaalsContact CD2-CG2 3.42Å; L1217-V1219 HydrophobicContact CG-CG2 3.91Å; L1217-V1219 PolarHBondContact O-N 3.34Å; L1217-I1289 PolarHBondContact N-O 2.85Å; L1217-I1291 HydrophobicContact CB-CG2 4.32Å; L1217-I1291 HydrophobicContact CD1-CG2 3.85Å; L1217-I1291 WeakPolarHBondContact O-CG2 3.41Å; L1217-I1291 PolarHBondContact O-N 2.6Å; L1217-F1293 HydrophobicContact CD1-CD2 4.39Å; L1217-F1293 HydrophobicContact CD1-CE2 4.24Å; L1217-L1302 HydrophobicContact CD2-CD1 4.47Å; L1217-L1318 HydrophobicContact CD1-CB 4.04Å; L1217-L1318 HydrophobicContact CD1-CD1 3.66Å; L1217-L1318 HydrophobicContact CD1-CD2 3.42Å; L1217-L1318 VanDerWaalsContact CD1-CD2 3.42Å; L1217-L1318 HydrophobicContact CD1-CG 3.86Å; L1217-L1318 HydrophobicContact CD2-CD1 3.19Å; L1217-L1318 HydrophobicContact CD2-CD2 3.93Å; L1217-L1318 HydrophobicContact CD2-CG 4.11Å; L1217-L1318 HydrophobicContact CG-CD1 3.95Å; L1217-L1318 HydrophobicContact CG-CD2 4.21Å; L1217-L1407 CarbonylContact C-O 3.24Å; L1217-L1407 WeakPolarHBondContact CA-O 3.28Å; L1217-L1407 HydrophobicContact CD1-CB 4.32Å; L1217-C1409 HydrophobicContact CD1-CB 4.33Å; L1217-A1416 HydrophobicContact CD2-CB 4.42Å; L1217-L1419 HydrophobicContact CD1-CD1 4.01Å; L1217-L1419 HydrophobicContact CD2-CB 3.83Å; L1217-L1419 HydrophobicContact CD2-CD1 4.41Å; L1217-Q1426 PolarHBondContact N-O 2.96Å; L1217-L1427 HydrophobicContact CD2-CD1 4.15Å; L1217-L1427 HydrophobicContact CG-CD1 4.15Å; L1217-L1428 PolarHBondContact O-N 2.77Å
1218	I	44.4	Very low	38	Very low	23.2 Å²	23.2	70.5 Å²	70.5	12%	0.119	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	113.4	177.2	-55.7	172.2	0	0	0	108.7	T1045 L1216 K1226 Y1229 L1230 I1291 F1293 L1302 N1314 W1315 L1318 V1406 L1407 T1408 C1409 L1428 V1430	T1045-I1218 HydrophobicContact CG2-CD1 3.09Å; T1045-I1218 WeakPolarHBondContact OG1-CD1 3.49Å; L1216-I1218 HydrophobicContact CD2-CD1 4.12Å; L1216-I1218 HydrophobicContact CD2-CG1 4.2Å; L1216-I1218 HydrophobicContact CG-CG1 4.3Å; I1218-K1226 HydrophobicContact CG2-CB 3.83Å; I1218-K1226 HydrophobicContact CG2-CD 3.97Å; I1218-K1226 HydrophobicContact CG2-CG 3.72Å; I1218-K1226 WeakPolarHBondContact O-CD 3.44Å; I1218-Y1229 HydrophobicContact CD1-CD1 4.24Å; I1218-L1230 HydrophobicContact CD1-CD1 4.31Å; I1218-L1230 HydrophobicContact CD1-CD2 3.98Å; I1218-L1230 HydrophobicContact CD1-CG 3.72Å; I1218-I1291 HydrophobicContact CG1-CG2 3.91Å; I1218-F1293 HydrophobicContact CG2-CD2 3.9Å; I1218-F1293 HydrophobicContact CG2-CE2 4.18Å; I1218-L1302 HydrophobicContact CB-CD1 3.74Å; I1218-L1302 HydrophobicContact CB-CD2 4.48Å; I1218-L1302 HydrophobicContact CD1-CD1 4.48Å; I1218-L1302 HydrophobicContact CG2-CD1 3.27Å; I1218-L1302 HydrophobicContact CG2-CD2 3.3Å; I1218-L1302 HydrophobicContact CG2-CG 3.85Å; I1218-N1314 HydrophobicContact CD1-CB 3.35Å; I1218-N1314 HydrophobicContact CG1-CB 3.83Å; I1218-N1314 HydrophobicContact CG2-CB 3.85Å; I1218-N1314 WeakPolarHBondContact CG2-ND2 3.31Å; I1218-W1315 HydrophobicContact CD1-CB 4.4Å; I1218-W1315 HydrophobicContact CD1-CG 3.73Å; I1218-W1315 VanDerWaalsContact CD1-NE1 3.34Å; I1218-L1318 HydrophobicContact CD1-CD1 4Å; I1218-L1318 HydrophobicContact CG1-CD1 3.53Å; I1218-V1406 HydrophobicContact CD1-CG1 3.81Å; I1218-V1406 HydrophobicContact CG1-CG1 4.3Å; I1218-L1407 PolarHBondContact N-O 3.27Å; I1218-T1408 HydrophobicContact CB-CG2 4.1Å; I1218-T1408 VanDerWaalsContact O-CA 3.23Å; I1218-T1408 WeakPolarHBondContact O-CA 3.33Å; I1218-C1409 PolarHBondContact O-N 3Å; I1218-C1409 VanDerWaalsContact O-N 3.08Å; I1218-L1428 WeakPolarHBondContact CA-O 3.46Å; I1218-L1428 HydrophobicContact CG2-CD2 4.22Å; I1218-V1430 HydrophobicContact CG2-CG2 3.71Å
1219	V	43	Very low	38.5	Very low	44.8 Å²	44.8	70.9 Å²	70.9	27%	0.272	40%	0.399	S	S	.	.			trans	-110.1	137.5	-177.2	-176.3	0	0	0	0	110.2	L1217 H1292 L1302 P1303 N1314 L1318 C1409 S1411 A1416 L1427 L1428 T1429 V1430	L1217-V1219 HydrophobicContact CD1-CG2 3.99Å; L1217-V1219 HydrophobicContact CD2-CG2 3.64Å; L1217-V1219 VanDerWaalsContact CD2-CG2 3.42Å; L1217-V1219 HydrophobicContact CG-CG2 3.91Å; L1217-V1219 PolarHBondContact O-N 3.34Å; V1219-H1292 PolarHBondContact O-CE1 3.12Å; V1219-H1292 PolarHBondContact O-ND1 2.98Å; V1219-L1302 HydrophobicContact CG1-CD1 4.36Å; V1219-L1302 HydrophobicContact CG1-CD2 3.89Å; V1219-L1302 HydrophobicContact CG1-CG 3.68Å; V1219-L1302 HydrophobicContact CG2-CD1 4.16Å; V1219-L1302 HydrophobicContact CG2-CD2 4.35Å; V1219-L1302 HydrophobicContact CG2-CG 4.29Å; V1219-P1303 HydrophobicContact CG1-CG 4.21Å; V1219-N1314 HydrophobicContact CG1-CB 3.56Å; V1219-N1314 WeakPolarHBondContact CG1-ND2 3.46Å; V1219-N1314 HydrophobicContact CG2-CB 4.47Å; V1219-L1318 HydrophobicContact CG2-CD1 4.07Å; V1219-C1409 HydrophobicContact CG2-CB 4.34Å; V1219-S1411 VanDerWaalsContact CG1-CA 3.46Å; V1219-A1416 HydrophobicContact CG2-CB 4.15Å; V1219-L1427 HydrophobicContact CB-CD1 3.76Å; V1219-L1427 HydrophobicContact CG1-CD1 4.48Å; V1219-L1427 HydrophobicContact CG2-CD1 3.62Å; V1219-L1428 PolarHBondContact N-O 2.89Å; V1219-T1429 HydrophobicContact CG1-CG2 4.46Å; V1219-T1429 CarbonylContact O-C 3.55Å; V1219-T1429 VanDerWaalsContact O-CA 3.27Å; V1219-T1429 WeakPolarHBondContact O-CA 3.32Å; V1219-V1430 PolarHBondContact O-N 3.34Å
1220	G	42	Very low	38.8	Very low	21 Å²	21	66.1 Å²	66.1	22%	0.216	38%	0.378	C	S	.	.			trans	-152.6	171	177.5	0	0	0	0	0	111.3	S1224 K1226 P1303 C1409 D1410	G1220-S1224 WeakPolarHBondContact CA-OG 3.21Å; G1220-K1226 VanDerWaalsContact C-CE 3.41Å; G1220-K1226 VanDerWaalsContact CA-CE 3.47Å; G1220-K1226 VanDerWaalsContact N-NZ 3.13Å; G1220-K1226 VanDerWaalsContact O-CE 3.22Å; G1220-K1226 WeakPolarHBondContact O-CE 3.35Å; G1220-K1226 PolarHBondContact O-NZ 3.2Å; G1220-P1303 WeakPolarHBondContact O-CG 3.47Å; G1220-C1409 PolarHBondContact N-O 2.95Å; G1220-D1410 WeakPolarHBondContact O-CA 3.12Å
1221	S	38.7	Very low	39	Very low	67.6 Å²	67.6	65.2 Å²	65.2	47%	0.473	38%	0.378	S	S	.	.			trans	-74.4	158.5	176.1	54.8	0	0	0	0	112.4	G1223 S1224 K1226 P1303 S1304	S1221-G1223 PolarHBondContact O-N 3.24Å; S1221-S1224 WeakPolarHBondContact O-CB 3.37Å; S1221-S1224 PolarHBondContact O-N 3.29Å; S1221-S1224 VanDerWaalsContact O-N 3.16Å; S1221-S1224 PolarHBondContact O-OG 3.12Å; S1221-K1226 WeakPolarHBondContact O-CE 3.47Å; S1221-K1226 PolarHBondContact O-NZ 2.69Å; S1221-P1303 WeakPolarHBondContact O-CB 3.43Å; S1221-P1303 VanDerWaalsContact O-CG 3.23Å; S1221-P1303 WeakPolarHBondContact O-CG 3.16Å; S1221-S1304 PolarHBondContact OG-O 3Å
1222	N	37.7	Very low	39.2	Very low	119.2 Å²	119.2	64.6 Å²	64.6	64%	0.637	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	141.3	170.1	-70.7	-17.2	0	0	0	111.9	E743 S1224 K1226 E1673	E743-N1222 WeakPolarHBondContact OE1-CB 3.18Å; E743-N1222 PolarHBondContact OE1-ND2 3.37Å; N1222-S1224 PolarHBondContact O-N 2.92Å; N1222-K1226 PolarHBondContact OD1-NZ 3.08Å; N1222-E1673 HydrophobicContact CB-CG 3.71Å; N1222-E1673 WeakPolarHBondContact CB-OE1 3.28Å; N1222-E1673 WeakPolarHBondContact CB-OE2 3.45Å
1223	G	38.5	Very low	39.5	Very low	46 Å²	46	59.8 Å²	59.8	47%	0.474	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.4	17.2	175.6	0	0	0	0	0	117	S1221 G1225 I1473 P1474 L1475 E1673	S1221-G1223 PolarHBondContact O-N 3.24Å; G1223-G1225 VanDerWaalsContact C-N 3.33Å; G1223-G1225 PolarHBondContact O-N 3.27Å; G1223-I1473 WeakPolarHBondContact O-CG2 3.3Å; G1223-P1474 VanDerWaalsContact O-CD 3.3Å; G1223-P1474 WeakPolarHBondContact O-CD 3.49Å; G1223-L1475 PolarHBondContact O-N 2.84Å; G1223-E1673 PolarHBondContact N-OE2 2.91Å
1224	S	41.5	Very low	39.6	Very low	50.8 Å²	50.8	58.2 Å²	58.2	36%	0.355	36%	0.355	S	S	.	.	S	Bend	trans	-98	22.3	174.4	71.1	0	0	0	0	114.8	G1220 S1221 N1222 K1226	G1220-S1224 WeakPolarHBondContact CA-OG 3.21Å; S1221-S1224 WeakPolarHBondContact O-CB 3.37Å; S1221-S1224 PolarHBondContact O-N 3.29Å; S1221-S1224 VanDerWaalsContact O-N 3.16Å; S1221-S1224 PolarHBondContact O-OG 3.12Å; N1222-S1224 PolarHBondContact O-N 2.92Å; S1224-K1226 VanDerWaalsContact C-N 3.3Å; S1224-K1226 PolarHBondContact O-N 3Å; S1224-K1226 WeakPolarHBondContact OG-CE 3.42Å; S1224-K1226 WeakPolarHBondContact OG-CG 3.23Å
1225	G	38	Very low	39.6	Very low	36.2 Å²	36.2	59.9 Å²	59.9	37%	0.373	36%	0.36	S	S	.	.	S	Bend	trans	63	30.2	175	0	0	0	0	0	116.5	G1223 T1227 T1228 Y1229	G1223-G1225 VanDerWaalsContact C-N 3.33Å; G1223-G1225 PolarHBondContact O-N 3.27Å; G1225-T1227 VanDerWaalsContact C-N 3.32Å; G1225-T1227 PolarHBondContact O-N 3.25Å; G1225-T1228 CarbonylContact O-C 3.5Å; G1225-T1228 WeakPolarHBondContact O-CA 3.35Å; G1225-T1228 VanDerWaalsContact O-CB 3.27Å; G1225-T1228 WeakPolarHBondContact O-CB 3.32Å; G1225-T1228 PolarHBondContact O-N 3.02Å; G1225-T1228 VanDerWaalsContact O-N 3.11Å; G1225-Y1229 WeakPolarHBondContact O-CB 3.38Å; G1225-Y1229 PolarHBondContact O-N 3.14Å
1226	K	41.6	Very low	39.4	Very low	78 Å²	78	58.8 Å²	58.8	34%	0.339	36%	0.359	S	S	.	.	H	α-helix	trans	-57.4	-19	175.7	-57.8	-170.7	-137.2	-160.5	0	114.8	I1218 G1220 S1221 N1222 S1224 T1228 Y1229 L1230 D1383 C1409 S1664	I1218-K1226 HydrophobicContact CG2-CB 3.83Å; I1218-K1226 HydrophobicContact CG2-CD 3.97Å; I1218-K1226 HydrophobicContact CG2-CG 3.72Å; I1218-K1226 WeakPolarHBondContact O-CD 3.44Å; G1220-K1226 VanDerWaalsContact C-CE 3.41Å; G1220-K1226 VanDerWaalsContact CA-CE 3.47Å; G1220-K1226 VanDerWaalsContact N-NZ 3.13Å; G1220-K1226 VanDerWaalsContact O-CE 3.22Å; G1220-K1226 WeakPolarHBondContact O-CE 3.35Å; G1220-K1226 PolarHBondContact O-NZ 3.2Å; S1221-K1226 WeakPolarHBondContact O-CE 3.47Å; S1221-K1226 PolarHBondContact O-NZ 2.69Å; N1222-K1226 PolarHBondContact OD1-NZ 3.08Å; S1224-K1226 VanDerWaalsContact C-N 3.3Å; S1224-K1226 PolarHBondContact O-N 3Å; S1224-K1226 WeakPolarHBondContact OG-CE 3.42Å; S1224-K1226 WeakPolarHBondContact OG-CG 3.23Å; K1226-T1228 VanDerWaalsContact C-N 3.31Å; K1226-T1228 PolarHBondContact O-N 3.12Å; K1226-Y1229 WeakPolarHBondContact O-CA 3.31Å; K1226-Y1229 VanDerWaalsContact O-CB 3.27Å; K1226-Y1229 WeakPolarHBondContact O-CB 2.78Å; K1226-Y1229 PolarHBondContact O-N 3.17Å; K1226-L1230 WeakPolarHBondContact O-CB 3.31Å; K1226-L1230 PolarHBondContact O-N 3Å; K1226-D1383 VanDerWaalsContact CE-OD1 3.3Å; K1226-D1383 WeakPolarHBondContact CE-OD1 3.42Å; K1226-D1383 IonicContact NZ-OD1 3.87Å; K1226-C1409 WeakPolarHBondContact CD-O 3.32Å; K1226-C1409 WeakPolarHBondContact CE-O 3.43Å; K1226-S1664 VanDerWaalsContact NZ-C 3.34Å; K1226-S1664 PolarHBondContact NZ-O 2.96Å; K1226-S1664 PolarHBondContact NZ-OG 3.29Å
1227	T	39.8	Very low	39.1	Very low	84.6 Å²	84.6	59.2 Å²	59.2	52%	0.519	36%	0.36	S	S	.	.	H	α-helix	trans	-88	-9.4	176.1	-34.3	0	0	0	0	113	N1194 G1225 L1230 S1231 F1293 L1297 S1298 I1299 D1382	N1194-T1227 WeakPolarHBondContact ND2-CG2 3.41Å; G1225-T1227 VanDerWaalsContact C-N 3.32Å; G1225-T1227 PolarHBondContact O-N 3.25Å; T1227-L1230 PolarHBondContact O-N 2.9Å; T1227-S1231 WeakPolarHBondContact O-CB 3.4Å; T1227-S1231 PolarHBondContact O-N 3.11Å; T1227-S1231 PolarHBondContact O-OG 3.42Å; T1227-F1293 HydrophobicContact CG2-CD1 4.36Å; T1227-F1293 HydrophobicContact CG2-CE1 4.07Å; T1227-L1297 HydrophobicContact CG2-CD2 4.13Å; T1227-S1298 WeakPolarHBondContact CB-OG 3.2Å; T1227-S1298 PolarHBondContact OG1-OG 2.75Å; T1227-I1299 WeakPolarHBondContact O-CD1 3.29Å; T1227-I1299 WeakPolarHBondContact O-CG1 3.49Å; T1227-D1382 WeakPolarHBondContact CB-OD2 3.32Å; T1227-D1382 WeakPolarHBondContact CG2-OD2 3.45Å; T1227-D1382 PolarHBondContact OG1-OD2 3.45Å
1228	T	37.8	Very low	38.9	Very low	84.2 Å²	84.2	60.8 Å²	60.8	52%	0.517	37%	0.368	S	S	.	.	H	α-helix	trans	-74.4	-14.5	169.6	-38.9	0	0	0	0	113.7	G1225 K1226 L1230 S1231 A1232	G1225-T1228 CarbonylContact O-C 3.5Å; G1225-T1228 WeakPolarHBondContact O-CA 3.35Å; G1225-T1228 VanDerWaalsContact O-CB 3.27Å; G1225-T1228 WeakPolarHBondContact O-CB 3.32Å; G1225-T1228 PolarHBondContact O-N 3.02Å; G1225-T1228 VanDerWaalsContact O-N 3.11Å; K1226-T1228 VanDerWaalsContact C-N 3.31Å; K1226-T1228 PolarHBondContact O-N 3.12Å; T1228-L1230 WeakPolarHBondContact O-CB 3.4Å; T1228-L1230 PolarHBondContact O-N 2.82Å; T1228-S1231 VanDerWaalsContact CA-OG 3.28Å; T1228-S1231 WeakPolarHBondContact CA-OG 3.35Å; T1228-S1231 PolarHBondContact O-N 2.99Å; T1228-S1231 PolarHBondContact O-OG 3.22Å; T1228-S1231 VanDerWaalsContact O-OG 3.08Å; T1228-A1232 VanDerWaalsContact O-CB 3.29Å; T1228-A1232 WeakPolarHBondContact O-CB 3.39Å; T1228-A1232 PolarHBondContact O-N 3.2Å
1229	Y	39.3	Very low	38.6	Very low	129 Å²	129	64.5 Å²	64.5	51%	0.506	39%	0.385	S	S	.	.	H	α-helix	trans	-65.2	-26.9	165.4	-136.1	-95.7	0	0	0	114.1	R814 H824 L1201 I1218 G1225 K1226 A1232 L1233 V1430	R814-Y1229 VanDerWaalsContact CD-CE1 3.42Å; R814-Y1229 WeakPolarHBondContact CD-OH 3.47Å; R814-Y1229 HydrophobicContact CG-CE1 4.44Å; R814-Y1229 WeakPolarHBondContact CG-OH 3.27Å; H824-Y1229 AromaticContact CE1-CD1 3.95Å; H824-Y1229 AromaticContact CE1-CE1 3.33Å; H824-Y1229 WeakPolarHBondContact CE1-CE1 3.39Å; H824-Y1229 AromaticContact ND1-CE1 3.73Å; L1201-Y1229 HydrophobicContact CD2-CE1 3.97Å; L1201-Y1229 WeakPolarHBondContact CD2-OH 3.46Å; I1218-Y1229 HydrophobicContact CD1-CD1 4.24Å; G1225-Y1229 WeakPolarHBondContact O-CB 3.38Å; G1225-Y1229 PolarHBondContact O-N 3.14Å; K1226-Y1229 WeakPolarHBondContact O-CA 3.31Å; K1226-Y1229 VanDerWaalsContact O-CB 3.27Å; K1226-Y1229 WeakPolarHBondContact O-CB 2.78Å; K1226-Y1229 PolarHBondContact O-N 3.17Å; Y1229-A1232 PolarHBondContact O-N 3.42Å; Y1229-L1233 HydrophobicContact CD1-CD1 4.48Å; Y1229-L1233 HydrophobicContact CE1-CD1 4.22Å; Y1229-L1233 VanDerWaalsContact O-CB 3.28Å; Y1229-L1233 WeakPolarHBondContact O-CB 3.28Å; Y1229-L1233 PolarHBondContact O-N 3.41Å; Y1229-V1430 HydrophobicContact CD2-CG1 4.36Å; Y1229-V1430 HydrophobicContact CD2-CG2 4.3Å; Y1229-V1430 HydrophobicContact CE2-CG1 4.46Å; Y1229-V1430 HydrophobicContact CG-CG2 4.49Å
1230	L	39.1	Very low	38.2	Very low	48 Å²	48	64.9 Å²	64.9	25%	0.251	39%	0.39	S	S	.	.	H	α-helix	trans	-79.9	-32.5	179.8	-97.1	170.9	0	0	0	113.6	A1039 N1040 M1147 I1218 K1226 T1227 T1228 A1232 L1233 T1234 I1291 F1293 L1380 D1382 T1408	A1039-L1230 HydrophobicContact CB-CD2 3.41Å; A1039-L1230 VanDerWaalsContact CB-CD2 3.41Å; N1040-L1230 HydrophobicContact CB-CD1 3.65Å; N1040-L1230 HydrophobicContact CB-CD2 3.47Å; N1040-L1230 VanDerWaalsContact CB-CD2 3.47Å; N1040-L1230 HydrophobicContact CB-CG 4.16Å; N1040-L1230 WeakPolarHBondContact ND2-CD1 3.43Å; N1040-L1230 WeakPolarHBondContact ND2-CD2 3.4Å; M1147-L1230 HydrophobicContact CE-CD2 3.51Å; I1218-L1230 HydrophobicContact CD1-CD1 4.31Å; I1218-L1230 HydrophobicContact CD1-CD2 3.98Å; I1218-L1230 HydrophobicContact CD1-CG 3.72Å; K1226-L1230 WeakPolarHBondContact O-CB 3.31Å; K1226-L1230 PolarHBondContact O-N 3Å; T1227-L1230 PolarHBondContact O-N 2.9Å; T1228-L1230 WeakPolarHBondContact O-CB 3.4Å; T1228-L1230 PolarHBondContact O-N 2.82Å; L1230-A1232 VanDerWaalsContact C-N 3.28Å; L1230-L1233 CarbonylContact O-C 3.58Å; L1230-L1233 WeakPolarHBondContact O-CB 2.97Å; L1230-L1233 PolarHBondContact O-N 3.36Å; L1230-T1234 WeakPolarHBondContact O-CB 3.41Å; L1230-T1234 PolarHBondContact O-N 3.29Å; L1230-T1234 PolarHBondContact O-OG1 3.33Å; L1230-I1291 HydrophobicContact CD2-CG2 4.13Å; L1230-F1293 HydrophobicContact CD2-CE1 3.91Å; L1230-F1293 HydrophobicContact CD2-CZ 4.03Å; L1230-L1380 HydrophobicContact CD1-CB 4.2Å; L1230-L1380 HydrophobicContact CD1-CD2 4.45Å; L1230-L1380 HydrophobicContact CD2-CD2 4.46Å; L1230-L1380 HydrophobicContact CG-CB 4.46Å; L1230-L1380 HydrophobicContact CG-CD2 4.02Å; L1230-D1382 HydrophobicContact CD1-CB 4.02Å; L1230-T1408 HydrophobicContact CB-CG2 4.1Å; L1230-T1408 HydrophobicContact CD1-CG2 3.5Å; L1230-T1408 HydrophobicContact CG-CG2 4.44Å
1231	S	36.1	Very low	37.7	Very low	48.2 Å²	48.2	69.2 Å²	69.2	34%	0.337	41%	0.408	S	S	.	.	H	α-helix	trans	-74	-34.3	179.4	57.1	0	0	0	0	112.5	S1055 T1227 T1228 L1233 T1234 I1235 I1299	S1055-S1231 VanDerWaalsContact CB-OG 3.24Å; S1055-S1231 WeakPolarHBondContact CB-OG 3.03Å; S1055-S1231 WeakPolarHBondContact OG-CA 3.3Å; S1055-S1231 WeakPolarHBondContact OG-CB 2.83Å; S1055-S1231 PolarHBondContact OG-O 3.31Å; S1055-S1231 PolarHBondContact OG-OG 3.37Å; T1227-S1231 WeakPolarHBondContact O-CB 3.4Å; T1227-S1231 PolarHBondContact O-N 3.11Å; T1227-S1231 PolarHBondContact O-OG 3.42Å; T1228-S1231 VanDerWaalsContact CA-OG 3.28Å; T1228-S1231 WeakPolarHBondContact CA-OG 3.35Å; T1228-S1231 PolarHBondContact O-N 2.99Å; T1228-S1231 PolarHBondContact O-OG 3.22Å; T1228-S1231 VanDerWaalsContact O-OG 3.08Å; S1231-L1233 VanDerWaalsContact C-N 3.33Å; S1231-L1233 PolarHBondContact O-N 3.46Å; S1231-T1234 WeakPolarHBondContact O-CB 3.38Å; S1231-T1234 PolarHBondContact O-N 3.07Å; S1231-I1235 VanDerWaalsContact O-CB 3.31Å; S1231-I1235 WeakPolarHBondContact O-CB 3.42Å; S1231-I1235 WeakPolarHBondContact O-CD1 3.39Å; S1231-I1235 WeakPolarHBondContact O-CG1 3.31Å; S1231-I1235 PolarHBondContact O-N 3.09Å; S1231-I1299 WeakPolarHBondContact OG-CG2 3.46Å
1232	A	36.3	Very low	37.5	Very low	57.4 Å²	57.4	73.7 Å²	73.7	47%	0.474	42%	0.415	S	S	.	.	H	α-helix	trans	-67.2	-34	174.5	0	0	0	0	0	112.5	S1055 T1228 Y1229 L1230 I1235 S1236	S1055-A1232 PolarHBondContact OG-N 3.34Å; T1228-A1232 VanDerWaalsContact O-CB 3.29Å; T1228-A1232 WeakPolarHBondContact O-CB 3.39Å; T1228-A1232 PolarHBondContact O-N 3.2Å; Y1229-A1232 PolarHBondContact O-N 3.42Å; L1230-A1232 VanDerWaalsContact C-N 3.28Å; A1232-I1235 PolarHBondContact O-N 3.19Å; A1232-S1236 WeakPolarHBondContact O-CB 3.33Å; A1232-S1236 PolarHBondContact O-N 3.09Å
1233	L	37.9	Very low	37.1	Very low	35.6 Å²	35.6	74.5 Å²	74.5	19%	0.186	41%	0.409	C	S	.	.	H	α-helix	trans	-75.4	-35.2	176.5	-149.1	100	0	0	0	112.1	H824 V1037 T1038 A1039 M1147 L1216 Y1229 L1230 S1231 I1235 S1236 L1237 L1380 V1406	H824-L1233 WeakPolarHBondContact CD2-CD1 3.11Å; H824-L1233 VanDerWaalsContact NE2-CD1 3.28Å; H824-L1233 WeakPolarHBondContact NE2-CD1 3.08Å; V1037-L1233 HydrophobicContact CB-CD1 4.1Å; V1037-L1233 HydrophobicContact CG1-CD1 4Å; V1037-L1233 WeakPolarHBondContact O-CD1 3.28Å; V1037-L1233 WeakPolarHBondContact O-CD2 3.17Å; V1037-L1233 WeakPolarHBondContact O-CG 3.17Å; T1038-L1233 HydrophobicContact CG2-CD2 4.28Å; A1039-L1233 HydrophobicContact CB-CB 3.21Å; A1039-L1233 HydrophobicContact CB-CD1 3.53Å; A1039-L1233 HydrophobicContact CB-CD2 4.41Å; A1039-L1233 HydrophobicContact CB-CG 3.83Å; M1147-L1233 HydrophobicContact CE-CB 3.93Å; M1147-L1233 HydrophobicContact CE-CD2 3.43Å; M1147-L1233 VanDerWaalsContact CE-CD2 3.43Å; M1147-L1233 HydrophobicContact CE-CG 4.24Å; M1147-L1233 HydrophobicContact CG-CD2 3.81Å; M1147-L1233 HydrophobicContact SD-CD2 3.76Å; M1147-L1233 HydrophobicContact SD-CG 4.5Å; L1216-L1233 HydrophobicContact CD2-CD2 4.18Å; Y1229-L1233 HydrophobicContact CD1-CD1 4.48Å; Y1229-L1233 HydrophobicContact CE1-CD1 4.22Å; Y1229-L1233 VanDerWaalsContact O-CB 3.28Å; Y1229-L1233 WeakPolarHBondContact O-CB 3.28Å; Y1229-L1233 PolarHBondContact O-N 3.41Å; L1230-L1233 CarbonylContact O-C 3.58Å; L1230-L1233 WeakPolarHBondContact O-CB 2.97Å; L1230-L1233 PolarHBondContact O-N 3.36Å; S1231-L1233 VanDerWaalsContact C-N 3.33Å; S1231-L1233 PolarHBondContact O-N 3.46Å; L1233-I1235 PolarHBondContact O-N 3.32Å; L1233-S1236 PolarHBondContact O-N 3.24Å; L1233-S1236 VanDerWaalsContact O-N 3.13Å; L1233-S1236 PolarHBondContact O-OG 3.36Å; L1233-L1237 HydrophobicContact CD2-CD1 3.92Å; L1233-L1237 VanDerWaalsContact CD2-CD1 3.5Å; L1233-L1237 HydrophobicContact CD2-CG 4.44Å; L1233-L1237 HydrophobicContact CG-CD1 3.99Å; L1233-L1237 HydrophobicContact CG-CG 4.31Å; L1233-L1237 WeakPolarHBondContact O-CB 3.3Å; L1233-L1237 VanDerWaalsContact O-CD1 3.3Å; L1233-L1237 WeakPolarHBondContact O-CD1 3.39Å; L1233-L1237 WeakPolarHBondContact O-CG 3.33Å; L1233-L1237 PolarHBondContact O-N 3.06Å; L1233-L1380 HydrophobicContact CD2-CD2 4.31Å; L1233-V1406 HydrophobicContact CD2-CB 4.38Å; L1233-V1406 HydrophobicContact CD2-CG1 3.73Å; L1233-V1406 HydrophobicContact CD2-CG2 3.88Å
1234	T	36.5	Very low	36.7	Very low	43.2 Å²	43.2	79.2 Å²	79.2	27%	0.265	42%	0.417	S	S	.	.	H	α-helix	trans	-63.1	-37.2	175.2	-45.3	0	0	0	0	111.1	C1058 Q1152 L1230 S1231 S1236 L1237 I1238 I1289 I1291	C1058-T1234 HydrophobicContact CB-CG2 3.62Å; Q1152-T1234 HydrophobicContact CG-CG2 4.28Å; L1230-T1234 WeakPolarHBondContact O-CB 3.41Å; L1230-T1234 PolarHBondContact O-N 3.29Å; L1230-T1234 PolarHBondContact O-OG1 3.33Å; S1231-T1234 WeakPolarHBondContact O-CB 3.38Å; S1231-T1234 PolarHBondContact O-N 3.07Å; T1234-S1236 VanDerWaalsContact C-N 3.26Å; T1234-S1236 PolarHBondContact O-N 3.15Å; T1234-L1237 PolarHBondContact O-N 3.06Å; T1234-I1238 HydrophobicContact CG2-CD1 3.73Å; T1234-I1238 HydrophobicContact CG2-CG1 4.25Å; T1234-I1238 WeakPolarHBondContact O-CA 3.49Å; T1234-I1238 WeakPolarHBondContact O-CB 3.39Å; T1234-I1238 WeakPolarHBondContact O-CD1 3.36Å; T1234-I1238 WeakPolarHBondContact O-CG1 3.34Å; T1234-I1238 PolarHBondContact O-N 3.01Å; T1234-I1289 HydrophobicContact CG2-CD1 4.38Å; T1234-I1291 HydrophobicContact CG2-CD1 3.43Å; T1234-I1291 VanDerWaalsContact CG2-CD1 3.43Å
1235	I	38.3	Very low	36.2	Very low	75.6 Å²	75.6	80.2 Å²	80.2	39%	0.388	42%	0.424	S	S	.	.	H	α-helix	trans	-68.8	-39.5	176.8	-67.3	165.7	0	0	0	110.9	D714 R1050 E1051 Y1054 S1055 S1231 A1232 L1233 L1237 I1238 E1239 W1242	D714-I1235 VanDerWaalsContact OD1-CD1 3.26Å; D714-I1235 WeakPolarHBondContact OD1-CD1 3.42Å; D714-I1235 WeakPolarHBondContact OD2-CG2 3.34Å; R1050-I1235 WeakPolarHBondContact O-CD1 3.4Å; E1051-I1235 WeakPolarHBondContact O-CD1 3.41Å; Y1054-I1235 HydrophobicContact CD1-CG1 4.23Å; S1055-I1235 WeakPolarHBondContact OG-CD1 3.43Å; S1231-I1235 VanDerWaalsContact O-CB 3.31Å; S1231-I1235 WeakPolarHBondContact O-CB 3.42Å; S1231-I1235 WeakPolarHBondContact O-CD1 3.39Å; S1231-I1235 WeakPolarHBondContact O-CG1 3.31Å; S1231-I1235 PolarHBondContact O-N 3.09Å; A1232-I1235 PolarHBondContact O-N 3.19Å; L1233-I1235 PolarHBondContact O-N 3.32Å; I1235-L1237 VanDerWaalsContact C-N 3.3Å; I1235-L1237 PolarHBondContact O-N 3.16Å; I1235-I1238 CarbonylContact O-C 3.59Å; I1235-I1238 PolarHBondContact O-N 3.27Å; I1235-E1239 VanDerWaalsContact CG2-CD 3.45Å; I1235-E1239 HydrophobicContact CG2-CG 4.24Å; I1235-E1239 WeakPolarHBondContact CG2-OE1 2.85Å; I1235-E1239 VanDerWaalsContact O-CB 3.27Å; I1235-E1239 WeakPolarHBondContact O-CB 3.36Å; I1235-E1239 VanDerWaalsContact O-CG 3.32Å; I1235-E1239 WeakPolarHBondContact O-CG 3.13Å; I1235-E1239 PolarHBondContact O-N 3.06Å; I1235-W1242 HydrophobicContact CG2-CB 3.66Å; I1235-W1242 HydrophobicContact CG2-CD2 4.45Å; I1235-W1242 HydrophobicContact CG2-CE3 4.33Å; I1235-W1242 HydrophobicContact CG2-CG 4.21Å
1236	S	36.8	Very low	35.8	Very low	44.4 Å²	44.4	83.6 Å²	83.6	31%	0.31	43%	0.433	S	S	.	.	H	α-helix	trans	-71.5	-29.9	177.9	171.4	0	0	0	0	114	C786 A1232 L1233 T1234 E1239 S1240 F1284	C786-S1236 VanDerWaalsContact CB-OG 3.28Å; C786-S1236 WeakPolarHBondContact CB-OG 3.46Å; A1232-S1236 WeakPolarHBondContact O-CB 3.33Å; A1232-S1236 PolarHBondContact O-N 3.09Å; L1233-S1236 PolarHBondContact O-N 3.24Å; L1233-S1236 VanDerWaalsContact O-N 3.13Å; L1233-S1236 PolarHBondContact O-OG 3.36Å; T1234-S1236 VanDerWaalsContact C-N 3.26Å; T1234-S1236 PolarHBondContact O-N 3.15Å; S1236-E1239 PolarHBondContact O-N 3.18Å; S1236-S1240 VanDerWaalsContact O-CB 3.28Å; S1236-S1240 WeakPolarHBondContact O-CB 3.27Å; S1236-S1240 PolarHBondContact O-N 3.21Å; S1236-S1240 PolarHBondContact O-OG 3.19Å; S1236-F1284 VanDerWaalsContact O-CD2 3.31Å; S1236-F1284 WeakPolarHBondContact O-CD2 3.43Å
1237	L	36.3	Very low	35.1	Very low	49.6 Å²	49.6	85.2 Å²	85.2	26%	0.26	45%	0.45	S	S	.	.	H	α-helix	trans	-82.8	-26	176.7	-73.8	168.4	0	0	0	112.9	K1143 M1147 L1233 T1234 I1235 E1239 S1240 N1241 F1284 H1287 I1289	K1143-L1237 HydrophobicContact CB-CD2 4.09Å; K1143-L1237 HydrophobicContact CD-CD2 3.82Å; K1143-L1237 HydrophobicContact CG-CD2 3.97Å; M1147-L1237 HydrophobicContact CG-CD1 3.68Å; M1147-L1237 HydrophobicContact SD-CD1 3.23Å; M1147-L1237 WeakPolarHBondContact SD-CD1 3.42Å; L1233-L1237 HydrophobicContact CD2-CD1 3.92Å; L1233-L1237 VanDerWaalsContact CD2-CD1 3.5Å; L1233-L1237 HydrophobicContact CD2-CG 4.44Å; L1233-L1237 HydrophobicContact CG-CD1 3.99Å; L1233-L1237 HydrophobicContact CG-CG 4.31Å; L1233-L1237 WeakPolarHBondContact O-CB 3.3Å; L1233-L1237 VanDerWaalsContact O-CD1 3.3Å; L1233-L1237 WeakPolarHBondContact O-CD1 3.39Å; L1233-L1237 WeakPolarHBondContact O-CG 3.33Å; L1233-L1237 PolarHBondContact O-N 3.06Å; T1234-L1237 PolarHBondContact O-N 3.06Å; I1235-L1237 VanDerWaalsContact C-N 3.3Å; I1235-L1237 PolarHBondContact O-N 3.16Å; L1237-E1239 VanDerWaalsContact C-N 3.31Å; L1237-S1240 WeakPolarHBondContact CA-OG 3.29Å; L1237-S1240 PolarHBondContact O-N 2.87Å; L1237-S1240 PolarHBondContact O-OG 3.43Å; L1237-N1241 PolarHBondContact O-N 2.9Å; L1237-F1284 HydrophobicContact CD2-CB 4.33Å; L1237-F1284 HydrophobicContact CD2-CD1 4.48Å; L1237-F1284 HydrophobicContact CD2-CG 4.39Å; L1237-H1287 PolarHBondContact O-N 3.37Å; L1237-I1289 HydrophobicContact CB-CD1 3.47Å; L1237-I1289 VanDerWaalsContact CB-CD1 3.47Å; L1237-I1289 HydrophobicContact CB-CG1 4.46Å; L1237-I1289 HydrophobicContact CD1-CD1 4.4Å
1238	I	37.9	Very low	34.5	Very low	89.4 Å²	89.4	87.5 Å²	87.5	46%	0.458	46%	0.457	S	S	.	.	H	α-helix	trans	-71.3	-36.6	172.9	-69.5	168.8	0	0	0	110.3	Y1054 C1058 T1234 I1235 S1240 W1242 I1289	Y1054-I1238 HydrophobicContact CE1-CD1 4.18Å; C1058-I1238 HydrophobicContact CB-CD1 3.78Å; C1058-I1238 WeakPolarHBondContact SG-CD1 3.41Å; T1234-I1238 HydrophobicContact CG2-CD1 3.73Å; T1234-I1238 HydrophobicContact CG2-CG1 4.25Å; T1234-I1238 WeakPolarHBondContact O-CA 3.49Å; T1234-I1238 WeakPolarHBondContact O-CB 3.39Å; T1234-I1238 WeakPolarHBondContact O-CD1 3.36Å; T1234-I1238 WeakPolarHBondContact O-CG1 3.34Å; T1234-I1238 PolarHBondContact O-N 3.01Å; I1235-I1238 CarbonylContact O-C 3.59Å; I1235-I1238 PolarHBondContact O-N 3.27Å; I1238-S1240 PolarHBondContact O-N 3.49Å; I1238-W1242 HydrophobicContact CB-CD2 4.45Å; I1238-W1242 HydrophobicContact CB-CE3 3.69Å; I1238-W1242 HydrophobicContact CB-CZ3 3.76Å; I1238-W1242 HydrophobicContact CD1-CH2 4.37Å; I1238-W1242 HydrophobicContact CD1-CZ3 4.28Å; I1238-W1242 HydrophobicContact CG1-CD2 4.42Å; I1238-W1242 HydrophobicContact CG1-CE3 3.58Å; I1238-W1242 HydrophobicContact CG1-CH2 3.59Å; I1238-W1242 HydrophobicContact CG1-CZ3 3.08Å; I1238-W1242 HydrophobicContact CG2-CB 4.32Å; I1238-W1242 HydrophobicContact CG2-CD2 3.93Å; I1238-W1242 HydrophobicContact CG2-CE3 3.66Å; I1238-W1242 HydrophobicContact CG2-CG 4.35Å; I1238-W1242 HydrophobicContact CG2-CZ3 4.07Å; I1238-W1242 WeakPolarHBondContact O-CA 3.4Å; I1238-W1242 WeakPolarHBondContact O-CB 3.16Å; I1238-W1242 PolarHBondContact O-N 3.46Å; I1238-I1289 HydrophobicContact CD1-CD1 4.43Å; I1238-I1289 HydrophobicContact CG1-CD1 3.54Å
1239	E	37.4	Very low	34.1	Very low	102 Å²	102	89.3 Å²	89.3	48%	0.477	46%	0.463	S	S	.	.	H	α-helix	trans	-89.9	-1.8	-174.8	-69.6	-173.4	155.3	0	0	114.1	I1235 S1236 L1237 N1241 W1242 Y1243	I1235-E1239 VanDerWaalsContact CG2-CD 3.45Å; I1235-E1239 HydrophobicContact CG2-CG 4.24Å; I1235-E1239 WeakPolarHBondContact CG2-OE1 2.85Å; I1235-E1239 VanDerWaalsContact O-CB 3.27Å; I1235-E1239 WeakPolarHBondContact O-CB 3.36Å; I1235-E1239 VanDerWaalsContact O-CG 3.32Å; I1235-E1239 WeakPolarHBondContact O-CG 3.13Å; I1235-E1239 PolarHBondContact O-N 3.06Å; S1236-E1239 PolarHBondContact O-N 3.18Å; L1237-E1239 VanDerWaalsContact C-N 3.31Å; E1239-N1241 VanDerWaalsContact C-N 3.34Å; E1239-N1241 PolarHBondContact O-N 2.97Å; E1239-W1242 HydrophobicContact CB-CB 3.72Å; E1239-W1242 WeakPolarHBondContact O-CB 3.24Å; E1239-W1242 PolarHBondContact O-N 3.27Å; E1239-W1242 WeakPolarHBondContact OE2-CA 3.21Å; E1239-Y1243 HydrophobicContact CG-CD2 4.33Å; E1239-Y1243 WeakPolarHBondContact O-CB 3.2Å; E1239-Y1243 PolarHBondContact O-N 2.8Å
1240	S	34.2	Very low	33.8	Very low	52.6 Å²	52.6	91.4 Å²	91.4	37%	0.368	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-0.6	179.3	63.2	0	0	0	0	115.2	S1236 L1237 I1238 W1242 K1244	S1236-S1240 VanDerWaalsContact O-CB 3.28Å; S1236-S1240 WeakPolarHBondContact O-CB 3.27Å; S1236-S1240 PolarHBondContact O-N 3.21Å; S1236-S1240 PolarHBondContact O-OG 3.19Å; L1237-S1240 WeakPolarHBondContact CA-OG 3.29Å; L1237-S1240 PolarHBondContact O-N 2.87Å; L1237-S1240 PolarHBondContact O-OG 3.43Å; I1238-S1240 PolarHBondContact O-N 3.49Å; S1240-W1242 PolarHBondContact O-N 3.14Å; S1240-K1244 VanDerWaalsContact O-CD 3.24Å; S1240-K1244 WeakPolarHBondContact O-CD 3.43Å; S1240-K1244 WeakPolarHBondContact O-CE 3.45Å; S1240-K1244 PolarHBondContact O-NZ 2.95Å
1241	N	32	Very low	33.6	Very low	111.2 Å²	111.2	94 Å²	94	60%	0.595	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	11.3	-177.7	-78.1	-41.8	0	0	0	115.4	L1237 E1239 Y1243 K1244	L1237-N1241 PolarHBondContact O-N 2.9Å; E1239-N1241 VanDerWaalsContact C-N 3.34Å; E1239-N1241 PolarHBondContact O-N 2.97Å; N1241-Y1243 CarbonylContact O-C 3.57Å; N1241-Y1243 PolarHBondContact O-N 3.14Å; N1241-K1244 HydrophobicContact CB-CD 4.13Å; N1241-K1244 WeakPolarHBondContact O-CB 3.35Å; N1241-K1244 VanDerWaalsContact O-CG 3.27Å; N1241-K1244 WeakPolarHBondContact O-CG 3.2Å; N1241-K1244 PolarHBondContact O-N 3.27Å; N1241-K1244 WeakPolarHBondContact OD1-CE 3.49Å; N1241-K1244 PolarHBondContact OD1-NZ 2.99Å
1242	W	33.6	Very low	33.6	Very low	163 Å²	163	97.1 Å²	97.1	62%	0.617	51%	0.505	S	S	*	.			trans	-85	-22.3	-177.5	105.5	-63.2	0	0	0	115.4	I1235 I1238 E1239 S1240 K1244 S1245	I1235-W1242 HydrophobicContact CG2-CB 3.66Å; I1235-W1242 HydrophobicContact CG2-CD2 4.45Å; I1235-W1242 HydrophobicContact CG2-CE3 4.33Å; I1235-W1242 HydrophobicContact CG2-CG 4.21Å; I1238-W1242 HydrophobicContact CB-CD2 4.45Å; I1238-W1242 HydrophobicContact CB-CE3 3.69Å; I1238-W1242 HydrophobicContact CB-CZ3 3.76Å; I1238-W1242 HydrophobicContact CD1-CH2 4.37Å; I1238-W1242 HydrophobicContact CD1-CZ3 4.28Å; I1238-W1242 HydrophobicContact CG1-CD2 4.42Å; I1238-W1242 HydrophobicContact CG1-CE3 3.58Å; I1238-W1242 HydrophobicContact CG1-CH2 3.59Å; I1238-W1242 HydrophobicContact CG1-CZ3 3.08Å; I1238-W1242 HydrophobicContact CG2-CB 4.32Å; I1238-W1242 HydrophobicContact CG2-CD2 3.93Å; I1238-W1242 HydrophobicContact CG2-CE3 3.66Å; I1238-W1242 HydrophobicContact CG2-CG 4.35Å; I1238-W1242 HydrophobicContact CG2-CZ3 4.07Å; I1238-W1242 WeakPolarHBondContact O-CA 3.4Å; I1238-W1242 WeakPolarHBondContact O-CB 3.16Å; I1238-W1242 PolarHBondContact O-N 3.46Å; E1239-W1242 HydrophobicContact CB-CB 3.72Å; E1239-W1242 WeakPolarHBondContact O-CB 3.24Å; E1239-W1242 PolarHBondContact O-N 3.27Å; E1239-W1242 WeakPolarHBondContact OE2-CA 3.21Å; S1240-W1242 PolarHBondContact O-N 3.14Å; W1242-K1244 VanDerWaalsContact C-N 3.34Å; W1242-K1244 PolarHBondContact O-N 3.25Å; W1242-K1244 VanDerWaalsContact O-N 3.16Å; W1242-S1245 PolarHBondContact O-OG 3.11Å; W1242-S1245 VanDerWaalsContact O-OG 3.12Å
1243	Y	31.1	Very low	33.5	Very low	134.8 Å²	134.8	101.5 Å²	101.5	53%	0.529	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	4.2	-175.7	67.9	-85.7	0	0	0	114.2	F780 E1239 N1241 S1245 I1246 R1281	F780-Y1243 HydrophobicContact CE2-CD1 4.29Å; F780-Y1243 HydrophobicContact CE2-CE1 4.32Å; E1239-Y1243 HydrophobicContact CG-CD2 4.33Å; E1239-Y1243 WeakPolarHBondContact O-CB 3.2Å; E1239-Y1243 PolarHBondContact O-N 2.8Å; N1241-Y1243 CarbonylContact O-C 3.57Å; N1241-Y1243 PolarHBondContact O-N 3.14Å; Y1243-S1245 VanDerWaalsContact C-N 3.34Å; Y1243-S1245 PolarHBondContact O-N 3.18Å; Y1243-S1245 VanDerWaalsContact O-N 3.09Å; Y1243-I1246 PolarHBondContact O-N 3.46Å; Y1243-R1281 HydrophobicContact CD1-CB 4.19Å; Y1243-R1281 HydrophobicContact CD1-CG 4.2Å; Y1243-R1281 HydrophobicContact CD2-CB 4.2Å; Y1243-R1281 HydrophobicContact CD2-CG 3.78Å; Y1243-R1281 HydrophobicContact CE1-CB 3.76Å; Y1243-R1281 HydrophobicContact CE1-CG 4.25Å; Y1243-R1281 HydrophobicContact CE2-CB 3.75Å; Y1243-R1281 HydrophobicContact CE2-CG 3.82Å; Y1243-R1281 HydrophobicContact CG-CB 4.42Å; Y1243-R1281 HydrophobicContact CG-CG 4Å
1244	K	30	Very low	33.3	Very low	146 Å²	146	106.1 Å²	106.1	64%	0.635	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	5.2	-176.5	-76.1	-175.8	-179.2	168.1	0	115.8	S1240 N1241 W1242	S1240-K1244 VanDerWaalsContact O-CD 3.24Å; S1240-K1244 WeakPolarHBondContact O-CD 3.43Å; S1240-K1244 WeakPolarHBondContact O-CE 3.45Å; S1240-K1244 PolarHBondContact O-NZ 2.95Å; N1241-K1244 HydrophobicContact CB-CD 4.13Å; N1241-K1244 WeakPolarHBondContact O-CB 3.35Å; N1241-K1244 VanDerWaalsContact O-CG 3.27Å; N1241-K1244 WeakPolarHBondContact O-CG 3.2Å; N1241-K1244 PolarHBondContact O-N 3.27Å; N1241-K1244 WeakPolarHBondContact OD1-CE 3.49Å; N1241-K1244 PolarHBondContact OD1-NZ 2.99Å; W1242-K1244 VanDerWaalsContact C-N 3.34Å; W1242-K1244 PolarHBondContact O-N 3.25Å; W1242-K1244 VanDerWaalsContact O-N 3.16Å
1245	S	29.4	Very low	33.2	Very low	72 Å²	72	112.3 Å²	112.3	50%	0.503	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-119.7	37.6	-174.7	59.1	0	0	0	0	116.2	W1242 Y1243	W1242-S1245 PolarHBondContact O-OG 3.11Å; W1242-S1245 VanDerWaalsContact O-OG 3.12Å; Y1243-S1245 VanDerWaalsContact C-N 3.34Å; Y1243-S1245 PolarHBondContact O-N 3.18Å; Y1243-S1245 VanDerWaalsContact O-N 3.09Å
1246	I	29.5	Very low	32.9	Very low	107.8 Å²	107.8	115.8 Å²	115.8	55%	0.553	58%	0.576	S	S	*	*			trans	-137.4	115.5	171.6	-58	172.8	0	0	0	111.1	Y1243 M1248	Y1243-I1246 PolarHBondContact O-N 3.46Å; I1246-M1248 HydrophobicContact CG2-CG 4.12Å; I1246-M1248 PolarHBondContact O-N 3.08Å
1247	P	28.2	Very low	32.8	Very low	109.6 Å²	109.6	116.5 Å²	116.5	71%	0.712	59%	0.585	S	S	*	*			trans	-83	130.1	-173.6	24.5	-20.8	0	0	0	112.5	N1249	P1247-N1249 VanDerWaalsContact C-N 3.27Å; P1247-N1249 PolarHBondContact O-N 3.35Å
1248	M	27.6	Very low	32.7	Very low	134.4 Å²	134.4	119.3 Å²	119.3	66%	0.662	60%	0.604	S	S	*	*			trans	-76.7	118.1	165.9	-86.6	-99.4	173.4	0	0	112.9	I1246 K1250	I1246-M1248 HydrophobicContact CG2-CG 4.12Å; I1246-M1248 PolarHBondContact O-N 3.08Å; M1248-K1250 HydrophobicContact CE-CD 4.01Å; M1248-K1250 HydrophobicContact CE-CG 4.33Å; M1248-K1250 PolarHBondContact O-N 3Å; M1248-K1250 VanDerWaalsContact O-N 3.11Å; M1248-K1250 HydrophobicContact SD-CB 4.49Å; M1248-K1250 HydrophobicContact SD-CD 3.77Å; M1248-K1250 HydrophobicContact SD-CG 3.81Å
1249	N	29.5	Very low	32.4	Very low	121 Å²	121	123.2 Å²	123.2	65%	0.647	62%	0.618	S	S	*	*			trans	-91.9	116.2	166.8	-141.3	-18.3	0	0	0	112.1	P1247 T1251 I1252	P1247-N1249 VanDerWaalsContact C-N 3.27Å; P1247-N1249 PolarHBondContact O-N 3.35Å; N1249-T1251 VanDerWaalsContact C-N 3.29Å; N1249-T1251 PolarHBondContact O-N 3.19Å; N1249-T1251 PolarHBondContact OD1-N 3.4Å; N1249-T1251 VanDerWaalsContact OD1-N 3.08Å; N1249-T1251 PolarHBondContact OD1-OG1 3.4Å; N1249-I1252 HydrophobicContact CB-CD1 4.5Å; N1249-I1252 PolarHBondContact O-N 2.87Å
1250	K	32.9	Very low	32.2	Very low	173.4 Å²	173.4	124.7 Å²	124.7	75%	0.754	63%	0.629	S	S	*	*	H	α-helix	trans	-68.6	-3.9	-172	-94	178.4	176.5	175.6	0	114.6	M1248 I1252 Q1253	M1248-K1250 HydrophobicContact CE-CD 4.01Å; M1248-K1250 HydrophobicContact CE-CG 4.33Å; M1248-K1250 PolarHBondContact O-N 3Å; M1248-K1250 VanDerWaalsContact O-N 3.11Å; M1248-K1250 HydrophobicContact SD-CB 4.49Å; M1248-K1250 HydrophobicContact SD-CD 3.77Å; M1248-K1250 HydrophobicContact SD-CG 3.81Å; K1250-I1252 PolarHBondContact O-N 3.07Å; K1250-Q1253 PolarHBondContact O-N 2.64Å
1251	T	34	Very low	32.1	Very low	103.4 Å²	103.4	129.1 Å²	129.1	63%	0.634	65%	0.648	S	S	*	*	H	α-helix	trans	-92	-10.1	-170	17.2	0	0	0	0	115.4	N1249	N1249-T1251 VanDerWaalsContact C-N 3.29Å; N1249-T1251 PolarHBondContact O-N 3.19Å; N1249-T1251 PolarHBondContact OD1-N 3.4Å; N1249-T1251 VanDerWaalsContact OD1-N 3.08Å; N1249-T1251 PolarHBondContact OD1-OG1 3.4Å
1252	I	36.3	Very low	32.2	Very low	113.4 Å²	113.4	128.3 Å²	128.3	58%	0.582	65%	0.651	S	S	*	*	S	Bend	trans	-101.4	-25.2	-176.6	-60.5	175.3	0	0	0	112.8	N1249 K1250 N1254 K1255 F1256	N1249-I1252 HydrophobicContact CB-CD1 4.5Å; N1249-I1252 PolarHBondContact O-N 2.87Å; K1250-I1252 PolarHBondContact O-N 3.07Å; I1252-N1254 VanDerWaalsContact C-N 3.3Å; I1252-N1254 PolarHBondContact O-N 3.03Å; I1252-K1255 PolarHBondContact O-N 3.13Å; I1252-F1256 HydrophobicContact CG2-CD2 4.12Å; I1252-F1256 HydrophobicContact CG2-CE2 4.05Å; I1252-F1256 WeakPolarHBondContact O-CD2 3.01Å; I1252-F1256 PolarHBondContact O-N 2.8Å
1253	Q	33.5	Very low	32.2	Very low	148.8 Å²	148.8	127.5 Å²	127.5	70%	0.695	66%	0.657	S	S	*	*	H	α-helix	trans	-66.8	-27.9	-179.6	-80.4	-178.3	-20.6	0	0	114.1	K1250 K1255 F1256 A1257	K1250-Q1253 PolarHBondContact O-N 2.64Å; Q1253-K1255 VanDerWaalsContact C-N 3.34Å; Q1253-K1255 PolarHBondContact O-N 3.3Å; Q1253-F1256 PolarHBondContact O-N 2.84Å; Q1253-A1257 WeakPolarHBondContact O-CA 3.42Å; Q1253-A1257 WeakPolarHBondContact O-CB 3.17Å; Q1253-A1257 PolarHBondContact O-N 3.08Å
1254	N	34.5	Very low	32.1	Very low	132 Å²	132	124.4 Å²	124.4	71%	0.706	67%	0.667	S	S	*	*	H	α-helix	trans	-80.2	-15.5	-177.8	-75.3	-5.3	0	0	0	114.6	I1252 F1256 A1257 T1258	I1252-N1254 VanDerWaalsContact C-N 3.3Å; I1252-N1254 PolarHBondContact O-N 3.03Å; N1254-F1256 VanDerWaalsContact C-N 3.33Å; N1254-F1256 PolarHBondContact O-N 3.18Å; N1254-A1257 PolarHBondContact O-N 3.31Å; N1254-T1258 WeakPolarHBondContact O-CB 3.31Å; N1254-T1258 WeakPolarHBondContact O-CG2 3.42Å; N1254-T1258 PolarHBondContact O-N 3.33Å; N1254-T1258 VanDerWaalsContact O-N 3.1Å; N1254-T1258 PolarHBondContact O-OG1 3.11Å
1255	K	34	Very low	32	Very low	174.8 Å²	174.8	122.3 Å²	122.3	76%	0.76	67%	0.67	S	S	*	*	H	α-helix	trans	-90.1	-18.9	178.2	-87.3	-177	176	178.6	0	114.6	I1252 Q1253 T1258	I1252-K1255 PolarHBondContact O-N 3.13Å; Q1253-K1255 VanDerWaalsContact C-N 3.34Å; Q1253-K1255 PolarHBondContact O-N 3.3Å; K1255-T1258 WeakPolarHBondContact CA-OG1 3.44Å; K1255-T1258 PolarHBondContact O-OG1 3.33Å
1256	F	31.6	Very low	32	Very low	147.8 Å²	147.8	128 Å²	128	65%	0.648	69%	0.687	S	S	*	*	H	α-helix	trans	-92.1	-27.1	176.4	-89.5	-87.6	0	0	0	113.3	I1252 Q1253 N1254 T1258 K1259 L1260	I1252-F1256 HydrophobicContact CG2-CD2 4.12Å; I1252-F1256 HydrophobicContact CG2-CE2 4.05Å; I1252-F1256 WeakPolarHBondContact O-CD2 3.01Å; I1252-F1256 PolarHBondContact O-N 2.8Å; Q1253-F1256 PolarHBondContact O-N 2.84Å; N1254-F1256 VanDerWaalsContact C-N 3.33Å; N1254-F1256 PolarHBondContact O-N 3.18Å; F1256-T1258 VanDerWaalsContact C-N 3.32Å; F1256-T1258 PolarHBondContact O-N 3.31Å; F1256-K1259 PolarHBondContact O-N 2.92Å; F1256-K1259 VanDerWaalsContact O-N 3.09Å; F1256-L1260 PolarHBondContact O-N 3.13Å
1257	A	34.6	Very low	31.9	Very low	58.6 Å²	58.6	131.6 Å²	131.6	48%	0.484	70%	0.703	S	S	.	*	H	α-helix	trans	-70.6	-25.1	-179.5	0	0	0	0	0	113.8	Q1253 N1254 K1259 L1260 N1261	Q1253-A1257 WeakPolarHBondContact O-CA 3.42Å; Q1253-A1257 WeakPolarHBondContact O-CB 3.17Å; Q1253-A1257 PolarHBondContact O-N 3.08Å; N1254-A1257 PolarHBondContact O-N 3.31Å; A1257-K1259 VanDerWaalsContact C-N 3.29Å; A1257-K1259 PolarHBondContact O-N 3.14Å; A1257-K1259 VanDerWaalsContact O-N 3.09Å; A1257-L1260 PolarHBondContact O-N 2.89Å; A1257-N1261 WeakPolarHBondContact O-CB 3.36Å; A1257-N1261 PolarHBondContact O-N 2.9Å; A1257-N1261 PolarHBondContact O-ND2 2.73Å; A1257-N1261 PolarHBondContact O-OD1 3.22Å
1258	T	34.4	Very low	31.8	Very low	109.8 Å²	109.8	133.8 Å²	133.8	67%	0.674	71%	0.709	S	S	*	*	H	α-helix	trans	-85.7	-13.1	-178.1	46.4	0	0	0	0	114.7	N1254 K1255 F1256	N1254-T1258 WeakPolarHBondContact O-CB 3.31Å; N1254-T1258 WeakPolarHBondContact O-CG2 3.42Å; N1254-T1258 PolarHBondContact O-N 3.33Å; N1254-T1258 VanDerWaalsContact O-N 3.1Å; N1254-T1258 PolarHBondContact O-OG1 3.11Å; K1255-T1258 WeakPolarHBondContact CA-OG1 3.44Å; K1255-T1258 PolarHBondContact O-OG1 3.33Å; F1256-T1258 VanDerWaalsContact C-N 3.32Å; F1256-T1258 PolarHBondContact O-N 3.31Å
1259	K	31.7	Very low	31.9	Very low	171.8 Å²	171.8	134.9 Å²	134.9	75%	0.747	72%	0.717	S	S	*	*	H	α-helix	trans	-101.8	-8.1	-176.9	-141.9	170.9	-174	178.4	0	114.6	F1256 A1257 S1262	F1256-K1259 PolarHBondContact O-N 2.92Å; F1256-K1259 VanDerWaalsContact O-N 3.09Å; A1257-K1259 VanDerWaalsContact C-N 3.29Å; A1257-K1259 PolarHBondContact O-N 3.14Å; A1257-K1259 VanDerWaalsContact O-N 3.09Å; K1259-S1262 PolarHBondContact O-OG 3.46Å
1260	L	32.9	Very low	31.9	Very low	133.2 Å²	133.2	134.6 Å²	134.6	70%	0.697	73%	0.725	S	S	*	*	S	Bend	trans	-99.3	-13.2	177.8	-91.9	155.7	0	0	0	113.3	F1256 A1257 S1262 I1263 G1264	F1256-L1260 PolarHBondContact O-N 3.13Å; A1257-L1260 PolarHBondContact O-N 2.89Å; L1260-S1262 VanDerWaalsContact C-N 3.28Å; L1260-S1262 PolarHBondContact O-N 2.98Å; L1260-I1263 PolarHBondContact O-N 3.25Å; L1260-I1263 VanDerWaalsContact O-N 3.11Å; L1260-G1264 PolarHBondContact O-N 3.27Å
1261	N	32.3	Very low	31.6	Very low	144 Å²	144	134.1 Å²	134.1	77%	0.77	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-0.9	177.6	-73.4	-9.6	0	0	0	114.3	A1257 I1263	A1257-N1261 WeakPolarHBondContact O-CB 3.36Å; A1257-N1261 PolarHBondContact O-N 2.9Å; A1257-N1261 PolarHBondContact O-ND2 2.73Å; A1257-N1261 PolarHBondContact O-OD1 3.22Å; N1261-I1263 VanDerWaalsContact C-N 3.3Å
1262	S	34.8	Very low	31.4	Very low	94.4 Å²	94.4	135.5 Å²	135.5	66%	0.66	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	1.7	-179	60.9	0	0	0	0	115.2	K1259 L1260	K1259-S1262 PolarHBondContact O-OG 3.46Å; L1260-S1262 VanDerWaalsContact C-N 3.28Å; L1260-S1262 PolarHBondContact O-N 2.98Å
1263	I	34.1	Very low	31.1	Very low	145.6 Å²	145.6	137.2 Å²	137.2	75%	0.747	74%	0.736	S	S	*	*	S	Bend	trans	-126.3	50.4	177.7	-53.7	174.6	0	0	0	109.7	L1260 N1261 S1265	L1260-I1263 PolarHBondContact O-N 3.25Å; L1260-I1263 VanDerWaalsContact O-N 3.11Å; N1261-I1263 VanDerWaalsContact C-N 3.3Å; I1263-S1265 VanDerWaalsContact C-N 3.31Å; I1263-S1265 PolarHBondContact O-N 3.34Å
1264	G	27.9	Very low	31	Very low	71.6 Å²	71.6	134.6 Å²	134.6	74%	0.738	73%	0.734	S	S	*	*			trans	-94	61.2	172.8	0	0	0	0	0	113.6	L1260 F1266	L1260-G1264 PolarHBondContact O-N 3.27Å; G1264-F1266 PolarHBondContact O-N 2.94Å; G1264-F1266 VanDerWaalsContact O-N 3.17Å
1265	S	28.8	Very low	30.8	Very low	100.6 Å²	100.6	136 Å²	136	70%	0.703	73%	0.734	S	S	*	*			trans	-133.2	81.9	165.8	101.5	0	0	0	0	111.5	I1263	I1263-S1265 VanDerWaalsContact C-N 3.31Å; I1263-S1265 PolarHBondContact O-N 3.34Å
1266	F	29.3	Very low	30.5	Very low	192.8 Å²	192.8	132.3 Å²	132.3	85%	0.846	72%	0.722	S	S	*	*	S	Bend	trans	173.1	81.1	178	-88.5	-81.6	0	0	0	116.5	G1264	G1264-F1266 PolarHBondContact O-N 2.94Å; G1264-F1266 VanDerWaalsContact O-N 3.17Å
1267	M	27.6	Very low	30.5	Very low	183.4 Å²	183.4	130.2 Å²	130.2	90%	0.903	72%	0.716	S	S	*	*			trans	125	81.9	171	-65.8	-165.8	164.7	0	0	115.7	D1269	M1267-D1269 VanDerWaalsContact C-N 3.32Å; M1267-D1269 PolarHBondContact O-N 3.09Å
1268	N	26.2	Very low	30.4	Very low	155.2 Å²	155.2	132 Å²	132	83%	0.83	72%	0.722	S	S	*	*			trans	-84.4	119.6	153.1	-71.1	-24	0	0	0	108.2
1269	D	29.4	Very low	30.5	Very low	156.4 Å²	156.4	129.5 Å²	129.5	84%	0.836	71%	0.709	S	S	*	*			trans	168.2	116.3	144	-83.5	-17.8	0	0	0	111.5	M1267	M1267-D1269 VanDerWaalsContact C-N 3.32Å; M1267-D1269 PolarHBondContact O-N 3.09Å
1270	S	28.2	Very low	31.2	Very low	115 Å²	115	125.5 Å²	125.5	80%	0.804	69%	0.692	S	S	*	*			trans	-13.3	116.1	169.9	60.3	0	0	0	0	116.7
1271	M	27.5	Very low	32.1	Very low	164 Å²	164	122 Å²	122	81%	0.808	67%	0.67	S	S	*	*			trans	-151.3	117.3	150.8	-106.6	176.3	127.8	0	0	110.9	H1273	M1271-H1273 VanDerWaalsContact C-N 3.34Å; M1271-H1273 PolarHBondContact O-CD2 3.44Å; M1271-H1273 PolarHBondContact O-N 3.27Å; M1271-H1273 VanDerWaalsContact O-N 3.16Å
1272	D	30.3	Very low	33.1	Very low	131.4 Å²	131.4	116.5 Å²	116.5	70%	0.703	64%	0.642	S	S	*	*			trans	-67.3	113.3	177.4	-81.5	-41.4	0	0	0	112.7	S1274 K1275	D1272-S1274 PolarHBondContact O-N 3.1Å; D1272-S1274 VanDerWaalsContact O-N 3.1Å; D1272-K1275 PolarHBondContact O-N 3.15Å
1273	H	29.6	Very low	34.2	Very low	151 Å²	151	117.5 Å²	117.5	70%	0.699	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-74.6	0.9	176.8	-84.6	-75.9	0	0	0	115	M1271 K1275	M1271-H1273 VanDerWaalsContact C-N 3.34Å; M1271-H1273 PolarHBondContact O-CD2 3.44Å; M1271-H1273 PolarHBondContact O-N 3.27Å; M1271-H1273 VanDerWaalsContact O-N 3.16Å; H1273-K1275 VanDerWaalsContact C-N 3.32Å; H1273-K1275 PolarHBondContact O-N 3.08Å; H1273-K1275 VanDerWaalsContact O-N 3.15Å
1274	S	30.9	Very low	35.6	Very low	93.6 Å²	93.6	111.4 Å²	111.4	66%	0.655	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-80.8	-10.2	-176.4	58.5	0	0	0	0	114.9	D1272 L1276	D1272-S1274 PolarHBondContact O-N 3.1Å; D1272-S1274 VanDerWaalsContact O-N 3.1Å; S1274-L1276 PolarHBondContact O-N 2.99Å
1275	K	29.7	Very low	37.4	Very low	161 Å²	161	112.8 Å²	112.8	70%	0.7	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-92.1	4.5	-176.9	-77.4	-179.2	174.6	177.8	0	115.5	D1272 H1273 I1277	D1272-K1275 PolarHBondContact O-N 3.15Å; H1273-K1275 VanDerWaalsContact C-N 3.32Å; H1273-K1275 PolarHBondContact O-N 3.08Å; H1273-K1275 VanDerWaalsContact O-N 3.15Å; K1275-I1277 PolarHBondContact O-N 3.34Å
1276	L	28.4	Very low	39.3	Very low	97.6 Å²	97.6	114 Å²	114	51%	0.511	59%	0.594	S	S	.	*	S	Bend	trans	-95.1	36.5	-177.9	-88.5	149.9	0	0	0	113	S1274 T1278 S1279	S1274-L1276 PolarHBondContact O-N 2.99Å; L1276-T1278 PolarHBondContact O-N 3.05Å; L1276-T1278 VanDerWaalsContact O-N 3.08Å; L1276-S1279 PolarHBondContact O-OG 3.47Å
1277	I	32.3	Very low	41.5	Very low	103.4 Å²	103.4	105.4 Å²	105.4	53%	0.53	56%	0.556	S	S	.	*	S	Bend	trans	-57	7.5	172.7	-45.9	167.9	0	0	0	114.7	S710 K1275	S710-I1277 WeakPolarHBondContact O-CD1 3.13Å; K1275-I1277 PolarHBondContact O-N 3.34Å
1278	T	31.6	Very low	43.8	Very low	97 Å²	97	99 Å²	99	60%	0.595	52%	0.524	S	S	*	.	S	Bend	trans	-113.1	42.9	-173.1	43.9	0	0	0	0	114.5	L1276 I1283	L1276-T1278 PolarHBondContact O-N 3.05Å; L1276-T1278 VanDerWaalsContact O-N 3.08Å; T1278-I1283 WeakPolarHBondContact OG1-CD1 3.29Å
1279	S	36.1	Very low	46	Very low	57.4 Å²	57.4	92.3 Å²	92.3	40%	0.401	49%	0.488	S	S	.	.			trans	-74.3	35.9	-176.5	53.3	0	0	0	0	118.8	L1276 R1281	L1276-S1279 PolarHBondContact O-OG 3.47Å; S1279-R1281 VanDerWaalsContact C-N 3.3Å; S1279-R1281 PolarHBondContact O-N 3.37Å; S1279-R1281 VanDerWaalsContact O-O 3.12Å; S1279-R1281 PolarHBondContact OG-O 3.2Å
1280	Q	47.3	Very low	48.3	Very low	86.4 Å²	86.4	85.1 Å²	85.1	40%	0.404	45%	0.449	S	S	.	.	S	Bend	trans	-83.2	9.5	179.3	-74.5	174.5	-6.9	0	0	115.8	E658 T689	E658-Q1280 VanDerWaalsContact CD-CB 3.48Å; E658-Q1280 VanDerWaalsContact CD-O 3.31Å; E658-Q1280 HydrophobicContact CG-CB 3.56Å; E658-Q1280 HydrophobicContact CG-CG 3.64Å; E658-Q1280 WeakPolarHBondContact OE1-CA 3.36Å; E658-Q1280 WeakPolarHBondContact OE1-CB 3.4Å; E658-Q1280 WeakPolarHBondContact OE1-CG 3.48Å; T689-Q1280 HydrophobicContact CG2-CG 4.4Å; T689-Q1280 PolarHBondContact OG1-NE2 2.83Å; T689-Q1280 VanDerWaalsContact OG1-NE2 3.1Å
1281	R	51.7	Low	50.5	Low	60 Å²	60	80.7 Å²	80.7	23%	0.226	42%	0.417	C	S	.	.	S	Bend	trans	-112.7	142.3	176.8	-76.9	173.9	169.7	-131.3	9.6	110.9	Y1054 C1058 L1065 L1066 E1069 S1135 S1139 Y1243 S1279 I1283	Y1054-R1281 PolarHBondContact OH-NH1 3.49Å; C1058-R1281 PolarHBondContact SG-NH2 3.49Å; L1065-R1281 VanDerWaalsContact CG-NH1 3.27Å; L1066-R1281 HydrophobicContact CD1-CG 4.21Å; E1069-R1281 IonicContact OE1-CZ 3.79Å; E1069-R1281 IonicContact OE1-NE 3.95Å; E1069-R1281 PolarHBondContact OE1-NE 3.31Å; E1069-R1281 IonicContact OE1-NH1 2.9Å; E1069-R1281 PolarHBondContact OE1-NH1 3.2Å; E1069-R1281 VanDerWaalsContact OE1-NH1 3.12Å; E1069-R1281 IonicContact OE1-NH2 3.57Å; E1069-R1281 PolarHBondContact OE1-NH2 2.86Å; E1069-R1281 WeakPolarHBondContact OE2-CD 3.47Å; E1069-R1281 WeakPolarHBondContact OE2-CG 3.33Å; E1069-R1281 IonicContact OE2-CZ 2.93Å; E1069-R1281 IonicContact OE2-NE 3.45Å; E1069-R1281 PolarHBondContact OE2-NE 3.38Å; E1069-R1281 IonicContact OE2-NH1 3.16Å; E1069-R1281 PolarHBondContact OE2-NH1 2.81Å; E1069-R1281 IonicContact OE2-NH2 3.44Å; S1135-R1281 PolarHBondContact OG-NH2 2.62Å; S1139-R1281 PolarHBondContact O-NH1 3.22Å; Y1243-R1281 HydrophobicContact CD1-CB 4.19Å; Y1243-R1281 HydrophobicContact CD1-CG 4.2Å; Y1243-R1281 HydrophobicContact CD2-CB 4.2Å; Y1243-R1281 HydrophobicContact CD2-CG 3.78Å; Y1243-R1281 HydrophobicContact CE1-CB 3.76Å; Y1243-R1281 HydrophobicContact CE1-CG 4.25Å; Y1243-R1281 HydrophobicContact CE2-CB 3.75Å; Y1243-R1281 HydrophobicContact CE2-CG 3.82Å; Y1243-R1281 HydrophobicContact CG-CB 4.42Å; Y1243-R1281 HydrophobicContact CG-CG 4Å; S1279-R1281 VanDerWaalsContact C-N 3.3Å; S1279-R1281 PolarHBondContact O-N 3.37Å; S1279-R1281 VanDerWaalsContact O-O 3.12Å; S1279-R1281 PolarHBondContact OG-O 3.2Å; R1281-I1283 PolarHBondContact O-N 3.03Å
1282	P	52.7	Low	52.9	Low	28 Å²	28	73.7 Å²	73.7	18%	0.182	38%	0.382	C	S	.	.			trans	-63.2	127	174.8	26.5	-32.6	0	0	0	110.4	E1069 N1073 F1284	E1069-P1282 HydrophobicContact CB-CG 3.72Å; N1073-P1282 HydrophobicContact CB-CB 4.24Å; N1073-P1282 HydrophobicContact CB-CG 4.42Å; N1073-P1282 WeakPolarHBondContact ND2-CB 3.47Å; P1282-F1284 HydrophobicContact CB-CE1 4.19Å; P1282-F1284 HydrophobicContact CB-CE2 4.47Å; P1282-F1284 HydrophobicContact CB-CZ 4.11Å; P1282-F1284 HydrophobicContact CG-CE1 4.2Å; P1282-F1284 HydrophobicContact CG-CE2 4.06Å; P1282-F1284 HydrophobicContact CG-CZ 3.7Å; P1282-F1284 VanDerWaalsContact CG-CZ 3.44Å; P1282-F1284 PolarHBondContact O-N 3Å
1283	I	58	Low	54.9	Low	115.6 Å²	115.6	67.9 Å²	67.9	59%	0.593	35%	0.35	S	S	*	.			trans	-83	114.3	170.1	-58.8	170.7	0	0	0	106.9	T1278 R1281	T1278-I1283 WeakPolarHBondContact OG1-CD1 3.29Å; R1281-I1283 PolarHBondContact O-N 3.03Å
1284	F	63.9	Low	56.9	Low	19 Å²	19	60.7 Å²	60.7	8%	0.083	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-82.4	142.4	175.3	-60.6	-69.6	0	0	0	111	E1069 F1072 N1073 L1132 L1136 S1139 L1211 S1236 L1237 P1282	E1069-F1284 HydrophobicContact CB-CE2 4.18Å; E1069-F1284 HydrophobicContact CB-CZ 3.83Å; E1069-F1284 HydrophobicContact CG-CE2 3.95Å; E1069-F1284 HydrophobicContact CG-CZ 4.06Å; E1069-F1284 VanDerWaalsContact O-CZ 3.28Å; E1069-F1284 WeakPolarHBondContact O-CZ 3.27Å; F1072-F1284 HydrophobicContact CB-CE1 4.33Å; F1072-F1284 HydrophobicContact CB-CZ 4.36Å; F1072-F1284 AromaticContact CD1-CD1 3.8Å; F1072-F1284 HydrophobicContact CD1-CD1 3.8Å; F1072-F1284 AromaticContact CD1-CE1 3.57Å; F1072-F1284 HydrophobicContact CD1-CE1 3.57Å; F1072-F1284 VanDerWaalsContact CD1-CE1 3.49Å; F1072-F1284 HydrophobicContact CD1-CZ 4.34Å; F1072-F1284 HydrophobicContact CE1-CD1 4.19Å; F1072-F1284 HydrophobicContact CE1-CE1 4.36Å; F1072-F1284 HydrophobicContact CG-CE1 4.37Å; N1073-F1284 HydrophobicContact CB-CE1 4.22Å; N1073-F1284 VanDerWaalsContact OD1-CD1 3.22Å; N1073-F1284 WeakPolarHBondContact OD1-CD1 3.36Å; N1073-F1284 WeakPolarHBondContact OD1-CE1 3.12Å; L1132-F1284 HydrophobicContact CD1-CZ 4.47Å; L1136-F1284 HydrophobicContact CD2-CB 4.04Å; L1136-F1284 HydrophobicContact CD2-CD1 4.01Å; L1136-F1284 HydrophobicContact CD2-CD2 4.14Å; L1136-F1284 HydrophobicContact CD2-CE1 4.37Å; L1136-F1284 HydrophobicContact CD2-CG 3.78Å; S1139-F1284 WeakPolarHBondContact CB-O 3.43Å; L1211-F1284 HydrophobicContact CD1-CD1 3.81Å; L1211-F1284 HydrophobicContact CD1-CE1 3.59Å; S1236-F1284 VanDerWaalsContact O-CD2 3.31Å; S1236-F1284 WeakPolarHBondContact O-CD2 3.43Å; L1237-F1284 HydrophobicContact CD2-CB 4.33Å; L1237-F1284 HydrophobicContact CD2-CD1 4.48Å; L1237-F1284 HydrophobicContact CD2-CG 4.39Å; P1282-F1284 HydrophobicContact CB-CE1 4.19Å; P1282-F1284 HydrophobicContact CB-CE2 4.47Å; P1282-F1284 HydrophobicContact CB-CZ 4.11Å; P1282-F1284 HydrophobicContact CG-CE1 4.2Å; P1282-F1284 HydrophobicContact CG-CE2 4.06Å; P1282-F1284 HydrophobicContact CG-CZ 3.7Å; P1282-F1284 VanDerWaalsContact CG-CZ 3.44Å; P1282-F1284 PolarHBondContact O-N 3Å
1285	V	66.1	Low	58.5	Low	99.8 Å²	99.8	59.2 Å²	59.2	61%	0.605	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-61.7	145.5	161.7	-178	0	0	0	0	107.6	H1287 Q1376	V1285-H1287 PolarHBondContact O-CE1 3.33Å; V1285-H1287 VanDerWaalsContact O-CE1 3.26Å; V1285-H1287 PolarHBondContact O-N 3.05Å; V1285-H1287 VanDerWaalsContact O-N 3.12Å; V1285-H1287 PolarHBondContact O-ND1 3.07Å; V1285-Q1376 HydrophobicContact CB-CG 4.38Å; V1285-Q1376 HydrophobicContact CG1-CG 4Å
1286	K	68.6	Low	59.9	Low	126.6 Å²	126.6	52 Å²	52	55%	0.55	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-65.1	124.1	178	-158	177.5	174.1	-166.3	0	110.1	N1213 C1214	N1213-K1286 PolarHBondContact OD1-NZ 3.21Å; C1214-K1286 VanDerWaalsContact SG-CD 3.59Å; C1214-K1286 WeakPolarHBondContact SG-CE 3.41Å; C1214-K1286 VanDerWaalsContact SG-CG 3.52Å
1287	H	74.4	Confident	61.3	Low	11.4 Å²	11.4	48.4 Å²	48.4	5%	0.053	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	147.1	175.4	-67	69.2	0	0	0	110.7	F1072 L1136 L1237 V1285 I1289 Q1376 A1378 R1404	F1072-H1287 AromaticContact CE1-CE1 3.79Å; F1072-H1287 AromaticContact CE1-NE2 3.84Å; F1072-H1287 AromaticContact CZ-NE2 3.81Å; L1136-H1287 PolarHBondContact O-N 2.89Å; L1237-H1287 PolarHBondContact O-N 3.37Å; V1285-H1287 PolarHBondContact O-CE1 3.33Å; V1285-H1287 VanDerWaalsContact O-CE1 3.26Å; V1285-H1287 PolarHBondContact O-N 3.05Å; V1285-H1287 VanDerWaalsContact O-N 3.12Å; V1285-H1287 PolarHBondContact O-ND1 3.07Å; H1287-I1289 HydrophobicContact CB-CG1 4.12Å; H1287-I1289 PolarHBondContact O-N 3.43Å; H1287-Q1376 CarbonylContact C-O 3.55Å; H1287-Q1376 WeakPolarHBondContact CA-O 3.38Å; H1287-Q1376 HydrophobicContact CB-CB 4.49Å; H1287-Q1376 VanDerWaalsContact CD2-CB 3.46Å; H1287-Q1376 WeakPolarHBondContact CD2-CB 3.19Å; H1287-A1378 HydrophobicContact CB-CB 4.07Å; H1287-R1404 PolarHBondContact CE1-NH1 2.98Å; H1287-R1404 VanDerWaalsContact CE1-NH1 3.27Å; H1287-R1404 PolarHBondContact NE2-NH1 3.35Å
1288	Q	76.1	Confident	62	Low	48.2 Å²	48.2	45.5 Å²	45.5	23%	0.225	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	121.7	157.9	-64.6	-102.4	-3.4	0	0	107.7	Q1322 I1375 Q1376 F1377 A1378	Q1288-Q1322 VanDerWaalsContact OE1-CD 3.29Å; Q1288-I1375 HydrophobicContact CB-CG2 4.48Å; Q1288-I1375 HydrophobicContact CG-CG2 3.71Å; Q1288-Q1376 PolarHBondContact N-O 3.01Å; Q1288-F1377 HydrophobicContact CB-CD1 3.78Å; Q1288-F1377 HydrophobicContact CB-CE1 3.96Å; Q1288-F1377 HydrophobicContact CB-CG 4.48Å; Q1288-F1377 HydrophobicContact CG-CD1 4.42Å; Q1288-F1377 HydrophobicContact CG-CE1 4.19Å; Q1288-F1377 CarbonylContact O-C 3.57Å; Q1288-F1377 WeakPolarHBondContact O-CA 3.38Å; Q1288-F1377 VanDerWaalsContact OE1-CE1 3.28Å; Q1288-F1377 VanDerWaalsContact OE1-CZ 3.29Å; Q1288-A1378 PolarHBondContact O-N 3.31Å
1289	I	73.2	Confident	62.6	Low	15.2 Å²	15.2	44.7 Å²	44.7	8%	0.078	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	126.4	-169.7	-61.1	-179.8	0	0	0	110.1	T1133 L1136 I1137 I1215 L1216 L1217 T1234 L1237 I1238 H1287 I1291 A1378 L1380	T1133-I1289 HydrophobicContact CG2-CD1 4.17Å; T1133-I1289 HydrophobicContact CG2-CG2 4.2Å; T1133-I1289 WeakPolarHBondContact O-CD1 3.29Å; L1136-I1289 HydrophobicContact CB-CD1 3.48Å; L1136-I1289 VanDerWaalsContact CB-CD1 3.47Å; L1136-I1289 HydrophobicContact CB-CG1 4.45Å; L1136-I1289 HydrophobicContact CD1-CD1 4.23Å; L1136-I1289 HydrophobicContact CG-CD1 4.47Å; I1137-I1289 HydrophobicContact CD1-CD1 4.16Å; I1137-I1289 HydrophobicContact CG1-CD1 3.53Å; I1137-I1289 VanDerWaalsContact CG1-CD1 3.47Å; I1137-I1289 HydrophobicContact CG1-CG1 4.35Å; I1215-I1289 WeakPolarHBondContact CA-O 3.19Å; I1215-I1289 HydrophobicContact CG1-CB 4.4Å; I1215-I1289 PolarHBondContact O-N 3.19Å; L1216-I1289 HydrophobicContact CD1-CG2 4.28Å; L1216-I1289 PolarHBondContact N-O 3.18Å; L1217-I1289 PolarHBondContact N-O 2.85Å; T1234-I1289 HydrophobicContact CG2-CD1 4.38Å; L1237-I1289 HydrophobicContact CB-CD1 3.47Å; L1237-I1289 VanDerWaalsContact CB-CD1 3.47Å; L1237-I1289 HydrophobicContact CB-CG1 4.46Å; L1237-I1289 HydrophobicContact CD1-CD1 4.4Å; I1238-I1289 HydrophobicContact CD1-CD1 4.43Å; I1238-I1289 HydrophobicContact CG1-CD1 3.54Å; H1287-I1289 HydrophobicContact CB-CG1 4.12Å; H1287-I1289 PolarHBondContact O-N 3.43Å; I1289-I1291 HydrophobicContact CG2-CB 4.32Å; I1289-I1291 HydrophobicContact CG2-CD1 3.81Å; I1289-I1291 HydrophobicContact CG2-CG1 3.31Å; I1289-A1378 WeakPolarHBondContact CA-O 3.34Å; I1289-A1378 HydrophobicContact CG1-CB 4.38Å; I1289-L1380 HydrophobicContact CB-CD1 4.42Å; I1289-L1380 HydrophobicContact CD1-CD1 4.38Å; I1289-L1380 HydrophobicContact CG1-CD1 4.19Å; I1289-L1380 HydrophobicContact CG2-CD1 3.66Å; I1289-L1380 VanDerWaalsContact CG2-CD1 3.47Å; I1289-L1380 HydrophobicContact CG2-CD2 4.29Å
1290	L	77.1	Confident	63	Low	4.6 Å²	4.6	43.4 Å²	43.4	2%	0.024	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	119.5	166	-66.9	106.6	0	0	0	107.7	L1216 W1315 L1318 L1319 A1378 F1379 L1380	L1216-L1290 HydrophobicContact CB-CG 4.32Å; L1216-L1290 HydrophobicContact CD2-CD2 4.3Å; L1216-L1290 WeakPolarHBondContact O-CA 3.28Å; L1290-W1315 HydrophobicContact CD2-CB 4.24Å; L1290-W1315 HydrophobicContact CD2-CD2 4.48Å; L1290-W1315 HydrophobicContact CD2-CG 4.07Å; L1290-L1318 HydrophobicContact CD2-CB 4.09Å; L1290-L1318 HydrophobicContact CD2-CD1 4.21Å; L1290-L1319 HydrophobicContact CD1-CD2 4.12Å; L1290-L1319 HydrophobicContact CD1-CG 3.92Å; L1290-L1319 HydrophobicContact CD2-CD2 4.3Å; L1290-L1319 HydrophobicContact CD2-CG 4.18Å; L1290-A1378 PolarHBondContact N-O 2.98Å; L1290-F1379 HydrophobicContact CB-CD1 3.95Å; L1290-F1379 HydrophobicContact CB-CE1 4.26Å; L1290-F1379 HydrophobicContact CD1-CD1 4.13Å; L1290-F1379 HydrophobicContact CD1-CE1 3.7Å; L1290-F1379 VanDerWaalsContact CD1-CE1 3.41Å; L1290-F1379 HydrophobicContact CD1-CZ 4.05Å; L1290-F1379 HydrophobicContact CD2-CD1 4.42Å; L1290-F1379 HydrophobicContact CD2-CE1 4.05Å; L1290-F1379 HydrophobicContact CG-CD1 4.42Å; L1290-F1379 HydrophobicContact CG-CE1 4.28Å; L1290-F1379 CarbonylContact O-C 3.56Å; L1290-F1379 WeakPolarHBondContact O-CA 3.22Å; L1290-L1380 PolarHBondContact O-N 3.27Å
1291	I	75.8	Confident	62.7	Low	24 Å²	24	41.1 Å²	41.1	12%	0.123	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	138.9	-176.5	-164.1	167.4	0	0	0	110.4	F1048 V1053 L1129 T1133 L1216 L1217 I1218 L1230 T1234 I1289 F1293 L1380	F1048-I1291 HydrophobicContact CD1-CG2 4.36Å; F1048-I1291 HydrophobicContact CE1-CG2 3.64Å; V1053-I1291 HydrophobicContact CG2-CD1 4.38Å; L1129-I1291 HydrophobicContact CD2-CD1 3.43Å; L1129-I1291 VanDerWaalsContact CD2-CD1 3.46Å; L1129-I1291 HydrophobicContact CD2-CG1 3.99Å; T1133-I1291 HydrophobicContact CG2-CD1 4.12Å; T1133-I1291 VanDerWaalsContact OG1-CD1 3.31Å; T1133-I1291 WeakPolarHBondContact OG1-CD1 3.21Å; L1216-I1291 HydrophobicContact CD1-CG2 3.66Å; L1216-I1291 HydrophobicContact CG-CG2 4.38Å; L1216-I1291 PolarHBondContact O-N 2.71Å; L1216-I1291 VanDerWaalsContact O-N 3.12Å; L1217-I1291 HydrophobicContact CB-CG2 4.32Å; L1217-I1291 HydrophobicContact CD1-CG2 3.85Å; L1217-I1291 WeakPolarHBondContact O-CG2 3.41Å; L1217-I1291 PolarHBondContact O-N 2.6Å; I1218-I1291 HydrophobicContact CG1-CG2 3.91Å; L1230-I1291 HydrophobicContact CD2-CG2 4.13Å; T1234-I1291 HydrophobicContact CG2-CD1 3.43Å; T1234-I1291 VanDerWaalsContact CG2-CD1 3.43Å; I1289-I1291 HydrophobicContact CG2-CB 4.32Å; I1289-I1291 HydrophobicContact CG2-CD1 3.81Å; I1289-I1291 HydrophobicContact CG2-CG1 3.31Å; I1291-F1293 HydrophobicContact CB-CE2 4.32Å; I1291-F1293 HydrophobicContact CD1-CD2 4.46Å; I1291-F1293 HydrophobicContact CD1-CE1 4.33Å; I1291-F1293 HydrophobicContact CD1-CE2 3.56Å; I1291-F1293 VanDerWaalsContact CD1-CE2 3.48Å; I1291-F1293 HydrophobicContact CD1-CZ 3.44Å; I1291-F1293 VanDerWaalsContact CD1-CZ 3.47Å; I1291-F1293 HydrophobicContact CG1-CD2 4.31Å; I1291-F1293 HydrophobicContact CG1-CE2 3.75Å; I1291-F1293 HydrophobicContact CG1-CZ 4.02Å; I1291-F1293 HydrophobicContact CG2-CD2 4.08Å; I1291-F1293 HydrophobicContact CG2-CE1 4.49Å; I1291-F1293 HydrophobicContact CG2-CE2 3.94Å; I1291-F1293 VanDerWaalsContact CG2-CE2 3.44Å; I1291-F1293 HydrophobicContact CG2-CZ 3.67Å; I1291-L1380 CarbonylContact C-O 3.56Å; I1291-L1380 VanDerWaalsContact CA-O 3.3Å; I1291-L1380 WeakPolarHBondContact CA-O 3.32Å; I1291-L1380 HydrophobicContact CB-CB 4.28Å; I1291-L1380 HydrophobicContact CD1-CB 4.39Å; I1291-L1380 HydrophobicContact CD1-CD2 4.23Å; I1291-L1380 HydrophobicContact CG1-CB 4.09Å; I1291-L1380 HydrophobicContact CG1-CD1 4.43Å; I1291-L1380 HydrophobicContact CG2-CB 4.13Å
1292	H	76.9	Confident	62.7	Low	16.8 Å²	16.8	40.4 Å²	40.4	8%	0.078	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	134.1	175	-169.3	65.3	0	0	0	111.5	V1219 N1305 I1311 W1315 L1380 I1381 D1382	V1219-H1292 PolarHBondContact O-CE1 3.12Å; V1219-H1292 PolarHBondContact O-ND1 2.98Å; H1292-N1305 PolarHBondContact CE1-O 2.89Å; H1292-N1305 PolarHBondContact NE2-O 3.23Å; H1292-I1311 HydrophobicContact CB-CG2 4.48Å; H1292-I1311 VanDerWaalsContact CD2-CD1 3.46Å; H1292-I1311 WeakPolarHBondContact CD2-CD1 3.38Å; H1292-I1311 VanDerWaalsContact NE2-CD1 3.28Å; H1292-I1311 WeakPolarHBondContact NE2-CD1 3.36Å; H1292-I1311 WeakPolarHBondContact NE2-CG1 3.38Å; H1292-W1315 HydrophobicContact CB-CZ2 4.08Å; H1292-L1380 PolarHBondContact N-O 3.15Å; H1292-I1381 HydrophobicContact CB-CG1 4.49Å; H1292-I1381 WeakPolarHBondContact O-CA 3.25Å; H1292-D1382 PolarHBondContact O-N 3.16Å
1293	F	72.3	Confident	62.6	Low	9.4 Å²	9.4	42.4 Å²	42.4	4%	0.041	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	103.2	175.7	-65.3	-84.7	0	0	0	109.6	F1048 L1049 V1053 T1126 L1129 L1217 I1218 T1227 L1230 I1291 N1295 G1296 L1297 L1302 D1382	F1048-F1293 HydrophobicContact CE1-CE2 4.29Å; F1048-F1293 HydrophobicContact CZ-CD2 4.17Å; F1048-F1293 HydrophobicContact CZ-CE2 4.06Å; L1049-F1293 HydrophobicContact CD2-CE2 4.09Å; L1049-F1293 HydrophobicContact CD2-CZ 3.9Å; V1053-F1293 HydrophobicContact CG2-CE2 4.18Å; V1053-F1293 HydrophobicContact CG2-CZ 4.04Å; T1126-F1293 HydrophobicContact CG2-CD1 4.04Å; T1126-F1293 HydrophobicContact CG2-CE1 3.82Å; L1129-F1293 HydrophobicContact CD2-CE1 3.9Å; L1129-F1293 HydrophobicContact CD2-CZ 4.12Å; L1217-F1293 HydrophobicContact CD1-CD2 4.39Å; L1217-F1293 HydrophobicContact CD1-CE2 4.24Å; I1218-F1293 HydrophobicContact CG2-CD2 3.9Å; I1218-F1293 HydrophobicContact CG2-CE2 4.18Å; T1227-F1293 HydrophobicContact CG2-CD1 4.36Å; T1227-F1293 HydrophobicContact CG2-CE1 4.07Å; L1230-F1293 HydrophobicContact CD2-CE1 3.91Å; L1230-F1293 HydrophobicContact CD2-CZ 4.03Å; I1291-F1293 HydrophobicContact CB-CE2 4.32Å; I1291-F1293 HydrophobicContact CD1-CD2 4.46Å; I1291-F1293 HydrophobicContact CD1-CE1 4.33Å; I1291-F1293 HydrophobicContact CD1-CE2 3.56Å; I1291-F1293 VanDerWaalsContact CD1-CE2 3.48Å; I1291-F1293 HydrophobicContact CD1-CZ 3.44Å; I1291-F1293 VanDerWaalsContact CD1-CZ 3.47Å; I1291-F1293 HydrophobicContact CG1-CD2 4.31Å; I1291-F1293 HydrophobicContact CG1-CE2 3.75Å; I1291-F1293 HydrophobicContact CG1-CZ 4.02Å; I1291-F1293 HydrophobicContact CG2-CD2 4.08Å; I1291-F1293 HydrophobicContact CG2-CE1 4.49Å; I1291-F1293 HydrophobicContact CG2-CE2 3.94Å; I1291-F1293 VanDerWaalsContact CG2-CE2 3.44Å; I1291-F1293 HydrophobicContact CG2-CZ 3.67Å; F1293-N1295 VanDerWaalsContact C-N 3.3Å; F1293-N1295 PolarHBondContact O-N 3.3Å; F1293-G1296 PolarHBondContact O-N 2.87Å; F1293-L1297 HydrophobicContact CB-CG 4.4Å; F1293-L1297 HydrophobicContact CD1-CD1 4.27Å; F1293-L1297 HydrophobicContact CD1-CD2 4.1Å; F1293-L1297 HydrophobicContact CD1-CG 4.06Å; F1293-L1297 HydrophobicContact CD2-CD1 3.81Å; F1293-L1297 HydrophobicContact CD2-CG 4Å; F1293-L1297 HydrophobicContact CE1-CD1 4.16Å; F1293-L1297 HydrophobicContact CE1-CD2 4.13Å; F1293-L1297 HydrophobicContact CE1-CG 4.19Å; F1293-L1297 HydrophobicContact CE2-CD1 3.61Å; F1293-L1297 VanDerWaalsContact CE2-CD1 3.44Å; F1293-L1297 HydrophobicContact CE2-CG 4.2Å; F1293-L1297 HydrophobicContact CG-CD1 4.17Å; F1293-L1297 HydrophobicContact CG-CD2 4.42Å; F1293-L1297 HydrophobicContact CG-CG 3.97Å; F1293-L1297 HydrophobicContact CZ-CD1 3.79Å; F1293-L1297 HydrophobicContact CZ-CD2 4.15Å; F1293-L1297 HydrophobicContact CZ-CG 4.29Å; F1293-L1302 HydrophobicContact CB-CD2 4.27Å; F1293-L1302 HydrophobicContact CD2-CD1 4.4Å; F1293-L1302 HydrophobicContact CD2-CD2 4.15Å; F1293-L1302 HydrophobicContact CG-CD2 4.43Å; F1293-D1382 HydrophobicContact CD1-CB 3.62Å; F1293-D1382 HydrophobicContact CE1-CB 4.21Å; F1293-D1382 HydrophobicContact CG-CB 4.43Å
1294	C	72.2	Confident	62.8	Low	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-36.5	-174.1	-66.9	0	0	0	0	113.3	G1296 S1304 N1305 K1306 I1381 D1382 D1383 R1386 L1387	C1294-G1296 VanDerWaalsContact C-N 3.31Å; C1294-S1304 WeakPolarHBondContact O-CA 3.39Å; C1294-S1304 WeakPolarHBondContact O-CB 3.39Å; C1294-N1305 WeakPolarHBondContact CA-O 3.25Å; C1294-N1305 CarbonylContact O-C 3.6Å; C1294-N1305 PolarHBondContact O-N 3.04Å; C1294-N1305 VanDerWaalsContact O-N 3.16Å; C1294-K1306 VanDerWaalsContact O-CG 3.31Å; C1294-K1306 WeakPolarHBondContact O-CG 3.43Å; C1294-I1381 VanDerWaalsContact SG-CG2 3.53Å; C1294-D1382 VanDerWaalsContact CB-O 3.22Å; C1294-D1382 WeakPolarHBondContact CB-O 3.41Å; C1294-D1382 PolarHBondContact N-O 2.98Å; C1294-D1382 VanDerWaalsContact N-O 3.14Å; C1294-D1382 PolarHBondContact SG-O 3.27Å; C1294-D1382 VanDerWaalsContact SG-O 3.36Å; C1294-D1383 HydrophobicContact CB-CB 4.4Å; C1294-D1383 WeakPolarHBondContact CB-O 3.19Å; C1294-D1383 PolarHBondContact SG-O 3.04Å; C1294-D1383 VanDerWaalsContact SG-O 3.37Å; C1294-R1386 HydrophobicContact CB-CB 4.21Å; C1294-L1387 VanDerWaalsContact SG-CD2 3.55Å
1295	N	64	Low	62.9	Low	61.8 Å²	61.8	39.6 Å²	39.6	33%	0.33	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	3.2	177.6	-72.1	-34.6	0	0	0	113.5	F1293 S1304 K1306 D1383	F1293-N1295 VanDerWaalsContact C-N 3.3Å; F1293-N1295 PolarHBondContact O-N 3.3Å; N1295-S1304 WeakPolarHBondContact O-CB 2.98Å; N1295-K1306 VanDerWaalsContact OD1-CE 3.22Å; N1295-K1306 WeakPolarHBondContact OD1-CE 3.31Å; N1295-D1383 PolarHBondContact ND2-OD2 3.24Å
1296	G	59.7	Low	63.3	Low	10.8 Å²	10.8	37.7 Å²	37.7	11%	0.111	21%	0.212	C	C	.	.			trans	72.2	-172.8	-172.1	0	0	0	0	0	113	F1293 C1294 L1302 P1303	F1293-G1296 PolarHBondContact O-N 2.87Å; C1294-G1296 VanDerWaalsContact C-N 3.31Å; G1296-L1302 CarbonylContact C-O 3.55Å; G1296-L1302 VanDerWaalsContact CA-O 3.26Å; G1296-L1302 WeakPolarHBondContact CA-O 3.29Å; G1296-P1303 WeakPolarHBondContact CA-O 3.35Å
1297	L	56.6	Low	63.6	Low	21.2 Å²	21.2	35.5 Å²	35.5	11%	0.111	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-130.6	98.1	173.9	-76.6	172.6	0	0	0	107.7	L1049 Y1052 A1056 T1126 T1227 F1293 I1299 T1300 G1301 L1302	L1049-L1297 HydrophobicContact CD2-CD1 4.23Å; Y1052-L1297 HydrophobicContact CD1-CD2 4.49Å; Y1052-L1297 HydrophobicContact CD2-CD2 4.39Å; Y1052-L1297 HydrophobicContact CE1-CD2 4.07Å; Y1052-L1297 HydrophobicContact CE2-CD2 3.96Å; A1056-L1297 HydrophobicContact CB-CD2 4.39Å; T1126-L1297 HydrophobicContact CG2-CD2 3.85Å; T1227-L1297 HydrophobicContact CG2-CD2 4.13Å; F1293-L1297 HydrophobicContact CB-CG 4.4Å; F1293-L1297 HydrophobicContact CD1-CD1 4.27Å; F1293-L1297 HydrophobicContact CD1-CD2 4.1Å; F1293-L1297 HydrophobicContact CD1-CG 4.06Å; F1293-L1297 HydrophobicContact CD2-CD1 3.81Å; F1293-L1297 HydrophobicContact CD2-CG 4Å; F1293-L1297 HydrophobicContact CE1-CD1 4.16Å; F1293-L1297 HydrophobicContact CE1-CD2 4.13Å; F1293-L1297 HydrophobicContact CE1-CG 4.19Å; F1293-L1297 HydrophobicContact CE2-CD1 3.61Å; F1293-L1297 VanDerWaalsContact CE2-CD1 3.44Å; F1293-L1297 HydrophobicContact CE2-CG 4.2Å; F1293-L1297 HydrophobicContact CG-CD1 4.17Å; F1293-L1297 HydrophobicContact CG-CD2 4.42Å; F1293-L1297 HydrophobicContact CG-CG 3.97Å; F1293-L1297 HydrophobicContact CZ-CD1 3.79Å; F1293-L1297 HydrophobicContact CZ-CD2 4.15Å; F1293-L1297 HydrophobicContact CZ-CG 4.29Å; L1297-I1299 VanDerWaalsContact C-N 3.3Å; L1297-I1299 PolarHBondContact O-N 3.26Å; L1297-I1299 VanDerWaalsContact O-N 3.1Å; L1297-T1300 HydrophobicContact CB-CG2 4.31Å; L1297-T1300 VanDerWaalsContact CB-OG1 3.25Å; L1297-T1300 WeakPolarHBondContact CB-OG1 3.24Å; L1297-T1300 CarbonylContact O-C 3.58Å; L1297-T1300 WeakPolarHBondContact O-CA 3.4Å; L1297-T1300 PolarHBondContact O-N 3.14Å; L1297-T1300 VanDerWaalsContact O-N 3.08Å; L1297-T1300 PolarHBondContact O-OG1 3.34Å; L1297-T1300 VanDerWaalsContact O-OG1 3.09Å; L1297-G1301 PolarHBondContact O-N 3.01Å; L1297-G1301 VanDerWaalsContact O-N 3.09Å; L1297-L1302 HydrophobicContact CB-CB 4.05Å; L1297-L1302 HydrophobicContact CB-CD1 4.39Å; L1297-L1302 HydrophobicContact CD1-CD1 4.19Å; L1297-L1302 HydrophobicContact CD1-CD2 4.35Å; L1297-L1302 HydrophobicContact CG-CD2 4.49Å; L1297-L1302 PolarHBondContact N-O 3.17Å; L1297-L1302 VanDerWaalsContact N-O 3.08Å; L1297-L1302 PolarHBondContact O-N 3.12Å; L1297-L1302 VanDerWaalsContact O-N 3.13Å
1298	S	46.6	Very low	64	Low	43.2 Å²	43.2	35.1 Å²	35.1	30%	0.302	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-34	-176.2	45.5	0	0	0	0	113.7	T1227 T1300 G1301 S1627 G1628 D1631 S1668	T1227-S1298 WeakPolarHBondContact CB-OG 3.2Å; T1227-S1298 PolarHBondContact OG1-OG 2.75Å; S1298-T1300 VanDerWaalsContact C-N 3.29Å; S1298-T1300 PolarHBondContact O-N 3.34Å; S1298-G1301 PolarHBondContact O-N 3.09Å; S1298-G1301 VanDerWaalsContact O-N 3.12Å; S1298-S1627 WeakPolarHBondContact CB-OG 3.17Å; S1298-S1627 VanDerWaalsContact OG-CB 3.27Å; S1298-S1627 WeakPolarHBondContact OG-CB 3.35Å; S1298-S1627 PolarHBondContact OG-OG 3.48Å; S1298-G1628 PolarHBondContact O-N 3.44Å; S1298-D1631 WeakPolarHBondContact CA-OD2 3.44Å; S1298-D1631 VanDerWaalsContact CB-CG 3.47Å; S1298-D1631 WeakPolarHBondContact CB-OD1 3.46Å; S1298-D1631 WeakPolarHBondContact CB-OD2 2.87Å; S1298-D1631 WeakPolarHBondContact O-CB 3.39Å; S1298-D1631 VanDerWaalsContact O-OD1 3.04Å; S1298-D1631 PolarHBondContact OG-OD2 3.49Å; S1298-S1668 VanDerWaalsContact CB-OG 3.28Å; S1298-S1668 WeakPolarHBondContact CB-OG 3.29Å
1299	I	45.3	Very low	64.2	Low	79 Å²	79	35 Å²	35	41%	0.405	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-26.1	176.8	-70.1	167.7	0	0	0	112.6	F1048 Y1052 T1227 S1231 L1297 D1631	F1048-I1299 HydrophobicContact CD2-CG2 3.71Å; F1048-I1299 HydrophobicContact CE1-CB 4.3Å; F1048-I1299 HydrophobicContact CE1-CG2 4.23Å; F1048-I1299 HydrophobicContact CE2-CB 4.03Å; F1048-I1299 HydrophobicContact CE2-CD1 4.08Å; F1048-I1299 HydrophobicContact CE2-CG2 3.21Å; F1048-I1299 HydrophobicContact CG-CG2 4.42Å; F1048-I1299 HydrophobicContact CZ-CB 3.77Å; F1048-I1299 HydrophobicContact CZ-CD1 3.59Å; F1048-I1299 HydrophobicContact CZ-CG1 4.25Å; F1048-I1299 HydrophobicContact CZ-CG2 3.51Å; Y1052-I1299 HydrophobicContact CD2-CB 4.04Å; Y1052-I1299 HydrophobicContact CD2-CD1 3.89Å; Y1052-I1299 HydrophobicContact CD2-CG1 4.5Å; Y1052-I1299 HydrophobicContact CD2-CG2 4.24Å; Y1052-I1299 HydrophobicContact CE2-CD1 3.95Å; T1227-I1299 WeakPolarHBondContact O-CD1 3.29Å; T1227-I1299 WeakPolarHBondContact O-CG1 3.49Å; S1231-I1299 WeakPolarHBondContact OG-CG2 3.46Å; L1297-I1299 VanDerWaalsContact C-N 3.3Å; L1297-I1299 PolarHBondContact O-N 3.26Å; L1297-I1299 VanDerWaalsContact O-N 3.1Å; I1299-D1631 HydrophobicContact CB-CB 4.48Å; I1299-D1631 HydrophobicContact CG1-CB 3.86Å; I1299-D1631 WeakPolarHBondContact CG1-OD1 3.4Å; I1299-D1631 WeakPolarHBondContact CG1-OD2 3.23Å; I1299-D1631 PolarHBondContact N-OD1 3.04Å
1300	T	43.9	Very low	64.3	Low	30.2 Å²	30.2	37.1 Å²	37.1	19%	0.185	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-0.6	-173.1	64	0	0	0	0	112.9	T1045 F1048 Y1052 L1297 S1298 L1302	T1045-T1300 HydrophobicContact CG2-CG2 3.68Å; F1048-T1300 HydrophobicContact CB-CG2 4.11Å; F1048-T1300 HydrophobicContact CD1-CG2 3.86Å; F1048-T1300 VanDerWaalsContact CD1-CG2 3.43Å; F1048-T1300 HydrophobicContact CE1-CG2 4.03Å; F1048-T1300 HydrophobicContact CG-CG2 3.82Å; Y1052-T1300 HydrophobicContact CD1-CG2 3.74Å; Y1052-T1300 WeakPolarHBondContact CD1-OG1 3.14Å; Y1052-T1300 HydrophobicContact CE1-CG2 3.94Å; Y1052-T1300 WeakPolarHBondContact CE1-O 3.33Å; Y1052-T1300 HydrophobicContact CG-CG2 3.64Å; L1297-T1300 HydrophobicContact CB-CG2 4.31Å; L1297-T1300 VanDerWaalsContact CB-OG1 3.25Å; L1297-T1300 WeakPolarHBondContact CB-OG1 3.24Å; L1297-T1300 CarbonylContact O-C 3.58Å; L1297-T1300 WeakPolarHBondContact O-CA 3.4Å; L1297-T1300 PolarHBondContact O-N 3.14Å; L1297-T1300 VanDerWaalsContact O-N 3.08Å; L1297-T1300 PolarHBondContact O-OG1 3.34Å; L1297-T1300 VanDerWaalsContact O-OG1 3.09Å; S1298-T1300 VanDerWaalsContact C-N 3.29Å; S1298-T1300 PolarHBondContact O-N 3.34Å; T1300-L1302 VanDerWaalsContact C-N 3.29Å; T1300-L1302 PolarHBondContact O-N 3.25Å; T1300-L1302 WeakPolarHBondContact OG1-CB 3.3Å; T1300-L1302 PolarHBondContact OG1-N 3.45Å
1301	G	42.6	Very low	64.4	Low	37.8 Å²	37.8	37 Å²	37	39%	0.39	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	13.1	-175.2	0	0	0	0	0	114.4	L1297 S1298 P1303 G1663	L1297-G1301 PolarHBondContact O-N 3.01Å; L1297-G1301 VanDerWaalsContact O-N 3.09Å; S1298-G1301 PolarHBondContact O-N 3.09Å; S1298-G1301 VanDerWaalsContact O-N 3.12Å; G1301-P1303 VanDerWaalsContact O-CD 3.25Å; G1301-P1303 WeakPolarHBondContact O-CD 3.2Å; G1301-P1303 VanDerWaalsContact O-N 3.09Å; G1301-G1663 WeakPolarHBondContact CA-O 3.42Å; G1301-G1663 WeakPolarHBondContact O-CA 3.43Å
1302	L	50.4	Low	64.9	Low	45.6 Å²	45.6	35.9 Å²	35.9	24%	0.239	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-70	117.6	178.8	-130.4	128.8	0	0	0	109.4	F1048 Y1052 L1217 I1218 V1219 F1293 G1296 L1297 T1300	F1048-L1302 HydrophobicContact CD2-CD1 4.34Å; F1048-L1302 HydrophobicContact CE1-CD1 4.49Å; F1048-L1302 HydrophobicContact CE2-CD1 3.5Å; F1048-L1302 VanDerWaalsContact CE2-CD1 3.42Å; F1048-L1302 HydrophobicContact CE2-CD2 3.68Å; F1048-L1302 HydrophobicContact CE2-CG 4.28Å; F1048-L1302 HydrophobicContact CZ-CD1 3.22Å; F1048-L1302 HydrophobicContact CZ-CD2 3.79Å; Y1052-L1302 HydrophobicContact CD1-CB 3.96Å; Y1052-L1302 HydrophobicContact CD1-CD1 4.17Å; Y1052-L1302 HydrophobicContact CE1-CB 4.3Å; Y1052-L1302 HydrophobicContact CE1-CD1 4.24Å; L1217-L1302 HydrophobicContact CD2-CD1 4.47Å; I1218-L1302 HydrophobicContact CB-CD1 3.74Å; I1218-L1302 HydrophobicContact CB-CD2 4.48Å; I1218-L1302 HydrophobicContact CD1-CD1 4.48Å; I1218-L1302 HydrophobicContact CG2-CD1 3.27Å; I1218-L1302 HydrophobicContact CG2-CD2 3.3Å; I1218-L1302 HydrophobicContact CG2-CG 3.85Å; V1219-L1302 HydrophobicContact CG1-CD1 4.36Å; V1219-L1302 HydrophobicContact CG1-CD2 3.89Å; V1219-L1302 HydrophobicContact CG1-CG 3.68Å; V1219-L1302 HydrophobicContact CG2-CD1 4.16Å; V1219-L1302 HydrophobicContact CG2-CD2 4.35Å; V1219-L1302 HydrophobicContact CG2-CG 4.29Å; F1293-L1302 HydrophobicContact CB-CD2 4.27Å; F1293-L1302 HydrophobicContact CD2-CD1 4.4Å; F1293-L1302 HydrophobicContact CD2-CD2 4.15Å; F1293-L1302 HydrophobicContact CG-CD2 4.43Å; G1296-L1302 CarbonylContact C-O 3.55Å; G1296-L1302 VanDerWaalsContact CA-O 3.26Å; G1296-L1302 WeakPolarHBondContact CA-O 3.29Å; L1297-L1302 HydrophobicContact CB-CB 4.05Å; L1297-L1302 HydrophobicContact CB-CD1 4.39Å; L1297-L1302 HydrophobicContact CD1-CD1 4.19Å; L1297-L1302 HydrophobicContact CD1-CD2 4.35Å; L1297-L1302 HydrophobicContact CG-CD2 4.49Å; L1297-L1302 PolarHBondContact N-O 3.17Å; L1297-L1302 VanDerWaalsContact N-O 3.08Å; L1297-L1302 PolarHBondContact O-N 3.12Å; L1297-L1302 VanDerWaalsContact O-N 3.13Å; T1300-L1302 VanDerWaalsContact C-N 3.29Å; T1300-L1302 PolarHBondContact O-N 3.25Å; T1300-L1302 WeakPolarHBondContact OG1-CB 3.3Å; T1300-L1302 PolarHBondContact OG1-N 3.45Å
1303	P	51.2	Low	65	Low	69.8 Å²	69.8	38.1 Å²	38.1	45%	0.453	22%	0.215	S	C	.	.			trans	-70.7	150.9	-174.9	28.5	-35	0	0	0	111.4	V1219 G1220 S1221 G1296 G1301 N1305	V1219-P1303 HydrophobicContact CG1-CG 4.21Å; G1220-P1303 WeakPolarHBondContact O-CG 3.47Å; S1221-P1303 WeakPolarHBondContact O-CB 3.43Å; S1221-P1303 VanDerWaalsContact O-CG 3.23Å; S1221-P1303 WeakPolarHBondContact O-CG 3.16Å; G1296-P1303 WeakPolarHBondContact CA-O 3.35Å; G1301-P1303 VanDerWaalsContact O-CD 3.25Å; G1301-P1303 WeakPolarHBondContact O-CD 3.2Å; G1301-P1303 VanDerWaalsContact O-N 3.09Å; P1303-N1305 PolarHBondContact O-N 3.02Å
1304	S	61.4	Low	65.1	Low	51.8 Å²	51.8	40.3 Å²	40.3	36%	0.362	23%	0.227	S	C	.	.			trans	-70.2	122.4	174.4	65.9	0	0	0	0	110.6	S1221 C1294 N1295 K1306	S1221-S1304 PolarHBondContact OG-O 3Å; C1294-S1304 WeakPolarHBondContact O-CA 3.39Å; C1294-S1304 WeakPolarHBondContact O-CB 3.39Å; N1295-S1304 WeakPolarHBondContact O-CB 2.98Å; S1304-K1306 PolarHBondContact OG-NZ 3.1Å
1305	N	66.7	Low	65.6	Low	23.6 Å²	23.6	40.5 Å²	40.5	13%	0.126	23%	0.228	C	C	.	.			trans	-122.4	116.3	166.9	-169.8	-15	0	0	0	109.7	H1292 C1294 P1303 K1307 E1310	H1292-N1305 PolarHBondContact CE1-O 2.89Å; H1292-N1305 PolarHBondContact NE2-O 3.23Å; C1294-N1305 WeakPolarHBondContact CA-O 3.25Å; C1294-N1305 CarbonylContact O-C 3.6Å; C1294-N1305 PolarHBondContact O-N 3.04Å; C1294-N1305 VanDerWaalsContact O-N 3.16Å; P1303-N1305 PolarHBondContact O-N 3.02Å; N1305-K1307 PolarHBondContact OD1-N 3.11Å; N1305-K1307 VanDerWaalsContact OD1-N 3.11Å; N1305-E1310 WeakPolarHBondContact ND2-CB 3.17Å; N1305-E1310 PolarHBondContact ND2-OE2 2.86Å; N1305-E1310 PolarHBondContact OD1-OE2 3.1Å
1306	K	74.1	Confident	66.5	Low	60.6 Å²	60.6	37.5 Å²	37.5	26%	0.263	21%	0.212	S	C	.	.			trans	-105.7	-14.2	-178.4	-63.7	176.2	-172.2	151.8	0	112.7	C1294 N1295 S1304 L1308 R1386 L1387 E1388	C1294-K1306 VanDerWaalsContact O-CG 3.31Å; C1294-K1306 WeakPolarHBondContact O-CG 3.43Å; N1295-K1306 VanDerWaalsContact OD1-CE 3.22Å; N1295-K1306 WeakPolarHBondContact OD1-CE 3.31Å; S1304-K1306 PolarHBondContact OG-NZ 3.1Å; K1306-L1308 PolarHBondContact O-N 3.23Å; K1306-R1386 WeakPolarHBondContact CB-O 3.36Å; K1306-R1386 HydrophobicContact CD-CB 4.49Å; K1306-R1386 WeakPolarHBondContact CG-O 3.36Å; K1306-L1387 CarbonylContact O-C 3.46Å; K1306-L1387 WeakPolarHBondContact O-CA 3.32Å; K1306-E1388 HydrophobicContact CB-CB 4.4Å; K1306-E1388 HydrophobicContact CB-CG 4.33Å; K1306-E1388 WeakPolarHBondContact CD-OE1 3.41Å; K1306-E1388 PolarHBondContact O-N 3.05Å
1307	K	76	Confident	67.3	Low	80.8 Å²	80.8	39 Å²	39	35%	0.351	22%	0.218	S	C	.	.	B	Isolated β-bridge	trans	-74.6	113.3	-173.2	-71	179.5	178.3	177.6	0	109.9	N1305 N1309 E1310 I1311 E1388	N1305-K1307 PolarHBondContact OD1-N 3.11Å; N1305-K1307 VanDerWaalsContact OD1-N 3.11Å; K1307-N1309 VanDerWaalsContact C-N 3.29Å; K1307-N1309 WeakPolarHBondContact CB-OD1 3.16Å; K1307-N1309 PolarHBondContact O-N 3.04Å; K1307-N1309 VanDerWaalsContact O-N 3.16Å; K1307-E1310 HydrophobicContact CB-CB 4.26Å; K1307-E1310 HydrophobicContact CB-CG 4.12Å; K1307-E1310 VanDerWaalsContact CD-CD 3.42Å; K1307-E1310 HydrophobicContact CD-CG 4.2Å; K1307-E1310 VanDerWaalsContact CD-OE1 3.32Å; K1307-E1310 WeakPolarHBondContact CD-OE1 3.36Å; K1307-E1310 WeakPolarHBondContact CE-OE1 3.15Å; K1307-E1310 IonicContact NZ-OE1 3.21Å; K1307-E1310 PolarHBondContact NZ-OE1 3.28Å; K1307-E1310 PolarHBondContact O-N 3.27Å; K1307-E1310 VanDerWaalsContact O-N 3.16Å; K1307-I1311 WeakPolarHBondContact O-CD1 3.38Å; K1307-I1311 VanDerWaalsContact O-CG1 3.3Å; K1307-I1311 WeakPolarHBondContact O-CG1 3.39Å; K1307-I1311 PolarHBondContact O-N 3.12Å; K1307-I1311 VanDerWaalsContact O-N 3.11Å; K1307-E1388 WeakPolarHBondContact CA-O 3.26Å
1308	L	82	Confident	68.1	Low	2 Å²	2	40 Å²	40	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-57.7	-36.2	-179.9	179.7	61.7	0	0	0	112	K1306 I1311 L1312 L1355 L1387 E1388 T1391 W1394	K1306-L1308 PolarHBondContact O-N 3.23Å; L1308-I1311 PolarHBondContact O-N 3.09Å; L1308-L1312 HydrophobicContact CD1-CD1 4.14Å; L1308-L1312 HydrophobicContact CD1-CD2 4.42Å; L1308-L1312 HydrophobicContact CD1-CG 3.98Å; L1308-L1312 HydrophobicContact CG-CD1 3.99Å; L1308-L1312 HydrophobicContact CG-CG 4.26Å; L1308-L1312 WeakPolarHBondContact O-CB 3.31Å; L1308-L1312 VanDerWaalsContact O-CG 3.3Å; L1308-L1312 WeakPolarHBondContact O-CG 3.3Å; L1308-L1312 PolarHBondContact O-N 3.15Å; L1308-L1355 HydrophobicContact CB-CD1 4.27Å; L1308-L1355 HydrophobicContact CD2-CD1 4.06Å; L1308-L1355 HydrophobicContact CD2-CD2 4.36Å; L1308-L1355 HydrophobicContact CG-CD1 4.06Å; L1308-L1387 HydrophobicContact CD1-CD1 4.39Å; L1308-E1388 WeakPolarHBondContact CB-O 3.34Å; L1308-E1388 PolarHBondContact N-O 3.13Å; L1308-T1391 HydrophobicContact CD2-CG2 3.67Å; L1308-W1394 HydrophobicContact CD1-CB 4.4Å; L1308-W1394 HydrophobicContact CD1-CD2 4.13Å; L1308-W1394 HydrophobicContact CD1-CG 3.9Å; L1308-W1394 HydrophobicContact CD2-CB 4.19Å; L1308-W1394 VanDerWaalsContact CD2-CD1 3.44Å; L1308-W1394 HydrophobicContact CD2-CG 3.95Å; L1308-W1394 HydrophobicContact CG-CG 4.42Å
1309	N	79.1	Confident	69.7	Low	47.6 Å²	47.6	38 Å²	38	26%	0.255	21%	0.209	S	C	.	.	H	α-helix	trans	-58.2	-51.8	177.7	179.7	-9.9	0	0	0	112	K1307 I1311 L1312 Q1313 I1353 L1355 Y1358	K1307-N1309 VanDerWaalsContact C-N 3.29Å; K1307-N1309 WeakPolarHBondContact CB-OD1 3.16Å; K1307-N1309 PolarHBondContact O-N 3.04Å; K1307-N1309 VanDerWaalsContact O-N 3.16Å; N1309-I1311 VanDerWaalsContact C-N 3.32Å; N1309-I1311 PolarHBondContact O-N 3.3Å; N1309-L1312 PolarHBondContact O-N 3.29Å; N1309-Q1313 WeakPolarHBondContact O-CB 3.37Å; N1309-Q1313 PolarHBondContact O-N 3.26Å; N1309-I1353 PolarHBondContact ND2-O 3.23Å; N1309-L1355 HydrophobicContact CB-CD1 4.22Å; N1309-Y1358 HydrophobicContact CB-CD2 4.37Å; N1309-Y1358 WeakPolarHBondContact OD1-CD2 3.37Å; N1309-Y1358 WeakPolarHBondContact OD1-CE2 3.38Å
1310	E	76.1	Confident	71.4	Confident	59.2 Å²	59.2	35.2 Å²	35.2	28%	0.277	19%	0.194	S	C	.	.	H	α-helix	trans	-65.2	-36.9	179.4	-65.9	178.1	-167.3	0	0	111.7	N1305 K1307 Q1313 N1314	N1305-E1310 WeakPolarHBondContact ND2-CB 3.17Å; N1305-E1310 PolarHBondContact ND2-OE2 2.86Å; N1305-E1310 PolarHBondContact OD1-OE2 3.1Å; K1307-E1310 HydrophobicContact CB-CB 4.26Å; K1307-E1310 HydrophobicContact CB-CG 4.12Å; K1307-E1310 VanDerWaalsContact CD-CD 3.42Å; K1307-E1310 HydrophobicContact CD-CG 4.2Å; K1307-E1310 VanDerWaalsContact CD-OE1 3.32Å; K1307-E1310 WeakPolarHBondContact CD-OE1 3.36Å; K1307-E1310 WeakPolarHBondContact CE-OE1 3.15Å; K1307-E1310 IonicContact NZ-OE1 3.21Å; K1307-E1310 PolarHBondContact NZ-OE1 3.28Å; K1307-E1310 PolarHBondContact O-N 3.27Å; K1307-E1310 VanDerWaalsContact O-N 3.16Å; E1310-Q1313 PolarHBondContact O-N 3.06Å; E1310-N1314 VanDerWaalsContact O-CB 3.27Å; E1310-N1314 WeakPolarHBondContact O-CB 3.32Å; E1310-N1314 VanDerWaalsContact O-CG 3.26Å; E1310-N1314 PolarHBondContact O-N 3.06Å; E1310-N1314 PolarHBondContact O-ND2 3.14Å; E1310-N1314 VanDerWaalsContact O-ND2 3.15Å
1311	I	80.3	Confident	72.8	Confident	2.4 Å²	2.4	37.7 Å²	37.7	1%	0.012	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-49.7	176.8	-63.1	164.1	0	0	0	110.6	H1292 K1307 L1308 N1309 Q1313 N1314 W1315 L1387	H1292-I1311 HydrophobicContact CB-CG2 4.48Å; H1292-I1311 VanDerWaalsContact CD2-CD1 3.46Å; H1292-I1311 WeakPolarHBondContact CD2-CD1 3.38Å; H1292-I1311 VanDerWaalsContact NE2-CD1 3.28Å; H1292-I1311 WeakPolarHBondContact NE2-CD1 3.36Å; H1292-I1311 WeakPolarHBondContact NE2-CG1 3.38Å; K1307-I1311 WeakPolarHBondContact O-CD1 3.38Å; K1307-I1311 VanDerWaalsContact O-CG1 3.3Å; K1307-I1311 WeakPolarHBondContact O-CG1 3.39Å; K1307-I1311 PolarHBondContact O-N 3.12Å; K1307-I1311 VanDerWaalsContact O-N 3.11Å; L1308-I1311 PolarHBondContact O-N 3.09Å; N1309-I1311 VanDerWaalsContact C-N 3.32Å; N1309-I1311 PolarHBondContact O-N 3.3Å; I1311-Q1313 VanDerWaalsContact C-N 3.34Å; I1311-Q1313 PolarHBondContact O-N 3.27Å; I1311-N1314 PolarHBondContact O-N 3.15Å; I1311-W1315 HydrophobicContact CG2-CD2 4.22Å; I1311-W1315 HydrophobicContact CG2-CG 4.49Å; I1311-W1315 HydrophobicContact CG2-CZ2 4.36Å; I1311-W1315 WeakPolarHBondContact O-CB 3.32Å; I1311-W1315 PolarHBondContact O-N 3.15Å; I1311-L1387 HydrophobicContact CD1-CD2 3.38Å; I1311-L1387 VanDerWaalsContact CD1-CD2 3.42Å
1312	L	84.5	Confident	74.2	Confident	0.4 Å²	0.4	37.3 Å²	37.3	0%	0.002	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-42.5	178.7	-69.6	177.3	0	0	0	111.5	L1308 N1309 N1314 W1315 L1316 L1355 I1359 F1362 W1394	L1308-L1312 HydrophobicContact CD1-CD1 4.14Å; L1308-L1312 HydrophobicContact CD1-CD2 4.42Å; L1308-L1312 HydrophobicContact CD1-CG 3.98Å; L1308-L1312 HydrophobicContact CG-CD1 3.99Å; L1308-L1312 HydrophobicContact CG-CG 4.26Å; L1308-L1312 WeakPolarHBondContact O-CB 3.31Å; L1308-L1312 VanDerWaalsContact O-CG 3.3Å; L1308-L1312 WeakPolarHBondContact O-CG 3.3Å; L1308-L1312 PolarHBondContact O-N 3.15Å; N1309-L1312 PolarHBondContact O-N 3.29Å; L1312-N1314 VanDerWaalsContact C-N 3.3Å; L1312-N1314 PolarHBondContact O-N 3Å; L1312-W1315 HydrophobicContact CD2-CE3 4.45Å; L1312-W1315 PolarHBondContact O-N 3.03Å; L1312-L1316 VanDerWaalsContact O-CB 3.31Å; L1312-L1316 WeakPolarHBondContact O-CB 3.42Å; L1312-L1316 WeakPolarHBondContact O-CD1 3.4Å; L1312-L1316 VanDerWaalsContact O-CG 3.26Å; L1312-L1316 WeakPolarHBondContact O-CG 3.35Å; L1312-L1316 PolarHBondContact O-N 3.18Å; L1312-L1355 HydrophobicContact CD1-CD1 4.18Å; L1312-I1359 HydrophobicContact CD1-CG1 3.93Å; L1312-F1362 HydrophobicContact CD2-CB 4.11Å; L1312-F1362 HydrophobicContact CD2-CD1 3.95Å; L1312-F1362 HydrophobicContact CD2-CD2 3.96Å; L1312-F1362 HydrophobicContact CD2-CE1 4.35Å; L1312-F1362 HydrophobicContact CD2-CE2 4.38Å; L1312-F1362 HydrophobicContact CD2-CG 3.74Å; L1312-F1362 HydrophobicContact CD2-CZ 4.43Å; L1312-W1394 HydrophobicContact CD1-CB 4.17Å; L1312-W1394 HydrophobicContact CD2-CB 4.43Å; L1312-W1394 HydrophobicContact CD2-CE3 4.33Å
1313	Q	79.9	Confident	75.6	Confident	63 Å²	63	35.2 Å²	35.2	29%	0.294	18%	0.183	S	C	.	.	H	α-helix	trans	-59	-46.3	175.7	-176	-177.1	13	0	0	111.4	N1309 E1310 I1311 L1316 N1317 Y1358	N1309-Q1313 WeakPolarHBondContact O-CB 3.37Å; N1309-Q1313 PolarHBondContact O-N 3.26Å; E1310-Q1313 PolarHBondContact O-N 3.06Å; I1311-Q1313 VanDerWaalsContact C-N 3.34Å; I1311-Q1313 PolarHBondContact O-N 3.27Å; Q1313-L1316 PolarHBondContact O-N 3.17Å; Q1313-N1317 WeakPolarHBondContact O-CB 3.31Å; Q1313-N1317 VanDerWaalsContact O-CG 3.3Å; Q1313-N1317 PolarHBondContact O-N 3.14Å; Q1313-N1317 PolarHBondContact O-ND2 3.3Å; Q1313-N1317 VanDerWaalsContact O-ND2 3.15Å; Q1313-Y1358 HydrophobicContact CB-CD1 4.38Å; Q1313-Y1358 HydrophobicContact CB-CE1 3.88Å; Q1313-Y1358 HydrophobicContact CB-CE2 4.31Å; Q1313-Y1358 VanDerWaalsContact CD-OH 3.29Å; Q1313-Y1358 HydrophobicContact CG-CE1 3.95Å; Q1313-Y1358 VanDerWaalsContact CG-OH 3.24Å; Q1313-Y1358 WeakPolarHBondContact CG-OH 3.31Å; Q1313-Y1358 PolarHBondContact NE2-OH 3.08Å; Q1313-Y1358 VanDerWaalsContact NE2-OH 3.11Å
1314	N	75	Confident	76.8	Confident	54.8 Å²	54.8	34.3 Å²	34.3	29%	0.293	17%	0.174	S	C	.	.	H	α-helix	trans	-64.8	-46.2	178.3	-89.9	-18	0	0	0	111.6	I1218 V1219 E1310 I1311 L1312 L1316 N1317 L1318	I1218-N1314 HydrophobicContact CD1-CB 3.35Å; I1218-N1314 HydrophobicContact CG1-CB 3.83Å; I1218-N1314 HydrophobicContact CG2-CB 3.85Å; I1218-N1314 WeakPolarHBondContact CG2-ND2 3.31Å; V1219-N1314 HydrophobicContact CG1-CB 3.56Å; V1219-N1314 WeakPolarHBondContact CG1-ND2 3.46Å; V1219-N1314 HydrophobicContact CG2-CB 4.47Å; E1310-N1314 VanDerWaalsContact O-CB 3.27Å; E1310-N1314 WeakPolarHBondContact O-CB 3.32Å; E1310-N1314 VanDerWaalsContact O-CG 3.26Å; E1310-N1314 PolarHBondContact O-N 3.06Å; E1310-N1314 PolarHBondContact O-ND2 3.14Å; E1310-N1314 VanDerWaalsContact O-ND2 3.15Å; I1311-N1314 PolarHBondContact O-N 3.15Å; L1312-N1314 VanDerWaalsContact C-N 3.3Å; L1312-N1314 PolarHBondContact O-N 3Å; N1314-L1316 VanDerWaalsContact C-N 3.3Å; N1314-L1316 PolarHBondContact O-N 3.15Å; N1314-N1317 PolarHBondContact O-N 3.26Å; N1314-L1318 WeakPolarHBondContact O-CB 3.33Å; N1314-L1318 VanDerWaalsContact O-CD1 3.27Å; N1314-L1318 WeakPolarHBondContact O-CD1 3.3Å; N1314-L1318 VanDerWaalsContact O-CG 3.31Å; N1314-L1318 WeakPolarHBondContact O-CG 3.29Å; N1314-L1318 PolarHBondContact O-N 3.08Å
1315	W	81.6	Confident	77.2	Confident	4.2 Å²	4.2	36.2 Å²	36.2	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-40.4	176.2	-77.8	3.5	0	0	0	112.5	I1218 L1290 H1292 I1311 L1312 L1318 L1319 F1362 F1379 I1381 W1394 F1405	I1218-W1315 HydrophobicContact CD1-CB 4.4Å; I1218-W1315 HydrophobicContact CD1-CG 3.73Å; I1218-W1315 VanDerWaalsContact CD1-NE1 3.34Å; L1290-W1315 HydrophobicContact CD2-CB 4.24Å; L1290-W1315 HydrophobicContact CD2-CD2 4.48Å; L1290-W1315 HydrophobicContact CD2-CG 4.07Å; H1292-W1315 HydrophobicContact CB-CZ2 4.08Å; I1311-W1315 HydrophobicContact CG2-CD2 4.22Å; I1311-W1315 HydrophobicContact CG2-CG 4.49Å; I1311-W1315 HydrophobicContact CG2-CZ2 4.36Å; I1311-W1315 WeakPolarHBondContact O-CB 3.32Å; I1311-W1315 PolarHBondContact O-N 3.15Å; L1312-W1315 HydrophobicContact CD2-CE3 4.45Å; L1312-W1315 PolarHBondContact O-N 3.03Å; W1315-L1318 WeakPolarHBondContact O-CB 3.43Å; W1315-L1318 PolarHBondContact O-N 3.17Å; W1315-L1319 VanDerWaalsContact O-CB 3.3Å; W1315-L1319 WeakPolarHBondContact O-CB 3.41Å; W1315-L1319 VanDerWaalsContact O-CG 3.26Å; W1315-L1319 WeakPolarHBondContact O-CG 3.38Å; W1315-L1319 PolarHBondContact O-N 3.03Å; W1315-F1362 HydrophobicContact CB-CE2 4.39Å; W1315-F1362 HydrophobicContact CD2-CE2 4.44Å; W1315-F1362 AromaticContact CE3-CE2 3.68Å; W1315-F1362 HydrophobicContact CE3-CE2 3.68Å; W1315-F1362 AromaticContact CE3-CZ 3.71Å; W1315-F1362 HydrophobicContact CE3-CZ 3.71Å; W1315-F1362 HydrophobicContact CZ3-CE2 4.35Å; W1315-F1362 AromaticContact CZ3-CZ 3.89Å; W1315-F1362 HydrophobicContact CZ3-CZ 3.91Å; W1315-F1379 HydrophobicContact CD2-CD1 4.21Å; W1315-F1379 HydrophobicContact CD2-CE1 4.36Å; W1315-F1379 AromaticContact CE3-CD1 3.71Å; W1315-F1379 HydrophobicContact CE3-CD1 3.77Å; W1315-F1379 AromaticContact CE3-CE1 3.89Å; W1315-F1379 HydrophobicContact CE3-CE1 4.14Å; W1315-F1379 HydrophobicContact CH2-CB 4.01Å; W1315-F1379 AromaticContact CH2-CD1 3.84Å; W1315-F1379 HydrophobicContact CH2-CD1 3.88Å; W1315-F1379 HydrophobicContact CH2-CG 4.36Å; W1315-F1379 HydrophobicContact CZ2-CD1 4.28Å; W1315-F1379 HydrophobicContact CZ3-CB 4.21Å; W1315-F1379 AromaticContact CZ3-CD1 3.6Å; W1315-F1379 HydrophobicContact CZ3-CD1 3.6Å; W1315-F1379 VanDerWaalsContact CZ3-CD1 3.41Å; W1315-F1379 HydrophobicContact CZ3-CE1 4.33Å; W1315-F1379 HydrophobicContact CZ3-CG 4.25Å; W1315-I1381 HydrophobicContact CH2-CD1 3.57Å; W1315-I1381 HydrophobicContact CH2-CG1 3.55Å; W1315-I1381 VanDerWaalsContact CH2-CG1 3.41Å; W1315-I1381 HydrophobicContact CZ2-CD1 4.29Å; W1315-I1381 HydrophobicContact CZ2-CG1 3.95Å; W1315-I1381 HydrophobicContact CZ3-CD1 4.24Å; W1315-I1381 HydrophobicContact CZ3-CG1 4.46Å; W1315-W1394 AromaticContact CZ3-CZ3 4Å; W1315-W1394 HydrophobicContact CZ3-CZ3 4.18Å; W1315-F1405 HydrophobicContact CH2-CE1 4.44Å; W1315-F1405 HydrophobicContact CZ3-CE1 4.18Å
1316	L	83.5	Confident	77.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-46.2	175.9	-76.4	167.1	0	0	0	112	L1312 Q1313 N1314 L1318 L1319 I1320 F1344 Y1358 C1361 F1362 F1365	L1312-L1316 VanDerWaalsContact O-CB 3.31Å; L1312-L1316 WeakPolarHBondContact O-CB 3.42Å; L1312-L1316 WeakPolarHBondContact O-CD1 3.4Å; L1312-L1316 VanDerWaalsContact O-CG 3.26Å; L1312-L1316 WeakPolarHBondContact O-CG 3.35Å; L1312-L1316 PolarHBondContact O-N 3.18Å; Q1313-L1316 PolarHBondContact O-N 3.17Å; N1314-L1316 VanDerWaalsContact C-N 3.3Å; N1314-L1316 PolarHBondContact O-N 3.15Å; L1316-L1318 PolarHBondContact O-N 3.23Å; L1316-L1319 PolarHBondContact O-N 3.07Å; L1316-I1320 WeakPolarHBondContact O-CB 3.22Å; L1316-I1320 WeakPolarHBondContact O-CD1 3.39Å; L1316-I1320 VanDerWaalsContact O-CG1 3.24Å; L1316-I1320 WeakPolarHBondContact O-CG1 3.3Å; L1316-I1320 PolarHBondContact O-N 3.16Å; L1316-F1344 HydrophobicContact CB-CD2 4.47Å; L1316-F1344 HydrophobicContact CB-CE2 3.99Å; L1316-F1344 HydrophobicContact CB-CZ 4.09Å; L1316-F1344 HydrophobicContact CD1-CD2 4.29Å; L1316-F1344 HydrophobicContact CD1-CE2 3.87Å; L1316-F1344 HydrophobicContact CG-CE2 4.44Å; L1316-Y1358 HydrophobicContact CD1-CD1 3.81Å; L1316-Y1358 HydrophobicContact CD1-CE1 4.5Å; L1316-C1361 HydrophobicContact CD1-CB 3.91Å; L1316-C1361 HydrophobicContact CD2-CB 4.27Å; L1316-F1362 HydrophobicContact CD2-CB 4.47Å; L1316-F1362 HydrophobicContact CD2-CD2 4.43Å; L1316-F1362 HydrophobicContact CG-CD2 4.49Å; L1316-F1365 HydrophobicContact CD2-CB 4.05Å; L1316-F1365 HydrophobicContact CD2-CD1 4.38Å; L1316-F1365 HydrophobicContact CD2-CD2 3.42Å; L1316-F1365 VanDerWaalsContact CD2-CD2 3.43Å; L1316-F1365 HydrophobicContact CD2-CE2 3.9Å; L1316-F1365 HydrophobicContact CD2-CG 3.7Å
1317	N	76.3	Confident	77.4	Confident	42 Å²	42	34.4 Å²	34.4	23%	0.225	17%	0.173	C	C	.	.	H	α-helix	trans	-59.1	-43.1	175.5	-73.3	-36	0	0	0	111.5	Q1313 N1314 I1320 I1321 F1344 K1348	Q1313-N1317 WeakPolarHBondContact O-CB 3.31Å; Q1313-N1317 VanDerWaalsContact O-CG 3.3Å; Q1313-N1317 PolarHBondContact O-N 3.14Å; Q1313-N1317 PolarHBondContact O-ND2 3.3Å; Q1313-N1317 VanDerWaalsContact O-ND2 3.15Å; N1314-N1317 PolarHBondContact O-N 3.26Å; N1317-I1320 WeakPolarHBondContact O-CB 3.3Å; N1317-I1320 PolarHBondContact O-N 2.84Å; N1317-I1321 WeakPolarHBondContact O-CG1 3.39Å; N1317-I1321 PolarHBondContact O-N 2.99Å; N1317-I1321 VanDerWaalsContact O-N 3.14Å; N1317-F1344 VanDerWaalsContact OD1-CE1 3.27Å; N1317-F1344 WeakPolarHBondContact OD1-CE1 3.24Å; N1317-F1344 WeakPolarHBondContact OD1-CZ 3.43Å; N1317-K1348 PolarHBondContact OD1-NZ 2.93Å
1318	L	74.3	Confident	77	Confident	43 Å²	43	35.3 Å²	35.3	23%	0.225	18%	0.182	C	C	.	.	H	α-helix	trans	-66.2	-44.7	178.2	-74.2	172.6	0	0	0	112.6	L1189 H1191 C1193 L1216 L1217 I1218 V1219 L1290 N1314 W1315 L1316 I1320 I1321 Q1322	L1189-L1318 HydrophobicContact CD2-CD2 4.39Å; H1191-L1318 HydrophobicContact CB-CD2 3.99Å; C1193-L1318 WeakPolarHBondContact SG-CD2 3.31Å; C1193-L1318 WeakPolarHBondContact SG-CG 3.47Å; L1216-L1318 HydrophobicContact CD1-CD1 4.5Å; L1216-L1318 HydrophobicContact CD1-CD2 3.59Å; L1216-L1318 HydrophobicContact CD1-CG 4.45Å; L1216-L1318 HydrophobicContact CD2-CB 3.38Å; L1216-L1318 HydrophobicContact CD2-CD1 3.82Å; L1216-L1318 HydrophobicContact CD2-CD2 3.71Å; L1216-L1318 HydrophobicContact CD2-CG 3.77Å; L1216-L1318 HydrophobicContact CG-CB 4.11Å; L1216-L1318 HydrophobicContact CG-CD1 3.62Å; L1216-L1318 HydrophobicContact CG-CD2 3.6Å; L1216-L1318 HydrophobicContact CG-CG 3.92Å; L1217-L1318 HydrophobicContact CD1-CB 4.04Å; L1217-L1318 HydrophobicContact CD1-CD1 3.66Å; L1217-L1318 HydrophobicContact CD1-CD2 3.42Å; L1217-L1318 VanDerWaalsContact CD1-CD2 3.42Å; L1217-L1318 HydrophobicContact CD1-CG 3.86Å; L1217-L1318 HydrophobicContact CD2-CD1 3.19Å; L1217-L1318 HydrophobicContact CD2-CD2 3.93Å; L1217-L1318 HydrophobicContact CD2-CG 4.11Å; L1217-L1318 HydrophobicContact CG-CD1 3.95Å; L1217-L1318 HydrophobicContact CG-CD2 4.21Å; I1218-L1318 HydrophobicContact CD1-CD1 4Å; I1218-L1318 HydrophobicContact CG1-CD1 3.53Å; V1219-L1318 HydrophobicContact CG2-CD1 4.07Å; L1290-L1318 HydrophobicContact CD2-CB 4.09Å; L1290-L1318 HydrophobicContact CD2-CD1 4.21Å; N1314-L1318 WeakPolarHBondContact O-CB 3.33Å; N1314-L1318 VanDerWaalsContact O-CD1 3.27Å; N1314-L1318 WeakPolarHBondContact O-CD1 3.3Å; N1314-L1318 VanDerWaalsContact O-CG 3.31Å; N1314-L1318 WeakPolarHBondContact O-CG 3.29Å; N1314-L1318 PolarHBondContact O-N 3.08Å; W1315-L1318 WeakPolarHBondContact O-CB 3.43Å; W1315-L1318 PolarHBondContact O-N 3.17Å; L1316-L1318 PolarHBondContact O-N 3.23Å; L1318-I1320 VanDerWaalsContact C-N 3.32Å; L1318-I1320 PolarHBondContact O-N 3.4Å; L1318-I1321 PolarHBondContact O-N 3.16Å; L1318-Q1322 WeakPolarHBondContact O-CB 3.33Å; L1318-Q1322 VanDerWaalsContact O-CG 3.31Å; L1318-Q1322 WeakPolarHBondContact O-CG 3.33Å; L1318-Q1322 PolarHBondContact O-N 3.32Å
1319	L	80.6	Confident	76.1	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.5	-40.5	175.3	-75.4	171.6	0	0	0	110.9	L1290 W1315 L1316 I1321 Q1322 L1323 F1362 F1365 L1369 F1377 F1379	L1290-L1319 HydrophobicContact CD1-CD2 4.12Å; L1290-L1319 HydrophobicContact CD1-CG 3.92Å; L1290-L1319 HydrophobicContact CD2-CD2 4.3Å; L1290-L1319 HydrophobicContact CD2-CG 4.18Å; W1315-L1319 VanDerWaalsContact O-CB 3.3Å; W1315-L1319 WeakPolarHBondContact O-CB 3.41Å; W1315-L1319 VanDerWaalsContact O-CG 3.26Å; W1315-L1319 WeakPolarHBondContact O-CG 3.38Å; W1315-L1319 PolarHBondContact O-N 3.03Å; L1316-L1319 PolarHBondContact O-N 3.07Å; L1319-I1321 VanDerWaalsContact C-N 3.34Å; L1319-I1321 PolarHBondContact O-N 3.4Å; L1319-Q1322 PolarHBondContact O-N 3.14Å; L1319-L1323 HydrophobicContact CB-CD1 4.4Å; L1319-L1323 WeakPolarHBondContact O-CB 3.3Å; L1319-L1323 WeakPolarHBondContact O-CD1 3.33Å; L1319-L1323 WeakPolarHBondContact O-CG 3.37Å; L1319-L1323 PolarHBondContact O-N 3.23Å; L1319-F1362 HydrophobicContact CD1-CE2 4.39Å; L1319-F1365 HydrophobicContact CB-CD1 4.34Å; L1319-F1365 HydrophobicContact CB-CE1 4.5Å; L1319-F1365 HydrophobicContact CD1-CB 4.45Å; L1319-L1369 HydrophobicContact CD2-CD1 4.36Å; L1319-L1369 HydrophobicContact CD2-CD2 4.42Å; L1319-F1377 HydrophobicContact CD2-CD1 4.44Å; L1319-F1377 HydrophobicContact CD2-CE1 4.31Å; L1319-F1379 HydrophobicContact CD1-CE1 4.34Å; L1319-F1379 HydrophobicContact CD1-CZ 4.28Å; L1319-F1379 HydrophobicContact CD2-CE1 4.41Å; L1319-F1379 HydrophobicContact CD2-CZ 4.33Å
1320	I	79.4	Confident	75.8	Confident	19.6 Å²	19.6	42.2 Å²	42.2	10%	0.101	23%	0.227	C	C	.	.	H	α-helix	trans	-59	-48	176.1	-73.3	164.6	0	0	0	111	L1316 N1317 L1318 Q1322 L1323 D1324 K1341 F1344 F1365	L1316-I1320 WeakPolarHBondContact O-CB 3.22Å; L1316-I1320 WeakPolarHBondContact O-CD1 3.39Å; L1316-I1320 VanDerWaalsContact O-CG1 3.24Å; L1316-I1320 WeakPolarHBondContact O-CG1 3.3Å; L1316-I1320 PolarHBondContact O-N 3.16Å; N1317-I1320 WeakPolarHBondContact O-CB 3.3Å; N1317-I1320 PolarHBondContact O-N 2.84Å; L1318-I1320 VanDerWaalsContact C-N 3.32Å; L1318-I1320 PolarHBondContact O-N 3.4Å; I1320-Q1322 VanDerWaalsContact C-N 3.31Å; I1320-Q1322 PolarHBondContact O-N 3.05Å; I1320-L1323 PolarHBondContact O-N 3.21Å; I1320-D1324 WeakPolarHBondContact O-CB 3.41Å; I1320-D1324 PolarHBondContact O-N 3.26Å; I1320-K1341 HydrophobicContact CG1-CG 4.33Å; I1320-K1341 HydrophobicContact CG2-CD 4.38Å; I1320-K1341 VanDerWaalsContact CG2-CE 3.47Å; I1320-K1341 HydrophobicContact CG2-CG 4.26Å; I1320-F1344 HydrophobicContact CD1-CB 4.46Å; I1320-F1344 HydrophobicContact CD1-CD1 3.45Å; I1320-F1344 VanDerWaalsContact CD1-CD1 3.42Å; I1320-F1344 HydrophobicContact CD1-CE1 3.65Å; I1320-F1344 HydrophobicContact CD1-CG 4.09Å; I1320-F1344 HydrophobicContact CD1-CZ 4.3Å; I1320-F1365 HydrophobicContact CD1-CE1 4.48Å; I1320-F1365 HydrophobicContact CD1-CZ 3.99Å; I1320-F1365 HydrophobicContact CG1-CE1 3.69Å; I1320-F1365 HydrophobicContact CG1-CE2 4.49Å; I1320-F1365 HydrophobicContact CG1-CZ 3.57Å; I1320-F1365 VanDerWaalsContact CG1-CZ 3.41Å
1321	I	74.3	Confident	75.7	Confident	82.8 Å²	82.8	45.5 Å²	45.5	43%	0.425	25%	0.246	S	C	.	.	H	α-helix	trans	-63.2	-42.3	179.1	-65.2	163.9	0	0	0	111.1	L1189 N1317 L1318 L1319 N1325	L1189-I1321 HydrophobicContact CD2-CD1 4.23Å; L1189-I1321 HydrophobicContact CD2-CG2 4.18Å; N1317-I1321 WeakPolarHBondContact O-CG1 3.39Å; N1317-I1321 PolarHBondContact O-N 2.99Å; N1317-I1321 VanDerWaalsContact O-N 3.14Å; L1318-I1321 PolarHBondContact O-N 3.16Å; L1319-I1321 VanDerWaalsContact C-N 3.34Å; L1319-I1321 PolarHBondContact O-N 3.4Å; I1321-N1325 PolarHBondContact O-ND2 3.25Å
1322	Q	72.6	Confident	75.5	Confident	30.4 Å²	30.4	51.2 Å²	51.2	14%	0.142	28%	0.276	C	S	.	.	H	α-helix	trans	-68	-44.6	178.8	-87.1	177.5	1.4	0	0	112	I1215 Q1288 L1318 L1319 I1320 D1324 N1325 I1326	I1215-Q1322 HydrophobicContact CD1-CG 3.9Å; Q1288-Q1322 VanDerWaalsContact OE1-CD 3.29Å; L1318-Q1322 WeakPolarHBondContact O-CB 3.33Å; L1318-Q1322 VanDerWaalsContact O-CG 3.31Å; L1318-Q1322 WeakPolarHBondContact O-CG 3.33Å; L1318-Q1322 PolarHBondContact O-N 3.32Å; L1319-Q1322 PolarHBondContact O-N 3.14Å; I1320-Q1322 VanDerWaalsContact C-N 3.31Å; I1320-Q1322 PolarHBondContact O-N 3.05Å; Q1322-D1324 VanDerWaalsContact C-N 3.32Å; Q1322-D1324 PolarHBondContact O-N 2.86Å; Q1322-N1325 WeakPolarHBondContact O-CB 3.21Å; Q1322-N1325 PolarHBondContact O-N 3.19Å; Q1322-I1326 HydrophobicContact CG-CD1 3.93Å; Q1322-I1326 VanDerWaalsContact O-CD1 3.3Å; Q1322-I1326 WeakPolarHBondContact O-CD1 3.42Å; Q1322-I1326 VanDerWaalsContact O-CG1 3.29Å; Q1322-I1326 WeakPolarHBondContact O-CG1 3.38Å; Q1322-I1326 PolarHBondContact O-N 3.09Å
1323	L	78.5	Confident	75.2	Confident	0.2 Å²	0.2	52.6 Å²	52.6	0%	0.001	28%	0.283	C	S	.	.	H	α-helix	trans	-69	-32.7	-179	-69.4	173	0	0	0	112	L1319 I1320 N1325 I1326 C1327 L1337 F1365 F1368 L1369 L1372	L1319-L1323 HydrophobicContact CB-CD1 4.4Å; L1319-L1323 WeakPolarHBondContact O-CB 3.3Å; L1319-L1323 WeakPolarHBondContact O-CD1 3.33Å; L1319-L1323 WeakPolarHBondContact O-CG 3.37Å; L1319-L1323 PolarHBondContact O-N 3.23Å; I1320-L1323 PolarHBondContact O-N 3.21Å; L1323-N1325 VanDerWaalsContact C-N 3.3Å; L1323-N1325 PolarHBondContact O-N 3.03Å; L1323-I1326 HydrophobicContact CD2-CD1 4.41Å; L1323-I1326 PolarHBondContact O-N 3.03Å; L1323-I1326 VanDerWaalsContact O-N 3.15Å; L1323-C1327 VanDerWaalsContact O-CB 3.26Å; L1323-C1327 WeakPolarHBondContact O-CB 3.41Å; L1323-C1327 PolarHBondContact O-N 3.24Å; L1323-C1327 PolarHBondContact O-SG 3.06Å; L1323-C1327 VanDerWaalsContact O-SG 3.35Å; L1323-L1337 HydrophobicContact CB-CD1 3.87Å; L1323-L1337 HydrophobicContact CB-CD2 3.91Å; L1323-L1337 HydrophobicContact CB-CG 4.48Å; L1323-L1337 HydrophobicContact CD1-CD1 4.05Å; L1323-F1365 HydrophobicContact CD1-CD1 3.87Å; L1323-F1365 HydrophobicContact CD1-CE1 4Å; L1323-F1368 HydrophobicContact CD1-CD1 3.89Å; L1323-F1368 HydrophobicContact CD1-CE1 4Å; L1323-F1368 HydrophobicContact CD2-CD1 4.36Å; L1323-F1368 HydrophobicContact CD2-CE1 4.07Å; L1323-F1368 HydrophobicContact CG-CE1 4.45Å; L1323-L1369 HydrophobicContact CD1-CD2 4.17Å; L1323-L1369 HydrophobicContact CD2-CD2 3.84Å; L1323-L1369 HydrophobicContact CG-CD2 4.44Å; L1323-L1372 HydrophobicContact CD2-CD1 3.45Å; L1323-L1372 VanDerWaalsContact CD2-CD1 3.47Å
1324	D	75.8	Confident	75.1	Confident	51 Å²	51	54.3 Å²	54.3	27%	0.273	29%	0.289	S	S	.	.	H	α-helix	trans	-57.6	-45.2	172.1	-87.9	-22.4	0	0	0	112.3	I1320 Q1322 I1326 N1328 L1337 K1341	I1320-D1324 WeakPolarHBondContact O-CB 3.41Å; I1320-D1324 PolarHBondContact O-N 3.26Å; Q1322-D1324 VanDerWaalsContact C-N 3.32Å; Q1322-D1324 PolarHBondContact O-N 2.86Å; D1324-I1326 VanDerWaalsContact C-N 3.31Å; D1324-I1326 PolarHBondContact O-N 3.1Å; D1324-N1328 VanDerWaalsContact O-CG 3.23Å; D1324-N1328 PolarHBondContact O-N 2.97Å; D1324-N1328 PolarHBondContact O-ND2 3.28Å; D1324-N1328 VanDerWaalsContact O-ND2 3.13Å; D1324-N1328 PolarHBondContact O-OD1 3.35Å; D1324-L1337 WeakPolarHBondContact OD1-CD2 3.37Å; D1324-K1341 VanDerWaalsContact CG-CE 3.48Å; D1324-K1341 WeakPolarHBondContact OD1-CE 3.39Å; D1324-K1341 IonicContact OD1-NZ 3.15Å; D1324-K1341 PolarHBondContact OD1-NZ 3.02Å; D1324-K1341 VanDerWaalsContact OD2-CE 3.3Å; D1324-K1341 WeakPolarHBondContact OD2-CE 3.34Å; D1324-K1341 IonicContact OD2-NZ 3.01Å; D1324-K1341 PolarHBondContact OD2-NZ 3.11Å
1325	N	70.6	Confident	75.3	Confident	92.4 Å²	92.4	58.2 Å²	58.2	49%	0.494	30%	0.304	S	S	.	.	H	α-helix	trans	-66.8	-33	179.3	-71.8	-40.4	0	0	0	112.4	L1211 I1321 Q1322 L1323	L1211-N1325 HydrophobicContact CD1-CB 3.88Å; I1321-N1325 PolarHBondContact O-ND2 3.25Å; Q1322-N1325 WeakPolarHBondContact O-CB 3.21Å; Q1322-N1325 PolarHBondContact O-N 3.19Å; L1323-N1325 VanDerWaalsContact C-N 3.3Å; L1323-N1325 PolarHBondContact O-N 3.03Å
1326	I	72.6	Confident	75.1	Confident	45.2 Å²	45.2	60.9 Å²	60.9	23%	0.232	32%	0.318	C	S	.	.	H	α-helix	trans	-81.8	-47.3	-178.3	-64.9	161.7	0	0	0	111.4	Q1322 L1323 D1324 N1328 L1372 I1375 F1377	Q1322-I1326 HydrophobicContact CG-CD1 3.93Å; Q1322-I1326 VanDerWaalsContact O-CD1 3.3Å; Q1322-I1326 WeakPolarHBondContact O-CD1 3.42Å; Q1322-I1326 VanDerWaalsContact O-CG1 3.29Å; Q1322-I1326 WeakPolarHBondContact O-CG1 3.38Å; Q1322-I1326 PolarHBondContact O-N 3.09Å; L1323-I1326 HydrophobicContact CD2-CD1 4.41Å; L1323-I1326 PolarHBondContact O-N 3.03Å; L1323-I1326 VanDerWaalsContact O-N 3.15Å; D1324-I1326 VanDerWaalsContact C-N 3.31Å; D1324-I1326 PolarHBondContact O-N 3.1Å; I1326-N1328 VanDerWaalsContact C-N 3.27Å; I1326-N1328 PolarHBondContact O-N 3.3Å; I1326-L1372 HydrophobicContact CG2-CD1 4.46Å; I1326-L1372 HydrophobicContact CG2-CD2 4.39Å; I1326-I1375 HydrophobicContact CB-CD1 4.41Å; I1326-I1375 HydrophobicContact CD1-CD1 3.78Å; I1326-I1375 HydrophobicContact CG1-CD1 4.12Å; I1326-I1375 HydrophobicContact CG2-CD1 3.61Å; I1326-I1375 VanDerWaalsContact CG2-CD1 3.44Å; I1326-F1377 HydrophobicContact CD1-CZ 4.47Å
1327	C	72.3	Confident	74.9	Confident	1.6 Å²	1.6	61.1 Å²	61.1	1%	0.011	32%	0.319	C	S	.	.	H	α-helix	trans	-75.8	-9.6	-173.4	-65.8	0	0	0	0	113.6	L1323 C1329 N1330 L1333 K1334 L1337	L1323-C1327 VanDerWaalsContact O-CB 3.26Å; L1323-C1327 WeakPolarHBondContact O-CB 3.41Å; L1323-C1327 PolarHBondContact O-N 3.24Å; L1323-C1327 PolarHBondContact O-SG 3.06Å; L1323-C1327 VanDerWaalsContact O-SG 3.35Å; C1327-C1329 PolarHBondContact O-N 3.1Å; C1327-N1330 PolarHBondContact O-N 3.14Å; C1327-N1330 VanDerWaalsContact O-N 3.12Å; C1327-L1333 HydrophobicContact CB-CB 4.2Å; C1327-K1334 WeakPolarHBondContact O-CE 3.43Å; C1327-K1334 VanDerWaalsContact O-CG 3.23Å; C1327-K1334 WeakPolarHBondContact O-CG 3.35Å; C1327-L1337 HydrophobicContact CB-CD2 3.94Å
1328	N	67.9	Low	75	Confident	100 Å²	100	61.5 Å²	61.5	54%	0.535	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-18.3	173.1	-85.9	-23.6	0	0	0	114	D1324 I1326 K1334	D1324-N1328 VanDerWaalsContact O-CG 3.23Å; D1324-N1328 PolarHBondContact O-N 2.97Å; D1324-N1328 PolarHBondContact O-ND2 3.28Å; D1324-N1328 VanDerWaalsContact O-ND2 3.13Å; D1324-N1328 PolarHBondContact O-OD1 3.35Å; I1326-N1328 VanDerWaalsContact C-N 3.27Å; I1326-N1328 PolarHBondContact O-N 3.3Å; N1328-K1334 VanDerWaalsContact C-CE 3.44Å; N1328-K1334 VanDerWaalsContact CA-CE 3.47Å; N1328-K1334 WeakPolarHBondContact O-CE 3.41Å; N1328-K1334 PolarHBondContact O-NZ 3.07Å
1329	C	62.7	Low	75.3	Confident	121.2 Å²	121.2	63.8 Å²	63.8	82%	0.819	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-6.8	179.7	-57.3	0	0	0	0	115.2	C1327	C1327-C1329 PolarHBondContact O-N 3.1Å
1330	N	73.3	Confident	75.1	Confident	73.4 Å²	73.4	64.4 Å²	64.4	39%	0.393	34%	0.338	S	S	.	.			trans	-146	114.8	-175.6	-173.6	-22	0	0	0	112.4	C1327 I1332 L1333 K1334	C1327-N1330 PolarHBondContact O-N 3.14Å; C1327-N1330 VanDerWaalsContact O-N 3.12Å; N1330-I1332 VanDerWaalsContact C-N 3.31Å; N1330-I1332 PolarHBondContact O-N 3.06Å; N1330-I1332 PolarHBondContact OD1-N 3.02Å; N1330-I1332 VanDerWaalsContact OD1-N 3.1Å; N1330-L1333 HydrophobicContact CB-CB 4.29Å; N1330-L1333 HydrophobicContact CB-CD1 4.07Å; N1330-L1333 HydrophobicContact CB-CG 4.27Å; N1330-L1333 PolarHBondContact O-N 3.12Å; N1330-L1333 VanDerWaalsContact O-N 3.08Å; N1330-K1334 WeakPolarHBondContact O-CB 3.39Å; N1330-K1334 PolarHBondContact O-N 3.19Å
1331	D	73.5	Confident	75.1	Confident	127.6 Å²	127.6	65.9 Å²	65.9	68%	0.682	34%	0.344	S	S	*	.	H	α-helix	trans	-62.2	-32.3	-173.7	-65.9	-37.7	0	0	0	114	L1333 K1334 K1335	D1331-L1333 VanDerWaalsContact C-N 3.33Å; D1331-K1334 PolarHBondContact O-N 3.05Å; D1331-K1334 WeakPolarHBondContact OD1-CD 3.31Å; D1331-K1334 WeakPolarHBondContact OD1-CE 3.18Å; D1331-K1334 IonicContact OD1-NZ 2.75Å; D1331-K1334 PolarHBondContact OD1-NZ 3.04Å; D1331-K1335 WeakPolarHBondContact O-CB 3.43Å; D1331-K1335 PolarHBondContact O-N 3.06Å
1332	I	76.7	Confident	75.1	Confident	123 Å²	123	67 Å²	67	63%	0.631	35%	0.35	S	S	*	.	H	α-helix	trans	-66.9	-45.3	177.5	-60.6	170.8	0	0	0	110	N1330 K1334 K1335 L1336	N1330-I1332 VanDerWaalsContact C-N 3.31Å; N1330-I1332 PolarHBondContact O-N 3.06Å; N1330-I1332 PolarHBondContact OD1-N 3.02Å; N1330-I1332 VanDerWaalsContact OD1-N 3.1Å; I1332-K1334 VanDerWaalsContact C-N 3.32Å; I1332-K1334 PolarHBondContact O-N 3.32Å; I1332-K1335 PolarHBondContact O-N 3.05Å; I1332-L1336 HydrophobicContact CG2-CD1 4.34Å; I1332-L1336 WeakPolarHBondContact O-CG 3.38Å; I1332-L1336 PolarHBondContact O-N 3.23Å; I1332-L1336 VanDerWaalsContact O-N 3.12Å
1333	L	77.3	Confident	75.1	Confident	28.2 Å²	28.2	66.9 Å²	66.9	15%	0.148	35%	0.353	C	S	.	.	H	α-helix	trans	-68	-36.6	177.4	-66.6	177.7	0	0	0	111.3	C1327 N1330 D1331 K1335 L1336 L1337 F1368 L1372	C1327-L1333 HydrophobicContact CB-CB 4.2Å; N1330-L1333 HydrophobicContact CB-CB 4.29Å; N1330-L1333 HydrophobicContact CB-CD1 4.07Å; N1330-L1333 HydrophobicContact CB-CG 4.27Å; N1330-L1333 PolarHBondContact O-N 3.12Å; N1330-L1333 VanDerWaalsContact O-N 3.08Å; D1331-L1333 VanDerWaalsContact C-N 3.33Å; L1333-K1335 VanDerWaalsContact C-N 3.34Å; L1333-K1335 PolarHBondContact O-N 3.14Å; L1333-L1336 PolarHBondContact O-N 3.38Å; L1333-L1337 VanDerWaalsContact O-CB 3.25Å; L1333-L1337 WeakPolarHBondContact O-CB 3.35Å; L1333-L1337 PolarHBondContact O-N 3.07Å; L1333-F1368 HydrophobicContact CB-CZ 4.39Å; L1333-F1368 HydrophobicContact CD2-CE2 4.22Å; L1333-F1368 HydrophobicContact CD2-CZ 4.23Å; L1333-L1372 HydrophobicContact CD1-CD2 3.76Å
1334	K	78.2	Confident	74.8	Confident	99.8 Å²	99.8	67.1 Å²	67.1	43%	0.434	35%	0.354	S	S	.	.	H	α-helix	trans	-62.2	-42.1	174.1	-153.8	176.8	-176.9	171.4	0	111.9	C1327 N1328 N1330 D1331 I1332 L1337 S1338	C1327-K1334 WeakPolarHBondContact O-CE 3.43Å; C1327-K1334 VanDerWaalsContact O-CG 3.23Å; C1327-K1334 WeakPolarHBondContact O-CG 3.35Å; N1328-K1334 VanDerWaalsContact C-CE 3.44Å; N1328-K1334 VanDerWaalsContact CA-CE 3.47Å; N1328-K1334 WeakPolarHBondContact O-CE 3.41Å; N1328-K1334 PolarHBondContact O-NZ 3.07Å; N1330-K1334 WeakPolarHBondContact O-CB 3.39Å; N1330-K1334 PolarHBondContact O-N 3.19Å; D1331-K1334 PolarHBondContact O-N 3.05Å; D1331-K1334 WeakPolarHBondContact OD1-CD 3.31Å; D1331-K1334 WeakPolarHBondContact OD1-CE 3.18Å; D1331-K1334 IonicContact OD1-NZ 2.75Å; D1331-K1334 PolarHBondContact OD1-NZ 3.04Å; I1332-K1334 VanDerWaalsContact C-N 3.32Å; I1332-K1334 PolarHBondContact O-N 3.32Å; K1334-L1337 PolarHBondContact O-N 3.08Å; K1334-S1338 VanDerWaalsContact O-CB 3.31Å; K1334-S1338 WeakPolarHBondContact O-CB 3.31Å; K1334-S1338 PolarHBondContact O-N 3.17Å; K1334-S1338 PolarHBondContact O-OG 3.15Å
1335	K	78.8	Confident	74.4	Confident	135.8 Å²	135.8	68.7 Å²	68.7	59%	0.59	36%	0.362	S	S	*	.	H	α-helix	trans	-63.2	-50.3	176.3	-171.3	178.8	177.2	-176.1	0	111.4	D1331 I1332 L1333 L1337 S1338 E1339	D1331-K1335 WeakPolarHBondContact O-CB 3.43Å; D1331-K1335 PolarHBondContact O-N 3.06Å; I1332-K1335 PolarHBondContact O-N 3.05Å; L1333-K1335 VanDerWaalsContact C-N 3.34Å; L1333-K1335 PolarHBondContact O-N 3.14Å; K1335-L1337 VanDerWaalsContact C-N 3.34Å; K1335-L1337 PolarHBondContact O-N 3.31Å; K1335-S1338 WeakPolarHBondContact CA-OG 3.48Å; K1335-S1338 WeakPolarHBondContact O-CB 3.41Å; K1335-S1338 PolarHBondContact O-N 3.1Å; K1335-S1338 VanDerWaalsContact O-N 3.13Å; K1335-S1338 PolarHBondContact O-OG 3.16Å; K1335-E1339 WeakPolarHBondContact CE-OE1 3.27Å; K1335-E1339 IonicContact NZ-OE1 2.68Å; K1335-E1339 PolarHBondContact O-N 3.33Å
1336	L	77.5	Confident	73.8	Confident	62 Å²	62	70.6 Å²	70.6	33%	0.325	37%	0.37	S	S	.	.	H	α-helix	trans	-60.8	-40.9	176.8	-71.5	170.9	0	0	0	112.5	I1332 L1333 S1338 E1339 L1340 F1368	I1332-L1336 HydrophobicContact CG2-CD1 4.34Å; I1332-L1336 WeakPolarHBondContact O-CG 3.38Å; I1332-L1336 PolarHBondContact O-N 3.23Å; I1332-L1336 VanDerWaalsContact O-N 3.12Å; L1333-L1336 PolarHBondContact O-N 3.38Å; L1336-S1338 VanDerWaalsContact C-N 3.33Å; L1336-S1338 PolarHBondContact O-N 2.93Å; L1336-E1339 PolarHBondContact O-N 3.23Å; L1336-L1340 WeakPolarHBondContact O-CG 3.3Å; L1336-L1340 PolarHBondContact O-N 3.19Å; L1336-L1340 VanDerWaalsContact O-N 3.11Å; L1336-F1368 HydrophobicContact CB-CD2 4.28Å; L1336-F1368 HydrophobicContact CB-CE2 3.66Å; L1336-F1368 HydrophobicContact CD1-CE2 4.37Å
1337	L	80.3	Confident	73	Confident	3.2 Å²	3.2	70.6 Å²	70.6	2%	0.017	37%	0.37	C	S	.	.	H	α-helix	trans	-64.9	-38.1	174.8	-176.8	63.8	0	0	0	111.5	L1323 D1324 C1327 L1333 K1334 K1335 E1339 L1340 K1341 F1365 F1368	L1323-L1337 HydrophobicContact CB-CD1 3.87Å; L1323-L1337 HydrophobicContact CB-CD2 3.91Å; L1323-L1337 HydrophobicContact CB-CG 4.48Å; L1323-L1337 HydrophobicContact CD1-CD1 4.05Å; D1324-L1337 WeakPolarHBondContact OD1-CD2 3.37Å; C1327-L1337 HydrophobicContact CB-CD2 3.94Å; L1333-L1337 VanDerWaalsContact O-CB 3.25Å; L1333-L1337 WeakPolarHBondContact O-CB 3.35Å; L1333-L1337 PolarHBondContact O-N 3.07Å; K1334-L1337 PolarHBondContact O-N 3.08Å; K1335-L1337 VanDerWaalsContact C-N 3.34Å; K1335-L1337 PolarHBondContact O-N 3.31Å; L1337-E1339 VanDerWaalsContact C-N 3.34Å; L1337-E1339 PolarHBondContact O-N 3.18Å; L1337-L1340 PolarHBondContact O-N 3.22Å; L1337-K1341 HydrophobicContact CD1-CG 4.46Å; L1337-K1341 HydrophobicContact CG-CD 4.26Å; L1337-K1341 HydrophobicContact CG-CG 4.42Å; L1337-K1341 VanDerWaalsContact O-CB 3.3Å; L1337-K1341 WeakPolarHBondContact O-CB 3.36Å; L1337-K1341 WeakPolarHBondContact O-CD 3.48Å; L1337-K1341 VanDerWaalsContact O-CG 3.28Å; L1337-K1341 WeakPolarHBondContact O-CG 3.36Å; L1337-K1341 PolarHBondContact O-N 3.1Å; L1337-F1365 HydrophobicContact CD1-CE1 4.29Å; L1337-F1368 HydrophobicContact CB-CE1 4.46Å; L1337-F1368 HydrophobicContact CB-CZ 4.15Å; L1337-F1368 HydrophobicContact CD1-CE1 4.34Å
1338	S	78.3	Confident	72.1	Confident	50.4 Å²	50.4	75.2 Å²	75.2	35%	0.352	39%	0.39	S	S	.	.	H	α-helix	trans	-65.1	-37.8	175.9	74.8	0	0	0	0	112.3	K1334 K1335 L1336 K1341 L1342	K1334-S1338 VanDerWaalsContact O-CB 3.31Å; K1334-S1338 WeakPolarHBondContact O-CB 3.31Å; K1334-S1338 PolarHBondContact O-N 3.17Å; K1334-S1338 PolarHBondContact O-OG 3.15Å; K1335-S1338 WeakPolarHBondContact CA-OG 3.48Å; K1335-S1338 WeakPolarHBondContact O-CB 3.41Å; K1335-S1338 PolarHBondContact O-N 3.1Å; K1335-S1338 VanDerWaalsContact O-N 3.13Å; K1335-S1338 PolarHBondContact O-OG 3.16Å; L1336-S1338 VanDerWaalsContact C-N 3.33Å; L1336-S1338 PolarHBondContact O-N 2.93Å; S1338-K1341 PolarHBondContact O-N 3.17Å; S1338-L1342 VanDerWaalsContact O-CB 3.28Å; S1338-L1342 WeakPolarHBondContact O-CB 3.35Å; S1338-L1342 WeakPolarHBondContact O-CD1 3.28Å; S1338-L1342 VanDerWaalsContact O-CG 3.27Å; S1338-L1342 WeakPolarHBondContact O-CG 3.41Å; S1338-L1342 PolarHBondContact O-N 3.23Å
1339	E	79.3	Confident	71.2	Confident	91.6 Å²	91.6	77.7 Å²	77.7	43%	0.428	40%	0.402	S	S	.	.	H	α-helix	trans	-64.7	-42.6	173.5	-70.4	172	-170.3	0	0	111.5	K1335 L1336 L1337 L1342 S1343	K1335-E1339 WeakPolarHBondContact CE-OE1 3.27Å; K1335-E1339 IonicContact NZ-OE1 2.68Å; K1335-E1339 PolarHBondContact O-N 3.33Å; L1336-E1339 PolarHBondContact O-N 3.23Å; L1337-E1339 VanDerWaalsContact C-N 3.34Å; L1337-E1339 PolarHBondContact O-N 3.18Å; E1339-L1342 PolarHBondContact O-N 3.01Å; E1339-S1343 WeakPolarHBondContact O-CB 3.14Å; E1339-S1343 PolarHBondContact O-N 3.23Å; E1339-S1343 VanDerWaalsContact O-N 3.12Å
1340	L	77.6	Confident	70.5	Confident	13.8 Å²	13.8	74.8 Å²	74.8	7%	0.072	38%	0.383	C	S	.	.	H	α-helix	trans	-64.7	-42.8	174.5	-70.1	174.9	0	0	0	112	L1336 L1337 S1343 F1344 R1364 F1365 F1368	L1336-L1340 WeakPolarHBondContact O-CG 3.3Å; L1336-L1340 PolarHBondContact O-N 3.19Å; L1336-L1340 VanDerWaalsContact O-N 3.11Å; L1337-L1340 PolarHBondContact O-N 3.22Å; L1340-S1343 WeakPolarHBondContact CA-OG 2.86Å; L1340-S1343 PolarHBondContact O-N 2.87Å; L1340-S1343 PolarHBondContact O-OG 3.13Å; L1340-F1344 WeakPolarHBondContact O-CB 3.38Å; L1340-F1344 PolarHBondContact O-N 3Å; L1340-F1344 VanDerWaalsContact O-N 3.12Å; L1340-R1364 HydrophobicContact CD2-CB 3.93Å; L1340-F1365 HydrophobicContact CB-CE2 4.09Å; L1340-F1365 HydrophobicContact CB-CZ 4.05Å; L1340-F1368 HydrophobicContact CD1-CB 3.72Å; L1340-F1368 HydrophobicContact CD1-CD1 4.35Å; L1340-F1368 HydrophobicContact CD1-CD2 3.85Å; L1340-F1368 HydrophobicContact CD1-CE2 4.23Å; L1340-F1368 HydrophobicContact CD1-CG 3.71Å; L1340-F1368 VanDerWaalsContact CD1-CG 3.45Å
1341	K	79.5	Confident	69.3	Low	49.6 Å²	49.6	76.8 Å²	76.8	22%	0.216	40%	0.403	C	S	.	.	H	α-helix	trans	-62.5	-43.1	175.5	-80.2	173.9	154	-159.1	0	112.7	I1320 D1324 L1337 S1338 S1343 F1344 N1345	I1320-K1341 HydrophobicContact CG1-CG 4.33Å; I1320-K1341 HydrophobicContact CG2-CD 4.38Å; I1320-K1341 VanDerWaalsContact CG2-CE 3.47Å; I1320-K1341 HydrophobicContact CG2-CG 4.26Å; D1324-K1341 VanDerWaalsContact CG-CE 3.48Å; D1324-K1341 WeakPolarHBondContact OD1-CE 3.39Å; D1324-K1341 IonicContact OD1-NZ 3.15Å; D1324-K1341 PolarHBondContact OD1-NZ 3.02Å; D1324-K1341 VanDerWaalsContact OD2-CE 3.3Å; D1324-K1341 WeakPolarHBondContact OD2-CE 3.34Å; D1324-K1341 IonicContact OD2-NZ 3.01Å; D1324-K1341 PolarHBondContact OD2-NZ 3.11Å; L1337-K1341 HydrophobicContact CD1-CG 4.46Å; L1337-K1341 HydrophobicContact CG-CD 4.26Å; L1337-K1341 HydrophobicContact CG-CG 4.42Å; L1337-K1341 VanDerWaalsContact O-CB 3.3Å; L1337-K1341 WeakPolarHBondContact O-CB 3.36Å; L1337-K1341 WeakPolarHBondContact O-CD 3.48Å; L1337-K1341 VanDerWaalsContact O-CG 3.28Å; L1337-K1341 WeakPolarHBondContact O-CG 3.36Å; L1337-K1341 PolarHBondContact O-N 3.1Å; S1338-K1341 PolarHBondContact O-N 3.17Å; K1341-S1343 VanDerWaalsContact C-N 3.32Å; K1341-S1343 PolarHBondContact O-N 3.11Å; K1341-F1344 PolarHBondContact O-N 3.06Å; K1341-F1344 VanDerWaalsContact O-N 3.15Å; K1341-N1345 VanDerWaalsContact O-CB 3.28Å; K1341-N1345 WeakPolarHBondContact O-CB 3.39Å; K1341-N1345 PolarHBondContact O-N 3.11Å
1342	L	74.2	Confident	68.2	Low	105.6 Å²	105.6	76.4 Å²	76.4	55%	0.553	40%	0.4	S	S	*	.	H	α-helix	trans	-60.8	-45.1	175.2	-75.7	165.7	0	0	0	110	S1338 E1339 F1344 N1345 M1346	S1338-L1342 VanDerWaalsContact O-CB 3.28Å; S1338-L1342 WeakPolarHBondContact O-CB 3.35Å; S1338-L1342 WeakPolarHBondContact O-CD1 3.28Å; S1338-L1342 VanDerWaalsContact O-CG 3.27Å; S1338-L1342 WeakPolarHBondContact O-CG 3.41Å; S1338-L1342 PolarHBondContact O-N 3.23Å; E1339-L1342 PolarHBondContact O-N 3.01Å; L1342-F1344 VanDerWaalsContact C-N 3.25Å; L1342-F1344 PolarHBondContact O-N 2.85Å; L1342-F1344 VanDerWaalsContact O-N 3.11Å; L1342-N1345 PolarHBondContact O-N 2.98Å; L1342-M1346 VanDerWaalsContact O-CB 3.3Å; L1342-M1346 WeakPolarHBondContact O-CB 3.29Å; L1342-M1346 VanDerWaalsContact O-CG 3.22Å; L1342-M1346 WeakPolarHBondContact O-CG 3.41Å; L1342-M1346 PolarHBondContact O-N 3.2Å; L1342-M1346 VanDerWaalsContact O-N 3.12Å
1343	S	71.5	Confident	67.3	Low	29.4 Å²	29.4	72 Å²	72	21%	0.206	38%	0.378	C	S	.	.	H	α-helix	trans	-61.8	-29	176.5	75	0	0	0	0	113.7	E1339 L1340 K1341 N1347 F1357	E1339-S1343 WeakPolarHBondContact O-CB 3.14Å; E1339-S1343 PolarHBondContact O-N 3.23Å; E1339-S1343 VanDerWaalsContact O-N 3.12Å; L1340-S1343 WeakPolarHBondContact CA-OG 2.86Å; L1340-S1343 PolarHBondContact O-N 2.87Å; L1340-S1343 PolarHBondContact O-OG 3.13Å; K1341-S1343 VanDerWaalsContact C-N 3.32Å; K1341-S1343 PolarHBondContact O-N 3.11Å; S1343-N1347 PolarHBondContact O-ND2 3.12Å; S1343-N1347 PolarHBondContact O-OD1 2.9Å; S1343-F1357 WeakPolarHBondContact O-CZ 3.28Å
1344	F	72.3	Confident	66.9	Low	3.8 Å²	3.8	74.4 Å²	74.4	2%	0.017	39%	0.391	C	S	.	.	H	α-helix	trans	-84.5	-41.1	177.6	-175.6	-107.9	0	0	0	113.1	L1316 N1317 I1320 L1340 K1341 L1342 K1348 F1357 Y1358	L1316-F1344 HydrophobicContact CB-CD2 4.47Å; L1316-F1344 HydrophobicContact CB-CE2 3.99Å; L1316-F1344 HydrophobicContact CB-CZ 4.09Å; L1316-F1344 HydrophobicContact CD1-CD2 4.29Å; L1316-F1344 HydrophobicContact CD1-CE2 3.87Å; L1316-F1344 HydrophobicContact CG-CE2 4.44Å; N1317-F1344 VanDerWaalsContact OD1-CE1 3.27Å; N1317-F1344 WeakPolarHBondContact OD1-CE1 3.24Å; N1317-F1344 WeakPolarHBondContact OD1-CZ 3.43Å; I1320-F1344 HydrophobicContact CD1-CB 4.46Å; I1320-F1344 HydrophobicContact CD1-CD1 3.45Å; I1320-F1344 VanDerWaalsContact CD1-CD1 3.42Å; I1320-F1344 HydrophobicContact CD1-CE1 3.65Å; I1320-F1344 HydrophobicContact CD1-CG 4.09Å; I1320-F1344 HydrophobicContact CD1-CZ 4.3Å; L1340-F1344 WeakPolarHBondContact O-CB 3.38Å; L1340-F1344 PolarHBondContact O-N 3Å; L1340-F1344 VanDerWaalsContact O-N 3.12Å; K1341-F1344 PolarHBondContact O-N 3.06Å; K1341-F1344 VanDerWaalsContact O-N 3.15Å; L1342-F1344 VanDerWaalsContact C-N 3.25Å; L1342-F1344 PolarHBondContact O-N 2.85Å; L1342-F1344 VanDerWaalsContact O-N 3.11Å; F1344-K1348 VanDerWaalsContact CE1-CE 3.43Å; F1344-K1348 PolarHBondContact O-N 3.23Å; F1344-F1357 HydrophobicContact CD2-CE1 4.45Å; F1344-Y1358 HydrophobicContact CE2-CD1 4.23Å; F1344-Y1358 AromaticContact CE2-CE1 3.89Å; F1344-Y1358 HydrophobicContact CE2-CE1 3.94Å; F1344-Y1358 HydrophobicContact CZ-CE1 4.44Å
1345	N	68.4	Low	66.8	Low	84.4 Å²	84.4	71.4 Å²	71.4	45%	0.451	38%	0.38	S	S	.	.	H	α-helix	trans	-80.6	-33.5	-175.6	-79.3	-11.9	0	0	0	113.5	K1341 L1342 N1347 K1348	K1341-N1345 VanDerWaalsContact O-CB 3.28Å; K1341-N1345 WeakPolarHBondContact O-CB 3.39Å; K1341-N1345 PolarHBondContact O-N 3.11Å; L1342-N1345 PolarHBondContact O-N 2.98Å; N1345-N1347 PolarHBondContact O-N 3.15Å; N1345-N1347 VanDerWaalsContact O-N 3.14Å; N1345-K1348 WeakPolarHBondContact O-CB 2.97Å; N1345-K1348 PolarHBondContact O-N 3.15Å; N1345-K1348 VanDerWaalsContact O-N 3.12Å
1346	M	58.2	Low	66.6	Low	133.4 Å²	133.4	68.8 Å²	68.8	66%	0.657	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.4	177.6	-71	-68.6	-77	0	0	112.1	L1342	L1342-M1346 VanDerWaalsContact O-CB 3.3Å; L1342-M1346 WeakPolarHBondContact O-CB 3.29Å; L1342-M1346 VanDerWaalsContact O-CG 3.22Å; L1342-M1346 WeakPolarHBondContact O-CG 3.41Å; L1342-M1346 PolarHBondContact O-N 3.2Å; L1342-M1346 VanDerWaalsContact O-N 3.12Å
1347	N	55.4	Low	66.7	Low	43.8 Å²	43.8	66.8 Å²	66.8	23%	0.234	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-1.9	-177.4	-67.4	6.4	0	0	0	113.8	S1343 N1345 I1349 S1350 I1353 F1357 L1903 T1904	S1343-N1347 PolarHBondContact O-ND2 3.12Å; S1343-N1347 PolarHBondContact O-OD1 2.9Å; N1345-N1347 PolarHBondContact O-N 3.15Å; N1345-N1347 VanDerWaalsContact O-N 3.14Å; N1347-I1349 VanDerWaalsContact C-N 3.28Å; N1347-I1349 PolarHBondContact O-N 3.28Å; N1347-S1350 PolarHBondContact O-N 3.08Å; N1347-S1350 PolarHBondContact O-OG 3.3Å; N1347-I1353 VanDerWaalsContact O-CD1 3.31Å; N1347-I1353 WeakPolarHBondContact O-CD1 3.43Å; N1347-I1353 WeakPolarHBondContact O-CG1 3.41Å; N1347-F1357 HydrophobicContact CB-CE1 4.18Å; N1347-F1357 HydrophobicContact CB-CE2 3.91Å; N1347-F1357 HydrophobicContact CB-CZ 3.76Å; N1347-F1357 WeakPolarHBondContact ND2-CD2 3.2Å; N1347-F1357 WeakPolarHBondContact ND2-CE2 3.27Å; N1347-F1357 WeakPolarHBondContact ND2-CZ 3.25Å; N1347-L1903 HydrophobicContact CB-CB 4.01Å; N1347-L1903 HydrophobicContact CB-CD2 4.47Å; N1347-L1903 PolarHBondContact ND2-O 3.12Å; N1347-L1903 WeakPolarHBondContact O-CD2 3.34Å; N1347-L1903 PolarHBondContact OD1-O 3.12Å; N1347-L1903 VanDerWaalsContact OD1-O 3.05Å; N1347-T1904 VanDerWaalsContact ND2-CG2 3.34Å; N1347-T1904 WeakPolarHBondContact ND2-CG2 3.3Å; N1347-T1904 PolarHBondContact ND2-N 2.81Å; N1347-T1904 WeakPolarHBondContact OD1-CA 3.36Å
1348	K	53.9	Low	66.7	Low	98.8 Å²	98.8	67 Å²	67	43%	0.43	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-14.5	174.3	-102.2	-179.9	176.2	174.9	0	113.4	N1317 F1344 N1345 S1350 I1353	N1317-K1348 PolarHBondContact OD1-NZ 2.93Å; F1344-K1348 VanDerWaalsContact CE1-CE 3.43Å; F1344-K1348 PolarHBondContact O-N 3.23Å; N1345-K1348 WeakPolarHBondContact O-CB 2.97Å; N1345-K1348 PolarHBondContact O-N 3.15Å; N1345-K1348 VanDerWaalsContact O-N 3.12Å; K1348-S1350 VanDerWaalsContact C-N 3.35Å; K1348-I1353 HydrophobicContact CG-CD1 4.5Å
1349	I	48.6	Very low	67	Low	153 Å²	153	65.4 Å²	65.4	79%	0.785	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-22	-173.1	-58.2	172	0	0	0	111.7	N1347	N1347-I1349 VanDerWaalsContact C-N 3.28Å; N1347-I1349 PolarHBondContact O-N 3.28Å
1350	S	47.8	Very low	67.1	Low	60.6 Å²	60.6	64.4 Å²	64.4	42%	0.424	34%	0.34	S	S	.	.	S	Bend	trans	-93.2	119.7	171.4	53.3	0	0	0	0	110.4	N1347 K1348 N1352 I1353 L1903	N1347-S1350 PolarHBondContact O-N 3.08Å; N1347-S1350 PolarHBondContact O-OG 3.3Å; K1348-S1350 VanDerWaalsContact C-N 3.35Å; S1350-N1352 VanDerWaalsContact C-N 3.34Å; S1350-N1352 PolarHBondContact O-N 3.24Å; S1350-N1352 VanDerWaalsContact O-N 3.15Å; S1350-I1353 WeakPolarHBondContact O-CG1 3.36Å; S1350-L1903 WeakPolarHBondContact OG-CD2 3.4Å
1351	S	47.8	Very low	67.4	Low	114.8 Å²	114.8	64 Å²	64	80%	0.803	34%	0.339	S	S	*	.	S	Bend	trans	-64.4	-5.4	-176.2	44.3	0	0	0	0	115.8	I1353	S1351-I1353 PolarHBondContact O-N 2.89Å
1352	N	50.8	Low	67.8	Low	118.6 Å²	118.6	61.7 Å²	61.7	63%	0.634	33%	0.328	S	S	*	.			trans	-114.2	73.9	180	-82.7	-19.7	0	0	0	111.3	S1350 D1354 L1903	S1350-N1352 VanDerWaalsContact C-N 3.34Å; S1350-N1352 PolarHBondContact O-N 3.24Å; S1350-N1352 VanDerWaalsContact O-N 3.15Å; N1352-D1354 PolarHBondContact O-N 3.21Å; N1352-L1903 WeakPolarHBondContact O-CD1 3.49Å
1353	I	58.3	Low	68.3	Low	31 Å²	31	58 Å²	58	16%	0.159	31%	0.313	C	S	.	.			trans	-84.6	112.8	177.6	-52.6	176.1	0	0	0	110	N1309 N1347 K1348 S1350 S1351 F1357 Y1358 L1903	N1309-I1353 PolarHBondContact ND2-O 3.23Å; N1347-I1353 VanDerWaalsContact O-CD1 3.31Å; N1347-I1353 WeakPolarHBondContact O-CD1 3.43Å; N1347-I1353 WeakPolarHBondContact O-CG1 3.41Å; K1348-I1353 HydrophobicContact CG-CD1 4.5Å; S1350-I1353 WeakPolarHBondContact O-CG1 3.36Å; S1351-I1353 PolarHBondContact O-N 2.89Å; I1353-F1357 HydrophobicContact CG2-CB 4.11Å; I1353-F1357 HydrophobicContact CG2-CD1 3.4Å; I1353-F1357 HydrophobicContact CG2-CE1 4.1Å; I1353-F1357 HydrophobicContact CG2-CG 4.03Å; I1353-Y1358 HydrophobicContact CB-CD2 4.41Å; I1353-Y1358 HydrophobicContact CB-CE2 3.63Å; I1353-Y1358 HydrophobicContact CD1-CE2 4.45Å; I1353-Y1358 WeakPolarHBondContact CD1-OH 3.23Å; I1353-Y1358 HydrophobicContact CG2-CD1 4.37Å; I1353-Y1358 HydrophobicContact CG2-CD2 3.7Å; I1353-Y1358 HydrophobicContact CG2-CE1 4.19Å; I1353-Y1358 HydrophobicContact CG2-CE2 3.2Å; I1353-Y1358 HydrophobicContact CG2-CG 4.34Å; I1353-L1903 HydrophobicContact CB-CD2 4Å; I1353-L1903 HydrophobicContact CD1-CD2 4.02Å; I1353-L1903 HydrophobicContact CG1-CD2 3.6Å; I1353-L1903 HydrophobicContact CG2-CD1 4.38Å; I1353-L1903 HydrophobicContact CG2-CD2 4.08Å
1354	D	68.7	Low	68.9	Low	78.8 Å²	78.8	62.7 Å²	62.7	42%	0.421	33%	0.326	S	S	.	.			trans	-63.5	140.7	178.3	-128.2	-25.4	0	0	0	112.3	N1352 K1356 F1357 Y1358 V1900 L1903	N1352-D1354 PolarHBondContact O-N 3.21Å; D1354-K1356 HydrophobicContact CB-CB 4.18Å; D1354-K1356 PolarHBondContact O-N 3.04Å; D1354-K1356 VanDerWaalsContact O-N 3.11Å; D1354-K1356 PolarHBondContact OD1-N 2.89Å; D1354-F1357 WeakPolarHBondContact O-CA 3.04Å; D1354-F1357 VanDerWaalsContact O-CB 3.26Å; D1354-F1357 WeakPolarHBondContact O-CB 3.24Å; D1354-F1357 PolarHBondContact O-N 3.13Å; D1354-F1357 VanDerWaalsContact O-N 3.08Å; D1354-Y1358 PolarHBondContact O-N 2.94Å; D1354-V1900 HydrophobicContact CB-CG1 4.48Å; D1354-V1900 WeakPolarHBondContact OD2-CG1 3.3Å; D1354-L1903 HydrophobicContact CB-CD1 4.3Å
1355	L	74.6	Confident	69.6	Low	37.8 Å²	37.8	62.5 Å²	62.5	20%	0.198	33%	0.326	C	S	.	.	H	α-helix	trans	-53.8	-35.9	174.5	175.7	78.6	0	0	0	111.6	L1308 N1309 L1312 F1357 Y1358 I1359 P1389	L1308-L1355 HydrophobicContact CB-CD1 4.27Å; L1308-L1355 HydrophobicContact CD2-CD1 4.06Å; L1308-L1355 HydrophobicContact CD2-CD2 4.36Å; L1308-L1355 HydrophobicContact CG-CD1 4.06Å; N1309-L1355 HydrophobicContact CB-CD1 4.22Å; L1312-L1355 HydrophobicContact CD1-CD1 4.18Å; L1355-F1357 VanDerWaalsContact C-N 3.29Å; L1355-F1357 PolarHBondContact O-N 3.26Å; L1355-Y1358 PolarHBondContact O-N 3.1Å; L1355-Y1358 VanDerWaalsContact O-N 3.16Å; L1355-I1359 HydrophobicContact CD1-CD1 4.36Å; L1355-I1359 HydrophobicContact CD1-CG1 4.33Å; L1355-I1359 HydrophobicContact CD2-CD1 4.23Å; L1355-I1359 HydrophobicContact CD2-CG1 4.27Å; L1355-I1359 HydrophobicContact CG-CD1 3.9Å; L1355-I1359 HydrophobicContact CG-CG1 4.35Å; L1355-I1359 VanDerWaalsContact O-CG1 3.27Å; L1355-I1359 WeakPolarHBondContact O-CG1 3.3Å; L1355-I1359 PolarHBondContact O-N 3.04Å; L1355-P1389 HydrophobicContact CD1-CG 4.04Å; L1355-P1389 HydrophobicContact CD2-CG 3.47Å; L1355-P1389 VanDerWaalsContact CD2-CG 3.44Å
1356	K	76	Confident	70.6	Confident	79.6 Å²	79.6	58.5 Å²	58.5	35%	0.346	30%	0.304	S	S	.	.	H	α-helix	trans	-56.9	-40.5	176.1	-132.6	178.4	177.7	-178.6	0	112.4	D1354 I1359 Q1360 D1908 S1928 T1930 S1944	D1354-K1356 HydrophobicContact CB-CB 4.18Å; D1354-K1356 PolarHBondContact O-N 3.04Å; D1354-K1356 VanDerWaalsContact O-N 3.11Å; D1354-K1356 PolarHBondContact OD1-N 2.89Å; K1356-I1359 PolarHBondContact O-N 3.24Å; K1356-Q1360 WeakPolarHBondContact O-CB 3.28Å; K1356-Q1360 VanDerWaalsContact O-CG 3.26Å; K1356-Q1360 WeakPolarHBondContact O-CG 3.32Å; K1356-Q1360 PolarHBondContact O-N 3.06Å; K1356-Q1360 VanDerWaalsContact O-N 3.11Å; K1356-D1908 IonicContact NZ-OD2 3.38Å; K1356-D1908 PolarHBondContact NZ-OD2 2.86Å; K1356-S1928 PolarHBondContact NZ-OG 2.9Å; K1356-S1928 VanDerWaalsContact NZ-OG 3.11Å; K1356-T1930 HydrophobicContact CD-CG2 4.18Å; K1356-T1930 PolarHBondContact NZ-OG1 3.05Å; K1356-S1944 WeakPolarHBondContact CE-OG 3.47Å; K1356-S1944 PolarHBondContact NZ-OG 2.88Å
1357	F	79	Confident	71.8	Confident	20 Å²	20	56.4 Å²	56.4	9%	0.088	30%	0.296	C	S	.	.	H	α-helix	trans	-65.1	-46.6	177.8	172.3	-98.3	0	0	0	111.3	S1343 F1344 N1347 I1353 D1354 L1355 I1359 Q1360 C1361 T1904	S1343-F1357 WeakPolarHBondContact O-CZ 3.28Å; F1344-F1357 HydrophobicContact CD2-CE1 4.45Å; N1347-F1357 HydrophobicContact CB-CE1 4.18Å; N1347-F1357 HydrophobicContact CB-CE2 3.91Å; N1347-F1357 HydrophobicContact CB-CZ 3.76Å; N1347-F1357 WeakPolarHBondContact ND2-CD2 3.2Å; N1347-F1357 WeakPolarHBondContact ND2-CE2 3.27Å; N1347-F1357 WeakPolarHBondContact ND2-CZ 3.25Å; I1353-F1357 HydrophobicContact CG2-CB 4.11Å; I1353-F1357 HydrophobicContact CG2-CD1 3.4Å; I1353-F1357 HydrophobicContact CG2-CE1 4.1Å; I1353-F1357 HydrophobicContact CG2-CG 4.03Å; D1354-F1357 WeakPolarHBondContact O-CA 3.04Å; D1354-F1357 VanDerWaalsContact O-CB 3.26Å; D1354-F1357 WeakPolarHBondContact O-CB 3.24Å; D1354-F1357 PolarHBondContact O-N 3.13Å; D1354-F1357 VanDerWaalsContact O-N 3.08Å; L1355-F1357 VanDerWaalsContact C-N 3.29Å; L1355-F1357 PolarHBondContact O-N 3.26Å; F1357-I1359 VanDerWaalsContact C-N 3.29Å; F1357-I1359 PolarHBondContact O-N 3.15Å; F1357-Q1360 WeakPolarHBondContact O-CB 3.46Å; F1357-Q1360 PolarHBondContact O-N 3.16Å; F1357-Q1360 VanDerWaalsContact O-N 3.14Å; F1357-C1361 VanDerWaalsContact CE1-SG 3.51Å; F1357-C1361 WeakPolarHBondContact CE1-SG 3.3Å; F1357-C1361 WeakPolarHBondContact CE2-SG 3.44Å; F1357-C1361 WeakPolarHBondContact CZ-SG 3.24Å; F1357-C1361 WeakPolarHBondContact O-CB 3.38Å; F1357-C1361 PolarHBondContact O-N 3.09Å; F1357-C1361 PolarHBondContact O-SG 3.28Å; F1357-T1904 HydrophobicContact CE2-CG2 4.49Å
1358	Y	81	Confident	73.3	Confident	8.6 Å²	8.6	54.7 Å²	54.7	3%	0.034	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-36.6	177.4	-72.8	-64.8	0	0	0	112.8	N1309 Q1313 L1316 F1344 I1353 D1354 L1355 Q1360 C1361 F1362	N1309-Y1358 HydrophobicContact CB-CD2 4.37Å; N1309-Y1358 WeakPolarHBondContact OD1-CD2 3.37Å; N1309-Y1358 WeakPolarHBondContact OD1-CE2 3.38Å; Q1313-Y1358 HydrophobicContact CB-CD1 4.38Å; Q1313-Y1358 HydrophobicContact CB-CE1 3.88Å; Q1313-Y1358 HydrophobicContact CB-CE2 4.31Å; Q1313-Y1358 VanDerWaalsContact CD-OH 3.29Å; Q1313-Y1358 HydrophobicContact CG-CE1 3.95Å; Q1313-Y1358 VanDerWaalsContact CG-OH 3.24Å; Q1313-Y1358 WeakPolarHBondContact CG-OH 3.31Å; Q1313-Y1358 PolarHBondContact NE2-OH 3.08Å; Q1313-Y1358 VanDerWaalsContact NE2-OH 3.11Å; L1316-Y1358 HydrophobicContact CD1-CD1 3.81Å; L1316-Y1358 HydrophobicContact CD1-CE1 4.5Å; F1344-Y1358 HydrophobicContact CE2-CD1 4.23Å; F1344-Y1358 AromaticContact CE2-CE1 3.89Å; F1344-Y1358 HydrophobicContact CE2-CE1 3.94Å; F1344-Y1358 HydrophobicContact CZ-CE1 4.44Å; I1353-Y1358 HydrophobicContact CB-CD2 4.41Å; I1353-Y1358 HydrophobicContact CB-CE2 3.63Å; I1353-Y1358 HydrophobicContact CD1-CE2 4.45Å; I1353-Y1358 WeakPolarHBondContact CD1-OH 3.23Å; I1353-Y1358 HydrophobicContact CG2-CD1 4.37Å; I1353-Y1358 HydrophobicContact CG2-CD2 3.7Å; I1353-Y1358 HydrophobicContact CG2-CE1 4.19Å; I1353-Y1358 HydrophobicContact CG2-CE2 3.2Å; I1353-Y1358 HydrophobicContact CG2-CG 4.34Å; D1354-Y1358 PolarHBondContact O-N 2.94Å; L1355-Y1358 PolarHBondContact O-N 3.1Å; L1355-Y1358 VanDerWaalsContact O-N 3.16Å; Y1358-Q1360 PolarHBondContact O-N 2.97Å; Y1358-C1361 PolarHBondContact O-N 3.32Å; Y1358-F1362 VanDerWaalsContact O-CB 3.22Å; Y1358-F1362 WeakPolarHBondContact O-CB 3.39Å; Y1358-F1362 PolarHBondContact O-N 3.29Å
1359	I	84.1	Confident	74.8	Confident	16 Å²	16	50 Å²	50	8%	0.082	27%	0.266	C	S	.	.	H	α-helix	trans	-59.4	-46.8	173.1	-73	175.4	0	0	0	111	L1312 L1355 K1356 F1357 C1361 F1362 A1363 E1393 W1394 L1946	L1312-I1359 HydrophobicContact CD1-CG1 3.93Å; L1355-I1359 HydrophobicContact CD1-CD1 4.36Å; L1355-I1359 HydrophobicContact CD1-CG1 4.33Å; L1355-I1359 HydrophobicContact CD2-CD1 4.23Å; L1355-I1359 HydrophobicContact CD2-CG1 4.27Å; L1355-I1359 HydrophobicContact CG-CD1 3.9Å; L1355-I1359 HydrophobicContact CG-CG1 4.35Å; L1355-I1359 VanDerWaalsContact O-CG1 3.27Å; L1355-I1359 WeakPolarHBondContact O-CG1 3.3Å; L1355-I1359 PolarHBondContact O-N 3.04Å; K1356-I1359 PolarHBondContact O-N 3.24Å; F1357-I1359 VanDerWaalsContact C-N 3.29Å; F1357-I1359 PolarHBondContact O-N 3.15Å; I1359-C1361 VanDerWaalsContact C-N 3.34Å; I1359-C1361 PolarHBondContact O-N 2.72Å; I1359-F1362 WeakPolarHBondContact O-CB 3.34Å; I1359-F1362 PolarHBondContact O-N 2.94Å; I1359-A1363 WeakPolarHBondContact O-CB 3.37Å; I1359-A1363 PolarHBondContact O-N 3.29Å; I1359-E1393 HydrophobicContact CD1-CB 4.24Å; I1359-E1393 WeakPolarHBondContact CG2-O 3.48Å; I1359-W1394 HydrophobicContact CD1-CB 4.18Å; I1359-W1394 HydrophobicContact CG1-CB 3.78Å; I1359-L1946 HydrophobicContact CG2-CD2 3.84Å
1360	Q	81.6	Confident	76.4	Confident	71.4 Å²	71.4	43.7 Å²	43.7	33%	0.334	24%	0.239	S	C	.	.	H	α-helix	trans	-68.9	-42.1	179.9	-71.8	-179.5	-9.7	0	0	112.8	K1356 F1357 Y1358 F1362 A1363 R1364 S1928 L1946	K1356-Q1360 WeakPolarHBondContact O-CB 3.28Å; K1356-Q1360 VanDerWaalsContact O-CG 3.26Å; K1356-Q1360 WeakPolarHBondContact O-CG 3.32Å; K1356-Q1360 PolarHBondContact O-N 3.06Å; K1356-Q1360 VanDerWaalsContact O-N 3.11Å; F1357-Q1360 WeakPolarHBondContact O-CB 3.46Å; F1357-Q1360 PolarHBondContact O-N 3.16Å; F1357-Q1360 VanDerWaalsContact O-N 3.14Å; Y1358-Q1360 PolarHBondContact O-N 2.97Å; Q1360-F1362 PolarHBondContact O-N 2.84Å; Q1360-A1363 PolarHBondContact O-N 3.28Å; Q1360-R1364 WeakPolarHBondContact O-CB 3.39Å; Q1360-R1364 WeakPolarHBondContact O-CG 3.37Å; Q1360-R1364 PolarHBondContact O-N 3.14Å; Q1360-R1364 VanDerWaalsContact O-N 3.1Å; Q1360-S1928 PolarHBondContact NE2-OG 2.96Å; Q1360-L1946 HydrophobicContact CG-CD1 4.25Å; Q1360-L1946 HydrophobicContact CG-CD2 4.2Å
1361	C	83.1	Confident	78.1	Confident	6 Å²	6	48.4 Å²	48.4	4%	0.041	25%	0.248	C	C	.	.	H	α-helix	trans	-58.4	-49.5	172.1	-73.8	0	0	0	0	110.4	L1316 F1357 Y1358 I1359 A1363 R1364 F1365	L1316-C1361 HydrophobicContact CD1-CB 3.91Å; L1316-C1361 HydrophobicContact CD2-CB 4.27Å; F1357-C1361 VanDerWaalsContact CE1-SG 3.51Å; F1357-C1361 WeakPolarHBondContact CE1-SG 3.3Å; F1357-C1361 WeakPolarHBondContact CE2-SG 3.44Å; F1357-C1361 WeakPolarHBondContact CZ-SG 3.24Å; F1357-C1361 WeakPolarHBondContact O-CB 3.38Å; F1357-C1361 PolarHBondContact O-N 3.09Å; F1357-C1361 PolarHBondContact O-SG 3.28Å; Y1358-C1361 PolarHBondContact O-N 3.32Å; I1359-C1361 VanDerWaalsContact C-N 3.34Å; I1359-C1361 PolarHBondContact O-N 2.72Å; C1361-A1363 VanDerWaalsContact C-N 3.33Å; C1361-A1363 PolarHBondContact O-N 3.29Å; C1361-R1364 WeakPolarHBondContact O-CB 3.3Å; C1361-R1364 PolarHBondContact O-N 3.04Å; C1361-R1364 VanDerWaalsContact O-N 3.11Å; C1361-F1365 VanDerWaalsContact O-CD2 3.25Å; C1361-F1365 WeakPolarHBondContact O-CD2 3.35Å; C1361-F1365 PolarHBondContact O-N 3Å
1362	F	87.5	Confident	79.6	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.1	-45.1	178.5	-172	-107.2	0	0	0	112	L1312 W1315 L1316 L1319 Y1358 I1359 Q1360 R1364 F1365 I1366 F1379 W1394 F1405	L1312-F1362 HydrophobicContact CD2-CB 4.11Å; L1312-F1362 HydrophobicContact CD2-CD1 3.95Å; L1312-F1362 HydrophobicContact CD2-CD2 3.96Å; L1312-F1362 HydrophobicContact CD2-CE1 4.35Å; L1312-F1362 HydrophobicContact CD2-CE2 4.38Å; L1312-F1362 HydrophobicContact CD2-CG 3.74Å; L1312-F1362 HydrophobicContact CD2-CZ 4.43Å; W1315-F1362 HydrophobicContact CB-CE2 4.39Å; W1315-F1362 HydrophobicContact CD2-CE2 4.44Å; W1315-F1362 AromaticContact CE3-CE2 3.68Å; W1315-F1362 HydrophobicContact CE3-CE2 3.68Å; W1315-F1362 AromaticContact CE3-CZ 3.71Å; W1315-F1362 HydrophobicContact CE3-CZ 3.71Å; W1315-F1362 HydrophobicContact CZ3-CE2 4.35Å; W1315-F1362 AromaticContact CZ3-CZ 3.89Å; W1315-F1362 HydrophobicContact CZ3-CZ 3.91Å; L1316-F1362 HydrophobicContact CD2-CB 4.47Å; L1316-F1362 HydrophobicContact CD2-CD2 4.43Å; L1316-F1362 HydrophobicContact CG-CD2 4.49Å; L1319-F1362 HydrophobicContact CD1-CE2 4.39Å; Y1358-F1362 VanDerWaalsContact O-CB 3.22Å; Y1358-F1362 WeakPolarHBondContact O-CB 3.39Å; Y1358-F1362 PolarHBondContact O-N 3.29Å; I1359-F1362 WeakPolarHBondContact O-CB 3.34Å; I1359-F1362 PolarHBondContact O-N 2.94Å; Q1360-F1362 PolarHBondContact O-N 2.84Å; F1362-R1364 VanDerWaalsContact C-N 3.34Å; F1362-R1364 PolarHBondContact O-N 3.13Å; F1362-F1365 PolarHBondContact O-N 2.95Å; F1362-I1366 HydrophobicContact CD1-CG1 4.04Å; F1362-I1366 HydrophobicContact CD2-CG1 4.48Å; F1362-I1366 HydrophobicContact CE1-CD1 4.05Å; F1362-I1366 HydrophobicContact CE1-CG1 3.72Å; F1362-I1366 HydrophobicContact CE2-CD1 4.13Å; F1362-I1366 HydrophobicContact CE2-CG1 4.27Å; F1362-I1366 HydrophobicContact CG-CG1 4.43Å; F1362-I1366 HydrophobicContact CZ-CD1 3.7Å; F1362-I1366 HydrophobicContact CZ-CG1 3.85Å; F1362-I1366 WeakPolarHBondContact O-CB 3.36Å; F1362-I1366 VanDerWaalsContact O-CG1 3.28Å; F1362-I1366 WeakPolarHBondContact O-CG1 3.34Å; F1362-I1366 PolarHBondContact O-N 3.13Å; F1362-F1379 AromaticContact CE2-CE1 3.88Å; F1362-F1379 HydrophobicContact CE2-CE1 4.13Å; F1362-F1379 HydrophobicContact CE2-CZ 4.35Å; F1362-F1379 HydrophobicContact CZ-CD1 4.39Å; F1362-F1379 AromaticContact CZ-CE1 3.93Å; F1362-F1379 HydrophobicContact CZ-CE1 4.13Å; F1362-F1379 HydrophobicContact CZ-CZ 4.34Å; F1362-W1394 HydrophobicContact CD1-CE3 4.33Å; F1362-W1394 WeakPolarHBondContact CD1-O 3.42Å; F1362-W1394 AromaticContact CE1-CE3 3.88Å; F1362-W1394 HydrophobicContact CE1-CE3 3.91Å; F1362-W1394 AromaticContact CE1-CZ3 4Å; F1362-W1394 HydrophobicContact CE1-CZ3 4.1Å; F1362-W1394 HydrophobicContact CZ-CZ3 4.45Å; F1362-F1405 HydrophobicContact CE1-CE1 4.46Å; F1362-F1405 HydrophobicContact CE1-CZ 4.11Å; F1362-F1405 HydrophobicContact CZ-CE1 4.42Å; F1362-F1405 AromaticContact CZ-CZ 4Å; F1362-F1405 HydrophobicContact CZ-CZ 4.05Å
1363	A	85.7	Confident	80.6	Confident	28 Å²	28	42.3 Å²	42.3	23%	0.231	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-42.1	175.2	0	0	0	0	0	112.9	I1359 Q1360 C1361 I1366 N1367 P1396	I1359-A1363 WeakPolarHBondContact O-CB 3.37Å; I1359-A1363 PolarHBondContact O-N 3.29Å; Q1360-A1363 PolarHBondContact O-N 3.28Å; C1361-A1363 VanDerWaalsContact C-N 3.33Å; C1361-A1363 PolarHBondContact O-N 3.29Å; A1363-I1366 PolarHBondContact O-N 3.15Å; A1363-N1367 WeakPolarHBondContact O-CB 3.28Å; A1363-N1367 VanDerWaalsContact O-CG 3.28Å; A1363-N1367 PolarHBondContact O-N 3.27Å; A1363-N1367 PolarHBondContact O-ND2 3.14Å; A1363-P1396 HydrophobicContact CB-CG 4.37Å
1364	R	84.8	Confident	81.4	Confident	127.8 Å²	127.8	48.6 Å²	48.6	48%	0.482	24%	0.241	S	C	.	.	H	α-helix	trans	-64.3	-41.6	175.1	-70.3	176.4	71.2	170.3	2.5	112	L1340 Q1360 C1361 F1362 N1367 F1368	L1340-R1364 HydrophobicContact CD2-CB 3.93Å; Q1360-R1364 WeakPolarHBondContact O-CB 3.39Å; Q1360-R1364 WeakPolarHBondContact O-CG 3.37Å; Q1360-R1364 PolarHBondContact O-N 3.14Å; Q1360-R1364 VanDerWaalsContact O-N 3.1Å; C1361-R1364 WeakPolarHBondContact O-CB 3.3Å; C1361-R1364 PolarHBondContact O-N 3.04Å; C1361-R1364 VanDerWaalsContact O-N 3.11Å; F1362-R1364 VanDerWaalsContact C-N 3.34Å; F1362-R1364 PolarHBondContact O-N 3.13Å; R1364-N1367 PolarHBondContact O-N 3.09Å; R1364-F1368 WeakPolarHBondContact O-CB 3.4Å; R1364-F1368 PolarHBondContact O-N 3.17Å
1365	F	87.2	Confident	82	Confident	0.6 Å²	0.6	46.7 Å²	46.7	0%	0.003	23%	0.23	C	C	.	.	H	α-helix	trans	-65.3	-44.2	175.6	-90.9	-94.7	0	0	0	111.9	L1316 L1319 I1320 L1323 L1337 L1340 C1361 F1362 N1367 F1368 L1369	L1316-F1365 HydrophobicContact CD2-CB 4.05Å; L1316-F1365 HydrophobicContact CD2-CD1 4.38Å; L1316-F1365 HydrophobicContact CD2-CD2 3.42Å; L1316-F1365 VanDerWaalsContact CD2-CD2 3.43Å; L1316-F1365 HydrophobicContact CD2-CE2 3.9Å; L1316-F1365 HydrophobicContact CD2-CG 3.7Å; L1319-F1365 HydrophobicContact CB-CD1 4.34Å; L1319-F1365 HydrophobicContact CB-CE1 4.5Å; L1319-F1365 HydrophobicContact CD1-CB 4.45Å; I1320-F1365 HydrophobicContact CD1-CE1 4.48Å; I1320-F1365 HydrophobicContact CD1-CZ 3.99Å; I1320-F1365 HydrophobicContact CG1-CE1 3.69Å; I1320-F1365 HydrophobicContact CG1-CE2 4.49Å; I1320-F1365 HydrophobicContact CG1-CZ 3.57Å; I1320-F1365 VanDerWaalsContact CG1-CZ 3.41Å; L1323-F1365 HydrophobicContact CD1-CD1 3.87Å; L1323-F1365 HydrophobicContact CD1-CE1 4Å; L1337-F1365 HydrophobicContact CD1-CE1 4.29Å; L1340-F1365 HydrophobicContact CB-CE2 4.09Å; L1340-F1365 HydrophobicContact CB-CZ 4.05Å; C1361-F1365 VanDerWaalsContact O-CD2 3.25Å; C1361-F1365 WeakPolarHBondContact O-CD2 3.35Å; C1361-F1365 PolarHBondContact O-N 3Å; F1362-F1365 PolarHBondContact O-N 2.95Å; F1365-N1367 VanDerWaalsContact C-N 3.34Å; F1365-N1367 PolarHBondContact O-N 3.1Å; F1365-F1368 CarbonylContact O-C 3.32Å; F1365-F1368 WeakPolarHBondContact O-CA 3.29Å; F1365-F1368 VanDerWaalsContact O-CB 3.29Å; F1365-F1368 WeakPolarHBondContact O-CB 3.37Å; F1365-F1368 PolarHBondContact O-N 3.26Å; F1365-F1368 VanDerWaalsContact O-N 3.09Å; F1365-L1369 WeakPolarHBondContact O-CG 3.35Å; F1365-L1369 PolarHBondContact O-N 3.14Å
1366	I	87.6	Confident	82.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.3	-45.1	175.2	-67.4	-63.4	0	0	0	110.7	F1362 A1363 F1368 L1369 G1370 F1379 P1396 L1399 P1400 V1403 F1405	F1362-I1366 HydrophobicContact CD1-CG1 4.04Å; F1362-I1366 HydrophobicContact CD2-CG1 4.48Å; F1362-I1366 HydrophobicContact CE1-CD1 4.05Å; F1362-I1366 HydrophobicContact CE1-CG1 3.72Å; F1362-I1366 HydrophobicContact CE2-CD1 4.13Å; F1362-I1366 HydrophobicContact CE2-CG1 4.27Å; F1362-I1366 HydrophobicContact CG-CG1 4.43Å; F1362-I1366 HydrophobicContact CZ-CD1 3.7Å; F1362-I1366 HydrophobicContact CZ-CG1 3.85Å; F1362-I1366 WeakPolarHBondContact O-CB 3.36Å; F1362-I1366 VanDerWaalsContact O-CG1 3.28Å; F1362-I1366 WeakPolarHBondContact O-CG1 3.34Å; F1362-I1366 PolarHBondContact O-N 3.13Å; A1363-I1366 PolarHBondContact O-N 3.15Å; I1366-F1368 VanDerWaalsContact C-N 3.29Å; I1366-F1368 PolarHBondContact O-N 3.29Å; I1366-L1369 HydrophobicContact CD1-CD1 4.13Å; I1366-L1369 WeakPolarHBondContact O-CB 3.27Å; I1366-L1369 PolarHBondContact O-N 3.04Å; I1366-L1369 VanDerWaalsContact O-N 3.14Å; I1366-G1370 PolarHBondContact O-N 3.17Å; I1366-F1379 HydrophobicContact CD1-CD2 4.43Å; I1366-F1379 HydrophobicContact CD1-CE1 4.36Å; I1366-F1379 HydrophobicContact CD1-CE2 3.67Å; I1366-F1379 HydrophobicContact CD1-CZ 3.6Å; I1366-P1396 HydrophobicContact CB-CG 4.29Å; I1366-P1396 HydrophobicContact CG1-CG 4.48Å; I1366-P1396 HydrophobicContact CG2-CG 4.15Å; I1366-L1399 HydrophobicContact CG2-CD2 4.22Å; I1366-P1400 HydrophobicContact CG2-CG 4.29Å; I1366-P1400 VanDerWaalsContact O-CG 3.29Å; I1366-P1400 WeakPolarHBondContact O-CG 3.28Å; I1366-V1403 HydrophobicContact CD1-CG1 4.29Å; I1366-V1403 HydrophobicContact CG2-CG1 4.38Å; I1366-V1403 HydrophobicContact CG2-CG2 4.5Å; I1366-F1405 HydrophobicContact CD1-CE2 4.48Å; I1366-F1405 HydrophobicContact CD1-CZ 4.21Å
1367	N	85.1	Confident	82.8	Confident	89.6 Å²	89.6	42.8 Å²	42.8	48%	0.479	21%	0.212	S	C	.	.	H	α-helix	trans	-61.1	-37.8	174.3	-74.1	-21.5	0	0	0	112.2	A1363 R1364 F1365 L1369 G1370	A1363-N1367 WeakPolarHBondContact O-CB 3.28Å; A1363-N1367 VanDerWaalsContact O-CG 3.28Å; A1363-N1367 PolarHBondContact O-N 3.27Å; A1363-N1367 PolarHBondContact O-ND2 3.14Å; R1364-N1367 PolarHBondContact O-N 3.09Å; F1365-N1367 VanDerWaalsContact C-N 3.34Å; F1365-N1367 PolarHBondContact O-N 3.1Å; N1367-L1369 VanDerWaalsContact C-N 3.33Å; N1367-L1369 PolarHBondContact O-N 3.06Å; N1367-G1370 PolarHBondContact O-N 3.21Å; N1367-G1370 VanDerWaalsContact O-N 3.11Å
1368	F	85.4	Confident	83	Confident	7.6 Å²	7.6	41.9 Å²	41.9	3%	0.033	21%	0.208	C	C	.	.	H	α-helix	trans	-62.7	-39.1	175	-178.6	-99.2	0	0	0	112.7	L1323 L1333 L1336 L1337 L1340 R1364 F1365 I1366 G1370 Y1371	L1323-F1368 HydrophobicContact CD1-CD1 3.89Å; L1323-F1368 HydrophobicContact CD1-CE1 4Å; L1323-F1368 HydrophobicContact CD2-CD1 4.36Å; L1323-F1368 HydrophobicContact CD2-CE1 4.07Å; L1323-F1368 HydrophobicContact CG-CE1 4.45Å; L1333-F1368 HydrophobicContact CB-CZ 4.39Å; L1333-F1368 HydrophobicContact CD2-CE2 4.22Å; L1333-F1368 HydrophobicContact CD2-CZ 4.23Å; L1336-F1368 HydrophobicContact CB-CD2 4.28Å; L1336-F1368 HydrophobicContact CB-CE2 3.66Å; L1336-F1368 HydrophobicContact CD1-CE2 4.37Å; L1337-F1368 HydrophobicContact CB-CE1 4.46Å; L1337-F1368 HydrophobicContact CB-CZ 4.15Å; L1337-F1368 HydrophobicContact CD1-CE1 4.34Å; L1340-F1368 HydrophobicContact CD1-CB 3.72Å; L1340-F1368 HydrophobicContact CD1-CD1 4.35Å; L1340-F1368 HydrophobicContact CD1-CD2 3.85Å; L1340-F1368 HydrophobicContact CD1-CE2 4.23Å; L1340-F1368 HydrophobicContact CD1-CG 3.71Å; L1340-F1368 VanDerWaalsContact CD1-CG 3.45Å; R1364-F1368 WeakPolarHBondContact O-CB 3.4Å; R1364-F1368 PolarHBondContact O-N 3.17Å; F1365-F1368 CarbonylContact O-C 3.32Å; F1365-F1368 WeakPolarHBondContact O-CA 3.29Å; F1365-F1368 VanDerWaalsContact O-CB 3.29Å; F1365-F1368 WeakPolarHBondContact O-CB 3.37Å; F1365-F1368 PolarHBondContact O-N 3.26Å; F1365-F1368 VanDerWaalsContact O-N 3.09Å; I1366-F1368 VanDerWaalsContact C-N 3.29Å; I1366-F1368 PolarHBondContact O-N 3.29Å; F1368-G1370 PolarHBondContact O-N 3.27Å; F1368-G1370 VanDerWaalsContact O-N 3.15Å; F1368-Y1371 HydrophobicContact CD2-CD2 4.33Å; F1368-Y1371 WeakPolarHBondContact O-CB 2.95Å; F1368-Y1371 WeakPolarHBondContact O-CD2 3.05Å; F1368-Y1371 PolarHBondContact O-N 2.95Å; F1368-Y1371 VanDerWaalsContact O-N 3.11Å
1369	L	85.5	Confident	83.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-57.5	-29.2	173.8	-59	-175.7	0	0	0	111.8	L1319 L1323 F1365 I1366 N1367 Y1371 L1372 F1377 F1379 N1402 V1403	L1319-L1369 HydrophobicContact CD2-CD1 4.36Å; L1319-L1369 HydrophobicContact CD2-CD2 4.42Å; L1323-L1369 HydrophobicContact CD1-CD2 4.17Å; L1323-L1369 HydrophobicContact CD2-CD2 3.84Å; L1323-L1369 HydrophobicContact CG-CD2 4.44Å; F1365-L1369 WeakPolarHBondContact O-CG 3.35Å; F1365-L1369 PolarHBondContact O-N 3.14Å; I1366-L1369 HydrophobicContact CD1-CD1 4.13Å; I1366-L1369 WeakPolarHBondContact O-CB 3.27Å; I1366-L1369 PolarHBondContact O-N 3.04Å; I1366-L1369 VanDerWaalsContact O-N 3.14Å; N1367-L1369 VanDerWaalsContact C-N 3.33Å; N1367-L1369 PolarHBondContact O-N 3.06Å; L1369-Y1371 PolarHBondContact O-N 3.13Å; L1369-L1372 HydrophobicContact CD2-CD1 4.28Å; L1369-L1372 WeakPolarHBondContact O-CA 3.43Å; L1369-L1372 WeakPolarHBondContact O-CB 3.32Å; L1369-L1372 PolarHBondContact O-N 3.23Å; L1369-F1377 HydrophobicContact CB-CD2 4.21Å; L1369-F1377 HydrophobicContact CB-CE2 4.24Å; L1369-F1377 HydrophobicContact CD1-CB 4.28Å; L1369-F1377 HydrophobicContact CD1-CD1 3.98Å; L1369-F1377 HydrophobicContact CD1-CD2 4.09Å; L1369-F1377 HydrophobicContact CD1-CE1 4.33Å; L1369-F1377 HydrophobicContact CD1-CE2 4.41Å; L1369-F1377 HydrophobicContact CD1-CG 3.85Å; L1369-F1377 HydrophobicContact CD1-CZ 4.42Å; L1369-F1377 HydrophobicContact CD2-CD1 4.42Å; L1369-F1377 HydrophobicContact CD2-CD2 4.33Å; L1369-F1377 HydrophobicContact CD2-CE1 3.94Å; L1369-F1377 HydrophobicContact CD2-CE2 3.92Å; L1369-F1377 HydrophobicContact CD2-CZ 3.68Å; L1369-F1377 HydrophobicContact CG-CD2 4.44Å; L1369-F1377 HydrophobicContact CG-CE2 4.41Å; L1369-F1377 HydrophobicContact CG-CZ 4.41Å; L1369-F1379 HydrophobicContact CD1-CE2 4.04Å; L1369-F1379 HydrophobicContact CD1-CZ 3.94Å; L1369-N1402 PolarHBondContact O-ND2 3.29Å; L1369-N1402 PolarHBondContact O-OD1 3.11Å; L1369-V1403 HydrophobicContact CB-CG2 3.9Å; L1369-V1403 HydrophobicContact CD1-CG2 4.1Å
1370	G	82.7	Confident	83.3	Confident	21.8 Å²	21.8	40.7 Å²	40.7	23%	0.225	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.8	176.3	0	0	0	0	0	115.3	I1366 N1367 F1368 L1372 N1373 P1400	I1366-G1370 PolarHBondContact O-N 3.17Å; N1367-G1370 PolarHBondContact O-N 3.21Å; N1367-G1370 VanDerWaalsContact O-N 3.11Å; F1368-G1370 PolarHBondContact O-N 3.27Å; F1368-G1370 VanDerWaalsContact O-N 3.15Å; G1370-L1372 VanDerWaalsContact C-N 3.32Å; G1370-N1373 PolarHBondContact O-OD1 2.71Å; G1370-P1400 VanDerWaalsContact CA-CB 3.46Å
1371	Y	82.6	Confident	83.4	Confident	159 Å²	159	37.4 Å²	37.4	62%	0.624	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-18.4	173.1	-62.7	-76.2	0	0	0	112.7	F1368 L1369 N1373	F1368-Y1371 HydrophobicContact CD2-CD2 4.33Å; F1368-Y1371 WeakPolarHBondContact O-CB 2.95Å; F1368-Y1371 WeakPolarHBondContact O-CD2 3.05Å; F1368-Y1371 PolarHBondContact O-N 2.95Å; F1368-Y1371 VanDerWaalsContact O-N 3.11Å; L1369-Y1371 PolarHBondContact O-N 3.13Å; Y1371-N1373 VanDerWaalsContact C-N 3.33Å; Y1371-N1373 PolarHBondContact O-N 2.92Å; Y1371-N1373 VanDerWaalsContact O-N 3.12Å
1372	L	80	Confident	83.4	Confident	13.4 Å²	13.4	37.3 Å²	37.3	7%	0.07	19%	0.186	C	C	.	.			trans	-88.8	65.6	-178.7	-58.7	177.2	0	0	0	111.6	L1323 I1326 L1333 L1369 G1370 D1374 I1375 F1377 N1402	L1323-L1372 HydrophobicContact CD2-CD1 3.45Å; L1323-L1372 VanDerWaalsContact CD2-CD1 3.47Å; I1326-L1372 HydrophobicContact CG2-CD1 4.46Å; I1326-L1372 HydrophobicContact CG2-CD2 4.39Å; L1333-L1372 HydrophobicContact CD1-CD2 3.76Å; L1369-L1372 HydrophobicContact CD2-CD1 4.28Å; L1369-L1372 WeakPolarHBondContact O-CA 3.43Å; L1369-L1372 WeakPolarHBondContact O-CB 3.32Å; L1369-L1372 PolarHBondContact O-N 3.23Å; G1370-L1372 VanDerWaalsContact C-N 3.32Å; L1372-D1374 PolarHBondContact O-N 3.06Å; L1372-D1374 VanDerWaalsContact O-N 3.1Å; L1372-I1375 PolarHBondContact O-N 3.16Å; L1372-I1375 VanDerWaalsContact O-N 3.12Å; L1372-F1377 HydrophobicContact CB-CE2 4.45Å; L1372-F1377 HydrophobicContact CD1-CE2 4.21Å; L1372-F1377 HydrophobicContact CD1-CZ 4.11Å; L1372-N1402 PolarHBondContact O-ND2 3.21Å
1373	N	72.1	Confident	83.1	Confident	90.6 Å²	90.6	38.3 Å²	38.3	48%	0.484	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-28.6	-174.4	-73.4	-43.7	0	0	0	114.8	G1370 Y1371 I1375 K1401	G1370-N1373 PolarHBondContact O-OD1 2.71Å; Y1371-N1373 VanDerWaalsContact C-N 3.33Å; Y1371-N1373 PolarHBondContact O-N 2.92Å; Y1371-N1373 VanDerWaalsContact O-N 3.12Å; N1373-I1375 VanDerWaalsContact C-N 3.3Å; N1373-I1375 PolarHBondContact O-N 3.16Å; N1373-K1401 WeakPolarHBondContact OD1-CE 3.4Å; N1373-K1401 PolarHBondContact OD1-NZ 3.32Å
1374	D	74.7	Confident	83	Confident	163.8 Å²	163.8	37.1 Å²	37.1	88%	0.876	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-11.6	-175.9	-58.5	-36.6	0	0	0	113.6	L1372	L1372-D1374 PolarHBondContact O-N 3.06Å; L1372-D1374 VanDerWaalsContact O-N 3.1Å
1375	I	80.6	Confident	83	Confident	38.4 Å²	38.4	31.7 Å²	31.7	20%	0.197	16%	0.162	C	C	.	.			trans	-118.3	126.9	-174.5	-54.6	178.7	0	0	0	109.5	Q1288 I1326 L1372 N1373 F1377 N1402	Q1288-I1375 HydrophobicContact CB-CG2 4.48Å; Q1288-I1375 HydrophobicContact CG-CG2 3.71Å; I1326-I1375 HydrophobicContact CB-CD1 4.41Å; I1326-I1375 HydrophobicContact CD1-CD1 3.78Å; I1326-I1375 HydrophobicContact CG1-CD1 4.12Å; I1326-I1375 HydrophobicContact CG2-CD1 3.61Å; I1326-I1375 VanDerWaalsContact CG2-CD1 3.44Å; L1372-I1375 PolarHBondContact O-N 3.16Å; L1372-I1375 VanDerWaalsContact O-N 3.12Å; N1373-I1375 VanDerWaalsContact C-N 3.3Å; N1373-I1375 PolarHBondContact O-N 3.16Å; I1375-F1377 HydrophobicContact CB-CE2 3.87Å; I1375-F1377 HydrophobicContact CB-CZ 4.27Å; I1375-F1377 HydrophobicContact CG2-CD2 4.18Å; I1375-F1377 HydrophobicContact CG2-CE1 4.33Å; I1375-F1377 HydrophobicContact CG2-CE2 3.55Å; I1375-F1377 VanDerWaalsContact CG2-CE2 3.46Å; I1375-F1377 HydrophobicContact CG2-CZ 3.63Å; I1375-N1402 WeakPolarHBondContact O-CB 3.31Å; I1375-N1402 PolarHBondContact O-ND2 3.05Å
1376	Q	83	Confident	82.5	Confident	36 Å²	36	34.8 Å²	34.8	17%	0.168	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	135.2	174.9	-58.2	-66.1	-55	0	0	110	V1285 H1287 Q1288 N1402	V1285-Q1376 HydrophobicContact CB-CG 4.38Å; V1285-Q1376 HydrophobicContact CG1-CG 4Å; H1287-Q1376 CarbonylContact C-O 3.55Å; H1287-Q1376 WeakPolarHBondContact CA-O 3.38Å; H1287-Q1376 HydrophobicContact CB-CB 4.49Å; H1287-Q1376 VanDerWaalsContact CD2-CB 3.46Å; H1287-Q1376 WeakPolarHBondContact CD2-CB 3.19Å; Q1288-Q1376 PolarHBondContact N-O 3.01Å; Q1376-N1402 CarbonylContact C-O 3.53Å; Q1376-N1402 WeakPolarHBondContact CA-O 2.99Å; Q1376-N1402 VanDerWaalsContact NE2-CB 3.33Å
1377	F	84.4	Confident	82.2	Confident	0.8 Å²	0.8	35 Å²	35	0%	0.004	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	135.3	179.1	-66.8	-92.7	0	0	0	110.4	Q1288 L1319 I1326 L1369 L1372 I1375 F1379 N1402 V1403 R1404	Q1288-F1377 HydrophobicContact CB-CD1 3.78Å; Q1288-F1377 HydrophobicContact CB-CE1 3.96Å; Q1288-F1377 HydrophobicContact CB-CG 4.48Å; Q1288-F1377 HydrophobicContact CG-CD1 4.42Å; Q1288-F1377 HydrophobicContact CG-CE1 4.19Å; Q1288-F1377 CarbonylContact O-C 3.57Å; Q1288-F1377 WeakPolarHBondContact O-CA 3.38Å; Q1288-F1377 VanDerWaalsContact OE1-CE1 3.28Å; Q1288-F1377 VanDerWaalsContact OE1-CZ 3.29Å; L1319-F1377 HydrophobicContact CD2-CD1 4.44Å; L1319-F1377 HydrophobicContact CD2-CE1 4.31Å; I1326-F1377 HydrophobicContact CD1-CZ 4.47Å; L1369-F1377 HydrophobicContact CB-CD2 4.21Å; L1369-F1377 HydrophobicContact CB-CE2 4.24Å; L1369-F1377 HydrophobicContact CD1-CB 4.28Å; L1369-F1377 HydrophobicContact CD1-CD1 3.98Å; L1369-F1377 HydrophobicContact CD1-CD2 4.09Å; L1369-F1377 HydrophobicContact CD1-CE1 4.33Å; L1369-F1377 HydrophobicContact CD1-CE2 4.41Å; L1369-F1377 HydrophobicContact CD1-CG 3.85Å; L1369-F1377 HydrophobicContact CD1-CZ 4.42Å; L1369-F1377 HydrophobicContact CD2-CD1 4.42Å; L1369-F1377 HydrophobicContact CD2-CD2 4.33Å; L1369-F1377 HydrophobicContact CD2-CE1 3.94Å; L1369-F1377 HydrophobicContact CD2-CE2 3.92Å; L1369-F1377 HydrophobicContact CD2-CZ 3.68Å; L1369-F1377 HydrophobicContact CG-CD2 4.44Å; L1369-F1377 HydrophobicContact CG-CE2 4.41Å; L1369-F1377 HydrophobicContact CG-CZ 4.41Å; L1372-F1377 HydrophobicContact CB-CE2 4.45Å; L1372-F1377 HydrophobicContact CD1-CE2 4.21Å; L1372-F1377 HydrophobicContact CD1-CZ 4.11Å; I1375-F1377 HydrophobicContact CB-CE2 3.87Å; I1375-F1377 HydrophobicContact CB-CZ 4.27Å; I1375-F1377 HydrophobicContact CG2-CD2 4.18Å; I1375-F1377 HydrophobicContact CG2-CE1 4.33Å; I1375-F1377 HydrophobicContact CG2-CE2 3.55Å; I1375-F1377 VanDerWaalsContact CG2-CE2 3.46Å; I1375-F1377 HydrophobicContact CG2-CZ 3.63Å; F1377-F1379 HydrophobicContact CB-CE2 4.07Å; F1377-N1402 PolarHBondContact N-O 3.41Å; F1377-V1403 HydrophobicContact CB-CG2 4.43Å; F1377-R1404 PolarHBondContact O-N 3.06Å
1378	A	83.3	Confident	81.7	Confident	0.6 Å²	0.6	35.4 Å²	35.4	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	121	175.2	0	0	0	0	0	110.3	F1072 L1136 H1287 Q1288 I1289 L1290 L1380 R1404	F1072-A1378 HydrophobicContact CE2-CB 4.5Å; F1072-A1378 HydrophobicContact CZ-CB 4.31Å; L1136-A1378 HydrophobicContact CD1-CB 4.28Å; H1287-A1378 HydrophobicContact CB-CB 4.07Å; Q1288-A1378 PolarHBondContact O-N 3.31Å; I1289-A1378 WeakPolarHBondContact CA-O 3.34Å; I1289-A1378 HydrophobicContact CG1-CB 4.38Å; L1290-A1378 PolarHBondContact N-O 2.98Å; A1378-L1380 HydrophobicContact CB-CD1 3.87Å; A1378-L1380 WeakPolarHBondContact O-CD1 3.19Å; A1378-R1404 CarbonylContact C-O 3.44Å; A1378-R1404 WeakPolarHBondContact CA-O 3.37Å
1379	F	86.9	Confident	81.3	Confident	0.2 Å²	0.2	38.1 Å²	38.1	0%	0.001	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	116	176.6	-66.7	-94.9	0	0	0	109.1	L1290 W1315 L1319 F1362 I1366 L1369 F1377 V1403 R1404 F1405 V1406	L1290-F1379 HydrophobicContact CB-CD1 3.95Å; L1290-F1379 HydrophobicContact CB-CE1 4.26Å; L1290-F1379 HydrophobicContact CD1-CD1 4.13Å; L1290-F1379 HydrophobicContact CD1-CE1 3.7Å; L1290-F1379 VanDerWaalsContact CD1-CE1 3.41Å; L1290-F1379 HydrophobicContact CD1-CZ 4.05Å; L1290-F1379 HydrophobicContact CD2-CD1 4.42Å; L1290-F1379 HydrophobicContact CD2-CE1 4.05Å; L1290-F1379 HydrophobicContact CG-CD1 4.42Å; L1290-F1379 HydrophobicContact CG-CE1 4.28Å; L1290-F1379 CarbonylContact O-C 3.56Å; L1290-F1379 WeakPolarHBondContact O-CA 3.22Å; W1315-F1379 HydrophobicContact CD2-CD1 4.21Å; W1315-F1379 HydrophobicContact CD2-CE1 4.36Å; W1315-F1379 AromaticContact CE3-CD1 3.71Å; W1315-F1379 HydrophobicContact CE3-CD1 3.77Å; W1315-F1379 AromaticContact CE3-CE1 3.89Å; W1315-F1379 HydrophobicContact CE3-CE1 4.14Å; W1315-F1379 HydrophobicContact CH2-CB 4.01Å; W1315-F1379 AromaticContact CH2-CD1 3.84Å; W1315-F1379 HydrophobicContact CH2-CD1 3.88Å; W1315-F1379 HydrophobicContact CH2-CG 4.36Å; W1315-F1379 HydrophobicContact CZ2-CD1 4.28Å; W1315-F1379 HydrophobicContact CZ3-CB 4.21Å; W1315-F1379 AromaticContact CZ3-CD1 3.6Å; W1315-F1379 HydrophobicContact CZ3-CD1 3.6Å; W1315-F1379 VanDerWaalsContact CZ3-CD1 3.41Å; W1315-F1379 HydrophobicContact CZ3-CE1 4.33Å; W1315-F1379 HydrophobicContact CZ3-CG 4.25Å; L1319-F1379 HydrophobicContact CD1-CE1 4.34Å; L1319-F1379 HydrophobicContact CD1-CZ 4.28Å; L1319-F1379 HydrophobicContact CD2-CE1 4.41Å; L1319-F1379 HydrophobicContact CD2-CZ 4.33Å; F1362-F1379 AromaticContact CE2-CE1 3.88Å; F1362-F1379 HydrophobicContact CE2-CE1 4.13Å; F1362-F1379 HydrophobicContact CE2-CZ 4.35Å; F1362-F1379 HydrophobicContact CZ-CD1 4.39Å; F1362-F1379 AromaticContact CZ-CE1 3.93Å; F1362-F1379 HydrophobicContact CZ-CE1 4.13Å; F1362-F1379 HydrophobicContact CZ-CZ 4.34Å; I1366-F1379 HydrophobicContact CD1-CD2 4.43Å; I1366-F1379 HydrophobicContact CD1-CE1 4.36Å; I1366-F1379 HydrophobicContact CD1-CE2 3.67Å; I1366-F1379 HydrophobicContact CD1-CZ 3.6Å; L1369-F1379 HydrophobicContact CD1-CE2 4.04Å; L1369-F1379 HydrophobicContact CD1-CZ 3.94Å; F1377-F1379 HydrophobicContact CB-CE2 4.07Å; F1379-V1403 HydrophobicContact CD2-CG1 4.06Å; F1379-V1403 HydrophobicContact CE2-CG1 3.93Å; F1379-R1404 PolarHBondContact N-O 3.11Å; F1379-F1405 HydrophobicContact CB-CD1 3.49Å; F1379-F1405 VanDerWaalsContact CB-CD1 3.47Å; F1379-F1405 HydrophobicContact CB-CE1 3.37Å; F1379-F1405 HydrophobicContact CB-CG 4.14Å; F1379-F1405 HydrophobicContact CB-CZ 3.96Å; F1379-F1405 HydrophobicContact CD1-CE1 4.37Å; F1379-F1405 HydrophobicContact CD1-CZ 4.45Å; F1379-F1405 HydrophobicContact CD2-CE1 4.19Å; F1379-F1405 HydrophobicContact CD2-CE2 4.13Å; F1379-F1405 AromaticContact CD2-CZ 3.87Å; F1379-F1405 HydrophobicContact CD2-CZ 3.87Å; F1379-F1405 HydrophobicContact CE2-CZ 4.39Å; F1379-F1405 HydrophobicContact CG-CD1 4.31Å; F1379-F1405 AromaticContact CG-CE1 3.75Å; F1379-F1405 HydrophobicContact CG-CE1 3.75Å; F1379-F1405 HydrophobicContact CG-CE2 4.47Å; F1379-F1405 AromaticContact CG-CZ 3.87Å; F1379-F1405 HydrophobicContact CG-CZ 3.87Å; F1379-F1405 CarbonylContact O-C 3.56Å; F1379-F1405 VanDerWaalsContact O-CA 3.29Å; F1379-F1405 WeakPolarHBondContact O-CA 3.29Å; F1379-V1406 PolarHBondContact O-N 3.19Å
1380	L	84.9	Confident	80.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	124.8	-175.6	-65.4	77.3	0	0	0	109.6	L1129 L1132 T1133 L1230 L1233 I1289 L1290 I1291 H1292 A1378 V1406	L1129-L1380 HydrophobicContact CD1-CB 4.27Å; L1129-L1380 HydrophobicContact CD2-CB 4.28Å; L1129-L1380 HydrophobicContact CD2-CD2 4.32Å; L1129-L1380 HydrophobicContact CG-CB 4.34Å; L1129-L1380 HydrophobicContact CG-CD2 4.25Å; L1132-L1380 HydrophobicContact CD2-CD2 4.49Å; T1133-L1380 WeakPolarHBondContact OG1-CD2 3.41Å; L1230-L1380 HydrophobicContact CD1-CB 4.2Å; L1230-L1380 HydrophobicContact CD1-CD2 4.45Å; L1230-L1380 HydrophobicContact CD2-CD2 4.46Å; L1230-L1380 HydrophobicContact CG-CB 4.46Å; L1230-L1380 HydrophobicContact CG-CD2 4.02Å; L1233-L1380 HydrophobicContact CD2-CD2 4.31Å; I1289-L1380 HydrophobicContact CB-CD1 4.42Å; I1289-L1380 HydrophobicContact CD1-CD1 4.38Å; I1289-L1380 HydrophobicContact CG1-CD1 4.19Å; I1289-L1380 HydrophobicContact CG2-CD1 3.66Å; I1289-L1380 VanDerWaalsContact CG2-CD1 3.47Å; I1289-L1380 HydrophobicContact CG2-CD2 4.29Å; L1290-L1380 PolarHBondContact O-N 3.27Å; I1291-L1380 CarbonylContact C-O 3.56Å; I1291-L1380 VanDerWaalsContact CA-O 3.3Å; I1291-L1380 WeakPolarHBondContact CA-O 3.32Å; I1291-L1380 HydrophobicContact CB-CB 4.28Å; I1291-L1380 HydrophobicContact CD1-CB 4.39Å; I1291-L1380 HydrophobicContact CD1-CD2 4.23Å; I1291-L1380 HydrophobicContact CG1-CB 4.09Å; I1291-L1380 HydrophobicContact CG1-CD1 4.43Å; I1291-L1380 HydrophobicContact CG2-CB 4.13Å; H1292-L1380 PolarHBondContact N-O 3.15Å; A1378-L1380 HydrophobicContact CB-CD1 3.87Å; A1378-L1380 WeakPolarHBondContact O-CD1 3.19Å; L1380-V1406 CarbonylContact C-O 3.54Å; L1380-V1406 VanDerWaalsContact CA-O 3.27Å; L1380-V1406 WeakPolarHBondContact CA-O 3.35Å; L1380-V1406 HydrophobicContact CB-CB 4.46Å; L1380-V1406 HydrophobicContact CD1-CG2 4.38Å; L1380-V1406 HydrophobicContact CD2-CB 4.06Å; L1380-V1406 HydrophobicContact CD2-CG1 4.2Å; L1380-V1406 HydrophobicContact CD2-CG2 4.21Å; L1380-V1406 HydrophobicContact CG-CB 3.93Å; L1380-V1406 HydrophobicContact CG-CG2 4.13Å
1381	I	85	Confident	80.7	Confident	1.8 Å²	1.8	43.8 Å²	43.8	1%	0.009	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	121.4	175.7	-53.8	-177	0	0	0	109.3	H1292 C1294 W1315 C1384 L1387 W1394 V1406 L1407 T1408	H1292-I1381 HydrophobicContact CB-CG1 4.49Å; H1292-I1381 WeakPolarHBondContact O-CA 3.25Å; C1294-I1381 VanDerWaalsContact SG-CG2 3.53Å; W1315-I1381 HydrophobicContact CH2-CD1 3.57Å; W1315-I1381 HydrophobicContact CH2-CG1 3.55Å; W1315-I1381 VanDerWaalsContact CH2-CG1 3.41Å; W1315-I1381 HydrophobicContact CZ2-CD1 4.29Å; W1315-I1381 HydrophobicContact CZ2-CG1 3.95Å; W1315-I1381 HydrophobicContact CZ3-CD1 4.24Å; W1315-I1381 HydrophobicContact CZ3-CG1 4.46Å; I1381-C1384 HydrophobicContact CB-CB 4.38Å; I1381-C1384 HydrophobicContact CG2-CB 4.11Å; I1381-L1387 HydrophobicContact CD1-CD1 4.5Å; I1381-W1394 HydrophobicContact CD1-CH2 3.4Å; I1381-W1394 VanDerWaalsContact CD1-CH2 3.49Å; I1381-W1394 HydrophobicContact CD1-CZ2 3.77Å; I1381-W1394 HydrophobicContact CD1-CZ3 4.31Å; I1381-V1406 PolarHBondContact N-O 3.12Å; I1381-L1407 HydrophobicContact CB-CD2 3.77Å; I1381-L1407 HydrophobicContact CD1-CD2 3.94Å; I1381-L1407 HydrophobicContact CG1-CD2 3.9Å; I1381-L1407 CarbonylContact O-C 3.5Å; I1381-L1407 WeakPolarHBondContact O-CA 3.4Å; I1381-T1408 PolarHBondContact O-N 3.19Å
1382	D	83	Confident	80.7	Confident	4.2 Å²	4.2	38.1 Å²	38.1	2%	0.022	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	134.3	171.7	-160.3	41.7	0	0	0	111.4	T1126 L1129 T1227 L1230 H1292 F1293 C1294 T1408	T1126-D1382 VanDerWaalsContact CB-OD2 3.29Å; T1126-D1382 WeakPolarHBondContact CB-OD2 3.34Å; T1126-D1382 VanDerWaalsContact CG2-OD2 3.29Å; T1126-D1382 WeakPolarHBondContact CG2-OD2 3.33Å; T1126-D1382 PolarHBondContact OG1-OD1 3.13Å; T1126-D1382 PolarHBondContact OG1-OD2 3.17Å; L1129-D1382 HydrophobicContact CD1-CB 4.23Å; L1129-D1382 HydrophobicContact CD2-CB 4.4Å; T1227-D1382 WeakPolarHBondContact CB-OD2 3.32Å; T1227-D1382 WeakPolarHBondContact CG2-OD2 3.45Å; T1227-D1382 PolarHBondContact OG1-OD2 3.45Å; L1230-D1382 HydrophobicContact CD1-CB 4.02Å; H1292-D1382 PolarHBondContact O-N 3.16Å; F1293-D1382 HydrophobicContact CD1-CB 3.62Å; F1293-D1382 HydrophobicContact CE1-CB 4.21Å; F1293-D1382 HydrophobicContact CG-CB 4.43Å; C1294-D1382 VanDerWaalsContact CB-O 3.22Å; C1294-D1382 WeakPolarHBondContact CB-O 3.41Å; C1294-D1382 PolarHBondContact N-O 2.98Å; C1294-D1382 VanDerWaalsContact N-O 3.14Å; C1294-D1382 PolarHBondContact SG-O 3.27Å; C1294-D1382 VanDerWaalsContact SG-O 3.36Å; D1382-T1408 VanDerWaalsContact CA-OG1 3.26Å; D1382-T1408 WeakPolarHBondContact CA-OG1 3.29Å; D1382-T1408 WeakPolarHBondContact OD1-CB 3.36Å; D1382-T1408 WeakPolarHBondContact OD1-CG2 3.36Å; D1382-T1408 PolarHBondContact OD1-OG1 2.9Å
1383	D	80.2	Confident	80.8	Confident	21 Å²	21	42.4 Å²	42.4	11%	0.112	22%	0.217	C	C	.	.	S	Bend	trans	53.2	55.5	-176.5	-69.4	-28.2	0	0	0	112.9	K1125 K1226 C1294 N1295 D1385 R1386 T1408	K1125-D1383 WeakPolarHBondContact CE-OD1 3.19Å; K1226-D1383 VanDerWaalsContact CE-OD1 3.3Å; K1226-D1383 WeakPolarHBondContact CE-OD1 3.42Å; K1226-D1383 IonicContact NZ-OD1 3.87Å; C1294-D1383 HydrophobicContact CB-CB 4.4Å; C1294-D1383 WeakPolarHBondContact CB-O 3.19Å; C1294-D1383 PolarHBondContact SG-O 3.04Å; C1294-D1383 VanDerWaalsContact SG-O 3.37Å; N1295-D1383 PolarHBondContact ND2-OD2 3.24Å; D1383-D1385 PolarHBondContact O-N 3.09Å; D1383-D1385 VanDerWaalsContact O-N 3.15Å; D1383-R1386 HydrophobicContact CB-CB 4.47Å; D1383-R1386 HydrophobicContact CB-CG 3.88Å; D1383-R1386 VanDerWaalsContact O-CB 3.27Å; D1383-R1386 WeakPolarHBondContact O-CB 3.34Å; D1383-R1386 PolarHBondContact O-N 3.06Å; D1383-T1408 CarbonylContact C-O 3.55Å; D1383-T1408 WeakPolarHBondContact CA-O 3.37Å; D1383-T1408 PolarHBondContact N-O 3.18Å; D1383-T1408 PolarHBondContact N-OG1 3.08Å
1384	C	84.6	Confident	81.4	Confident	2.4 Å²	2.4	38.2 Å²	38.2	2%	0.016	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-59	-22.6	179.1	-174.1	0	0	0	0	113.2	I1381 R1386 L1387 L1407 T1408	I1381-C1384 HydrophobicContact CB-CB 4.38Å; I1381-C1384 HydrophobicContact CG2-CB 4.11Å; C1384-R1386 PolarHBondContact O-N 2.92Å; C1384-R1386 VanDerWaalsContact O-N 3.15Å; C1384-L1387 WeakPolarHBondContact O-CD1 3.38Å; C1384-L1387 WeakPolarHBondContact O-CG 3.38Å; C1384-L1387 PolarHBondContact O-N 3.22Å; C1384-L1387 VanDerWaalsContact SG-CD1 3.6Å; C1384-L1407 HydrophobicContact CB-CB 4.31Å; C1384-L1407 HydrophobicContact CB-CD2 4.39Å; C1384-T1408 WeakPolarHBondContact CB-O 3.5Å; C1384-T1408 PolarHBondContact N-O 3.28Å
1385	D	83.7	Confident	82	Confident	13.4 Å²	13.4	30.6 Å²	30.6	7%	0.072	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-74.2	4.5	172.4	62.6	-36.4	0	0	0	114.3	D1383 M1390 C1409 D1410 S1413 V1415	D1383-D1385 PolarHBondContact O-N 3.09Å; D1383-D1385 VanDerWaalsContact O-N 3.15Å; D1385-M1390 VanDerWaalsContact C-SD 3.53Å; D1385-M1390 HydrophobicContact CB-CE 3.74Å; D1385-M1390 VanDerWaalsContact O-CE 3.26Å; D1385-M1390 WeakPolarHBondContact O-CE 3.3Å; D1385-C1409 HydrophobicContact CB-CB 4.31Å; D1385-C1409 WeakPolarHBondContact OD1-CA 3.24Å; D1385-C1409 WeakPolarHBondContact OD1-CB 3.41Å; D1385-D1410 PolarHBondContact OD2-N 3.12Å; D1385-S1413 WeakPolarHBondContact CB-OG 3.35Å; D1385-V1415 HydrophobicContact CB-CB 4.31Å; D1385-V1415 HydrophobicContact CB-CG2 4.32Å
1386	R	77.8	Confident	82.1	Confident	66.6 Å²	66.6	29.7 Å²	29.7	25%	0.251	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-109.2	3	174.5	-55.8	-61.3	-174.5	-179.9	-0.4	113.8	C1294 K1306 D1383 C1384 R1672	C1294-R1386 HydrophobicContact CB-CB 4.21Å; K1306-R1386 WeakPolarHBondContact CB-O 3.36Å; K1306-R1386 HydrophobicContact CD-CB 4.49Å; K1306-R1386 WeakPolarHBondContact CG-O 3.36Å; D1383-R1386 HydrophobicContact CB-CB 4.47Å; D1383-R1386 HydrophobicContact CB-CG 3.88Å; D1383-R1386 VanDerWaalsContact O-CB 3.27Å; D1383-R1386 WeakPolarHBondContact O-CB 3.34Å; D1383-R1386 PolarHBondContact O-N 3.06Å; C1384-R1386 PolarHBondContact O-N 2.92Å; C1384-R1386 VanDerWaalsContact O-N 3.15Å; R1386-R1672 VanDerWaalsContact CZ-CD 3.48Å; R1386-R1672 VanDerWaalsContact CZ-CZ 3.48Å
1387	L	80.2	Confident	81.9	Confident	3 Å²	3	35 Å²	35	2%	0.016	17%	0.174	C	C	.	.			trans	-65.8	140.8	177.5	-68.1	172.4	0	0	0	111.3	C1294 K1306 L1308 I1311 I1381 C1384 P1389 M1390 W1394	C1294-L1387 VanDerWaalsContact SG-CD2 3.55Å; K1306-L1387 CarbonylContact O-C 3.46Å; K1306-L1387 WeakPolarHBondContact O-CA 3.32Å; L1308-L1387 HydrophobicContact CD1-CD1 4.39Å; I1311-L1387 HydrophobicContact CD1-CD2 3.38Å; I1311-L1387 VanDerWaalsContact CD1-CD2 3.42Å; I1381-L1387 HydrophobicContact CD1-CD1 4.5Å; C1384-L1387 WeakPolarHBondContact O-CD1 3.38Å; C1384-L1387 WeakPolarHBondContact O-CG 3.38Å; C1384-L1387 PolarHBondContact O-N 3.22Å; C1384-L1387 VanDerWaalsContact SG-CD1 3.6Å; L1387-P1389 CarbonylContact C-O 3.53Å; L1387-P1389 CarbonylContact O-C 3.5Å; L1387-P1389 VanDerWaalsContact O-C 3.27Å; L1387-M1390 VanDerWaalsContact O-CA 3.24Å; L1387-M1390 WeakPolarHBondContact O-CA 3.29Å; L1387-M1390 WeakPolarHBondContact O-CG 3.33Å; L1387-M1390 PolarHBondContact O-N 3.23Å; L1387-M1390 VanDerWaalsContact O-N 3.11Å; L1387-W1394 HydrophobicContact CD1-CZ2 4.23Å
1388	E	76	Confident	81.8	Confident	99.4 Å²	99.4	39.7 Å²	39.7	46%	0.464	20%	0.199	S	C	.	.	B	Isolated β-bridge	trans	-118.2	115.9	178.1	-69.3	177.7	-175.6	0	0	109.3	K1306 K1307 L1308	K1306-E1388 HydrophobicContact CB-CB 4.4Å; K1306-E1388 HydrophobicContact CB-CG 4.33Å; K1306-E1388 WeakPolarHBondContact CD-OE1 3.41Å; K1306-E1388 PolarHBondContact O-N 3.05Å; K1307-E1388 WeakPolarHBondContact CA-O 3.26Å; L1308-E1388 WeakPolarHBondContact CB-O 3.34Å; L1308-E1388 PolarHBondContact N-O 3.13Å
1389	P	76.4	Confident	81.9	Confident	63 Å²	63	39.9 Å²	39.9	41%	0.409	20%	0.2	S	C	.	.	S	Bend	cis	-71.3	158	-6.1	32.9	-36.1	0	0	0	112.5	L1355 L1387 T1391	L1355-P1389 HydrophobicContact CD1-CG 4.04Å; L1355-P1389 HydrophobicContact CD2-CG 3.47Å; L1355-P1389 VanDerWaalsContact CD2-CG 3.44Å; L1387-P1389 CarbonylContact C-O 3.53Å; L1387-P1389 CarbonylContact O-C 3.5Å; L1387-P1389 VanDerWaalsContact O-C 3.27Å; P1389-T1391 HydrophobicContact CB-CG2 4.13Å; P1389-T1391 HydrophobicContact CG-CG2 4.11Å; P1389-T1391 PolarHBondContact O-N 3.12Å
1390	M	76	Confident	81.9	Confident	102 Å²	102	40.9 Å²	40.9	50%	0.502	21%	0.206	S	C	.	.			trans	-76.2	53.9	179.4	-82.1	-161.5	-162.1	0	0	112.2	D1385 L1387 S1413 S1414 V1415	D1385-M1390 VanDerWaalsContact C-SD 3.53Å; D1385-M1390 HydrophobicContact CB-CE 3.74Å; D1385-M1390 VanDerWaalsContact O-CE 3.26Å; D1385-M1390 WeakPolarHBondContact O-CE 3.3Å; L1387-M1390 VanDerWaalsContact O-CA 3.24Å; L1387-M1390 WeakPolarHBondContact O-CA 3.29Å; L1387-M1390 WeakPolarHBondContact O-CG 3.33Å; L1387-M1390 PolarHBondContact O-N 3.23Å; L1387-M1390 VanDerWaalsContact O-N 3.11Å; M1390-S1413 WeakPolarHBondContact CE-OG 3.44Å; M1390-S1414 WeakPolarHBondContact CE-OG 3.28Å; M1390-V1415 HydrophobicContact CE-CB 4.09Å; M1390-V1415 HydrophobicContact CE-CG2 3.47Å; M1390-V1415 VanDerWaalsContact CE-CG2 3.47Å; M1390-V1415 HydrophobicContact CG-CG2 3.73Å; M1390-V1415 HydrophobicContact SD-CG2 4.39Å
1391	T	78.8	Confident	81.7	Confident	39.2 Å²	39.2	47.4 Å²	47.4	24%	0.24	23%	0.234	C	C	.	.			trans	-105.7	151	-179.2	73.2	0	0	0	0	112	L1308 P1389 E1393 W1394	L1308-T1391 HydrophobicContact CD2-CG2 3.67Å; P1389-T1391 HydrophobicContact CB-CG2 4.13Å; P1389-T1391 HydrophobicContact CG-CG2 4.11Å; P1389-T1391 PolarHBondContact O-N 3.12Å; T1391-E1393 WeakPolarHBondContact OG1-CG 3.38Å; T1391-E1393 PolarHBondContact OG1-N 3.35Å; T1391-W1394 PolarHBondContact O-NE1 3.2Å; T1391-W1394 VanDerWaalsContact O-NE1 3.14Å
1392	L	83.7	Confident	81.6	Confident	39.4 Å²	39.4	47.4 Å²	47.4	21%	0.206	24%	0.235	C	C	.	.			trans	-107.8	4.7	174.2	-69.8	175	0	0	0	113.1	W1394 L1395 V1415 N1418 L1419	L1392-W1394 PolarHBondContact O-N 3.14Å; L1392-L1395 HydrophobicContact CD2-CD1 4.37Å; L1392-L1395 WeakPolarHBondContact O-CB 3.36Å; L1392-L1395 PolarHBondContact O-N 3.24Å; L1392-L1395 VanDerWaalsContact O-N 3.11Å; L1392-V1415 HydrophobicContact CD1-CG1 4.34Å; L1392-V1415 HydrophobicContact CD2-CG1 3.98Å; L1392-V1415 HydrophobicContact CG-CG1 4.35Å; L1392-N1418 HydrophobicContact CD1-CB 3.73Å; L1392-L1419 HydrophobicContact CD1-CD2 3.97Å; L1392-L1419 HydrophobicContact CD1-CG 3.84Å; L1392-L1419 HydrophobicContact CD2-CD1 4.36Å; L1392-L1419 HydrophobicContact CD2-CD2 3.94Å; L1392-L1419 HydrophobicContact CD2-CG 4.13Å
1393	E	81.2	Confident	81.8	Confident	105 Å²	105	47.2 Å²	47.2	49%	0.491	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-25.7	-177.7	-64.7	-177	161.9	0	0	113.3	I1359 T1391 L1395 L1946	I1359-E1393 HydrophobicContact CD1-CB 4.24Å; I1359-E1393 WeakPolarHBondContact CG2-O 3.48Å; T1391-E1393 WeakPolarHBondContact OG1-CG 3.38Å; T1391-E1393 PolarHBondContact OG1-N 3.35Å; E1393-L1395 PolarHBondContact O-N 3.11Å; E1393-L1946 HydrophobicContact CB-CD1 4.41Å; E1393-L1946 PolarHBondContact OE1-N 3.49Å; E1393-L1946 WeakPolarHBondContact OE2-CD1 3.27Å
1394	W	85.5	Confident	82.1	Confident	2 Å²	2	48 Å²	48	1%	0.008	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-16.4	176.5	68.1	-91.5	0	0	0	113.6	L1308 L1312 W1315 I1359 F1362 I1381 L1387 T1391 L1392 P1396 F1405	L1308-W1394 HydrophobicContact CD1-CB 4.4Å; L1308-W1394 HydrophobicContact CD1-CD2 4.13Å; L1308-W1394 HydrophobicContact CD1-CG 3.9Å; L1308-W1394 HydrophobicContact CD2-CB 4.19Å; L1308-W1394 VanDerWaalsContact CD2-CD1 3.44Å; L1308-W1394 HydrophobicContact CD2-CG 3.95Å; L1308-W1394 HydrophobicContact CG-CG 4.42Å; L1312-W1394 HydrophobicContact CD1-CB 4.17Å; L1312-W1394 HydrophobicContact CD2-CB 4.43Å; L1312-W1394 HydrophobicContact CD2-CE3 4.33Å; W1315-W1394 AromaticContact CZ3-CZ3 4Å; W1315-W1394 HydrophobicContact CZ3-CZ3 4.18Å; I1359-W1394 HydrophobicContact CD1-CB 4.18Å; I1359-W1394 HydrophobicContact CG1-CB 3.78Å; F1362-W1394 HydrophobicContact CD1-CE3 4.33Å; F1362-W1394 WeakPolarHBondContact CD1-O 3.42Å; F1362-W1394 AromaticContact CE1-CE3 3.88Å; F1362-W1394 HydrophobicContact CE1-CE3 3.91Å; F1362-W1394 AromaticContact CE1-CZ3 4Å; F1362-W1394 HydrophobicContact CE1-CZ3 4.1Å; F1362-W1394 HydrophobicContact CZ-CZ3 4.45Å; I1381-W1394 HydrophobicContact CD1-CH2 3.4Å; I1381-W1394 VanDerWaalsContact CD1-CH2 3.49Å; I1381-W1394 HydrophobicContact CD1-CZ2 3.77Å; I1381-W1394 HydrophobicContact CD1-CZ3 4.31Å; L1387-W1394 HydrophobicContact CD1-CZ2 4.23Å; T1391-W1394 PolarHBondContact O-NE1 3.2Å; T1391-W1394 VanDerWaalsContact O-NE1 3.14Å; L1392-W1394 PolarHBondContact O-N 3.14Å; W1394-P1396 WeakPolarHBondContact O-CD 3.4Å; W1394-F1405 HydrophobicContact CH2-CD1 4.29Å; W1394-F1405 AromaticContact CH2-CE1 3.94Å; W1394-F1405 HydrophobicContact CH2-CE1 4.04Å; W1394-F1405 HydrophobicContact CZ3-CD1 4.35Å; W1394-F1405 AromaticContact CZ3-CE1 3.67Å; W1394-F1405 HydrophobicContact CZ3-CE1 3.67Å; W1394-F1405 HydrophobicContact CZ3-CZ 4.33Å
1395	L	86.5	Confident	82.4	Confident	5.2 Å²	5.2	47.9 Å²	47.9	3%	0.027	23%	0.234	C	C	.	.	S	Bend	trans	-95.6	109.2	-178	-163	83.5	0	0	0	110.4	I1114 I1215 L1392 E1393 Q1397 L1399 F1405 L1407 L1419 R1422	I1114-L1395 HydrophobicContact CD1-CD2 3.61Å; I1114-L1395 HydrophobicContact CD1-CG 4.44Å; I1114-L1395 HydrophobicContact CG1-CD2 4.36Å; I1215-L1395 HydrophobicContact CD1-CD2 4.05Å; L1392-L1395 HydrophobicContact CD2-CD1 4.37Å; L1392-L1395 WeakPolarHBondContact O-CB 3.36Å; L1392-L1395 PolarHBondContact O-N 3.24Å; L1392-L1395 VanDerWaalsContact O-N 3.11Å; E1393-L1395 PolarHBondContact O-N 3.11Å; L1395-Q1397 PolarHBondContact O-N 3.39Å; L1395-L1399 HydrophobicContact CD1-CD2 4.49Å; L1395-L1399 HydrophobicContact CD2-CD1 4.27Å; L1395-F1405 HydrophobicContact CD1-CD1 3.88Å; L1395-F1405 HydrophobicContact CD1-CD2 3.8Å; L1395-F1405 HydrophobicContact CD1-CE1 3.89Å; L1395-F1405 HydrophobicContact CD1-CE2 3.8Å; L1395-F1405 HydrophobicContact CD1-CG 3.84Å; L1395-F1405 HydrophobicContact CD1-CZ 3.85Å; L1395-F1405 HydrophobicContact CD2-CD1 4.28Å; L1395-F1405 HydrophobicContact CD2-CD2 3.9Å; L1395-F1405 HydrophobicContact CD2-CE1 4.42Å; L1395-F1405 HydrophobicContact CD2-CE2 4.04Å; L1395-F1405 HydrophobicContact CD2-CG 4.04Å; L1395-F1405 HydrophobicContact CD2-CZ 4.3Å; L1395-L1407 HydrophobicContact CD1-CD1 3.92Å; L1395-L1407 HydrophobicContact CD2-CD1 4.48Å; L1395-L1419 HydrophobicContact CD1-CD2 4.42Å; L1395-L1419 HydrophobicContact CD2-CD2 3.89Å; L1395-R1422 PolarHBondContact O-NH1 3.26Å
1396	P	82.6	Confident	82.6	Confident	18 Å²	18	47.4 Å²	47.4	12%	0.117	23%	0.232	C	C	.	.			trans	-54.4	144.6	-175.1	-27.3	35.6	0	0	0	113.2	A1363 I1366 W1394 I1398 L1399 R1422	A1363-P1396 HydrophobicContact CB-CG 4.37Å; I1366-P1396 HydrophobicContact CB-CG 4.29Å; I1366-P1396 HydrophobicContact CG1-CG 4.48Å; I1366-P1396 HydrophobicContact CG2-CG 4.15Å; W1394-P1396 WeakPolarHBondContact O-CD 3.4Å; P1396-I1398 VanDerWaalsContact C-N 3.31Å; P1396-I1398 PolarHBondContact O-N 3.15Å; P1396-L1399 HydrophobicContact CB-CD2 4.27Å; P1396-L1399 HydrophobicContact CG-CD2 4.36Å; P1396-R1422 PolarHBondContact O-NH1 3.11Å; P1396-R1422 VanDerWaalsContact O-NH1 3.12Å; P1396-R1422 PolarHBondContact O-NH2 2.99Å
1397	Q	79.7	Confident	83.2	Confident	147.2 Å²	147.2	44.2 Å²	44.2	69%	0.688	22%	0.22	S	C	*	.	S	Bend	trans	-65.2	-30.6	178.2	-69.7	-171.3	-2.7	0	0	112.8	R1086 L1395 R1422	R1086-Q1397 VanDerWaalsContact CZ-O 3.22Å; R1086-Q1397 PolarHBondContact NH1-O 3.22Å; R1086-Q1397 PolarHBondContact NH2-O 3.05Å; L1395-Q1397 PolarHBondContact O-N 3.39Å; Q1397-R1422 PolarHBondContact O-NH2 3.29Å; Q1397-R1422 VanDerWaalsContact O-NH2 3.09Å
1398	I	81.5	Confident	83.5	Confident	100.2 Å²	100.2	44.1 Å²	44.1	51%	0.514	22%	0.219	S	C	.	.	S	Bend	trans	-123	123.2	177.2	-53.5	173.4	0	0	0	107.5	Y1103 P1396	Y1103-I1398 HydrophobicContact CD2-CD1 4.14Å; Y1103-I1398 HydrophobicContact CE2-CD1 3.21Å; Y1103-I1398 HydrophobicContact CE2-CG1 3.75Å; Y1103-I1398 WeakPolarHBondContact OH-CG1 3.22Å; Y1103-I1398 WeakPolarHBondContact OH-CG2 3.49Å; P1396-I1398 VanDerWaalsContact C-N 3.31Å; P1396-I1398 PolarHBondContact O-N 3.15Å
1399	L	86.1	Confident	83.9	Confident	4.6 Å²	4.6	39.4 Å²	39.4	2%	0.024	20%	0.197	C	C	.	.			trans	-100.5	141.1	176.7	-66.4	173.1	0	0	0	109.9	G1112 I1114 C1214 I1215 I1366 L1395 P1396 V1403 F1405	G1112-L1399 PolarHBondContact N-O 3.19Å; I1114-L1399 HydrophobicContact CD1-CD1 4.3Å; I1114-L1399 HydrophobicContact CG1-CD1 3.78Å; C1214-L1399 HydrophobicContact CB-CB 3.67Å; C1214-L1399 HydrophobicContact CB-CD1 3.6Å; C1214-L1399 HydrophobicContact CB-CG 4.27Å; I1215-L1399 HydrophobicContact CD1-CD1 4.04Å; I1215-L1399 HydrophobicContact CG1-CD1 3.66Å; I1366-L1399 HydrophobicContact CG2-CD2 4.22Å; L1395-L1399 HydrophobicContact CD1-CD2 4.49Å; L1395-L1399 HydrophobicContact CD2-CD1 4.27Å; P1396-L1399 HydrophobicContact CB-CD2 4.27Å; P1396-L1399 HydrophobicContact CG-CD2 4.36Å; L1399-V1403 HydrophobicContact CD2-CG1 4.46Å; L1399-F1405 HydrophobicContact CD1-CD2 3.82Å; L1399-F1405 HydrophobicContact CD1-CE2 4.33Å; L1399-F1405 HydrophobicContact CD2-CD2 4.07Å; L1399-F1405 HydrophobicContact CD2-CE2 3.71Å
1400	P	85.9	Confident	84.2	Confident	21.4 Å²	21.4	37.6 Å²	37.6	14%	0.139	18%	0.184	C	C	.	.			trans	-64.3	151.2	171.8	-20.9	31.5	0	0	0	112.9	G1112 I1366 G1370 N1402 V1403	G1112-P1400 WeakPolarHBondContact CA-O 3.31Å; G1112-P1400 PolarHBondContact N-O 3.27Å; I1366-P1400 HydrophobicContact CG2-CG 4.29Å; I1366-P1400 VanDerWaalsContact O-CG 3.29Å; I1366-P1400 WeakPolarHBondContact O-CG 3.28Å; G1370-P1400 VanDerWaalsContact CA-CB 3.46Å; P1400-N1402 WeakPolarHBondContact CB-OD1 3.33Å; P1400-N1402 PolarHBondContact O-N 3.13Å; P1400-V1403 HydrophobicContact CB-CB 4.44Å; P1400-V1403 HydrophobicContact CB-CG2 4.17Å; P1400-V1403 HydrophobicContact CG-CG2 4.17Å; P1400-V1403 PolarHBondContact O-N 3.17Å
1401	K	81.7	Confident	84.3	Confident	137 Å²	137	35.8 Å²	35.8	60%	0.596	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.2	-175.8	32.6	-177.4	177.5	-177.9	0	115.1	C1110 N1373	C1110-K1401 HydrophobicContact CB-CB 4.32Å; C1110-K1401 WeakPolarHBondContact O-CA 3.18Å; C1110-K1401 WeakPolarHBondContact O-CB 3.24Å; N1373-K1401 WeakPolarHBondContact OD1-CE 3.4Å; N1373-K1401 PolarHBondContact OD1-NZ 3.32Å
1402	N	83.2	Confident	84.3	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.011	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	2.8	-178.3	67.1	-38.8	0	0	0	113.2	L1369 L1372 I1375 Q1376 F1377 P1400	L1369-N1402 PolarHBondContact O-ND2 3.29Å; L1369-N1402 PolarHBondContact O-OD1 3.11Å; L1372-N1402 PolarHBondContact O-ND2 3.21Å; I1375-N1402 WeakPolarHBondContact O-CB 3.31Å; I1375-N1402 PolarHBondContact O-ND2 3.05Å; Q1376-N1402 CarbonylContact C-O 3.53Å; Q1376-N1402 WeakPolarHBondContact CA-O 2.99Å; Q1376-N1402 VanDerWaalsContact NE2-CB 3.33Å; F1377-N1402 PolarHBondContact N-O 3.41Å; P1400-N1402 WeakPolarHBondContact CB-OD1 3.33Å; P1400-N1402 PolarHBondContact O-N 3.13Å
1403	V	86.6	Confident	84.1	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	128.1	179.3	177.1	0	0	0	0	109.8	G1112 I1366 L1369 F1377 F1379 L1399 P1400 F1405	G1112-V1403 VanDerWaalsContact CA-O 3.27Å; G1112-V1403 WeakPolarHBondContact CA-O 3.33Å; I1366-V1403 HydrophobicContact CD1-CG1 4.29Å; I1366-V1403 HydrophobicContact CG2-CG1 4.38Å; I1366-V1403 HydrophobicContact CG2-CG2 4.5Å; L1369-V1403 HydrophobicContact CB-CG2 3.9Å; L1369-V1403 HydrophobicContact CD1-CG2 4.1Å; F1377-V1403 HydrophobicContact CB-CG2 4.43Å; F1379-V1403 HydrophobicContact CD2-CG1 4.06Å; F1379-V1403 HydrophobicContact CE2-CG1 3.93Å; L1399-V1403 HydrophobicContact CD2-CG1 4.46Å; P1400-V1403 HydrophobicContact CB-CB 4.44Å; P1400-V1403 HydrophobicContact CB-CG2 4.17Å; P1400-V1403 HydrophobicContact CG-CG2 4.17Å; P1400-V1403 PolarHBondContact O-N 3.17Å; V1403-F1405 HydrophobicContact CG1-CD2 4.3Å; V1403-F1405 HydrophobicContact CG1-CE2 3.8Å
1404	R	87.1	Confident	84	Confident	37.4 Å²	37.4	38.1 Å²	38.1	14%	0.141	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	143.8	177.3	-62.1	-179.7	-175.1	162.6	-1.4	111.2	F1072 L1075 T1076 S1113 L1211 C1214 H1287 F1377 A1378 F1379	F1072-R1404 VanDerWaalsContact CE1-NH1 3.3Å; F1072-R1404 HydrophobicContact CE2-CB 4.46Å; F1072-R1404 HydrophobicContact CZ-CB 4.47Å; F1072-R1404 PolarHBondContact O-NH1 3.19Å; L1075-R1404 HydrophobicContact CD1-CB 4.39Å; L1075-R1404 HydrophobicContact CD1-CG 4.46Å; T1076-R1404 PolarHBondContact OG1-NH2 3.09Å; S1113-R1404 WeakPolarHBondContact O-CA 3.39Å; L1211-R1404 PolarHBondContact O-NE 3.45Å; L1211-R1404 PolarHBondContact O-NH2 2.98Å; C1214-R1404 CarbonylContact O-C 3.11Å; C1214-R1404 WeakPolarHBondContact O-CA 3.21Å; H1287-R1404 PolarHBondContact CE1-NH1 2.98Å; H1287-R1404 VanDerWaalsContact CE1-NH1 3.27Å; H1287-R1404 PolarHBondContact NE2-NH1 3.35Å; F1377-R1404 PolarHBondContact O-N 3.06Å; A1378-R1404 CarbonylContact C-O 3.44Å; A1378-R1404 WeakPolarHBondContact CA-O 3.37Å; F1379-R1404 PolarHBondContact N-O 3.11Å
1405	F	89.6	Confident	83.9	Confident	0.2 Å²	0.2	38.2 Å²	38.2	0%	0.001	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	138.7	172.2	-78.2	-94.1	0	0	0	110.4	S1113 I1114 L1115 C1214 I1215 L1216 W1315 F1362 I1366 F1379 W1394 L1395 L1399 V1403 L1407	S1113-F1405 PolarHBondContact O-N 3.2Å; S1113-F1405 VanDerWaalsContact O-N 3.09Å; I1114-F1405 CarbonylContact C-O 3.53Å; I1114-F1405 WeakPolarHBondContact CA-O 3.28Å; I1114-F1405 HydrophobicContact CB-CB 4.45Å; I1114-F1405 HydrophobicContact CG1-CB 4.12Å; I1114-F1405 HydrophobicContact CG2-CB 4.22Å; L1115-F1405 PolarHBondContact N-O 3.07Å; C1214-F1405 PolarHBondContact O-N 3.02Å; I1215-F1405 CarbonylContact C-O 3.31Å; I1215-F1405 WeakPolarHBondContact CA-O 3.39Å; I1215-F1405 HydrophobicContact CG1-CB 4.36Å; I1215-F1405 HydrophobicContact CG2-CB 4.35Å; L1216-F1405 PolarHBondContact N-O 3.02Å; W1315-F1405 HydrophobicContact CH2-CE1 4.44Å; W1315-F1405 HydrophobicContact CZ3-CE1 4.18Å; F1362-F1405 HydrophobicContact CE1-CE1 4.46Å; F1362-F1405 HydrophobicContact CE1-CZ 4.11Å; F1362-F1405 HydrophobicContact CZ-CE1 4.42Å; F1362-F1405 AromaticContact CZ-CZ 4Å; F1362-F1405 HydrophobicContact CZ-CZ 4.05Å; I1366-F1405 HydrophobicContact CD1-CE2 4.48Å; I1366-F1405 HydrophobicContact CD1-CZ 4.21Å; F1379-F1405 HydrophobicContact CB-CD1 3.49Å; F1379-F1405 VanDerWaalsContact CB-CD1 3.47Å; F1379-F1405 HydrophobicContact CB-CE1 3.37Å; F1379-F1405 HydrophobicContact CB-CG 4.14Å; F1379-F1405 HydrophobicContact CB-CZ 3.96Å; F1379-F1405 HydrophobicContact CD1-CE1 4.37Å; F1379-F1405 HydrophobicContact CD1-CZ 4.45Å; F1379-F1405 HydrophobicContact CD2-CE1 4.19Å; F1379-F1405 HydrophobicContact CD2-CE2 4.13Å; F1379-F1405 AromaticContact CD2-CZ 3.87Å; F1379-F1405 HydrophobicContact CD2-CZ 3.87Å; F1379-F1405 HydrophobicContact CE2-CZ 4.39Å; F1379-F1405 HydrophobicContact CG-CD1 4.31Å; F1379-F1405 AromaticContact CG-CE1 3.75Å; F1379-F1405 HydrophobicContact CG-CE1 3.75Å; F1379-F1405 HydrophobicContact CG-CE2 4.47Å; F1379-F1405 AromaticContact CG-CZ 3.87Å; F1379-F1405 HydrophobicContact CG-CZ 3.87Å; F1379-F1405 CarbonylContact O-C 3.56Å; F1379-F1405 VanDerWaalsContact O-CA 3.29Å; F1379-F1405 WeakPolarHBondContact O-CA 3.29Å; W1394-F1405 HydrophobicContact CH2-CD1 4.29Å; W1394-F1405 AromaticContact CH2-CE1 3.94Å; W1394-F1405 HydrophobicContact CH2-CE1 4.04Å; W1394-F1405 HydrophobicContact CZ3-CD1 4.35Å; W1394-F1405 AromaticContact CZ3-CE1 3.67Å; W1394-F1405 HydrophobicContact CZ3-CE1 3.67Å; W1394-F1405 HydrophobicContact CZ3-CZ 4.33Å; L1395-F1405 HydrophobicContact CD1-CD1 3.88Å; L1395-F1405 HydrophobicContact CD1-CD2 3.8Å; L1395-F1405 HydrophobicContact CD1-CE1 3.89Å; L1395-F1405 HydrophobicContact CD1-CE2 3.8Å; L1395-F1405 HydrophobicContact CD1-CG 3.84Å; L1395-F1405 HydrophobicContact CD1-CZ 3.85Å; L1395-F1405 HydrophobicContact CD2-CD1 4.28Å; L1395-F1405 HydrophobicContact CD2-CD2 3.9Å; L1395-F1405 HydrophobicContact CD2-CE1 4.42Å; L1395-F1405 HydrophobicContact CD2-CE2 4.04Å; L1395-F1405 HydrophobicContact CD2-CG 4.04Å; L1395-F1405 HydrophobicContact CD2-CZ 4.3Å; L1399-F1405 HydrophobicContact CD1-CD2 3.82Å; L1399-F1405 HydrophobicContact CD1-CE2 4.33Å; L1399-F1405 HydrophobicContact CD2-CD2 4.07Å; L1399-F1405 HydrophobicContact CD2-CE2 3.71Å; V1403-F1405 HydrophobicContact CG1-CD2 4.3Å; V1403-F1405 HydrophobicContact CG1-CE2 3.8Å; F1405-L1407 HydrophobicContact CD1-CD2 4.43Å
1406	V	88.4	Confident	83.6	Confident	2.8 Å²	2.8	38.2 Å²	38.2	2%	0.017	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	115.8	169.8	-173	0	0	0	0	108	F1072 L1115 I1117 L1129 L1132 L1216 I1218 L1233 F1379 L1380 I1381	F1072-V1406 HydrophobicContact CD2-CG2 3.85Å; F1072-V1406 HydrophobicContact CE2-CG2 3.81Å; L1115-V1406 HydrophobicContact CB-CB 4.48Å; L1115-V1406 HydrophobicContact CB-CG1 4.27Å; L1115-V1406 HydrophobicContact CB-CG2 4.28Å; L1115-V1406 HydrophobicContact CD2-CG1 4.06Å; L1115-V1406 HydrophobicContact CD2-CG2 4.46Å; L1115-V1406 HydrophobicContact CG-CG1 4.26Å; L1115-V1406 CarbonylContact O-C 3.48Å; L1115-V1406 VanDerWaalsContact O-CA 3.29Å; L1115-V1406 WeakPolarHBondContact O-CA 3.42Å; I1117-V1406 HydrophobicContact CD1-CG1 3.83Å; I1117-V1406 HydrophobicContact CG1-CG1 4.3Å; L1129-V1406 HydrophobicContact CD1-CG1 4.46Å; L1132-V1406 HydrophobicContact CD2-CB 4.45Å; L1132-V1406 HydrophobicContact CD2-CG1 4.1Å; L1132-V1406 HydrophobicContact CD2-CG2 4.08Å; L1216-V1406 HydrophobicContact CB-CG1 4.46Å; L1216-V1406 HydrophobicContact CB-CG2 4.4Å; L1216-V1406 HydrophobicContact CD2-CG1 4.16Å; L1216-V1406 HydrophobicContact CD2-CG2 4.44Å; L1216-V1406 HydrophobicContact CG-CG1 4.2Å; L1216-V1406 CarbonylContact O-C 3.51Å; L1216-V1406 VanDerWaalsContact O-CA 3.3Å; L1216-V1406 WeakPolarHBondContact O-CA 3.37Å; I1218-V1406 HydrophobicContact CD1-CG1 3.81Å; I1218-V1406 HydrophobicContact CG1-CG1 4.3Å; L1233-V1406 HydrophobicContact CD2-CB 4.38Å; L1233-V1406 HydrophobicContact CD2-CG1 3.73Å; L1233-V1406 HydrophobicContact CD2-CG2 3.88Å; F1379-V1406 PolarHBondContact O-N 3.19Å; L1380-V1406 CarbonylContact C-O 3.54Å; L1380-V1406 VanDerWaalsContact CA-O 3.27Å; L1380-V1406 WeakPolarHBondContact CA-O 3.35Å; L1380-V1406 HydrophobicContact CB-CB 4.46Å; L1380-V1406 HydrophobicContact CD1-CG2 4.38Å; L1380-V1406 HydrophobicContact CD2-CB 4.06Å; L1380-V1406 HydrophobicContact CD2-CG1 4.2Å; L1380-V1406 HydrophobicContact CD2-CG2 4.21Å; L1380-V1406 HydrophobicContact CG-CB 3.93Å; L1380-V1406 HydrophobicContact CG-CG2 4.13Å; I1381-V1406 PolarHBondContact N-O 3.12Å
1407	L	90.2	Very high	83.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	134.4	-174.2	-54.3	175.9	0	0	0	108.7	I1114 L1115 L1116 I1117 I1215 L1216 L1217 I1218 I1381 C1384 L1395 F1405 L1419	I1114-L1407 HydrophobicContact CG2-CD1 3.9Å; I1114-L1407 HydrophobicContact CG2-CG 4.25Å; L1115-L1407 PolarHBondContact O-N 3.35Å; L1116-L1407 CarbonylContact C-O 3.53Å; L1116-L1407 WeakPolarHBondContact CA-O 3.37Å; L1116-L1407 HydrophobicContact CD1-CB 4.12Å; I1117-L1407 PolarHBondContact N-O 3.06Å; I1215-L1407 HydrophobicContact CG2-CD1 3.99Å; L1216-L1407 PolarHBondContact O-N 2.81Å; L1217-L1407 CarbonylContact C-O 3.24Å; L1217-L1407 WeakPolarHBondContact CA-O 3.28Å; L1217-L1407 HydrophobicContact CD1-CB 4.32Å; I1218-L1407 PolarHBondContact N-O 3.27Å; I1381-L1407 HydrophobicContact CB-CD2 3.77Å; I1381-L1407 HydrophobicContact CD1-CD2 3.94Å; I1381-L1407 HydrophobicContact CG1-CD2 3.9Å; I1381-L1407 CarbonylContact O-C 3.5Å; I1381-L1407 WeakPolarHBondContact O-CA 3.4Å; C1384-L1407 HydrophobicContact CB-CB 4.31Å; C1384-L1407 HydrophobicContact CB-CD2 4.39Å; L1395-L1407 HydrophobicContact CD1-CD1 3.92Å; L1395-L1407 HydrophobicContact CD2-CD1 4.48Å; F1405-L1407 HydrophobicContact CD1-CD2 4.43Å; L1407-L1419 HydrophobicContact CD1-CD1 3.6Å; L1407-L1419 HydrophobicContact CD1-CD2 4.14Å
1408	T	85.9	Confident	83.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	143.3	169.1	77.4	0	0	0	0	110.7	I1117 K1125 L1129 I1218 L1230 I1381 D1382 D1383 C1384	I1117-T1408 HydrophobicContact CB-CG2 4.01Å; I1117-T1408 HydrophobicContact CD1-CG2 4.4Å; I1117-T1408 HydrophobicContact CG2-CG2 4.35Å; I1117-T1408 CarbonylContact O-C 3.59Å; I1117-T1408 VanDerWaalsContact O-CA 3.25Å; I1117-T1408 WeakPolarHBondContact O-CA 3.38Å; K1125-T1408 HydrophobicContact CB-CG2 4.24Å; L1129-T1408 HydrophobicContact CB-CG2 4.09Å; L1129-T1408 HydrophobicContact CD1-CG2 3.51Å; L1129-T1408 VanDerWaalsContact CD1-CG2 3.45Å; L1129-T1408 HydrophobicContact CG-CG2 4.42Å; I1218-T1408 HydrophobicContact CB-CG2 4.1Å; I1218-T1408 VanDerWaalsContact O-CA 3.23Å; I1218-T1408 WeakPolarHBondContact O-CA 3.33Å; L1230-T1408 HydrophobicContact CB-CG2 4.1Å; L1230-T1408 HydrophobicContact CD1-CG2 3.5Å; L1230-T1408 HydrophobicContact CG-CG2 4.44Å; I1381-T1408 PolarHBondContact O-N 3.19Å; D1382-T1408 VanDerWaalsContact CA-OG1 3.26Å; D1382-T1408 WeakPolarHBondContact CA-OG1 3.29Å; D1382-T1408 WeakPolarHBondContact OD1-CB 3.36Å; D1382-T1408 WeakPolarHBondContact OD1-CG2 3.36Å; D1382-T1408 PolarHBondContact OD1-OG1 2.9Å; D1383-T1408 CarbonylContact C-O 3.55Å; D1383-T1408 WeakPolarHBondContact CA-O 3.37Å; D1383-T1408 PolarHBondContact N-O 3.18Å; D1383-T1408 PolarHBondContact N-OG1 3.08Å; C1384-T1408 WeakPolarHBondContact CB-O 3.5Å; C1384-T1408 PolarHBondContact N-O 3.28Å
1409	C	85.8	Confident	83.4	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	162.1	177.5	-55.3	0	0	0	0	111.4	L1116 I1117 V1118 K1125 L1217 I1218 V1219 G1220 K1226 D1385 A1416	L1116-C1409 HydrophobicContact CD1-CB 4.21Å; L1116-C1409 VanDerWaalsContact CD1-SG 3.52Å; I1117-C1409 PolarHBondContact O-N 3.11Å; V1118-C1409 WeakPolarHBondContact CA-O 3.35Å; K1125-C1409 WeakPolarHBondContact CD-O 3.37Å; K1125-C1409 WeakPolarHBondContact CE-O 3.3Å; L1217-C1409 HydrophobicContact CD1-CB 4.33Å; I1218-C1409 PolarHBondContact O-N 3Å; I1218-C1409 VanDerWaalsContact O-N 3.08Å; V1219-C1409 HydrophobicContact CG2-CB 4.34Å; G1220-C1409 PolarHBondContact N-O 2.95Å; K1226-C1409 WeakPolarHBondContact CD-O 3.32Å; K1226-C1409 WeakPolarHBondContact CE-O 3.43Å; D1385-C1409 HydrophobicContact CB-CB 4.31Å; D1385-C1409 WeakPolarHBondContact OD1-CA 3.24Å; D1385-C1409 WeakPolarHBondContact OD1-CB 3.41Å; C1409-A1416 HydrophobicContact CB-CB 3.97Å; C1409-A1416 VanDerWaalsContact SG-CB 3.57Å
1410	D	82.6	Confident	83.1	Confident	26.2 Å²	26.2	38.5 Å²	38.5	14%	0.14	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	142.8	163.2	-172.1	6.4	0	0	0	111.1	G1220 D1385 K1412 S1413	G1220-D1410 WeakPolarHBondContact O-CA 3.12Å; D1385-D1410 PolarHBondContact OD2-N 3.12Å; D1410-K1412 PolarHBondContact O-N 3.33Å; D1410-K1412 VanDerWaalsContact O-N 3.15Å; D1410-K1412 PolarHBondContact OD1-N 3.05Å; D1410-S1413 VanDerWaalsContact O-CB 3.27Å; D1410-S1413 WeakPolarHBondContact O-CB 3.3Å; D1410-S1413 PolarHBondContact O-N 3.05Å
1411	S	78.2	Confident	82.6	Confident	63.2 Å²	63.2	43.4 Å²	43.4	44%	0.442	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-27.8	172.2	59.3	0	0	0	0	115.2	V1219	V1219-S1411 VanDerWaalsContact CG1-CA 3.46Å
1412	K	79	Confident	82.4	Confident	175.2 Å²	175.2	39.2 Å²	39.2	76%	0.762	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-4.1	-179.1	-63	177.7	-177.7	175.9	0	113.7	D1410	D1410-K1412 PolarHBondContact O-N 3.33Å; D1410-K1412 VanDerWaalsContact O-N 3.15Å; D1410-K1412 PolarHBondContact OD1-N 3.05Å
1413	S	78.4	Confident	82.1	Confident	13.6 Å²	13.6	43.8 Å²	43.8	10%	0.095	22%	0.222	C	C	.	.			trans	-66.8	143.3	-173.7	178	0	0	0	0	113.3	D1385 M1390 D1410 V1415 A1416 R1417	D1385-S1413 WeakPolarHBondContact CB-OG 3.35Å; M1390-S1413 WeakPolarHBondContact CE-OG 3.44Å; D1410-S1413 VanDerWaalsContact O-CB 3.27Å; D1410-S1413 WeakPolarHBondContact O-CB 3.3Å; D1410-S1413 PolarHBondContact O-N 3.05Å; S1413-V1415 VanDerWaalsContact C-N 3.28Å; S1413-V1415 PolarHBondContact O-N 2.8Å; S1413-V1415 WeakPolarHBondContact OG-CB 3.37Å; S1413-V1415 PolarHBondContact OG-N 3.21Å; S1413-V1415 VanDerWaalsContact OG-N 3.1Å; S1413-A1416 PolarHBondContact O-N 3.11Å; S1413-R1417 PolarHBondContact O-N 3.14Å; S1413-R1417 PolarHBondContact O-NE 3.01Å
1414	S	80	Confident	81.7	Confident	43.8 Å²	43.8	44.4 Å²	44.4	31%	0.306	23%	0.225	S	C	.	.	H	α-helix	trans	-64.1	-35.8	167.8	50.3	0	0	0	0	112	M1390 A1416 R1417 N1418	M1390-S1414 WeakPolarHBondContact CE-OG 3.28Å; S1414-A1416 VanDerWaalsContact C-N 3.34Å; S1414-A1416 PolarHBondContact O-N 2.88Å; S1414-R1417 WeakPolarHBondContact O-CB 3.46Å; S1414-R1417 PolarHBondContact O-N 3.09Å; S1414-R1417 VanDerWaalsContact O-N 3.15Å; S1414-N1418 VanDerWaalsContact O-CG 3.3Å; S1414-N1418 PolarHBondContact O-N 3.09Å; S1414-N1418 PolarHBondContact O-OD1 3.18Å
1415	V	81.8	Confident	81.5	Confident	4.6 Å²	4.6	43.1 Å²	43.1	3%	0.028	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-43.1	177.4	177.5	0	0	0	0	110.7	D1385 M1390 L1392 S1413 R1417 N1418 L1419	D1385-V1415 HydrophobicContact CB-CB 4.31Å; D1385-V1415 HydrophobicContact CB-CG2 4.32Å; M1390-V1415 HydrophobicContact CE-CB 4.09Å; M1390-V1415 HydrophobicContact CE-CG2 3.47Å; M1390-V1415 VanDerWaalsContact CE-CG2 3.47Å; M1390-V1415 HydrophobicContact CG-CG2 3.73Å; M1390-V1415 HydrophobicContact SD-CG2 4.39Å; L1392-V1415 HydrophobicContact CD1-CG1 4.34Å; L1392-V1415 HydrophobicContact CD2-CG1 3.98Å; L1392-V1415 HydrophobicContact CG-CG1 4.35Å; S1413-V1415 VanDerWaalsContact C-N 3.28Å; S1413-V1415 PolarHBondContact O-N 2.8Å; S1413-V1415 WeakPolarHBondContact OG-CB 3.37Å; S1413-V1415 PolarHBondContact OG-N 3.21Å; S1413-V1415 VanDerWaalsContact OG-N 3.1Å; V1415-R1417 VanDerWaalsContact C-N 3.35Å; V1415-R1417 PolarHBondContact O-N 3.16Å; V1415-N1418 PolarHBondContact O-N 3.22Å; V1415-L1419 HydrophobicContact CG1-CD1 3.89Å; V1415-L1419 HydrophobicContact CG1-CG 4.41Å; V1415-L1419 WeakPolarHBondContact O-CB 3.37Å; V1415-L1419 WeakPolarHBondContact O-CG 3.41Å; V1415-L1419 PolarHBondContact O-N 3.05Å
1416	A	80.8	Confident	81.2	Confident	5.8 Å²	5.8	45.9 Å²	45.9	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-60.8	-44.3	175.8	0	0	0	0	0	111.7	L1116 V1118 L1217 V1219 C1409 S1413 S1414 N1418 L1419 C1420	L1116-A1416 HydrophobicContact CD2-CB 4.38Å; V1118-A1416 HydrophobicContact CG1-CB 4.12Å; V1118-A1416 HydrophobicContact CG2-CB 4.42Å; L1217-A1416 HydrophobicContact CD2-CB 4.42Å; V1219-A1416 HydrophobicContact CG2-CB 4.15Å; C1409-A1416 HydrophobicContact CB-CB 3.97Å; C1409-A1416 VanDerWaalsContact SG-CB 3.57Å; S1413-A1416 PolarHBondContact O-N 3.11Å; S1414-A1416 VanDerWaalsContact C-N 3.34Å; S1414-A1416 PolarHBondContact O-N 2.88Å; A1416-N1418 VanDerWaalsContact C-N 3.34Å; A1416-N1418 PolarHBondContact O-N 3.35Å; A1416-L1419 PolarHBondContact O-N 3.27Å; A1416-C1420 WeakPolarHBondContact O-CB 3.36Å; A1416-C1420 PolarHBondContact O-N 2.97Å; A1416-C1420 VanDerWaalsContact O-N 3.1Å; A1416-C1420 PolarHBondContact O-SG 3.29Å
1417	R	80.7	Confident	81.1	Confident	147.8 Å²	147.8	49.8 Å²	49.8	56%	0.558	26%	0.255	S	S	*	.	H	α-helix	trans	-61.3	-43.6	175.7	-75.7	-177	-76.4	123.7	-7.6	112.2	S1413 S1414 V1415 C1420 N1421	S1413-R1417 PolarHBondContact O-N 3.14Å; S1413-R1417 PolarHBondContact O-NE 3.01Å; S1414-R1417 WeakPolarHBondContact O-CB 3.46Å; S1414-R1417 PolarHBondContact O-N 3.09Å; S1414-R1417 VanDerWaalsContact O-N 3.15Å; V1415-R1417 VanDerWaalsContact C-N 3.35Å; V1415-R1417 PolarHBondContact O-N 3.16Å; R1417-C1420 PolarHBondContact O-N 2.94Å; R1417-N1421 PolarHBondContact O-N 3.3Å; R1417-N1421 PolarHBondContact O-ND2 2.76Å
1418	N	78.5	Confident	80.8	Confident	71.6 Å²	71.6	51.5 Å²	51.5	38%	0.383	26%	0.264	S	S	.	.	H	α-helix	trans	-68.4	-40.5	-179.7	-69.6	-8.2	0	0	0	112.3	L1392 S1414 V1415 A1416 N1421	L1392-N1418 HydrophobicContact CD1-CB 3.73Å; S1414-N1418 VanDerWaalsContact O-CG 3.3Å; S1414-N1418 PolarHBondContact O-N 3.09Å; S1414-N1418 PolarHBondContact O-OD1 3.18Å; V1415-N1418 PolarHBondContact O-N 3.22Å; A1416-N1418 VanDerWaalsContact C-N 3.34Å; A1416-N1418 PolarHBondContact O-N 3.35Å; N1418-N1421 WeakPolarHBondContact O-CB 3.39Å; N1418-N1421 PolarHBondContact O-N 3.05Å
1419	L	81.5	Confident	80.8	Confident	0.4 Å²	0.4	56 Å²	56	0%	0.002	29%	0.291	C	S	.	.	H	α-helix	trans	-66.9	-39	176.1	-75.7	170.6	0	0	0	112.3	L1116 L1217 L1392 L1395 L1407 V1415 A1416 N1421 R1422 C1425	L1116-L1419 HydrophobicContact CD1-CD1 3.84Å; L1116-L1419 HydrophobicContact CD2-CB 3.86Å; L1116-L1419 HydrophobicContact CD2-CD1 4.44Å; L1217-L1419 HydrophobicContact CD1-CD1 4.01Å; L1217-L1419 HydrophobicContact CD2-CB 3.83Å; L1217-L1419 HydrophobicContact CD2-CD1 4.41Å; L1392-L1419 HydrophobicContact CD1-CD2 3.97Å; L1392-L1419 HydrophobicContact CD1-CG 3.84Å; L1392-L1419 HydrophobicContact CD2-CD1 4.36Å; L1392-L1419 HydrophobicContact CD2-CD2 3.94Å; L1392-L1419 HydrophobicContact CD2-CG 4.13Å; L1395-L1419 HydrophobicContact CD1-CD2 4.42Å; L1395-L1419 HydrophobicContact CD2-CD2 3.89Å; L1407-L1419 HydrophobicContact CD1-CD1 3.6Å; L1407-L1419 HydrophobicContact CD1-CD2 4.14Å; V1415-L1419 HydrophobicContact CG1-CD1 3.89Å; V1415-L1419 HydrophobicContact CG1-CG 4.41Å; V1415-L1419 WeakPolarHBondContact O-CB 3.37Å; V1415-L1419 WeakPolarHBondContact O-CG 3.41Å; V1415-L1419 PolarHBondContact O-N 3.05Å; A1416-L1419 PolarHBondContact O-N 3.27Å; L1419-N1421 PolarHBondContact O-N 2.88Å; L1419-N1421 VanDerWaalsContact O-N 3.15Å; L1419-R1422 WeakPolarHBondContact O-CB 3.23Å; L1419-R1422 PolarHBondContact O-N 3.09Å; L1419-C1425 VanDerWaalsContact O-CB 3.25Å; L1419-C1425 WeakPolarHBondContact O-CB 3.33Å; L1419-C1425 PolarHBondContact O-SG 3.2Å; L1419-C1425 VanDerWaalsContact O-SG 3.34Å
1420	C	79.6	Confident	80.5	Confident	55.4 Å²	55.4	56.7 Å²	56.7	37%	0.374	30%	0.295	S	S	.	.	H	α-helix	trans	-59.9	-23.4	175.1	-76.1	0	0	0	0	113.7	A1416 R1417 R1422	A1416-C1420 WeakPolarHBondContact O-CB 3.36Å; A1416-C1420 PolarHBondContact O-N 2.97Å; A1416-C1420 VanDerWaalsContact O-N 3.1Å; A1416-C1420 PolarHBondContact O-SG 3.29Å; R1417-C1420 PolarHBondContact O-N 2.94Å; C1420-R1422 VanDerWaalsContact C-N 3.27Å; C1420-R1422 PolarHBondContact O-N 3.14Å
1421	N	75.8	Confident	80.4	Confident	125.2 Å²	125.2	58.4 Å²	58.4	67%	0.67	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-13.2	176.1	-67.5	-21.6	0	0	0	113.1	R1417 N1418 L1419	R1417-N1421 PolarHBondContact O-N 3.3Å; R1417-N1421 PolarHBondContact O-ND2 2.76Å; N1418-N1421 WeakPolarHBondContact O-CB 3.39Å; N1418-N1421 PolarHBondContact O-N 3.05Å; L1419-N1421 PolarHBondContact O-N 2.88Å; L1419-N1421 VanDerWaalsContact O-N 3.15Å
1422	R	77.2	Confident	80.4	Confident	49 Å²	49	57.3 Å²	57.3	19%	0.185	31%	0.308	C	S	.	.	S	Bend	trans	-78.4	137.1	177.5	-63.2	-177.8	57.1	126.5	-6.3	111.4	L1395 P1396 Q1397 L1419 C1420 D1424 C1425	L1395-R1422 PolarHBondContact O-NH1 3.26Å; P1396-R1422 PolarHBondContact O-NH1 3.11Å; P1396-R1422 VanDerWaalsContact O-NH1 3.12Å; P1396-R1422 PolarHBondContact O-NH2 2.99Å; Q1397-R1422 PolarHBondContact O-NH2 3.29Å; Q1397-R1422 VanDerWaalsContact O-NH2 3.09Å; L1419-R1422 WeakPolarHBondContact O-CB 3.23Å; L1419-R1422 PolarHBondContact O-N 3.09Å; C1420-R1422 VanDerWaalsContact C-N 3.27Å; C1420-R1422 PolarHBondContact O-N 3.14Å; R1422-D1424 VanDerWaalsContact C-N 3.28Å; R1422-D1424 VanDerWaalsContact CB-OD1 3.25Å; R1422-D1424 WeakPolarHBondContact CB-OD1 3.33Å; R1422-D1424 IonicContact CZ-OD1 3.07Å; R1422-D1424 IonicContact CZ-OD2 3.44Å; R1422-D1424 IonicContact NE-OD1 3.44Å; R1422-D1424 PolarHBondContact NE-OD1 3.22Å; R1422-D1424 IonicContact NE-OD2 3.34Å; R1422-D1424 IonicContact NH2-OD1 3.26Å; R1422-D1424 PolarHBondContact NH2-OD1 3.26Å; R1422-D1424 IonicContact NH2-OD2 3.2Å; R1422-D1424 PolarHBondContact NH2-OD2 3.16Å; R1422-D1424 PolarHBondContact O-N 3.34Å; R1422-C1425 HydrophobicContact CB-CB 4.1Å; R1422-C1425 WeakPolarHBondContact O-CB 3.29Å; R1422-C1425 PolarHBondContact O-N 3.19Å; R1422-C1425 VanDerWaalsContact O-N 3.09Å
1423	I	75.5	Confident	80.5	Confident	98 Å²	98	49.7 Å²	49.7	50%	0.503	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-28.8	-177	-53	169.9	0	0	0	111.7	R1078 A1082 T1085 C1425 C2064	R1078-I1423 PolarHBondContact NE-O 2.96Å; R1078-I1423 VanDerWaalsContact NE-O 3.09Å; R1078-I1423 PolarHBondContact NH1-O 3Å; R1078-I1423 PolarHBondContact NH2-O 3.31Å; R1078-I1423 VanDerWaalsContact NH2-O 3.13Å; A1082-I1423 HydrophobicContact CB-CG2 4.1Å; T1085-I1423 HydrophobicContact CG2-CD1 4.14Å; T1085-I1423 HydrophobicContact CG2-CG2 4.22Å; I1423-C1425 VanDerWaalsContact C-N 3.34Å; I1423-C2064 HydrophobicContact CG1-CB 4.43Å
1424	D	78.7	Confident	80.7	Confident	11.4 Å²	11.4	51.8 Å²	51.8	6%	0.061	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	3.2	179.9	59.7	-11.8	0	0	0	114	A1082 R1086 S1113 I1114 C1214 I1215 R1422	A1082-D1424 HydrophobicContact CB-CB 4.05Å; R1086-D1424 IonicContact NH2-OD2 3.27Å; R1086-D1424 PolarHBondContact NH2-OD2 2.97Å; S1113-D1424 WeakPolarHBondContact CA-O 3.21Å; S1113-D1424 VanDerWaalsContact CB-O 3.3Å; S1113-D1424 WeakPolarHBondContact CB-O 3.3Å; I1114-D1424 PolarHBondContact N-O 3.17Å; C1214-D1424 HydrophobicContact CB-CB 4.33Å; C1214-D1424 PolarHBondContact N-O 3.43Å; I1215-D1424 PolarHBondContact N-O 3.42Å; R1422-D1424 VanDerWaalsContact C-N 3.28Å; R1422-D1424 VanDerWaalsContact CB-OD1 3.25Å; R1422-D1424 WeakPolarHBondContact CB-OD1 3.33Å; R1422-D1424 IonicContact CZ-OD1 3.07Å; R1422-D1424 IonicContact CZ-OD2 3.44Å; R1422-D1424 IonicContact NE-OD1 3.44Å; R1422-D1424 PolarHBondContact NE-OD1 3.22Å; R1422-D1424 IonicContact NE-OD2 3.34Å; R1422-D1424 IonicContact NH2-OD1 3.26Å; R1422-D1424 PolarHBondContact NH2-OD1 3.26Å; R1422-D1424 IonicContact NH2-OD2 3.2Å; R1422-D1424 PolarHBondContact NH2-OD2 3.16Å; R1422-D1424 PolarHBondContact O-N 3.34Å
1425	C	83	Confident	80.9	Confident	11.4 Å²	11.4	54 Å²	54	8%	0.077	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	133.8	-178	-173.8	0	0	0	0	112.9	R1078 I1114 I1215 L1419 R1422 I1423	R1078-C1425 VanDerWaalsContact CZ-O 3.26Å; R1078-C1425 PolarHBondContact NE-O 3.28Å; R1078-C1425 PolarHBondContact NH2-O 3.18Å; I1114-C1425 HydrophobicContact CB-CB 4.36Å; I1114-C1425 CarbonylContact O-C 3.56Å; I1114-C1425 WeakPolarHBondContact O-CA 3.48Å; I1215-C1425 HydrophobicContact CB-CB 4.23Å; I1215-C1425 HydrophobicContact CG2-CB 4.49Å; I1215-C1425 CarbonylContact O-C 3.24Å; I1215-C1425 WeakPolarHBondContact O-CA 3.38Å; L1419-C1425 VanDerWaalsContact O-CB 3.25Å; L1419-C1425 WeakPolarHBondContact O-CB 3.33Å; L1419-C1425 PolarHBondContact O-SG 3.2Å; L1419-C1425 VanDerWaalsContact O-SG 3.34Å; R1422-C1425 HydrophobicContact CB-CB 4.1Å; R1422-C1425 WeakPolarHBondContact O-CB 3.29Å; R1422-C1425 PolarHBondContact O-N 3.19Å; R1422-C1425 VanDerWaalsContact O-N 3.09Å; I1423-C1425 VanDerWaalsContact C-N 3.34Å
1426	Q	84.1	Confident	80.8	Confident	57.6 Å²	57.6	60.3 Å²	60.3	27%	0.269	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	120.8	174.1	-178.9	137.7	8.5	0	0	109.9	S1074 L1075 R1078 I1114 L1115 L1116 I1210 N1213 I1215 L1217	S1074-Q1426 PolarHBondContact OG-NE2 2.91Å; S1074-Q1426 PolarHBondContact OG-OE1 3.31Å; S1074-Q1426 VanDerWaalsContact OG-OE1 3.09Å; L1075-Q1426 HydrophobicContact CD2-CB 4.01Å; R1078-Q1426 HydrophobicContact CG-CB 4.35Å; I1114-Q1426 PolarHBondContact O-N 2.93Å; L1115-Q1426 HydrophobicContact CD1-CG 4.42Å; L1116-Q1426 PolarHBondContact N-O 3.21Å; I1210-Q1426 HydrophobicContact CB-CG 4.11Å; I1210-Q1426 HydrophobicContact CG1-CG 3.74Å; I1210-Q1426 HydrophobicContact CG2-CG 4.12Å; N1213-Q1426 HydrophobicContact CB-CB 4.32Å; N1213-Q1426 PolarHBondContact ND2-OE1 3.1Å; I1215-Q1426 PolarHBondContact O-N 2.91Å; L1217-Q1426 PolarHBondContact N-O 2.96Å
1427	L	85.1	Confident	80.7	Confident	85.6 Å²	85.6	61.6 Å²	61.6	45%	0.448	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	130.8	178.8	179.9	66.1	0	0	0	111.5	L1116 V1118 L1217 V1219 T1429	L1116-L1427 HydrophobicContact CB-CD1 4.32Å; L1116-L1427 HydrophobicContact CD2-CD1 4.01Å; L1116-L1427 HydrophobicContact CG-CD1 4.17Å; L1116-L1427 CarbonylContact O-C 3.55Å; L1116-L1427 WeakPolarHBondContact O-CA 3.5Å; V1118-L1427 HydrophobicContact CB-CD1 3.99Å; V1118-L1427 HydrophobicContact CG1-CD1 3.74Å; V1118-L1427 HydrophobicContact CG2-CD1 3.39Å; V1118-L1427 HydrophobicContact CG2-CG 4.23Å; L1217-L1427 HydrophobicContact CD2-CD1 4.15Å; L1217-L1427 HydrophobicContact CG-CD1 4.15Å; V1219-L1427 HydrophobicContact CB-CD1 3.76Å; V1219-L1427 HydrophobicContact CG1-CD1 4.48Å; V1219-L1427 HydrophobicContact CG2-CD1 3.62Å; L1427-T1429 HydrophobicContact CD1-CG2 4.46Å; L1427-T1429 HydrophobicContact CD2-CG2 4.24Å; L1427-T1429 HydrophobicContact CG-CG2 4.23Å
1428	L	85.2	Confident	80.9	Confident	36.2 Å²	36.2	56.8 Å²	56.8	19%	0.19	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	119.3	168.3	-179.4	87.6	0	0	0	109.2	E1067 V1068 A1071 L1115 L1116 I1117 V1118 Y1128 L1216 L1217 I1218 V1219 V1430	E1067-L1428 HydrophobicContact CB-CD1 4.34Å; V1068-L1428 HydrophobicContact CB-CD2 4.14Å; V1068-L1428 HydrophobicContact CG2-CD2 3.65Å; V1068-L1428 VanDerWaalsContact CG2-CD2 3.46Å; A1071-L1428 HydrophobicContact CB-CB 4.34Å; A1071-L1428 HydrophobicContact CB-CD1 4.34Å; A1071-L1428 HydrophobicContact CB-CD2 4.07Å; A1071-L1428 HydrophobicContact CB-CG 4.43Å; L1115-L1428 HydrophobicContact CD1-CB 4.13Å; L1116-L1428 PolarHBondContact O-N 3.35Å; I1117-L1428 CarbonylContact C-O 3.45Å; I1117-L1428 WeakPolarHBondContact CA-O 3.39Å; I1117-L1428 HydrophobicContact CG1-CB 4.49Å; I1117-L1428 HydrophobicContact CG1-CD2 4.38Å; V1118-L1428 PolarHBondContact N-O 2.99Å; Y1128-L1428 HydrophobicContact CD1-CD2 4.26Å; Y1128-L1428 HydrophobicContact CE1-CD2 4.35Å; L1216-L1428 HydrophobicContact CD1-CB 4Å; L1217-L1428 PolarHBondContact O-N 2.77Å; I1218-L1428 WeakPolarHBondContact CA-O 3.46Å; I1218-L1428 HydrophobicContact CG2-CD2 4.22Å; V1219-L1428 PolarHBondContact N-O 2.89Å; L1428-V1430 HydrophobicContact CD2-CG2 4.15Å
1429	T	84.4	Confident	81.1	Confident	93 Å²	93	53.5 Å²	53.5	57%	0.571	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	120.5	177.6	37.1	0	0	0	0	111.1	V1118 V1219 L1427 S1431	V1118-T1429 HydrophobicContact CG2-CG2 3.47Å; V1118-T1429 VanDerWaalsContact CG2-CG2 3.47Å; V1118-T1429 CarbonylContact O-C 3.55Å; V1118-T1429 WeakPolarHBondContact O-CA 3.4Å; V1219-T1429 HydrophobicContact CG1-CG2 4.46Å; V1219-T1429 CarbonylContact O-C 3.55Å; V1219-T1429 VanDerWaalsContact O-CA 3.27Å; V1219-T1429 WeakPolarHBondContact O-CA 3.32Å; L1427-T1429 HydrophobicContact CD1-CG2 4.46Å; L1427-T1429 HydrophobicContact CD2-CG2 4.24Å; L1427-T1429 HydrophobicContact CG-CG2 4.23Å; T1429-S1431 PolarHBondContact O-N 3.1Å
1430	V	80.5	Confident	80.8	Confident	15 Å²	15	55 Å²	55	9%	0.091	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-76.6	110.2	175.3	-178.1	0	0	0	0	109	I1117 V1118 K1125 Y1128 I1218 V1219 Y1229 L1428	I1117-V1430 HydrophobicContact CG2-CG2 3.61Å; V1118-V1430 PolarHBondContact O-N 2.97Å; K1125-V1430 HydrophobicContact CG-CG2 4.3Å; Y1128-V1430 HydrophobicContact CD1-CG2 4.47Å; Y1128-V1430 HydrophobicContact CD2-CG1 4.24Å; Y1128-V1430 HydrophobicContact CD2-CG2 4.31Å; Y1128-V1430 HydrophobicContact CE1-CG2 4.39Å; Y1128-V1430 HydrophobicContact CE2-CB 4.37Å; Y1128-V1430 HydrophobicContact CE2-CG1 3.66Å; Y1128-V1430 HydrophobicContact CE2-CG2 4.04Å; Y1128-V1430 HydrophobicContact CG-CG2 4.37Å; I1218-V1430 HydrophobicContact CG2-CG2 3.71Å; V1219-V1430 PolarHBondContact O-N 3.34Å; Y1229-V1430 HydrophobicContact CD2-CG1 4.36Å; Y1229-V1430 HydrophobicContact CD2-CG2 4.3Å; Y1229-V1430 HydrophobicContact CE2-CG1 4.46Å; Y1229-V1430 HydrophobicContact CG-CG2 4.49Å; L1428-V1430 HydrophobicContact CD2-CG2 4.15Å
1431	S	80.2	Confident	80.7	Confident	61.6 Å²	61.6	53 Å²	53	43%	0.431	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-78.8	159.3	175.6	57.6	0	0	0	0	112	R1063 H1064 T1429	R1063-S1431 PolarHBondContact NH1-OG 3.37Å; R1063-S1431 PolarHBondContact NH2-OG 3.17Å; H1064-S1431 PolarHBondContact CE1-O 3.18Å; H1064-S1431 PolarHBondContact NE2-O 2.84Å; H1064-S1431 VanDerWaalsContact NE2-O 3.12Å; H1064-S1431 PolarHBondContact NE2-OG 3.05Å; H1064-S1431 VanDerWaalsContact NE2-OG 3.16Å; T1429-S1431 PolarHBondContact O-N 3.1Å
1432	G	79.2	Confident	81	Confident	41 Å²	41	47.1 Å²	47.1	42%	0.423	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-65.2	159.7	172.7	0	0	0	0	0	113	R1063 T1434 S1472	R1063-G1432 PolarHBondContact NH2-O 2.97Å; G1432-T1434 PolarHBondContact O-N 3.47Å; G1432-S1472 CarbonylContact C-O 3.54Å; G1432-S1472 VanDerWaalsContact CA-O 3.23Å; G1432-S1472 WeakPolarHBondContact CA-O 3.31Å
1433	L	80.3	Confident	81.1	Confident	16.6 Å²	16.6	49.6 Å²	49.6	9%	0.087	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-63.9	135.6	180	-61.2	177.2	0	0	0	112	I1060 E1437 R1438 A1441 S1472 P1474 L1477	I1060-L1433 HydrophobicContact CG2-CD1 4.27Å; I1060-L1433 HydrophobicContact CG2-CD2 4.04Å; I1060-L1433 WeakPolarHBondContact O-CD2 3.27Å; L1433-E1437 HydrophobicContact CB-CB 4.15Å; L1433-E1437 HydrophobicContact CD2-CB 4.12Å; L1433-E1437 WeakPolarHBondContact CD2-OE2 3.2Å; L1433-R1438 HydrophobicContact CB-CG 3.71Å; L1433-R1438 HydrophobicContact CD1-CG 4.43Å; L1433-R1438 PolarHBondContact O-NE 3.33Å; L1433-R1438 PolarHBondContact O-NH2 3.14Å; L1433-R1438 VanDerWaalsContact O-NH2 3.08Å; L1433-A1441 HydrophobicContact CD1-CB 4.39Å; L1433-S1472 WeakPolarHBondContact CB-O 3.49Å; L1433-S1472 WeakPolarHBondContact CG-O 3.31Å; L1433-S1472 PolarHBondContact N-O 2.99Å; L1433-P1474 HydrophobicContact CD1-CB 4.39Å; L1433-P1474 HydrophobicContact CD1-CG 3.91Å; L1433-P1474 HydrophobicContact CD2-CG 4.33Å; L1433-P1474 HydrophobicContact CG-CG 4.08Å; L1433-L1477 HydrophobicContact CD1-CD1 3.87Å
1434	T	82.7	Confident	80.9	Confident	57.8 Å²	57.8	47 Å²	47	36%	0.355	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-70.2	160.2	168.8	62.6	0	0	0	0	111.2	G1432 H1436 E1437 R1438	G1432-T1434 PolarHBondContact O-N 3.47Å; T1434-H1436 PolarHBondContact O-N 3.08Å; T1434-H1436 VanDerWaalsContact O-N 3.14Å; T1434-E1437 WeakPolarHBondContact CB-OE2 3.33Å; T1434-E1437 WeakPolarHBondContact CG2-OE2 3.34Å; T1434-E1437 PolarHBondContact N-OE2 3.07Å; T1434-E1437 WeakPolarHBondContact O-CB 3.39Å; T1434-E1437 PolarHBondContact O-N 3.09Å; T1434-E1437 VanDerWaalsContact O-N 3.1Å; T1434-E1437 WeakPolarHBondContact OG1-CB 3.35Å; T1434-E1437 VanDerWaalsContact OG1-CD 3.22Å; T1434-E1437 WeakPolarHBondContact OG1-CG 3.33Å; T1434-E1437 PolarHBondContact OG1-N 3.11Å; T1434-E1437 PolarHBondContact OG1-OE2 3.01Å; T1434-R1438 VanDerWaalsContact O-CG 3.27Å; T1434-R1438 WeakPolarHBondContact O-CG 3.39Å; T1434-R1438 PolarHBondContact O-N 3.28Å
1435	T	83.3	Confident	80.6	Confident	89.8 Å²	89.8	48.2 Å²	48.2	55%	0.551	27%	0.273	S	S	*	.	H	α-helix	trans	-54.6	-38	-178.8	47.7	0	0	0	0	113.4	G1439 I1466	T1435-G1439 PolarHBondContact O-N 3.12Å; T1435-G1439 VanDerWaalsContact O-N 3.15Å; T1435-I1466 HydrophobicContact CG2-CG2 4.33Å
1436	H	79.8	Confident	80.2	Confident	136.8 Å²	136.8	47.9 Å²	47.9	63%	0.633	27%	0.271	S	S	*	.	H	α-helix	trans	-67.7	-44.4	175.8	-102.7	-71.9	0	0	0	112.2	T1434 R1438 G1439 A1440	T1434-H1436 PolarHBondContact O-N 3.08Å; T1434-H1436 VanDerWaalsContact O-N 3.14Å; H1436-R1438 VanDerWaalsContact C-N 3.35Å; H1436-R1438 PolarHBondContact O-N 3.03Å; H1436-G1439 CarbonylContact O-C 3.55Å; H1436-G1439 WeakPolarHBondContact O-CA 3.33Å; H1436-G1439 PolarHBondContact O-N 3.14Å; H1436-G1439 VanDerWaalsContact O-N 3.08Å; H1436-A1440 WeakPolarHBondContact O-CB 3.47Å; H1436-A1440 PolarHBondContact O-N 3.25Å
1437	E	79	Confident	79.4	Confident	32 Å²	32	46.9 Å²	46.9	15%	0.15	28%	0.276	C	S	.	.	H	α-helix	trans	-63.6	-39.4	176.8	-69.7	177.9	153.3	0	0	112	I1060 R1063 H1064 L1433 T1434 G1439 A1440 A1441	I1060-E1437 VanDerWaalsContact O-CB 3.3Å; I1060-E1437 WeakPolarHBondContact O-CB 3.24Å; I1060-E1437 WeakPolarHBondContact O-CG 3.48Å; R1063-E1437 WeakPolarHBondContact CB-OE1 3.24Å; R1063-E1437 IonicContact CZ-OE1 3.35Å; R1063-E1437 IonicContact CZ-OE2 3.97Å; R1063-E1437 IonicContact NE-OE1 3.52Å; R1063-E1437 PolarHBondContact NE-OE1 3.4Å; R1063-E1437 IonicContact NE-OE2 3.58Å; R1063-E1437 IonicContact NH2-OE1 3.45Å; R1063-E1437 IonicContact NH2-OE2 3.2Å; R1063-E1437 PolarHBondContact NH2-OE2 2.95Å; H1064-E1437 IonicContact CE1-OE1 2.99Å; H1064-E1437 IonicContact CE1-OE2 3.15Å; H1064-E1437 IonicContact NE2-OE2 3.65Å; L1433-E1437 HydrophobicContact CB-CB 4.15Å; L1433-E1437 HydrophobicContact CD2-CB 4.12Å; L1433-E1437 WeakPolarHBondContact CD2-OE2 3.2Å; T1434-E1437 WeakPolarHBondContact CB-OE2 3.33Å; T1434-E1437 WeakPolarHBondContact CG2-OE2 3.34Å; T1434-E1437 PolarHBondContact N-OE2 3.07Å; T1434-E1437 WeakPolarHBondContact O-CB 3.39Å; T1434-E1437 PolarHBondContact O-N 3.09Å; T1434-E1437 VanDerWaalsContact O-N 3.1Å; T1434-E1437 WeakPolarHBondContact OG1-CB 3.35Å; T1434-E1437 VanDerWaalsContact OG1-CD 3.22Å; T1434-E1437 WeakPolarHBondContact OG1-CG 3.33Å; T1434-E1437 PolarHBondContact OG1-N 3.11Å; T1434-E1437 PolarHBondContact OG1-OE2 3.01Å; E1437-G1439 VanDerWaalsContact C-N 3.33Å; E1437-G1439 PolarHBondContact O-N 3.14Å; E1437-A1440 WeakPolarHBondContact O-CA 3.29Å; E1437-A1440 WeakPolarHBondContact O-CB 3.21Å; E1437-A1440 PolarHBondContact O-N 3.13Å; E1437-A1441 WeakPolarHBondContact O-CB 3.35Å; E1437-A1441 PolarHBondContact O-N 2.98Å
1438	R	84.9	Confident	78.3	Confident	46.8 Å²	46.8	48 Å²	48	18%	0.177	28%	0.277	C	S	.	.	H	α-helix	trans	-58.9	-44.7	174	-63.8	175	-159.2	-174.3	4.5	111.2	L1433 T1434 H1436 A1440 A1441 V1442 I1466 A1471 L1477	L1433-R1438 HydrophobicContact CB-CG 3.71Å; L1433-R1438 HydrophobicContact CD1-CG 4.43Å; L1433-R1438 PolarHBondContact O-NE 3.33Å; L1433-R1438 PolarHBondContact O-NH2 3.14Å; L1433-R1438 VanDerWaalsContact O-NH2 3.08Å; T1434-R1438 VanDerWaalsContact O-CG 3.27Å; T1434-R1438 WeakPolarHBondContact O-CG 3.39Å; T1434-R1438 PolarHBondContact O-N 3.28Å; H1436-R1438 VanDerWaalsContact C-N 3.35Å; H1436-R1438 PolarHBondContact O-N 3.03Å; R1438-A1440 VanDerWaalsContact C-N 3.29Å; R1438-A1440 PolarHBondContact O-N 3.06Å; R1438-A1441 WeakPolarHBondContact O-CB 3.41Å; R1438-A1441 PolarHBondContact O-N 3.06Å; R1438-V1442 WeakPolarHBondContact O-CB 3.42Å; R1438-V1442 VanDerWaalsContact O-CG2 3.26Å; R1438-V1442 WeakPolarHBondContact O-CG2 3.31Å; R1438-V1442 PolarHBondContact O-N 3.05Å; R1438-I1466 HydrophobicContact CB-CB 4.41Å; R1438-I1466 HydrophobicContact CB-CD1 4.48Å; R1438-I1466 HydrophobicContact CB-CG1 4.04Å; R1438-I1466 HydrophobicContact CB-CG2 4Å; R1438-I1466 WeakPolarHBondContact CD-O 3.18Å; R1438-I1466 PolarHBondContact NH1-O 3.1Å; R1438-I1466 VanDerWaalsContact NH1-O 3.16Å; R1438-A1471 VanDerWaalsContact CD-O 3.28Å; R1438-A1471 WeakPolarHBondContact CD-O 3.37Å; R1438-A1471 VanDerWaalsContact CG-O 3.29Å; R1438-A1471 WeakPolarHBondContact CG-O 3.33Å; R1438-A1471 PolarHBondContact NE-O 2.91Å; R1438-L1477 HydrophobicContact CB-CD1 4.03Å; R1438-L1477 HydrophobicContact CG-CD1 4.18Å
1439	G	82.5	Confident	77.3	Confident	2.2 Å²	2.2	49.8 Å²	49.8	2%	0.023	28%	0.282	C	S	.	.	H	α-helix	trans	-65.6	-37	176.2	0	0	0	0	0	113.3	T1435 H1436 E1437 A1441 V1442 R1443 I1466	T1435-G1439 PolarHBondContact O-N 3.12Å; T1435-G1439 VanDerWaalsContact O-N 3.15Å; H1436-G1439 CarbonylContact O-C 3.55Å; H1436-G1439 WeakPolarHBondContact O-CA 3.33Å; H1436-G1439 PolarHBondContact O-N 3.14Å; H1436-G1439 VanDerWaalsContact O-N 3.08Å; E1437-G1439 VanDerWaalsContact C-N 3.33Å; E1437-G1439 PolarHBondContact O-N 3.14Å; G1439-A1441 VanDerWaalsContact C-N 3.31Å; G1439-A1441 PolarHBondContact O-N 2.85Å; G1439-V1442 PolarHBondContact O-N 3.47Å; G1439-R1443 VanDerWaalsContact C-NH1 3.31Å; G1439-R1443 WeakPolarHBondContact O-CB 3.41Å; G1439-R1443 WeakPolarHBondContact O-CD 3.34Å; G1439-R1443 VanDerWaalsContact O-CG 3.28Å; G1439-R1443 WeakPolarHBondContact O-CG 3.36Å; G1439-R1443 PolarHBondContact O-N 3.21Å; G1439-R1443 VanDerWaalsContact O-N 3.1Å; G1439-R1443 PolarHBondContact O-NH1 3.05Å; G1439-R1443 VanDerWaalsContact O-NH1 3.16Å; G1439-I1466 VanDerWaalsContact CA-CD1 3.41Å
1440	A	76.8	Confident	76.2	Confident	33.4 Å²	33.4	48.1 Å²	48.1	28%	0.276	28%	0.283	S	S	.	.	H	α-helix	trans	-64.3	-44.3	172.3	0	0	0	0	0	111.9	A1059 H1436 E1437 R1438 V1442 R1443 S1444	A1059-A1440 WeakPolarHBondContact O-CB 3.11Å; H1436-A1440 WeakPolarHBondContact O-CB 3.47Å; H1436-A1440 PolarHBondContact O-N 3.25Å; E1437-A1440 WeakPolarHBondContact O-CA 3.29Å; E1437-A1440 WeakPolarHBondContact O-CB 3.21Å; E1437-A1440 PolarHBondContact O-N 3.13Å; R1438-A1440 VanDerWaalsContact C-N 3.29Å; R1438-A1440 PolarHBondContact O-N 3.06Å; A1440-V1442 VanDerWaalsContact C-N 3.3Å; A1440-V1442 PolarHBondContact O-N 3.39Å; A1440-R1443 PolarHBondContact O-N 3.22Å; A1440-R1443 VanDerWaalsContact O-N 3.1Å; A1440-S1444 VanDerWaalsContact O-CB 3.28Å; A1440-S1444 WeakPolarHBondContact O-CB 3.34Å; A1440-S1444 PolarHBondContact O-N 3.29Å
1441	A	76.2	Confident	75.7	Confident	11.6 Å²	11.6	49.5 Å²	49.5	10%	0.096	29%	0.288	C	S	.	.	H	α-helix	trans	-61.2	-47.6	179.4	0	0	0	0	0	111.7	A1059 I1060 L1433 E1437 R1438 G1439 R1443 S1444 L1445 L1477	A1059-A1441 WeakPolarHBondContact O-CA 3.33Å; A1059-A1441 PolarHBondContact O-N 3.33Å; I1060-A1441 HydrophobicContact CG1-CB 4.28Å; I1060-A1441 HydrophobicContact CG2-CB 3.82Å; L1433-A1441 HydrophobicContact CD1-CB 4.39Å; E1437-A1441 WeakPolarHBondContact O-CB 3.35Å; E1437-A1441 PolarHBondContact O-N 2.98Å; R1438-A1441 WeakPolarHBondContact O-CB 3.41Å; R1438-A1441 PolarHBondContact O-N 3.06Å; G1439-A1441 VanDerWaalsContact C-N 3.31Å; G1439-A1441 PolarHBondContact O-N 2.85Å; A1441-R1443 PolarHBondContact O-N 2.85Å; A1441-S1444 PolarHBondContact O-N 3.17Å; A1441-L1445 HydrophobicContact CB-CD1 4.4Å; A1441-L1445 VanDerWaalsContact O-CB 3.3Å; A1441-L1445 WeakPolarHBondContact O-CB 3.39Å; A1441-L1445 WeakPolarHBondContact O-CD1 3.27Å; A1441-L1445 VanDerWaalsContact O-CG 3.28Å; A1441-L1445 WeakPolarHBondContact O-CG 3.42Å; A1441-L1445 PolarHBondContact O-N 3.21Å; A1441-L1477 HydrophobicContact CB-CD1 3.95Å
1442	V	81.7	Confident	75.5	Confident	1.6 Å²	1.6	51.1 Å²	51.1	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-61.7	-45.8	177.3	173.2	0	0	0	0	111.5	R1438 G1439 A1440 S1444 L1445 L1446 L1453 L1462 L1465 L1477	R1438-V1442 WeakPolarHBondContact O-CB 3.42Å; R1438-V1442 VanDerWaalsContact O-CG2 3.26Å; R1438-V1442 WeakPolarHBondContact O-CG2 3.31Å; R1438-V1442 PolarHBondContact O-N 3.05Å; G1439-V1442 PolarHBondContact O-N 3.47Å; A1440-V1442 VanDerWaalsContact C-N 3.3Å; A1440-V1442 PolarHBondContact O-N 3.39Å; V1442-S1444 VanDerWaalsContact C-N 3.3Å; V1442-S1444 PolarHBondContact O-N 3.15Å; V1442-L1445 PolarHBondContact O-N 3.04Å; V1442-L1446 HydrophobicContact CG1-CD1 3.75Å; V1442-L1446 HydrophobicContact CG1-CG 4.41Å; V1442-L1446 WeakPolarHBondContact O-CB 3.29Å; V1442-L1446 WeakPolarHBondContact O-CG 3.21Å; V1442-L1446 PolarHBondContact O-N 3.08Å; V1442-L1453 HydrophobicContact CG1-CD1 3.75Å; V1442-L1453 HydrophobicContact CG1-CG 4.45Å; V1442-L1462 HydrophobicContact CB-CD1 3.82Å; V1442-L1462 HydrophobicContact CG1-CD1 3.57Å; V1442-L1462 VanDerWaalsContact CG1-CD1 3.48Å; V1442-L1462 HydrophobicContact CG2-CD1 4.39Å; V1442-L1465 HydrophobicContact CB-CD2 4.48Å; V1442-L1465 HydrophobicContact CG1-CD2 3.91Å; V1442-L1465 HydrophobicContact CG2-CD2 3.72Å; V1442-L1465 HydrophobicContact CG2-CG 4.34Å; V1442-L1477 HydrophobicContact CG2-CD1 4.43Å; V1442-L1477 HydrophobicContact CG2-CD2 3.9Å
1443	R	79.3	Confident	75.4	Confident	101.2 Å²	101.2	49.8 Å²	49.8	38%	0.382	28%	0.279	S	S	.	.	H	α-helix	trans	-60.9	-39.1	176.5	-72.2	178.9	-165	110.8	-6.7	112.1	G1439 A1440 A1441 G1447 E1455	G1439-R1443 VanDerWaalsContact C-NH1 3.31Å; G1439-R1443 WeakPolarHBondContact O-CB 3.41Å; G1439-R1443 WeakPolarHBondContact O-CD 3.34Å; G1439-R1443 VanDerWaalsContact O-CG 3.28Å; G1439-R1443 WeakPolarHBondContact O-CG 3.36Å; G1439-R1443 PolarHBondContact O-N 3.21Å; G1439-R1443 VanDerWaalsContact O-N 3.1Å; G1439-R1443 PolarHBondContact O-NH1 3.05Å; G1439-R1443 VanDerWaalsContact O-NH1 3.16Å; A1440-R1443 PolarHBondContact O-N 3.22Å; A1440-R1443 VanDerWaalsContact O-N 3.1Å; A1441-R1443 PolarHBondContact O-N 2.85Å; R1443-G1447 VanDerWaalsContact O-CA 3.27Å; R1443-G1447 WeakPolarHBondContact O-CA 3.3Å; R1443-G1447 PolarHBondContact O-N 2.97Å; R1443-E1455 IonicContact CZ-OE1 3Å; R1443-E1455 IonicContact CZ-OE2 3.07Å; R1443-E1455 IonicContact NE-OE1 3.28Å; R1443-E1455 PolarHBondContact NE-OE1 3.04Å; R1443-E1455 IonicContact NE-OE2 3.27Å; R1443-E1455 VanDerWaalsContact NH2-CD 3.28Å; R1443-E1455 IonicContact NH2-OE1 3.47Å; R1443-E1455 PolarHBondContact NH2-OE1 3.05Å; R1443-E1455 VanDerWaalsContact NH2-OE1 3.11Å; R1443-E1455 IonicContact NH2-OE2 2.9Å; R1443-E1455 PolarHBondContact NH2-OE2 3.2Å
1444	S	71.4	Confident	75.1	Confident	44.4 Å²	44.4	51.2 Å²	51.2	31%	0.31	29%	0.286	S	S	.	.	H	α-helix	trans	-70.9	-45.3	178.3	-166.3	0	0	0	0	112.2	A1059 A1440 A1441 V1442 L1446 G1447 K1448	A1059-S1444 WeakPolarHBondContact CB-OG 3.31Å; A1440-S1444 VanDerWaalsContact O-CB 3.28Å; A1440-S1444 WeakPolarHBondContact O-CB 3.34Å; A1440-S1444 PolarHBondContact O-N 3.29Å; A1441-S1444 PolarHBondContact O-N 3.17Å; V1442-S1444 VanDerWaalsContact C-N 3.3Å; V1442-S1444 PolarHBondContact O-N 3.15Å; S1444-L1446 VanDerWaalsContact C-N 3.33Å; S1444-L1446 PolarHBondContact O-N 3.45Å; S1444-G1447 CarbonylContact O-C 3.54Å; S1444-G1447 PolarHBondContact O-N 2.85Å; S1444-K1448 WeakPolarHBondContact O-CG 3.39Å; S1444-K1448 PolarHBondContact O-N 3.16Å; S1444-K1448 VanDerWaalsContact O-N 3.13Å
1445	L	72.5	Confident	74.8	Confident	36 Å²	36	52.4 Å²	52.4	19%	0.188	29%	0.287	C	S	.	.	H	α-helix	trans	-66.3	-45.2	-178.6	-73.1	166.8	0	0	0	111.9	A1441 V1442 Y1449 L1477 K1478 C1481	A1441-L1445 HydrophobicContact CB-CD1 4.4Å; A1441-L1445 VanDerWaalsContact O-CB 3.3Å; A1441-L1445 WeakPolarHBondContact O-CB 3.39Å; A1441-L1445 WeakPolarHBondContact O-CD1 3.27Å; A1441-L1445 VanDerWaalsContact O-CG 3.28Å; A1441-L1445 WeakPolarHBondContact O-CG 3.42Å; A1441-L1445 PolarHBondContact O-N 3.21Å; V1442-L1445 PolarHBondContact O-N 3.04Å; L1445-Y1449 VanDerWaalsContact O-CD2 3.23Å; L1445-Y1449 WeakPolarHBondContact O-CD2 3.33Å; L1445-Y1449 WeakPolarHBondContact O-CE2 3.32Å; L1445-L1477 HydrophobicContact CD1-CB 4.4Å; L1445-K1478 HydrophobicContact CD1-CB 4.45Å; L1445-K1478 HydrophobicContact CD2-CG 4.38Å; L1445-C1481 HydrophobicContact CB-CB 4.07Å; L1445-C1481 HydrophobicContact CD1-CB 4.37Å
1446	L	74.4	Confident	74.1	Confident	4.8 Å²	4.8	50.8 Å²	50.8	3%	0.025	28%	0.28	C	S	.	.	H	α-helix	trans	-76.5	-34.1	176.5	-65.5	176.2	0	0	0	112.1	V1442 S1444 K1448 Y1449 G1450 K1451 L1453 C1481 L1484	V1442-L1446 HydrophobicContact CG1-CD1 3.75Å; V1442-L1446 HydrophobicContact CG1-CG 4.41Å; V1442-L1446 WeakPolarHBondContact O-CB 3.29Å; V1442-L1446 WeakPolarHBondContact O-CG 3.21Å; V1442-L1446 PolarHBondContact O-N 3.08Å; S1444-L1446 VanDerWaalsContact C-N 3.33Å; S1444-L1446 PolarHBondContact O-N 3.45Å; L1446-K1448 VanDerWaalsContact C-N 3.28Å; L1446-K1448 PolarHBondContact O-N 3.25Å; L1446-Y1449 CarbonylContact O-C 3.48Å; L1446-Y1449 WeakPolarHBondContact O-CA 3.29Å; L1446-Y1449 PolarHBondContact O-N 3.15Å; L1446-G1450 PolarHBondContact O-N 3.04Å; L1446-K1451 CarbonylContact C-O 3.53Å; L1446-K1451 VanDerWaalsContact C-O 3.24Å; L1446-K1451 HydrophobicContact CB-CB 4.08Å; L1446-K1451 VanDerWaalsContact CB-O 3.28Å; L1446-K1451 WeakPolarHBondContact CB-O 3.3Å; L1446-K1451 HydrophobicContact CD2-CB 4.4Å; L1446-K1451 PolarHBondContact O-N 3.15Å; L1446-L1453 HydrophobicContact CD1-CD1 3.91Å; L1446-L1453 HydrophobicContact CD1-CD2 4.07Å; L1446-L1453 HydrophobicContact CD1-CG 3.62Å; L1446-C1481 HydrophobicContact CD2-CB 3.96Å; L1446-C1481 HydrophobicContact CG-CB 4.3Å; L1446-L1484 HydrophobicContact CD2-CB 4.42Å
1447	G	67.7	Low	73	Confident	37 Å²	37	48.1 Å²	48.1	38%	0.381	29%	0.289	S	S	.	.	H	α-helix	trans	-61.5	-30.7	177.1	0	0	0	0	0	113.5	R1443 S1444 Y1449 G1450 K1451	R1443-G1447 VanDerWaalsContact O-CA 3.27Å; R1443-G1447 WeakPolarHBondContact O-CA 3.3Å; R1443-G1447 PolarHBondContact O-N 2.97Å; S1444-G1447 CarbonylContact O-C 3.54Å; S1444-G1447 PolarHBondContact O-N 2.85Å; G1447-Y1449 PolarHBondContact O-N 3.22Å; G1447-Y1449 VanDerWaalsContact O-N 3.13Å; G1447-G1450 PolarHBondContact O-N 3.29Å; G1447-G1450 VanDerWaalsContact O-N 3.13Å; G1447-K1451 PolarHBondContact N-O 3.15Å
1448	K	62.6	Low	71.8	Confident	109.6 Å²	109.6	56.2 Å²	56.2	48%	0.477	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-29	169.7	-112.1	176.2	-178.2	-172.3	0	113	S1444 L1446 E1632	S1444-K1448 WeakPolarHBondContact O-CG 3.39Å; S1444-K1448 PolarHBondContact O-N 3.16Å; S1444-K1448 VanDerWaalsContact O-N 3.13Å; L1446-K1448 VanDerWaalsContact C-N 3.28Å; L1446-K1448 PolarHBondContact O-N 3.25Å; K1448-E1632 WeakPolarHBondContact CE-OE1 3.27Å; K1448-E1632 IonicContact NZ-OE1 2.64Å; K1448-E1632 PolarHBondContact NZ-OE1 2.97Å
1449	Y	63.1	Low	70.7	Confident	73 Å²	73	62.4 Å²	62.4	29%	0.286	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	14.7	-178.4	-53	-69.1	0	0	0	112.7	L1445 L1446 G1447 K1451 D1482 R1485	L1445-Y1449 VanDerWaalsContact O-CD2 3.23Å; L1445-Y1449 WeakPolarHBondContact O-CD2 3.33Å; L1445-Y1449 WeakPolarHBondContact O-CE2 3.32Å; L1446-Y1449 CarbonylContact O-C 3.48Å; L1446-Y1449 WeakPolarHBondContact O-CA 3.29Å; L1446-Y1449 PolarHBondContact O-N 3.15Å; G1447-Y1449 PolarHBondContact O-N 3.22Å; G1447-Y1449 VanDerWaalsContact O-N 3.13Å; Y1449-K1451 WeakPolarHBondContact O-CD 3.49Å; Y1449-K1451 WeakPolarHBondContact O-CG 3.42Å; Y1449-K1451 PolarHBondContact O-N 3.24Å; Y1449-K1451 VanDerWaalsContact O-N 3.15Å; Y1449-D1482 PolarHBondContact OH-OD1 3.14Å; Y1449-R1485 HydrophobicContact CD2-CG 3.98Å; Y1449-R1485 VanDerWaalsContact CE2-CD 3.43Å; Y1449-R1485 HydrophobicContact CE2-CG 4.25Å; Y1449-R1485 HydrophobicContact CG-CG 4.1Å; Y1449-R1485 VanDerWaalsContact CZ-CD 3.41Å; Y1449-R1485 PolarHBondContact OH-NH1 3.18Å
1450	G	62.5	Low	70.4	Confident	58 Å²	58	64.8 Å²	64.8	60%	0.598	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	12.3	-177.5	0	0	0	0	0	114.9	L1446 G1447	L1446-G1450 PolarHBondContact O-N 3.04Å; G1447-G1450 PolarHBondContact O-N 3.29Å; G1447-G1450 VanDerWaalsContact O-N 3.13Å
1451	K	70.4	Confident	70.7	Confident	45.2 Å²	45.2	64.7 Å²	64.7	20%	0.197	35%	0.354	C	S	.	.			trans	-94.7	138.4	-178.1	-68.4	173.9	176.9	-150.6	0	110.2	W832 L1446 G1447 Y1449 L1484 R1485 Y1487	W832-K1451 HydrophobicContact CD2-CD 4.42Å; W832-K1451 HydrophobicContact CD2-CG 4.06Å; W832-K1451 HydrophobicContact CE3-CB 3.93Å; W832-K1451 HydrophobicContact CE3-CD 3.63Å; W832-K1451 HydrophobicContact CE3-CG 3.6Å; W832-K1451 HydrophobicContact CH2-CD 4.1Å; W832-K1451 HydrophobicContact CZ3-CB 4.21Å; W832-K1451 HydrophobicContact CZ3-CD 3.22Å; W832-K1451 HydrophobicContact CZ3-CG 3.61Å; L1446-K1451 CarbonylContact C-O 3.53Å; L1446-K1451 VanDerWaalsContact C-O 3.24Å; L1446-K1451 HydrophobicContact CB-CB 4.08Å; L1446-K1451 VanDerWaalsContact CB-O 3.28Å; L1446-K1451 WeakPolarHBondContact CB-O 3.3Å; L1446-K1451 HydrophobicContact CD2-CB 4.4Å; L1446-K1451 PolarHBondContact O-N 3.15Å; G1447-K1451 PolarHBondContact N-O 3.15Å; Y1449-K1451 WeakPolarHBondContact O-CD 3.49Å; Y1449-K1451 WeakPolarHBondContact O-CG 3.42Å; Y1449-K1451 PolarHBondContact O-N 3.24Å; Y1449-K1451 VanDerWaalsContact O-N 3.15Å; K1451-L1484 PolarHBondContact NZ-O 3.05Å; K1451-R1485 HydrophobicContact CD-CG 4.17Å; K1451-R1485 VanDerWaalsContact NZ-CG 3.27Å; K1451-R1485 PolarHBondContact NZ-O 2.99Å; K1451-Y1487 PolarHBondContact NZ-O 3.18Å; K1451-Y1487 VanDerWaalsContact NZ-O 3.15Å
1452	V	74.7	Confident	71.1	Confident	95 Å²	95	64.5 Å²	64.5	58%	0.576	35%	0.351	S	S	*	.			trans	-134.1	136.8	178.6	-175.8	0	0	0	0	109.2	Y1490	V1452-Y1490 PolarHBondContact O-OH 3.5Å; V1452-Y1490 VanDerWaalsContact O-OH 3.13Å
1453	L	78.2	Confident	71.2	Confident	13.8 Å²	13.8	66 Å²	66	7%	0.072	36%	0.362	C	S	.	.			trans	-87.8	148.1	173.6	-64.1	-179.6	0	0	0	110.6	V1442 L1446 E1455 Q1461 L1462 L1465 L1493 L1497	V1442-L1453 HydrophobicContact CG1-CD1 3.75Å; V1442-L1453 HydrophobicContact CG1-CG 4.45Å; L1446-L1453 HydrophobicContact CD1-CD1 3.91Å; L1446-L1453 HydrophobicContact CD1-CD2 4.07Å; L1446-L1453 HydrophobicContact CD1-CG 3.62Å; L1453-E1455 PolarHBondContact O-N 3Å; L1453-Q1461 HydrophobicContact CB-CB 4.12Å; L1453-Q1461 HydrophobicContact CD2-CB 4.41Å; L1453-L1462 HydrophobicContact CB-CB 4.31Å; L1453-L1462 HydrophobicContact CD1-CD1 4.26Å; L1453-L1465 HydrophobicContact CD1-CD2 4.12Å; L1453-L1493 HydrophobicContact CD2-CD2 4Å; L1453-L1497 HydrophobicContact CD2-CD1 4.39Å
1454	N	74.3	Confident	71.5	Confident	44.8 Å²	44.8	63.3 Å²	63.3	24%	0.24	36%	0.356	C	S	.	.			trans	-67.4	124.9	177.1	-169.9	-11.4	0	0	0	111.3	S1456 N1460 Q1461 L1462	N1454-S1456 VanDerWaalsContact CG-OG 3.3Å; N1454-S1456 PolarHBondContact ND2-OG 3.18Å; N1454-S1456 VanDerWaalsContact OD1-CB 3.27Å; N1454-S1456 WeakPolarHBondContact OD1-CB 3.37Å; N1454-S1456 PolarHBondContact OD1-N 3.18Å; N1454-S1456 PolarHBondContact OD1-OG 3.1Å; N1454-N1460 CarbonylContact O-C 3.5Å; N1454-N1460 WeakPolarHBondContact O-CA 3.4Å; N1454-Q1461 HydrophobicContact CB-CB 4.34Å; N1454-Q1461 HydrophobicContact CB-CG 4.12Å; N1454-Q1461 VanDerWaalsContact N-OE1 3.08Å; N1454-Q1461 PolarHBondContact O-N 3.4Å; N1454-L1462 PolarHBondContact O-N 3.43Å
1455	E	76.5	Confident	72.2	Confident	83.4 Å²	83.4	61.3 Å²	61.3	39%	0.39	34%	0.342	S	S	.	.			trans	-105.5	1.3	179	-60.6	-172.8	-157.6	0	0	113.4	R1443 L1453 N1460 L1462	R1443-E1455 IonicContact CZ-OE1 3Å; R1443-E1455 IonicContact CZ-OE2 3.07Å; R1443-E1455 IonicContact NE-OE1 3.28Å; R1443-E1455 PolarHBondContact NE-OE1 3.04Å; R1443-E1455 IonicContact NE-OE2 3.27Å; R1443-E1455 VanDerWaalsContact NH2-CD 3.28Å; R1443-E1455 IonicContact NH2-OE1 3.47Å; R1443-E1455 PolarHBondContact NH2-OE1 3.05Å; R1443-E1455 VanDerWaalsContact NH2-OE1 3.11Å; R1443-E1455 IonicContact NH2-OE2 2.9Å; R1443-E1455 PolarHBondContact NH2-OE2 3.2Å; L1453-E1455 PolarHBondContact O-N 3Å; E1455-N1460 PolarHBondContact O-ND2 2.85Å; E1455-L1462 VanDerWaalsContact CD-CD2 3.46Å; E1455-L1462 HydrophobicContact CG-CB 4.12Å; E1455-L1462 HydrophobicContact CG-CD2 3.8Å; E1455-L1462 WeakPolarHBondContact OE1-CD2 3.4Å
1456	S	68.5	Low	72.9	Confident	56.6 Å²	56.6	60.5 Å²	60.5	40%	0.396	34%	0.337	S	S	.	.			trans	-63	142.6	-179.9	63.2	0	0	0	0	112.2	N1454 F1458 R1459 N1460	N1454-S1456 VanDerWaalsContact CG-OG 3.3Å; N1454-S1456 PolarHBondContact ND2-OG 3.18Å; N1454-S1456 VanDerWaalsContact OD1-CB 3.27Å; N1454-S1456 WeakPolarHBondContact OD1-CB 3.37Å; N1454-S1456 PolarHBondContact OD1-N 3.18Å; N1454-S1456 PolarHBondContact OD1-OG 3.1Å; S1456-F1458 VanDerWaalsContact C-N 3.28Å; S1456-F1458 PolarHBondContact O-N 3.03Å; S1456-F1458 VanDerWaalsContact O-N 3.09Å; S1456-R1459 CarbonylContact O-C 3.47Å; S1456-R1459 VanDerWaalsContact O-C 3.31Å; S1456-R1459 PolarHBondContact O-N 3.41Å; S1456-R1459 VanDerWaalsContact O-N 3.14Å; S1456-N1460 WeakPolarHBondContact O-CA 3.4Å; S1456-N1460 WeakPolarHBondContact O-CB 3.28Å; S1456-N1460 PolarHBondContact O-N 3.06Å; S1456-N1460 VanDerWaalsContact O-N 3.14Å
1457	G	56	Low	73.5	Confident	79.2 Å²	79.2	67.5 Å²	67.5	82%	0.816	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.3	-171.6	0	0	0	0	0	115.7
1458	F	53.8	Low	74.4	Confident	203 Å²	203	66.7 Å²	66.7	89%	0.89	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-20.2	-178.9	-76.2	-81.5	0	0	0	114.5	S1456	S1456-F1458 VanDerWaalsContact C-N 3.28Å; S1456-F1458 PolarHBondContact O-N 3.03Å; S1456-F1458 VanDerWaalsContact O-N 3.09Å
1459	R	62.5	Low	75.6	Confident	177.2 Å²	177.2	70.6 Å²	70.6	67%	0.669	37%	0.368	S	S	*	.	S	Bend	trans	-145.7	56.6	179.6	-69.1	-171.3	-177.2	179.9	2	111	E836 S1456 Q1461	E836-R1459 IonicContact OE2-CZ 2.81Å; E836-R1459 IonicContact OE2-NH1 2.6Å; E836-R1459 PolarHBondContact OE2-NH1 3.43Å; S1456-R1459 CarbonylContact O-C 3.47Å; S1456-R1459 VanDerWaalsContact O-C 3.31Å; S1456-R1459 PolarHBondContact O-N 3.41Å; S1456-R1459 VanDerWaalsContact O-N 3.14Å; R1459-Q1461 VanDerWaalsContact C-N 3.3Å; R1459-Q1461 PolarHBondContact O-N 3.16Å
1460	N	76.3	Confident	76.7	Confident	52.8 Å²	52.8	68.8 Å²	68.8	28%	0.282	36%	0.363	S	S	.	.			trans	-73.5	88.1	-178.2	-166.8	-19.9	0	0	0	110.7	N1454 E1455 S1456 L1462 S1463 V1464	N1454-N1460 CarbonylContact O-C 3.5Å; N1454-N1460 WeakPolarHBondContact O-CA 3.4Å; E1455-N1460 PolarHBondContact O-ND2 2.85Å; S1456-N1460 WeakPolarHBondContact O-CA 3.4Å; S1456-N1460 WeakPolarHBondContact O-CB 3.28Å; S1456-N1460 PolarHBondContact O-N 3.06Å; S1456-N1460 VanDerWaalsContact O-N 3.14Å; N1460-L1462 VanDerWaalsContact C-N 3.26Å; N1460-L1462 PolarHBondContact O-N 3.15Å; N1460-L1462 WeakPolarHBondContact OD1-CB 3.35Å; N1460-L1462 PolarHBondContact OD1-N 3.14Å; N1460-L1462 VanDerWaalsContact OD1-N 3.14Å; N1460-S1463 VanDerWaalsContact CB-OG 3.27Å; N1460-S1463 WeakPolarHBondContact CB-OG 3.3Å; N1460-S1463 VanDerWaalsContact CG-CB 3.47Å; N1460-S1463 VanDerWaalsContact CG-OG 3.26Å; N1460-S1463 WeakPolarHBondContact O-CB 3.24Å; N1460-S1463 PolarHBondContact O-N 3.18Å; N1460-S1463 VanDerWaalsContact O-N 3.11Å; N1460-S1463 PolarHBondContact O-OG 3.22Å; N1460-S1463 VanDerWaalsContact O-OG 3.05Å; N1460-S1463 WeakPolarHBondContact OD1-CB 3.27Å; N1460-S1463 PolarHBondContact OD1-N 3.03Å; N1460-S1463 VanDerWaalsContact OD1-N 3.15Å; N1460-S1463 PolarHBondContact OD1-OG 2.93Å; N1460-V1464 PolarHBondContact O-N 3.09Å
1461	Q	82.2	Confident	77.8	Confident	30.6 Å²	30.6	66.1 Å²	66.1	14%	0.143	34%	0.335	C	S	.	.	H	α-helix	trans	-63.8	-34.8	176.7	-73.3	174.5	-18.1	0	0	111.3	L1453 N1454 R1459 S1463 V1464 L1465 Y1490 L1497	L1453-Q1461 HydrophobicContact CB-CB 4.12Å; L1453-Q1461 HydrophobicContact CD2-CB 4.41Å; N1454-Q1461 HydrophobicContact CB-CB 4.34Å; N1454-Q1461 HydrophobicContact CB-CG 4.12Å; N1454-Q1461 VanDerWaalsContact N-OE1 3.08Å; N1454-Q1461 PolarHBondContact O-N 3.4Å; R1459-Q1461 VanDerWaalsContact C-N 3.3Å; R1459-Q1461 PolarHBondContact O-N 3.16Å; Q1461-S1463 VanDerWaalsContact C-N 3.35Å; Q1461-V1464 PolarHBondContact O-N 3.02Å; Q1461-L1465 PolarHBondContact O-N 3.08Å; Q1461-Y1490 PolarHBondContact OE1-OH 3.06Å; Q1461-L1497 HydrophobicContact CB-CD1 3.68Å; Q1461-L1497 HydrophobicContact CG-CD1 3.83Å
1462	L	84.3	Confident	78.5	Confident	7.8 Å²	7.8	65.4 Å²	65.4	4%	0.041	34%	0.336	C	S	.	.	H	α-helix	trans	-63.9	-42.4	178	-179.4	64.6	0	0	0	111.3	V1442 L1453 N1454 E1455 N1460 V1464 L1465 I1466	V1442-L1462 HydrophobicContact CB-CD1 3.82Å; V1442-L1462 HydrophobicContact CG1-CD1 3.57Å; V1442-L1462 VanDerWaalsContact CG1-CD1 3.48Å; V1442-L1462 HydrophobicContact CG2-CD1 4.39Å; L1453-L1462 HydrophobicContact CB-CB 4.31Å; L1453-L1462 HydrophobicContact CD1-CD1 4.26Å; N1454-L1462 PolarHBondContact O-N 3.43Å; E1455-L1462 VanDerWaalsContact CD-CD2 3.46Å; E1455-L1462 HydrophobicContact CG-CB 4.12Å; E1455-L1462 HydrophobicContact CG-CD2 3.8Å; E1455-L1462 WeakPolarHBondContact OE1-CD2 3.4Å; N1460-L1462 VanDerWaalsContact C-N 3.26Å; N1460-L1462 PolarHBondContact O-N 3.15Å; N1460-L1462 WeakPolarHBondContact OD1-CB 3.35Å; N1460-L1462 PolarHBondContact OD1-N 3.14Å; N1460-L1462 VanDerWaalsContact OD1-N 3.14Å; L1462-V1464 VanDerWaalsContact C-N 3.31Å; L1462-V1464 PolarHBondContact O-N 3.09Å; L1462-L1465 PolarHBondContact O-N 3.07Å; L1462-I1466 HydrophobicContact CD1-CD1 3.8Å; L1462-I1466 HydrophobicContact CD1-CG1 4.16Å; L1462-I1466 HydrophobicContact CD2-CD1 4.1Å; L1462-I1466 HydrophobicContact CG-CD1 3.56Å; L1462-I1466 HydrophobicContact CG-CG1 4.28Å; L1462-I1466 WeakPolarHBondContact O-CB 3.4Å; L1462-I1466 VanDerWaalsContact O-CG1 3.27Å; L1462-I1466 WeakPolarHBondContact O-CG1 3.3Å; L1462-I1466 PolarHBondContact O-N 3.23Å
1463	S	84.3	Confident	78.9	Confident	33.6 Å²	33.6	62.2 Å²	62.2	24%	0.235	32%	0.315	C	S	.	.	H	α-helix	trans	-64.1	-35.7	178.3	67.1	0	0	0	0	112.5	N1460 Q1461 L1465 I1466 Q1467	N1460-S1463 VanDerWaalsContact CB-OG 3.27Å; N1460-S1463 WeakPolarHBondContact CB-OG 3.3Å; N1460-S1463 VanDerWaalsContact CG-CB 3.47Å; N1460-S1463 VanDerWaalsContact CG-OG 3.26Å; N1460-S1463 WeakPolarHBondContact O-CB 3.24Å; N1460-S1463 PolarHBondContact O-N 3.18Å; N1460-S1463 VanDerWaalsContact O-N 3.11Å; N1460-S1463 PolarHBondContact O-OG 3.22Å; N1460-S1463 VanDerWaalsContact O-OG 3.05Å; N1460-S1463 WeakPolarHBondContact OD1-CB 3.27Å; N1460-S1463 PolarHBondContact OD1-N 3.03Å; N1460-S1463 VanDerWaalsContact OD1-N 3.15Å; N1460-S1463 PolarHBondContact OD1-OG 2.93Å; Q1461-S1463 VanDerWaalsContact C-N 3.35Å; S1463-L1465 VanDerWaalsContact C-N 3.31Å; S1463-L1465 PolarHBondContact O-N 3.11Å; S1463-I1466 PolarHBondContact O-N 3.02Å; S1463-Q1467 VanDerWaalsContact O-CB 3.28Å; S1463-Q1467 WeakPolarHBondContact O-CB 3.33Å; S1463-Q1467 WeakPolarHBondContact O-CG 3.38Å; S1463-Q1467 PolarHBondContact O-N 3.26Å
1464	V	85.3	Confident	79	Confident	44.4 Å²	44.4	63 Å²	63	27%	0.269	32%	0.322	S	S	.	.	H	α-helix	trans	-60.7	-41.1	176.9	177.3	0	0	0	0	111.1	N1460 Q1461 L1462 K1468 L1497 K1498	N1460-V1464 PolarHBondContact O-N 3.09Å; Q1461-V1464 PolarHBondContact O-N 3.02Å; L1462-V1464 VanDerWaalsContact C-N 3.31Å; L1462-V1464 PolarHBondContact O-N 3.09Å; V1464-K1468 WeakPolarHBondContact O-CG 3.31Å; V1464-L1497 HydrophobicContact CG1-CB 4.26Å; V1464-K1498 HydrophobicContact CG1-CG 4.44Å
1465	L	85.8	Confident	79.3	Confident	0.8 Å²	0.8	61.9 Å²	61.9	0%	0.004	32%	0.315	C	S	.	.	H	α-helix	trans	-74.5	-41.5	178.2	-175	61.5	0	0	0	112.3	V1442 L1453 Q1461 L1462 S1463 Q1467 K1468 A1471 Y1476 L1477 A1480 L1484 L1497 L1500	V1442-L1465 HydrophobicContact CB-CD2 4.48Å; V1442-L1465 HydrophobicContact CG1-CD2 3.91Å; V1442-L1465 HydrophobicContact CG2-CD2 3.72Å; V1442-L1465 HydrophobicContact CG2-CG 4.34Å; L1453-L1465 HydrophobicContact CD1-CD2 4.12Å; Q1461-L1465 PolarHBondContact O-N 3.08Å; L1462-L1465 PolarHBondContact O-N 3.07Å; S1463-L1465 VanDerWaalsContact C-N 3.31Å; S1463-L1465 PolarHBondContact O-N 3.11Å; L1465-Q1467 VanDerWaalsContact C-N 3.28Å; L1465-Q1467 PolarHBondContact O-N 3.2Å; L1465-K1468 HydrophobicContact CD1-CG 4.45Å; L1465-K1468 WeakPolarHBondContact O-CB 3.35Å; L1465-K1468 VanDerWaalsContact O-CG 3.31Å; L1465-K1468 WeakPolarHBondContact O-CG 3.37Å; L1465-K1468 PolarHBondContact O-N 3.09Å; L1465-A1471 WeakPolarHBondContact O-CB 3.33Å; L1465-Y1476 HydrophobicContact CD1-CE1 4.29Å; L1465-L1477 HydrophobicContact CG-CD2 4.42Å; L1465-A1480 HydrophobicContact CD1-CB 3.9Å; L1465-L1484 HydrophobicContact CD1-CD1 4.44Å; L1465-L1484 HydrophobicContact CD2-CD1 4.07Å; L1465-L1497 HydrophobicContact CB-CD2 4.36Å; L1465-L1497 HydrophobicContact CD1-CD2 4.35Å; L1465-L1500 HydrophobicContact CD1-CD1 4.43Å; L1465-L1500 HydrophobicContact CD1-CD2 4.13Å
1466	I	86.6	Confident	79.8	Confident	19.6 Å²	19.6	57.9 Å²	57.9	10%	0.101	30%	0.297	C	S	.	.	H	α-helix	trans	-66.4	-28.9	-179.1	-70.3	174.9	0	0	0	112.6	T1435 R1438 G1439 L1462 S1463 K1468 A1471	T1435-I1466 HydrophobicContact CG2-CG2 4.33Å; R1438-I1466 HydrophobicContact CB-CB 4.41Å; R1438-I1466 HydrophobicContact CB-CD1 4.48Å; R1438-I1466 HydrophobicContact CB-CG1 4.04Å; R1438-I1466 HydrophobicContact CB-CG2 4Å; R1438-I1466 WeakPolarHBondContact CD-O 3.18Å; R1438-I1466 PolarHBondContact NH1-O 3.1Å; R1438-I1466 VanDerWaalsContact NH1-O 3.16Å; G1439-I1466 VanDerWaalsContact CA-CD1 3.41Å; L1462-I1466 HydrophobicContact CD1-CD1 3.8Å; L1462-I1466 HydrophobicContact CD1-CG1 4.16Å; L1462-I1466 HydrophobicContact CD2-CD1 4.1Å; L1462-I1466 HydrophobicContact CG-CD1 3.56Å; L1462-I1466 HydrophobicContact CG-CG1 4.28Å; L1462-I1466 WeakPolarHBondContact O-CB 3.4Å; L1462-I1466 VanDerWaalsContact O-CG1 3.27Å; L1462-I1466 WeakPolarHBondContact O-CG1 3.3Å; L1462-I1466 PolarHBondContact O-N 3.23Å; S1463-I1466 PolarHBondContact O-N 3.02Å; I1466-K1468 VanDerWaalsContact C-N 3.34Å; I1466-A1471 WeakPolarHBondContact O-CB 3.34Å
1467	Q	87.1	Confident	80.5	Confident	151.8 Å²	151.8	55.2 Å²	55.2	71%	0.709	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-5.5	-179.3	-72.6	175.1	0.1	0	0	114	S1463 L1465	S1463-Q1467 VanDerWaalsContact O-CB 3.28Å; S1463-Q1467 WeakPolarHBondContact O-CB 3.33Å; S1463-Q1467 WeakPolarHBondContact O-CG 3.38Å; S1463-Q1467 PolarHBondContact O-N 3.26Å; L1465-Q1467 VanDerWaalsContact C-N 3.28Å; L1465-Q1467 PolarHBondContact O-N 3.2Å
1468	K	87.9	Confident	81.7	Confident	20 Å²	20	55.6 Å²	55.6	9%	0.087	26%	0.257	C	S	.	.	S	Bend	trans	-60.3	147.4	174.4	-62.8	-75.4	172.4	175.6	0	110.8	V1464 L1465 I1466 D1470 A1471 Y1476 L1497 K1498 L1500 D1502	V1464-K1468 WeakPolarHBondContact O-CG 3.31Å; L1465-K1468 HydrophobicContact CD1-CG 4.45Å; L1465-K1468 WeakPolarHBondContact O-CB 3.35Å; L1465-K1468 VanDerWaalsContact O-CG 3.31Å; L1465-K1468 WeakPolarHBondContact O-CG 3.37Å; L1465-K1468 PolarHBondContact O-N 3.09Å; I1466-K1468 VanDerWaalsContact C-N 3.34Å; K1468-D1470 PolarHBondContact O-N 3.26Å; K1468-A1471 HydrophobicContact CB-CB 4.13Å; K1468-A1471 WeakPolarHBondContact O-CB 3.31Å; K1468-A1471 PolarHBondContact O-N 3.28Å; K1468-A1471 VanDerWaalsContact O-N 3.11Å; K1468-Y1476 HydrophobicContact CB-CE1 3.73Å; K1468-Y1476 VanDerWaalsContact CB-OH 3.26Å; K1468-Y1476 WeakPolarHBondContact CB-OH 3.41Å; K1468-Y1476 WeakPolarHBondContact CD-OH 3.48Å; K1468-Y1476 HydrophobicContact CG-CE1 4.26Å; K1468-Y1476 VanDerWaalsContact CG-OH 3.27Å; K1468-Y1476 WeakPolarHBondContact CG-OH 3.37Å; K1468-L1497 WeakPolarHBondContact CE-O 3.3Å; K1468-K1498 PolarHBondContact NZ-O 3.44Å; K1468-L1500 WeakPolarHBondContact CE-O 3.16Å; K1468-L1500 PolarHBondContact NZ-O 3.05Å; K1468-D1502 HydrophobicContact CD-CB 4.49Å; K1468-D1502 WeakPolarHBondContact CD-OD1 3.29Å; K1468-D1502 WeakPolarHBondContact CE-OD1 3.3Å; K1468-D1502 IonicContact NZ-OD1 3.16Å; K1468-D1502 PolarHBondContact NZ-OD1 3.32Å
1469	R	86.6	Confident	83	Confident	192.6 Å²	192.6	46.1 Å²	46.1	73%	0.727	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-58.1	-48.6	-170.5	-135	178.6	-177.9	-179.7	-0.9	112.4	A1471 D1502	R1469-A1471 VanDerWaalsContact C-N 3.31Å; R1469-A1471 PolarHBondContact O-N 3.05Å; R1469-D1502 HydrophobicContact CB-CB 4.18Å; R1469-D1502 HydrophobicContact CG-CB 4.04Å; R1469-D1502 PolarHBondContact N-O 3.04Å; R1469-D1502 IonicContact NE-OD2 3.69Å; R1469-D1502 PolarHBondContact NE-OD2 3.31Å
1470	D	86.8	Confident	84.2	Confident	35.2 Å²	35.2	37.7 Å²	37.7	19%	0.188	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-88.5	7.4	-179.5	-70.2	-4	0	0	0	113.2	K1468 S1472 I1473 Y1476 D1502 T1503 I1504	K1468-D1470 PolarHBondContact O-N 3.26Å; D1470-S1472 PolarHBondContact O-N 3.26Å; D1470-I1473 HydrophobicContact CB-CD1 4.34Å; D1470-I1473 WeakPolarHBondContact O-CB 3.38Å; D1470-I1473 PolarHBondContact O-N 2.98Å; D1470-Y1476 HydrophobicContact CB-CD2 3.8Å; D1470-Y1476 HydrophobicContact CB-CE2 4.41Å; D1470-Y1476 HydrophobicContact CB-CG 3.92Å; D1470-Y1476 VanDerWaalsContact O-CB 3.29Å; D1470-Y1476 WeakPolarHBondContact O-CB 3.44Å; D1470-D1502 PolarHBondContact N-O 3.21Å; D1470-D1502 VanDerWaalsContact N-O 3.08Å; D1470-T1503 WeakPolarHBondContact OD2-CA 3.34Å; D1470-T1503 WeakPolarHBondContact OD2-CB 3.33Å; D1470-I1504 HydrophobicContact CB-CG1 4.22Å; D1470-I1504 PolarHBondContact OD2-N 3.14Å
1471	A	85.9	Confident	84.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-62.5	-14	178.1	0	0	0	0	0	113.8	R1438 L1465 I1466 K1468 R1469 I1473 Y1476 L1477	R1438-A1471 VanDerWaalsContact CD-O 3.28Å; R1438-A1471 WeakPolarHBondContact CD-O 3.37Å; R1438-A1471 VanDerWaalsContact CG-O 3.29Å; R1438-A1471 WeakPolarHBondContact CG-O 3.33Å; R1438-A1471 PolarHBondContact NE-O 2.91Å; L1465-A1471 WeakPolarHBondContact O-CB 3.33Å; I1466-A1471 WeakPolarHBondContact O-CB 3.34Å; K1468-A1471 HydrophobicContact CB-CB 4.13Å; K1468-A1471 WeakPolarHBondContact O-CB 3.31Å; K1468-A1471 PolarHBondContact O-N 3.28Å; K1468-A1471 VanDerWaalsContact O-N 3.11Å; R1469-A1471 VanDerWaalsContact C-N 3.31Å; R1469-A1471 PolarHBondContact O-N 3.05Å; A1471-I1473 PolarHBondContact O-N 3.07Å; A1471-Y1476 HydrophobicContact CB-CD1 4.27Å; A1471-Y1476 HydrophobicContact CB-CE1 4.32Å; A1471-L1477 HydrophobicContact CB-CD2 4.02Å; A1471-L1477 WeakPolarHBondContact O-CD1 3.27Å
1472	S	84.2	Confident	84.2	Confident	31.2 Å²	31.2	34.5 Å²	34.5	22%	0.218	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-67.4	-18.8	168.7	56.8	0	0	0	0	113.6	G1432 L1433 D1470	G1432-S1472 CarbonylContact C-O 3.54Å; G1432-S1472 VanDerWaalsContact CA-O 3.23Å; G1432-S1472 WeakPolarHBondContact CA-O 3.31Å; L1433-S1472 WeakPolarHBondContact CB-O 3.49Å; L1433-S1472 WeakPolarHBondContact CG-O 3.31Å; L1433-S1472 PolarHBondContact N-O 2.99Å; D1470-S1472 PolarHBondContact O-N 3.26Å
1473	I	82.9	Confident	84	Confident	27.6 Å²	27.6	34.5 Å²	34.5	14%	0.142	17%	0.168	C	C	.	.	S	Bend	trans	-97.1	120.7	-176.7	-53.7	176	0	0	0	108.4	G1122 G1223 D1470 A1471 L1475 Y1476 L1477 I1504	G1122-I1473 VanDerWaalsContact O-CG2 3.32Å; G1122-I1473 WeakPolarHBondContact O-CG2 3.38Å; G1223-I1473 WeakPolarHBondContact O-CG2 3.3Å; D1470-I1473 HydrophobicContact CB-CD1 4.34Å; D1470-I1473 WeakPolarHBondContact O-CB 3.38Å; D1470-I1473 PolarHBondContact O-N 2.98Å; A1471-I1473 PolarHBondContact O-N 3.07Å; I1473-L1475 VanDerWaalsContact C-N 3.27Å; I1473-L1475 HydrophobicContact CG2-CB 4.1Å; I1473-L1475 PolarHBondContact O-N 3.14Å; I1473-L1475 VanDerWaalsContact O-N 3.15Å; I1473-Y1476 WeakPolarHBondContact O-CB 3.41Å; I1473-Y1476 PolarHBondContact O-N 3.05Å; I1473-Y1476 VanDerWaalsContact O-N 3.1Å; I1473-L1477 PolarHBondContact O-N 3.3Å; I1473-I1504 HydrophobicContact CB-CD1 4.33Å; I1473-I1504 HydrophobicContact CD1-CD1 4.02Å; I1473-I1504 HydrophobicContact CG2-CD1 4.07Å
1474	P	80.8	Confident	83.8	Confident	31.8 Å²	31.8	33.1 Å²	33.1	21%	0.206	16%	0.158	C	C	.	.	H	α-helix	trans	-52.1	-37.8	178.1	-26.5	30.6	0	0	0	114.4	I1060 G1122 G1223 L1433 Y1476 L1477 K1478	I1060-P1474 HydrophobicContact CD1-CB 4.15Å; I1060-P1474 HydrophobicContact CG2-CB 4.13Å; I1060-P1474 HydrophobicContact CG2-CG 3.72Å; G1122-P1474 VanDerWaalsContact O-CD 3.3Å; G1122-P1474 WeakPolarHBondContact O-CD 3.23Å; G1223-P1474 VanDerWaalsContact O-CD 3.3Å; G1223-P1474 WeakPolarHBondContact O-CD 3.49Å; L1433-P1474 HydrophobicContact CD1-CB 4.39Å; L1433-P1474 HydrophobicContact CD1-CG 3.91Å; L1433-P1474 HydrophobicContact CD2-CG 4.33Å; L1433-P1474 HydrophobicContact CG-CG 4.08Å; P1474-Y1476 VanDerWaalsContact C-N 3.34Å; P1474-Y1476 PolarHBondContact O-N 3.1Å; P1474-L1477 PolarHBondContact O-N 3.17Å; P1474-K1478 PolarHBondContact O-N 3.07Å
1475	L	80.2	Confident	83.4	Confident	19.8 Å²	19.8	33.5 Å²	33.5	10%	0.104	15%	0.154	C	C	.	.	H	α-helix	trans	-58.9	-42.5	177.5	-178.9	62.7	0	0	0	112.7	G1122 G1223 I1473 L1477 K1478 L1479 I1504 S1671 E1673 I1674	G1122-L1475 PolarHBondContact O-N 3.08Å; G1223-L1475 PolarHBondContact O-N 2.84Å; I1473-L1475 VanDerWaalsContact C-N 3.27Å; I1473-L1475 HydrophobicContact CG2-CB 4.1Å; I1473-L1475 PolarHBondContact O-N 3.14Å; I1473-L1475 VanDerWaalsContact O-N 3.15Å; L1475-L1477 VanDerWaalsContact C-N 3.34Å; L1475-L1477 PolarHBondContact O-N 3.48Å; L1475-K1478 PolarHBondContact O-N 3.28Å; L1475-L1479 HydrophobicContact CD1-CD1 4.36Å; L1475-L1479 HydrophobicContact CD1-CG 4.33Å; L1475-L1479 HydrophobicContact CG-CD1 4.16Å; L1475-L1479 HydrophobicContact CG-CG 4.5Å; L1475-L1479 WeakPolarHBondContact O-CG 3.33Å; L1475-L1479 PolarHBondContact O-N 3Å; L1475-I1504 HydrophobicContact CB-CD1 4.48Å; L1475-I1504 HydrophobicContact CD2-CD1 4.41Å; L1475-S1671 WeakPolarHBondContact CD2-OG 3.32Å; L1475-E1673 HydrophobicContact CD2-CB 4.41Å; L1475-E1673 VanDerWaalsContact CD2-OE2 3.25Å; L1475-E1673 WeakPolarHBondContact CD2-OE2 3.46Å; L1475-I1674 HydrophobicContact CD1-CD1 4.4Å; L1475-I1674 HydrophobicContact CD2-CD1 4.5Å
1476	Y	86.8	Confident	82.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.8	-46.3	176.9	175.9	-89.8	0	0	0	111.1	L1465 K1468 D1470 A1471 I1473 P1474 K1478 L1479 A1480 L1500 P1501 I1504 L1507	L1465-Y1476 HydrophobicContact CD1-CE1 4.29Å; K1468-Y1476 HydrophobicContact CB-CE1 3.73Å; K1468-Y1476 VanDerWaalsContact CB-OH 3.26Å; K1468-Y1476 WeakPolarHBondContact CB-OH 3.41Å; K1468-Y1476 WeakPolarHBondContact CD-OH 3.48Å; K1468-Y1476 HydrophobicContact CG-CE1 4.26Å; K1468-Y1476 VanDerWaalsContact CG-OH 3.27Å; K1468-Y1476 WeakPolarHBondContact CG-OH 3.37Å; D1470-Y1476 HydrophobicContact CB-CD2 3.8Å; D1470-Y1476 HydrophobicContact CB-CE2 4.41Å; D1470-Y1476 HydrophobicContact CB-CG 3.92Å; D1470-Y1476 VanDerWaalsContact O-CB 3.29Å; D1470-Y1476 WeakPolarHBondContact O-CB 3.44Å; A1471-Y1476 HydrophobicContact CB-CD1 4.27Å; A1471-Y1476 HydrophobicContact CB-CE1 4.32Å; I1473-Y1476 WeakPolarHBondContact O-CB 3.41Å; I1473-Y1476 PolarHBondContact O-N 3.05Å; I1473-Y1476 VanDerWaalsContact O-N 3.1Å; P1474-Y1476 VanDerWaalsContact C-N 3.34Å; P1474-Y1476 PolarHBondContact O-N 3.1Å; Y1476-K1478 VanDerWaalsContact C-N 3.3Å; Y1476-K1478 PolarHBondContact O-N 3Å; Y1476-L1479 PolarHBondContact O-N 3.16Å; Y1476-A1480 HydrophobicContact CE1-CB 4.31Å; Y1476-A1480 VanDerWaalsContact O-CB 3.27Å; Y1476-A1480 WeakPolarHBondContact O-CB 3.32Å; Y1476-A1480 PolarHBondContact O-N 3.08Å; Y1476-L1500 WeakPolarHBondContact OH-CD2 3.4Å; Y1476-P1501 WeakPolarHBondContact CE2-O 3.42Å; Y1476-P1501 PolarHBondContact OH-O 2.98Å; Y1476-I1504 HydrophobicContact CD2-CG1 3.98Å; Y1476-I1504 HydrophobicContact CG-CG1 4.39Å; Y1476-L1507 HydrophobicContact CD2-CD2 4.12Å; Y1476-L1507 HydrophobicContact CE2-CB 4.45Å; Y1476-L1507 HydrophobicContact CE2-CD1 3.98Å; Y1476-L1507 HydrophobicContact CE2-CD2 4.08Å
1477	L	84.4	Confident	81.8	Confident	0.4 Å²	0.4	38.3 Å²	38.3	0%	0.002	18%	0.176	C	C	.	.	H	α-helix	trans	-63.3	-38.5	179	-67.3	-179.8	0	0	0	111.8	L1433 R1438 A1441 V1442 L1445 L1465 A1471 I1473 P1474 L1475 C1481	L1433-L1477 HydrophobicContact CD1-CD1 3.87Å; R1438-L1477 HydrophobicContact CB-CD1 4.03Å; R1438-L1477 HydrophobicContact CG-CD1 4.18Å; A1441-L1477 HydrophobicContact CB-CD1 3.95Å; V1442-L1477 HydrophobicContact CG2-CD1 4.43Å; V1442-L1477 HydrophobicContact CG2-CD2 3.9Å; L1445-L1477 HydrophobicContact CD1-CB 4.4Å; L1465-L1477 HydrophobicContact CG-CD2 4.42Å; A1471-L1477 HydrophobicContact CB-CD2 4.02Å; A1471-L1477 WeakPolarHBondContact O-CD1 3.27Å; I1473-L1477 PolarHBondContact O-N 3.3Å; P1474-L1477 PolarHBondContact O-N 3.17Å; L1475-L1477 VanDerWaalsContact C-N 3.34Å; L1475-L1477 PolarHBondContact O-N 3.48Å; L1477-C1481 VanDerWaalsContact O-CB 3.29Å; L1477-C1481 WeakPolarHBondContact O-CB 3.26Å; L1477-C1481 PolarHBondContact O-N 3.23Å; L1477-C1481 PolarHBondContact O-SG 3.14Å
1478	K	81	Confident	80.6	Confident	87.8 Å²	87.8	34.5 Å²	34.5	38%	0.382	17%	0.166	S	C	.	.	H	α-helix	trans	-61.1	-55.3	173.7	-175.3	-178.2	176.4	-172.9	0	111.1	L1445 P1474 L1475 Y1476 A1480 C1481 D1482	L1445-K1478 HydrophobicContact CD1-CB 4.45Å; L1445-K1478 HydrophobicContact CD2-CG 4.38Å; P1474-K1478 PolarHBondContact O-N 3.07Å; L1475-K1478 PolarHBondContact O-N 3.28Å; Y1476-K1478 VanDerWaalsContact C-N 3.3Å; Y1476-K1478 PolarHBondContact O-N 3Å; K1478-A1480 VanDerWaalsContact C-N 3.33Å; K1478-A1480 PolarHBondContact O-N 3.06Å; K1478-C1481 PolarHBondContact O-N 3.25Å; K1478-C1481 VanDerWaalsContact O-N 3.1Å; K1478-D1482 VanDerWaalsContact CE-OD2 3.28Å; K1478-D1482 WeakPolarHBondContact CE-OD2 3.23Å; K1478-D1482 WeakPolarHBondContact CG-OD2 3.08Å; K1478-D1482 WeakPolarHBondContact O-CB 3.47Å; K1478-D1482 PolarHBondContact O-N 3.21Å
1479	L	81.9	Confident	79.5	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.016	18%	0.181	C	C	.	.	H	α-helix	trans	-58	-43.9	179.7	-70.8	172.8	0	0	0	112.1	L1475 Y1476 C1481 D1482 E1483 I1504 L1507 V1508 P1624 L1625 I1674	L1475-L1479 HydrophobicContact CD1-CD1 4.36Å; L1475-L1479 HydrophobicContact CD1-CG 4.33Å; L1475-L1479 HydrophobicContact CG-CD1 4.16Å; L1475-L1479 HydrophobicContact CG-CG 4.5Å; L1475-L1479 WeakPolarHBondContact O-CG 3.33Å; L1475-L1479 PolarHBondContact O-N 3Å; Y1476-L1479 PolarHBondContact O-N 3.16Å; L1479-C1481 VanDerWaalsContact C-N 3.34Å; L1479-C1481 PolarHBondContact O-N 3.28Å; L1479-D1482 PolarHBondContact O-N 3.19Å; L1479-E1483 VanDerWaalsContact O-CB 3.3Å; L1479-E1483 WeakPolarHBondContact O-CB 3.42Å; L1479-E1483 PolarHBondContact O-N 3.11Å; L1479-I1504 HydrophobicContact CD1-CG2 4.2Å; L1479-L1507 HydrophobicContact CB-CD2 3.54Å; L1479-L1507 VanDerWaalsContact CB-CD2 3.48Å; L1479-L1507 HydrophobicContact CB-CG 4.4Å; L1479-L1507 HydrophobicContact CD1-CD2 4.42Å; L1479-L1507 HydrophobicContact CG-CD2 4.48Å; L1479-V1508 HydrophobicContact CD1-CG2 4.43Å; L1479-P1624 HydrophobicContact CD2-CB 4.19Å; L1479-P1624 VanDerWaalsContact CD2-O 3.24Å; L1479-P1624 WeakPolarHBondContact CD2-O 3.29Å; L1479-L1625 HydrophobicContact CD2-CD2 4.37Å; L1479-I1674 HydrophobicContact CD1-CD1 4.1Å; L1479-I1674 HydrophobicContact CD1-CG1 4.4Å; L1479-I1674 HydrophobicContact CD2-CD1 3.88Å; L1479-I1674 HydrophobicContact CG-CD1 4.43Å
1480	A	86.3	Confident	78.3	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.2	-40.1	178.6	0	0	0	0	0	111.8	L1465 Y1476 K1478 E1483 L1484 L1500 L1507	L1465-A1480 HydrophobicContact CD1-CB 3.9Å; Y1476-A1480 HydrophobicContact CE1-CB 4.31Å; Y1476-A1480 VanDerWaalsContact O-CB 3.27Å; Y1476-A1480 WeakPolarHBondContact O-CB 3.32Å; Y1476-A1480 PolarHBondContact O-N 3.08Å; K1478-A1480 VanDerWaalsContact C-N 3.33Å; K1478-A1480 PolarHBondContact O-N 3.06Å; A1480-E1483 PolarHBondContact O-N 3.2Å; A1480-L1484 VanDerWaalsContact O-CB 3.3Å; A1480-L1484 WeakPolarHBondContact O-CB 3.38Å; A1480-L1484 WeakPolarHBondContact O-CD1 3.45Å; A1480-L1484 WeakPolarHBondContact O-CG 3.3Å; A1480-L1484 PolarHBondContact O-N 3Å; A1480-L1500 HydrophobicContact CB-CD2 3.81Å; A1480-L1507 HydrophobicContact CB-CD1 4.17Å; A1480-L1507 HydrophobicContact CB-CD2 4.24Å
1481	C	82.4	Confident	77.1	Confident	3 Å²	3	38 Å²	38	2%	0.02	19%	0.189	C	C	.	.	H	α-helix	trans	-68	-40.1	175.6	-69.5	0	0	0	0	112.2	L1445 L1446 L1477 K1478 L1479 L1484 R1485	L1445-C1481 HydrophobicContact CB-CB 4.07Å; L1445-C1481 HydrophobicContact CD1-CB 4.37Å; L1446-C1481 HydrophobicContact CD2-CB 3.96Å; L1446-C1481 HydrophobicContact CG-CB 4.3Å; L1477-C1481 VanDerWaalsContact O-CB 3.29Å; L1477-C1481 WeakPolarHBondContact O-CB 3.26Å; L1477-C1481 PolarHBondContact O-N 3.23Å; L1477-C1481 PolarHBondContact O-SG 3.14Å; K1478-C1481 PolarHBondContact O-N 3.25Å; K1478-C1481 VanDerWaalsContact O-N 3.1Å; L1479-C1481 VanDerWaalsContact C-N 3.34Å; L1479-C1481 PolarHBondContact O-N 3.28Å; C1481-L1484 CarbonylContact O-C 3.57Å; C1481-L1484 PolarHBondContact O-N 3.02Å; C1481-R1485 WeakPolarHBondContact O-CB 3.29Å; C1481-R1485 PolarHBondContact O-N 3.1Å
1482	D	77.5	Confident	76.2	Confident	13.8 Å²	13.8	42.7 Å²	42.7	7%	0.074	21%	0.211	C	C	.	.	H	α-helix	trans	-66.6	-37.4	176.3	-75	-30.4	0	0	0	111.5	Y1449 K1478 L1479 R1485 L1486 P1624	Y1449-D1482 PolarHBondContact OH-OD1 3.14Å; K1478-D1482 VanDerWaalsContact CE-OD2 3.28Å; K1478-D1482 WeakPolarHBondContact CE-OD2 3.23Å; K1478-D1482 WeakPolarHBondContact CG-OD2 3.08Å; K1478-D1482 WeakPolarHBondContact O-CB 3.47Å; K1478-D1482 PolarHBondContact O-N 3.21Å; L1479-D1482 PolarHBondContact O-N 3.19Å; D1482-R1485 VanDerWaalsContact O-CB 3.22Å; D1482-R1485 WeakPolarHBondContact O-CB 3.32Å; D1482-R1485 PolarHBondContact O-N 3.04Å; D1482-R1485 IonicContact OD1-CZ 3.17Å; D1482-R1485 IonicContact OD1-NH1 3.53Å; D1482-R1485 PolarHBondContact OD1-NH1 3.12Å; D1482-R1485 IonicContact OD1-NH2 3.26Å; D1482-L1486 WeakPolarHBondContact O-CG 3.35Å; D1482-L1486 PolarHBondContact O-N 3.14Å; D1482-P1624 HydrophobicContact CB-CB 4.29Å; D1482-P1624 HydrophobicContact CB-CG 4.38Å
1483	E	80.1	Confident	75.8	Confident	8.6 Å²	8.6	41.7 Å²	41.7	4%	0.04	20%	0.203	C	C	.	.	H	α-helix	trans	-68.8	-43.1	172.4	-141.8	19.3	173.5	0	0	111.9	L1479 A1480 R1485 L1486 Y1487 L1500 L1507 V1511 R1514 P1624	L1479-E1483 VanDerWaalsContact O-CB 3.3Å; L1479-E1483 WeakPolarHBondContact O-CB 3.42Å; L1479-E1483 PolarHBondContact O-N 3.11Å; A1480-E1483 PolarHBondContact O-N 3.2Å; E1483-R1485 PolarHBondContact O-N 3.17Å; E1483-L1486 WeakPolarHBondContact O-CB 3.3Å; E1483-L1486 PolarHBondContact O-N 3.27Å; E1483-L1486 VanDerWaalsContact O-N 3.14Å; E1483-Y1487 HydrophobicContact CG-CE2 4.21Å; E1483-Y1487 WeakPolarHBondContact O-CD2 3.44Å; E1483-Y1487 VanDerWaalsContact O-CE2 3.22Å; E1483-Y1487 WeakPolarHBondContact O-CE2 3.45Å; E1483-Y1487 PolarHBondContact O-N 3.32Å; E1483-Y1487 PolarHBondContact OE1-OH 3.38Å; E1483-L1500 HydrophobicContact CG-CD2 4.23Å; E1483-L1507 HydrophobicContact CG-CD2 4.49Å; E1483-V1511 VanDerWaalsContact CD-CG2 3.47Å; E1483-V1511 HydrophobicContact CG-CG2 4.04Å; E1483-V1511 WeakPolarHBondContact OE1-CG2 3.48Å; E1483-R1514 VanDerWaalsContact CD-NE 3.34Å; E1483-R1514 VanDerWaalsContact OE1-CD 3.26Å; E1483-R1514 WeakPolarHBondContact OE1-CD 3.45Å; E1483-R1514 IonicContact OE1-CZ 3.03Å; E1483-R1514 VanDerWaalsContact OE1-CZ 3.23Å; E1483-R1514 IonicContact OE1-NE 3.18Å; E1483-R1514 PolarHBondContact OE1-NE 3.25Å; E1483-R1514 VanDerWaalsContact OE1-NE 3.15Å; E1483-R1514 IonicContact OE1-NH1 2.86Å; E1483-R1514 IonicContact OE1-NH2 3.2Å; E1483-R1514 PolarHBondContact OE1-NH2 3.07Å; E1483-R1514 IonicContact OE2-CZ 3.67Å; E1483-R1514 VanDerWaalsContact OE2-CZ 3.29Å; E1483-R1514 IonicContact OE2-NE 3.45Å; E1483-R1514 PolarHBondContact OE2-NE 3.1Å; E1483-R1514 VanDerWaalsContact OE2-NE 3.11Å; E1483-R1514 IonicContact OE2-NH1 3.78Å; E1483-R1514 PolarHBondContact OE2-NH1 3.06Å; E1483-R1514 IonicContact OE2-NH2 3.35Å; E1483-R1514 PolarHBondContact OE2-NH2 2.83Å; E1483-P1624 WeakPolarHBondContact OE1-CG 3.33Å
1484	L	80.4	Confident	75.3	Confident	4.2 Å²	4.2	41.8 Å²	41.8	2%	0.022	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-29.7	173.5	-73	169	0	0	0	112	W832 L1446 K1451 L1465 A1480 C1481 L1486 Y1487 L1493 L1497 L1500	W832-L1484 VanDerWaalsContact CH2-C 3.43Å; W832-L1484 HydrophobicContact CH2-CB 4.14Å; W832-L1484 WeakPolarHBondContact CH2-O 3.44Å; W832-L1484 HydrophobicContact CZ2-CB 4.4Å; W832-L1484 WeakPolarHBondContact CZ2-O 3.38Å; L1446-L1484 HydrophobicContact CD2-CB 4.42Å; K1451-L1484 PolarHBondContact NZ-O 3.05Å; L1465-L1484 HydrophobicContact CD1-CD1 4.44Å; L1465-L1484 HydrophobicContact CD2-CD1 4.07Å; A1480-L1484 VanDerWaalsContact O-CB 3.3Å; A1480-L1484 WeakPolarHBondContact O-CB 3.38Å; A1480-L1484 WeakPolarHBondContact O-CD1 3.45Å; A1480-L1484 WeakPolarHBondContact O-CG 3.3Å; A1480-L1484 PolarHBondContact O-N 3Å; C1481-L1484 CarbonylContact O-C 3.57Å; C1481-L1484 PolarHBondContact O-N 3.02Å; L1484-L1486 VanDerWaalsContact C-N 3.31Å; L1484-L1486 PolarHBondContact O-N 3.02Å; L1484-Y1487 WeakPolarHBondContact O-CB 3.46Å; L1484-Y1487 PolarHBondContact O-N 3.45Å; L1484-Y1487 VanDerWaalsContact O-N 3.13Å; L1484-L1493 HydrophobicContact CD2-CD1 3.84Å; L1484-L1497 HydrophobicContact CD1-CD2 3.75Å; L1484-L1497 HydrophobicContact CD2-CD2 3.87Å; L1484-L1497 HydrophobicContact CD2-CG 4.14Å; L1484-L1497 HydrophobicContact CG-CD2 4.36Å; L1484-L1500 HydrophobicContact CD1-CD1 4.12Å; L1484-L1500 HydrophobicContact CD2-CD1 3.92Å; L1484-L1500 HydrophobicContact CG-CD1 4.01Å
1485	R	76	Confident	75.1	Confident	51.8 Å²	51.8	42.8 Å²	42.8	20%	0.195	22%	0.223	C	C	.	.	H	α-helix	trans	-63.8	-34.8	176.6	-169.9	-176.3	69.9	-175.2	0.2	112.2	Y1449 K1451 C1481 D1482 E1483 Y1487 H1623	Y1449-R1485 HydrophobicContact CD2-CG 3.98Å; Y1449-R1485 VanDerWaalsContact CE2-CD 3.43Å; Y1449-R1485 HydrophobicContact CE2-CG 4.25Å; Y1449-R1485 HydrophobicContact CG-CG 4.1Å; Y1449-R1485 VanDerWaalsContact CZ-CD 3.41Å; Y1449-R1485 PolarHBondContact OH-NH1 3.18Å; K1451-R1485 HydrophobicContact CD-CG 4.17Å; K1451-R1485 VanDerWaalsContact NZ-CG 3.27Å; K1451-R1485 PolarHBondContact NZ-O 2.99Å; C1481-R1485 WeakPolarHBondContact O-CB 3.29Å; C1481-R1485 PolarHBondContact O-N 3.1Å; D1482-R1485 VanDerWaalsContact O-CB 3.22Å; D1482-R1485 WeakPolarHBondContact O-CB 3.32Å; D1482-R1485 PolarHBondContact O-N 3.04Å; D1482-R1485 IonicContact OD1-CZ 3.17Å; D1482-R1485 IonicContact OD1-NH1 3.53Å; D1482-R1485 PolarHBondContact OD1-NH1 3.12Å; D1482-R1485 IonicContact OD1-NH2 3.26Å; E1483-R1485 PolarHBondContact O-N 3.17Å; R1485-Y1487 VanDerWaalsContact C-N 3.34Å; R1485-Y1487 PolarHBondContact O-N 2.83Å; R1485-H1623 PolarHBondContact NH1-NE2 2.67Å; R1485-H1623 PolarHBondContact NH2-CD2 3.45Å; R1485-H1623 PolarHBondContact NH2-CE1 3.1Å; R1485-H1623 VanDerWaalsContact NH2-CE1 3.31Å; R1485-H1623 PolarHBondContact NH2-NE2 3.03Å
1486	L	70.4	Confident	74.9	Confident	65.2 Å²	65.2	44.4 Å²	44.4	34%	0.341	23%	0.229	S	C	.	.	H	α-helix	trans	-77.6	-16.5	-176.1	-65.9	172.3	0	0	0	113.6	D1482 E1483 L1484 S1488 R1514 P1624	D1482-L1486 WeakPolarHBondContact O-CG 3.35Å; D1482-L1486 PolarHBondContact O-N 3.14Å; E1483-L1486 WeakPolarHBondContact O-CB 3.3Å; E1483-L1486 PolarHBondContact O-N 3.27Å; E1483-L1486 VanDerWaalsContact O-N 3.14Å; L1484-L1486 VanDerWaalsContact C-N 3.31Å; L1484-L1486 PolarHBondContact O-N 3.02Å; L1486-S1488 PolarHBondContact O-N 2.99Å; L1486-R1514 VanDerWaalsContact CD1-NH2 3.33Å; L1486-P1624 HydrophobicContact CD1-CG 3.92Å
1487	Y	69.3	Low	74.7	Confident	56 Å²	56	44.5 Å²	44.5	22%	0.22	23%	0.229	C	C	.	.			trans	-79.6	124.1	177.8	-99.2	-84.8	0	0	0	111.2	W832 K1451 E1483 L1484 R1485 N1489 Y1490 Q1492 L1493 K1496	W832-Y1487 VanDerWaalsContact CZ2-O 3.28Å; W832-Y1487 WeakPolarHBondContact CZ2-O 3.43Å; K1451-Y1487 PolarHBondContact NZ-O 3.18Å; K1451-Y1487 VanDerWaalsContact NZ-O 3.15Å; E1483-Y1487 HydrophobicContact CG-CE2 4.21Å; E1483-Y1487 WeakPolarHBondContact O-CD2 3.44Å; E1483-Y1487 VanDerWaalsContact O-CE2 3.22Å; E1483-Y1487 WeakPolarHBondContact O-CE2 3.45Å; E1483-Y1487 PolarHBondContact O-N 3.32Å; E1483-Y1487 PolarHBondContact OE1-OH 3.38Å; L1484-Y1487 WeakPolarHBondContact O-CB 3.46Å; L1484-Y1487 PolarHBondContact O-N 3.45Å; L1484-Y1487 VanDerWaalsContact O-N 3.13Å; R1485-Y1487 VanDerWaalsContact C-N 3.34Å; R1485-Y1487 PolarHBondContact O-N 2.83Å; Y1487-N1489 HydrophobicContact CE1-CB 4.12Å; Y1487-N1489 WeakPolarHBondContact CE1-O 3.35Å; Y1487-Y1490 WeakPolarHBondContact O-CE1 3.38Å; Y1487-Q1492 HydrophobicContact CE1-CB 4.44Å; Y1487-Q1492 WeakPolarHBondContact OH-CB 3.41Å; Y1487-Q1492 PolarHBondContact OH-OE1 2.94Å; Y1487-L1493 HydrophobicContact CD1-CD1 4.41Å; Y1487-K1496 HydrophobicContact CD1-CB 4.23Å; Y1487-K1496 HydrophobicContact CD1-CD 3.84Å; Y1487-K1496 HydrophobicContact CD1-CG 4.14Å; Y1487-K1496 HydrophobicContact CD2-CD 4.13Å; Y1487-K1496 HydrophobicContact CD2-CG 4.18Å; Y1487-K1496 HydrophobicContact CE1-CB 3.79Å; Y1487-K1496 HydrophobicContact CE1-CD 3.97Å; Y1487-K1496 HydrophobicContact CE1-CG 4.04Å; Y1487-K1496 HydrophobicContact CE2-CB 4.37Å; Y1487-K1496 HydrophobicContact CE2-CD 4.07Å; Y1487-K1496 HydrophobicContact CE2-CG 4.11Å; Y1487-K1496 HydrophobicContact CG-CD 3.93Å; Y1487-K1496 HydrophobicContact CG-CG 4.21Å; Y1487-K1496 WeakPolarHBondContact OH-CE 3.26Å; Y1487-K1496 PolarHBondContact OH-NZ 2.73Å
1488	S	60	Low	74.6	Confident	72.2 Å²	72.2	52 Å²	52	51%	0.505	26%	0.262	S	S	.	.			trans	-85.5	-32.9	-178.9	48.1	0	0	0	0	113.7	L1486 Y1490	L1486-S1488 PolarHBondContact O-N 2.99Å; S1488-Y1490 WeakPolarHBondContact O-CD2 3.46Å; S1488-Y1490 WeakPolarHBondContact O-CE2 3.49Å; S1488-Y1490 PolarHBondContact O-N 3.21Å; S1488-Y1490 VanDerWaalsContact O-N 3.13Å
1489	N	65.1	Low	74.7	Confident	74.6 Å²	74.6	54.5 Å²	54.5	40%	0.399	28%	0.275	S	S	.	.			trans	-89.7	92.4	-171.9	-70.1	0.3	0	0	0	112.4	Y1487 E1491 Q1492	Y1487-N1489 HydrophobicContact CE1-CB 4.12Å; Y1487-N1489 WeakPolarHBondContact CE1-O 3.35Å; N1489-E1491 VanDerWaalsContact C-N 3.29Å; N1489-E1491 PolarHBondContact O-N 3.19Å; N1489-E1491 VanDerWaalsContact O-N 3.15Å; N1489-Q1492 HydrophobicContact CB-CG 4.37Å; N1489-Q1492 PolarHBondContact O-N 3.24Å; N1489-Q1492 VanDerWaalsContact O-N 3.16Å
1490	Y	62.2	Low	74.8	Confident	81 Å²	81	54.8 Å²	54.8	32%	0.318	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-61.7	-31.1	-176.5	-144.6	-86.9	0	0	0	114.3	R831 W832 V1452 Q1461 Y1487 S1488 Q1492 L1493	R831-Y1490 HydrophobicContact CB-CD2 3.44Å; R831-Y1490 VanDerWaalsContact CB-CD2 3.44Å; R831-Y1490 HydrophobicContact CB-CE2 3.54Å; R831-Y1490 WeakPolarHBondContact O-CB 3.27Å; R831-Y1490 VanDerWaalsContact O-CD2 3.24Å; R831-Y1490 WeakPolarHBondContact O-CD2 3.33Å; W832-Y1490 HydrophobicContact CB-CD1 4.12Å; W832-Y1490 HydrophobicContact CB-CD2 4.33Å; W832-Y1490 HydrophobicContact CB-CE1 3.79Å; W832-Y1490 HydrophobicContact CB-CE2 4.04Å; W832-Y1490 HydrophobicContact CB-CG 4.27Å; W832-Y1490 AromaticContact CD1-CD1 2.89Å; W832-Y1490 AromaticContact CD1-CE1 3.28Å; W832-Y1490 AromaticContact CD1-CG 3.33Å; W832-Y1490 AromaticContact CD2-CD1 3.56Å; W832-Y1490 HydrophobicContact CD2-CD1 3.56Å; W832-Y1490 HydrophobicContact CD2-CD2 4.35Å; W832-Y1490 AromaticContact CD2-CE1 3.06Å; W832-Y1490 HydrophobicContact CD2-CE1 3.06Å; W832-Y1490 AromaticContact CD2-CZ 3.77Å; W832-Y1490 AromaticContact CE2-CD1 3.41Å; W832-Y1490 VanDerWaalsContact CE2-CD1 3.41Å; W832-Y1490 AromaticContact CE2-CE1 3.29Å; W832-Y1490 HydrophobicContact CE3-CD1 4.48Å; W832-Y1490 HydrophobicContact CE3-CD2 4.23Å; W832-Y1490 AromaticContact CE3-CE1 3.59Å; W832-Y1490 HydrophobicContact CE3-CE1 3.59Å; W832-Y1490 AromaticContact CG-CD1 3.31Å; W832-Y1490 HydrophobicContact CG-CD1 3.31Å; W832-Y1490 HydrophobicContact CG-CD2 4.34Å; W832-Y1490 AromaticContact CG-CE1 3.12Å; W832-Y1490 HydrophobicContact CG-CE1 3.12Å; W832-Y1490 HydrophobicContact CG-CE2 4.22Å; W832-Y1490 AromaticContact CG-CG 3.84Å; W832-Y1490 HydrophobicContact CG-CG 3.84Å; W832-Y1490 AromaticContact CG-CZ 3.57Å; W832-Y1490 HydrophobicContact CH2-CD2 4.48Å; W832-Y1490 HydrophobicContact CZ2-CD1 4.3Å; W832-Y1490 HydrophobicContact CZ2-CE1 4.07Å; W832-Y1490 HydrophobicContact CZ3-CD2 4.27Å; W832-Y1490 HydrophobicContact CZ3-CE1 4.35Å; W832-Y1490 AromaticContact NE1-CD1 2.96Å; W832-Y1490 AromaticContact NE1-CE1 3.38Å; W832-Y1490 AromaticContact NE1-CG 3.82Å; V1452-Y1490 PolarHBondContact O-OH 3.5Å; V1452-Y1490 VanDerWaalsContact O-OH 3.13Å; Q1461-Y1490 PolarHBondContact OE1-OH 3.06Å; Y1487-Y1490 WeakPolarHBondContact O-CE1 3.38Å; S1488-Y1490 WeakPolarHBondContact O-CD2 3.46Å; S1488-Y1490 WeakPolarHBondContact O-CE2 3.49Å; S1488-Y1490 PolarHBondContact O-N 3.21Å; S1488-Y1490 VanDerWaalsContact O-N 3.13Å; Y1490-Q1492 VanDerWaalsContact C-N 3.26Å; Y1490-Q1492 PolarHBondContact O-N 3.16Å; Y1490-L1493 HydrophobicContact CD1-CD2 4.22Å; Y1490-L1493 HydrophobicContact CD2-CB 4.37Å; Y1490-L1493 HydrophobicContact CD2-CD2 3.76Å; Y1490-L1493 HydrophobicContact CE1-CD2 3.99Å; Y1490-L1493 HydrophobicContact CE2-CD2 3.52Å; Y1490-L1493 WeakPolarHBondContact O-CB 3.36Å; Y1490-L1493 PolarHBondContact O-N 3.18Å; Y1490-L1493 VanDerWaalsContact O-N 3.15Å
1491	E	60.8	Low	74.9	Confident	165.2 Å²	165.2	55.7 Å²	55.7	77%	0.772	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-58.9	-34.3	177.5	-62.7	-178	168.1	0	0	112.3	N1489 L1493	N1489-E1491 VanDerWaalsContact C-N 3.29Å; N1489-E1491 PolarHBondContact O-N 3.19Å; N1489-E1491 VanDerWaalsContact O-N 3.15Å; E1491-L1493 VanDerWaalsContact C-N 3.32Å
1492	Q	68.5	Low	75	Confident	99.6 Å²	99.6	59 Å²	59	47%	0.465	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-88.4	-1	179	-63.4	-178.4	-2.4	0	0	113	Y1487 N1489 Y1490 G1494 A1495 K1496	Y1487-Q1492 HydrophobicContact CE1-CB 4.44Å; Y1487-Q1492 WeakPolarHBondContact OH-CB 3.41Å; Y1487-Q1492 PolarHBondContact OH-OE1 2.94Å; N1489-Q1492 HydrophobicContact CB-CG 4.37Å; N1489-Q1492 PolarHBondContact O-N 3.24Å; N1489-Q1492 VanDerWaalsContact O-N 3.16Å; Y1490-Q1492 VanDerWaalsContact C-N 3.26Å; Y1490-Q1492 PolarHBondContact O-N 3.16Å; Q1492-G1494 VanDerWaalsContact C-N 3.28Å; Q1492-G1494 PolarHBondContact O-N 3.06Å; Q1492-A1495 WeakPolarHBondContact O-CA 3.45Å; Q1492-A1495 WeakPolarHBondContact O-CB 3.28Å; Q1492-A1495 PolarHBondContact O-N 3.1Å; Q1492-A1495 VanDerWaalsContact O-N 3.1Å; Q1492-K1496 HydrophobicContact CB-CD 4.4Å; Q1492-K1496 PolarHBondContact O-N 3.21Å; Q1492-K1496 VanDerWaalsContact OE1-NZ 3.16Å
1493	L	74	Confident	75.5	Confident	9.6 Å²	9.6	60.1 Å²	60.1	5%	0.05	31%	0.307	C	S	.	.	H	α-helix	trans	-57.5	-39.9	-175.9	-171.3	71.7	0	0	0	111.8	W832 L1453 L1484 Y1487 Y1490 E1491 A1495 K1496 L1497	W832-L1493 HydrophobicContact CZ2-CD1 3.79Å; W832-L1493 HydrophobicContact CZ2-CD2 4.45Å; W832-L1493 VanDerWaalsContact NE1-CD2 3.34Å; L1453-L1493 HydrophobicContact CD2-CD2 4Å; L1484-L1493 HydrophobicContact CD2-CD1 3.84Å; Y1487-L1493 HydrophobicContact CD1-CD1 4.41Å; Y1490-L1493 HydrophobicContact CD1-CD2 4.22Å; Y1490-L1493 HydrophobicContact CD2-CB 4.37Å; Y1490-L1493 HydrophobicContact CD2-CD2 3.76Å; Y1490-L1493 HydrophobicContact CE1-CD2 3.99Å; Y1490-L1493 HydrophobicContact CE2-CD2 3.52Å; Y1490-L1493 WeakPolarHBondContact O-CB 3.36Å; Y1490-L1493 PolarHBondContact O-N 3.18Å; Y1490-L1493 VanDerWaalsContact O-N 3.15Å; E1491-L1493 VanDerWaalsContact C-N 3.32Å; L1493-A1495 VanDerWaalsContact C-N 3.32Å; L1493-A1495 PolarHBondContact O-N 3.09Å; L1493-K1496 PolarHBondContact O-N 3.16Å; L1493-L1497 HydrophobicContact CD1-CG 4.48Å; L1493-L1497 HydrophobicContact CD2-CD1 4.42Å; L1493-L1497 HydrophobicContact CG-CD1 4.03Å; L1493-L1497 HydrophobicContact CG-CG 4.39Å; L1493-L1497 VanDerWaalsContact O-CB 3.31Å; L1493-L1497 WeakPolarHBondContact O-CB 3.43Å; L1493-L1497 WeakPolarHBondContact O-CD1 3.37Å; L1493-L1497 VanDerWaalsContact O-CG 3.27Å; L1493-L1497 WeakPolarHBondContact O-CG 3.35Å; L1493-L1497 PolarHBondContact O-N 3.05Å
1494	G	73.1	Confident	75.7	Confident	30.4 Å²	30.4	59.9 Å²	59.9	31%	0.313	31%	0.306	S	S	.	.	H	α-helix	trans	-64.8	-35.4	177.6	0	0	0	0	0	113.7	Q1492 K1498	Q1492-G1494 VanDerWaalsContact C-N 3.28Å; Q1492-G1494 PolarHBondContact O-N 3.06Å; G1494-K1498 WeakPolarHBondContact O-CG 3.36Å; G1494-K1498 PolarHBondContact O-N 3.31Å
1495	A	76.9	Confident	75.9	Confident	53.4 Å²	53.4	61.8 Å²	61.8	44%	0.441	32%	0.32	S	S	.	.	H	α-helix	trans	-73.7	-42.5	174.3	0	0	0	0	0	111	Q1492 L1493 L1497 K1498 Q1499	Q1492-A1495 WeakPolarHBondContact O-CA 3.45Å; Q1492-A1495 WeakPolarHBondContact O-CB 3.28Å; Q1492-A1495 PolarHBondContact O-N 3.1Å; Q1492-A1495 VanDerWaalsContact O-N 3.1Å; L1493-A1495 VanDerWaalsContact C-N 3.32Å; L1493-A1495 PolarHBondContact O-N 3.09Å; A1495-L1497 PolarHBondContact O-N 3.15Å; A1495-K1498 WeakPolarHBondContact O-CB 3.31Å; A1495-K1498 PolarHBondContact O-N 3.15Å; A1495-K1498 VanDerWaalsContact O-N 3.15Å; A1495-Q1499 WeakPolarHBondContact O-CG 3.31Å; A1495-Q1499 PolarHBondContact O-N 3.21Å; A1495-Q1499 VanDerWaalsContact O-N 3.09Å
1496	K	76.8	Confident	76.4	Confident	51.8 Å²	51.8	61.4 Å²	61.4	23%	0.225	33%	0.325	C	S	.	.	H	α-helix	trans	-65.8	-38.9	178.5	-133.7	104.3	177	-177.6	0	112.7	Y1487 Q1492 L1493 K1498 Q1499 L1500	Y1487-K1496 HydrophobicContact CD1-CB 4.23Å; Y1487-K1496 HydrophobicContact CD1-CD 3.84Å; Y1487-K1496 HydrophobicContact CD1-CG 4.14Å; Y1487-K1496 HydrophobicContact CD2-CD 4.13Å; Y1487-K1496 HydrophobicContact CD2-CG 4.18Å; Y1487-K1496 HydrophobicContact CE1-CB 3.79Å; Y1487-K1496 HydrophobicContact CE1-CD 3.97Å; Y1487-K1496 HydrophobicContact CE1-CG 4.04Å; Y1487-K1496 HydrophobicContact CE2-CB 4.37Å; Y1487-K1496 HydrophobicContact CE2-CD 4.07Å; Y1487-K1496 HydrophobicContact CE2-CG 4.11Å; Y1487-K1496 HydrophobicContact CG-CD 3.93Å; Y1487-K1496 HydrophobicContact CG-CG 4.21Å; Y1487-K1496 WeakPolarHBondContact OH-CE 3.26Å; Y1487-K1496 PolarHBondContact OH-NZ 2.73Å; Q1492-K1496 HydrophobicContact CB-CD 4.4Å; Q1492-K1496 PolarHBondContact O-N 3.21Å; Q1492-K1496 VanDerWaalsContact OE1-NZ 3.16Å; L1493-K1496 PolarHBondContact O-N 3.16Å; K1496-K1498 VanDerWaalsContact C-N 3.29Å; K1496-K1498 PolarHBondContact O-N 3.13Å; K1496-Q1499 HydrophobicContact CD-CB 4.44Å; K1496-Q1499 CarbonylContact O-C 3.44Å; K1496-Q1499 PolarHBondContact O-N 2.98Å; K1496-L1500 PolarHBondContact O-N 3.11Å
1497	L	82	Confident	77.2	Confident	2.6 Å²	2.6	58.4 Å²	58.4	1%	0.014	31%	0.309	C	S	.	.	H	α-helix	trans	-59.3	-34.4	172.4	-81.6	164.6	0	0	0	112.7	L1453 Q1461 V1464 L1465 K1468 L1484 L1493 A1495 L1500	L1453-L1497 HydrophobicContact CD2-CD1 4.39Å; Q1461-L1497 HydrophobicContact CB-CD1 3.68Å; Q1461-L1497 HydrophobicContact CG-CD1 3.83Å; V1464-L1497 HydrophobicContact CG1-CB 4.26Å; L1465-L1497 HydrophobicContact CB-CD2 4.36Å; L1465-L1497 HydrophobicContact CD1-CD2 4.35Å; K1468-L1497 WeakPolarHBondContact CE-O 3.3Å; L1484-L1497 HydrophobicContact CD1-CD2 3.75Å; L1484-L1497 HydrophobicContact CD2-CD2 3.87Å; L1484-L1497 HydrophobicContact CD2-CG 4.14Å; L1484-L1497 HydrophobicContact CG-CD2 4.36Å; L1493-L1497 HydrophobicContact CD1-CG 4.48Å; L1493-L1497 HydrophobicContact CD2-CD1 4.42Å; L1493-L1497 HydrophobicContact CG-CD1 4.03Å; L1493-L1497 HydrophobicContact CG-CG 4.39Å; L1493-L1497 VanDerWaalsContact O-CB 3.31Å; L1493-L1497 WeakPolarHBondContact O-CB 3.43Å; L1493-L1497 WeakPolarHBondContact O-CD1 3.37Å; L1493-L1497 VanDerWaalsContact O-CG 3.27Å; L1493-L1497 WeakPolarHBondContact O-CG 3.35Å; L1493-L1497 PolarHBondContact O-N 3.05Å; A1495-L1497 PolarHBondContact O-N 3.15Å; L1497-L1500 HydrophobicContact CD2-CD1 4.19Å
1498	K	81.5	Confident	78	Confident	158.8 Å²	158.8	55.8 Å²	55.8	69%	0.69	30%	0.299	S	S	*	.	H	α-helix	trans	-73.3	-37.4	174.1	-70.2	179.2	179.7	-176.4	0	112.1	V1464 K1468 G1494 A1495 K1496 L1500	V1464-K1498 HydrophobicContact CG1-CG 4.44Å; K1468-K1498 PolarHBondContact NZ-O 3.44Å; G1494-K1498 WeakPolarHBondContact O-CG 3.36Å; G1494-K1498 PolarHBondContact O-N 3.31Å; A1495-K1498 WeakPolarHBondContact O-CB 3.31Å; A1495-K1498 PolarHBondContact O-N 3.15Å; A1495-K1498 VanDerWaalsContact O-N 3.15Å; K1496-K1498 VanDerWaalsContact C-N 3.29Å; K1496-K1498 PolarHBondContact O-N 3.13Å; K1498-L1500 VanDerWaalsContact C-N 3.32Å; K1498-L1500 PolarHBondContact O-N 3.44Å
1499	Q	83.2	Confident	79.3	Confident	139.2 Å²	139.2	53.7 Å²	53.7	65%	0.65	28%	0.282	S	S	*	.	H	α-helix	trans	-74	-23.3	177.4	-70	174	-9.1	0	0	113.5	A1495 K1496	A1495-Q1499 WeakPolarHBondContact O-CG 3.31Å; A1495-Q1499 PolarHBondContact O-N 3.21Å; A1495-Q1499 VanDerWaalsContact O-N 3.09Å; K1496-Q1499 HydrophobicContact CD-CB 4.44Å; K1496-Q1499 CarbonylContact O-C 3.44Å; K1496-Q1499 PolarHBondContact O-N 2.98Å
1500	L	84.9	Confident	80.2	Confident	9.6 Å²	9.6	52.9 Å²	52.9	5%	0.05	28%	0.278	C	S	.	.	S	Bend	trans	-55.1	127.8	-179.8	-118.4	151.8	0	0	0	110.5	L1465 K1468 Y1476 A1480 E1483 L1484 K1496 L1497 K1498 L1507	L1465-L1500 HydrophobicContact CD1-CD1 4.43Å; L1465-L1500 HydrophobicContact CD1-CD2 4.13Å; K1468-L1500 WeakPolarHBondContact CE-O 3.16Å; K1468-L1500 PolarHBondContact NZ-O 3.05Å; Y1476-L1500 WeakPolarHBondContact OH-CD2 3.4Å; A1480-L1500 HydrophobicContact CB-CD2 3.81Å; E1483-L1500 HydrophobicContact CG-CD2 4.23Å; L1484-L1500 HydrophobicContact CD1-CD1 4.12Å; L1484-L1500 HydrophobicContact CD2-CD1 3.92Å; L1484-L1500 HydrophobicContact CG-CD1 4.01Å; K1496-L1500 PolarHBondContact O-N 3.11Å; L1497-L1500 HydrophobicContact CD2-CD1 4.19Å; K1498-L1500 VanDerWaalsContact C-N 3.32Å; K1498-L1500 PolarHBondContact O-N 3.44Å; L1500-L1507 HydrophobicContact CD1-CD1 4.35Å; L1500-L1507 HydrophobicContact CD2-CD1 3.97Å; L1500-L1507 VanDerWaalsContact CD2-CD1 3.47Å; L1500-L1507 HydrophobicContact CG-CD1 4.12Å
1501	P	86.9	Confident	81.3	Confident	18.6 Å²	18.6	49.1 Å²	49.1	12%	0.121	26%	0.263	C	S	.	.			trans	-64.5	150.7	-175.3	-15.7	22.2	0	0	0	113.8	Y1476 T1503 S1506 L1507 D1510	Y1476-P1501 WeakPolarHBondContact CE2-O 3.42Å; Y1476-P1501 PolarHBondContact OH-O 2.98Å; P1501-T1503 VanDerWaalsContact C-N 3.33Å; P1501-T1503 PolarHBondContact O-N 3.05Å; P1501-S1506 VanDerWaalsContact CB-CB 3.45Å; P1501-S1506 WeakPolarHBondContact CB-OG 3.25Å; P1501-L1507 HydrophobicContact CB-CB 4.47Å; P1501-L1507 HydrophobicContact CG-CB 3.79Å; P1501-L1507 HydrophobicContact CG-CD1 4.42Å; P1501-L1507 HydrophobicContact CG-CG 4.23Å; P1501-D1510 VanDerWaalsContact CD-OD2 3.31Å; P1501-D1510 WeakPolarHBondContact CD-OD2 3.43Å; P1501-D1510 HydrophobicContact CG-CB 4.17Å; P1501-D1510 WeakPolarHBondContact CG-OD2 3.38Å
1502	D	86.2	Confident	82.6	Confident	73.6 Å²	73.6	41.4 Å²	41.4	39%	0.394	23%	0.227	S	C	.	.	S	Bend	trans	-78.9	-15.8	-174.8	-69.7	-7.9	0	0	0	114.3	K1468 R1469 D1470	K1468-D1502 HydrophobicContact CD-CB 4.49Å; K1468-D1502 WeakPolarHBondContact CD-OD1 3.29Å; K1468-D1502 WeakPolarHBondContact CE-OD1 3.3Å; K1468-D1502 IonicContact NZ-OD1 3.16Å; K1468-D1502 PolarHBondContact NZ-OD1 3.32Å; R1469-D1502 HydrophobicContact CB-CB 4.18Å; R1469-D1502 HydrophobicContact CG-CB 4.04Å; R1469-D1502 PolarHBondContact N-O 3.04Å; R1469-D1502 IonicContact NE-OD2 3.69Å; R1469-D1502 PolarHBondContact NE-OD2 3.31Å; D1470-D1502 PolarHBondContact N-O 3.21Å; D1470-D1502 VanDerWaalsContact N-O 3.08Å
1503	T	86.4	Confident	83.3	Confident	35.8 Å²	35.8	40.7 Å²	40.7	22%	0.22	22%	0.223	C	C	.	.	S	Bend	trans	-125.8	155.1	-174.7	66.6	0	0	0	0	113.1	D1470 P1501 S1505 S1506 L1507	D1470-T1503 WeakPolarHBondContact OD2-CA 3.34Å; D1470-T1503 WeakPolarHBondContact OD2-CB 3.33Å; P1501-T1503 VanDerWaalsContact C-N 3.33Å; P1501-T1503 PolarHBondContact O-N 3.05Å; T1503-S1505 VanDerWaalsContact C-N 3.33Å; T1503-S1505 PolarHBondContact O-N 3.33Å; T1503-S1505 PolarHBondContact OG1-OG 3.33Å; T1503-S1506 PolarHBondContact N-OG 3.25Å; T1503-S1506 PolarHBondContact O-N 3.11Å; T1503-S1506 PolarHBondContact O-OG 3.19Å; T1503-S1506 VanDerWaalsContact O-OG 3.08Å; T1503-S1506 WeakPolarHBondContact OG1-CB 3.39Å; T1503-S1506 PolarHBondContact OG1-N 3.02Å; T1503-S1506 PolarHBondContact OG1-OG 3.23Å; T1503-S1506 VanDerWaalsContact OG1-OG 3.11Å; T1503-L1507 WeakPolarHBondContact O-CB 3.35Å; T1503-L1507 PolarHBondContact O-N 2.96Å
1504	I	84.8	Confident	83.8	Confident	5.2 Å²	5.2	43.3 Å²	43.3	3%	0.027	23%	0.232	C	C	.	.	H	α-helix	trans	-57.9	-45.8	177.6	-63.7	172.9	0	0	0	110.8	D1470 I1473 L1475 Y1476 L1479 S1506 L1507 V1508 L1677	D1470-I1504 HydrophobicContact CB-CG1 4.22Å; D1470-I1504 PolarHBondContact OD2-N 3.14Å; I1473-I1504 HydrophobicContact CB-CD1 4.33Å; I1473-I1504 HydrophobicContact CD1-CD1 4.02Å; I1473-I1504 HydrophobicContact CG2-CD1 4.07Å; L1475-I1504 HydrophobicContact CB-CD1 4.48Å; L1475-I1504 HydrophobicContact CD2-CD1 4.41Å; Y1476-I1504 HydrophobicContact CD2-CG1 3.98Å; Y1476-I1504 HydrophobicContact CG-CG1 4.39Å; L1479-I1504 HydrophobicContact CD1-CG2 4.2Å; I1504-S1506 VanDerWaalsContact C-N 3.33Å; I1504-S1506 PolarHBondContact O-N 3.06Å; I1504-L1507 PolarHBondContact O-N 3.19Å; I1504-L1507 VanDerWaalsContact O-N 3.15Å; I1504-V1508 HydrophobicContact CG2-CG2 4.31Å; I1504-V1508 WeakPolarHBondContact O-CG2 3.29Å; I1504-V1508 PolarHBondContact O-N 3.22Å; I1504-L1677 HydrophobicContact CG2-CD1 4.09Å
1505	S	85	Confident	84.3	Confident	43.4 Å²	43.4	41.8 Å²	41.8	30%	0.303	22%	0.217	S	C	.	.	H	α-helix	trans	-58.2	-45.4	-179.9	-34.9	0	0	0	0	112.7	T1503 L1507 V1508 I1509 L1677	T1503-S1505 VanDerWaalsContact C-N 3.33Å; T1503-S1505 PolarHBondContact O-N 3.33Å; T1503-S1505 PolarHBondContact OG1-OG 3.33Å; S1505-L1507 VanDerWaalsContact C-N 3.31Å; S1505-L1507 PolarHBondContact O-N 3.16Å; S1505-V1508 PolarHBondContact O-N 2.92Å; S1505-I1509 WeakPolarHBondContact O-CD1 3.4Å; S1505-I1509 VanDerWaalsContact O-CG1 3.28Å; S1505-I1509 WeakPolarHBondContact O-CG1 3.35Å; S1505-I1509 PolarHBondContact O-N 3.14Å; S1505-I1509 VanDerWaalsContact O-N 3.13Å; S1505-L1677 WeakPolarHBondContact OG-CD2 3.32Å
1506	S	86.2	Confident	84.7	Confident	43 Å²	43	41 Å²	41	30%	0.301	20%	0.204	S	C	.	.	H	α-helix	trans	-71.3	-34.8	178.9	-18.2	0	0	0	0	112.2	P1501 T1503 I1504 I1509 D1510	P1501-S1506 VanDerWaalsContact CB-CB 3.45Å; P1501-S1506 WeakPolarHBondContact CB-OG 3.25Å; T1503-S1506 PolarHBondContact N-OG 3.25Å; T1503-S1506 PolarHBondContact O-N 3.11Å; T1503-S1506 PolarHBondContact O-OG 3.19Å; T1503-S1506 VanDerWaalsContact O-OG 3.08Å; T1503-S1506 WeakPolarHBondContact OG1-CB 3.39Å; T1503-S1506 PolarHBondContact OG1-N 3.02Å; T1503-S1506 PolarHBondContact OG1-OG 3.23Å; T1503-S1506 VanDerWaalsContact OG1-OG 3.11Å; I1504-S1506 VanDerWaalsContact C-N 3.33Å; I1504-S1506 PolarHBondContact O-N 3.06Å; S1506-I1509 WeakPolarHBondContact O-CB 3.36Å; S1506-I1509 PolarHBondContact O-N 3.18Å; S1506-D1510 PolarHBondContact O-N 3.02Å; S1506-D1510 VanDerWaalsContact O-N 3.14Å
1507	L	86.8	Confident	84.9	Confident	2.6 Å²	2.6	43.6 Å²	43.6	1%	0.014	23%	0.227	C	C	.	.	H	α-helix	trans	-65	-43	175.4	-172.1	77.8	0	0	0	111.8	Y1476 L1479 A1480 E1483 L1500 P1501 T1503 I1504 S1505 I1509 D1510 V1511	Y1476-L1507 HydrophobicContact CD2-CD2 4.12Å; Y1476-L1507 HydrophobicContact CE2-CB 4.45Å; Y1476-L1507 HydrophobicContact CE2-CD1 3.98Å; Y1476-L1507 HydrophobicContact CE2-CD2 4.08Å; L1479-L1507 HydrophobicContact CB-CD2 3.54Å; L1479-L1507 VanDerWaalsContact CB-CD2 3.48Å; L1479-L1507 HydrophobicContact CB-CG 4.4Å; L1479-L1507 HydrophobicContact CD1-CD2 4.42Å; L1479-L1507 HydrophobicContact CG-CD2 4.48Å; A1480-L1507 HydrophobicContact CB-CD1 4.17Å; A1480-L1507 HydrophobicContact CB-CD2 4.24Å; E1483-L1507 HydrophobicContact CG-CD2 4.49Å; L1500-L1507 HydrophobicContact CD1-CD1 4.35Å; L1500-L1507 HydrophobicContact CD2-CD1 3.97Å; L1500-L1507 VanDerWaalsContact CD2-CD1 3.47Å; L1500-L1507 HydrophobicContact CG-CD1 4.12Å; P1501-L1507 HydrophobicContact CB-CB 4.47Å; P1501-L1507 HydrophobicContact CG-CB 3.79Å; P1501-L1507 HydrophobicContact CG-CD1 4.42Å; P1501-L1507 HydrophobicContact CG-CG 4.23Å; T1503-L1507 WeakPolarHBondContact O-CB 3.35Å; T1503-L1507 PolarHBondContact O-N 2.96Å; I1504-L1507 PolarHBondContact O-N 3.19Å; I1504-L1507 VanDerWaalsContact O-N 3.15Å; S1505-L1507 VanDerWaalsContact C-N 3.31Å; S1505-L1507 PolarHBondContact O-N 3.16Å; L1507-I1509 VanDerWaalsContact C-N 3.33Å; L1507-I1509 PolarHBondContact O-N 3.21Å; L1507-D1510 PolarHBondContact O-N 3.17Å; L1507-V1511 HydrophobicContact CD2-CG2 4.29Å; L1507-V1511 VanDerWaalsContact O-CG2 3.29Å; L1507-V1511 WeakPolarHBondContact O-CG2 3.32Å; L1507-V1511 PolarHBondContact O-N 3.24Å
1508	V	86.5	Confident	84.6	Confident	0.6 Å²	0.6	47 Å²	47	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-43.4	174.7	173.3	0	0	0	0	110.9	L1479 I1504 S1505 D1510 V1511 V1512 L1625 I1674 L1677 V1678 I1681	L1479-V1508 HydrophobicContact CD1-CG2 4.43Å; I1504-V1508 HydrophobicContact CG2-CG2 4.31Å; I1504-V1508 WeakPolarHBondContact O-CG2 3.29Å; I1504-V1508 PolarHBondContact O-N 3.22Å; S1505-V1508 PolarHBondContact O-N 2.92Å; V1508-D1510 VanDerWaalsContact C-N 3.31Å; V1508-D1510 PolarHBondContact O-N 3.2Å; V1508-V1511 PolarHBondContact O-N 3.03Å; V1508-V1512 HydrophobicContact CG1-CG2 4.46Å; V1508-V1512 WeakPolarHBondContact O-CG2 3.37Å; V1508-V1512 PolarHBondContact O-N 3.24Å; V1508-L1625 HydrophobicContact CB-CD2 4.42Å; V1508-L1625 HydrophobicContact CG1-CD1 4.3Å; V1508-L1625 HydrophobicContact CG1-CD2 4.11Å; V1508-L1625 HydrophobicContact CG2-CD2 3.99Å; V1508-I1674 HydrophobicContact CG1-CG2 4.5Å; V1508-I1674 HydrophobicContact CG2-CG1 4.11Å; V1508-I1674 HydrophobicContact CG2-CG2 4.46Å; V1508-L1677 HydrophobicContact CG1-CB 4.43Å; V1508-L1677 HydrophobicContact CG2-CD1 4.22Å; V1508-V1678 HydrophobicContact CG1-CG2 4.01Å; V1508-I1681 HydrophobicContact CG1-CD1 3.99Å
1509	I	86.6	Confident	84.4	Confident	28.2 Å²	28.2	40.1 Å²	40.1	15%	0.145	22%	0.223	C	C	.	.	H	α-helix	trans	-58.1	-44.2	175.5	-69.9	166	0	0	0	111.1	S1505 S1506 L1507 V1512 K1513 I1681 Y1688	S1505-I1509 WeakPolarHBondContact O-CD1 3.4Å; S1505-I1509 VanDerWaalsContact O-CG1 3.28Å; S1505-I1509 WeakPolarHBondContact O-CG1 3.35Å; S1505-I1509 PolarHBondContact O-N 3.14Å; S1505-I1509 VanDerWaalsContact O-N 3.13Å; S1506-I1509 WeakPolarHBondContact O-CB 3.36Å; S1506-I1509 PolarHBondContact O-N 3.18Å; L1507-I1509 VanDerWaalsContact C-N 3.33Å; L1507-I1509 PolarHBondContact O-N 3.21Å; I1509-V1512 PolarHBondContact O-N 2.95Å; I1509-K1513 HydrophobicContact CG2-CD 4.04Å; I1509-K1513 VanDerWaalsContact CG2-CE 3.46Å; I1509-K1513 HydrophobicContact CG2-CG 4.36Å; I1509-K1513 WeakPolarHBondContact O-CB 3.3Å; I1509-K1513 VanDerWaalsContact O-CG 3.3Å; I1509-K1513 WeakPolarHBondContact O-CG 3.35Å; I1509-K1513 PolarHBondContact O-N 3.18Å; I1509-I1681 HydrophobicContact CB-CD1 4.47Å; I1509-I1681 HydrophobicContact CG1-CD1 3.55Å; I1509-I1681 VanDerWaalsContact CG1-CD1 3.48Å; I1509-I1681 HydrophobicContact CG1-CG1 3.91Å; I1509-Y1688 HydrophobicContact CD1-CD1 3.98Å; I1509-Y1688 HydrophobicContact CD1-CE1 3.8Å
1510	D	85.5	Confident	84.2	Confident	59.2 Å²	59.2	34.5 Å²	34.5	32%	0.317	20%	0.202	S	C	.	.	H	α-helix	trans	-69.5	-35.3	179.9	-80.3	4.3	0	0	0	112.6	P1501 S1506 L1507 V1508 K1513 R1514	P1501-D1510 VanDerWaalsContact CD-OD2 3.31Å; P1501-D1510 WeakPolarHBondContact CD-OD2 3.43Å; P1501-D1510 HydrophobicContact CG-CB 4.17Å; P1501-D1510 WeakPolarHBondContact CG-OD2 3.38Å; S1506-D1510 PolarHBondContact O-N 3.02Å; S1506-D1510 VanDerWaalsContact O-N 3.14Å; L1507-D1510 PolarHBondContact O-N 3.17Å; V1508-D1510 VanDerWaalsContact C-N 3.31Å; V1508-D1510 PolarHBondContact O-N 3.2Å; D1510-K1513 PolarHBondContact O-N 2.9Å; D1510-K1513 IonicContact OD1-NZ 3.38Å; D1510-K1513 PolarHBondContact OD1-NZ 3.48Å; D1510-R1514 WeakPolarHBondContact O-CB 3.18Å; D1510-R1514 PolarHBondContact O-N 3.1Å
1511	V	85.6	Confident	84	Confident	1.2 Å²	1.2	35.7 Å²	35.7	1%	0.007	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-47.7	171.3	173.6	0	0	0	0	110.6	E1483 L1507 V1508 R1514 V1515 P1624 L1625	E1483-V1511 VanDerWaalsContact CD-CG2 3.47Å; E1483-V1511 HydrophobicContact CG-CG2 4.04Å; E1483-V1511 WeakPolarHBondContact OE1-CG2 3.48Å; L1507-V1511 HydrophobicContact CD2-CG2 4.29Å; L1507-V1511 VanDerWaalsContact O-CG2 3.29Å; L1507-V1511 WeakPolarHBondContact O-CG2 3.32Å; L1507-V1511 PolarHBondContact O-N 3.24Å; V1508-V1511 PolarHBondContact O-N 3.03Å; V1511-R1514 WeakPolarHBondContact O-CB 3.26Å; V1511-R1514 PolarHBondContact O-N 3.23Å; V1511-V1515 WeakPolarHBondContact O-CG2 3.4Å; V1511-V1515 PolarHBondContact O-N 3.19Å; V1511-V1515 VanDerWaalsContact O-N 3.13Å; V1511-P1624 HydrophobicContact CG1-CG 4.5Å; V1511-L1625 HydrophobicContact CB-CD1 4.37Å; V1511-L1625 HydrophobicContact CB-CD2 4.37Å; V1511-L1625 HydrophobicContact CB-CG 4.43Å; V1511-L1625 HydrophobicContact CG1-CD1 3.85Å; V1511-L1625 HydrophobicContact CG1-CD2 4.12Å; V1511-L1625 HydrophobicContact CG1-CG 3.79Å; V1511-L1625 HydrophobicContact CG2-CD2 4.48Å
1512	V	86.6	Confident	83.8	Confident	3.4 Å²	3.4	36.8 Å²	36.8	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-61	-49.3	177.5	174	0	0	0	0	110.4	V1508 I1509 R1514 V1515 E1516 T1524 L1528 L1625 I1681	V1508-V1512 HydrophobicContact CG1-CG2 4.46Å; V1508-V1512 WeakPolarHBondContact O-CG2 3.37Å; V1508-V1512 PolarHBondContact O-N 3.24Å; I1509-V1512 PolarHBondContact O-N 2.95Å; V1512-R1514 VanDerWaalsContact C-N 3.31Å; V1512-R1514 PolarHBondContact O-N 3.19Å; V1512-V1515 WeakPolarHBondContact O-CA 3.45Å; V1512-V1515 PolarHBondContact O-N 3.34Å; V1512-V1515 VanDerWaalsContact O-N 3.09Å; V1512-E1516 HydrophobicContact CG1-CG 4.11Å; V1512-E1516 WeakPolarHBondContact O-CG 3.32Å; V1512-E1516 PolarHBondContact O-N 3.07Å; V1512-T1524 HydrophobicContact CG1-CG2 4.43Å; V1512-L1528 HydrophobicContact CG1-CD1 4.02Å; V1512-L1528 HydrophobicContact CG2-CD1 3.91Å; V1512-L1625 HydrophobicContact CG2-CD1 3.92Å; V1512-I1681 HydrophobicContact CG1-CG2 4.39Å
1513	K	84.2	Confident	83.7	Confident	84.8 Å²	84.8	34.2 Å²	34.2	37%	0.369	20%	0.201	S	C	.	.	H	α-helix	trans	-57	-41.2	177.2	-75.9	174.3	-176.4	167	0	113	I1509 D1510 V1515 E1516 C1517	I1509-K1513 HydrophobicContact CG2-CD 4.04Å; I1509-K1513 VanDerWaalsContact CG2-CE 3.46Å; I1509-K1513 HydrophobicContact CG2-CG 4.36Å; I1509-K1513 WeakPolarHBondContact O-CB 3.3Å; I1509-K1513 VanDerWaalsContact O-CG 3.3Å; I1509-K1513 WeakPolarHBondContact O-CG 3.35Å; I1509-K1513 PolarHBondContact O-N 3.18Å; D1510-K1513 PolarHBondContact O-N 2.9Å; D1510-K1513 IonicContact OD1-NZ 3.38Å; D1510-K1513 PolarHBondContact OD1-NZ 3.48Å; K1513-V1515 VanDerWaalsContact C-N 3.31Å; K1513-V1515 PolarHBondContact O-N 3.22Å; K1513-E1516 WeakPolarHBondContact CA-OE2 3.46Å; K1513-E1516 PolarHBondContact O-N 3.18Å; K1513-C1517 WeakPolarHBondContact O-CB 3.37Å; K1513-C1517 PolarHBondContact O-N 3.26Å; K1513-C1517 PolarHBondContact O-SG 2.9Å; K1513-C1517 VanDerWaalsContact O-SG 3.33Å
1514	R	84.5	Confident	83.7	Confident	63.2 Å²	63.2	32.4 Å²	32.4	24%	0.238	19%	0.19	C	C	.	.	H	α-helix	trans	-59.7	-44.3	176.3	176.7	-176.3	57.5	78.8	1.2	110.8	E1483 L1486 D1510 V1511 V1512 C1517 S1518 G1621	E1483-R1514 VanDerWaalsContact CD-NE 3.34Å; E1483-R1514 VanDerWaalsContact OE1-CD 3.26Å; E1483-R1514 WeakPolarHBondContact OE1-CD 3.45Å; E1483-R1514 IonicContact OE1-CZ 3.03Å; E1483-R1514 VanDerWaalsContact OE1-CZ 3.23Å; E1483-R1514 IonicContact OE1-NE 3.18Å; E1483-R1514 PolarHBondContact OE1-NE 3.25Å; E1483-R1514 VanDerWaalsContact OE1-NE 3.15Å; E1483-R1514 IonicContact OE1-NH1 2.86Å; E1483-R1514 IonicContact OE1-NH2 3.2Å; E1483-R1514 PolarHBondContact OE1-NH2 3.07Å; E1483-R1514 IonicContact OE2-CZ 3.67Å; E1483-R1514 VanDerWaalsContact OE2-CZ 3.29Å; E1483-R1514 IonicContact OE2-NE 3.45Å; E1483-R1514 PolarHBondContact OE2-NE 3.1Å; E1483-R1514 VanDerWaalsContact OE2-NE 3.11Å; E1483-R1514 IonicContact OE2-NH1 3.78Å; E1483-R1514 PolarHBondContact OE2-NH1 3.06Å; E1483-R1514 IonicContact OE2-NH2 3.35Å; E1483-R1514 PolarHBondContact OE2-NH2 2.83Å; L1486-R1514 VanDerWaalsContact CD1-NH2 3.33Å; D1510-R1514 WeakPolarHBondContact O-CB 3.18Å; D1510-R1514 PolarHBondContact O-N 3.1Å; V1511-R1514 WeakPolarHBondContact O-CB 3.26Å; V1511-R1514 PolarHBondContact O-N 3.23Å; V1512-R1514 VanDerWaalsContact C-N 3.31Å; V1512-R1514 PolarHBondContact O-N 3.19Å; R1514-C1517 WeakPolarHBondContact O-CB 3.4Å; R1514-C1517 PolarHBondContact O-N 3.27Å; R1514-S1518 PolarHBondContact O-N 3Å; R1514-S1518 VanDerWaalsContact O-N 3.16Å; R1514-S1518 PolarHBondContact O-OG 3.39Å; R1514-G1621 PolarHBondContact NH1-O 3.07Å; R1514-G1621 PolarHBondContact NH2-O 3.07Å
1515	V	83.6	Confident	83.7	Confident	0.2 Å²	0.2	34.5 Å²	34.5	0%	0.001	20%	0.198	C	C	.	.	H	α-helix	trans	-69.9	-41.7	178.3	-179.4	0	0	0	0	111.2	V1511 V1512 K1513 C1517 S1518 C1519 T1524 L1618 G1621 L1622	V1511-V1515 WeakPolarHBondContact O-CG2 3.4Å; V1511-V1515 PolarHBondContact O-N 3.19Å; V1511-V1515 VanDerWaalsContact O-N 3.13Å; V1512-V1515 WeakPolarHBondContact O-CA 3.45Å; V1512-V1515 PolarHBondContact O-N 3.34Å; V1512-V1515 VanDerWaalsContact O-N 3.09Å; K1513-V1515 VanDerWaalsContact C-N 3.31Å; K1513-V1515 PolarHBondContact O-N 3.22Å; V1515-C1517 VanDerWaalsContact C-N 3.28Å; V1515-C1517 PolarHBondContact O-N 3.02Å; V1515-S1518 WeakPolarHBondContact CA-OG 3.32Å; V1515-S1518 CarbonylContact O-C 3.52Å; V1515-S1518 WeakPolarHBondContact O-CA 3.41Å; V1515-S1518 PolarHBondContact O-N 3.17Å; V1515-S1518 VanDerWaalsContact O-N 3.1Å; V1515-S1518 PolarHBondContact O-OG 3.28Å; V1515-S1518 VanDerWaalsContact O-OG 3.09Å; V1515-C1519 HydrophobicContact CG1-CB 4.38Å; V1515-C1519 PolarHBondContact O-N 3.03Å; V1515-T1524 HydrophobicContact CB-CG2 4.16Å; V1515-T1524 HydrophobicContact CG1-CG2 3.83Å; V1515-L1618 HydrophobicContact CG1-CD1 3.74Å; V1515-L1618 HydrophobicContact CG1-CG 4.34Å; V1515-G1621 VanDerWaalsContact CG2-C 3.44Å; V1515-G1621 VanDerWaalsContact CG2-O 3.31Å; V1515-G1621 WeakPolarHBondContact CG2-O 3.32Å; V1515-L1622 HydrophobicContact CB-CD2 4.11Å; V1515-L1622 HydrophobicContact CG1-CD2 4.07Å; V1515-L1622 HydrophobicContact CG1-CG 4.08Å; V1515-L1622 HydrophobicContact CG2-CD2 3.9Å; V1515-L1622 HydrophobicContact CG2-CG 4.27Å
1516	E	84.3	Confident	83.8	Confident	35.6 Å²	35.6	32.4 Å²	32.4	17%	0.166	18%	0.183	C	C	.	.	H	α-helix	trans	-56.7	-39.5	173.8	-70	-177.7	145.3	0	0	111.7	V1512 K1513 S1518 G1520 T1524 R1525	V1512-E1516 HydrophobicContact CG1-CG 4.11Å; V1512-E1516 WeakPolarHBondContact O-CG 3.32Å; V1512-E1516 PolarHBondContact O-N 3.07Å; K1513-E1516 WeakPolarHBondContact CA-OE2 3.46Å; K1513-E1516 PolarHBondContact O-N 3.18Å; E1516-S1518 VanDerWaalsContact C-N 3.32Å; E1516-S1518 PolarHBondContact O-N 3.12Å; E1516-G1520 CarbonylContact O-C 3.51Å; E1516-G1520 VanDerWaalsContact O-C 3.28Å; E1516-G1520 WeakPolarHBondContact O-CA 3.27Å; E1516-G1520 PolarHBondContact O-N 3.24Å; E1516-T1524 HydrophobicContact CG-CG2 3.93Å; E1516-R1525 IonicContact OE1-CZ 3.26Å; E1516-R1525 IonicContact OE1-NE 3.27Å; E1516-R1525 PolarHBondContact OE1-NE 3.24Å; E1516-R1525 IonicContact OE1-NH2 3.05Å; E1516-R1525 PolarHBondContact OE1-NH2 2.98Å
1517	C	81.3	Confident	84	Confident	105.8 Å²	105.8	30.4 Å²	30.4	72%	0.715	17%	0.169	S	C	*	.	H	α-helix	trans	-68.7	-26.7	175.5	-68.9	0	0	0	0	113.8	K1513 R1514 V1515	K1513-C1517 WeakPolarHBondContact O-CB 3.37Å; K1513-C1517 PolarHBondContact O-N 3.26Å; K1513-C1517 PolarHBondContact O-SG 2.9Å; K1513-C1517 VanDerWaalsContact O-SG 3.33Å; R1514-C1517 WeakPolarHBondContact O-CB 3.4Å; R1514-C1517 PolarHBondContact O-N 3.27Å; V1515-C1517 VanDerWaalsContact C-N 3.28Å; V1515-C1517 PolarHBondContact O-N 3.02Å
1518	S	75.2	Confident	84.1	Confident	76 Å²	76	30.3 Å²	30.3	53%	0.531	17%	0.168	S	C	.	.	H	α-helix	trans	-94.5	-36.1	-176.5	62.5	0	0	0	0	113.9	R1514 V1515 E1516	R1514-S1518 PolarHBondContact O-N 3Å; R1514-S1518 VanDerWaalsContact O-N 3.16Å; R1514-S1518 PolarHBondContact O-OG 3.39Å; V1515-S1518 WeakPolarHBondContact CA-OG 3.32Å; V1515-S1518 CarbonylContact O-C 3.52Å; V1515-S1518 WeakPolarHBondContact O-CA 3.41Å; V1515-S1518 PolarHBondContact O-N 3.17Å; V1515-S1518 VanDerWaalsContact O-N 3.1Å; V1515-S1518 PolarHBondContact O-OG 3.28Å; V1515-S1518 VanDerWaalsContact O-OG 3.09Å; E1516-S1518 VanDerWaalsContact C-N 3.32Å; E1516-S1518 PolarHBondContact O-N 3.12Å
1519	C	77.8	Confident	84.1	Confident	13.8 Å²	13.8	30.3 Å²	30.3	9%	0.093	17%	0.168	C	C	.	.	H	α-helix	trans	-117.1	-5.5	-172.6	-59.8	0	0	0	0	113.3	V1515 L1523 L1618 Y1697	V1515-C1519 HydrophobicContact CG1-CB 4.38Å; V1515-C1519 PolarHBondContact O-N 3.03Å; C1519-L1523 HydrophobicContact CB-CD2 4.34Å; C1519-L1618 HydrophobicContact CB-CD1 3.77Å; C1519-Y1697 VanDerWaalsContact O-CE2 3.23Å; C1519-Y1697 WeakPolarHBondContact O-CE2 3.2Å
1520	G	79	Confident	84.1	Confident	19.8 Å²	19.8	28.9 Å²	28.9	20%	0.204	16%	0.161	C	C	.	.			trans	94.3	147.2	-175.3	0	0	0	0	0	113.3	E1516 T1524	E1516-G1520 CarbonylContact O-C 3.51Å; E1516-G1520 VanDerWaalsContact O-C 3.28Å; E1516-G1520 WeakPolarHBondContact O-CA 3.27Å; E1516-G1520 PolarHBondContact O-N 3.24Å; G1520-T1524 WeakPolarHBondContact O-CB 3.34Å; G1520-T1524 PolarHBondContact O-N 3.29Å; G1520-T1524 VanDerWaalsContact O-N 3.16Å; G1520-T1524 PolarHBondContact O-OG1 2.89Å
1521	S	81.7	Confident	84.2	Confident	35.4 Å²	35.4	26.8 Å²	26.8	25%	0.248	15%	0.15	C	C	.	.	H	α-helix	trans	-66.4	-50	-175.9	57	0	0	0	0	112.8	L1523 T1524 R1525	S1521-L1523 PolarHBondContact O-N 3.15Å; S1521-T1524 PolarHBondContact O-N 3.27Å; S1521-R1525 VanDerWaalsContact O-CB 3.28Å; S1521-R1525 WeakPolarHBondContact O-CB 3.3Å; S1521-R1525 VanDerWaalsContact O-CG 3.26Å; S1521-R1525 WeakPolarHBondContact O-CG 3.26Å; S1521-R1525 PolarHBondContact O-N 3.21Å
1522	E	81.6	Confident	84.1	Confident	41.8 Å²	41.8	27.1 Å²	27.1	20%	0.195	15%	0.152	C	C	.	.	H	α-helix	trans	-64.4	-43.3	-176.2	-60.1	-52.2	124.3	0	0	111.6	T1524 R1525 I1526 W1550 V1727	E1522-T1524 VanDerWaalsContact C-N 3.34Å; E1522-T1524 PolarHBondContact O-N 3.12Å; E1522-R1525 PolarHBondContact O-N 3.04Å; E1522-I1526 WeakPolarHBondContact O-CG2 3.38Å; E1522-I1526 PolarHBondContact O-N 3.11Å; E1522-W1550 HydrophobicContact CB-CH2 3.85Å; E1522-W1550 HydrophobicContact CB-CZ2 4.12Å; E1522-V1727 HydrophobicContact CB-CG2 4.27Å; E1522-V1727 WeakPolarHBondContact OE2-CG2 3.3Å; E1522-V1727 PolarHBondContact OE2-N 3.18Å; E1522-V1727 VanDerWaalsContact OE2-N 3.14Å
1523	L	84.7	Confident	84	Confident	18.2 Å²	18.2	27.2 Å²	27.2	10%	0.095	15%	0.153	C	C	.	.	H	α-helix	trans	-64.1	-39.5	178.1	-168.1	99.5	0	0	0	112	C1519 S1521 R1525 I1526 T1527 I1547 L1610 L1618	C1519-L1523 HydrophobicContact CB-CD2 4.34Å; S1521-L1523 PolarHBondContact O-N 3.15Å; L1523-R1525 PolarHBondContact O-N 3.25Å; L1523-I1526 HydrophobicContact CD1-CG2 4.38Å; L1523-I1526 VanDerWaalsContact O-CG2 3.27Å; L1523-I1526 WeakPolarHBondContact O-CG2 3.43Å; L1523-T1527 WeakPolarHBondContact O-CB 3.27Å; L1523-T1527 PolarHBondContact O-N 3.08Å; L1523-T1527 PolarHBondContact O-OG1 3.23Å; L1523-I1547 HydrophobicContact CD1-CG2 3.85Å; L1523-L1610 HydrophobicContact CD1-CD1 4.06Å; L1523-L1610 HydrophobicContact CD1-CD2 4.33Å; L1523-L1610 HydrophobicContact CD2-CD1 4.04Å; L1523-L1610 HydrophobicContact CD2-CD2 4.39Å; L1523-L1618 HydrophobicContact CD1-CD2 4.43Å; L1523-L1618 HydrophobicContact CD2-CB 4.44Å; L1523-L1618 HydrophobicContact CD2-CD1 3.4Å; L1523-L1618 VanDerWaalsContact CD2-CD1 3.4Å; L1523-L1618 HydrophobicContact CD2-CD2 4.11Å; L1523-L1618 HydrophobicContact CD2-CG 4.05Å; L1523-L1618 HydrophobicContact CG-CD2 3.99Å
1524	T	86.4	Confident	83.8	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.2	-42.4	175.6	-53.9	0	0	0	0	111	V1512 V1515 E1516 G1520 S1521 E1522 T1527 L1528 L1622	V1512-T1524 HydrophobicContact CG1-CG2 4.43Å; V1515-T1524 HydrophobicContact CB-CG2 4.16Å; V1515-T1524 HydrophobicContact CG1-CG2 3.83Å; E1516-T1524 HydrophobicContact CG-CG2 3.93Å; G1520-T1524 WeakPolarHBondContact O-CB 3.34Å; G1520-T1524 PolarHBondContact O-N 3.29Å; G1520-T1524 VanDerWaalsContact O-N 3.16Å; G1520-T1524 PolarHBondContact O-OG1 2.89Å; S1521-T1524 PolarHBondContact O-N 3.27Å; E1522-T1524 VanDerWaalsContact C-N 3.34Å; E1522-T1524 PolarHBondContact O-N 3.12Å; T1524-T1527 PolarHBondContact O-N 3.05Å; T1524-L1528 HydrophobicContact CG2-CD1 3.94Å; T1524-L1528 HydrophobicContact CG2-CG 4.48Å; T1524-L1528 WeakPolarHBondContact O-CB 3.38Å; T1524-L1528 VanDerWaalsContact O-CG 3.28Å; T1524-L1528 WeakPolarHBondContact O-CG 3.33Å; T1524-L1528 PolarHBondContact O-N 2.78Å; T1524-L1622 HydrophobicContact CG2-CD2 4.42Å
1525	R	85.4	Confident	83.2	Confident	48 Å²	48	26.6 Å²	26.6	18%	0.181	15%	0.151	C	C	.	.	H	α-helix	trans	-69.4	-41.2	-179.2	-109.7	175.9	-161.5	-170	-1.9	113.1	E1516 S1521 E1522 L1523 T1527 G1529 C1682 V1727	E1516-R1525 IonicContact OE1-CZ 3.26Å; E1516-R1525 IonicContact OE1-NE 3.27Å; E1516-R1525 PolarHBondContact OE1-NE 3.24Å; E1516-R1525 IonicContact OE1-NH2 3.05Å; E1516-R1525 PolarHBondContact OE1-NH2 2.98Å; S1521-R1525 VanDerWaalsContact O-CB 3.28Å; S1521-R1525 WeakPolarHBondContact O-CB 3.3Å; S1521-R1525 VanDerWaalsContact O-CG 3.26Å; S1521-R1525 WeakPolarHBondContact O-CG 3.26Å; S1521-R1525 PolarHBondContact O-N 3.21Å; E1522-R1525 PolarHBondContact O-N 3.04Å; L1523-R1525 PolarHBondContact O-N 3.25Å; R1525-T1527 VanDerWaalsContact C-N 3.33Å; R1525-T1527 PolarHBondContact O-N 3Å; R1525-G1529 WeakPolarHBondContact O-CA 3.37Å; R1525-G1529 PolarHBondContact O-N 3.27Å; R1525-C1682 PolarHBondContact NE-O 3Å; R1525-C1682 PolarHBondContact NH2-O 2.91Å; R1525-V1727 HydrophobicContact CB-CB 4.46Å; R1525-V1727 HydrophobicContact CB-CG1 4.39Å; R1525-V1727 HydrophobicContact CG-CB 4.23Å; R1525-V1727 HydrophobicContact CG-CG1 3.99Å; R1525-V1727 PolarHBondContact NH1-O 3.36Å; R1525-V1727 PolarHBondContact NH2-O 2.89Å
1526	I	87	Confident	82.5	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.4	-42	175.7	-169.9	65.4	0	0	0	110.5	E1522 L1523 G1529 L1530 W1550 V1727 I1732 I1735	E1522-I1526 WeakPolarHBondContact O-CG2 3.38Å; E1522-I1526 PolarHBondContact O-N 3.11Å; L1523-I1526 HydrophobicContact CD1-CG2 4.38Å; L1523-I1526 VanDerWaalsContact O-CG2 3.27Å; L1523-I1526 WeakPolarHBondContact O-CG2 3.43Å; I1526-G1529 PolarHBondContact O-N 3.11Å; I1526-L1530 HydrophobicContact CD1-CD1 4.38Å; I1526-L1530 HydrophobicContact CD1-CG 4.28Å; I1526-L1530 HydrophobicContact CG1-CD1 3.98Å; I1526-L1530 HydrophobicContact CG1-CG 4.3Å; I1526-L1530 WeakPolarHBondContact O-CB 3.28Å; I1526-L1530 VanDerWaalsContact O-CG 3.26Å; I1526-L1530 WeakPolarHBondContact O-CG 3.41Å; I1526-L1530 PolarHBondContact O-N 2.99Å; I1526-W1550 HydrophobicContact CB-CD2 4.3Å; I1526-W1550 HydrophobicContact CB-CE3 4.45Å; I1526-W1550 HydrophobicContact CD1-CB 4.38Å; I1526-W1550 HydrophobicContact CD1-CD2 4.39Å; I1526-W1550 HydrophobicContact CD1-CG 4Å; I1526-W1550 HydrophobicContact CG1-CB 4.2Å; I1526-W1550 HydrophobicContact CG1-CD2 3.94Å; I1526-W1550 HydrophobicContact CG1-CE3 4.35Å; I1526-W1550 HydrophobicContact CG1-CG 3.86Å; I1526-W1550 HydrophobicContact CG2-CD2 4.28Å; I1526-W1550 HydrophobicContact CG2-CE3 3.93Å; I1526-W1550 HydrophobicContact CG2-CH2 4.44Å; I1526-W1550 HydrophobicContact CG2-CZ3 4.06Å; I1526-V1727 HydrophobicContact CB-CG1 4.3Å; I1526-V1727 HydrophobicContact CB-CG2 3.9Å; I1526-V1727 HydrophobicContact CD1-CG1 4Å; I1526-V1727 HydrophobicContact CD1-CG2 4.3Å; I1526-I1732 HydrophobicContact CD1-CG1 3.76Å; I1526-I1735 HydrophobicContact CD1-CD1 4.05Å
1527	T	88.9	Confident	81.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.8	-48.6	179.2	-56.8	0	0	0	0	111.8	L1523 T1524 R1525 G1529 L1531 L1543 I1547 L1618 L1619 L1622	L1523-T1527 WeakPolarHBondContact O-CB 3.27Å; L1523-T1527 PolarHBondContact O-N 3.08Å; L1523-T1527 PolarHBondContact O-OG1 3.23Å; T1524-T1527 PolarHBondContact O-N 3.05Å; R1525-T1527 VanDerWaalsContact C-N 3.33Å; R1525-T1527 PolarHBondContact O-N 3Å; T1527-G1529 VanDerWaalsContact C-N 3.33Å; T1527-G1529 PolarHBondContact O-N 3.28Å; T1527-L1531 HydrophobicContact CG2-CD1 4.35Å; T1527-L1531 WeakPolarHBondContact O-CB 3.44Å; T1527-L1531 VanDerWaalsContact O-CG 3.31Å; T1527-L1531 WeakPolarHBondContact O-CG 3.41Å; T1527-L1531 PolarHBondContact O-N 2.94Å; T1527-L1531 VanDerWaalsContact O-N 3.11Å; T1527-L1543 HydrophobicContact CG2-CD1 4.34Å; T1527-L1543 HydrophobicContact CG2-CD2 4Å; T1527-L1543 HydrophobicContact CG2-CG 4.45Å; T1527-I1547 HydrophobicContact CG2-CD1 4.38Å; T1527-I1547 WeakPolarHBondContact OG1-CD1 3.38Å; T1527-L1618 HydrophobicContact CG2-CD2 3.73Å; T1527-L1618 VanDerWaalsContact OG1-CD2 3.24Å; T1527-L1618 WeakPolarHBondContact OG1-CD2 3.37Å; T1527-L1619 HydrophobicContact CG2-CD2 4.47Å; T1527-L1622 HydrophobicContact CG2-CD1 4.24Å
1528	L	88.8	Confident	81.5	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-66.9	-35.6	175.8	-70	175.4	0	0	0	112.1	V1512 T1524 L1531 T1532 L1622 F1669 V1678	V1512-L1528 HydrophobicContact CG1-CD1 4.02Å; V1512-L1528 HydrophobicContact CG2-CD1 3.91Å; T1524-L1528 HydrophobicContact CG2-CD1 3.94Å; T1524-L1528 HydrophobicContact CG2-CG 4.48Å; T1524-L1528 WeakPolarHBondContact O-CB 3.38Å; T1524-L1528 VanDerWaalsContact O-CG 3.28Å; T1524-L1528 WeakPolarHBondContact O-CG 3.33Å; T1524-L1528 PolarHBondContact O-N 2.78Å; L1528-L1531 PolarHBondContact O-N 3.25Å; L1528-T1532 WeakPolarHBondContact O-CB 3.39Å; L1528-T1532 VanDerWaalsContact O-CG2 3.29Å; L1528-T1532 WeakPolarHBondContact O-CG2 3.29Å; L1528-T1532 PolarHBondContact O-N 2.99Å; L1528-T1532 PolarHBondContact O-OG1 3.21Å; L1528-L1622 HydrophobicContact CD1-CD2 4.27Å; L1528-L1622 HydrophobicContact CD2-CD1 3.92Å; L1528-L1622 HydrophobicContact CD2-CD2 4.01Å; L1528-L1622 HydrophobicContact CD2-CG 4.49Å; L1528-L1622 HydrophobicContact CG-CD1 4.22Å; L1528-L1622 HydrophobicContact CG-CD2 4.37Å; L1528-F1669 HydrophobicContact CD2-CE1 3.95Å; L1528-F1669 HydrophobicContact CD2-CZ 4.15Å; L1528-V1678 HydrophobicContact CB-CG1 3.78Å; L1528-V1678 HydrophobicContact CD1-CG1 4.14Å; L1528-V1678 HydrophobicContact CD2-CG1 3.98Å; L1528-V1678 HydrophobicContact CG-CG1 4.18Å
1529	G	86.7	Confident	81.5	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.6	-49.5	176.5	0	0	0	0	0	112.9	R1525 I1526 T1527 L1531 T1532 C1533	R1525-G1529 WeakPolarHBondContact O-CA 3.37Å; R1525-G1529 PolarHBondContact O-N 3.27Å; I1526-G1529 PolarHBondContact O-N 3.11Å; T1527-G1529 VanDerWaalsContact C-N 3.33Å; T1527-G1529 PolarHBondContact O-N 3.28Å; G1529-L1531 VanDerWaalsContact C-N 3.34Å; G1529-L1531 PolarHBondContact O-N 2.98Å; G1529-T1532 WeakPolarHBondContact CA-OG1 3.35Å; G1529-T1532 PolarHBondContact O-N 3.2Å; G1529-T1532 VanDerWaalsContact O-N 3.12Å; G1529-T1532 PolarHBondContact O-OG1 3.25Å; G1529-T1532 VanDerWaalsContact O-OG1 3.09Å; G1529-C1533 VanDerWaalsContact O-CB 3.29Å; G1529-C1533 WeakPolarHBondContact O-CB 3.3Å; G1529-C1533 PolarHBondContact O-N 3.37Å; G1529-C1533 PolarHBondContact O-SG 3.14Å
1530	L	88.1	Confident	81.5	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-58.8	-45.9	175.5	-71.7	167.3	0	0	0	111.2	I1526 T1532 S1534 L1538 L1543 L1546 I1547 I1732 I1735 L1736	I1526-L1530 HydrophobicContact CD1-CD1 4.38Å; I1526-L1530 HydrophobicContact CD1-CG 4.28Å; I1526-L1530 HydrophobicContact CG1-CD1 3.98Å; I1526-L1530 HydrophobicContact CG1-CG 4.3Å; I1526-L1530 WeakPolarHBondContact O-CB 3.28Å; I1526-L1530 VanDerWaalsContact O-CG 3.26Å; I1526-L1530 WeakPolarHBondContact O-CG 3.41Å; I1526-L1530 PolarHBondContact O-N 2.99Å; L1530-T1532 VanDerWaalsContact C-N 3.33Å; L1530-T1532 PolarHBondContact O-N 3.2Å; L1530-S1534 VanDerWaalsContact O-CB 3.26Å; L1530-S1534 WeakPolarHBondContact O-CB 3.32Å; L1530-S1534 PolarHBondContact O-N 3.13Å; L1530-S1534 VanDerWaalsContact O-N 3.12Å; L1530-S1534 PolarHBondContact O-OG 3.44Å; L1530-S1534 VanDerWaalsContact O-OG 3.12Å; L1530-L1538 HydrophobicContact CB-CD1 4.22Å; L1530-L1543 HydrophobicContact CB-CD1 4.05Å; L1530-L1543 HydrophobicContact CD1-CD1 4.07Å; L1530-L1546 HydrophobicContact CD1-CB 3.76Å; L1530-L1546 HydrophobicContact CD2-CB 4.16Å; L1530-L1546 HydrophobicContact CD2-CD1 4.35Å; L1530-L1546 HydrophobicContact CG-CB 4.5Å; L1530-I1547 HydrophobicContact CD1-CG1 3.93Å; L1530-I1732 HydrophobicContact CD2-CG2 4.24Å; L1530-I1735 HydrophobicContact CD2-CB 4.48Å; L1530-I1735 HydrophobicContact CD2-CG2 4.25Å; L1530-L1736 HydrophobicContact CD2-CD2 3.9Å; L1530-L1736 HydrophobicContact CD2-CG 4Å
1531	L	86.2	Confident	81.2	Confident	13.8 Å²	13.8	28.6 Å²	28.6	7%	0.072	14%	0.143	C	C	.	.	H	α-helix	trans	-67.3	-30.4	178.1	-70.9	171.3	0	0	0	113.6	T1527 L1528 G1529 S1534 L1538 L1543 L1626 L1667 F1669	T1527-L1531 HydrophobicContact CG2-CD1 4.35Å; T1527-L1531 WeakPolarHBondContact O-CB 3.44Å; T1527-L1531 VanDerWaalsContact O-CG 3.31Å; T1527-L1531 WeakPolarHBondContact O-CG 3.41Å; T1527-L1531 PolarHBondContact O-N 2.94Å; T1527-L1531 VanDerWaalsContact O-N 3.11Å; L1528-L1531 PolarHBondContact O-N 3.25Å; G1529-L1531 VanDerWaalsContact C-N 3.34Å; G1529-L1531 PolarHBondContact O-N 2.98Å; L1531-S1534 PolarHBondContact O-OG 3.45Å; L1531-L1538 HydrophobicContact CD2-CB 4.28Å; L1531-L1538 HydrophobicContact CD2-CD1 4.28Å; L1531-L1538 HydrophobicContact CD2-CG 4.45Å; L1531-L1543 HydrophobicContact CD1-CD2 4.32Å; L1531-L1543 HydrophobicContact CD2-CD1 4.46Å; L1531-L1543 HydrophobicContact CD2-CD2 4.4Å; L1531-L1543 HydrophobicContact CG-CD1 4.33Å; L1531-L1543 HydrophobicContact CG-CD2 4.43Å; L1531-L1626 HydrophobicContact CD1-CD1 4.28Å; L1531-L1626 HydrophobicContact CD1-CD2 3.85Å; L1531-L1667 HydrophobicContact CD2-CB 3.8Å; L1531-L1667 HydrophobicContact CD2-CD1 4.22Å; L1531-F1669 HydrophobicContact CB-CE2 3.81Å; L1531-F1669 HydrophobicContact CB-CZ 3.91Å; L1531-F1669 WeakPolarHBondContact O-CE2 3.27Å
1532	T	84.6	Confident	81.1	Confident	8.2 Å²	8.2	30.7 Å²	30.7	5%	0.05	15%	0.149	C	C	.	.	H	α-helix	trans	-83.1	-37.5	179.1	47	0	0	0	0	113.1	L1528 G1529 L1530 F1669 H1675 V1678	L1528-T1532 WeakPolarHBondContact O-CB 3.39Å; L1528-T1532 VanDerWaalsContact O-CG2 3.29Å; L1528-T1532 WeakPolarHBondContact O-CG2 3.29Å; L1528-T1532 PolarHBondContact O-N 2.99Å; L1528-T1532 PolarHBondContact O-OG1 3.21Å; G1529-T1532 WeakPolarHBondContact CA-OG1 3.35Å; G1529-T1532 PolarHBondContact O-N 3.2Å; G1529-T1532 VanDerWaalsContact O-N 3.12Å; G1529-T1532 PolarHBondContact O-OG1 3.25Å; G1529-T1532 VanDerWaalsContact O-OG1 3.09Å; L1530-T1532 VanDerWaalsContact C-N 3.33Å; L1530-T1532 PolarHBondContact O-N 3.2Å; T1532-F1669 HydrophobicContact CG2-CD2 4.46Å; T1532-F1669 HydrophobicContact CG2-CE2 3.51Å; T1532-F1669 VanDerWaalsContact CG2-CE2 3.47Å; T1532-F1669 HydrophobicContact CG2-CZ 3.62Å; T1532-H1675 WeakPolarHBondContact CA-NE2 3.5Å; T1532-H1675 PolarHBondContact O-NE2 3.23Å; T1532-V1678 HydrophobicContact CG2-CB 4.08Å; T1532-V1678 HydrophobicContact CG2-CG1 3.64Å
1533	C	83.6	Confident	81.3	Confident	6.6 Å²	6.6	28.7 Å²	28.7	5%	0.045	14%	0.139	C	C	.	.	H	α-helix	trans	-83	-22.6	-178.4	-70.2	0	0	0	0	113.6	G1529 R1535 L1729 I1732 H1733 L1736 H1749	G1529-C1533 VanDerWaalsContact O-CB 3.29Å; G1529-C1533 WeakPolarHBondContact O-CB 3.3Å; G1529-C1533 PolarHBondContact O-N 3.37Å; G1529-C1533 PolarHBondContact O-SG 3.14Å; C1533-R1535 PolarHBondContact O-N 3.38Å; C1533-L1729 VanDerWaalsContact SG-CD1 3.6Å; C1533-L1729 WeakPolarHBondContact SG-CD1 3.34Å; C1533-I1732 HydrophobicContact CB-CG2 3.69Å; C1533-H1733 PolarHBondContact SG-NE2 3.44Å; C1533-L1736 HydrophobicContact CB-CD1 3.79Å; C1533-H1749 PolarHBondContact O-CE1 3.13Å
1534	S	79.7	Confident	81.3	Confident	14.8 Å²	14.8	28.3 Å²	28.3	10%	0.103	14%	0.137	C	C	.	.			trans	-67	128.8	175.7	172.6	0	0	0	0	111.5	L1530 L1531 Q1536 L1538	L1530-S1534 VanDerWaalsContact O-CB 3.26Å; L1530-S1534 WeakPolarHBondContact O-CB 3.32Å; L1530-S1534 PolarHBondContact O-N 3.13Å; L1530-S1534 VanDerWaalsContact O-N 3.12Å; L1530-S1534 PolarHBondContact O-OG 3.44Å; L1530-S1534 VanDerWaalsContact O-OG 3.12Å; L1531-S1534 PolarHBondContact O-OG 3.45Å; S1534-Q1536 VanDerWaalsContact C-N 3.28Å; S1534-Q1536 WeakPolarHBondContact CB-O 3.38Å; S1534-Q1536 PolarHBondContact O-N 3.37Å; S1534-Q1536 PolarHBondContact OG-N 3Å; S1534-Q1536 PolarHBondContact OG-O 3.03Å; S1534-L1538 WeakPolarHBondContact OG-CD2 3.17Å
1535	R	72.6	Confident	81.1	Confident	120.4 Å²	120.4	31.6 Å²	31.6	45%	0.454	16%	0.155	S	C	.	.	S	Bend	trans	-77.4	-16.4	176.5	-68.1	-176.4	70.2	-176.5	9.4	113.1	C1533 D1745 Y1748	C1533-R1535 PolarHBondContact O-N 3.38Å; R1535-D1745 VanDerWaalsContact CD-OD1 3.27Å; R1535-D1745 WeakPolarHBondContact CD-OD1 3.39Å; R1535-D1745 IonicContact CZ-OD1 3.17Å; R1535-D1745 IonicContact NE-OD1 3.3Å; R1535-D1745 PolarHBondContact NE-OD1 3.04Å; R1535-D1745 IonicContact NH1-OD1 3.58Å; R1535-D1745 PolarHBondContact NH1-OD1 3.13Å; R1535-Y1748 HydrophobicContact CG-CD1 4.27Å; R1535-Y1748 HydrophobicContact CG-CE1 4.04Å
1536	Q	69.2	Low	81.1	Confident	84.8 Å²	84.8	29.5 Å²	29.5	40%	0.396	15%	0.147	S	C	.	.	S	Bend	trans	-118.3	145.8	176.1	-63.6	-177.6	1.3	0	0	109.6	S1534 L1538 N1742 D1745	S1534-Q1536 VanDerWaalsContact C-N 3.28Å; S1534-Q1536 WeakPolarHBondContact CB-O 3.38Å; S1534-Q1536 PolarHBondContact O-N 3.37Å; S1534-Q1536 PolarHBondContact OG-N 3Å; S1534-Q1536 PolarHBondContact OG-O 3.03Å; Q1536-L1538 PolarHBondContact O-N 3.16Å; Q1536-N1742 VanDerWaalsContact CD-ND2 3.29Å; Q1536-N1742 PolarHBondContact NE2-ND2 3.05Å; Q1536-N1742 VanDerWaalsContact NE2-ND2 3.13Å; Q1536-N1742 PolarHBondContact OE1-ND2 2.93Å; Q1536-N1742 VanDerWaalsContact OE1-ND2 3.14Å; Q1536-D1745 PolarHBondContact NE2-OD2 3.43Å
1537	P	69.3	Low	81.1	Confident	59.4 Å²	59.4	29.5 Å²	29.5	39%	0.386	15%	0.147	S	C	.	.	P	Polyproline II helix	trans	-65.5	128.6	177.1	29.9	-34.6	0	0	0	109.6	A1666 L1667	P1537-A1666 HydrophobicContact CB-CB 3.74Å; P1537-A1666 HydrophobicContact CG-CB 3.84Å; P1537-L1667 WeakPolarHBondContact CA-O 3.47Å; P1537-L1667 VanDerWaalsContact CB-O 3.22Å; P1537-L1667 WeakPolarHBondContact CB-O 3.34Å
1538	L	76	Confident	80.8	Confident	3.4 Å²	3.4	29.9 Å²	29.9	2%	0.018	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	135.1	-174.6	-63.2	175.2	0	0	0	110.3	L1530 L1531 S1534 Q1536 E1542 L1543 L1546 A1666 L1667 L1740	L1530-L1538 HydrophobicContact CB-CD1 4.22Å; L1531-L1538 HydrophobicContact CD2-CB 4.28Å; L1531-L1538 HydrophobicContact CD2-CD1 4.28Å; L1531-L1538 HydrophobicContact CD2-CG 4.45Å; S1534-L1538 WeakPolarHBondContact OG-CD2 3.17Å; Q1536-L1538 PolarHBondContact O-N 3.16Å; L1538-E1542 HydrophobicContact CD2-CB 4.49Å; L1538-L1543 HydrophobicContact CB-CB 4.48Å; L1538-L1543 HydrophobicContact CD1-CD1 4.28Å; L1538-L1546 HydrophobicContact CD1-CD1 3.92Å; L1538-L1546 HydrophobicContact CD2-CD1 4.14Å; L1538-L1546 HydrophobicContact CG-CD1 4.5Å; L1538-A1666 CarbonylContact O-C 3.55Å; L1538-A1666 WeakPolarHBondContact O-CA 3.37Å; L1538-L1667 PolarHBondContact N-O 2.89Å; L1538-L1667 VanDerWaalsContact O-CB 3.3Å; L1538-L1667 WeakPolarHBondContact O-CB 3.44Å; L1538-L1667 PolarHBondContact O-N 3.23Å; L1538-L1740 HydrophobicContact CD2-CD1 3.49Å; L1538-L1740 VanDerWaalsContact CD2-CD1 3.45Å; L1538-L1740 HydrophobicContact CD2-CD2 4.02Å; L1538-L1740 HydrophobicContact CD2-CG 4.08Å
1539	S	74.5	Confident	80.4	Confident	19.8 Å²	19.8	31.6 Å²	31.6	14%	0.138	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	159.3	168.3	64.8	0	0	0	0	111.6	E1541 E1542 L1543 S1664 R1665	S1539-E1541 PolarHBondContact O-N 3.24Å; S1539-E1542 WeakPolarHBondContact CB-OE2 3.43Å; S1539-E1542 PolarHBondContact N-OE2 3.09Å; S1539-E1542 PolarHBondContact O-N 3.2Å; S1539-E1542 VanDerWaalsContact OG-CB 3.28Å; S1539-E1542 WeakPolarHBondContact OG-CB 3.42Å; S1539-E1542 VanDerWaalsContact OG-CD 3.24Å; S1539-E1542 VanDerWaalsContact OG-CG 3.28Å; S1539-E1542 WeakPolarHBondContact OG-CG 3.4Å; S1539-E1542 PolarHBondContact OG-N 3.04Å; S1539-E1542 VanDerWaalsContact OG-N 3.12Å; S1539-E1542 PolarHBondContact OG-OE2 3.07Å; S1539-L1543 WeakPolarHBondContact O-CB 3.42Å; S1539-L1543 PolarHBondContact O-N 3.31Å; S1539-S1664 WeakPolarHBondContact CB-O 3.45Å; S1539-R1665 VanDerWaalsContact CA-O 3.27Å; S1539-R1665 WeakPolarHBondContact CA-O 3.33Å
1540	T	76.6	Confident	80.3	Confident	20.2 Å²	20.2	31.6 Å²	31.6	12%	0.124	16%	0.157	C	C	.	.	H	α-helix	trans	-60	-33.7	175.3	60.5	0	0	0	0	112.2	H1544 L1619 F1629 L1662 G1663 R1665 L1667	T1540-H1544 WeakPolarHBondContact O-CB 3.37Å; T1540-H1544 PolarHBondContact O-N 3.1Å; T1540-H1544 VanDerWaalsContact O-N 3.09Å; T1540-L1619 HydrophobicContact CG2-CD1 4.42Å; T1540-F1629 HydrophobicContact CG2-CD2 4.36Å; T1540-L1662 HydrophobicContact CG2-CD2 4.41Å; T1540-L1662 WeakPolarHBondContact OG1-CA 3.42Å; T1540-L1662 PolarHBondContact OG1-O 3.34Å; T1540-G1663 PolarHBondContact OG1-N 3Å; T1540-G1663 PolarHBondContact OG1-O 3.14Å; T1540-R1665 PolarHBondContact N-O 3.41Å; T1540-L1667 HydrophobicContact CG2-CD1 3.95Å; T1540-L1667 HydrophobicContact CG2-CD2 4.08Å; T1540-L1667 HydrophobicContact CG2-CG 4.01Å
1541	E	74.2	Confident	80	Confident	103.8 Å²	103.8	32.7 Å²	32.7	49%	0.485	16%	0.163	S	C	.	.	H	α-helix	trans	-71.2	-45.1	177.1	-134.4	-179.5	-175.1	0	0	111.8	S1539 L1543 H1544 N1545 R1665	S1539-E1541 PolarHBondContact O-N 3.24Å; E1541-L1543 VanDerWaalsContact C-N 3.34Å; E1541-L1543 PolarHBondContact O-N 2.85Å; E1541-H1544 WeakPolarHBondContact O-CB 3.47Å; E1541-H1544 PolarHBondContact O-N 3.33Å; E1541-N1545 WeakPolarHBondContact O-CB 3.38Å; E1541-N1545 VanDerWaalsContact O-CG 3.26Å; E1541-N1545 PolarHBondContact O-N 2.98Å; E1541-N1545 PolarHBondContact O-ND2 2.94Å; E1541-N1545 VanDerWaalsContact O-ND2 3.16Å; E1541-R1665 IonicContact OE1-NH1 3.27Å
1542	E	79.1	Confident	79.6	Confident	80.2 Å²	80.2	32.8 Å²	32.8	38%	0.375	16%	0.163	S	C	.	.	H	α-helix	trans	-62.2	-44.1	174.7	-73.9	162.6	152.5	0	0	111.4	L1538 S1539 H1544 N1545 L1546	L1538-E1542 HydrophobicContact CD2-CB 4.49Å; S1539-E1542 WeakPolarHBondContact CB-OE2 3.43Å; S1539-E1542 PolarHBondContact N-OE2 3.09Å; S1539-E1542 PolarHBondContact O-N 3.2Å; S1539-E1542 VanDerWaalsContact OG-CB 3.28Å; S1539-E1542 WeakPolarHBondContact OG-CB 3.42Å; S1539-E1542 VanDerWaalsContact OG-CD 3.24Å; S1539-E1542 VanDerWaalsContact OG-CG 3.28Å; S1539-E1542 WeakPolarHBondContact OG-CG 3.4Å; S1539-E1542 PolarHBondContact OG-N 3.04Å; S1539-E1542 VanDerWaalsContact OG-N 3.12Å; S1539-E1542 PolarHBondContact OG-OE2 3.07Å; E1542-H1544 VanDerWaalsContact C-N 3.3Å; E1542-H1544 PolarHBondContact O-N 3.1Å; E1542-N1545 PolarHBondContact O-N 3.08Å; E1542-L1546 WeakPolarHBondContact O-CB 3.43Å; E1542-L1546 WeakPolarHBondContact O-CD1 3.36Å; E1542-L1546 VanDerWaalsContact O-CG 3.23Å; E1542-L1546 WeakPolarHBondContact O-CG 3.29Å; E1542-L1546 PolarHBondContact O-N 3.23Å
1543	L	85.2	Confident	79	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.1	-41.9	176	-179.5	64.5	0	0	0	111.5	T1527 L1530 L1531 L1538 S1539 E1541 L1546 I1547 L1619 L1667	T1527-L1543 HydrophobicContact CG2-CD1 4.34Å; T1527-L1543 HydrophobicContact CG2-CD2 4Å; T1527-L1543 HydrophobicContact CG2-CG 4.45Å; L1530-L1543 HydrophobicContact CB-CD1 4.05Å; L1530-L1543 HydrophobicContact CD1-CD1 4.07Å; L1531-L1543 HydrophobicContact CD1-CD2 4.32Å; L1531-L1543 HydrophobicContact CD2-CD1 4.46Å; L1531-L1543 HydrophobicContact CD2-CD2 4.4Å; L1531-L1543 HydrophobicContact CG-CD1 4.33Å; L1531-L1543 HydrophobicContact CG-CD2 4.43Å; L1538-L1543 HydrophobicContact CB-CB 4.48Å; L1538-L1543 HydrophobicContact CD1-CD1 4.28Å; S1539-L1543 WeakPolarHBondContact O-CB 3.42Å; S1539-L1543 PolarHBondContact O-N 3.31Å; E1541-L1543 VanDerWaalsContact C-N 3.34Å; E1541-L1543 PolarHBondContact O-N 2.85Å; L1543-L1546 PolarHBondContact O-N 3.1Å; L1543-I1547 HydrophobicContact CD1-CD1 4.11Å; L1543-I1547 HydrophobicContact CD1-CG1 4.43Å; L1543-I1547 HydrophobicContact CG-CD1 3.95Å; L1543-I1547 WeakPolarHBondContact O-CD1 3.28Å; L1543-I1547 VanDerWaalsContact O-CG1 3.27Å; L1543-I1547 WeakPolarHBondContact O-CG1 3.27Å; L1543-I1547 PolarHBondContact O-N 3.2Å; L1543-I1547 VanDerWaalsContact O-N 3.07Å; L1543-L1619 HydrophobicContact CD2-CD2 4.04Å; L1543-L1667 HydrophobicContact CB-CD1 4.39Å; L1543-L1667 HydrophobicContact CD2-CD1 3.44Å; L1543-L1667 VanDerWaalsContact CD2-CD1 3.45Å
1544	H	84.8	Confident	78.5	Confident	10.2 Å²	10.2	34 Å²	34	5%	0.047	17%	0.168	C	C	.	.	H	α-helix	trans	-61.1	-49.8	176.2	-163.1	169.4	0	0	0	111	T1540 E1541 E1542 L1546 I1547 D1548 H1609 L1610 S1612 L1615	T1540-H1544 WeakPolarHBondContact O-CB 3.37Å; T1540-H1544 PolarHBondContact O-N 3.1Å; T1540-H1544 VanDerWaalsContact O-N 3.09Å; E1541-H1544 WeakPolarHBondContact O-CB 3.47Å; E1541-H1544 PolarHBondContact O-N 3.33Å; E1542-H1544 VanDerWaalsContact C-N 3.3Å; E1542-H1544 PolarHBondContact O-N 3.1Å; H1544-L1546 VanDerWaalsContact C-N 3.31Å; H1544-L1546 PolarHBondContact O-N 3.24Å; H1544-I1547 PolarHBondContact O-N 2.96Å; H1544-I1547 VanDerWaalsContact O-N 3.15Å; H1544-D1548 IonicContact CD2-OD1 3.37Å; H1544-D1548 IonicContact CD2-OD2 3.19Å; H1544-D1548 PolarHBondContact CD2-OD2 3.09Å; H1544-D1548 IonicContact NE2-OD1 2.77Å; H1544-D1548 IonicContact NE2-OD2 3.28Å; H1544-D1548 PolarHBondContact NE2-OD2 2.97Å; H1544-D1548 PolarHBondContact O-N 3.17Å; H1544-H1609 AromaticContact CE1-CE1 3.37Å; H1544-H1609 PolarHBondContact CE1-CE1 3.16Å; H1544-H1609 VanDerWaalsContact CE1-CE1 3.44Å; H1544-H1609 AromaticContact CE1-NE2 3.87Å; H1544-H1609 AromaticContact NE2-CE1 3.15Å; H1544-H1609 PolarHBondContact NE2-CE1 3.22Å; H1544-H1609 AromaticContact NE2-ND1 3.73Å; H1544-H1609 AromaticContact NE2-NE2 3.85Å; H1544-L1610 PolarHBondContact CE1-O 3.09Å; H1544-L1610 VanDerWaalsContact CE1-O 3.27Å; H1544-L1610 PolarHBondContact NE2-O 3.25Å; H1544-S1612 PolarHBondContact CE1-OG 3.34Å; H1544-L1615 HydrophobicContact CB-CD2 3.6Å; H1544-L1615 VanDerWaalsContact CG-CD2 3.48Å
1545	N	82.1	Confident	78.1	Confident	68.6 Å²	68.6	37.1 Å²	37.1	37%	0.367	18%	0.177	S	C	.	.	H	α-helix	trans	-60.2	-39.8	179	-67.3	-31.3	0	0	0	112.2	E1541 E1542 I1547 D1548 E1549	E1541-N1545 WeakPolarHBondContact O-CB 3.38Å; E1541-N1545 VanDerWaalsContact O-CG 3.26Å; E1541-N1545 PolarHBondContact O-N 2.98Å; E1541-N1545 PolarHBondContact O-ND2 2.94Å; E1541-N1545 VanDerWaalsContact O-ND2 3.16Å; E1542-N1545 PolarHBondContact O-N 3.08Å; N1545-I1547 VanDerWaalsContact C-N 3.33Å; N1545-I1547 PolarHBondContact O-N 3.38Å; N1545-D1548 PolarHBondContact O-N 2.97Å; N1545-E1549 VanDerWaalsContact O-CG 3.25Å; N1545-E1549 WeakPolarHBondContact O-CG 3.28Å; N1545-E1549 PolarHBondContact O-N 3.04Å
1546	L	86.1	Confident	77.7	Confident	5 Å²	5	33.3 Å²	33.3	3%	0.026	17%	0.165	C	C	.	.	H	α-helix	trans	-67.7	-34.9	177.6	-67.5	164.1	0	0	0	112.5	L1530 L1538 E1542 L1543 H1544 E1549 W1550 I1735 L1736 K1739 L1740	L1530-L1546 HydrophobicContact CD1-CB 3.76Å; L1530-L1546 HydrophobicContact CD2-CB 4.16Å; L1530-L1546 HydrophobicContact CD2-CD1 4.35Å; L1530-L1546 HydrophobicContact CG-CB 4.5Å; L1538-L1546 HydrophobicContact CD1-CD1 3.92Å; L1538-L1546 HydrophobicContact CD2-CD1 4.14Å; L1538-L1546 HydrophobicContact CG-CD1 4.5Å; E1542-L1546 WeakPolarHBondContact O-CB 3.43Å; E1542-L1546 WeakPolarHBondContact O-CD1 3.36Å; E1542-L1546 VanDerWaalsContact O-CG 3.23Å; E1542-L1546 WeakPolarHBondContact O-CG 3.29Å; E1542-L1546 PolarHBondContact O-N 3.23Å; L1543-L1546 PolarHBondContact O-N 3.1Å; H1544-L1546 VanDerWaalsContact C-N 3.31Å; H1544-L1546 PolarHBondContact O-N 3.24Å; L1546-E1549 PolarHBondContact O-N 3.16Å; L1546-W1550 PolarHBondContact O-N 3.18Å; L1546-W1550 VanDerWaalsContact O-N 3.09Å; L1546-I1735 HydrophobicContact CB-CG2 4.21Å; L1546-I1735 HydrophobicContact CD2-CG2 3.85Å; L1546-L1736 HydrophobicContact CD1-CD2 4.09Å; L1546-L1736 HydrophobicContact CD2-CD2 4.48Å; L1546-K1739 HydrophobicContact CD2-CB 4.04Å; L1546-L1740 HydrophobicContact CD1-CD1 3.89Å; L1546-L1740 VanDerWaalsContact CD1-CD1 3.45Å; L1546-L1740 HydrophobicContact CD2-CB 4.49Å; L1546-L1740 HydrophobicContact CD2-CD1 4.03Å; L1546-L1740 HydrophobicContact CG-CD1 4.19Å
1547	I	86.1	Confident	77.4	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-71.8	-40.6	175.1	-65.5	164.3	0	0	0	110.7	L1523 T1527 L1530 L1543 H1544 N1545 E1549 W1550 L1551 L1610 L1615	L1523-I1547 HydrophobicContact CD1-CG2 3.85Å; T1527-I1547 HydrophobicContact CG2-CD1 4.38Å; T1527-I1547 WeakPolarHBondContact OG1-CD1 3.38Å; L1530-I1547 HydrophobicContact CD1-CG1 3.93Å; L1543-I1547 HydrophobicContact CD1-CD1 4.11Å; L1543-I1547 HydrophobicContact CD1-CG1 4.43Å; L1543-I1547 HydrophobicContact CG-CD1 3.95Å; L1543-I1547 WeakPolarHBondContact O-CD1 3.28Å; L1543-I1547 VanDerWaalsContact O-CG1 3.27Å; L1543-I1547 WeakPolarHBondContact O-CG1 3.27Å; L1543-I1547 PolarHBondContact O-N 3.2Å; L1543-I1547 VanDerWaalsContact O-N 3.07Å; H1544-I1547 PolarHBondContact O-N 2.96Å; H1544-I1547 VanDerWaalsContact O-N 3.15Å; N1545-I1547 VanDerWaalsContact C-N 3.33Å; N1545-I1547 PolarHBondContact O-N 3.38Å; I1547-E1549 VanDerWaalsContact C-N 3.29Å; I1547-E1549 PolarHBondContact O-N 3.08Å; I1547-W1550 WeakPolarHBondContact O-CB 3.12Å; I1547-W1550 PolarHBondContact O-N 3.24Å; I1547-L1551 HydrophobicContact CG2-CD1 4.43Å; I1547-L1551 WeakPolarHBondContact O-CG 3.35Å; I1547-L1551 PolarHBondContact O-N 3.27Å; I1547-L1610 HydrophobicContact CG2-CB 4.5Å; I1547-L1610 HydrophobicContact CG2-CD2 3.94Å; I1547-L1615 HydrophobicContact CD1-CD1 3.97Å
1548	D	83.6	Confident	76.9	Confident	7.8 Å²	7.8	35.4 Å²	35.4	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-59.7	-42.1	174.1	-74.3	-19.5	0	0	0	111.2	H1544 N1545 W1550 L1551 I1552 H1609 L1610 K1653	H1544-D1548 IonicContact CD2-OD1 3.37Å; H1544-D1548 IonicContact CD2-OD2 3.19Å; H1544-D1548 PolarHBondContact CD2-OD2 3.09Å; H1544-D1548 IonicContact NE2-OD1 2.77Å; H1544-D1548 IonicContact NE2-OD2 3.28Å; H1544-D1548 PolarHBondContact NE2-OD2 2.97Å; H1544-D1548 PolarHBondContact O-N 3.17Å; N1545-D1548 PolarHBondContact O-N 2.97Å; D1548-W1550 VanDerWaalsContact C-N 3.31Å; D1548-W1550 PolarHBondContact O-N 2.99Å; D1548-L1551 CarbonylContact O-C 3.41Å; D1548-L1551 WeakPolarHBondContact O-CB 3.29Å; D1548-L1551 PolarHBondContact O-N 3.16Å; D1548-L1551 VanDerWaalsContact O-N 3.13Å; D1548-I1552 VanDerWaalsContact O-CG1 3.27Å; D1548-I1552 WeakPolarHBondContact O-CG1 3.4Å; D1548-I1552 PolarHBondContact O-N 3.09Å; D1548-H1609 VanDerWaalsContact CG-ND1 3.3Å; D1548-H1609 WeakPolarHBondContact OD1-CA 3.48Å; D1548-H1609 IonicContact OD1-CE1 3.28Å; D1548-H1609 IonicContact OD1-CG 3.38Å; D1548-H1609 IonicContact OD1-ND1 3.37Å; D1548-H1609 PolarHBondContact OD1-ND1 3.05Å; D1548-H1609 IonicContact OD2-CE1 3.47Å; D1548-H1609 PolarHBondContact OD2-CE1 2.9Å; D1548-H1609 VanDerWaalsContact OD2-CE1 3.23Å; D1548-H1609 IonicContact OD2-CG 2.84Å; D1548-H1609 IonicContact OD2-ND1 3.49Å; D1548-H1609 PolarHBondContact OD2-ND1 3.16Å; D1548-L1610 WeakPolarHBondContact OD1-CB 3.25Å; D1548-L1610 PolarHBondContact OD1-N 3.2Å; D1548-K1653 IonicContact OD2-NZ 3.9Å; D1548-K1653 PolarHBondContact OD2-NZ 2.88Å
1549	E	80.6	Confident	75.9	Confident	36 Å²	36	40.7 Å²	40.7	17%	0.168	19%	0.194	C	C	.	.	H	α-helix	trans	-64.1	-39.5	176.7	-104.9	-41.6	-177.9	0	0	112.2	N1545 L1546 I1547 L1551 I1552 E1553 K1739	N1545-E1549 VanDerWaalsContact O-CG 3.25Å; N1545-E1549 WeakPolarHBondContact O-CG 3.28Å; N1545-E1549 PolarHBondContact O-N 3.04Å; L1546-E1549 PolarHBondContact O-N 3.16Å; I1547-E1549 VanDerWaalsContact C-N 3.29Å; I1547-E1549 PolarHBondContact O-N 3.08Å; E1549-L1551 VanDerWaalsContact C-N 3.3Å; E1549-L1551 PolarHBondContact O-N 3.13Å; E1549-I1552 CarbonylContact O-C 3.58Å; E1549-I1552 PolarHBondContact O-N 3.15Å; E1549-I1552 VanDerWaalsContact O-N 3.14Å; E1549-E1553 PolarHBondContact O-N 3.29Å; E1549-K1739 HydrophobicContact CB-CG 4.31Å; E1549-K1739 HydrophobicContact CG-CB 4.45Å; E1549-K1739 HydrophobicContact CG-CD 4.25Å; E1549-K1739 VanDerWaalsContact CG-CE 3.47Å; E1549-K1739 HydrophobicContact CG-CG 3.93Å; E1549-K1739 WeakPolarHBondContact OE1-CD 3.38Å; E1549-K1739 WeakPolarHBondContact OE1-CE 3.27Å; E1549-K1739 IonicContact OE1-NZ 3.22Å; E1549-K1739 PolarHBondContact OE1-NZ 3.27Å; E1549-K1739 VanDerWaalsContact OE2-CE 3.27Å; E1549-K1739 WeakPolarHBondContact OE2-CE 3.34Å; E1549-K1739 IonicContact OE2-NZ 2.78Å; E1549-K1739 PolarHBondContact OE2-NZ 3.1Å
1550	W	84.4	Confident	75	Confident	1.6 Å²	1.6	46 Å²	46	1%	0.006	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-38.1	172.5	173.6	69	0	0	0	112.7	E1522 I1526 L1546 I1547 D1548 I1552 S1554 L1724 K1725 V1727 I1735	E1522-W1550 HydrophobicContact CB-CH2 3.85Å; E1522-W1550 HydrophobicContact CB-CZ2 4.12Å; I1526-W1550 HydrophobicContact CB-CD2 4.3Å; I1526-W1550 HydrophobicContact CB-CE3 4.45Å; I1526-W1550 HydrophobicContact CD1-CB 4.38Å; I1526-W1550 HydrophobicContact CD1-CD2 4.39Å; I1526-W1550 HydrophobicContact CD1-CG 4Å; I1526-W1550 HydrophobicContact CG1-CB 4.2Å; I1526-W1550 HydrophobicContact CG1-CD2 3.94Å; I1526-W1550 HydrophobicContact CG1-CE3 4.35Å; I1526-W1550 HydrophobicContact CG1-CG 3.86Å; I1526-W1550 HydrophobicContact CG2-CD2 4.28Å; I1526-W1550 HydrophobicContact CG2-CE3 3.93Å; I1526-W1550 HydrophobicContact CG2-CH2 4.44Å; I1526-W1550 HydrophobicContact CG2-CZ3 4.06Å; L1546-W1550 PolarHBondContact O-N 3.18Å; L1546-W1550 VanDerWaalsContact O-N 3.09Å; I1547-W1550 WeakPolarHBondContact O-CB 3.12Å; I1547-W1550 PolarHBondContact O-N 3.24Å; D1548-W1550 VanDerWaalsContact C-N 3.31Å; D1548-W1550 PolarHBondContact O-N 2.99Å; W1550-I1552 VanDerWaalsContact C-N 3.34Å; W1550-S1554 WeakPolarHBondContact O-CB 3.29Å; W1550-S1554 PolarHBondContact O-N 3.06Å; W1550-S1554 PolarHBondContact O-OG 3.18Å; W1550-L1724 HydrophobicContact CH2-CB 4.3Å; W1550-L1724 HydrophobicContact CH2-CD1 4.04Å; W1550-L1724 HydrophobicContact CH2-CD2 4.26Å; W1550-L1724 HydrophobicContact CH2-CG 4.39Å; W1550-L1724 HydrophobicContact CZ2-CB 4.28Å; W1550-L1724 HydrophobicContact CZ3-CD2 4.42Å; W1550-K1725 PolarHBondContact NE1-O 3.16Å; W1550-V1727 HydrophobicContact CZ2-CG2 3.84Å; W1550-I1735 HydrophobicContact CB-CD1 3.74Å; W1550-I1735 HydrophobicContact CG-CD1 4.1Å
1551	L	81.9	Confident	73.7	Confident	22 Å²	22	54.3 Å²	54.3	12%	0.115	25%	0.247	C	C	.	.	H	α-helix	trans	-65.9	-39.9	174.2	-70.8	171.2	0	0	0	111.3	I1547 D1548 E1549 S1554 W1555 P1608 L1610 L1724	I1547-L1551 HydrophobicContact CG2-CD1 4.43Å; I1547-L1551 WeakPolarHBondContact O-CG 3.35Å; I1547-L1551 PolarHBondContact O-N 3.27Å; D1548-L1551 CarbonylContact O-C 3.41Å; D1548-L1551 WeakPolarHBondContact O-CB 3.29Å; D1548-L1551 PolarHBondContact O-N 3.16Å; D1548-L1551 VanDerWaalsContact O-N 3.13Å; E1549-L1551 VanDerWaalsContact C-N 3.3Å; E1549-L1551 PolarHBondContact O-N 3.13Å; L1551-S1554 PolarHBondContact O-N 2.87Å; L1551-W1555 VanDerWaalsContact O-CB 3.27Å; L1551-W1555 WeakPolarHBondContact O-CB 3.32Å; L1551-W1555 PolarHBondContact O-N 2.94Å; L1551-P1608 HydrophobicContact CB-CB 4.25Å; L1551-P1608 HydrophobicContact CB-CG 4.32Å; L1551-L1610 HydrophobicContact CD1-CB 4.04Å; L1551-L1724 HydrophobicContact CD2-CD2 4.2Å
1552	I	76.8	Confident	72.1	Confident	16.2 Å²	16.2	56.6 Å²	56.6	8%	0.083	26%	0.262	C	S	.	.	H	α-helix	trans	-65.8	-48.5	176.1	-67	163.7	0	0	0	110.7	D1548 E1549 W1550 S1554 W1555 M1556 Q1607 P1608	D1548-I1552 VanDerWaalsContact O-CG1 3.27Å; D1548-I1552 WeakPolarHBondContact O-CG1 3.4Å; D1548-I1552 PolarHBondContact O-N 3.09Å; E1549-I1552 CarbonylContact O-C 3.58Å; E1549-I1552 PolarHBondContact O-N 3.15Å; E1549-I1552 VanDerWaalsContact O-N 3.14Å; W1550-I1552 VanDerWaalsContact C-N 3.34Å; I1552-S1554 VanDerWaalsContact C-N 3.31Å; I1552-S1554 PolarHBondContact O-N 3Å; I1552-W1555 CarbonylContact O-C 3.59Å; I1552-W1555 WeakPolarHBondContact O-CB 3.39Å; I1552-W1555 PolarHBondContact O-N 3.14Å; I1552-W1555 VanDerWaalsContact O-N 3.11Å; I1552-M1556 HydrophobicContact CG2-CE 4.16Å; I1552-M1556 HydrophobicContact CG2-CG 4.13Å; I1552-M1556 HydrophobicContact CG2-SD 3.97Å; I1552-M1556 WeakPolarHBondContact O-CB 3.34Å; I1552-M1556 WeakPolarHBondContact O-CG 3.29Å; I1552-M1556 PolarHBondContact O-N 3.02Å; I1552-Q1607 HydrophobicContact CD1-CB 4.39Å; I1552-Q1607 HydrophobicContact CG1-CB 4.39Å; I1552-P1608 HydrophobicContact CB-CG 4.45Å; I1552-P1608 HydrophobicContact CG1-CG 3.92Å
1553	E	73	Confident	70.5	Confident	36.2 Å²	36.2	55.9 Å²	55.9	17%	0.169	28%	0.277	C	S	.	.	H	α-helix	trans	-56.9	-45.7	175.9	-81.7	-165.4	-168.5	0	0	111.4	E1549 W1555 M1556 E1557 K1725 N1734	E1549-E1553 PolarHBondContact O-N 3.29Å; E1553-W1555 VanDerWaalsContact C-N 3.31Å; E1553-W1555 PolarHBondContact O-N 3.35Å; E1553-M1556 PolarHBondContact O-N 3.09Å; E1553-E1557 PolarHBondContact O-N 3.21Å; E1553-K1725 HydrophobicContact CB-CD 4.46Å; E1553-K1725 IonicContact OE2-NZ 3.19Å; E1553-K1725 PolarHBondContact OE2-NZ 3.19Å; E1553-N1734 PolarHBondContact OE1-ND2 2.9Å
1554	S	73.5	Confident	68.6	Low	2.8 Å²	2.8	62.3 Å²	62.3	2%	0.02	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-38.5	178.3	-60.6	0	0	0	0	112.1	W1550 L1551 I1552 K1725	W1550-S1554 WeakPolarHBondContact O-CB 3.29Å; W1550-S1554 PolarHBondContact O-N 3.06Å; W1550-S1554 PolarHBondContact O-OG 3.18Å; L1551-S1554 PolarHBondContact O-N 2.87Å; I1552-S1554 VanDerWaalsContact C-N 3.31Å; I1552-S1554 PolarHBondContact O-N 3Å; S1554-K1725 VanDerWaalsContact OG-CB 3.31Å; S1554-K1725 WeakPolarHBondContact OG-CB 3.43Å; S1554-K1725 PolarHBondContact OG-N 3.15Å
1555	W	70.3	Confident	67	Low	80.4 Å²	80.4	66.3 Å²	66.3	31%	0.305	33%	0.328	S	S	.	.	H	α-helix	trans	-74.7	-36.5	178.9	-178.7	79.6	0	0	0	112.9	L1551 I1552 E1553 E1558 Q1559 P1608	L1551-W1555 VanDerWaalsContact O-CB 3.27Å; L1551-W1555 WeakPolarHBondContact O-CB 3.32Å; L1551-W1555 PolarHBondContact O-N 2.94Å; I1552-W1555 CarbonylContact O-C 3.59Å; I1552-W1555 WeakPolarHBondContact O-CB 3.39Å; I1552-W1555 PolarHBondContact O-N 3.14Å; I1552-W1555 VanDerWaalsContact O-N 3.11Å; E1553-W1555 VanDerWaalsContact C-N 3.31Å; E1553-W1555 PolarHBondContact O-N 3.35Å; W1555-E1558 PolarHBondContact O-N 3.42Å; W1555-Q1559 HydrophobicContact CD2-CG 4.27Å; W1555-Q1559 HydrophobicContact CH2-CG 4.33Å; W1555-Q1559 HydrophobicContact CZ2-CG 3.98Å; W1555-Q1559 HydrophobicContact CZ3-CG 4.48Å; W1555-Q1559 VanDerWaalsContact O-CG 3.26Å; W1555-Q1559 WeakPolarHBondContact O-CG 3.28Å; W1555-Q1559 PolarHBondContact O-N 3.26Å; W1555-Q1559 VanDerWaalsContact O-N 3.14Å; W1555-P1608 HydrophobicContact CB-CG 3.87Å; W1555-P1608 HydrophobicContact CD2-CG 4.44Å; W1555-P1608 HydrophobicContact CG-CG 4.11Å
1556	M	63.9	Low	65.9	Low	41 Å²	41	64.1 Å²	64.1	20%	0.202	32%	0.316	C	S	.	.	H	α-helix	trans	-71.9	-35.5	-179.9	-71.8	-151.6	98.6	0	0	112.9	I1552 E1553 E1558 Q1559 Y1560 Y1564	I1552-M1556 HydrophobicContact CG2-CE 4.16Å; I1552-M1556 HydrophobicContact CG2-CG 4.13Å; I1552-M1556 HydrophobicContact CG2-SD 3.97Å; I1552-M1556 WeakPolarHBondContact O-CB 3.34Å; I1552-M1556 WeakPolarHBondContact O-CG 3.29Å; I1552-M1556 PolarHBondContact O-N 3.02Å; E1553-M1556 PolarHBondContact O-N 3.09Å; M1556-E1558 VanDerWaalsContact C-N 3.26Å; M1556-E1558 PolarHBondContact O-N 3.16Å; M1556-Q1559 PolarHBondContact O-N 3.25Å; M1556-Y1560 HydrophobicContact CE-CD2 4.17Å; M1556-Y1560 HydrophobicContact CE-CE2 4.13Å; M1556-Y1560 WeakPolarHBondContact O-CA 3.35Å; M1556-Y1560 WeakPolarHBondContact O-CB 3.17Å; M1556-Y1560 PolarHBondContact O-N 2.9Å; M1556-Y1560 VanDerWaalsContact O-N 3.09Å; M1556-Y1560 HydrophobicContact SD-CD2 4.04Å; M1556-Y1560 HydrophobicContact SD-CE2 3.81Å; M1556-Y1564 HydrophobicContact CE-CD2 3.72Å; M1556-Y1564 VanDerWaalsContact CE-CD2 3.45Å; M1556-Y1564 HydrophobicContact CE-CE2 4.06Å; M1556-Y1564 HydrophobicContact CE-CG 4.16Å; M1556-Y1564 HydrophobicContact SD-CD2 3.87Å; M1556-Y1564 WeakPolarHBondContact SD-CD2 3.46Å; M1556-Y1564 HydrophobicContact SD-CE2 4.08Å; M1556-Y1564 VanDerWaalsContact SD-CE2 3.56Å; M1556-Y1564 HydrophobicContact SD-CG 4.1Å
1557	E	63.3	Low	64.8	Low	107 Å²	107	66 Å²	66	50%	0.5	33%	0.33	S	S	.	.	H	α-helix	trans	-61	-30.8	174.9	-81.5	-178.9	-177.3	0	0	112.5	E1553 K1725	E1553-E1557 PolarHBondContact O-N 3.21Å; E1557-K1725 VanDerWaalsContact OE1-CE 3.29Å; E1557-K1725 WeakPolarHBondContact OE1-CE 3.31Å; E1557-K1725 IonicContact OE1-NZ 3.72Å; E1557-K1725 PolarHBondContact OE1-NZ 3.24Å; E1557-K1725 WeakPolarHBondContact OE2-CD 3.38Å; E1557-K1725 IonicContact OE2-NZ 3.79Å
1558	E	58.2	Low	63.9	Low	80.4 Å²	80.4	66.4 Å²	66.4	38%	0.376	33%	0.331	S	S	.	.	H	α-helix	trans	-78	-39	175.7	-71.3	-168.5	146.2	0	0	113.2	W1555 M1556 I1722 H1723	W1555-E1558 PolarHBondContact O-N 3.42Å; M1556-E1558 VanDerWaalsContact C-N 3.26Å; M1556-E1558 PolarHBondContact O-N 3.16Å; E1558-I1722 WeakPolarHBondContact OE1-CA 3.16Å; E1558-I1722 WeakPolarHBondContact OE2-CA 3.39Å; E1558-I1722 WeakPolarHBondContact OE2-CG2 3.28Å; E1558-H1723 WeakPolarHBondContact OE1-CA 3.45Å; E1558-H1723 PolarHBondContact OE1-N 3.16Å
1559	Q	56.1	Low	63.1	Low	114.8 Å²	114.8	71.6 Å²	71.6	54%	0.536	36%	0.355	S	S	.	.	H	α-helix	trans	-82.2	-33.2	-176.1	-67.3	-105.9	-24.1	0	0	113.4	W1555 M1556	W1555-Q1559 HydrophobicContact CD2-CG 4.27Å; W1555-Q1559 HydrophobicContact CH2-CG 4.33Å; W1555-Q1559 HydrophobicContact CZ2-CG 3.98Å; W1555-Q1559 HydrophobicContact CZ3-CG 4.48Å; W1555-Q1559 VanDerWaalsContact O-CG 3.26Å; W1555-Q1559 WeakPolarHBondContact O-CG 3.28Å; W1555-Q1559 PolarHBondContact O-N 3.26Å; W1555-Q1559 VanDerWaalsContact O-N 3.14Å; M1556-Q1559 PolarHBondContact O-N 3.25Å
1560	Y	54.3	Low	62.5	Low	132.6 Å²	132.6	74.6 Å²	74.6	52%	0.52	37%	0.369	S	S	.	.			trans	-123.7	82	-173.6	-67.7	-86.6	0	0	0	111.4	M1556 N1562	M1556-Y1560 HydrophobicContact CE-CD2 4.17Å; M1556-Y1560 HydrophobicContact CE-CE2 4.13Å; M1556-Y1560 WeakPolarHBondContact O-CA 3.35Å; M1556-Y1560 WeakPolarHBondContact O-CB 3.17Å; M1556-Y1560 PolarHBondContact O-N 2.9Å; M1556-Y1560 VanDerWaalsContact O-N 3.09Å; M1556-Y1560 HydrophobicContact SD-CD2 4.04Å; M1556-Y1560 HydrophobicContact SD-CE2 3.81Å; Y1560-N1562 PolarHBondContact O-N 3.22Å; Y1560-N1562 VanDerWaalsContact O-N 3.1Å
1561	K	49.6	Very low	61.9	Low	194.2 Å²	194.2	75.4 Å²	75.4	84%	0.844	37%	0.374	S	S	*	.	S	Bend	trans	-59.5	-12.4	165.6	-80.5	-176	177	176.1	0	113.7
1562	N	41.9	Very low	61.2	Low	150.8 Å²	150.8	79.7 Å²	79.7	81%	0.806	39%	0.391	S	S	*	.	S	Bend	trans	-139.5	109.9	172.4	-67.3	-40.3	0	0	0	109.5	Y1560	Y1560-N1562 PolarHBondContact O-N 3.22Å; Y1560-N1562 VanDerWaalsContact O-N 3.1Å
1563	G	44.5	Very low	60.7	Low	67.2 Å²	67.2	81.2 Å²	81.2	69%	0.693	40%	0.401	S	S	*	.			trans	121.1	22.1	154.8	0	0	0	0	0	119.9	T1565	G1563-T1565 PolarHBondContact O-N 3.17Å
1564	Y	46	Very low	60.2	Low	133.6 Å²	133.6	81.8 Å²	81.8	52%	0.524	41%	0.408	S	S	.	.			trans	-90.7	107.5	160.4	-170.6	-99.5	0	0	0	109.4	M1556 D1566	M1556-Y1564 HydrophobicContact CE-CD2 3.72Å; M1556-Y1564 VanDerWaalsContact CE-CD2 3.45Å; M1556-Y1564 HydrophobicContact CE-CE2 4.06Å; M1556-Y1564 HydrophobicContact CE-CG 4.16Å; M1556-Y1564 HydrophobicContact SD-CD2 3.87Å; M1556-Y1564 WeakPolarHBondContact SD-CD2 3.46Å; M1556-Y1564 HydrophobicContact SD-CE2 4.08Å; M1556-Y1564 VanDerWaalsContact SD-CE2 3.56Å; M1556-Y1564 HydrophobicContact SD-CG 4.1Å; Y1564-D1566 HydrophobicContact CE1-CB 4.37Å; Y1564-D1566 PolarHBondContact O-N 3.14Å
1565	T	49.9	Very low	59.9	Low	94.2 Å²	94.2	82.9 Å²	82.9	58%	0.578	41%	0.414	S	S	*	.			trans	-88.5	105	173.7	47	0	0	0	0	108.8	G1563 S1567	G1563-T1565 PolarHBondContact O-N 3.17Å; T1565-S1567 PolarHBondContact O-N 3.11Å
1566	D	59.9	Low	59.8	Low	21.4 Å²	21.4	84.4 Å²	84.4	11%	0.114	43%	0.427	C	S	.	.			trans	-59.6	130.2	165	-164.3	-7.3	0	0	0	108.1	Y1564 W1568 Q1569 R1755	Y1564-D1566 HydrophobicContact CE1-CB 4.37Å; Y1564-D1566 PolarHBondContact O-N 3.14Å; D1566-W1568 PolarHBondContact O-N 3.08Å; D1566-W1568 VanDerWaalsContact OD1-CD1 3.29Å; D1566-W1568 PolarHBondContact OD1-N 3.22Å; D1566-Q1569 HydrophobicContact CB-CB 4.46Å; D1566-Q1569 HydrophobicContact CB-CG 3.96Å; D1566-Q1569 WeakPolarHBondContact O-CA 3.5Å; D1566-Q1569 VanDerWaalsContact O-CB 3.32Å; D1566-Q1569 WeakPolarHBondContact O-CB 3.27Å; D1566-Q1569 PolarHBondContact O-N 3.17Å; D1566-R1755 IonicContact OD2-CZ 3.48Å; D1566-R1755 VanDerWaalsContact OD2-CZ 3.25Å; D1566-R1755 IonicContact OD2-NH1 3.33Å; D1566-R1755 PolarHBondContact OD2-NH1 3.13Å; D1566-R1755 IonicContact OD2-NH2 3.21Å; D1566-R1755 PolarHBondContact OD2-NH2 3.21Å
1567	S	63.3	Low	60.1	Low	46.2 Å²	46.2	86.7 Å²	86.7	32%	0.323	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-56.6	-26.3	-176.1	51.6	0	0	0	0	112.9	T1565 Q1569 E1570	T1565-S1567 PolarHBondContact O-N 3.11Å; S1567-Q1569 VanDerWaalsContact C-N 3.32Å; S1567-Q1569 PolarHBondContact O-N 2.95Å; S1567-E1570 PolarHBondContact O-N 3.25Å
1568	W	67.4	Low	60.5	Low	7.2 Å²	7.2	84.8 Å²	84.8	3%	0.027	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-68.7	-28.1	173.6	-66.7	106.1	0	0	0	113.9	D1566 E1570 L1571 I1588 I1591 F1595 L1746 L1750 E1758 L1762	D1566-W1568 PolarHBondContact O-N 3.08Å; D1566-W1568 VanDerWaalsContact OD1-CD1 3.29Å; D1566-W1568 PolarHBondContact OD1-N 3.22Å; W1568-E1570 VanDerWaalsContact C-N 3.32Å; W1568-E1570 PolarHBondContact O-N 3.14Å; W1568-L1571 HydrophobicContact CE3-CD1 3.77Å; W1568-L1571 HydrophobicContact CZ3-CD1 4.25Å; W1568-L1571 WeakPolarHBondContact O-CB 3.42Å; W1568-L1571 WeakPolarHBondContact O-CG 3.37Å; W1568-L1571 PolarHBondContact O-N 3.13Å; W1568-I1588 HydrophobicContact CZ3-CG1 4.49Å; W1568-I1591 HydrophobicContact CD2-CD1 4.08Å; W1568-I1591 HydrophobicContact CE3-CD1 4.07Å; W1568-I1591 HydrophobicContact CG-CD1 4.48Å; W1568-I1591 HydrophobicContact CH2-CB 4.4Å; W1568-I1591 HydrophobicContact CH2-CD1 4.29Å; W1568-I1591 HydrophobicContact CH2-CG2 3.88Å; W1568-I1591 HydrophobicContact CZ2-CD1 4.28Å; W1568-I1591 HydrophobicContact CZ2-CG2 3.63Å; W1568-I1591 HydrophobicContact CZ3-CD1 4.18Å; W1568-I1591 HydrophobicContact CZ3-CG2 4.38Å; W1568-F1595 HydrophobicContact CH2-CE2 4.37Å; W1568-F1595 AromaticContact CZ2-CE2 3.67Å; W1568-F1595 HydrophobicContact CZ2-CE2 4.03Å; W1568-F1595 HydrophobicContact CZ2-CZ 4.24Å; W1568-L1746 HydrophobicContact CH2-CD2 3.98Å; W1568-L1746 HydrophobicContact CZ2-CD1 4.41Å; W1568-L1746 HydrophobicContact CZ2-CD2 4.2Å; W1568-L1750 HydrophobicContact CZ3-CD1 4.4Å; W1568-E1758 HydrophobicContact CB-CG 4.31Å; W1568-E1758 HydrophobicContact CE3-CB 4.3Å; W1568-E1758 HydrophobicContact CE3-CG 4.35Å; W1568-L1762 HydrophobicContact CE3-CD2 4.42Å; W1568-L1762 HydrophobicContact CH2-CD1 4.01Å; W1568-L1762 HydrophobicContact CH2-CD2 4.04Å; W1568-L1762 HydrophobicContact CH2-CG 4.42Å; W1568-L1762 HydrophobicContact CZ3-CD1 4.01Å; W1568-L1762 HydrophobicContact CZ3-CD2 3.8Å; W1568-L1762 HydrophobicContact CZ3-CG 4.09Å
1569	Q	66.1	Low	61.3	Low	116.8 Å²	116.8	86.5 Å²	86.5	55%	0.546	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-74.9	-12.3	-179.8	-67.8	174.5	1.6	0	0	113.1	D1566 S1567 L1571	D1566-Q1569 HydrophobicContact CB-CB 4.46Å; D1566-Q1569 HydrophobicContact CB-CG 3.96Å; D1566-Q1569 WeakPolarHBondContact O-CA 3.5Å; D1566-Q1569 VanDerWaalsContact O-CB 3.32Å; D1566-Q1569 WeakPolarHBondContact O-CB 3.27Å; D1566-Q1569 PolarHBondContact O-N 3.17Å; S1567-Q1569 VanDerWaalsContact C-N 3.32Å; S1567-Q1569 PolarHBondContact O-N 2.95Å; Q1569-L1571 VanDerWaalsContact C-N 3.26Å; Q1569-L1571 PolarHBondContact O-N 3.13Å
1570	E	69	Low	62.2	Low	100.8 Å²	100.8	82.6 Å²	82.6	47%	0.471	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-76.2	-12.1	174.1	-63.3	-171.6	177.6	0	0	113	S1567 W1568 K1572 I1587	S1567-E1570 PolarHBondContact O-N 3.25Å; W1568-E1570 VanDerWaalsContact C-N 3.32Å; W1568-E1570 PolarHBondContact O-N 3.14Å; E1570-K1572 PolarHBondContact O-N 3.11Å; E1570-I1587 HydrophobicContact CB-CD1 3.8Å; E1570-I1587 HydrophobicContact CB-CG2 4.45Å; E1570-I1587 WeakPolarHBondContact O-CD1 3.37Å
1571	L	70.3	Confident	63.1	Low	18.4 Å²	18.4	77.2 Å²	77.2	10%	0.096	41%	0.408	C	S	.	.			trans	-68.6	126.1	178.7	-65.5	174.9	0	0	0	111.6	W1568 Q1569 N1584 I1587 I1588 E1758 C1761	W1568-L1571 HydrophobicContact CE3-CD1 3.77Å; W1568-L1571 HydrophobicContact CZ3-CD1 4.25Å; W1568-L1571 WeakPolarHBondContact O-CB 3.42Å; W1568-L1571 WeakPolarHBondContact O-CG 3.37Å; W1568-L1571 PolarHBondContact O-N 3.13Å; Q1569-L1571 VanDerWaalsContact C-N 3.26Å; Q1569-L1571 PolarHBondContact O-N 3.13Å; L1571-N1584 WeakPolarHBondContact CA-OD1 3.46Å; L1571-N1584 HydrophobicContact CD2-CB 3.88Å; L1571-I1587 HydrophobicContact CD2-CB 4.1Å; L1571-I1587 HydrophobicContact CD2-CD1 4.33Å; L1571-I1587 HydrophobicContact CD2-CG2 3.92Å; L1571-I1587 HydrophobicContact CG-CG2 4.36Å; L1571-I1588 HydrophobicContact CD2-CD1 4.28Å; L1571-I1588 HydrophobicContact CD2-CG1 4.02Å; L1571-E1758 HydrophobicContact CD1-CB 4.45Å; L1571-E1758 HydrophobicContact CD1-CG 4.28Å; L1571-C1761 HydrophobicContact CB-CB 4.05Å; L1571-C1761 HydrophobicContact CD1-CB 4.04Å
1572	K	69	Low	64.3	Low	112 Å²	112	70.4 Å²	70.4	49%	0.487	38%	0.38	S	S	.	.			trans	-99	134.9	-176.3	-64	176.7	-174.6	170.3	0	111.9	E1570 P1574 L1575 N1580 N1584	E1570-K1572 PolarHBondContact O-N 3.11Å; K1572-P1574 WeakPolarHBondContact O-CD 3.38Å; K1572-L1575 VanDerWaalsContact O-CD2 3.22Å; K1572-L1575 WeakPolarHBondContact O-CD2 3.3Å; K1572-N1580 HydrophobicContact CB-CB 4.3Å; K1572-N1580 WeakPolarHBondContact CD-OD1 3.41Å; K1572-N1584 PolarHBondContact N-ND2 3.25Å; K1572-N1584 PolarHBondContact N-OD1 3.28Å; K1572-N1584 VanDerWaalsContact N-OD1 3.12Å; K1572-N1584 PolarHBondContact O-ND2 3.24Å
1573	V	66.1	Low	66	Low	46.6 Å²	46.6	64.9 Å²	64.9	28%	0.282	35%	0.353	S	S	.	.	S	Bend	trans	-116	135.7	173.5	-178.4	0	0	0	0	107.8	L1575 N1757 M1810	V1573-L1575 VanDerWaalsContact C-N 3.33Å; V1573-L1575 HydrophobicContact CB-CD1 4.22Å; V1573-L1575 HydrophobicContact CG1-CD1 3.95Å; V1573-L1575 HydrophobicContact CG1-CG 4.43Å; V1573-L1575 PolarHBondContact O-N 2.98Å; V1573-N1757 HydrophobicContact CG2-CB 4.07Å; V1573-M1810 HydrophobicContact CG1-CG 4.21Å; V1573-M1810 HydrophobicContact CG1-SD 4.13Å
1574	P	62.6	Low	67.7	Low	50 Å²	50	61.9 Å²	61.9	33%	0.325	32%	0.321	S	S	.	.			cis	-83.6	143.3	9.7	34	-35.1	0	0	0	114	K1572 D1576 N1580 I1581 T1764 M1810	K1572-P1574 WeakPolarHBondContact O-CD 3.38Å; P1574-D1576 VanDerWaalsContact C-N 3.27Å; P1574-D1576 WeakPolarHBondContact CB-OD2 3.37Å; P1574-D1576 WeakPolarHBondContact CG-OD2 3.39Å; P1574-D1576 PolarHBondContact O-N 3.12Å; P1574-D1576 VanDerWaalsContact O-N 3.11Å; P1574-N1580 PolarHBondContact O-ND2 3.24Å; P1574-N1580 VanDerWaalsContact O-ND2 3.12Å; P1574-I1581 HydrophobicContact CB-CG1 3.7Å; P1574-T1764 WeakPolarHBondContact CG-OG1 3.43Å; P1574-M1810 HydrophobicContact CG-CE 3.76Å
1575	L	66.6	Low	69.2	Low	25 Å²	25	56.7 Å²	56.7	13%	0.131	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	27.1	-179.2	-66.1	160.7	0	0	0	112.6	K1572 V1573 N1577 I1581 N1584 V1760 T1764 M1810 K1813 W1847	K1572-L1575 VanDerWaalsContact O-CD2 3.22Å; K1572-L1575 WeakPolarHBondContact O-CD2 3.3Å; V1573-L1575 VanDerWaalsContact C-N 3.33Å; V1573-L1575 HydrophobicContact CB-CD1 4.22Å; V1573-L1575 HydrophobicContact CG1-CD1 3.95Å; V1573-L1575 HydrophobicContact CG1-CG 4.43Å; V1573-L1575 PolarHBondContact O-N 2.98Å; L1575-N1577 VanDerWaalsContact C-N 3.32Å; L1575-N1577 PolarHBondContact O-N 3.36Å; L1575-I1581 HydrophobicContact CB-CG1 4.34Å; L1575-I1581 HydrophobicContact CD2-CG1 4.15Å; L1575-N1584 WeakPolarHBondContact CD2-ND2 3.41Å; L1575-V1760 HydrophobicContact CD1-CG1 4.36Å; L1575-T1764 HydrophobicContact CD1-CG2 4.35Å; L1575-T1764 WeakPolarHBondContact CD1-OG1 3.35Å; L1575-M1810 HydrophobicContact CB-CE 3.91Å; L1575-M1810 HydrophobicContact CB-SD 4.47Å; L1575-M1810 HydrophobicContact CD1-CE 3.68Å; L1575-M1810 HydrophobicContact CG-CE 4.01Å; L1575-K1813 WeakPolarHBondContact O-CE 3.3Å; L1575-K1813 PolarHBondContact O-NZ 2.97Å; L1575-W1847 HydrophobicContact CD1-CZ2 4.46Å; L1575-W1847 PolarHBondContact O-NE1 3.22Å
1576	D	67.2	Low	70.5	Confident	111.2 Å²	111.2	57.9 Å²	57.9	60%	0.595	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-26.9	179.6	-64.6	-37.1	0	0	0	112.3	P1574 L1578 K1813	P1574-D1576 VanDerWaalsContact C-N 3.27Å; P1574-D1576 WeakPolarHBondContact CB-OD2 3.37Å; P1574-D1576 WeakPolarHBondContact CG-OD2 3.39Å; P1574-D1576 PolarHBondContact O-N 3.12Å; P1574-D1576 VanDerWaalsContact O-N 3.11Å; D1576-L1578 PolarHBondContact O-N 3.33Å; D1576-K1813 IonicContact OD1-NZ 3.05Å; D1576-K1813 PolarHBondContact OD1-NZ 3.04Å
1577	N	71.3	Confident	71.2	Confident	90.6 Å²	90.6	57.8 Å²	57.8	48%	0.484	30%	0.298	S	S	.	.	S	Bend	trans	-91.1	131.2	-178.4	-106.9	-3.2	0	0	0	111.5	L1575 D1579 N1580 I1581	L1575-N1577 VanDerWaalsContact C-N 3.32Å; L1575-N1577 PolarHBondContact O-N 3.36Å; N1577-D1579 PolarHBondContact ND2-OD2 3.2Å; N1577-D1579 VanDerWaalsContact ND2-OD2 3.12Å; N1577-D1579 PolarHBondContact O-N 3.17Å; N1577-D1579 PolarHBondContact OD1-N 2.9Å; N1577-D1579 VanDerWaalsContact OD1-N 3.17Å; N1577-N1580 HydrophobicContact CB-CB 4.2Å; N1577-N1580 WeakPolarHBondContact O-CB 3.34Å; N1577-N1580 PolarHBondContact O-N 3.14Å; N1577-I1581 PolarHBondContact O-N 3.19Å; N1577-I1581 VanDerWaalsContact O-N 3.16Å
1578	L	71.7	Confident	71.8	Confident	67.4 Å²	67.4	55.6 Å²	55.6	35%	0.353	28%	0.283	S	S	.	.	H	α-helix	trans	-53.1	-38.4	174.8	-167.7	84.6	0	0	0	112	D1576 N1580 I1581 M1582 T1850 A1854 L1857	D1576-L1578 PolarHBondContact O-N 3.33Å; L1578-N1580 VanDerWaalsContact C-N 3.33Å; L1578-N1580 PolarHBondContact O-N 2.94Å; L1578-I1581 PolarHBondContact O-N 3.22Å; L1578-M1582 HydrophobicContact CD2-CG 4.31Å; L1578-M1582 HydrophobicContact CD2-SD 4.18Å; L1578-M1582 HydrophobicContact CG-CG 4.37Å; L1578-M1582 HydrophobicContact CG-SD 4.1Å; L1578-M1582 WeakPolarHBondContact O-CB 3.28Å; L1578-M1582 WeakPolarHBondContact O-CG 3.41Å; L1578-M1582 PolarHBondContact O-N 3.19Å; L1578-T1850 HydrophobicContact CD1-CG2 3.89Å; L1578-A1854 HydrophobicContact CD1-CB 3.95Å; L1578-A1854 HydrophobicContact CD2-CB 4.46Å; L1578-A1854 HydrophobicContact CG-CB 4.12Å; L1578-L1857 HydrophobicContact CD2-CD1 4.21Å
1579	D	74	Confident	72	Confident	115 Å²	115	60.9 Å²	60.9	62%	0.615	30%	0.304	S	S	*	.	H	α-helix	trans	-62.7	-38.4	178	-64.6	-36.2	0	0	0	112.9	N1577 M1582 S1583	N1577-D1579 PolarHBondContact ND2-OD2 3.2Å; N1577-D1579 VanDerWaalsContact ND2-OD2 3.12Å; N1577-D1579 PolarHBondContact O-N 3.17Å; N1577-D1579 PolarHBondContact OD1-N 2.9Å; N1577-D1579 VanDerWaalsContact OD1-N 3.17Å; D1579-M1582 PolarHBondContact O-N 3.27Å; D1579-S1583 VanDerWaalsContact O-CB 3.28Å; D1579-S1583 WeakPolarHBondContact O-CB 3.18Å; D1579-S1583 PolarHBondContact O-N 3.2Å; D1579-S1583 PolarHBondContact O-OG 2.97Å; D1579-S1583 VanDerWaalsContact O-OG 3.05Å
1580	N	75.8	Confident	72.2	Confident	34.4 Å²	34.4	60.7 Å²	60.7	18%	0.184	30%	0.303	C	S	.	.	H	α-helix	trans	-69	-41.4	177.6	-73.3	-9.1	0	0	0	110.6	K1572 P1574 N1577 L1578 S1583 N1584	K1572-N1580 HydrophobicContact CB-CB 4.3Å; K1572-N1580 WeakPolarHBondContact CD-OD1 3.41Å; P1574-N1580 PolarHBondContact O-ND2 3.24Å; P1574-N1580 VanDerWaalsContact O-ND2 3.12Å; N1577-N1580 HydrophobicContact CB-CB 4.2Å; N1577-N1580 WeakPolarHBondContact O-CB 3.34Å; N1577-N1580 PolarHBondContact O-N 3.14Å; L1578-N1580 VanDerWaalsContact C-N 3.33Å; L1578-N1580 PolarHBondContact O-N 2.94Å; N1580-S1583 WeakPolarHBondContact CA-OG 3.39Å; N1580-S1583 PolarHBondContact O-N 3.09Å; N1580-S1583 PolarHBondContact O-OG 3.18Å; N1580-S1583 VanDerWaalsContact O-OG 3.12Å; N1580-N1584 WeakPolarHBondContact O-CB 3.31Å; N1580-N1584 PolarHBondContact O-N 2.98Å; N1580-N1584 PolarHBondContact O-ND2 3.36Å; N1580-N1584 PolarHBondContact O-OD1 3.08Å
1581	I	73.9	Confident	72.3	Confident	19.2 Å²	19.2	56.2 Å²	56.2	10%	0.098	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-49.6	176.1	-61.4	170.2	0	0	0	109.6	P1574 L1575 N1577 L1578 S1583 N1584 E1585 T1850 I1851 A1854	P1574-I1581 HydrophobicContact CB-CG1 3.7Å; L1575-I1581 HydrophobicContact CB-CG1 4.34Å; L1575-I1581 HydrophobicContact CD2-CG1 4.15Å; N1577-I1581 PolarHBondContact O-N 3.19Å; N1577-I1581 VanDerWaalsContact O-N 3.16Å; L1578-I1581 PolarHBondContact O-N 3.22Å; I1581-S1583 PolarHBondContact O-N 3.13Å; I1581-N1584 PolarHBondContact O-N 3.21Å; I1581-E1585 WeakPolarHBondContact O-CB 3.31Å; I1581-E1585 WeakPolarHBondContact O-CG 3.39Å; I1581-E1585 PolarHBondContact O-N 3.11Å; I1581-T1850 HydrophobicContact CD1-CG2 4.36Å; I1581-I1851 HydrophobicContact CD1-CG1 4.28Å; I1581-I1851 HydrophobicContact CG2-CG1 4.34Å; I1581-A1854 HydrophobicContact CG2-CB 4Å
1582	M	73.7	Confident	72.1	Confident	50.4 Å²	50.4	56 Å²	56	25%	0.248	28%	0.281	C	S	.	.	H	α-helix	trans	-64.7	-36.2	179.1	-71.5	-174.9	71.3	0	0	113.2	L1578 D1579 K1586 A1854 L1857	L1578-M1582 HydrophobicContact CD2-CG 4.31Å; L1578-M1582 HydrophobicContact CD2-SD 4.18Å; L1578-M1582 HydrophobicContact CG-CG 4.37Å; L1578-M1582 HydrophobicContact CG-SD 4.1Å; L1578-M1582 WeakPolarHBondContact O-CB 3.28Å; L1578-M1582 WeakPolarHBondContact O-CG 3.41Å; L1578-M1582 PolarHBondContact O-N 3.19Å; D1579-M1582 PolarHBondContact O-N 3.27Å; M1582-K1586 WeakPolarHBondContact O-CB 3.46Å; M1582-K1586 WeakPolarHBondContact O-CD 3.27Å; M1582-K1586 VanDerWaalsContact O-CG 3.3Å; M1582-K1586 WeakPolarHBondContact O-CG 3.42Å; M1582-K1586 PolarHBondContact O-N 2.93Å; M1582-A1854 HydrophobicContact CG-CB 4.17Å; M1582-L1857 HydrophobicContact CE-CB 3.82Å; M1582-L1857 WeakPolarHBondContact CE-O 3.47Å; M1582-L1857 HydrophobicContact SD-CB 4.29Å; M1582-L1857 HydrophobicContact SD-CD1 4.31Å
1583	S	78.4	Confident	72	Confident	35.4 Å²	35.4	54.4 Å²	54.4	25%	0.248	28%	0.278	C	S	.	.	H	α-helix	trans	-67.3	-44.3	174.8	60.2	0	0	0	0	111.5	D1579 N1580 I1581 E1585 K1586 I1587	D1579-S1583 VanDerWaalsContact O-CB 3.28Å; D1579-S1583 WeakPolarHBondContact O-CB 3.18Å; D1579-S1583 PolarHBondContact O-N 3.2Å; D1579-S1583 PolarHBondContact O-OG 2.97Å; D1579-S1583 VanDerWaalsContact O-OG 3.05Å; N1580-S1583 WeakPolarHBondContact CA-OG 3.39Å; N1580-S1583 PolarHBondContact O-N 3.09Å; N1580-S1583 PolarHBondContact O-OG 3.18Å; N1580-S1583 VanDerWaalsContact O-OG 3.12Å; I1581-S1583 PolarHBondContact O-N 3.13Å; S1583-E1585 VanDerWaalsContact C-N 3.33Å; S1583-E1585 PolarHBondContact O-N 2.73Å; S1583-K1586 PolarHBondContact O-N 3.04Å; S1583-I1587 WeakPolarHBondContact O-CD1 3.45Å; S1583-I1587 VanDerWaalsContact O-CG1 3.31Å; S1583-I1587 WeakPolarHBondContact O-CG1 3.36Å; S1583-I1587 PolarHBondContact O-N 3.3Å; S1583-I1587 VanDerWaalsContact O-N 3.09Å
1584	N	79.4	Confident	71.8	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-65.1	-42.3	178.8	-70.3	-2.6	0	0	0	111.5	L1571 K1572 L1575 N1580 I1581 K1586 I1587 I1588	L1571-N1584 WeakPolarHBondContact CA-OD1 3.46Å; L1571-N1584 HydrophobicContact CD2-CB 3.88Å; K1572-N1584 PolarHBondContact N-ND2 3.25Å; K1572-N1584 PolarHBondContact N-OD1 3.28Å; K1572-N1584 VanDerWaalsContact N-OD1 3.12Å; K1572-N1584 PolarHBondContact O-ND2 3.24Å; L1575-N1584 WeakPolarHBondContact CD2-ND2 3.41Å; N1580-N1584 WeakPolarHBondContact O-CB 3.31Å; N1580-N1584 PolarHBondContact O-N 2.98Å; N1580-N1584 PolarHBondContact O-ND2 3.36Å; N1580-N1584 PolarHBondContact O-OD1 3.08Å; I1581-N1584 PolarHBondContact O-N 3.21Å; N1584-K1586 VanDerWaalsContact C-N 3.31Å; N1584-K1586 PolarHBondContact O-N 3.18Å; N1584-I1587 PolarHBondContact O-N 3.1Å; N1584-I1588 WeakPolarHBondContact O-CB 3.38Å; N1584-I1588 VanDerWaalsContact O-CG1 3.27Å; N1584-I1588 WeakPolarHBondContact O-CG1 3.36Å; N1584-I1588 PolarHBondContact O-N 2.86Å
1585	E	77.2	Confident	71.7	Confident	24.8 Å²	24.8	58.6 Å²	58.6	12%	0.116	29%	0.29	C	S	.	.	H	α-helix	trans	-58.6	-41.3	174.9	-78.6	-60.6	117.2	0	0	112.1	I1581 S1583 I1588 Y1589 S1765 P1766 A1767	I1581-E1585 WeakPolarHBondContact O-CB 3.31Å; I1581-E1585 WeakPolarHBondContact O-CG 3.39Å; I1581-E1585 PolarHBondContact O-N 3.11Å; S1583-E1585 VanDerWaalsContact C-N 3.33Å; S1583-E1585 PolarHBondContact O-N 2.73Å; E1585-I1588 PolarHBondContact O-N 3.33Å; E1585-Y1589 VanDerWaalsContact O-CB 3.27Å; E1585-Y1589 WeakPolarHBondContact O-CB 3.23Å; E1585-Y1589 PolarHBondContact O-N 2.95Å; E1585-S1765 VanDerWaalsContact OE1-CA 3.26Å; E1585-S1765 WeakPolarHBondContact OE1-CA 3.37Å; E1585-S1765 WeakPolarHBondContact OE1-CB 3.3Å; E1585-S1765 PolarHBondContact OE1-OG 3.2Å; E1585-S1765 PolarHBondContact OE2-OG 3.15Å; E1585-P1766 WeakPolarHBondContact OE1-CD 3.3Å; E1585-P1766 WeakPolarHBondContact OE2-CD 3.36Å; E1585-A1767 VanDerWaalsContact OE2-CB 3.3Å; E1585-A1767 WeakPolarHBondContact OE2-CB 3.42Å; E1585-A1767 PolarHBondContact OE2-N 3.08Å
1586	K	76.8	Confident	71.2	Confident	119.6 Å²	119.6	62.1 Å²	62.1	52%	0.52	31%	0.308	S	S	.	.	H	α-helix	trans	-64	-44.3	176.2	-89.1	176.8	-179	179.1	0	112.1	M1582 S1583 N1584 Y1589 Q1590	M1582-K1586 WeakPolarHBondContact O-CB 3.46Å; M1582-K1586 WeakPolarHBondContact O-CD 3.27Å; M1582-K1586 VanDerWaalsContact O-CG 3.3Å; M1582-K1586 WeakPolarHBondContact O-CG 3.42Å; M1582-K1586 PolarHBondContact O-N 2.93Å; S1583-K1586 PolarHBondContact O-N 3.04Å; N1584-K1586 VanDerWaalsContact C-N 3.31Å; N1584-K1586 PolarHBondContact O-N 3.18Å; K1586-Y1589 PolarHBondContact O-N 3.05Å; K1586-Q1590 WeakPolarHBondContact O-CB 3.3Å; K1586-Q1590 VanDerWaalsContact O-CG 3.27Å; K1586-Q1590 WeakPolarHBondContact O-CG 3.33Å; K1586-Q1590 PolarHBondContact O-N 3.08Å
1587	I	76	Confident	70.4	Confident	18.4 Å²	18.4	60.4 Å²	60.4	9%	0.094	30%	0.299	C	S	.	.	H	α-helix	trans	-63.5	-48.1	178.3	-66.8	161.7	0	0	0	109.9	E1570 L1571 S1583 N1584 Y1589 Q1590 I1591	E1570-I1587 HydrophobicContact CB-CD1 3.8Å; E1570-I1587 HydrophobicContact CB-CG2 4.45Å; E1570-I1587 WeakPolarHBondContact O-CD1 3.37Å; L1571-I1587 HydrophobicContact CD2-CB 4.1Å; L1571-I1587 HydrophobicContact CD2-CD1 4.33Å; L1571-I1587 HydrophobicContact CD2-CG2 3.92Å; L1571-I1587 HydrophobicContact CG-CG2 4.36Å; S1583-I1587 WeakPolarHBondContact O-CD1 3.45Å; S1583-I1587 VanDerWaalsContact O-CG1 3.31Å; S1583-I1587 WeakPolarHBondContact O-CG1 3.36Å; S1583-I1587 PolarHBondContact O-N 3.3Å; S1583-I1587 VanDerWaalsContact O-N 3.09Å; N1584-I1587 PolarHBondContact O-N 3.1Å; I1587-Y1589 VanDerWaalsContact C-N 3.3Å; I1587-Y1589 PolarHBondContact O-N 2.84Å; I1587-Q1590 WeakPolarHBondContact O-CB 3.42Å; I1587-Q1590 PolarHBondContact O-N 3.19Å; I1587-I1591 HydrophobicContact CG2-CD1 3.67Å; I1587-I1591 HydrophobicContact CG2-CG1 4.33Å; I1587-I1591 WeakPolarHBondContact O-CB 3.35Å; I1587-I1591 VanDerWaalsContact O-CG1 3.26Å; I1587-I1591 WeakPolarHBondContact O-CG1 3.27Å; I1587-I1591 PolarHBondContact O-N 3.13Å
1588	I	74.9	Confident	69.2	Low	0.6 Å²	0.6	65.3 Å²	65.3	0%	0.003	32%	0.316	C	S	.	.	H	α-helix	trans	-62.8	-40.2	179.6	-67.6	168.2	0	0	0	111	W1568 L1571 N1584 E1585 I1591 N1592 C1761 L1762 S1765 A1767 F1768	W1568-I1588 HydrophobicContact CZ3-CG1 4.49Å; L1571-I1588 HydrophobicContact CD2-CD1 4.28Å; L1571-I1588 HydrophobicContact CD2-CG1 4.02Å; N1584-I1588 WeakPolarHBondContact O-CB 3.38Å; N1584-I1588 VanDerWaalsContact O-CG1 3.27Å; N1584-I1588 WeakPolarHBondContact O-CG1 3.36Å; N1584-I1588 PolarHBondContact O-N 2.86Å; E1585-I1588 PolarHBondContact O-N 3.33Å; I1588-I1591 PolarHBondContact O-N 3.14Å; I1588-N1592 VanDerWaalsContact O-CB 3.29Å; I1588-N1592 WeakPolarHBondContact O-CB 3.35Å; I1588-N1592 VanDerWaalsContact O-CG 3.25Å; I1588-N1592 PolarHBondContact O-N 3.14Å; I1588-C1761 HydrophobicContact CD1-CB 4.46Å; I1588-L1762 HydrophobicContact CD1-CD2 4.22Å; I1588-L1762 HydrophobicContact CG1-CD2 4.32Å; I1588-L1762 HydrophobicContact CG2-CD2 4.18Å; I1588-S1765 VanDerWaalsContact CD1-CB 3.49Å; I1588-S1765 VanDerWaalsContact CD1-OG 3.29Å; I1588-S1765 WeakPolarHBondContact CD1-OG 3.16Å; I1588-A1767 HydrophobicContact CG2-CB 4.47Å; I1588-F1768 HydrophobicContact CG2-CB 4.26Å
1589	Y	71.6	Confident	67.8	Low	118.2 Å²	118.2	68.4 Å²	68.4	46%	0.464	33%	0.333	S	S	.	.	H	α-helix	trans	-64.6	-42.6	175.3	-164.2	-85.9	0	0	0	112	E1585 K1586 I1587 I1591 N1592 D1593 A1767	E1585-Y1589 VanDerWaalsContact O-CB 3.27Å; E1585-Y1589 WeakPolarHBondContact O-CB 3.23Å; E1585-Y1589 PolarHBondContact O-N 2.95Å; K1586-Y1589 PolarHBondContact O-N 3.05Å; I1587-Y1589 VanDerWaalsContact C-N 3.3Å; I1587-Y1589 PolarHBondContact O-N 2.84Å; Y1589-I1591 VanDerWaalsContact C-N 3.35Å; Y1589-I1591 PolarHBondContact O-N 3.26Å; Y1589-N1592 CarbonylContact O-C 3.59Å; Y1589-N1592 PolarHBondContact O-N 3.07Å; Y1589-D1593 VanDerWaalsContact O-CB 3.29Å; Y1589-D1593 WeakPolarHBondContact O-CB 3.3Å; Y1589-D1593 PolarHBondContact O-N 3.01Å; Y1589-A1767 HydrophobicContact CD2-CB 4.37Å
1590	Q	71.6	Confident	66.3	Low	112 Å²	112	69.7 Å²	69.7	52%	0.523	33%	0.333	S	S	.	.	H	α-helix	trans	-63.2	-41.4	175.2	-75	174.2	-7.1	0	0	112.1	K1586 I1587 N1592 D1593 Q1594	K1586-Q1590 WeakPolarHBondContact O-CB 3.3Å; K1586-Q1590 VanDerWaalsContact O-CG 3.27Å; K1586-Q1590 WeakPolarHBondContact O-CG 3.33Å; K1586-Q1590 PolarHBondContact O-N 3.08Å; I1587-Q1590 WeakPolarHBondContact O-CB 3.42Å; I1587-Q1590 PolarHBondContact O-N 3.19Å; Q1590-N1592 VanDerWaalsContact C-N 3.32Å; Q1590-D1593 PolarHBondContact O-N 3.07Å; Q1590-Q1594 WeakPolarHBondContact O-CB 3.34Å; Q1590-Q1594 VanDerWaalsContact O-CG 3.25Å; Q1590-Q1594 WeakPolarHBondContact O-CG 3.36Å; Q1590-Q1594 PolarHBondContact O-N 3.2Å
1591	I	69.9	Low	64.9	Low	7.8 Å²	7.8	72 Å²	72	4%	0.04	35%	0.35	C	S	.	.	H	α-helix	trans	-63.8	-45.6	175.6	-69.2	171.1	0	0	0	109.9	W1568 I1587 I1588 Y1589 D1593 Q1594 F1595	W1568-I1591 HydrophobicContact CD2-CD1 4.08Å; W1568-I1591 HydrophobicContact CE3-CD1 4.07Å; W1568-I1591 HydrophobicContact CG-CD1 4.48Å; W1568-I1591 HydrophobicContact CH2-CB 4.4Å; W1568-I1591 HydrophobicContact CH2-CD1 4.29Å; W1568-I1591 HydrophobicContact CH2-CG2 3.88Å; W1568-I1591 HydrophobicContact CZ2-CD1 4.28Å; W1568-I1591 HydrophobicContact CZ2-CG2 3.63Å; W1568-I1591 HydrophobicContact CZ3-CD1 4.18Å; W1568-I1591 HydrophobicContact CZ3-CG2 4.38Å; I1587-I1591 HydrophobicContact CG2-CD1 3.67Å; I1587-I1591 HydrophobicContact CG2-CG1 4.33Å; I1587-I1591 WeakPolarHBondContact O-CB 3.35Å; I1587-I1591 VanDerWaalsContact O-CG1 3.26Å; I1587-I1591 WeakPolarHBondContact O-CG1 3.27Å; I1587-I1591 PolarHBondContact O-N 3.13Å; I1588-I1591 PolarHBondContact O-N 3.14Å; Y1589-I1591 VanDerWaalsContact C-N 3.35Å; Y1589-I1591 PolarHBondContact O-N 3.26Å; I1591-D1593 VanDerWaalsContact C-N 3.32Å; I1591-D1593 PolarHBondContact O-N 3.08Å; I1591-Q1594 CarbonylContact O-C 3.19Å; I1591-Q1594 WeakPolarHBondContact O-CB 3.36Å; I1591-Q1594 PolarHBondContact O-N 2.99Å; I1591-F1595 HydrophobicContact CB-CE2 4.38Å; I1591-F1595 HydrophobicContact CG2-CD2 3.72Å; I1591-F1595 VanDerWaalsContact CG2-CD2 3.48Å; I1591-F1595 HydrophobicContact CG2-CE1 4.18Å; I1591-F1595 HydrophobicContact CG2-CE2 3.27Å; I1591-F1595 HydrophobicContact CG2-CZ 4Å; I1591-F1595 VanDerWaalsContact O-CD2 3.24Å; I1591-F1595 WeakPolarHBondContact O-CD2 3.39Å; I1591-F1595 VanDerWaalsContact O-CG 3.22Å; I1591-F1595 WeakPolarHBondContact O-CG 3.42Å; I1591-F1595 PolarHBondContact O-N 3.04Å
1592	N	67.2	Low	63.5	Low	12.8 Å²	12.8	76.9 Å²	76.9	7%	0.068	38%	0.381	C	S	.	.	H	α-helix	trans	-62.2	-38.6	176	-75.7	-11	0	0	0	112.8	I1588 Y1589 Q1590 F1595 N1596 M1743	I1588-N1592 VanDerWaalsContact O-CB 3.29Å; I1588-N1592 WeakPolarHBondContact O-CB 3.35Å; I1588-N1592 VanDerWaalsContact O-CG 3.25Å; I1588-N1592 PolarHBondContact O-N 3.14Å; Y1589-N1592 CarbonylContact O-C 3.59Å; Y1589-N1592 PolarHBondContact O-N 3.07Å; Q1590-N1592 VanDerWaalsContact C-N 3.32Å; N1592-F1595 VanDerWaalsContact CA-CD2 3.48Å; N1592-F1595 HydrophobicContact CB-CD2 4.39Å; N1592-F1595 WeakPolarHBondContact O-CB 3.28Å; N1592-F1595 PolarHBondContact O-N 2.99Å; N1592-F1595 VanDerWaalsContact OD1-CD2 3.31Å; N1592-F1595 WeakPolarHBondContact OD1-CD2 3.24Å; N1592-N1596 VanDerWaalsContact O-CB 3.32Å; N1592-N1596 WeakPolarHBondContact O-CB 3.34Å; N1592-N1596 PolarHBondContact O-N 3.05Å; N1592-N1596 PolarHBondContact O-ND2 3.18Å; N1592-N1596 VanDerWaalsContact O-ND2 3.13Å; N1592-M1743 WeakPolarHBondContact OD1-CE 3.36Å
1593	D	65.3	Low	62.2	Low	78 Å²	78	78.4 Å²	78.4	42%	0.417	39%	0.39	S	S	.	.	H	α-helix	trans	-70.4	-35.8	176.7	-167.9	48	0	0	0	111.7	Y1589 Q1590 I1591 F1595 N1596 N1597	Y1589-D1593 VanDerWaalsContact O-CB 3.29Å; Y1589-D1593 WeakPolarHBondContact O-CB 3.3Å; Y1589-D1593 PolarHBondContact O-N 3.01Å; Q1590-D1593 PolarHBondContact O-N 3.07Å; I1591-D1593 VanDerWaalsContact C-N 3.32Å; I1591-D1593 PolarHBondContact O-N 3.08Å; D1593-F1595 VanDerWaalsContact C-N 3.32Å; D1593-F1595 PolarHBondContact O-N 3.41Å; D1593-N1596 PolarHBondContact O-N 2.91Å; D1593-N1596 VanDerWaalsContact O-N 3.17Å; D1593-N1597 VanDerWaalsContact CG-ND2 3.29Å; D1593-N1597 VanDerWaalsContact O-CB 3.25Å; D1593-N1597 WeakPolarHBondContact O-CB 3.32Å; D1593-N1597 PolarHBondContact O-N 3.11Å; D1593-N1597 PolarHBondContact O-ND2 3.22Å; D1593-N1597 VanDerWaalsContact O-ND2 3.11Å; D1593-N1597 PolarHBondContact OD1-ND2 3.01Å; D1593-N1597 VanDerWaalsContact OD1-ND2 3.08Å; D1593-N1597 PolarHBondContact OD2-ND2 2.95Å
1594	Q	63.8	Low	60.8	Low	134.4 Å²	134.4	80 Å²	80	63%	0.628	40%	0.401	S	S	*	.	H	α-helix	trans	-65.3	-33	169.5	-73.1	178.4	22.5	0	0	112.6	Q1590 I1591	Q1590-Q1594 WeakPolarHBondContact O-CB 3.34Å; Q1590-Q1594 VanDerWaalsContact O-CG 3.25Å; Q1590-Q1594 WeakPolarHBondContact O-CG 3.36Å; Q1590-Q1594 PolarHBondContact O-N 3.2Å; I1591-Q1594 CarbonylContact O-C 3.19Å; I1591-Q1594 WeakPolarHBondContact O-CB 3.36Å; I1591-Q1594 PolarHBondContact O-N 2.99Å
1595	F	59.9	Low	59.3	Low	52.2 Å²	52.2	90.1 Å²	90.1	23%	0.229	44%	0.444	C	S	.	.	H	α-helix	trans	-71.7	-35.5	174.1	-75.7	-57.5	0	0	0	112.8	W1568 I1591 N1592 D1593 R1741 M1743	W1568-F1595 HydrophobicContact CH2-CE2 4.37Å; W1568-F1595 AromaticContact CZ2-CE2 3.67Å; W1568-F1595 HydrophobicContact CZ2-CE2 4.03Å; W1568-F1595 HydrophobicContact CZ2-CZ 4.24Å; I1591-F1595 HydrophobicContact CB-CE2 4.38Å; I1591-F1595 HydrophobicContact CG2-CD2 3.72Å; I1591-F1595 VanDerWaalsContact CG2-CD2 3.48Å; I1591-F1595 HydrophobicContact CG2-CE1 4.18Å; I1591-F1595 HydrophobicContact CG2-CE2 3.27Å; I1591-F1595 HydrophobicContact CG2-CZ 4Å; I1591-F1595 VanDerWaalsContact O-CD2 3.24Å; I1591-F1595 WeakPolarHBondContact O-CD2 3.39Å; I1591-F1595 VanDerWaalsContact O-CG 3.22Å; I1591-F1595 WeakPolarHBondContact O-CG 3.42Å; I1591-F1595 PolarHBondContact O-N 3.04Å; N1592-F1595 VanDerWaalsContact CA-CD2 3.48Å; N1592-F1595 HydrophobicContact CB-CD2 4.39Å; N1592-F1595 WeakPolarHBondContact O-CB 3.28Å; N1592-F1595 PolarHBondContact O-N 2.99Å; N1592-F1595 VanDerWaalsContact OD1-CD2 3.31Å; N1592-F1595 WeakPolarHBondContact OD1-CD2 3.24Å; D1593-F1595 VanDerWaalsContact C-N 3.32Å; D1593-F1595 PolarHBondContact O-N 3.41Å; F1595-R1741 HydrophobicContact CD1-CB 4.47Å; F1595-R1741 HydrophobicContact CD1-CG 4.32Å; F1595-R1741 HydrophobicContact CE1-CG 4.36Å; F1595-M1743 HydrophobicContact CD2-CE 4.28Å; F1595-M1743 HydrophobicContact CD2-SD 3.93Å; F1595-M1743 VanDerWaalsContact CD2-SD 3.56Å; F1595-M1743 HydrophobicContact CE2-CE 4.26Å; F1595-M1743 HydrophobicContact CE2-SD 3.86Å; F1595-M1743 WeakPolarHBondContact CE2-SD 3.37Å; F1595-M1743 HydrophobicContact CG-SD 4.35Å; F1595-M1743 HydrophobicContact CZ-SD 4.1Å
1596	N	55.3	Low	58.3	Low	97 Å²	97	92.2 Å²	92.2	52%	0.519	47%	0.473	S	S	.	.	H	α-helix	trans	-83	-34.8	-178.3	-76.1	-34.5	0	0	0	113.4	N1592 D1593 K1598	N1592-N1596 VanDerWaalsContact O-CB 3.32Å; N1592-N1596 WeakPolarHBondContact O-CB 3.34Å; N1592-N1596 PolarHBondContact O-N 3.05Å; N1592-N1596 PolarHBondContact O-ND2 3.18Å; N1592-N1596 VanDerWaalsContact O-ND2 3.13Å; D1593-N1596 PolarHBondContact O-N 2.91Å; D1593-N1596 VanDerWaalsContact O-N 3.17Å; N1596-K1598 PolarHBondContact O-N 3.27Å; N1596-K1598 VanDerWaalsContact O-N 3.1Å
1597	N	50.6	Low	57.8	Low	76.2 Å²	76.2	89.8 Å²	89.8	41%	0.407	46%	0.464	S	S	.	.	S	Bend	trans	-73.6	117.3	175.7	-76.2	-44.6	0	0	0	110	D1593 N1599	D1593-N1597 VanDerWaalsContact CG-ND2 3.29Å; D1593-N1597 VanDerWaalsContact O-CB 3.25Å; D1593-N1597 WeakPolarHBondContact O-CB 3.32Å; D1593-N1597 PolarHBondContact O-N 3.11Å; D1593-N1597 PolarHBondContact O-ND2 3.22Å; D1593-N1597 VanDerWaalsContact O-ND2 3.11Å; D1593-N1597 PolarHBondContact OD1-ND2 3.01Å; D1593-N1597 VanDerWaalsContact OD1-ND2 3.08Å; D1593-N1597 PolarHBondContact OD2-ND2 2.95Å; N1597-N1599 PolarHBondContact O-N 3.21Å
1598	K	46.1	Very low	57.5	Low	193 Å²	193	90.4 Å²	90.4	84%	0.839	47%	0.469	S	S	*	.			trans	-66.4	35	178.3	-70.7	-177.1	176.8	176.6	0	114	N1596 K1600	N1596-K1598 PolarHBondContact O-N 3.27Å; N1596-K1598 VanDerWaalsContact O-N 3.1Å; K1598-K1600 VanDerWaalsContact C-N 3.3Å; K1598-K1600 PolarHBondContact O-N 3.14Å; K1598-K1600 VanDerWaalsContact O-N 3.13Å
1599	N	42.3	Very low	57.6	Low	132.4 Å²	132.4	93.8 Å²	93.8	71%	0.708	49%	0.485	S	S	*	.			trans	-69.8	101.6	171.8	-69.3	-17.6	0	0	0	107.6	N1597 R1741	N1597-N1599 PolarHBondContact O-N 3.21Å; N1599-R1741 PolarHBondContact O-NH2 3.07Å
1600	K	43.6	Very low	58.1	Low	142 Å²	142	88.6 Å²	88.6	62%	0.617	47%	0.465	S	S	*	.			trans	-55.6	134.5	172.6	-73.2	179.2	176.1	-179.8	0	108	K1598 T1602	K1598-K1600 VanDerWaalsContact C-N 3.3Å; K1598-K1600 PolarHBondContact O-N 3.14Å; K1598-K1600 VanDerWaalsContact O-N 3.13Å; K1600-T1602 PolarHBondContact O-N 3.14Å; K1600-T1602 VanDerWaalsContact O-N 3.08Å
1601	P	45.7	Very low	58.6	Low	82.8 Å²	82.8	86.6 Å²	86.6	54%	0.538	46%	0.462	S	S	.	.			trans	-58.9	110.3	174.8	24.2	-31.6	0	0	0	108.3	L1603	P1601-L1603 VanDerWaalsContact C-N 3.33Å; P1601-L1603 PolarHBondContact O-N 3.07Å; P1601-L1603 VanDerWaalsContact O-N 3.08Å
1602	T	44.4	Very low	58.9	Low	123 Å²	123	88.5 Å²	88.5	76%	0.755	48%	0.476	S	S	*	.			trans	-75.7	103.2	172.3	47.6	0	0	0	0	107	K1600 S1604	K1600-T1602 PolarHBondContact O-N 3.14Å; K1600-T1602 VanDerWaalsContact O-N 3.08Å; T1602-S1604 PolarHBondContact O-N 3.09Å; T1602-S1604 VanDerWaalsContact O-N 3.14Å
1603	L	47.1	Very low	59.3	Low	81.6 Å²	81.6	92.7 Å²	92.7	43%	0.427	50%	0.497	S	S	.	.			trans	-54	118.6	172.9	-81.8	105.4	0	0	0	108.7	P1601 Q1607 H1609 M1649 K1653	P1601-L1603 VanDerWaalsContact C-N 3.33Å; P1601-L1603 PolarHBondContact O-N 3.07Å; P1601-L1603 VanDerWaalsContact O-N 3.08Å; L1603-Q1607 HydrophobicContact CD2-CB 4.48Å; L1603-H1609 HydrophobicContact CD2-CB 4.21Å; L1603-M1649 HydrophobicContact CB-CE 4.38Å; L1603-K1653 HydrophobicContact CD1-CD 4.21Å
1604	S	48.8	Very low	60	Low	69 Å²	69	91.8 Å²	91.8	48%	0.483	49%	0.492	S	S	.	.			trans	-71	139.5	172.8	60.3	0	0	0	0	108.8	T1602 G1606 Q1607	T1602-S1604 PolarHBondContact O-N 3.09Å; T1602-S1604 VanDerWaalsContact O-N 3.14Å; S1604-G1606 PolarHBondContact O-N 3.24Å; S1604-G1606 VanDerWaalsContact O-N 3.09Å; S1604-Q1607 VanDerWaalsContact N-OE1 3.14Å; S1604-Q1607 PolarHBondContact O-N 3.06Å; S1604-Q1607 VanDerWaalsContact OG-CD 3.27Å; S1604-Q1607 WeakPolarHBondContact OG-CG 3.4Å; S1604-Q1607 PolarHBondContact OG-NE2 3.34Å; S1604-Q1607 PolarHBondContact OG-OE1 3.47Å; S1604-Q1607 VanDerWaalsContact OG-OE1 3.1Å
1605	K	47.1	Very low	60.9	Low	215.4 Å²	215.4	85.6 Å²	85.6	94%	0.937	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	111.9	179.8	-76.4	-178.4	176.6	178.1	0	109.7
1606	G	56.9	Low	61.8	Low	70 Å²	70	86.3 Å²	86.3	72%	0.722	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	122.5	-8	175.9	0	0	0	0	0	116	S1604	S1604-G1606 PolarHBondContact O-N 3.24Å; S1604-G1606 VanDerWaalsContact O-N 3.09Å
1607	Q	65	Low	62.9	Low	68 Å²	68	85.2 Å²	85.2	32%	0.318	46%	0.459	S	S	.	.			trans	-70.6	143.5	176.4	-73.7	174.8	-39.3	0	0	112.3	I1552 L1603 S1604 H1609	I1552-Q1607 HydrophobicContact CD1-CB 4.39Å; I1552-Q1607 HydrophobicContact CG1-CB 4.39Å; L1603-Q1607 HydrophobicContact CD2-CB 4.48Å; S1604-Q1607 VanDerWaalsContact N-OE1 3.14Å; S1604-Q1607 PolarHBondContact O-N 3.06Å; S1604-Q1607 VanDerWaalsContact OG-CD 3.27Å; S1604-Q1607 WeakPolarHBondContact OG-CG 3.4Å; S1604-Q1607 PolarHBondContact OG-NE2 3.34Å; S1604-Q1607 PolarHBondContact OG-OE1 3.47Å; S1604-Q1607 VanDerWaalsContact OG-OE1 3.1Å; Q1607-H1609 PolarHBondContact O-N 3.33Å
1608	P	70.8	Confident	64.5	Low	32.2 Å²	32.2	81.7 Å²	81.7	21%	0.209	44%	0.44	C	S	.	.			trans	-64.1	131.5	173.1	28.3	-34.9	0	0	0	110.2	L1551 I1552 W1555	L1551-P1608 HydrophobicContact CB-CB 4.25Å; L1551-P1608 HydrophobicContact CB-CG 4.32Å; I1552-P1608 HydrophobicContact CB-CG 4.45Å; I1552-P1608 HydrophobicContact CG1-CG 3.92Å; W1555-P1608 HydrophobicContact CB-CG 3.87Å; W1555-P1608 HydrophobicContact CD2-CG 4.44Å; W1555-P1608 HydrophobicContact CG-CG 4.11Å
1609	H	77.6	Confident	66.3	Low	71.4 Å²	71.4	72.6 Å²	72.6	33%	0.331	40%	0.4	S	S	.	.			trans	-138	134.4	-179.1	172.3	63.5	0	0	0	109.1	H1544 D1548 L1603 Q1607 P1611 K1653	H1544-H1609 AromaticContact CE1-CE1 3.37Å; H1544-H1609 PolarHBondContact CE1-CE1 3.16Å; H1544-H1609 VanDerWaalsContact CE1-CE1 3.44Å; H1544-H1609 AromaticContact CE1-NE2 3.87Å; H1544-H1609 AromaticContact NE2-CE1 3.15Å; H1544-H1609 PolarHBondContact NE2-CE1 3.22Å; H1544-H1609 AromaticContact NE2-ND1 3.73Å; H1544-H1609 AromaticContact NE2-NE2 3.85Å; D1548-H1609 VanDerWaalsContact CG-ND1 3.3Å; D1548-H1609 WeakPolarHBondContact OD1-CA 3.48Å; D1548-H1609 IonicContact OD1-CE1 3.28Å; D1548-H1609 IonicContact OD1-CG 3.38Å; D1548-H1609 IonicContact OD1-ND1 3.37Å; D1548-H1609 PolarHBondContact OD1-ND1 3.05Å; D1548-H1609 IonicContact OD2-CE1 3.47Å; D1548-H1609 PolarHBondContact OD2-CE1 2.9Å; D1548-H1609 VanDerWaalsContact OD2-CE1 3.23Å; D1548-H1609 IonicContact OD2-CG 2.84Å; D1548-H1609 IonicContact OD2-ND1 3.49Å; D1548-H1609 PolarHBondContact OD2-ND1 3.16Å; L1603-H1609 HydrophobicContact CD2-CB 4.21Å; Q1607-H1609 PolarHBondContact O-N 3.33Å; H1609-P1611 VanDerWaalsContact O-CD 3.31Å; H1609-P1611 WeakPolarHBondContact O-CD 3.34Å; H1609-K1653 WeakPolarHBondContact CE1-CE 3.25Å; H1609-K1653 PolarHBondContact CE1-NZ 3.12Å; H1609-K1653 VanDerWaalsContact CE1-NZ 3.31Å; H1609-K1653 PolarHBondContact ND1-NZ 2.89Å; H1609-K1653 WeakPolarHBondContact NE2-CE 3.45Å
1610	L	81.9	Confident	68	Low	8.6 Å²	8.6	68 Å²	68	5%	0.045	38%	0.377	C	S	.	.			trans	-73.4	119.4	174.2	-175.1	70.3	0	0	0	109.2	L1523 H1544 I1547 D1548 L1551 S1612 L1614 L1615	L1523-L1610 HydrophobicContact CD1-CD1 4.06Å; L1523-L1610 HydrophobicContact CD1-CD2 4.33Å; L1523-L1610 HydrophobicContact CD2-CD1 4.04Å; L1523-L1610 HydrophobicContact CD2-CD2 4.39Å; H1544-L1610 PolarHBondContact CE1-O 3.09Å; H1544-L1610 VanDerWaalsContact CE1-O 3.27Å; H1544-L1610 PolarHBondContact NE2-O 3.25Å; I1547-L1610 HydrophobicContact CG2-CB 4.5Å; I1547-L1610 HydrophobicContact CG2-CD2 3.94Å; D1548-L1610 WeakPolarHBondContact OD1-CB 3.25Å; D1548-L1610 PolarHBondContact OD1-N 3.2Å; L1551-L1610 HydrophobicContact CD1-CB 4.04Å; L1610-S1612 PolarHBondContact O-N 3.05Å; L1610-L1614 HydrophobicContact CD1-CB 4.19Å; L1610-L1614 HydrophobicContact CD1-CD2 3.58Å; L1610-L1614 HydrophobicContact CD1-CG 3.94Å; L1610-L1614 HydrophobicContact CG-CB 4.48Å; L1610-L1615 HydrophobicContact CD2-CB 3.87Å; L1610-L1615 HydrophobicContact CD2-CD1 4.08Å; L1610-L1615 HydrophobicContact CD2-CG 4.49Å; L1610-L1615 HydrophobicContact CG-CB 4.37Å
1611	P	81.8	Confident	69.7	Low	71.8 Å²	71.8	61.7 Å²	61.7	47%	0.466	35%	0.353	S	S	.	.			trans	-60.3	134.8	176.6	-23.5	34.6	0	0	0	111.2	H1609 L1613 L1614 L1615	H1609-P1611 VanDerWaalsContact O-CD 3.31Å; H1609-P1611 WeakPolarHBondContact O-CD 3.34Å; P1611-L1613 PolarHBondContact O-N 3.23Å; P1611-L1613 VanDerWaalsContact O-N 3.11Å; P1611-L1614 WeakPolarHBondContact O-CA 3.44Å; P1611-L1614 WeakPolarHBondContact O-CB 3.35Å; P1611-L1614 PolarHBondContact O-N 3.23Å; P1611-L1615 PolarHBondContact O-N 3.11Å
1612	S	76.5	Confident	71.6	Confident	46.4 Å²	46.4	57.8 Å²	57.8	32%	0.324	33%	0.327	S	S	.	.	H	α-helix	trans	-55.2	-31.3	-176.8	-48.9	0	0	0	0	113.7	H1544 L1610 L1614 L1615 Y1616 L1662	H1544-S1612 PolarHBondContact CE1-OG 3.34Å; L1610-S1612 PolarHBondContact O-N 3.05Å; S1612-L1614 VanDerWaalsContact C-N 3.34Å; S1612-L1614 PolarHBondContact O-N 2.94Å; S1612-L1615 PolarHBondContact O-N 3.37Å; S1612-Y1616 WeakPolarHBondContact O-CB 3.37Å; S1612-Y1616 PolarHBondContact O-N 3.08Å; S1612-L1662 WeakPolarHBondContact O-CD1 3.39Å
1613	L	75.6	Confident	73.2	Confident	100.6 Å²	100.6	53.4 Å²	53.4	53%	0.527	30%	0.298	S	S	.	.	H	α-helix	trans	-62.7	-40.1	174	-179.3	67.2	0	0	0	112.2	P1611 Y1616 I1617 W1660	P1611-L1613 PolarHBondContact O-N 3.23Å; P1611-L1613 VanDerWaalsContact O-N 3.11Å; L1613-Y1616 WeakPolarHBondContact O-CB 3.21Å; L1613-Y1616 PolarHBondContact O-N 3.26Å; L1613-I1617 HydrophobicContact CD1-CD1 4.15Å; L1613-I1617 HydrophobicContact CD1-CG1 4.31Å; L1613-I1617 HydrophobicContact CD2-CD1 4.35Å; L1613-I1617 HydrophobicContact CG-CD1 4.14Å; L1613-I1617 WeakPolarHBondContact O-CD1 3.49Å; L1613-I1617 VanDerWaalsContact O-CG1 3.27Å; L1613-I1617 WeakPolarHBondContact O-CG1 3.4Å; L1613-I1617 PolarHBondContact O-N 2.98Å; L1613-W1660 HydrophobicContact CB-CZ2 4.24Å; L1613-W1660 HydrophobicContact CD1-CD2 4.43Å; L1613-W1660 HydrophobicContact CD1-CE3 4.35Å; L1613-W1660 HydrophobicContact CD1-CH2 3.62Å; L1613-W1660 HydrophobicContact CD1-CZ2 3.81Å; L1613-W1660 HydrophobicContact CD1-CZ3 3.9Å; L1613-W1660 HydrophobicContact CD2-CZ2 4.45Å; L1613-W1660 HydrophobicContact CG-CZ2 4.43Å
1614	L	78.5	Confident	74.7	Confident	59.8 Å²	59.8	49.8 Å²	49.8	31%	0.313	28%	0.28	S	S	.	.	H	α-helix	trans	-70.5	-39	179.4	-173.8	57.2	0	0	0	111	L1610 P1611 S1612 Y1616 I1617 L1618 Y1697	L1610-L1614 HydrophobicContact CD1-CB 4.19Å; L1610-L1614 HydrophobicContact CD1-CD2 3.58Å; L1610-L1614 HydrophobicContact CD1-CG 3.94Å; L1610-L1614 HydrophobicContact CG-CB 4.48Å; P1611-L1614 WeakPolarHBondContact O-CA 3.44Å; P1611-L1614 WeakPolarHBondContact O-CB 3.35Å; P1611-L1614 PolarHBondContact O-N 3.23Å; S1612-L1614 VanDerWaalsContact C-N 3.34Å; S1612-L1614 PolarHBondContact O-N 2.94Å; L1614-Y1616 VanDerWaalsContact C-N 3.32Å; L1614-Y1616 PolarHBondContact O-N 2.94Å; L1614-I1617 PolarHBondContact O-N 3.32Å; L1614-L1618 WeakPolarHBondContact O-CB 3.36Å; L1614-L1618 PolarHBondContact O-N 3.19Å; L1614-Y1697 HydrophobicContact CD2-CE1 4.26Å
1615	L	82.5	Confident	76.2	Confident	4.2 Å²	4.2	46.5 Å²	46.5	2%	0.022	26%	0.257	C	S	.	.	H	α-helix	trans	-59.9	-44	170.4	-178.4	63.3	0	0	0	111.4	H1544 I1547 L1610 P1611 S1612 I1617 L1618 L1619 L1662	H1544-L1615 HydrophobicContact CB-CD2 3.6Å; H1544-L1615 VanDerWaalsContact CG-CD2 3.48Å; I1547-L1615 HydrophobicContact CD1-CD1 3.97Å; L1610-L1615 HydrophobicContact CD2-CB 3.87Å; L1610-L1615 HydrophobicContact CD2-CD1 4.08Å; L1610-L1615 HydrophobicContact CD2-CG 4.49Å; L1610-L1615 HydrophobicContact CG-CB 4.37Å; P1611-L1615 PolarHBondContact O-N 3.11Å; S1612-L1615 PolarHBondContact O-N 3.37Å; L1615-I1617 VanDerWaalsContact C-N 3.33Å; L1615-I1617 PolarHBondContact O-N 3.38Å; L1615-L1618 HydrophobicContact CD1-CD2 4.44Å; L1615-L1618 WeakPolarHBondContact O-CB 3.17Å; L1615-L1618 PolarHBondContact O-N 3.14Å; L1615-L1619 HydrophobicContact CD1-CD1 4.22Å; L1615-L1619 HydrophobicContact CD1-CG 4.24Å; L1615-L1619 HydrophobicContact CG-CD1 4.04Å; L1615-L1619 HydrophobicContact CG-CG 4.42Å; L1615-L1619 WeakPolarHBondContact O-CB 3.41Å; L1615-L1619 WeakPolarHBondContact O-CG 3.2Å; L1615-L1619 PolarHBondContact O-N 3.2Å; L1615-L1662 HydrophobicContact CD2-CD1 4.39Å; L1615-L1662 HydrophobicContact CD2-CD2 4.17Å; L1615-L1662 HydrophobicContact CG-CD2 4.36Å
1616	Y	78.7	Confident	77.7	Confident	67.2 Å²	67.2	36.7 Å²	36.7	26%	0.264	21%	0.214	S	C	.	.	H	α-helix	trans	-62.2	-41.3	176.9	-179.1	-92.1	0	0	0	112.4	R815 S1612 L1613 L1614 L1618 L1619 T1620 F1629 N1630 W1660 L1662	R815-Y1616 PolarHBondContact NH1-OH 3.49Å; R815-Y1616 PolarHBondContact NH2-OH 3.09Å; S1612-Y1616 WeakPolarHBondContact O-CB 3.37Å; S1612-Y1616 PolarHBondContact O-N 3.08Å; L1613-Y1616 WeakPolarHBondContact O-CB 3.21Å; L1613-Y1616 PolarHBondContact O-N 3.26Å; L1614-Y1616 VanDerWaalsContact C-N 3.32Å; L1614-Y1616 PolarHBondContact O-N 2.94Å; Y1616-L1618 VanDerWaalsContact C-N 3.34Å; Y1616-L1618 PolarHBondContact O-N 3.48Å; Y1616-L1619 PolarHBondContact O-N 3.11Å; Y1616-T1620 HydrophobicContact CD1-CG2 3.87Å; Y1616-T1620 HydrophobicContact CE1-CG2 3.47Å; Y1616-T1620 VanDerWaalsContact CE1-CG2 3.47Å; Y1616-T1620 WeakPolarHBondContact CE1-OG1 3.41Å; Y1616-T1620 HydrophobicContact CE2-CG2 4.42Å; Y1616-T1620 HydrophobicContact CG-CG2 4.49Å; Y1616-T1620 VanDerWaalsContact O-CB 3.25Å; Y1616-T1620 WeakPolarHBondContact O-CB 3.41Å; Y1616-T1620 VanDerWaalsContact O-CG2 3.31Å; Y1616-T1620 WeakPolarHBondContact O-CG2 3.34Å; Y1616-T1620 PolarHBondContact O-N 3.15Å; Y1616-T1620 PolarHBondContact O-OG1 3.07Å; Y1616-F1629 HydrophobicContact CD2-CE2 4.3Å; Y1616-F1629 AromaticContact CD2-CZ 3.78Å; Y1616-F1629 HydrophobicContact CD2-CZ 3.95Å; Y1616-F1629 HydrophobicContact CE2-CE1 4.41Å; Y1616-F1629 HydrophobicContact CE2-CE2 4.31Å; Y1616-F1629 AromaticContact CE2-CZ 3.71Å; Y1616-F1629 HydrophobicContact CE2-CZ 3.86Å; Y1616-F1629 HydrophobicContact CG-CZ 4.49Å; Y1616-N1630 PolarHBondContact OH-ND2 2.78Å; Y1616-N1630 VanDerWaalsContact OH-ND2 3.15Å; Y1616-W1660 HydrophobicContact CD1-CE3 4.33Å; Y1616-W1660 HydrophobicContact CD2-CB 4.3Å; Y1616-W1660 HydrophobicContact CD2-CE3 4.45Å; Y1616-W1660 HydrophobicContact CG-CE3 4.32Å; Y1616-L1662 HydrophobicContact CD2-CD2 3.85Å
1617	I	79.8	Confident	78.2	Confident	74.6 Å²	74.6	34 Å²	34	38%	0.383	18%	0.184	S	C	.	.	H	α-helix	trans	-62	-44.5	175.1	-69.7	163.9	0	0	0	110.5	L1613 L1614 L1615 T1620 G1621	L1613-I1617 HydrophobicContact CD1-CD1 4.15Å; L1613-I1617 HydrophobicContact CD1-CG1 4.31Å; L1613-I1617 HydrophobicContact CD2-CD1 4.35Å; L1613-I1617 HydrophobicContact CG-CD1 4.14Å; L1613-I1617 WeakPolarHBondContact O-CD1 3.49Å; L1613-I1617 VanDerWaalsContact O-CG1 3.27Å; L1613-I1617 WeakPolarHBondContact O-CG1 3.4Å; L1613-I1617 PolarHBondContact O-N 2.98Å; L1614-I1617 PolarHBondContact O-N 3.32Å; L1615-I1617 VanDerWaalsContact C-N 3.33Å; L1615-I1617 PolarHBondContact O-N 3.38Å; I1617-T1620 VanDerWaalsContact CA-OG1 3.32Å; I1617-T1620 WeakPolarHBondContact CA-OG1 3.31Å; I1617-T1620 PolarHBondContact O-N 3.16Å; I1617-T1620 PolarHBondContact O-OG1 3.09Å; I1617-G1621 PolarHBondContact O-N 3.14Å
1618	L	83.7	Confident	78.1	Confident	1.2 Å²	1.2	31.5 Å²	31.5	1%	0.006	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-50.3	177.2	-180	103.7	0	0	0	111.8	V1515 C1519 L1523 T1527 L1614 L1615 Y1616 T1620 G1621 L1622	V1515-L1618 HydrophobicContact CG1-CD1 3.74Å; V1515-L1618 HydrophobicContact CG1-CG 4.34Å; C1519-L1618 HydrophobicContact CB-CD1 3.77Å; L1523-L1618 HydrophobicContact CD1-CD2 4.43Å; L1523-L1618 HydrophobicContact CD2-CB 4.44Å; L1523-L1618 HydrophobicContact CD2-CD1 3.4Å; L1523-L1618 VanDerWaalsContact CD2-CD1 3.4Å; L1523-L1618 HydrophobicContact CD2-CD2 4.11Å; L1523-L1618 HydrophobicContact CD2-CG 4.05Å; L1523-L1618 HydrophobicContact CG-CD2 3.99Å; T1527-L1618 HydrophobicContact CG2-CD2 3.73Å; T1527-L1618 VanDerWaalsContact OG1-CD2 3.24Å; T1527-L1618 WeakPolarHBondContact OG1-CD2 3.37Å; L1614-L1618 WeakPolarHBondContact O-CB 3.36Å; L1614-L1618 PolarHBondContact O-N 3.19Å; L1615-L1618 HydrophobicContact CD1-CD2 4.44Å; L1615-L1618 WeakPolarHBondContact O-CB 3.17Å; L1615-L1618 PolarHBondContact O-N 3.14Å; Y1616-L1618 VanDerWaalsContact C-N 3.34Å; Y1616-L1618 PolarHBondContact O-N 3.48Å; L1618-T1620 VanDerWaalsContact C-N 3.31Å; L1618-T1620 PolarHBondContact O-N 3.24Å; L1618-G1621 CarbonylContact O-C 3.59Å; L1618-G1621 WeakPolarHBondContact O-CA 3.19Å; L1618-G1621 PolarHBondContact O-N 3.22Å; L1618-G1621 VanDerWaalsContact O-N 3.16Å; L1618-L1622 HydrophobicContact CD1-CD1 4.46Å; L1618-L1622 HydrophobicContact CD2-CD1 3.88Å; L1618-L1622 HydrophobicContact CD2-CG 4.36Å; L1618-L1622 HydrophobicContact CG-CD1 4.27Å; L1618-L1622 WeakPolarHBondContact O-CG 3.31Å; L1618-L1622 PolarHBondContact O-N 3.02Å
1619	L	82.9	Confident	77.7	Confident	1.8 Å²	1.8	30.5 Å²	30.5	1%	0.009	17%	0.169	C	C	.	.	H	α-helix	trans	-65.4	-35.1	179.6	-68.6	176.2	0	0	0	111.9	T1527 T1540 L1543 L1615 Y1616 G1621 L1622 H1623 L1626 F1629 L1662 L1667	T1527-L1619 HydrophobicContact CG2-CD2 4.47Å; T1540-L1619 HydrophobicContact CG2-CD1 4.42Å; L1543-L1619 HydrophobicContact CD2-CD2 4.04Å; L1615-L1619 HydrophobicContact CD1-CD1 4.22Å; L1615-L1619 HydrophobicContact CD1-CG 4.24Å; L1615-L1619 HydrophobicContact CG-CD1 4.04Å; L1615-L1619 HydrophobicContact CG-CG 4.42Å; L1615-L1619 WeakPolarHBondContact O-CB 3.41Å; L1615-L1619 WeakPolarHBondContact O-CG 3.2Å; L1615-L1619 PolarHBondContact O-N 3.2Å; Y1616-L1619 PolarHBondContact O-N 3.11Å; L1619-G1621 VanDerWaalsContact C-N 3.33Å; L1619-G1621 PolarHBondContact O-N 3.01Å; L1619-L1622 CarbonylContact O-C 3.52Å; L1619-L1622 PolarHBondContact O-N 3.2Å; L1619-H1623 WeakPolarHBondContact O-CA 3.26Å; L1619-H1623 PolarHBondContact O-N 2.96Å; L1619-L1626 HydrophobicContact CD2-CD1 3.91Å; L1619-F1629 VanDerWaalsContact C-CE1 3.43Å; L1619-F1629 HydrophobicContact CB-CD1 4.19Å; L1619-F1629 HydrophobicContact CB-CD2 4.04Å; L1619-F1629 HydrophobicContact CB-CE1 3.75Å; L1619-F1629 VanDerWaalsContact CB-CE1 3.48Å; L1619-F1629 HydrophobicContact CB-CE2 3.58Å; L1619-F1629 VanDerWaalsContact CB-CE2 3.45Å; L1619-F1629 HydrophobicContact CB-CG 4.29Å; L1619-F1629 HydrophobicContact CB-CZ 3.43Å; L1619-F1629 VanDerWaalsContact CB-CZ 3.45Å; L1619-F1629 HydrophobicContact CD1-CD2 4.01Å; L1619-F1629 HydrophobicContact CD1-CE2 3.64Å; L1619-F1629 HydrophobicContact CD1-CZ 4.25Å; L1619-F1629 HydrophobicContact CG-CD2 4.39Å; L1619-F1629 HydrophobicContact CG-CE2 4.25Å; L1619-F1629 HydrophobicContact CG-CZ 4.35Å; L1619-F1629 WeakPolarHBondContact O-CD1 3.28Å; L1619-F1629 WeakPolarHBondContact O-CE1 3.27Å; L1619-L1662 HydrophobicContact CD1-CD2 3.9Å; L1619-L1667 HydrophobicContact CD1-CD1 4.4Å; L1619-L1667 HydrophobicContact CD2-CD1 4.12Å
1620	T	79.2	Confident	76.6	Confident	35.8 Å²	35.8	30.4 Å²	30.4	22%	0.22	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-37.5	172.9	-43.8	0	0	0	0	111.7	Y1616 I1617 L1618 L1622 H1623 F1629	Y1616-T1620 HydrophobicContact CD1-CG2 3.87Å; Y1616-T1620 HydrophobicContact CE1-CG2 3.47Å; Y1616-T1620 VanDerWaalsContact CE1-CG2 3.47Å; Y1616-T1620 WeakPolarHBondContact CE1-OG1 3.41Å; Y1616-T1620 HydrophobicContact CE2-CG2 4.42Å; Y1616-T1620 HydrophobicContact CG-CG2 4.49Å; Y1616-T1620 VanDerWaalsContact O-CB 3.25Å; Y1616-T1620 WeakPolarHBondContact O-CB 3.41Å; Y1616-T1620 VanDerWaalsContact O-CG2 3.31Å; Y1616-T1620 WeakPolarHBondContact O-CG2 3.34Å; Y1616-T1620 PolarHBondContact O-N 3.15Å; Y1616-T1620 PolarHBondContact O-OG1 3.07Å; I1617-T1620 VanDerWaalsContact CA-OG1 3.32Å; I1617-T1620 WeakPolarHBondContact CA-OG1 3.31Å; I1617-T1620 PolarHBondContact O-N 3.16Å; I1617-T1620 PolarHBondContact O-OG1 3.09Å; L1618-T1620 VanDerWaalsContact C-N 3.31Å; L1618-T1620 PolarHBondContact O-N 3.24Å; T1620-L1622 VanDerWaalsContact C-N 3.33Å; T1620-H1623 VanDerWaalsContact O-CB 3.27Å; T1620-H1623 WeakPolarHBondContact O-CB 3.35Å; T1620-H1623 PolarHBondContact O-N 2.99Å; T1620-F1629 HydrophobicContact CG2-CE1 3.61Å; T1620-F1629 HydrophobicContact CG2-CZ 3.88Å
1621	G	79.7	Confident	75.1	Confident	11.2 Å²	11.2	32.6 Å²	32.6	12%	0.115	18%	0.183	C	C	.	.	H	α-helix	trans	-64.6	-38.6	172.8	0	0	0	0	0	113.1	R1514 V1515 I1617 L1618 L1619 H1623 P1624	R1514-G1621 PolarHBondContact NH1-O 3.07Å; R1514-G1621 PolarHBondContact NH2-O 3.07Å; V1515-G1621 VanDerWaalsContact CG2-C 3.44Å; V1515-G1621 VanDerWaalsContact CG2-O 3.31Å; V1515-G1621 WeakPolarHBondContact CG2-O 3.32Å; I1617-G1621 PolarHBondContact O-N 3.14Å; L1618-G1621 CarbonylContact O-C 3.59Å; L1618-G1621 WeakPolarHBondContact O-CA 3.19Å; L1618-G1621 PolarHBondContact O-N 3.22Å; L1618-G1621 VanDerWaalsContact O-N 3.16Å; L1619-G1621 VanDerWaalsContact C-N 3.33Å; L1619-G1621 PolarHBondContact O-N 3.01Å; G1621-H1623 VanDerWaalsContact C-N 3.34Å; G1621-P1624 WeakPolarHBondContact O-CD 3.24Å
1622	L	85.1	Confident	73.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-85.5	-7.9	179	-68.1	176.2	0	0	0	114.3	V1515 T1524 T1527 L1528 L1618 L1619 T1620 P1624 L1625 L1626	V1515-L1622 HydrophobicContact CB-CD2 4.11Å; V1515-L1622 HydrophobicContact CG1-CD2 4.07Å; V1515-L1622 HydrophobicContact CG1-CG 4.08Å; V1515-L1622 HydrophobicContact CG2-CD2 3.9Å; V1515-L1622 HydrophobicContact CG2-CG 4.27Å; T1524-L1622 HydrophobicContact CG2-CD2 4.42Å; T1527-L1622 HydrophobicContact CG2-CD1 4.24Å; L1528-L1622 HydrophobicContact CD1-CD2 4.27Å; L1528-L1622 HydrophobicContact CD2-CD1 3.92Å; L1528-L1622 HydrophobicContact CD2-CD2 4.01Å; L1528-L1622 HydrophobicContact CD2-CG 4.49Å; L1528-L1622 HydrophobicContact CG-CD1 4.22Å; L1528-L1622 HydrophobicContact CG-CD2 4.37Å; L1618-L1622 HydrophobicContact CD1-CD1 4.46Å; L1618-L1622 HydrophobicContact CD2-CD1 3.88Å; L1618-L1622 HydrophobicContact CD2-CG 4.36Å; L1618-L1622 HydrophobicContact CG-CD1 4.27Å; L1618-L1622 WeakPolarHBondContact O-CG 3.31Å; L1618-L1622 PolarHBondContact O-N 3.02Å; L1619-L1622 CarbonylContact O-C 3.52Å; L1619-L1622 PolarHBondContact O-N 3.2Å; T1620-L1622 VanDerWaalsContact C-N 3.33Å; L1622-P1624 VanDerWaalsContact C-N 3.29Å; L1622-P1624 WeakPolarHBondContact O-CD 3.25Å; L1622-P1624 VanDerWaalsContact O-N 3.1Å; L1622-L1625 HydrophobicContact CD2-CD1 4.39Å; L1622-L1625 WeakPolarHBondContact O-CA 2.86Å; L1622-L1625 WeakPolarHBondContact O-CB 3.45Å; L1622-L1625 PolarHBondContact O-N 2.92Å; L1622-L1626 HydrophobicContact CB-CD1 3.79Å; L1622-L1626 HydrophobicContact CB-CG 4.21Å; L1622-L1626 PolarHBondContact O-N 3.15Å
1623	H	78.9	Confident	71.8	Confident	31.2 Å²	31.2	38.1 Å²	38.1	14%	0.144	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46	-39.4	-177.1	178.2	-57.2	0	0	0	114.7	R1485 L1619 T1620 G1621 L1625 L1626 F1629 N1630	R1485-H1623 PolarHBondContact NH1-NE2 2.67Å; R1485-H1623 PolarHBondContact NH2-CD2 3.45Å; R1485-H1623 PolarHBondContact NH2-CE1 3.1Å; R1485-H1623 VanDerWaalsContact NH2-CE1 3.31Å; R1485-H1623 PolarHBondContact NH2-NE2 3.03Å; L1619-H1623 WeakPolarHBondContact O-CA 3.26Å; L1619-H1623 PolarHBondContact O-N 2.96Å; T1620-H1623 VanDerWaalsContact O-CB 3.27Å; T1620-H1623 WeakPolarHBondContact O-CB 3.35Å; T1620-H1623 PolarHBondContact O-N 2.99Å; G1621-H1623 VanDerWaalsContact C-N 3.34Å; H1623-L1625 PolarHBondContact O-N 3.22Å; H1623-L1625 VanDerWaalsContact O-N 3.13Å; H1623-L1626 PolarHBondContact O-N 3.18Å; H1623-L1626 VanDerWaalsContact O-O 3.1Å; H1623-F1629 HydrophobicContact CB-CD1 4.33Å; H1623-F1629 AromaticContact CD2-CD1 3.75Å; H1623-F1629 PolarHBondContact CD2-O 3.5Å; H1623-F1629 PolarHBondContact NE2-O 3.15Å; H1623-N1630 PolarHBondContact CD2-ND2 3.13Å; H1623-N1630 PolarHBondContact NE2-ND2 3.1Å
1624	P	76.7	Confident	70.1	Confident	5.8 Å²	5.8	36.4 Å²	36.4	4%	0.038	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-29.2	176.9	-25.5	36.3	0	0	0	113.9	L1479 D1482 E1483 L1486 V1511 G1621 L1622 S1670	L1479-P1624 HydrophobicContact CD2-CB 4.19Å; L1479-P1624 VanDerWaalsContact CD2-O 3.24Å; L1479-P1624 WeakPolarHBondContact CD2-O 3.29Å; D1482-P1624 HydrophobicContact CB-CB 4.29Å; D1482-P1624 HydrophobicContact CB-CG 4.38Å; E1483-P1624 WeakPolarHBondContact OE1-CG 3.33Å; L1486-P1624 HydrophobicContact CD1-CG 3.92Å; V1511-P1624 HydrophobicContact CG1-CG 4.5Å; G1621-P1624 WeakPolarHBondContact O-CD 3.24Å; L1622-P1624 VanDerWaalsContact C-N 3.29Å; L1622-P1624 WeakPolarHBondContact O-CD 3.25Å; L1622-P1624 VanDerWaalsContact O-N 3.1Å; P1624-S1670 PolarHBondContact O-OG 3.21Å
1625	L	81.9	Confident	68.3	Low	0.2 Å²	0.2	37.5 Å²	37.5	0%	0.001	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-22.2	-178.5	-53.9	-176.6	0	0	0	113	L1479 V1508 V1511 V1512 L1622 H1623 F1669 S1670 I1674 V1678	L1479-L1625 HydrophobicContact CD2-CD2 4.37Å; V1508-L1625 HydrophobicContact CB-CD2 4.42Å; V1508-L1625 HydrophobicContact CG1-CD1 4.3Å; V1508-L1625 HydrophobicContact CG1-CD2 4.11Å; V1508-L1625 HydrophobicContact CG2-CD2 3.99Å; V1511-L1625 HydrophobicContact CB-CD1 4.37Å; V1511-L1625 HydrophobicContact CB-CD2 4.37Å; V1511-L1625 HydrophobicContact CB-CG 4.43Å; V1511-L1625 HydrophobicContact CG1-CD1 3.85Å; V1511-L1625 HydrophobicContact CG1-CD2 4.12Å; V1511-L1625 HydrophobicContact CG1-CG 3.79Å; V1511-L1625 HydrophobicContact CG2-CD2 4.48Å; V1512-L1625 HydrophobicContact CG2-CD1 3.92Å; L1622-L1625 HydrophobicContact CD2-CD1 4.39Å; L1622-L1625 WeakPolarHBondContact O-CA 2.86Å; L1622-L1625 WeakPolarHBondContact O-CB 3.45Å; L1622-L1625 PolarHBondContact O-N 2.92Å; H1623-L1625 PolarHBondContact O-N 3.22Å; H1623-L1625 VanDerWaalsContact O-N 3.13Å; L1625-F1669 HydrophobicContact CB-CD1 4.41Å; L1625-F1669 WeakPolarHBondContact O-CA 3.29Å; L1625-F1669 WeakPolarHBondContact O-CD1 3.32Å; L1625-S1670 PolarHBondContact O-N 3.27Å; L1625-S1670 PolarHBondContact O-OG 3.19Å; L1625-I1674 HydrophobicContact CB-CG2 3.96Å; L1625-I1674 HydrophobicContact CD2-CD1 4.4Å; L1625-I1674 HydrophobicContact CD2-CG2 3.91Å; L1625-I1674 HydrophobicContact CG-CG2 4.36Å; L1625-V1678 HydrophobicContact CD1-CG2 4.4Å
1626	L	77.7	Confident	66.4	Low	8.4 Å²	8.4	41.9 Å²	41.9	4%	0.044	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	158.5	-172.4	-58.6	178.6	0	0	0	112.2	L1531 L1619 L1622 H1623 S1668 F1669	L1531-L1626 HydrophobicContact CD1-CD1 4.28Å; L1531-L1626 HydrophobicContact CD1-CD2 3.85Å; L1619-L1626 HydrophobicContact CD2-CD1 3.91Å; L1622-L1626 HydrophobicContact CB-CD1 3.79Å; L1622-L1626 HydrophobicContact CB-CG 4.21Å; L1622-L1626 PolarHBondContact O-N 3.15Å; H1623-L1626 PolarHBondContact O-N 3.18Å; H1623-L1626 VanDerWaalsContact O-O 3.1Å; L1626-S1668 CarbonylContact C-O 3.51Å; L1626-S1668 VanDerWaalsContact CA-O 3.29Å; L1626-S1668 WeakPolarHBondContact CA-O 3.36Å; L1626-F1669 HydrophobicContact CD2-CD1 3.97Å; L1626-F1669 HydrophobicContact CD2-CE1 3.93Å; L1626-F1669 HydrophobicContact CD2-CZ 4.47Å
1627	S	67.7	Low	64.5	Low	13.4 Å²	13.4	44.7 Å²	44.7	9%	0.094	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	150.1	171.2	41.3	0	0	0	0	109.5	S1298 F1629 S1668 F1669 S1670	S1298-S1627 WeakPolarHBondContact CB-OG 3.17Å; S1298-S1627 VanDerWaalsContact OG-CB 3.27Å; S1298-S1627 WeakPolarHBondContact OG-CB 3.35Å; S1298-S1627 PolarHBondContact OG-OG 3.48Å; S1627-F1629 PolarHBondContact O-N 2.98Å; S1627-S1668 PolarHBondContact N-O 3.17Å; S1627-S1668 PolarHBondContact O-N 3.08Å; S1627-S1668 VanDerWaalsContact O-N 3.12Å; S1627-S1668 VanDerWaalsContact O-O 3.12Å; S1627-S1668 PolarHBondContact O-OG 3.35Å; S1627-S1668 PolarHBondContact OG-O 3.11Å; S1627-S1668 VanDerWaalsContact OG-O 3.13Å; S1627-S1668 PolarHBondContact OG-OG 3.24Å; S1627-S1668 VanDerWaalsContact OG-OG 3.07Å; S1627-F1669 VanDerWaalsContact OG-C 3.25Å; S1627-F1669 PolarHBondContact OG-O 3Å; S1627-S1670 WeakPolarHBondContact OG-CA 3.45Å; S1627-S1670 PolarHBondContact OG-N 2.93Å
1628	G	62.5	Low	62.6	Low	15.4 Å²	15.4	48.6 Å²	48.6	16%	0.159	26%	0.256	C	S	.	.	S	Bend	trans	86.7	-3.3	-173	0	0	0	0	0	114.4	S1298 D1631	S1298-G1628 PolarHBondContact O-N 3.44Å; G1628-D1631 WeakPolarHBondContact CA-OD2 3.29Å; G1628-D1631 PolarHBondContact N-OD2 3.09Å
1629	F	62.7	Low	60.5	Low	11.4 Å²	11.4	54.1 Å²	54.1	5%	0.05	28%	0.283	C	S	.	.	S	Bend	trans	-102.4	119.5	172.9	-171.1	-107.4	0	0	0	110	T1540 Y1616 L1619 T1620 H1623 S1627 D1631 L1662 L1667	T1540-F1629 HydrophobicContact CG2-CD2 4.36Å; Y1616-F1629 HydrophobicContact CD2-CE2 4.3Å; Y1616-F1629 AromaticContact CD2-CZ 3.78Å; Y1616-F1629 HydrophobicContact CD2-CZ 3.95Å; Y1616-F1629 HydrophobicContact CE2-CE1 4.41Å; Y1616-F1629 HydrophobicContact CE2-CE2 4.31Å; Y1616-F1629 AromaticContact CE2-CZ 3.71Å; Y1616-F1629 HydrophobicContact CE2-CZ 3.86Å; Y1616-F1629 HydrophobicContact CG-CZ 4.49Å; L1619-F1629 VanDerWaalsContact C-CE1 3.43Å; L1619-F1629 HydrophobicContact CB-CD1 4.19Å; L1619-F1629 HydrophobicContact CB-CD2 4.04Å; L1619-F1629 HydrophobicContact CB-CE1 3.75Å; L1619-F1629 VanDerWaalsContact CB-CE1 3.48Å; L1619-F1629 HydrophobicContact CB-CE2 3.58Å; L1619-F1629 VanDerWaalsContact CB-CE2 3.45Å; L1619-F1629 HydrophobicContact CB-CG 4.29Å; L1619-F1629 HydrophobicContact CB-CZ 3.43Å; L1619-F1629 VanDerWaalsContact CB-CZ 3.45Å; L1619-F1629 HydrophobicContact CD1-CD2 4.01Å; L1619-F1629 HydrophobicContact CD1-CE2 3.64Å; L1619-F1629 HydrophobicContact CD1-CZ 4.25Å; L1619-F1629 HydrophobicContact CG-CD2 4.39Å; L1619-F1629 HydrophobicContact CG-CE2 4.25Å; L1619-F1629 HydrophobicContact CG-CZ 4.35Å; L1619-F1629 WeakPolarHBondContact O-CD1 3.28Å; L1619-F1629 WeakPolarHBondContact O-CE1 3.27Å; T1620-F1629 HydrophobicContact CG2-CE1 3.61Å; T1620-F1629 HydrophobicContact CG2-CZ 3.88Å; H1623-F1629 HydrophobicContact CB-CD1 4.33Å; H1623-F1629 AromaticContact CD2-CD1 3.75Å; H1623-F1629 PolarHBondContact CD2-O 3.5Å; H1623-F1629 PolarHBondContact NE2-O 3.15Å; S1627-F1629 PolarHBondContact O-N 2.98Å; F1629-D1631 VanDerWaalsContact C-N 3.28Å; F1629-D1631 PolarHBondContact O-N 3.03Å; F1629-D1631 VanDerWaalsContact O-N 3.11Å; F1629-L1662 HydrophobicContact CE2-CD2 4.22Å; F1629-L1667 HydrophobicContact CB-CD2 3.78Å; F1629-L1667 HydrophobicContact CD2-CD2 4.21Å; F1629-L1667 HydrophobicContact CG-CD2 4.27Å
1630	N	54.3	Low	58.4	Low	69.2 Å²	69.2	59.2 Å²	59.2	37%	0.37	31%	0.311	S	S	.	.	S	Bend	trans	61.4	14.9	-178.1	-65.5	-27.1	0	0	0	116.9	R815 Y1616 H1623 E1632	R815-N1630 PolarHBondContact NE-OD1 2.68Å; R815-N1630 PolarHBondContact NH2-ND2 2.89Å; R815-N1630 PolarHBondContact NH2-OD1 2.84Å; Y1616-N1630 PolarHBondContact OH-ND2 2.78Å; Y1616-N1630 VanDerWaalsContact OH-ND2 3.15Å; H1623-N1630 PolarHBondContact CD2-ND2 3.13Å; H1623-N1630 PolarHBondContact NE2-ND2 3.1Å; N1630-E1632 VanDerWaalsContact C-N 3.3Å; N1630-E1632 PolarHBondContact O-N 3.17Å
1631	D	50.4	Low	56.5	Low	55.8 Å²	55.8	66.4 Å²	66.4	30%	0.298	34%	0.342	S	S	.	.			trans	-76	87.8	171.2	-76.8	-37.4	0	0	0	110.5	S1298 I1299 G1628 F1629 R1633 R1665	S1298-D1631 WeakPolarHBondContact CA-OD2 3.44Å; S1298-D1631 VanDerWaalsContact CB-CG 3.47Å; S1298-D1631 WeakPolarHBondContact CB-OD1 3.46Å; S1298-D1631 WeakPolarHBondContact CB-OD2 2.87Å; S1298-D1631 WeakPolarHBondContact O-CB 3.39Å; S1298-D1631 VanDerWaalsContact O-OD1 3.04Å; S1298-D1631 PolarHBondContact OG-OD2 3.49Å; I1299-D1631 HydrophobicContact CB-CB 4.48Å; I1299-D1631 HydrophobicContact CG1-CB 3.86Å; I1299-D1631 WeakPolarHBondContact CG1-OD1 3.4Å; I1299-D1631 WeakPolarHBondContact CG1-OD2 3.23Å; I1299-D1631 PolarHBondContact N-OD1 3.04Å; G1628-D1631 WeakPolarHBondContact CA-OD2 3.29Å; G1628-D1631 PolarHBondContact N-OD2 3.09Å; F1629-D1631 VanDerWaalsContact C-N 3.28Å; F1629-D1631 PolarHBondContact O-N 3.03Å; F1629-D1631 VanDerWaalsContact O-N 3.11Å; D1631-R1633 PolarHBondContact O-N 3.14Å; D1631-R1665 WeakPolarHBondContact O-CD 3.46Å; D1631-R1665 VanDerWaalsContact O-CZ 3.25Å; D1631-R1665 PolarHBondContact O-NE 2.95Å; D1631-R1665 PolarHBondContact O-NH1 3.12Å; D1631-R1665 PolarHBondContact O-NH2 3.06Å
1632	E	47.7	Very low	54.5	Low	67.8 Å²	67.8	74.6 Å²	74.6	32%	0.317	38%	0.377	S	S	.	.			trans	-37.5	67.9	-179.7	-62	179.6	165.1	0	0	116.8	L819 K1448 N1630 A1634 D1635 I1636 R1665	L819-E1632 HydrophobicContact CD2-CB 4.38Å; L819-E1632 HydrophobicContact CD2-CG 4.17Å; K1448-E1632 WeakPolarHBondContact CE-OE1 3.27Å; K1448-E1632 IonicContact NZ-OE1 2.64Å; K1448-E1632 PolarHBondContact NZ-OE1 2.97Å; N1630-E1632 VanDerWaalsContact C-N 3.3Å; N1630-E1632 PolarHBondContact O-N 3.17Å; E1632-A1634 PolarHBondContact O-N 3.3Å; E1632-A1634 VanDerWaalsContact O-N 3.14Å; E1632-D1635 PolarHBondContact O-N 3.3Å; E1632-I1636 WeakPolarHBondContact O-CG1 3.5Å; E1632-I1636 PolarHBondContact O-N 2.85Å; E1632-R1665 IonicContact OE1-NH1 2.73Å
1633	R	41.2	Very low	52.2	Low	166 Å²	166	80.2 Å²	80.2	63%	0.626	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-89.3	26.8	159.8	-74	-170.9	-179	171.4	4.7	114.4	L1043 F1048 E1051 D1631 D1635 I1636 R1665	L1043-R1633 VanDerWaalsContact CD1-CD 3.44Å; L1043-R1633 HydrophobicContact CD1-CG 3.91Å; L1043-R1633 VanDerWaalsContact CD1-NH2 3.31Å; L1043-R1633 VanDerWaalsContact CG-NH1 3.33Å; L1043-R1633 VanDerWaalsContact CG-NH2 3.25Å; F1048-R1633 VanDerWaalsContact CD1-NH1 3.32Å; E1051-R1633 IonicContact OE1-NH2 2.86Å; E1051-R1633 PolarHBondContact OE1-NH2 2.63Å; E1051-R1633 IonicContact OE2-CZ 3.7Å; E1051-R1633 VanDerWaalsContact OE2-CZ 3.3Å; E1051-R1633 IonicContact OE2-NH1 3.28Å; E1051-R1633 PolarHBondContact OE2-NH1 2.71Å; E1051-R1633 IonicContact OE2-NH2 3.56Å; E1051-R1633 PolarHBondContact OE2-NH2 3.48Å; D1631-R1633 PolarHBondContact O-N 3.14Å; R1633-D1635 PolarHBondContact O-N 3.43Å; R1633-I1636 PolarHBondContact O-N 3Å; R1633-R1665 VanDerWaalsContact C-NH2 3.32Å; R1633-R1665 PolarHBondContact O-NH2 3.1Å
1634	A	40.2	Very low	50.2	Low	63.4 Å²	63.4	84.1 Å²	84.1	52%	0.524	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-16.8	172.6	0	0	0	0	0	115.7	E1632	E1632-A1634 PolarHBondContact O-N 3.3Å; E1632-A1634 VanDerWaalsContact O-N 3.14Å
1635	D	41.2	Very low	48.5	Very low	84.4 Å²	84.4	93.8 Å²	93.8	45%	0.451	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	4.8	178.6	-68.3	-7.9	0	0	0	113.2	E1632 R1633 D1637 E1638 I1639 S1664 R1665	E1632-D1635 PolarHBondContact O-N 3.3Å; R1633-D1635 PolarHBondContact O-N 3.43Å; D1635-D1637 PolarHBondContact O-N 3.26Å; D1635-E1638 PolarHBondContact O-N 2.87Å; D1635-E1638 VanDerWaalsContact O-N 3.13Å; D1635-I1639 WeakPolarHBondContact O-CD1 3.41Å; D1635-I1639 PolarHBondContact O-N 2.96Å; D1635-S1664 PolarHBondContact OD2-OG 3.33Å; D1635-R1665 IonicContact OD2-NH1 3.85Å; D1635-R1665 PolarHBondContact OD2-NH1 3Å; D1635-R1665 IonicContact OD2-NH2 3.09Å
1636	I	41.8	Very low	46.5	Very low	96.6 Å²	96.6	99.8 Å²	99.8	50%	0.495	51%	0.509	S	S	.	.	H	α-helix	trans	-87.9	-26.6	179.3	-61.3	175.8	0	0	0	111.4	E1632 R1633 E1638 I1639	E1632-I1636 WeakPolarHBondContact O-CG1 3.5Å; E1632-I1636 PolarHBondContact O-N 2.85Å; R1633-I1636 PolarHBondContact O-N 3Å; I1636-E1638 VanDerWaalsContact C-N 3.3Å; I1636-E1638 PolarHBondContact O-N 3.4Å; I1636-I1639 PolarHBondContact O-N 3.23Å; I1636-I1639 VanDerWaalsContact O-N 3.11Å
1637	D	39.4	Very low	44.9	Very low	125.4 Å²	125.4	106.6 Å²	106.6	67%	0.671	55%	0.545	S	S	*	.	H	α-helix	trans	-81.3	-3.1	-176.7	-62.8	-17.6	0	0	0	112.6	D1635 I1639 D1640	D1635-D1637 PolarHBondContact O-N 3.26Å; D1637-I1639 VanDerWaalsContact C-N 3.3Å; D1637-I1639 PolarHBondContact O-N 3.06Å; D1637-D1640 PolarHBondContact O-N 2.9Å
1638	E	39.9	Very low	43.8	Very low	156.8 Å²	156.8	109.1 Å²	109.1	73%	0.733	56%	0.563	S	S	*	*	H	α-helix	trans	-103.4	3.4	175.9	-84.8	-172.8	179.3	0	0	113.5	D1635 I1636 D1640 E1641	D1635-E1638 PolarHBondContact O-N 2.87Å; D1635-E1638 VanDerWaalsContact O-N 3.13Å; I1636-E1638 VanDerWaalsContact C-N 3.3Å; I1636-E1638 PolarHBondContact O-N 3.4Å; E1638-D1640 VanDerWaalsContact C-N 3.3Å; E1638-D1640 PolarHBondContact O-N 2.91Å; E1638-E1641 PolarHBondContact O-N 3.36Å
1639	I	40.5	Very low	42.8	Very low	115.2 Å²	115.2	113.7 Å²	113.7	59%	0.591	58%	0.582	S	S	*	*			trans	-98.9	13.8	172.5	-57.2	175.6	0	0	0	110	D1635 I1636 D1637 E1641 L1643	D1635-I1639 WeakPolarHBondContact O-CD1 3.41Å; D1635-I1639 PolarHBondContact O-N 2.96Å; I1636-I1639 PolarHBondContact O-N 3.23Å; I1636-I1639 VanDerWaalsContact O-N 3.11Å; D1637-I1639 VanDerWaalsContact C-N 3.3Å; D1637-I1639 PolarHBondContact O-N 3.06Å; I1639-E1641 PolarHBondContact O-N 3.33Å; I1639-L1643 HydrophobicContact CG2-CD1 3.85Å
1640	D	38.1	Very low	41.8	Very low	109.8 Å²	109.8	118.4 Å²	118.4	59%	0.587	60%	0.603	S	S	*	*			trans	-73.2	23.2	173.4	-82.3	-27.1	0	0	0	111.8	Y1029 D1637 E1638 E1642 K1653 K1656	Y1029-D1640 PolarHBondContact OH-OD2 2.6Å; D1637-D1640 PolarHBondContact O-N 2.9Å; E1638-D1640 VanDerWaalsContact C-N 3.3Å; E1638-D1640 PolarHBondContact O-N 2.91Å; D1640-E1642 PolarHBondContact O-N 2.93Å; D1640-K1653 IonicContact OD1-NZ 2.61Å; D1640-K1653 PolarHBondContact OD1-NZ 3.44Å; D1640-K1656 IonicContact OD1-NZ 3.11Å
1641	E	39.2	Very low	41.3	Very low	187.2 Å²	187.2	118.2 Å²	118.2	88%	0.875	61%	0.605	S	S	*	*	S	Bend	trans	-70	5.3	175.6	-68.3	-146.5	151.1	0	0	116.2	E1638 I1639	E1638-E1641 PolarHBondContact O-N 3.36Å; I1639-E1641 PolarHBondContact O-N 3.33Å
1642	E	37.7	Very low	41	Very low	183 Å²	183	118.9 Å²	118.9	86%	0.855	61%	0.608	S	S	*	*	S	Bend	trans	-126.8	41.3	-178	-67.3	-165.8	165.1	0	0	114.9	D1640	D1640-E1642 PolarHBondContact O-N 2.93Å
1643	L	35.7	Very low	40.8	Very low	118.2 Å²	118.2	119.5 Å²	119.5	62%	0.619	61%	0.609	S	S	*	*			trans	-113.8	128.3	167.5	-81.4	154.7	0	0	0	111.5	I1639	I1639-L1643 HydrophobicContact CG2-CD1 3.85Å
1644	P	38.8	Very low	40.8	Very low	111.8 Å²	111.8	117.2 Å²	117.2	73%	0.726	61%	0.606	S	S	*	*			trans	-67.1	145.8	-177.2	2	4.3	0	0	0	112.5	D1646	P1644-D1646 PolarHBondContact O-N 3.29Å
1645	F	39.5	Very low	40.8	Very low	210 Å²	210	119.6 Å²	119.6	92%	0.921	61%	0.606	S	S	*	*			trans	-63.9	94.5	174.1	-79.4	-98.1	0	0	0	111.5
1646	D	41.2	Very low	40.9	Very low	126.4 Å²	126.4	121.3 Å²	121.3	68%	0.676	61%	0.61	S	S	*	*			trans	-137.6	117.5	163.1	-119.8	-16.2	0	0	0	110.1	P1644 S1648 M1649 T1651	P1644-D1646 PolarHBondContact O-N 3.29Å; D1646-S1648 VanDerWaalsContact C-N 3.3Å; D1646-S1648 PolarHBondContact O-N 3.08Å; D1646-M1649 WeakPolarHBondContact O-CB 3.4Å; D1646-M1649 PolarHBondContact O-N 3.12Å; D1646-M1649 VanDerWaalsContact O-N 3.07Å; D1646-T1651 PolarHBondContact O-OG1 3.4Å
1647	D	43.1	Very low	40.9	Very low	151.8 Å²	151.8	119.7 Å²	119.7	81%	0.812	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.5	9.7	-175.2	-82.2	-26.7	0	0	0	115.9	M1649 Q1650	D1647-M1649 PolarHBondContact O-N 3.25Å; D1647-Q1650 PolarHBondContact O-N 3.26Å; D1647-Q1650 VanDerWaalsContact O-N 3.13Å; D1647-Q1650 PolarHBondContact OD1-NE2 2.98Å; D1647-Q1650 VanDerWaalsContact OD1-NE2 3.11Å
1648	S	45.1	Very low	41	Very low	65.6 Å²	65.6	117.5 Å²	117.5	46%	0.459	59%	0.593	S	S	.	*			trans	-79.5	40.1	176.6	73.2	0	0	0	0	112.5	D1646 Q1650 T1651 I1652	D1646-S1648 VanDerWaalsContact C-N 3.3Å; D1646-S1648 PolarHBondContact O-N 3.08Å; S1648-Q1650 VanDerWaalsContact C-N 3.34Å; S1648-Q1650 PolarHBondContact O-N 3.2Å; S1648-T1651 WeakPolarHBondContact CB-OG1 3.34Å; S1648-T1651 WeakPolarHBondContact O-CA 3.46Å; S1648-T1651 PolarHBondContact O-N 2.98Å; S1648-T1651 VanDerWaalsContact O-N 3.12Å; S1648-T1651 PolarHBondContact O-OG1 3.04Å; S1648-T1651 PolarHBondContact OG-OG1 3.12Å; S1648-I1652 WeakPolarHBondContact O-CG1 3.38Å; S1648-I1652 PolarHBondContact O-N 3.21Å
1649	M	40.6	Very low	41.1	Very low	112.8 Å²	112.8	114.7 Å²	114.7	56%	0.556	58%	0.582	S	S	*	*	H	α-helix	trans	-64.4	-19.2	179.1	-125.7	165.6	77	0	0	113.7	L1603 D1646 D1647 T1651 I1652 K1653	L1603-M1649 HydrophobicContact CB-CE 4.38Å; D1646-M1649 WeakPolarHBondContact O-CB 3.4Å; D1646-M1649 PolarHBondContact O-N 3.12Å; D1646-M1649 VanDerWaalsContact O-N 3.07Å; D1647-M1649 PolarHBondContact O-N 3.25Å; M1649-T1651 PolarHBondContact O-N 3.08Å; M1649-I1652 HydrophobicContact CE-CB 3.82Å; M1649-I1652 HydrophobicContact CE-CD1 4.3Å; M1649-I1652 HydrophobicContact CE-CG2 3.87Å; M1649-I1652 PolarHBondContact O-N 3.3Å; M1649-K1653 HydrophobicContact CG-CG 4.42Å; M1649-K1653 WeakPolarHBondContact O-CB 3.37Å; M1649-K1653 VanDerWaalsContact O-CG 3.27Å; M1649-K1653 WeakPolarHBondContact O-CG 3.35Å; M1649-K1653 PolarHBondContact O-N 3.07Å; M1649-K1653 VanDerWaalsContact O-N 3.12Å
1650	Q	42	Very low	41.2	Very low	108.8 Å²	108.8	116.3 Å²	116.3	51%	0.508	58%	0.581	S	S	.	*	H	α-helix	trans	-73.4	-37.8	-179	-73.7	-173.1	1	0	0	113.1	D1647 S1648 I1652 K1653 Q1654	D1647-Q1650 PolarHBondContact O-N 3.26Å; D1647-Q1650 VanDerWaalsContact O-N 3.13Å; D1647-Q1650 PolarHBondContact OD1-NE2 2.98Å; D1647-Q1650 VanDerWaalsContact OD1-NE2 3.11Å; S1648-Q1650 VanDerWaalsContact C-N 3.34Å; S1648-Q1650 PolarHBondContact O-N 3.2Å; Q1650-I1652 VanDerWaalsContact C-N 3.27Å; Q1650-I1652 PolarHBondContact O-N 3.17Å; Q1650-K1653 PolarHBondContact O-N 3.18Å; Q1650-K1653 VanDerWaalsContact O-N 3.15Å; Q1650-Q1654 WeakPolarHBondContact O-CB 3.19Å; Q1650-Q1654 WeakPolarHBondContact O-CG 3.08Å; Q1650-Q1654 PolarHBondContact O-N 3.07Å; Q1650-Q1654 VanDerWaalsContact O-N 3.12Å
1651	T	43	Very low	41.4	Very low	66.4 Å²	66.4	114.7 Å²	114.7	41%	0.407	57%	0.572	S	S	.	*	H	α-helix	trans	-64.8	-42.4	174.5	46.1	0	0	0	0	110.5	D1646 S1648 M1649 K1653 Q1654 E1655	D1646-T1651 PolarHBondContact O-OG1 3.4Å; S1648-T1651 WeakPolarHBondContact CB-OG1 3.34Å; S1648-T1651 WeakPolarHBondContact O-CA 3.46Å; S1648-T1651 PolarHBondContact O-N 2.98Å; S1648-T1651 VanDerWaalsContact O-N 3.12Å; S1648-T1651 PolarHBondContact O-OG1 3.04Å; S1648-T1651 PolarHBondContact OG-OG1 3.12Å; M1649-T1651 PolarHBondContact O-N 3.08Å; T1651-K1653 VanDerWaalsContact C-N 3.34Å; T1651-K1653 PolarHBondContact O-N 3.19Å; T1651-Q1654 CarbonylContact O-C 3.29Å; T1651-Q1654 WeakPolarHBondContact O-CB 3.05Å; T1651-Q1654 PolarHBondContact O-N 2.97Å; T1651-Q1654 VanDerWaalsContact O-N 3.11Å; T1651-E1655 VanDerWaalsContact O-CB 3.27Å; T1651-E1655 WeakPolarHBondContact O-CB 3.36Å; T1651-E1655 VanDerWaalsContact O-CG 3.26Å; T1651-E1655 WeakPolarHBondContact O-CG 3.36Å; T1651-E1655 PolarHBondContact O-N 3.07Å
1652	I	44.6	Very low	41.7	Very low	69 Å²	69	109.4 Å²	109.4	35%	0.354	55%	0.549	S	S	.	.	H	α-helix	trans	-64.9	-37.1	176.1	-60	170.5	0	0	0	111.7	S1648 M1649 Q1650 E1655 K1656	S1648-I1652 WeakPolarHBondContact O-CG1 3.38Å; S1648-I1652 PolarHBondContact O-N 3.21Å; M1649-I1652 HydrophobicContact CE-CB 3.82Å; M1649-I1652 HydrophobicContact CE-CD1 4.3Å; M1649-I1652 HydrophobicContact CE-CG2 3.87Å; M1649-I1652 PolarHBondContact O-N 3.3Å; Q1650-I1652 VanDerWaalsContact C-N 3.27Å; Q1650-I1652 PolarHBondContact O-N 3.17Å; I1652-E1655 PolarHBondContact O-N 2.73Å; I1652-K1656 HydrophobicContact CG2-CD 4.22Å; I1652-K1656 HydrophobicContact CG2-CG 4.46Å; I1652-K1656 VanDerWaalsContact O-CB 3.29Å; I1652-K1656 WeakPolarHBondContact O-CB 3.2Å; I1652-K1656 VanDerWaalsContact O-CG 3.25Å; I1652-K1656 WeakPolarHBondContact O-CG 3.28Å; I1652-K1656 PolarHBondContact O-N 3.01Å; I1652-K1656 VanDerWaalsContact O-N 3.08Å
1653	K	43.7	Very low	42.1	Very low	80.6 Å²	80.6	101.4 Å²	101.4	35%	0.35	52%	0.516	S	S	.	.	H	α-helix	trans	-66.1	-43.4	174.3	-100.1	-173.1	177.5	-171.9	0	111.2	D1548 L1603 H1609 D1640 M1649 Q1650 T1651 K1656 L1657	D1548-K1653 IonicContact OD2-NZ 3.9Å; D1548-K1653 PolarHBondContact OD2-NZ 2.88Å; L1603-K1653 HydrophobicContact CD1-CD 4.21Å; H1609-K1653 WeakPolarHBondContact CE1-CE 3.25Å; H1609-K1653 PolarHBondContact CE1-NZ 3.12Å; H1609-K1653 VanDerWaalsContact CE1-NZ 3.31Å; H1609-K1653 PolarHBondContact ND1-NZ 2.89Å; H1609-K1653 WeakPolarHBondContact NE2-CE 3.45Å; D1640-K1653 IonicContact OD1-NZ 2.61Å; D1640-K1653 PolarHBondContact OD1-NZ 3.44Å; M1649-K1653 HydrophobicContact CG-CG 4.42Å; M1649-K1653 WeakPolarHBondContact O-CB 3.37Å; M1649-K1653 VanDerWaalsContact O-CG 3.27Å; M1649-K1653 WeakPolarHBondContact O-CG 3.35Å; M1649-K1653 PolarHBondContact O-N 3.07Å; M1649-K1653 VanDerWaalsContact O-N 3.12Å; Q1650-K1653 PolarHBondContact O-N 3.18Å; Q1650-K1653 VanDerWaalsContact O-N 3.15Å; T1651-K1653 VanDerWaalsContact C-N 3.34Å; T1651-K1653 PolarHBondContact O-N 3.19Å; K1653-K1656 PolarHBondContact O-N 3.08Å; K1653-L1657 HydrophobicContact CG-CD1 4.32Å; K1653-L1657 VanDerWaalsContact O-CB 3.29Å; K1653-L1657 WeakPolarHBondContact O-CB 3.15Å; K1653-L1657 WeakPolarHBondContact O-CD1 3.4Å; K1653-L1657 WeakPolarHBondContact O-CG 3.35Å; K1653-L1657 PolarHBondContact O-N 3.13Å
1654	Q	40.9	Very low	42.7	Very low	117.4 Å²	117.4	98.7 Å²	98.7	55%	0.549	51%	0.507	S	S	.	.	H	α-helix	trans	-66	-43.9	176.9	-76.8	-178.6	-20.8	0	0	111.8	Q1650 T1651 K1656 L1657 T1658	Q1650-Q1654 WeakPolarHBondContact O-CB 3.19Å; Q1650-Q1654 WeakPolarHBondContact O-CG 3.08Å; Q1650-Q1654 PolarHBondContact O-N 3.07Å; Q1650-Q1654 VanDerWaalsContact O-N 3.12Å; T1651-Q1654 CarbonylContact O-C 3.29Å; T1651-Q1654 WeakPolarHBondContact O-CB 3.05Å; T1651-Q1654 PolarHBondContact O-N 2.97Å; T1651-Q1654 VanDerWaalsContact O-N 3.11Å; Q1654-K1656 VanDerWaalsContact C-N 3.29Å; Q1654-K1656 PolarHBondContact O-N 3.24Å; Q1654-L1657 CarbonylContact O-C 3.55Å; Q1654-L1657 WeakPolarHBondContact O-CB 3.39Å; Q1654-L1657 PolarHBondContact O-N 3.16Å; Q1654-T1658 WeakPolarHBondContact O-CB 3.48Å; Q1654-T1658 VanDerWaalsContact O-CG2 3.25Å; Q1654-T1658 WeakPolarHBondContact O-CG2 3.33Å; Q1654-T1658 PolarHBondContact O-N 3.21Å; Q1654-T1658 PolarHBondContact O-OG1 3.06Å; Q1654-T1658 VanDerWaalsContact O-OG1 3.06Å
1655	E	41.6	Very low	43.5	Very low	115.2 Å²	115.2	98.8 Å²	98.8	54%	0.538	49%	0.493	S	S	.	.	H	α-helix	trans	-60.4	-44.9	174.1	-75.2	179.7	168.6	0	0	111.7	T1651 I1652 L1657 T1658 I1659	T1651-E1655 VanDerWaalsContact O-CB 3.27Å; T1651-E1655 WeakPolarHBondContact O-CB 3.36Å; T1651-E1655 VanDerWaalsContact O-CG 3.26Å; T1651-E1655 WeakPolarHBondContact O-CG 3.36Å; T1651-E1655 PolarHBondContact O-N 3.07Å; I1652-E1655 PolarHBondContact O-N 2.73Å; E1655-L1657 VanDerWaalsContact C-N 3.29Å; E1655-L1657 PolarHBondContact O-N 2.91Å; E1655-T1658 VanDerWaalsContact CA-OG1 3.31Å; E1655-T1658 WeakPolarHBondContact CA-OG1 3.31Å; E1655-T1658 PolarHBondContact O-N 3.25Å; E1655-T1658 PolarHBondContact O-OG1 3.11Å; E1655-I1659 VanDerWaalsContact O-CD1 3.25Å; E1655-I1659 WeakPolarHBondContact O-CD1 3.39Å; E1655-I1659 VanDerWaalsContact O-CG1 3.26Å; E1655-I1659 WeakPolarHBondContact O-CG1 3.38Å; E1655-I1659 PolarHBondContact O-N 3.26Å; E1655-I1659 VanDerWaalsContact O-N 3.1Å
1656	K	41.5	Very low	44.7	Very low	120 Å²	120	90.5 Å²	90.5	52%	0.522	46%	0.463	S	S	.	.	H	α-helix	trans	-65.2	-38.7	175.9	-76.4	-178.4	178	-178.5	0	112.6	D1640 I1652 K1653 Q1654 I1659 W1660	D1640-K1656 IonicContact OD1-NZ 3.11Å; I1652-K1656 HydrophobicContact CG2-CD 4.22Å; I1652-K1656 HydrophobicContact CG2-CG 4.46Å; I1652-K1656 VanDerWaalsContact O-CB 3.29Å; I1652-K1656 WeakPolarHBondContact O-CB 3.2Å; I1652-K1656 VanDerWaalsContact O-CG 3.25Å; I1652-K1656 WeakPolarHBondContact O-CG 3.28Å; I1652-K1656 PolarHBondContact O-N 3.01Å; I1652-K1656 VanDerWaalsContact O-N 3.08Å; K1653-K1656 PolarHBondContact O-N 3.08Å; Q1654-K1656 VanDerWaalsContact C-N 3.29Å; Q1654-K1656 PolarHBondContact O-N 3.24Å; K1656-I1659 PolarHBondContact O-N 2.8Å; K1656-W1660 WeakPolarHBondContact O-CB 3.31Å; K1656-W1660 VanDerWaalsContact O-CD1 3.3Å; K1656-W1660 PolarHBondContact O-N 3.3Å
1657	L	41.9	Very low	46.3	Very low	62.4 Å²	62.4	84.5 Å²	84.5	33%	0.327	43%	0.431	S	S	.	.	H	α-helix	trans	-68.1	-38	175.4	-85.2	154.7	0	0	0	112.2	K1653 Q1654 E1655 I1659 W1660 N1661 L1662	K1653-L1657 HydrophobicContact CG-CD1 4.32Å; K1653-L1657 VanDerWaalsContact O-CB 3.29Å; K1653-L1657 WeakPolarHBondContact O-CB 3.15Å; K1653-L1657 WeakPolarHBondContact O-CD1 3.4Å; K1653-L1657 WeakPolarHBondContact O-CG 3.35Å; K1653-L1657 PolarHBondContact O-N 3.13Å; Q1654-L1657 CarbonylContact O-C 3.55Å; Q1654-L1657 WeakPolarHBondContact O-CB 3.39Å; Q1654-L1657 PolarHBondContact O-N 3.16Å; E1655-L1657 VanDerWaalsContact C-N 3.29Å; E1655-L1657 PolarHBondContact O-N 2.91Å; L1657-I1659 PolarHBondContact O-N 3.06Å; L1657-W1660 PolarHBondContact O-N 3.07Å; L1657-N1661 WeakPolarHBondContact O-CB 3.36Å; L1657-N1661 VanDerWaalsContact O-CG 3.28Å; L1657-N1661 PolarHBondContact O-N 3.14Å; L1657-N1661 VanDerWaalsContact O-N 3.14Å; L1657-N1661 PolarHBondContact O-ND2 2.88Å; L1657-N1661 VanDerWaalsContact O-ND2 3.16Å; L1657-L1662 HydrophobicContact CB-CB 4.43Å; L1657-L1662 HydrophobicContact CD2-CB 3.82Å; L1657-L1662 HydrophobicContact CD2-CD1 3.7Å; L1657-L1662 HydrophobicContact CD2-CG 4.4Å; L1657-L1662 PolarHBondContact O-N 3.02Å; L1657-L1662 VanDerWaalsContact O-N 3.16Å
1658	T	41.6	Very low	47.7	Very low	79.2 Å²	79.2	79.3 Å²	79.3	49%	0.486	41%	0.406	S	S	.	.	H	α-helix	trans	-67.4	-37.6	176.2	55.7	0	0	0	0	112	Q1654 E1655 W1660 N1661 L1662	Q1654-T1658 WeakPolarHBondContact O-CB 3.48Å; Q1654-T1658 VanDerWaalsContact O-CG2 3.25Å; Q1654-T1658 WeakPolarHBondContact O-CG2 3.33Å; Q1654-T1658 PolarHBondContact O-N 3.21Å; Q1654-T1658 PolarHBondContact O-OG1 3.06Å; Q1654-T1658 VanDerWaalsContact O-OG1 3.06Å; E1655-T1658 VanDerWaalsContact CA-OG1 3.31Å; E1655-T1658 WeakPolarHBondContact CA-OG1 3.31Å; E1655-T1658 PolarHBondContact O-N 3.25Å; E1655-T1658 PolarHBondContact O-OG1 3.11Å; T1658-W1660 VanDerWaalsContact C-N 3.34Å; T1658-W1660 PolarHBondContact O-N 3.19Å; T1658-N1661 PolarHBondContact O-N 2.95Å; T1658-L1662 WeakPolarHBondContact O-CG 3.47Å; T1658-L1662 PolarHBondContact O-N 3.16Å; T1658-L1662 VanDerWaalsContact O-N 3.13Å
1659	I	43.2	Very low	49.2	Very low	97 Å²	97	77.2 Å²	77.2	50%	0.497	39%	0.389	S	S	.	.	H	α-helix	trans	-59.9	-38.9	174.1	-69.3	163.9	0	0	0	111.2	E1655 K1656 L1657	E1655-I1659 VanDerWaalsContact O-CD1 3.25Å; E1655-I1659 WeakPolarHBondContact O-CD1 3.39Å; E1655-I1659 VanDerWaalsContact O-CG1 3.26Å; E1655-I1659 WeakPolarHBondContact O-CG1 3.38Å; E1655-I1659 PolarHBondContact O-N 3.26Å; E1655-I1659 VanDerWaalsContact O-N 3.1Å; K1656-I1659 PolarHBondContact O-N 2.8Å; L1657-I1659 PolarHBondContact O-N 3.06Å
1660	W	41.3	Very low	50.6	Low	150.4 Å²	150.4	73.7 Å²	73.7	57%	0.57	38%	0.375	S	S	*	.	H	α-helix	trans	-85.5	-15.4	179.2	-67.6	67	0	0	0	113.4	L1613 Y1616 K1656 L1657 T1658 L1662 G1663	L1613-W1660 HydrophobicContact CB-CZ2 4.24Å; L1613-W1660 HydrophobicContact CD1-CD2 4.43Å; L1613-W1660 HydrophobicContact CD1-CE3 4.35Å; L1613-W1660 HydrophobicContact CD1-CH2 3.62Å; L1613-W1660 HydrophobicContact CD1-CZ2 3.81Å; L1613-W1660 HydrophobicContact CD1-CZ3 3.9Å; L1613-W1660 HydrophobicContact CD2-CZ2 4.45Å; L1613-W1660 HydrophobicContact CG-CZ2 4.43Å; Y1616-W1660 HydrophobicContact CD1-CE3 4.33Å; Y1616-W1660 HydrophobicContact CD2-CB 4.3Å; Y1616-W1660 HydrophobicContact CD2-CE3 4.45Å; Y1616-W1660 HydrophobicContact CG-CE3 4.32Å; K1656-W1660 WeakPolarHBondContact O-CB 3.31Å; K1656-W1660 VanDerWaalsContact O-CD1 3.3Å; K1656-W1660 PolarHBondContact O-N 3.3Å; L1657-W1660 PolarHBondContact O-N 3.07Å; T1658-W1660 VanDerWaalsContact C-N 3.34Å; T1658-W1660 PolarHBondContact O-N 3.19Å; W1660-L1662 VanDerWaalsContact C-N 3.3Å; W1660-L1662 HydrophobicContact CB-CD1 3.85Å; W1660-L1662 HydrophobicContact CB-CG 4.12Å; W1660-L1662 PolarHBondContact O-N 3.14Å; W1660-L1662 VanDerWaalsContact O-N 3.14Å; W1660-G1663 PolarHBondContact O-N 3.5Å
1661	N	43.4	Very low	51.9	Low	76.4 Å²	76.4	69.6 Å²	69.6	41%	0.409	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-36.9	23.5	-179.7	-103	-20.8	0	0	0	112.9	L1657 T1658 G1663 S1664	L1657-N1661 WeakPolarHBondContact O-CB 3.36Å; L1657-N1661 VanDerWaalsContact O-CG 3.28Å; L1657-N1661 PolarHBondContact O-N 3.14Å; L1657-N1661 VanDerWaalsContact O-N 3.14Å; L1657-N1661 PolarHBondContact O-ND2 2.88Å; L1657-N1661 VanDerWaalsContact O-ND2 3.16Å; T1658-N1661 PolarHBondContact O-N 2.95Å; N1661-G1663 PolarHBondContact O-N 3.02Å; N1661-S1664 WeakPolarHBondContact CA-OG 3.29Å; N1661-S1664 PolarHBondContact O-N 3.05Å; N1661-S1664 PolarHBondContact O-OG 3.27Å; N1661-S1664 PolarHBondContact OD1-OG 3.25Å
1662	L	45.7	Very low	53.1	Low	74.4 Å²	74.4	72.9 Å²	72.9	39%	0.39	36%	0.364	S	S	.	.			trans	-52.8	19.7	171.8	-79.8	155.3	0	0	0	111.7	T1540 S1612 L1615 Y1616 L1619 F1629 L1657 T1658 W1660	T1540-L1662 HydrophobicContact CG2-CD2 4.41Å; T1540-L1662 WeakPolarHBondContact OG1-CA 3.42Å; T1540-L1662 PolarHBondContact OG1-O 3.34Å; S1612-L1662 WeakPolarHBondContact O-CD1 3.39Å; L1615-L1662 HydrophobicContact CD2-CD1 4.39Å; L1615-L1662 HydrophobicContact CD2-CD2 4.17Å; L1615-L1662 HydrophobicContact CG-CD2 4.36Å; Y1616-L1662 HydrophobicContact CD2-CD2 3.85Å; L1619-L1662 HydrophobicContact CD1-CD2 3.9Å; F1629-L1662 HydrophobicContact CE2-CD2 4.22Å; L1657-L1662 HydrophobicContact CB-CB 4.43Å; L1657-L1662 HydrophobicContact CD2-CB 3.82Å; L1657-L1662 HydrophobicContact CD2-CD1 3.7Å; L1657-L1662 HydrophobicContact CD2-CG 4.4Å; L1657-L1662 PolarHBondContact O-N 3.02Å; L1657-L1662 VanDerWaalsContact O-N 3.16Å; T1658-L1662 WeakPolarHBondContact O-CG 3.47Å; T1658-L1662 PolarHBondContact O-N 3.16Å; T1658-L1662 VanDerWaalsContact O-N 3.13Å; W1660-L1662 VanDerWaalsContact C-N 3.3Å; W1660-L1662 HydrophobicContact CB-CD1 3.85Å; W1660-L1662 HydrophobicContact CB-CG 4.12Å; W1660-L1662 PolarHBondContact O-N 3.14Å; W1660-L1662 VanDerWaalsContact O-N 3.14Å
1663	G	44.9	Very low	54.5	Low	15.4 Å²	15.4	72.6 Å²	72.6	16%	0.159	36%	0.361	C	S	.	.			trans	-92.6	161.4	-179.4	0	0	0	0	0	114.1	G1301 T1540 W1660 N1661 R1665 A1666	G1301-G1663 WeakPolarHBondContact CA-O 3.42Å; G1301-G1663 WeakPolarHBondContact O-CA 3.43Å; T1540-G1663 PolarHBondContact OG1-N 3Å; T1540-G1663 PolarHBondContact OG1-O 3.14Å; W1660-G1663 PolarHBondContact O-N 3.5Å; N1661-G1663 PolarHBondContact O-N 3.02Å; G1663-R1665 PolarHBondContact O-N 3.27Å; G1663-A1666 PolarHBondContact O-N 2.88Å
1664	S	48.3	Very low	56.2	Low	60.8 Å²	60.8	68.8 Å²	68.8	43%	0.425	34%	0.344	S	S	.	.	S	Bend	trans	-65.7	0.8	-175.3	62.7	0	0	0	0	115.1	K1226 S1539 D1635 N1661	K1226-S1664 VanDerWaalsContact NZ-C 3.34Å; K1226-S1664 PolarHBondContact NZ-O 2.96Å; K1226-S1664 PolarHBondContact NZ-OG 3.29Å; S1539-S1664 WeakPolarHBondContact CB-O 3.45Å; D1635-S1664 PolarHBondContact OD2-OG 3.33Å; N1661-S1664 WeakPolarHBondContact CA-OG 3.29Å; N1661-S1664 PolarHBondContact O-N 3.05Å; N1661-S1664 PolarHBondContact O-OG 3.27Å; N1661-S1664 PolarHBondContact OD1-OG 3.25Å
1665	R	55.6	Low	58	Low	115 Å²	115	65.6 Å²	65.6	43%	0.434	33%	0.329	S	S	.	.			trans	-92.6	94.3	-176.4	-75	-177.9	166.5	162.6	-5	113.4	S1539 T1540 E1541 D1631 E1632 R1633 D1635 G1663 L1667	S1539-R1665 VanDerWaalsContact CA-O 3.27Å; S1539-R1665 WeakPolarHBondContact CA-O 3.33Å; T1540-R1665 PolarHBondContact N-O 3.41Å; E1541-R1665 IonicContact OE1-NH1 3.27Å; D1631-R1665 WeakPolarHBondContact O-CD 3.46Å; D1631-R1665 VanDerWaalsContact O-CZ 3.25Å; D1631-R1665 PolarHBondContact O-NE 2.95Å; D1631-R1665 PolarHBondContact O-NH1 3.12Å; D1631-R1665 PolarHBondContact O-NH2 3.06Å; E1632-R1665 IonicContact OE1-NH1 2.73Å; R1633-R1665 VanDerWaalsContact C-NH2 3.32Å; R1633-R1665 PolarHBondContact O-NH2 3.1Å; D1635-R1665 IonicContact OD2-NH1 3.85Å; D1635-R1665 PolarHBondContact OD2-NH1 3Å; D1635-R1665 IonicContact OD2-NH2 3.09Å; G1663-R1665 PolarHBondContact O-N 3.27Å; R1665-L1667 PolarHBondContact O-N 3.3Å
1666	A	65.5	Low	59.8	Low	34.8 Å²	34.8	63.8 Å²	63.8	29%	0.288	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	115.1	-177	0	0	0	0	0	111	P1537 L1538 G1663 S1668	P1537-A1666 HydrophobicContact CB-CB 3.74Å; P1537-A1666 HydrophobicContact CG-CB 3.84Å; L1538-A1666 CarbonylContact O-C 3.55Å; L1538-A1666 WeakPolarHBondContact O-CA 3.37Å; G1663-A1666 PolarHBondContact O-N 2.88Å; A1666-S1668 PolarHBondContact O-N 3.13Å
1667	L	73.9	Confident	61.7	Low	1.8 Å²	1.8	59.2 Å²	59.2	1%	0.009	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	130.9	176.9	-64.1	171	0	0	0	110.1	L1531 P1537 L1538 T1540 L1543 L1619 F1629 R1665	L1531-L1667 HydrophobicContact CD2-CB 3.8Å; L1531-L1667 HydrophobicContact CD2-CD1 4.22Å; P1537-L1667 WeakPolarHBondContact CA-O 3.47Å; P1537-L1667 VanDerWaalsContact CB-O 3.22Å; P1537-L1667 WeakPolarHBondContact CB-O 3.34Å; L1538-L1667 PolarHBondContact N-O 2.89Å; L1538-L1667 VanDerWaalsContact O-CB 3.3Å; L1538-L1667 WeakPolarHBondContact O-CB 3.44Å; L1538-L1667 PolarHBondContact O-N 3.23Å; T1540-L1667 HydrophobicContact CG2-CD1 3.95Å; T1540-L1667 HydrophobicContact CG2-CD2 4.08Å; T1540-L1667 HydrophobicContact CG2-CG 4.01Å; L1543-L1667 HydrophobicContact CB-CD1 4.39Å; L1543-L1667 HydrophobicContact CD2-CD1 3.44Å; L1543-L1667 VanDerWaalsContact CD2-CD1 3.45Å; L1619-L1667 HydrophobicContact CD1-CD1 4.4Å; L1619-L1667 HydrophobicContact CD2-CD1 4.12Å; F1629-L1667 HydrophobicContact CB-CD2 3.78Å; F1629-L1667 HydrophobicContact CD2-CD2 4.21Å; F1629-L1667 HydrophobicContact CG-CD2 4.27Å; R1665-L1667 PolarHBondContact O-N 3.3Å
1668	S	72.5	Confident	63.7	Low	41 Å²	41	56.3 Å²	56.3	29%	0.287	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	165.2	174.3	54.4	0	0	0	0	110.3	S1298 L1626 S1627 A1666	S1298-S1668 VanDerWaalsContact CB-OG 3.28Å; S1298-S1668 WeakPolarHBondContact CB-OG 3.29Å; L1626-S1668 CarbonylContact C-O 3.51Å; L1626-S1668 VanDerWaalsContact CA-O 3.29Å; L1626-S1668 WeakPolarHBondContact CA-O 3.36Å; S1627-S1668 PolarHBondContact N-O 3.17Å; S1627-S1668 PolarHBondContact O-N 3.08Å; S1627-S1668 VanDerWaalsContact O-N 3.12Å; S1627-S1668 VanDerWaalsContact O-O 3.12Å; S1627-S1668 PolarHBondContact O-OG 3.35Å; S1627-S1668 PolarHBondContact OG-O 3.11Å; S1627-S1668 VanDerWaalsContact OG-O 3.13Å; S1627-S1668 PolarHBondContact OG-OG 3.24Å; S1627-S1668 VanDerWaalsContact OG-OG 3.07Å; A1666-S1668 PolarHBondContact O-N 3.13Å
1669	F	78	Confident	65.6	Low	21.6 Å²	21.6	56.3 Å²	56.3	10%	0.095	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	141.3	171.8	-69.3	-80.5	0	0	0	110.8	L1528 L1531 T1532 L1625 L1626 S1627 S1671 I1674 H1675 V1678	L1528-F1669 HydrophobicContact CD2-CE1 3.95Å; L1528-F1669 HydrophobicContact CD2-CZ 4.15Å; L1531-F1669 HydrophobicContact CB-CE2 3.81Å; L1531-F1669 HydrophobicContact CB-CZ 3.91Å; L1531-F1669 WeakPolarHBondContact O-CE2 3.27Å; T1532-F1669 HydrophobicContact CG2-CD2 4.46Å; T1532-F1669 HydrophobicContact CG2-CE2 3.51Å; T1532-F1669 VanDerWaalsContact CG2-CE2 3.47Å; T1532-F1669 HydrophobicContact CG2-CZ 3.62Å; L1625-F1669 HydrophobicContact CB-CD1 4.41Å; L1625-F1669 WeakPolarHBondContact O-CA 3.29Å; L1625-F1669 WeakPolarHBondContact O-CD1 3.32Å; L1626-F1669 HydrophobicContact CD2-CD1 3.97Å; L1626-F1669 HydrophobicContact CD2-CE1 3.93Å; L1626-F1669 HydrophobicContact CD2-CZ 4.47Å; S1627-F1669 VanDerWaalsContact OG-C 3.25Å; S1627-F1669 PolarHBondContact OG-O 3Å; F1669-S1671 PolarHBondContact O-N 2.86Å; F1669-S1671 VanDerWaalsContact O-N 3.1Å; F1669-I1674 HydrophobicContact CD1-CG2 3.9Å; F1669-H1675 HydrophobicContact CB-CB 4.09Å; F1669-H1675 HydrophobicContact CD2-CB 3.88Å; F1669-H1675 AromaticContact CD2-CD2 3.62Å; F1669-H1675 AromaticContact CE2-CD2 3.86Å; F1669-H1675 HydrophobicContact CG-CB 4.1Å; F1669-V1678 HydrophobicContact CD1-CG2 4.49Å; F1669-V1678 HydrophobicContact CE1-CB 4.28Å; F1669-V1678 HydrophobicContact CE1-CG1 4.16Å; F1669-V1678 HydrophobicContact CE1-CG2 4.01Å; F1669-V1678 HydrophobicContact CZ-CB 4.39Å; F1669-V1678 HydrophobicContact CZ-CG1 4Å
1670	S	68.5	Low	67.3	Low	39.2 Å²	39.2	53.6 Å²	53.6	27%	0.274	27%	0.267	S	S	.	.	S	Bend	trans	-64.8	-18.6	-176.1	64	0	0	0	0	114	P1624 L1625 S1627 I1674	P1624-S1670 PolarHBondContact O-OG 3.21Å; L1625-S1670 PolarHBondContact O-N 3.27Å; L1625-S1670 PolarHBondContact O-OG 3.19Å; S1627-S1670 WeakPolarHBondContact OG-CA 3.45Å; S1627-S1670 PolarHBondContact OG-N 2.93Å; S1670-I1674 VanDerWaalsContact OG-CD1 3.25Å; S1670-I1674 WeakPolarHBondContact OG-CD1 3.35Å
1671	S	69.7	Low	69.1	Low	24.6 Å²	24.6	48.1 Å²	48.1	17%	0.172	25%	0.249	C	C	.	.			trans	-151.1	156.9	166.5	77.2	0	0	0	0	111.3	L1475 F1669 E1673 I1674 H1675	L1475-S1671 WeakPolarHBondContact CD2-OG 3.32Å; F1669-S1671 PolarHBondContact O-N 2.86Å; F1669-S1671 VanDerWaalsContact O-N 3.1Å; S1671-E1673 VanDerWaalsContact C-N 3.3Å; S1671-E1673 PolarHBondContact O-N 3.2Å; S1671-E1673 WeakPolarHBondContact OG-CB 3.49Å; S1671-E1673 PolarHBondContact OG-N 3.31Å; S1671-E1673 VanDerWaalsContact OG-N 3.13Å; S1671-I1674 WeakPolarHBondContact O-CB 3.27Å; S1671-I1674 PolarHBondContact O-N 3.12Å; S1671-I1674 VanDerWaalsContact O-N 3.15Å; S1671-I1674 VanDerWaalsContact OG-CD1 3.24Å; S1671-I1674 WeakPolarHBondContact OG-CD1 3.33Å; S1671-I1674 VanDerWaalsContact OG-CG1 3.27Å; S1671-I1674 WeakPolarHBondContact OG-CG1 3.44Å; S1671-I1674 PolarHBondContact OG-N 3.06Å; S1671-H1675 PolarHBondContact O-N 3.27Å; S1671-H1675 VanDerWaalsContact O-N 3.11Å
1672	R	69.2	Low	70.6	Confident	134.8 Å²	134.8	45.1 Å²	45.1	51%	0.509	23%	0.234	S	C	.	.	H	α-helix	trans	-67.7	-26.1	174.8	-169.3	169.8	-177.7	155.6	2	113.2	R1386 I1674 H1675 N1676	R1386-R1672 VanDerWaalsContact CZ-CD 3.48Å; R1386-R1672 VanDerWaalsContact CZ-CZ 3.48Å; R1672-I1674 VanDerWaalsContact C-N 3.32Å; R1672-I1674 PolarHBondContact O-N 3.26Å; R1672-H1675 PolarHBondContact O-N 3.22Å; R1672-N1676 WeakPolarHBondContact O-CB 3.3Å; R1672-N1676 VanDerWaalsContact O-CG 3.31Å; R1672-N1676 PolarHBondContact O-N 3.32Å; R1672-N1676 PolarHBondContact O-OD1 3.05Å
1673	E	73.6	Confident	71.9	Confident	63 Å²	63	43.4 Å²	43.4	29%	0.294	22%	0.223	S	C	.	.	H	α-helix	trans	-63.9	-42.5	173.2	-80.2	-179.2	154.4	0	0	110.7	N1121 N1222 G1223 L1475 S1671 N1676 L1677	N1121-E1673 HydrophobicContact CB-CB 4.42Å; N1121-E1673 VanDerWaalsContact CB-CD 3.43Å; N1121-E1673 HydrophobicContact CB-CG 4.1Å; N1121-E1673 VanDerWaalsContact CB-OE1 3.22Å; N1121-E1673 WeakPolarHBondContact CB-OE1 3.36Å; N1121-E1673 PolarHBondContact ND2-OE1 2.88Å; N1222-E1673 HydrophobicContact CB-CG 3.71Å; N1222-E1673 WeakPolarHBondContact CB-OE1 3.28Å; N1222-E1673 WeakPolarHBondContact CB-OE2 3.45Å; G1223-E1673 PolarHBondContact N-OE2 2.91Å; L1475-E1673 HydrophobicContact CD2-CB 4.41Å; L1475-E1673 VanDerWaalsContact CD2-OE2 3.25Å; L1475-E1673 WeakPolarHBondContact CD2-OE2 3.46Å; S1671-E1673 VanDerWaalsContact C-N 3.3Å; S1671-E1673 PolarHBondContact O-N 3.2Å; S1671-E1673 WeakPolarHBondContact OG-CB 3.49Å; S1671-E1673 PolarHBondContact OG-N 3.31Å; S1671-E1673 VanDerWaalsContact OG-N 3.13Å; E1673-N1676 PolarHBondContact O-N 3Å; E1673-L1677 HydrophobicContact CG-CD1 4.07Å; E1673-L1677 VanDerWaalsContact O-CB 3.32Å; E1673-L1677 WeakPolarHBondContact O-CB 3.43Å; E1673-L1677 WeakPolarHBondContact O-CD1 3.43Å; E1673-L1677 VanDerWaalsContact O-CG 3.24Å; E1673-L1677 WeakPolarHBondContact O-CG 3.23Å; E1673-L1677 PolarHBondContact O-N 3.14Å
1674	I	78.9	Confident	73	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.6	-44.9	174.4	-65	165.1	0	0	0	110.5	L1475 L1479 V1508 L1625 F1669 S1670 S1671 R1672 N1676 L1677 V1678	L1475-I1674 HydrophobicContact CD1-CD1 4.4Å; L1475-I1674 HydrophobicContact CD2-CD1 4.5Å; L1479-I1674 HydrophobicContact CD1-CD1 4.1Å; L1479-I1674 HydrophobicContact CD1-CG1 4.4Å; L1479-I1674 HydrophobicContact CD2-CD1 3.88Å; L1479-I1674 HydrophobicContact CG-CD1 4.43Å; V1508-I1674 HydrophobicContact CG1-CG2 4.5Å; V1508-I1674 HydrophobicContact CG2-CG1 4.11Å; V1508-I1674 HydrophobicContact CG2-CG2 4.46Å; L1625-I1674 HydrophobicContact CB-CG2 3.96Å; L1625-I1674 HydrophobicContact CD2-CD1 4.4Å; L1625-I1674 HydrophobicContact CD2-CG2 3.91Å; L1625-I1674 HydrophobicContact CG-CG2 4.36Å; F1669-I1674 HydrophobicContact CD1-CG2 3.9Å; S1670-I1674 VanDerWaalsContact OG-CD1 3.25Å; S1670-I1674 WeakPolarHBondContact OG-CD1 3.35Å; S1671-I1674 WeakPolarHBondContact O-CB 3.27Å; S1671-I1674 PolarHBondContact O-N 3.12Å; S1671-I1674 VanDerWaalsContact O-N 3.15Å; S1671-I1674 VanDerWaalsContact OG-CD1 3.24Å; S1671-I1674 WeakPolarHBondContact OG-CD1 3.33Å; S1671-I1674 VanDerWaalsContact OG-CG1 3.27Å; S1671-I1674 WeakPolarHBondContact OG-CG1 3.44Å; S1671-I1674 PolarHBondContact OG-N 3.06Å; R1672-I1674 VanDerWaalsContact C-N 3.32Å; R1672-I1674 PolarHBondContact O-N 3.26Å; I1674-N1676 VanDerWaalsContact C-N 3.35Å; I1674-N1676 PolarHBondContact O-N 3.02Å; I1674-L1677 PolarHBondContact O-N 3.2Å; I1674-V1678 HydrophobicContact CG2-CG2 4.04Å; I1674-V1678 WeakPolarHBondContact O-CB 3.25Å; I1674-V1678 VanDerWaalsContact O-CG2 3.25Å; I1674-V1678 WeakPolarHBondContact O-CG2 3.37Å; I1674-V1678 PolarHBondContact O-N 3.06Å
1675	H	79.8	Confident	73.3	Confident	49.8 Å²	49.8	48.2 Å²	48.2	23%	0.231	24%	0.237	C	C	.	.	H	α-helix	trans	-54.4	-50.8	175.3	172.1	-85.3	0	0	0	112.1	T1532 F1669 S1671 R1672 L1677 V1678 Y1679	T1532-H1675 WeakPolarHBondContact CA-NE2 3.5Å; T1532-H1675 PolarHBondContact O-NE2 3.23Å; F1669-H1675 HydrophobicContact CB-CB 4.09Å; F1669-H1675 HydrophobicContact CD2-CB 3.88Å; F1669-H1675 AromaticContact CD2-CD2 3.62Å; F1669-H1675 AromaticContact CE2-CD2 3.86Å; F1669-H1675 HydrophobicContact CG-CB 4.1Å; S1671-H1675 PolarHBondContact O-N 3.27Å; S1671-H1675 VanDerWaalsContact O-N 3.11Å; R1672-H1675 PolarHBondContact O-N 3.22Å; H1675-L1677 VanDerWaalsContact C-N 3.34Å; H1675-L1677 PolarHBondContact O-N 3.15Å; H1675-V1678 PolarHBondContact O-N 3.11Å; H1675-Y1679 WeakPolarHBondContact O-CB 3.4Å; H1675-Y1679 PolarHBondContact O-N 3.18Å
1676	N	78.7	Confident	72.9	Confident	79 Å²	79	47.2 Å²	47.2	42%	0.422	25%	0.247	S	C	.	.	H	α-helix	trans	-63.2	-41.5	178.9	-71.9	-7.2	0	0	0	112.1	R1672 E1673 I1674 Y1679 D1680	R1672-N1676 WeakPolarHBondContact O-CB 3.3Å; R1672-N1676 VanDerWaalsContact O-CG 3.31Å; R1672-N1676 PolarHBondContact O-N 3.32Å; R1672-N1676 PolarHBondContact O-OD1 3.05Å; E1673-N1676 PolarHBondContact O-N 3Å; I1674-N1676 VanDerWaalsContact C-N 3.35Å; I1674-N1676 PolarHBondContact O-N 3.02Å; N1676-Y1679 PolarHBondContact O-N 3.27Å; N1676-D1680 WeakPolarHBondContact O-CB 3.37Å; N1676-D1680 PolarHBondContact O-N 3.23Å
1677	L	81.6	Confident	71.9	Confident	23.6 Å²	23.6	52.3 Å²	52.3	12%	0.124	26%	0.263	C	S	.	.	H	α-helix	trans	-65.1	-43.2	177.8	-74.7	167.2	0	0	0	111.6	I1504 S1505 V1508 E1673 I1674 H1675 Y1679 D1680 I1681	I1504-L1677 HydrophobicContact CG2-CD1 4.09Å; S1505-L1677 WeakPolarHBondContact OG-CD2 3.32Å; V1508-L1677 HydrophobicContact CG1-CB 4.43Å; V1508-L1677 HydrophobicContact CG2-CD1 4.22Å; E1673-L1677 HydrophobicContact CG-CD1 4.07Å; E1673-L1677 VanDerWaalsContact O-CB 3.32Å; E1673-L1677 WeakPolarHBondContact O-CB 3.43Å; E1673-L1677 WeakPolarHBondContact O-CD1 3.43Å; E1673-L1677 VanDerWaalsContact O-CG 3.24Å; E1673-L1677 WeakPolarHBondContact O-CG 3.23Å; E1673-L1677 PolarHBondContact O-N 3.14Å; I1674-L1677 PolarHBondContact O-N 3.2Å; H1675-L1677 VanDerWaalsContact C-N 3.34Å; H1675-L1677 PolarHBondContact O-N 3.15Å; L1677-Y1679 VanDerWaalsContact C-N 3.33Å; L1677-D1680 WeakPolarHBondContact O-CB 3.38Å; L1677-D1680 PolarHBondContact O-N 3.14Å; L1677-I1681 WeakPolarHBondContact O-CB 3.37Å; L1677-I1681 VanDerWaalsContact O-CD1 3.3Å; L1677-I1681 WeakPolarHBondContact O-CD1 3.23Å; L1677-I1681 WeakPolarHBondContact O-CG1 3.34Å; L1677-I1681 PolarHBondContact O-N 3.25Å
1678	V	83.7	Confident	70.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.4	-42.1	176.3	172.5	0	0	0	0	110.6	V1508 L1528 T1532 L1625 F1669 I1674 H1675 D1680 I1681 C1682	V1508-V1678 HydrophobicContact CG1-CG2 4.01Å; L1528-V1678 HydrophobicContact CB-CG1 3.78Å; L1528-V1678 HydrophobicContact CD1-CG1 4.14Å; L1528-V1678 HydrophobicContact CD2-CG1 3.98Å; L1528-V1678 HydrophobicContact CG-CG1 4.18Å; T1532-V1678 HydrophobicContact CG2-CB 4.08Å; T1532-V1678 HydrophobicContact CG2-CG1 3.64Å; L1625-V1678 HydrophobicContact CD1-CG2 4.4Å; F1669-V1678 HydrophobicContact CD1-CG2 4.49Å; F1669-V1678 HydrophobicContact CE1-CB 4.28Å; F1669-V1678 HydrophobicContact CE1-CG1 4.16Å; F1669-V1678 HydrophobicContact CE1-CG2 4.01Å; F1669-V1678 HydrophobicContact CZ-CB 4.39Å; F1669-V1678 HydrophobicContact CZ-CG1 4Å; I1674-V1678 HydrophobicContact CG2-CG2 4.04Å; I1674-V1678 WeakPolarHBondContact O-CB 3.25Å; I1674-V1678 VanDerWaalsContact O-CG2 3.25Å; I1674-V1678 WeakPolarHBondContact O-CG2 3.37Å; I1674-V1678 PolarHBondContact O-N 3.06Å; H1675-V1678 PolarHBondContact O-N 3.11Å; V1678-D1680 VanDerWaalsContact C-N 3.32Å; V1678-D1680 PolarHBondContact O-N 3.03Å; V1678-I1681 PolarHBondContact O-N 3.01Å; V1678-I1681 VanDerWaalsContact O-N 3.16Å; V1678-C1682 WeakPolarHBondContact O-CB 3.43Å; V1678-C1682 PolarHBondContact O-N 3.06Å; V1678-C1682 PolarHBondContact O-SG 3.29Å; V1678-C1682 VanDerWaalsContact O-SG 3.34Å
1679	Y	81.9	Confident	68.9	Low	80 Å²	80	58.4 Å²	58.4	31%	0.314	29%	0.294	S	S	.	.	H	α-helix	trans	-58.6	-46.2	174.1	-175.9	-86.7	0	0	0	111.5	H1675 N1676 L1677 I1681 C1682 F1683 L1729	H1675-Y1679 WeakPolarHBondContact O-CB 3.4Å; H1675-Y1679 PolarHBondContact O-N 3.18Å; N1676-Y1679 PolarHBondContact O-N 3.27Å; L1677-Y1679 VanDerWaalsContact C-N 3.33Å; Y1679-I1681 VanDerWaalsContact C-N 3.32Å; Y1679-I1681 PolarHBondContact O-N 3.03Å; Y1679-C1682 PolarHBondContact O-N 3.2Å; Y1679-F1683 HydrophobicContact CD1-CD2 4.28Å; Y1679-F1683 AromaticContact CD2-CD2 3.59Å; Y1679-F1683 HydrophobicContact CD2-CD2 3.59Å; Y1679-F1683 AromaticContact CD2-CE2 3.73Å; Y1679-F1683 HydrophobicContact CD2-CE2 3.73Å; Y1679-F1683 HydrophobicContact CE1-CD2 4.25Å; Y1679-F1683 AromaticContact CE2-CD2 3.57Å; Y1679-F1683 HydrophobicContact CE2-CD2 3.57Å; Y1679-F1683 VanDerWaalsContact CE2-CD2 3.48Å; Y1679-F1683 AromaticContact CE2-CE2 3.8Å; Y1679-F1683 HydrophobicContact CE2-CE2 3.8Å; Y1679-F1683 AromaticContact CG-CD2 3.91Å; Y1679-F1683 HydrophobicContact CG-CD2 3.96Å; Y1679-F1683 HydrophobicContact CG-CE2 4.37Å; Y1679-F1683 AromaticContact CZ-CD2 3.91Å; Y1679-F1683 VanDerWaalsContact O-CD2 3.29Å; Y1679-F1683 WeakPolarHBondContact O-CD2 3.42Å; Y1679-F1683 PolarHBondContact O-N 3.12Å; Y1679-L1729 HydrophobicContact CE2-CD1 4.28Å; Y1679-L1729 WeakPolarHBondContact OH-CD1 3.38Å
1680	D	79.1	Confident	67	Low	39.4 Å²	39.4	63.6 Å²	63.6	21%	0.211	32%	0.321	C	S	.	.	H	α-helix	trans	-63.2	-38.4	176.4	-85.3	-18.1	0	0	0	112.4	N1676 L1677 V1678 N1684 K1687 Y1688	N1676-D1680 WeakPolarHBondContact O-CB 3.37Å; N1676-D1680 PolarHBondContact O-N 3.23Å; L1677-D1680 WeakPolarHBondContact O-CB 3.38Å; L1677-D1680 PolarHBondContact O-N 3.14Å; V1678-D1680 VanDerWaalsContact C-N 3.32Å; V1678-D1680 PolarHBondContact O-N 3.03Å; D1680-N1684 HydrophobicContact CB-CB 4.39Å; D1680-N1684 CarbonylContact O-C 3.41Å; D1680-N1684 WeakPolarHBondContact O-CA 3.33Å; D1680-N1684 WeakPolarHBondContact O-CB 3.37Å; D1680-N1684 PolarHBondContact O-N 3.16Å; D1680-N1684 WeakPolarHBondContact OD1-CB 3.26Å; D1680-N1684 PolarHBondContact OD1-ND2 3.2Å; D1680-K1687 IonicContact OD1-NZ 3.2Å; D1680-Y1688 HydrophobicContact CB-CE2 4.04Å
1681	I	77.9	Confident	65.4	Low	35 Å²	35	64.9 Å²	64.9	18%	0.179	34%	0.341	C	S	.	.	H	α-helix	trans	-66.1	-42.5	176	-69.3	160.8	0	0	0	111.2	V1508 I1509 V1512 L1677 V1678 Y1679 I1690	V1508-I1681 HydrophobicContact CG1-CD1 3.99Å; I1509-I1681 HydrophobicContact CB-CD1 4.47Å; I1509-I1681 HydrophobicContact CG1-CD1 3.55Å; I1509-I1681 VanDerWaalsContact CG1-CD1 3.48Å; I1509-I1681 HydrophobicContact CG1-CG1 3.91Å; V1512-I1681 HydrophobicContact CG1-CG2 4.39Å; L1677-I1681 WeakPolarHBondContact O-CB 3.37Å; L1677-I1681 VanDerWaalsContact O-CD1 3.3Å; L1677-I1681 WeakPolarHBondContact O-CD1 3.23Å; L1677-I1681 WeakPolarHBondContact O-CG1 3.34Å; L1677-I1681 PolarHBondContact O-N 3.25Å; V1678-I1681 PolarHBondContact O-N 3.01Å; V1678-I1681 VanDerWaalsContact O-N 3.16Å; Y1679-I1681 VanDerWaalsContact C-N 3.32Å; Y1679-I1681 PolarHBondContact O-N 3.03Å; I1681-I1690 HydrophobicContact CG2-CD1 4.08Å
1682	C	75.6	Confident	63.7	Low	13.8 Å²	13.8	69.4 Å²	69.4	9%	0.093	36%	0.359	C	S	.	.	H	α-helix	trans	-71.8	-38.5	-177.9	-70.6	0	0	0	0	112.7	R1525 V1678 Y1679	R1525-C1682 PolarHBondContact NE-O 3Å; R1525-C1682 PolarHBondContact NH2-O 2.91Å; V1678-C1682 WeakPolarHBondContact O-CB 3.43Å; V1678-C1682 PolarHBondContact O-N 3.06Å; V1678-C1682 PolarHBondContact O-SG 3.29Å; V1678-C1682 VanDerWaalsContact O-SG 3.34Å; Y1679-C1682 PolarHBondContact O-N 3.2Å
1683	F	73.8	Confident	61.9	Low	38 Å²	38	72.1 Å²	72.1	17%	0.167	37%	0.374	C	S	.	.	H	α-helix	trans	-121.9	-29.4	-166.8	-53.2	-62.5	0	0	0	115.6	Y1679 Q1685 L1729 I1732	Y1679-F1683 HydrophobicContact CD1-CD2 4.28Å; Y1679-F1683 AromaticContact CD2-CD2 3.59Å; Y1679-F1683 HydrophobicContact CD2-CD2 3.59Å; Y1679-F1683 AromaticContact CD2-CE2 3.73Å; Y1679-F1683 HydrophobicContact CD2-CE2 3.73Å; Y1679-F1683 HydrophobicContact CE1-CD2 4.25Å; Y1679-F1683 AromaticContact CE2-CD2 3.57Å; Y1679-F1683 HydrophobicContact CE2-CD2 3.57Å; Y1679-F1683 VanDerWaalsContact CE2-CD2 3.48Å; Y1679-F1683 AromaticContact CE2-CE2 3.8Å; Y1679-F1683 HydrophobicContact CE2-CE2 3.8Å; Y1679-F1683 AromaticContact CG-CD2 3.91Å; Y1679-F1683 HydrophobicContact CG-CD2 3.96Å; Y1679-F1683 HydrophobicContact CG-CE2 4.37Å; Y1679-F1683 AromaticContact CZ-CD2 3.91Å; Y1679-F1683 VanDerWaalsContact O-CD2 3.29Å; Y1679-F1683 WeakPolarHBondContact O-CD2 3.42Å; Y1679-F1683 PolarHBondContact O-N 3.12Å; F1683-Q1685 PolarHBondContact O-N 3.13Å; F1683-Q1685 VanDerWaalsContact O-N 3.16Å; F1683-L1729 HydrophobicContact CD1-CB 3.81Å; F1683-L1729 HydrophobicContact CD1-CD1 4.07Å; F1683-L1729 HydrophobicContact CD1-CG 4.44Å; F1683-L1729 HydrophobicContact CD2-CD1 4.16Å; F1683-L1729 HydrophobicContact CE1-CB 3.9Å; F1683-L1729 HydrophobicContact CE1-CD1 4.04Å; F1683-L1729 HydrophobicContact CE1-CG 4.43Å; F1683-L1729 HydrophobicContact CE2-CD1 4.02Å; F1683-L1729 HydrophobicContact CG-CB 4.43Å; F1683-L1729 HydrophobicContact CG-CD1 4.12Å; F1683-L1729 HydrophobicContact CZ-CD1 3.94Å; F1683-I1732 HydrophobicContact CE1-CD1 3.67Å; F1683-I1732 HydrophobicContact CZ-CD1 3.55Å; F1683-I1732 VanDerWaalsContact CZ-CD1 3.48Å
1684	N	66.3	Low	59.9	Low	57 Å²	57	77.5 Å²	77.5	31%	0.305	40%	0.397	S	S	.	.			trans	-97.7	63.3	-175.4	-76.9	-31.3	0	0	0	112.4	D1680 S1686 K1687	D1680-N1684 HydrophobicContact CB-CB 4.39Å; D1680-N1684 CarbonylContact O-C 3.41Å; D1680-N1684 WeakPolarHBondContact O-CA 3.33Å; D1680-N1684 WeakPolarHBondContact O-CB 3.37Å; D1680-N1684 PolarHBondContact O-N 3.16Å; D1680-N1684 WeakPolarHBondContact OD1-CB 3.26Å; D1680-N1684 PolarHBondContact OD1-ND2 3.2Å; N1684-S1686 VanDerWaalsContact C-N 3.26Å; N1684-S1686 PolarHBondContact O-N 3.2Å; N1684-S1686 VanDerWaalsContact O-N 3.13Å; N1684-K1687 PolarHBondContact O-N 3.18Å
1685	Q	55.7	Low	57.7	Low	121.8 Å²	121.8	85.1 Å²	85.1	57%	0.569	43%	0.427	S	S	*	.	H	α-helix	trans	-59.6	-27.9	-179.2	-65.5	-176.2	-0.4	0	0	113.6	F1683 K1687 Y1688 S1689	F1683-Q1685 PolarHBondContact O-N 3.13Å; F1683-Q1685 VanDerWaalsContact O-N 3.16Å; Q1685-K1687 VanDerWaalsContact C-N 3.32Å; Q1685-K1687 PolarHBondContact O-N 3.14Å; Q1685-Y1688 PolarHBondContact O-N 3.05Å; Q1685-S1689 WeakPolarHBondContact O-CB 3.44Å; Q1685-S1689 PolarHBondContact O-N 3.17Å; Q1685-S1689 PolarHBondContact O-OG 2.94Å
1686	S	45.9	Very low	55.1	Low	93.4 Å²	93.4	89.6 Å²	89.6	65%	0.653	45%	0.447	S	S	*	.	H	α-helix	trans	-65.2	-31.4	-175.9	60.5	0	0	0	0	114	N1684 Y1688 S1689	N1684-S1686 VanDerWaalsContact C-N 3.26Å; N1684-S1686 PolarHBondContact O-N 3.2Å; N1684-S1686 VanDerWaalsContact O-N 3.13Å; S1686-Y1688 VanDerWaalsContact C-N 3.34Å; S1686-Y1688 PolarHBondContact O-N 2.94Å; S1686-S1689 PolarHBondContact O-N 2.76Å
1687	K	45.3	Very low	52.9	Low	142 Å²	142	93.6 Å²	93.6	62%	0.617	46%	0.458	S	S	*	.	H	α-helix	trans	-77.1	-28.5	179.6	-76.5	-178.9	-179	169.3	0	113.3	D1680 N1684 Q1685	D1680-K1687 IonicContact OD1-NZ 3.2Å; N1684-K1687 PolarHBondContact O-N 3.18Å; Q1685-K1687 VanDerWaalsContact C-N 3.32Å; Q1685-K1687 PolarHBondContact O-N 3.14Å
1688	Y	45.7	Very low	50.2	Low	83.8 Å²	83.8	96.3 Å²	96.3	33%	0.329	48%	0.479	S	S	.	.	H	α-helix	trans	-100.8	3.8	-176.1	-67.4	-79	0	0	0	112.9	I1509 D1680 Q1685 S1686 I1690 H1692	I1509-Y1688 HydrophobicContact CD1-CD1 3.98Å; I1509-Y1688 HydrophobicContact CD1-CE1 3.8Å; D1680-Y1688 HydrophobicContact CB-CE2 4.04Å; Q1685-Y1688 PolarHBondContact O-N 3.05Å; S1686-Y1688 VanDerWaalsContact C-N 3.34Å; S1686-Y1688 PolarHBondContact O-N 2.94Å; Y1688-I1690 VanDerWaalsContact C-N 3.28Å; Y1688-I1690 PolarHBondContact O-N 3.29Å; Y1688-H1692 PolarHBondContact O-CD2 3.28Å; Y1688-H1692 PolarHBondContact O-NE2 3.21Å
1689	S	37.8	Very low	47.6	Very low	87.4 Å²	87.4	104.4 Å²	104.4	61%	0.611	51%	0.514	S	S	*	.			trans	-71.8	-0.6	177.1	-47.1	0	0	0	0	113.7	Q1685 S1686 G1691	Q1685-S1689 WeakPolarHBondContact O-CB 3.44Å; Q1685-S1689 PolarHBondContact O-N 3.17Å; Q1685-S1689 PolarHBondContact O-OG 2.94Å; S1686-S1689 PolarHBondContact O-N 2.76Å; S1689-G1691 PolarHBondContact O-N 3.1Å; S1689-G1691 VanDerWaalsContact O-N 3.07Å
1690	I	37.5	Very low	45	Very low	130.6 Å²	130.6	108.6 Å²	108.6	67%	0.67	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	23.2	-173.9	-62.3	167	0	0	0	111.3	I1681 Y1688 H1692	I1681-I1690 HydrophobicContact CG2-CD1 4.08Å; Y1688-I1690 VanDerWaalsContact C-N 3.28Å; Y1688-I1690 PolarHBondContact O-N 3.29Å; I1690-H1692 PolarHBondContact O-N 3.27Å; I1690-H1692 VanDerWaalsContact O-N 3.07Å
1691	G	35.9	Very low	42.6	Very low	66.6 Å²	66.6	113.5 Å²	113.5	69%	0.687	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	-0.6	178.7	0	0	0	0	0	115.1	S1689 K1693	S1689-G1691 PolarHBondContact O-N 3.1Å; S1689-G1691 VanDerWaalsContact O-N 3.07Å; G1691-K1693 VanDerWaalsContact C-N 3.29Å; G1691-K1693 PolarHBondContact O-N 3.19Å
1692	H	34.2	Very low	40.2	Very low	119.2 Å²	119.2	118.3 Å²	118.3	55%	0.552	59%	0.586	S	S	*	*			trans	-106.4	91.6	-176.1	-71.6	-75.8	0	0	0	111.1	Y1688 I1690 K1694 Y1695	Y1688-H1692 PolarHBondContact O-CD2 3.28Å; Y1688-H1692 PolarHBondContact O-NE2 3.21Å; I1690-H1692 PolarHBondContact O-N 3.27Å; I1690-H1692 VanDerWaalsContact O-N 3.07Å; H1692-K1694 PolarHBondContact O-N 3.1Å; H1692-K1694 VanDerWaalsContact O-N 3.16Å; H1692-Y1695 HydrophobicContact CB-CD2 4.33Å; H1692-Y1695 HydrophobicContact CB-CE2 3.94Å; H1692-Y1695 PolarHBondContact O-N 3.03Å
1693	K	31	Very low	38	Very low	190.6 Å²	190.6	126.1 Å²	126.1	83%	0.829	62%	0.622	S	S	*	*			trans	-64.2	85.5	167.7	-74.2	-177.2	175.8	-179.9	0	111.3	G1691 Y1695	G1691-K1693 VanDerWaalsContact C-N 3.29Å; G1691-K1693 PolarHBondContact O-N 3.19Å; K1693-Y1695 VanDerWaalsContact C-N 3.33Å; K1693-Y1695 HydrophobicContact CB-CD2 4.27Å; K1693-Y1695 HydrophobicContact CB-CE2 3.83Å; K1693-Y1695 WeakPolarHBondContact O-CD2 3.38Å; K1693-Y1695 WeakPolarHBondContact O-CE2 3.35Å; K1693-Y1695 PolarHBondContact O-N 2.98Å; K1693-Y1695 VanDerWaalsContact O-N 3.08Å
1694	K	30.5	Very low	35.9	Very low	176.8 Å²	176.8	130 Å²	130	77%	0.769	65%	0.649	S	S	*	*			trans	-74.9	62.8	171.7	-90.4	-174.9	169.3	-169.2	0	111.5	H1692 E1696	H1692-K1694 PolarHBondContact O-N 3.1Å; H1692-K1694 VanDerWaalsContact O-N 3.16Å; K1694-E1696 HydrophobicContact CD-CG 4.48Å; K1694-E1696 IonicContact NZ-OE1 3.19Å; K1694-E1696 PolarHBondContact NZ-OE1 3.32Å; K1694-E1696 PolarHBondContact O-N 3.13Å
1695	Y	33.6	Very low	34.1	Very low	159.8 Å²	159.8	136.5 Å²	136.5	63%	0.627	67%	0.674	S	S	*	*			trans	-104.8	72.2	169.9	-68.3	-73.1	0	0	0	107.7	H1692 K1693 Y1697	H1692-Y1695 HydrophobicContact CB-CD2 4.33Å; H1692-Y1695 HydrophobicContact CB-CE2 3.94Å; H1692-Y1695 PolarHBondContact O-N 3.03Å; K1693-Y1695 VanDerWaalsContact C-N 3.33Å; K1693-Y1695 HydrophobicContact CB-CD2 4.27Å; K1693-Y1695 HydrophobicContact CB-CE2 3.83Å; K1693-Y1695 WeakPolarHBondContact O-CD2 3.38Å; K1693-Y1695 WeakPolarHBondContact O-CE2 3.35Å; K1693-Y1695 PolarHBondContact O-N 2.98Å; K1693-Y1695 VanDerWaalsContact O-N 3.08Å; Y1695-Y1697 VanDerWaalsContact C-N 3.29Å; Y1695-Y1697 WeakPolarHBondContact O-CD2 3.11Å; Y1695-Y1697 PolarHBondContact O-N 3.12Å
1696	E	25.9	Very low	32.9	Very low	143.4 Å²	143.4	137.9 Å²	137.9	67%	0.67	69%	0.685	S	S	*	*			trans	-72	101.8	165.2	-79.8	177.6	167	0	0	107.5	K1694 S1698 H1723	K1694-E1696 HydrophobicContact CD-CG 4.48Å; K1694-E1696 IonicContact NZ-OE1 3.19Å; K1694-E1696 PolarHBondContact NZ-OE1 3.32Å; K1694-E1696 PolarHBondContact O-N 3.13Å; E1696-S1698 VanDerWaalsContact C-N 3.26Å; E1696-S1698 PolarHBondContact O-N 3.12Å; E1696-H1723 IonicContact OE1-CE1 3.49Å; E1696-H1723 PolarHBondContact OE1-CE1 3.45Å; E1696-H1723 IonicContact OE1-ND1 3.54Å; E1696-H1723 PolarHBondContact OE1-ND1 3.19Å; E1696-H1723 IonicContact OE2-CE1 3.9Å; E1696-H1723 IonicContact OE2-ND1 2.73Å
1697	Y	31.5	Very low	32.1	Very low	162.8 Å²	162.8	139.6 Å²	139.6	64%	0.638	70%	0.696	S	S	*	*			trans	-74	84.8	163	-83.6	-84.3	0	0	0	108.5	C1519 L1614 Y1695 F1699	C1519-Y1697 VanDerWaalsContact O-CE2 3.23Å; C1519-Y1697 WeakPolarHBondContact O-CE2 3.2Å; L1614-Y1697 HydrophobicContact CD2-CE1 4.26Å; Y1695-Y1697 VanDerWaalsContact C-N 3.29Å; Y1695-Y1697 WeakPolarHBondContact O-CD2 3.11Å; Y1695-Y1697 PolarHBondContact O-N 3.12Å; Y1697-F1699 HydrophobicContact CD1-CE2 4.39Å; Y1697-F1699 PolarHBondContact O-N 2.92Å; Y1697-F1699 VanDerWaalsContact O-N 3.13Å
1698	S	25.6	Very low	31.2	Very low	81.4 Å²	81.4	139.9 Å²	139.9	57%	0.569	70%	0.704	S	S	*	*			trans	-73.5	112	166.4	63.2	0	0	0	0	108.4	E1696 K1700	E1696-S1698 VanDerWaalsContact C-N 3.26Å; E1696-S1698 PolarHBondContact O-N 3.12Å; S1698-K1700 PolarHBondContact O-N 3.29Å
1699	F	29	Very low	30.5	Very low	169.8 Å²	169.8	145.4 Å²	145.4	75%	0.745	73%	0.73	S	S	*	*			trans	-60.7	88.8	163.1	-95.9	-91.5	0	0	0	108.9	Y1697 N1701	Y1697-F1699 HydrophobicContact CD1-CE2 4.39Å; Y1697-F1699 PolarHBondContact O-N 2.92Å; Y1697-F1699 VanDerWaalsContact O-N 3.13Å; F1699-N1701 PolarHBondContact O-N 3.21Å
1700	K	27.3	Very low	30.1	Very low	168.8 Å²	168.8	153.2 Å²	153.2	73%	0.734	75%	0.746	S	S	*	*			trans	-88.5	112.3	169.8	-84.1	-174.3	177.2	179	0	107.4	S1698 N1702	S1698-K1700 PolarHBondContact O-N 3.29Å; K1700-N1702 VanDerWaalsContact C-N 3.29Å; K1700-N1702 PolarHBondContact O-N 3.17Å
1701	N	28.2	Very low	29.8	Very low	140.8 Å²	140.8	151.6 Å²	151.6	75%	0.753	75%	0.752	S	S	*	*			trans	-60.1	73.8	170.3	-91.6	-10.4	0	0	0	111.2	F1699 Q1703	F1699-N1701 PolarHBondContact O-N 3.21Å; N1701-Q1703 PolarHBondContact O-N 2.92Å
1702	N	28	Very low	29.4	Very low	136.2 Å²	136.2	157.9 Å²	157.9	73%	0.728	76%	0.761	S	S	*	*			trans	-97.5	83.7	173.2	-79.9	-14.7	0	0	0	108.7	K1700 T1704	K1700-N1702 VanDerWaalsContact C-N 3.29Å; K1700-N1702 PolarHBondContact O-N 3.17Å; N1702-T1704 PolarHBondContact O-N 3.2Å
1703	Q	28.6	Very low	29.3	Very low	178.4 Å²	178.4	163 Å²	163	83%	0.834	78%	0.777	S	S	*	*			trans	21.5	81.9	142.4	-78.2	179.7	19.2	0	0	112.7	N1701 K1705	N1701-Q1703 PolarHBondContact O-N 2.92Å; Q1703-K1705 VanDerWaalsContact C-N 3.25Å; Q1703-K1705 PolarHBondContact O-N 3.12Å
1704	T	30.1	Very low	29.1	Very low	120.2 Å²	120.2	158.9 Å²	158.9	74%	0.737	77%	0.772	S	S	*	*			trans	-42.1	78.5	154	50.1	0	0	0	0	112.9	N1702 N1706	N1702-T1704 PolarHBondContact O-N 3.2Å; T1704-N1706 PolarHBondContact O-N 3.41Å
1705	K	29.6	Very low	29.1	Very low	192.8 Å²	192.8	159.1 Å²	159.1	84%	0.838	78%	0.776	S	S	*	*			trans	-125.6	111.3	151.3	-86.3	170	-178.9	177.3	0	109.1	Q1703	Q1703-K1705 VanDerWaalsContact C-N 3.25Å; Q1703-K1705 PolarHBondContact O-N 3.12Å
1706	N	30.4	Very low	28.9	Very low	150.4 Å²	150.4	157.3 Å²	157.3	80%	0.804	79%	0.786	S	S	*	*	S	Bend	trans	108.2	49.6	157.1	-65.8	-16.4	0	0	0	117	T1704	T1704-N1706 PolarHBondContact O-N 3.41Å
1707	C	28.1	Very low	29.2	Very low	128.8 Å²	128.8	157.8 Å²	157.8	87%	0.87	79%	0.792	S	S	*	*			trans	-134.7	58.1	153.6	-91.8	0	0	0	0	111.3	K1709	C1707-K1709 PolarHBondContact O-N 3.29Å; C1707-K1709 VanDerWaalsContact O-N 3.08Å
1708	N	27.8	Very low	29.3	Very low	148.6 Å²	148.6	154.9 Å²	154.9	80%	0.795	79%	0.793	S	S	*	*			trans	-93.3	100.2	174.1	-82.4	-16.6	0	0	0	111.2
1709	K	30.6	Very low	29.7	Very low	200.6 Å²	200.6	158.3 Å²	158.3	87%	0.872	81%	0.805	S	S	*	*	S	Bend	trans	175.4	61.8	162.2	-78.4	178.4	-177.5	-178.7	0	115.3	C1707	C1707-K1709 PolarHBondContact O-N 3.29Å; C1707-K1709 VanDerWaalsContact O-N 3.08Å
1710	R	28.4	Very low	30	Very low	250.8 Å²	250.8	157.1 Å²	157.1	95%	0.946	81%	0.806	S	S	*	*	S	Bend	trans	176.4	77.3	151.5	-101.9	174.1	176.2	167.2	-2.1	115.1
1711	A	31.5	Very low	30.8	Very low	97.2 Å²	97.2	156.4 Å²	156.4	80%	0.803	80%	0.804	S	S	*	*			trans	-166.6	100.1	151.8	0	0	0	0	0	110.8	Y1713	A1711-Y1713 PolarHBondContact O-N 3.37Å; A1711-Y1713 VanDerWaalsContact O-N 3.15Å
1712	K	27.4	Very low	31.8	Very low	199.4 Å²	199.4	155 Å²	155	87%	0.867	80%	0.795	S	S	*	*			trans	-90.6	111.2	163.6	-82.1	-177.4	172.7	-175.7	0	107.2	S1714	K1712-S1714 PolarHBondContact O-N 3.43Å
1713	Y	31.7	Very low	33.1	Very low	225.2 Å²	225.2	154.9 Å²	154.9	88%	0.883	79%	0.79	S	S	*	*			trans	-146.3	113.1	147	-89.6	-75.3	0	0	0	106.7	A1711	A1711-Y1713 PolarHBondContact O-N 3.37Å; A1711-Y1713 VanDerWaalsContact O-N 3.15Å
1714	S	27.8	Very low	34.6	Very low	105.2 Å²	105.2	149.6 Å²	149.6	74%	0.736	77%	0.767	S	S	*	*			trans	-46.4	114.7	165.4	53.6	0	0	0	0	111.3	K1712	K1712-S1714 PolarHBondContact O-N 3.43Å
1715	E	31	Very low	36.3	Very low	181 Å²	181	145.9 Å²	145.9	85%	0.846	74%	0.74	S	S	*	*				169.7	124.7	115.7	-80	175.5	172.4	0	0	110.6	I1717	E1715-I1717 PolarHBondContact O-N 2.97Å
1716	S	28.6	Very low	38.2	Very low	121 Å²	121	141.4 Å²	141.4	85%	0.846	73%	0.729	S	S	*	*			trans	-25.1	104.1	176.2	51.9	0	0	0	0	115.5
1717	I	32.9	Very low	40.2	Very low	154.6 Å²	154.6	135.1 Å²	135.1	79%	0.793	70%	0.696	S	S	*	*			trans	-114.5	128.5	158.3	-57.6	173.3	0	0	0	106.5	E1715	E1715-I1717 PolarHBondContact O-N 2.97Å
1718	P	33.6	Very low	42.6	Very low	101.4 Å²	101.4	131.5 Å²	131.5	66%	0.658	67%	0.67	S	S	*	*			trans	-68.3	146.9	-179.5	10.7	-6.4	0	0	0	111.4	D1720	P1718-D1720 PolarHBondContact O-N 3.14Å
1719	D	33.7	Very low	45	Very low	152.6 Å²	152.6	126.5 Å²	126.5	82%	0.816	64%	0.643	S	S	*	*			trans	-52	64.4	177.6	-82.9	-42	0	0	0	114.1	K1721	D1719-K1721 VanDerWaalsContact C-N 3.28Å; D1719-K1721 PolarHBondContact O-N 3.25Å; D1719-K1721 VanDerWaalsContact O-N 3.13Å; D1719-K1721 VanDerWaalsContact OD1-CE 3.31Å; D1719-K1721 WeakPolarHBondContact OD1-CE 3.41Å; D1719-K1721 IonicContact OD1-NZ 2.68Å; D1719-K1721 PolarHBondContact OD1-NZ 2.67Å
1720	D	35.7	Very low	47.3	Very low	144.2 Å²	144.2	122.2 Å²	122.2	77%	0.771	63%	0.626	S	S	*	*			trans	-75	93.9	170.9	-73.9	-24.4	0	0	0	109.5	P1718 I1722	P1718-D1720 PolarHBondContact O-N 3.14Å; D1720-I1722 PolarHBondContact O-N 3.29Å
1721	K	43.7	Very low	49.7	Very low	155.8 Å²	155.8	110.8 Å²	110.8	68%	0.677	58%	0.584	S	S	*	*			trans	-80.2	108.5	170.4	-73	178.4	-178.8	168	0	108.9	D1719 H1723	D1719-K1721 VanDerWaalsContact C-N 3.28Å; D1719-K1721 PolarHBondContact O-N 3.25Å; D1719-K1721 VanDerWaalsContact O-N 3.13Å; D1719-K1721 VanDerWaalsContact OD1-CE 3.31Å; D1719-K1721 WeakPolarHBondContact OD1-CE 3.41Å; D1719-K1721 IonicContact OD1-NZ 2.68Å; D1719-K1721 PolarHBondContact OD1-NZ 2.67Å; K1721-H1723 PolarHBondContact O-CD2 3.32Å; K1721-H1723 VanDerWaalsContact O-CD2 3.28Å; K1721-H1723 PolarHBondContact O-N 3.01Å
1722	I	49.1	Very low	52.1	Low	111.4 Å²	111.4	106.2 Å²	106.2	57%	0.571	55%	0.546	S	S	*	.			trans	-58.8	114.6	170.7	-59.7	170.2	0	0	0	108.1	E1558 D1720 L1724	E1558-I1722 WeakPolarHBondContact OE1-CA 3.16Å; E1558-I1722 WeakPolarHBondContact OE2-CA 3.39Å; E1558-I1722 WeakPolarHBondContact OE2-CG2 3.28Å; D1720-I1722 PolarHBondContact O-N 3.29Å; I1722-L1724 HydrophobicContact CG2-CD2 4.3Å; I1722-L1724 HydrophobicContact CG2-CG 4.38Å; I1722-L1724 PolarHBondContact O-N 3.18Å
1723	H	54.3	Low	54.8	Low	133.4 Å²	133.4	96.8 Å²	96.8	62%	0.618	51%	0.506	S	S	*	.			trans	-92.4	93.4	177.7	-82.5	-71.6	0	0	0	109.3	E1558 E1696 K1721	E1558-H1723 WeakPolarHBondContact OE1-CA 3.45Å; E1558-H1723 PolarHBondContact OE1-N 3.16Å; E1696-H1723 IonicContact OE1-CE1 3.49Å; E1696-H1723 PolarHBondContact OE1-CE1 3.45Å; E1696-H1723 IonicContact OE1-ND1 3.54Å; E1696-H1723 PolarHBondContact OE1-ND1 3.19Å; E1696-H1723 IonicContact OE2-CE1 3.9Å; E1696-H1723 IonicContact OE2-ND1 2.73Å; K1721-H1723 PolarHBondContact O-CD2 3.32Å; K1721-H1723 VanDerWaalsContact O-CD2 3.28Å; K1721-H1723 PolarHBondContact O-N 3.01Å
1724	L	61.2	Low	57.2	Low	67.6 Å²	67.6	87.2 Å²	87.2	35%	0.354	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-61.3	142.7	174.3	-66.7	168.7	0	0	0	111.3	W1550 L1551 I1722 T1726	W1550-L1724 HydrophobicContact CH2-CB 4.3Å; W1550-L1724 HydrophobicContact CH2-CD1 4.04Å; W1550-L1724 HydrophobicContact CH2-CD2 4.26Å; W1550-L1724 HydrophobicContact CH2-CG 4.39Å; W1550-L1724 HydrophobicContact CZ2-CB 4.28Å; W1550-L1724 HydrophobicContact CZ3-CD2 4.42Å; L1551-L1724 HydrophobicContact CD2-CD2 4.2Å; I1722-L1724 HydrophobicContact CG2-CD2 4.3Å; I1722-L1724 HydrophobicContact CG2-CG 4.38Å; I1722-L1724 PolarHBondContact O-N 3.18Å; L1724-T1726 PolarHBondContact O-N 3.43Å
1725	K	65.5	Low	59.7	Low	42.4 Å²	42.4	82.2 Å²	82.2	18%	0.184	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-62.1	130.2	-179.7	-170.5	174.5	-174.5	169.4	0	110.3	W1550 E1553 S1554 E1557 V1727 T1731	W1550-K1725 PolarHBondContact NE1-O 3.16Å; E1553-K1725 HydrophobicContact CB-CD 4.46Å; E1553-K1725 IonicContact OE2-NZ 3.19Å; E1553-K1725 PolarHBondContact OE2-NZ 3.19Å; S1554-K1725 VanDerWaalsContact OG-CB 3.31Å; S1554-K1725 WeakPolarHBondContact OG-CB 3.43Å; S1554-K1725 PolarHBondContact OG-N 3.15Å; E1557-K1725 VanDerWaalsContact OE1-CE 3.29Å; E1557-K1725 WeakPolarHBondContact OE1-CE 3.31Å; E1557-K1725 IonicContact OE1-NZ 3.72Å; E1557-K1725 PolarHBondContact OE1-NZ 3.24Å; E1557-K1725 WeakPolarHBondContact OE2-CD 3.38Å; E1557-K1725 IonicContact OE2-NZ 3.79Å; K1725-V1727 PolarHBondContact O-N 3.16Å; K1725-T1731 HydrophobicContact CD-CG2 4.27Å; K1725-T1731 HydrophobicContact CG-CG2 4.35Å
1726	T	68.7	Low	62.2	Low	98 Å²	98	73.6 Å²	73.6	60%	0.601	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-62.1	127	-178.6	50.8	0	0	0	0	111	L1724 T1728	L1724-T1726 PolarHBondContact O-N 3.43Å; T1726-T1728 PolarHBondContact O-N 3.09Å; T1726-T1728 VanDerWaalsContact O-N 3.09Å
1727	V	73.5	Confident	64.5	Low	17.2 Å²	17.2	68 Å²	68	10%	0.104	36%	0.355	C	S	.	.			trans	-73.4	102.6	179.9	-177.6	0	0	0	0	110	E1522 R1525 I1526 W1550 K1725 I1732	E1522-V1727 HydrophobicContact CB-CG2 4.27Å; E1522-V1727 WeakPolarHBondContact OE2-CG2 3.3Å; E1522-V1727 PolarHBondContact OE2-N 3.18Å; E1522-V1727 VanDerWaalsContact OE2-N 3.14Å; R1525-V1727 HydrophobicContact CB-CB 4.46Å; R1525-V1727 HydrophobicContact CB-CG1 4.39Å; R1525-V1727 HydrophobicContact CG-CB 4.23Å; R1525-V1727 HydrophobicContact CG-CG1 3.99Å; R1525-V1727 PolarHBondContact NH1-O 3.36Å; R1525-V1727 PolarHBondContact NH2-O 2.89Å; I1526-V1727 HydrophobicContact CB-CG1 4.3Å; I1526-V1727 HydrophobicContact CB-CG2 3.9Å; I1526-V1727 HydrophobicContact CD1-CG1 4Å; I1526-V1727 HydrophobicContact CD1-CG2 4.3Å; W1550-V1727 HydrophobicContact CZ2-CG2 3.84Å; K1725-V1727 PolarHBondContact O-N 3.16Å; V1727-I1732 HydrophobicContact CG1-CD1 3.61Å; V1727-I1732 HydrophobicContact CG1-CG1 4Å
1728	T	77.5	Confident	66.5	Low	53.6 Å²	53.6	61.6 Å²	61.6	33%	0.329	32%	0.324	S	S	.	.			trans	-110.3	164.7	172.3	69.4	0	0	0	0	111	T1726 Q1730 T1731 I1732	T1726-T1728 PolarHBondContact O-N 3.09Å; T1726-T1728 VanDerWaalsContact O-N 3.09Å; T1728-Q1730 PolarHBondContact O-N 3.27Å; T1728-Q1730 PolarHBondContact OG1-N 3.08Å; T1728-Q1730 PolarHBondContact OG1-OE1 2.94Å; T1728-T1731 PolarHBondContact N-OG1 3.32Å; T1728-T1731 PolarHBondContact O-N 3.05Å; T1728-T1731 VanDerWaalsContact O-N 3.1Å; T1728-T1731 PolarHBondContact O-OG1 3.31Å; T1728-T1731 WeakPolarHBondContact OG1-CG2 3.44Å; T1728-T1731 PolarHBondContact OG1-N 3.07Å; T1728-T1731 VanDerWaalsContact OG1-N 3.16Å; T1728-T1731 PolarHBondContact OG1-OG1 2.66Å; T1728-I1732 PolarHBondContact O-N 3.16Å; T1728-I1732 VanDerWaalsContact O-N 3.1Å
1729	L	79.5	Confident	68.3	Low	43.2 Å²	43.2	60.6 Å²	60.6	23%	0.226	31%	0.31	C	S	.	.	H	α-helix	trans	-57.2	-38.1	174.6	-173.2	94.2	0	0	0	111.3	C1533 Y1679 F1683 T1731 I1732 H1733 H1752	C1533-L1729 VanDerWaalsContact SG-CD1 3.6Å; C1533-L1729 WeakPolarHBondContact SG-CD1 3.34Å; Y1679-L1729 HydrophobicContact CE2-CD1 4.28Å; Y1679-L1729 WeakPolarHBondContact OH-CD1 3.38Å; F1683-L1729 HydrophobicContact CD1-CB 3.81Å; F1683-L1729 HydrophobicContact CD1-CD1 4.07Å; F1683-L1729 HydrophobicContact CD1-CG 4.44Å; F1683-L1729 HydrophobicContact CD2-CD1 4.16Å; F1683-L1729 HydrophobicContact CE1-CB 3.9Å; F1683-L1729 HydrophobicContact CE1-CD1 4.04Å; F1683-L1729 HydrophobicContact CE1-CG 4.43Å; F1683-L1729 HydrophobicContact CE2-CD1 4.02Å; F1683-L1729 HydrophobicContact CG-CB 4.43Å; F1683-L1729 HydrophobicContact CG-CD1 4.12Å; F1683-L1729 HydrophobicContact CZ-CD1 3.94Å; L1729-T1731 PolarHBondContact O-N 2.92Å; L1729-I1732 PolarHBondContact O-N 3.31Å; L1729-H1733 WeakPolarHBondContact O-CB 3.3Å; L1729-H1733 PolarHBondContact O-CD2 3.26Å; L1729-H1733 VanDerWaalsContact O-CD2 3.27Å; L1729-H1733 PolarHBondContact O-N 3.07Å; L1729-H1733 VanDerWaalsContact O-N 3.11Å; L1729-H1752 HydrophobicContact CD2-CB 4.45Å
1730	Q	78.5	Confident	70.1	Confident	110.2 Å²	110.2	54.4 Å²	54.4	52%	0.515	28%	0.276	S	S	.	.	H	α-helix	trans	-65.2	-43.4	177.2	-81.8	157.4	-16.7	0	0	112.1	T1728 I1732 H1733 N1734 A1753	T1728-Q1730 PolarHBondContact O-N 3.27Å; T1728-Q1730 PolarHBondContact OG1-N 3.08Å; T1728-Q1730 PolarHBondContact OG1-OE1 2.94Å; Q1730-I1732 VanDerWaalsContact C-N 3.34Å; Q1730-I1732 PolarHBondContact O-N 3.12Å; Q1730-H1733 PolarHBondContact O-N 3.04Å; Q1730-N1734 VanDerWaalsContact O-CB 3.31Å; Q1730-N1734 WeakPolarHBondContact O-CB 3.3Å; Q1730-N1734 VanDerWaalsContact O-CG 3.3Å; Q1730-N1734 PolarHBondContact O-N 2.87Å; Q1730-N1734 PolarHBondContact O-ND2 3.27Å; Q1730-N1734 VanDerWaalsContact O-ND2 3.13Å; Q1730-A1753 HydrophobicContact CG-CB 4.47Å; Q1730-A1753 WeakPolarHBondContact CG-O 3.06Å; Q1730-A1753 PolarHBondContact NE2-O 2.88Å
1731	T	78.3	Confident	71.3	Confident	12 Å²	12	54.6 Å²	54.6	7%	0.074	27%	0.266	C	S	.	.	H	α-helix	trans	-63.4	-40.9	178.1	55.8	0	0	0	0	112.1	K1725 T1728 L1729 N1734 I1735	K1725-T1731 HydrophobicContact CD-CG2 4.27Å; K1725-T1731 HydrophobicContact CG-CG2 4.35Å; T1728-T1731 PolarHBondContact N-OG1 3.32Å; T1728-T1731 PolarHBondContact O-N 3.05Å; T1728-T1731 VanDerWaalsContact O-N 3.1Å; T1728-T1731 PolarHBondContact O-OG1 3.31Å; T1728-T1731 WeakPolarHBondContact OG1-CG2 3.44Å; T1728-T1731 PolarHBondContact OG1-N 3.07Å; T1728-T1731 VanDerWaalsContact OG1-N 3.16Å; T1728-T1731 PolarHBondContact OG1-OG1 2.66Å; L1729-T1731 PolarHBondContact O-N 2.92Å; T1731-N1734 WeakPolarHBondContact O-CB 3.34Å; T1731-N1734 PolarHBondContact O-N 3.24Å; T1731-I1735 VanDerWaalsContact O-CD1 3.28Å; T1731-I1735 WeakPolarHBondContact O-CD1 3.29Å; T1731-I1735 VanDerWaalsContact O-CG1 3.3Å; T1731-I1735 WeakPolarHBondContact O-CG1 3.37Å; T1731-I1735 PolarHBondContact O-N 3.15Å; T1731-I1735 VanDerWaalsContact O-N 3.1Å
1732	I	82.6	Confident	72.4	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.5	-46.7	178.2	-72	159.4	0	0	0	111	I1526 L1530 C1533 F1683 V1727 T1728 L1729 Q1730 N1734 I1735 L1736	I1526-I1732 HydrophobicContact CD1-CG1 3.76Å; L1530-I1732 HydrophobicContact CD2-CG2 4.24Å; C1533-I1732 HydrophobicContact CB-CG2 3.69Å; F1683-I1732 HydrophobicContact CE1-CD1 3.67Å; F1683-I1732 HydrophobicContact CZ-CD1 3.55Å; F1683-I1732 VanDerWaalsContact CZ-CD1 3.48Å; V1727-I1732 HydrophobicContact CG1-CD1 3.61Å; V1727-I1732 HydrophobicContact CG1-CG1 4Å; T1728-I1732 PolarHBondContact O-N 3.16Å; T1728-I1732 VanDerWaalsContact O-N 3.1Å; L1729-I1732 PolarHBondContact O-N 3.31Å; Q1730-I1732 VanDerWaalsContact C-N 3.34Å; Q1730-I1732 PolarHBondContact O-N 3.12Å; I1732-N1734 VanDerWaalsContact C-N 3.3Å; I1732-N1734 PolarHBondContact O-N 3.21Å; I1732-I1735 PolarHBondContact O-N 3.1Å; I1732-L1736 HydrophobicContact CG2-CD1 3.89Å; I1732-L1736 HydrophobicContact CG2-CG 4.45Å; I1732-L1736 WeakPolarHBondContact O-CG 3.43Å; I1732-L1736 PolarHBondContact O-N 3.01Å
1733	H	83.1	Confident	73.2	Confident	3.6 Å²	3.6	44.5 Å²	44.5	2%	0.017	22%	0.22	C	C	.	.	H	α-helix	trans	-67	-31.3	178.1	-81.2	-71.5	0	0	0	112.8	C1533 L1729 Q1730 L1736 A1737 Y1748 H1749 H1752 A1753	C1533-H1733 PolarHBondContact SG-NE2 3.44Å; L1729-H1733 WeakPolarHBondContact O-CB 3.3Å; L1729-H1733 PolarHBondContact O-CD2 3.26Å; L1729-H1733 VanDerWaalsContact O-CD2 3.27Å; L1729-H1733 PolarHBondContact O-N 3.07Å; L1729-H1733 VanDerWaalsContact O-N 3.11Å; Q1730-H1733 PolarHBondContact O-N 3.04Å; H1733-L1736 PolarHBondContact O-N 3.22Å; H1733-A1737 VanDerWaalsContact O-CB 3.27Å; H1733-A1737 WeakPolarHBondContact O-CB 3.46Å; H1733-A1737 PolarHBondContact O-N 3.14Å; H1733-Y1748 AromaticContact CE1-CE1 3.88Å; H1733-H1749 WeakPolarHBondContact CB-O 3.41Å; H1733-H1749 AromaticContact CE1-CE1 3.98Å; H1733-H1749 AromaticContact CE1-ND1 3.55Å; H1733-H1749 PolarHBondContact CE1-ND1 2.95Å; H1733-H1749 AromaticContact CG-ND1 3.92Å; H1733-H1749 AromaticContact ND1-CE1 3.83Å; H1733-H1749 AromaticContact ND1-CG 3.88Å; H1733-H1749 AromaticContact ND1-ND1 3.01Å; H1733-H1749 PolarHBondContact ND1-ND1 3.31Å; H1733-H1749 VanDerWaalsContact ND1-ND1 3.18Å; H1733-H1752 HydrophobicContact CB-CB 4.24Å; H1733-H1752 WeakPolarHBondContact CD2-CB 3.22Å; H1733-H1752 AromaticContact CE1-CG 3.93Å; H1733-H1752 WeakPolarHBondContact ND1-CB 3.36Å; H1733-A1753 HydrophobicContact CB-CB 3.95Å
1734	N	81.3	Confident	73.8	Confident	21.8 Å²	21.8	41.3 Å²	41.3	12%	0.117	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-49	170.9	-94.9	-22.3	0	0	0	112	E1553 Q1730 T1731 I1732 L1736 A1737 S1738 A1753 R1755	E1553-N1734 PolarHBondContact OE1-ND2 2.9Å; Q1730-N1734 VanDerWaalsContact O-CB 3.31Å; Q1730-N1734 WeakPolarHBondContact O-CB 3.3Å; Q1730-N1734 VanDerWaalsContact O-CG 3.3Å; Q1730-N1734 PolarHBondContact O-N 2.87Å; Q1730-N1734 PolarHBondContact O-ND2 3.27Å; Q1730-N1734 VanDerWaalsContact O-ND2 3.13Å; T1731-N1734 WeakPolarHBondContact O-CB 3.34Å; T1731-N1734 PolarHBondContact O-N 3.24Å; I1732-N1734 VanDerWaalsContact C-N 3.3Å; I1732-N1734 PolarHBondContact O-N 3.21Å; N1734-L1736 VanDerWaalsContact C-N 3.33Å; N1734-L1736 PolarHBondContact O-N 3.22Å; N1734-A1737 PolarHBondContact O-N 3.34Å; N1734-A1737 VanDerWaalsContact O-N 3.16Å; N1734-S1738 WeakPolarHBondContact O-CB 3.3Å; N1734-S1738 PolarHBondContact O-N 2.99Å; N1734-S1738 PolarHBondContact O-OG 3.11Å; N1734-S1738 VanDerWaalsContact O-OG 3.1Å; N1734-A1753 HydrophobicContact CB-CB 4.3Å; N1734-A1753 VanDerWaalsContact OD1-CB 3.24Å; N1734-A1753 WeakPolarHBondContact OD1-CB 3.39Å; N1734-R1755 PolarHBondContact ND2-NH2 3.36Å; N1734-R1755 VanDerWaalsContact OD1-CD 3.27Å; N1734-R1755 WeakPolarHBondContact OD1-CD 3.24Å; N1734-R1755 PolarHBondContact OD1-NE 2.96Å; N1734-R1755 PolarHBondContact OD1-NH2 3.33Å
1735	I	81.9	Confident	74.4	Confident	0.6 Å²	0.6	38.3 Å²	38.3	0%	0.003	19%	0.189	C	C	.	.	H	α-helix	trans	-64.5	-41.1	180	-65.3	155.8	0	0	0	111	I1526 L1530 L1546 W1550 T1731 I1732 A1737 S1738 K1739	I1526-I1735 HydrophobicContact CD1-CD1 4.05Å; L1530-I1735 HydrophobicContact CD2-CB 4.48Å; L1530-I1735 HydrophobicContact CD2-CG2 4.25Å; L1546-I1735 HydrophobicContact CB-CG2 4.21Å; L1546-I1735 HydrophobicContact CD2-CG2 3.85Å; W1550-I1735 HydrophobicContact CB-CD1 3.74Å; W1550-I1735 HydrophobicContact CG-CD1 4.1Å; T1731-I1735 VanDerWaalsContact O-CD1 3.28Å; T1731-I1735 WeakPolarHBondContact O-CD1 3.29Å; T1731-I1735 VanDerWaalsContact O-CG1 3.3Å; T1731-I1735 WeakPolarHBondContact O-CG1 3.37Å; T1731-I1735 PolarHBondContact O-N 3.15Å; T1731-I1735 VanDerWaalsContact O-N 3.1Å; I1732-I1735 PolarHBondContact O-N 3.1Å; I1735-A1737 VanDerWaalsContact C-N 3.35Å; I1735-A1737 PolarHBondContact O-N 3.45Å; I1735-S1738 PolarHBondContact O-N 3.25Å; I1735-S1738 PolarHBondContact O-OG 3.22Å; I1735-S1738 VanDerWaalsContact O-OG 3.13Å; I1735-K1739 PolarHBondContact O-N 3.01Å; I1735-K1739 VanDerWaalsContact O-N 3.09Å
1736	L	82.5	Confident	75.1	Confident	1.2 Å²	1.2	36.6 Å²	36.6	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-64.2	-41.6	175.2	-69.8	171.2	0	0	0	111.4	L1530 C1533 L1546 I1732 H1733 N1734 L1740 H1749	L1530-L1736 HydrophobicContact CD2-CD2 3.9Å; L1530-L1736 HydrophobicContact CD2-CG 4Å; C1533-L1736 HydrophobicContact CB-CD1 3.79Å; L1546-L1736 HydrophobicContact CD1-CD2 4.09Å; L1546-L1736 HydrophobicContact CD2-CD2 4.48Å; I1732-L1736 HydrophobicContact CG2-CD1 3.89Å; I1732-L1736 HydrophobicContact CG2-CG 4.45Å; I1732-L1736 WeakPolarHBondContact O-CG 3.43Å; I1732-L1736 PolarHBondContact O-N 3.01Å; H1733-L1736 PolarHBondContact O-N 3.22Å; N1734-L1736 VanDerWaalsContact C-N 3.33Å; N1734-L1736 PolarHBondContact O-N 3.22Å; L1736-L1740 HydrophobicContact CB-CB 4.44Å; L1736-L1740 HydrophobicContact CD2-CB 4.25Å; L1736-L1740 HydrophobicContact CD2-CD1 4.36Å; L1736-L1740 HydrophobicContact CD2-CD2 4.35Å; L1736-L1740 HydrophobicContact CD2-CG 4.37Å; L1736-L1740 VanDerWaalsContact O-CA 3.3Å; L1736-L1740 WeakPolarHBondContact O-CA 3.37Å; L1736-L1740 WeakPolarHBondContact O-CB 3.29Å; L1736-L1740 PolarHBondContact O-N 3.18Å; L1736-L1740 VanDerWaalsContact O-N 3.13Å; L1736-H1749 HydrophobicContact CB-CB 4.4Å; L1736-H1749 VanDerWaalsContact CD1-CE1 3.45Å; L1736-H1749 WeakPolarHBondContact CD1-CE1 3.44Å
1737	A	78	Confident	75.6	Confident	3 Å²	3	32.2 Å²	32.2	3%	0.025	16%	0.155	C	C	.	.	H	α-helix	trans	-67.4	-39.7	177.6	0	0	0	0	0	113	H1733 N1734 I1735 L1746 H1749 L1750	H1733-A1737 VanDerWaalsContact O-CB 3.27Å; H1733-A1737 WeakPolarHBondContact O-CB 3.46Å; H1733-A1737 PolarHBondContact O-N 3.14Å; N1734-A1737 PolarHBondContact O-N 3.34Å; N1734-A1737 VanDerWaalsContact O-N 3.16Å; I1735-A1737 VanDerWaalsContact C-N 3.35Å; I1735-A1737 PolarHBondContact O-N 3.45Å; A1737-L1746 HydrophobicContact CB-CD1 4.06Å; A1737-L1746 WeakPolarHBondContact O-CD1 3.31Å; A1737-H1749 HydrophobicContact CB-CB 3.84Å; A1737-L1750 HydrophobicContact CB-CD2 3.67Å; A1737-L1750 HydrophobicContact CB-CG 3.86Å
1738	S	73.9	Confident	75.9	Confident	21 Å²	21	34.6 Å²	34.6	15%	0.147	16%	0.162	C	C	.	.	H	α-helix	trans	-78.1	-29.6	-174	60.5	0	0	0	0	113.5	N1734 I1735	N1734-S1738 WeakPolarHBondContact O-CB 3.3Å; N1734-S1738 PolarHBondContact O-N 2.99Å; N1734-S1738 PolarHBondContact O-OG 3.11Å; N1734-S1738 VanDerWaalsContact O-OG 3.1Å; I1735-S1738 PolarHBondContact O-N 3.25Å; I1735-S1738 PolarHBondContact O-OG 3.22Å; I1735-S1738 VanDerWaalsContact O-OG 3.13Å
1739	K	72.2	Confident	76.2	Confident	80.8 Å²	80.8	32.2 Å²	32.2	35%	0.351	15%	0.147	S	C	.	.	H	α-helix	trans	-128.1	-21.5	-169.2	-60.1	-65.5	176	149.2	0	115.7	L1546 E1549 I1735 R1741	L1546-K1739 HydrophobicContact CD2-CB 4.04Å; E1549-K1739 HydrophobicContact CB-CG 4.31Å; E1549-K1739 HydrophobicContact CG-CB 4.45Å; E1549-K1739 HydrophobicContact CG-CD 4.25Å; E1549-K1739 VanDerWaalsContact CG-CE 3.47Å; E1549-K1739 HydrophobicContact CG-CG 3.93Å; E1549-K1739 WeakPolarHBondContact OE1-CD 3.38Å; E1549-K1739 WeakPolarHBondContact OE1-CE 3.27Å; E1549-K1739 IonicContact OE1-NZ 3.22Å; E1549-K1739 PolarHBondContact OE1-NZ 3.27Å; E1549-K1739 VanDerWaalsContact OE2-CE 3.27Å; E1549-K1739 WeakPolarHBondContact OE2-CE 3.34Å; E1549-K1739 IonicContact OE2-NZ 2.78Å; E1549-K1739 PolarHBondContact OE2-NZ 3.1Å; I1735-K1739 PolarHBondContact O-N 3.01Å; I1735-K1739 VanDerWaalsContact O-N 3.09Å; K1739-R1741 VanDerWaalsContact C-N 3.3Å; K1739-R1741 WeakPolarHBondContact O-CG 3.3Å; K1739-R1741 PolarHBondContact O-N 3.07Å; K1739-R1741 VanDerWaalsContact O-N 3.15Å
1740	L	70	Confident	76.2	Confident	21 Å²	21	30.2 Å²	30.2	11%	0.11	14%	0.137	C	C	.	.			trans	-72.3	113.9	176.3	-159	81.2	0	0	0	108.6	L1538 L1546 L1736 N1742	L1538-L1740 HydrophobicContact CD2-CD1 3.49Å; L1538-L1740 VanDerWaalsContact CD2-CD1 3.45Å; L1538-L1740 HydrophobicContact CD2-CD2 4.02Å; L1538-L1740 HydrophobicContact CD2-CG 4.08Å; L1546-L1740 HydrophobicContact CD1-CD1 3.89Å; L1546-L1740 VanDerWaalsContact CD1-CD1 3.45Å; L1546-L1740 HydrophobicContact CD2-CB 4.49Å; L1546-L1740 HydrophobicContact CD2-CD1 4.03Å; L1546-L1740 HydrophobicContact CG-CD1 4.19Å; L1736-L1740 HydrophobicContact CB-CB 4.44Å; L1736-L1740 HydrophobicContact CD2-CB 4.25Å; L1736-L1740 HydrophobicContact CD2-CD1 4.36Å; L1736-L1740 HydrophobicContact CD2-CD2 4.35Å; L1736-L1740 HydrophobicContact CD2-CG 4.37Å; L1736-L1740 VanDerWaalsContact O-CA 3.3Å; L1736-L1740 WeakPolarHBondContact O-CA 3.37Å; L1736-L1740 WeakPolarHBondContact O-CB 3.29Å; L1736-L1740 PolarHBondContact O-N 3.18Å; L1736-L1740 VanDerWaalsContact O-N 3.13Å; L1740-N1742 HydrophobicContact CD2-CB 4.12Å; L1740-N1742 HydrophobicContact CG-CB 4.2Å; L1740-N1742 PolarHBondContact O-N 3.03Å
1741	R	62.8	Low	76.3	Confident	149.4 Å²	149.4	27 Å²	27	56%	0.564	12%	0.122	S	C	*	.	S	Bend	trans	-71.8	49	-176	-64.5	179.2	176.9	176.1	-4.1	112.9	F1595 N1599 K1739	F1595-R1741 HydrophobicContact CD1-CB 4.47Å; F1595-R1741 HydrophobicContact CD1-CG 4.32Å; F1595-R1741 HydrophobicContact CE1-CG 4.36Å; N1599-R1741 PolarHBondContact O-NH2 3.07Å; K1739-R1741 VanDerWaalsContact C-N 3.3Å; K1739-R1741 WeakPolarHBondContact O-CG 3.3Å; K1739-R1741 PolarHBondContact O-N 3.07Å; K1739-R1741 VanDerWaalsContact O-N 3.15Å
1742	N	66.3	Low	76.2	Confident	28.2 Å²	28.2	30 Å²	30	15%	0.151	14%	0.135	C	C	.	.			trans	-131.4	92.2	-177.3	-179.2	13.7	0	0	0	110.4	Q1536 L1740 K1744 D1745 L1746	Q1536-N1742 VanDerWaalsContact CD-ND2 3.29Å; Q1536-N1742 PolarHBondContact NE2-ND2 3.05Å; Q1536-N1742 VanDerWaalsContact NE2-ND2 3.13Å; Q1536-N1742 PolarHBondContact OE1-ND2 2.93Å; Q1536-N1742 VanDerWaalsContact OE1-ND2 3.14Å; L1740-N1742 HydrophobicContact CD2-CB 4.12Å; L1740-N1742 HydrophobicContact CG-CB 4.2Å; L1740-N1742 PolarHBondContact O-N 3.03Å; N1742-K1744 PolarHBondContact O-N 2.94Å; N1742-K1744 VanDerWaalsContact O-N 3.11Å; N1742-K1744 VanDerWaalsContact OD1-CB 3.24Å; N1742-K1744 WeakPolarHBondContact OD1-CB 3.34Å; N1742-K1744 PolarHBondContact OD1-N 3.21Å; N1742-K1744 VanDerWaalsContact OD1-N 3.15Å; N1742-D1745 PolarHBondContact ND2-OD2 3.24Å; N1742-D1745 VanDerWaalsContact ND2-OD2 3.08Å; N1742-D1745 PolarHBondContact O-N 3.19Å; N1742-L1746 PolarHBondContact O-N 3.2Å; N1742-L1746 VanDerWaalsContact O-N 3.17Å
1743	M	65.5	Low	76	Confident	26 Å²	26	30.4 Å²	30.4	13%	0.128	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-24	179	-69.3	-64.2	-81.1	0	0	113.4	N1592 F1595 D1745 L1746 F1768 Q1772	N1592-M1743 WeakPolarHBondContact OD1-CE 3.36Å; F1595-M1743 HydrophobicContact CD2-CE 4.28Å; F1595-M1743 HydrophobicContact CD2-SD 3.93Å; F1595-M1743 VanDerWaalsContact CD2-SD 3.56Å; F1595-M1743 HydrophobicContact CE2-CE 4.26Å; F1595-M1743 HydrophobicContact CE2-SD 3.86Å; F1595-M1743 WeakPolarHBondContact CE2-SD 3.37Å; F1595-M1743 HydrophobicContact CG-SD 4.35Å; F1595-M1743 HydrophobicContact CZ-SD 4.1Å; M1743-D1745 VanDerWaalsContact C-N 3.33Å; M1743-D1745 PolarHBondContact O-N 2.96Å; M1743-L1746 HydrophobicContact CE-CD2 4.27Å; M1743-L1746 WeakPolarHBondContact O-CB 3.25Å; M1743-L1746 PolarHBondContact O-N 3.2Å; M1743-L1746 HydrophobicContact SD-CD2 3.85Å; M1743-F1768 HydrophobicContact CE-CD2 3.58Å; M1743-F1768 VanDerWaalsContact CE-CD2 3.43Å; M1743-F1768 HydrophobicContact CE-CE2 3.55Å; M1743-F1768 VanDerWaalsContact CE-CE2 3.45Å; M1743-F1768 HydrophobicContact SD-CE2 4.49Å; M1743-Q1772 PolarHBondContact O-NE2 3.09Å
1744	K	66.5	Low	75.5	Confident	66 Å²	66	32.6 Å²	32.6	29%	0.287	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-40.4	179.9	-172.2	-169.7	180	-178.7	0	112.6	N1742 Y1777	N1742-K1744 PolarHBondContact O-N 2.94Å; N1742-K1744 VanDerWaalsContact O-N 3.11Å; N1742-K1744 VanDerWaalsContact OD1-CB 3.24Å; N1742-K1744 WeakPolarHBondContact OD1-CB 3.34Å; N1742-K1744 PolarHBondContact OD1-N 3.21Å; N1742-K1744 VanDerWaalsContact OD1-N 3.15Å; K1744-Y1777 HydrophobicContact CB-CD1 4.5Å; K1744-Y1777 HydrophobicContact CB-CD2 4.23Å; K1744-Y1777 HydrophobicContact CB-CE1 4.38Å; K1744-Y1777 HydrophobicContact CB-CE2 4.08Å; K1744-Y1777 HydrophobicContact CB-CG 4.41Å; K1744-Y1777 HydrophobicContact CD-CD1 4.17Å; K1744-Y1777 HydrophobicContact CD-CE1 3.61Å; K1744-Y1777 HydrophobicContact CD-CE2 4.29Å; K1744-Y1777 HydrophobicContact CG-CD1 3.99Å; K1744-Y1777 HydrophobicContact CG-CD2 4.15Å; K1744-Y1777 HydrophobicContact CG-CE1 3.88Å; K1744-Y1777 HydrophobicContact CG-CE2 4.22Å; K1744-Y1777 HydrophobicContact CG-CG 4.2Å
1745	D	73.3	Confident	75.3	Confident	4.4 Å²	4.4	33.2 Å²	33.2	2%	0.024	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	3.9	-174.9	-64.5	-52.2	0	0	0	112.1	R1535 Q1536 N1742 M1743 I1747 Y1748 H1749	R1535-D1745 VanDerWaalsContact CD-OD1 3.27Å; R1535-D1745 WeakPolarHBondContact CD-OD1 3.39Å; R1535-D1745 IonicContact CZ-OD1 3.17Å; R1535-D1745 IonicContact NE-OD1 3.3Å; R1535-D1745 PolarHBondContact NE-OD1 3.04Å; R1535-D1745 IonicContact NH1-OD1 3.58Å; R1535-D1745 PolarHBondContact NH1-OD1 3.13Å; Q1536-D1745 PolarHBondContact NE2-OD2 3.43Å; N1742-D1745 PolarHBondContact ND2-OD2 3.24Å; N1742-D1745 VanDerWaalsContact ND2-OD2 3.08Å; N1742-D1745 PolarHBondContact O-N 3.19Å; M1743-D1745 VanDerWaalsContact C-N 3.33Å; M1743-D1745 PolarHBondContact O-N 2.96Å; D1745-I1747 PolarHBondContact O-N 3.11Å; D1745-Y1748 WeakPolarHBondContact O-CB 3.33Å; D1745-Y1748 PolarHBondContact O-N 3.29Å; D1745-H1749 PolarHBondContact O-CD2 3.17Å; D1745-H1749 VanDerWaalsContact O-CD2 3.24Å; D1745-H1749 PolarHBondContact O-N 3.17Å
1746	L	80.3	Confident	75	Confident	6.6 Å²	6.6	34.8 Å²	34.8	4%	0.035	17%	0.17	C	C	.	.	H	α-helix	trans	-58.9	-50.8	-178.4	179.3	62.2	0	0	0	112.3	W1568 A1737 N1742 M1743 Y1748 H1749 L1750 L1762 F1768	W1568-L1746 HydrophobicContact CH2-CD2 3.98Å; W1568-L1746 HydrophobicContact CZ2-CD1 4.41Å; W1568-L1746 HydrophobicContact CZ2-CD2 4.2Å; A1737-L1746 HydrophobicContact CB-CD1 4.06Å; A1737-L1746 WeakPolarHBondContact O-CD1 3.31Å; N1742-L1746 PolarHBondContact O-N 3.2Å; N1742-L1746 VanDerWaalsContact O-N 3.17Å; M1743-L1746 HydrophobicContact CE-CD2 4.27Å; M1743-L1746 WeakPolarHBondContact O-CB 3.25Å; M1743-L1746 PolarHBondContact O-N 3.2Å; M1743-L1746 HydrophobicContact SD-CD2 3.85Å; L1746-Y1748 VanDerWaalsContact C-N 3.27Å; L1746-Y1748 PolarHBondContact O-N 3.13Å; L1746-H1749 PolarHBondContact O-N 3.11Å; L1746-L1750 HydrophobicContact CD1-CD1 3.95Å; L1746-L1750 HydrophobicContact CD1-CG 4.12Å; L1746-L1750 HydrophobicContact CG-CD1 3.94Å; L1746-L1750 HydrophobicContact CG-CG 4.48Å; L1746-L1750 WeakPolarHBondContact O-CB 3.15Å; L1746-L1750 WeakPolarHBondContact O-CG 3.25Å; L1746-L1750 PolarHBondContact O-N 3.16Å; L1746-L1762 HydrophobicContact CD2-CD1 3.92Å; L1746-L1762 HydrophobicContact CG-CD1 4.19Å; L1746-F1768 HydrophobicContact CD2-CE2 4.18Å
1747	I	80.9	Confident	74.7	Confident	7.4 Å²	7.4	38.1 Å²	38.1	4%	0.038	19%	0.188	C	C	.	.	H	α-helix	trans	-61.6	-40.7	179.7	-56.3	165.2	0	0	0	110.4	D1745 H1749 L1750 H1751 V1759 L1763 F1768 L1781 D1784 Y1788	D1745-I1747 PolarHBondContact O-N 3.11Å; I1747-H1749 PolarHBondContact O-N 2.78Å; I1747-L1750 PolarHBondContact O-N 3.22Å; I1747-H1751 VanDerWaalsContact O-CB 3.29Å; I1747-H1751 WeakPolarHBondContact O-CB 3.39Å; I1747-H1751 PolarHBondContact O-N 3.23Å; I1747-V1759 HydrophobicContact CG2-CG1 3.9Å; I1747-V1759 HydrophobicContact CG2-CG2 4.32Å; I1747-L1763 HydrophobicContact CD1-CD2 3.73Å; I1747-L1763 HydrophobicContact CD1-CG 4.46Å; I1747-L1763 HydrophobicContact CG1-CD2 4.45Å; I1747-L1763 HydrophobicContact CG2-CD2 4.42Å; I1747-L1763 HydrophobicContact CG2-CG 4.46Å; I1747-F1768 HydrophobicContact CD1-CE1 3.67Å; I1747-F1768 VanDerWaalsContact CD1-CE1 3.45Å; I1747-F1768 HydrophobicContact CD1-CZ 3.7Å; I1747-F1768 VanDerWaalsContact CD1-CZ 3.49Å; I1747-F1768 HydrophobicContact CG1-CE1 4.15Å; I1747-F1768 HydrophobicContact CG1-CZ 3.78Å; I1747-L1781 HydrophobicContact CD1-CD1 3.99Å; I1747-D1784 HydrophobicContact CD1-CB 4.1Å; I1747-D1784 HydrophobicContact CG2-CB 4.05Å; I1747-Y1788 HydrophobicContact CB-CE2 4.22Å; I1747-Y1788 HydrophobicContact CG2-CD2 4.16Å; I1747-Y1788 HydrophobicContact CG2-CE1 4.47Å; I1747-Y1788 HydrophobicContact CG2-CE2 3.35Å; I1747-Y1788 PolarHBondContact O-OH 3.26Å
1748	Y	79.5	Confident	74.8	Confident	67 Å²	67	39.1 Å²	39.1	26%	0.263	19%	0.192	S	C	.	.	H	α-helix	trans	-60.1	-47.1	177.1	171.5	-96.8	0	0	0	111.6	R1535 H1733 D1745 L1746 H1751 H1752 Y1788	R1535-Y1748 HydrophobicContact CG-CD1 4.27Å; R1535-Y1748 HydrophobicContact CG-CE1 4.04Å; H1733-Y1748 AromaticContact CE1-CE1 3.88Å; D1745-Y1748 WeakPolarHBondContact O-CB 3.33Å; D1745-Y1748 PolarHBondContact O-N 3.29Å; L1746-Y1748 VanDerWaalsContact C-N 3.27Å; L1746-Y1748 PolarHBondContact O-N 3.13Å; Y1748-H1751 PolarHBondContact O-N 3.1Å; Y1748-H1752 AromaticContact CD2-CD2 3.67Å; Y1748-H1752 AromaticContact CD2-NE2 3.87Å; Y1748-H1752 AromaticContact CE1-CD2 3.86Å; Y1748-H1752 AromaticContact CE2-CD2 3.28Å; Y1748-H1752 WeakPolarHBondContact CE2-CD2 3.41Å; Y1748-H1752 AromaticContact CE2-NE2 3.18Å; Y1748-H1752 VanDerWaalsContact CE2-NE2 3.26Å; Y1748-H1752 WeakPolarHBondContact CE2-NE2 3.28Å; Y1748-H1752 AromaticContact CZ-CD2 3.47Å; Y1748-H1752 VanDerWaalsContact CZ-CD2 3.5Å; Y1748-H1752 AromaticContact CZ-NE2 3.6Å; Y1748-H1752 PolarHBondContact O-CD2 2.98Å; Y1748-H1752 VanDerWaalsContact O-CD2 3.29Å; Y1748-H1752 PolarHBondContact O-N 3.24Å; Y1748-H1752 VanDerWaalsContact O-N 3.12Å; Y1748-Y1788 WeakPolarHBondContact CA-OH 3.48Å; Y1748-Y1788 PolarHBondContact N-OH 3.38Å
1749	H	82.5	Confident	75.1	Confident	2.8 Å²	2.8	38.1 Å²	38.1	1%	0.013	19%	0.185	C	C	.	.	H	α-helix	trans	-68.7	-43.9	178.9	-69.3	-48.8	0	0	0	112.4	C1533 H1733 L1736 A1737 D1745 L1746 I1747 H1751 H1752 A1753	C1533-H1749 PolarHBondContact O-CE1 3.13Å; H1733-H1749 WeakPolarHBondContact CB-O 3.41Å; H1733-H1749 AromaticContact CE1-CE1 3.98Å; H1733-H1749 AromaticContact CE1-ND1 3.55Å; H1733-H1749 PolarHBondContact CE1-ND1 2.95Å; H1733-H1749 AromaticContact CG-ND1 3.92Å; H1733-H1749 AromaticContact ND1-CE1 3.83Å; H1733-H1749 AromaticContact ND1-CG 3.88Å; H1733-H1749 AromaticContact ND1-ND1 3.01Å; H1733-H1749 PolarHBondContact ND1-ND1 3.31Å; H1733-H1749 VanDerWaalsContact ND1-ND1 3.18Å; L1736-H1749 HydrophobicContact CB-CB 4.4Å; L1736-H1749 VanDerWaalsContact CD1-CE1 3.45Å; L1736-H1749 WeakPolarHBondContact CD1-CE1 3.44Å; A1737-H1749 HydrophobicContact CB-CB 3.84Å; D1745-H1749 PolarHBondContact O-CD2 3.17Å; D1745-H1749 VanDerWaalsContact O-CD2 3.24Å; D1745-H1749 PolarHBondContact O-N 3.17Å; L1746-H1749 PolarHBondContact O-N 3.11Å; I1747-H1749 PolarHBondContact O-N 2.78Å; H1749-H1751 VanDerWaalsContact C-N 3.33Å; H1749-H1751 PolarHBondContact O-N 3.14Å; H1749-H1752 PolarHBondContact O-N 2.97Å; H1749-A1753 VanDerWaalsContact O-CB 3.27Å; H1749-A1753 WeakPolarHBondContact O-CB 3.26Å; H1749-A1753 PolarHBondContact O-N 3.28Å
1750	L	81	Confident	75.5	Confident	1.2 Å²	1.2	34.3 Å²	34.3	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-41.3	176.3	-71.2	171.7	0	0	0	112.5	W1568 A1737 L1746 I1747 H1752 A1753 G1754 R1755 E1758 V1759 L1762	W1568-L1750 HydrophobicContact CZ3-CD1 4.4Å; A1737-L1750 HydrophobicContact CB-CD2 3.67Å; A1737-L1750 HydrophobicContact CB-CG 3.86Å; L1746-L1750 HydrophobicContact CD1-CD1 3.95Å; L1746-L1750 HydrophobicContact CD1-CG 4.12Å; L1746-L1750 HydrophobicContact CG-CD1 3.94Å; L1746-L1750 HydrophobicContact CG-CG 4.48Å; L1746-L1750 WeakPolarHBondContact O-CB 3.15Å; L1746-L1750 WeakPolarHBondContact O-CG 3.25Å; L1746-L1750 PolarHBondContact O-N 3.16Å; I1747-L1750 PolarHBondContact O-N 3.22Å; L1750-H1752 PolarHBondContact O-N 3.44Å; L1750-A1753 WeakPolarHBondContact O-CB 3.48Å; L1750-A1753 PolarHBondContact O-N 2.96Å; L1750-A1753 VanDerWaalsContact O-N 3.15Å; L1750-G1754 PolarHBondContact O-N 3.18Å; L1750-R1755 HydrophobicContact CB-CB 4.36Å; L1750-R1755 HydrophobicContact CD2-CB 4.07Å; L1750-R1755 HydrophobicContact CD2-CG 4.42Å; L1750-R1755 PolarHBondContact O-N 3.17Å; L1750-R1755 VanDerWaalsContact O-N 3.08Å; L1750-E1758 HydrophobicContact CD1-CB 4.27Å; L1750-E1758 HydrophobicContact CD2-CB 4.45Å; L1750-V1759 HydrophobicContact CB-CG2 3.59Å; L1750-V1759 VanDerWaalsContact CB-CG2 3.47Å; L1750-V1759 HydrophobicContact CD1-CG2 4.38Å; L1750-L1762 HydrophobicContact CD1-CD1 3.39Å; L1750-L1762 VanDerWaalsContact CD1-CD1 3.42Å
1751	H	79.3	Confident	76	Confident	43.8 Å²	43.8	33.4 Å²	33.4	20%	0.203	16%	0.164	C	C	.	.	H	α-helix	trans	-61.1	-49.3	176.3	178.8	-69.2	0	0	0	111.8	I1747 Y1748 H1749 A1753 G1754 L1756 V1759 Y1788 T1791	I1747-H1751 VanDerWaalsContact O-CB 3.29Å; I1747-H1751 WeakPolarHBondContact O-CB 3.39Å; I1747-H1751 PolarHBondContact O-N 3.23Å; Y1748-H1751 PolarHBondContact O-N 3.1Å; H1749-H1751 VanDerWaalsContact C-N 3.33Å; H1749-H1751 PolarHBondContact O-N 3.14Å; H1751-A1753 VanDerWaalsContact C-N 3.26Å; H1751-A1753 PolarHBondContact O-N 3.02Å; H1751-G1754 PolarHBondContact O-N 3.16Å; H1751-G1754 VanDerWaalsContact O-N 3.12Å; H1751-L1756 WeakPolarHBondContact ND1-CD2 3.3Å; H1751-V1759 HydrophobicContact CB-CG2 4.18Å; H1751-Y1788 HydrophobicContact CB-CD1 4.1Å; H1751-Y1788 HydrophobicContact CB-CE1 3.56Å; H1751-Y1788 AromaticContact CD2-CD1 3.28Å; H1751-Y1788 VanDerWaalsContact CD2-CD1 3.42Å; H1751-Y1788 WeakPolarHBondContact CD2-CD1 3.4Å; H1751-Y1788 AromaticContact CD2-CE1 3.41Å; H1751-Y1788 WeakPolarHBondContact CD2-CE1 3.28Å; H1751-Y1788 AromaticContact CG-CD1 3.73Å; H1751-Y1788 AromaticContact CG-CE1 3.31Å; H1751-Y1788 AromaticContact ND1-CE1 3.81Å; H1751-Y1788 AromaticContact NE2-CD1 3.65Å; H1751-Y1788 AromaticContact NE2-CE1 3.84Å; H1751-T1791 PolarHBondContact CE1-OG1 2.95Å; H1751-T1791 VanDerWaalsContact CE1-OG1 3.3Å
1752	H	76.2	Confident	77	Confident	74.8 Å²	74.8	26.3 Å²	26.3	35%	0.346	14%	0.137	S	C	.	.	H	α-helix	trans	-69.7	-19.7	177.7	-81.7	-71.8	0	0	0	113.9	L1729 H1733 Y1748 H1749 L1750 G1754	L1729-H1752 HydrophobicContact CD2-CB 4.45Å; H1733-H1752 HydrophobicContact CB-CB 4.24Å; H1733-H1752 WeakPolarHBondContact CD2-CB 3.22Å; H1733-H1752 AromaticContact CE1-CG 3.93Å; H1733-H1752 WeakPolarHBondContact ND1-CB 3.36Å; Y1748-H1752 AromaticContact CD2-CD2 3.67Å; Y1748-H1752 AromaticContact CD2-NE2 3.87Å; Y1748-H1752 AromaticContact CE1-CD2 3.86Å; Y1748-H1752 AromaticContact CE2-CD2 3.28Å; Y1748-H1752 WeakPolarHBondContact CE2-CD2 3.41Å; Y1748-H1752 AromaticContact CE2-NE2 3.18Å; Y1748-H1752 VanDerWaalsContact CE2-NE2 3.26Å; Y1748-H1752 WeakPolarHBondContact CE2-NE2 3.28Å; Y1748-H1752 AromaticContact CZ-CD2 3.47Å; Y1748-H1752 VanDerWaalsContact CZ-CD2 3.5Å; Y1748-H1752 AromaticContact CZ-NE2 3.6Å; Y1748-H1752 PolarHBondContact O-CD2 2.98Å; Y1748-H1752 VanDerWaalsContact O-CD2 3.29Å; Y1748-H1752 PolarHBondContact O-N 3.24Å; Y1748-H1752 VanDerWaalsContact O-N 3.12Å; H1749-H1752 PolarHBondContact O-N 2.97Å; L1750-H1752 PolarHBondContact O-N 3.44Å; H1752-G1754 VanDerWaalsContact C-N 3.27Å
1753	A	79	Confident	77.8	Confident	7.6 Å²	7.6	24.9 Å²	24.9	6%	0.063	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-8.3	171.3	0	0	0	0	0	113.8	Q1730 H1733 N1734 H1749 L1750 H1751 R1755	Q1730-A1753 HydrophobicContact CG-CB 4.47Å; Q1730-A1753 WeakPolarHBondContact CG-O 3.06Å; Q1730-A1753 PolarHBondContact NE2-O 2.88Å; H1733-A1753 HydrophobicContact CB-CB 3.95Å; N1734-A1753 HydrophobicContact CB-CB 4.3Å; N1734-A1753 VanDerWaalsContact OD1-CB 3.24Å; N1734-A1753 WeakPolarHBondContact OD1-CB 3.39Å; H1749-A1753 VanDerWaalsContact O-CB 3.27Å; H1749-A1753 WeakPolarHBondContact O-CB 3.26Å; H1749-A1753 PolarHBondContact O-N 3.28Å; L1750-A1753 WeakPolarHBondContact O-CB 3.48Å; L1750-A1753 PolarHBondContact O-N 2.96Å; L1750-A1753 VanDerWaalsContact O-N 3.15Å; H1751-A1753 VanDerWaalsContact C-N 3.26Å; H1751-A1753 PolarHBondContact O-N 3.02Å; A1753-R1755 VanDerWaalsContact C-N 3.31Å; A1753-R1755 HydrophobicContact CB-CG 4.44Å; A1753-R1755 PolarHBondContact O-N 3.32Å
1754	G	73.1	Confident	78.5	Confident	49.4 Å²	49.4	24 Å²	24	51%	0.509	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	8.8	-175.5	0	0	0	0	0	114.3	L1750 H1751 H1752 L1756	L1750-G1754 PolarHBondContact O-N 3.18Å; H1751-G1754 PolarHBondContact O-N 3.16Å; H1751-G1754 VanDerWaalsContact O-N 3.12Å; H1752-G1754 VanDerWaalsContact C-N 3.27Å; G1754-L1756 VanDerWaalsContact C-N 3.27Å; G1754-L1756 PolarHBondContact O-N 3.12Å; G1754-L1756 VanDerWaalsContact O-N 3.08Å
1755	R	76.6	Confident	79.3	Confident	35.4 Å²	35.4	21 Å²	21	13%	0.134	11%	0.113	C	C	.	.			trans	-82.1	62.2	178.6	-76.2	-167.2	-172.3	-149.7	9.3	111.3	D1566 N1734 L1750 A1753 N1757 E1758 V1759	D1566-R1755 IonicContact OD2-CZ 3.48Å; D1566-R1755 VanDerWaalsContact OD2-CZ 3.25Å; D1566-R1755 IonicContact OD2-NH1 3.33Å; D1566-R1755 PolarHBondContact OD2-NH1 3.13Å; D1566-R1755 IonicContact OD2-NH2 3.21Å; D1566-R1755 PolarHBondContact OD2-NH2 3.21Å; N1734-R1755 PolarHBondContact ND2-NH2 3.36Å; N1734-R1755 VanDerWaalsContact OD1-CD 3.27Å; N1734-R1755 WeakPolarHBondContact OD1-CD 3.24Å; N1734-R1755 PolarHBondContact OD1-NE 2.96Å; N1734-R1755 PolarHBondContact OD1-NH2 3.33Å; L1750-R1755 HydrophobicContact CB-CB 4.36Å; L1750-R1755 HydrophobicContact CD2-CB 4.07Å; L1750-R1755 HydrophobicContact CD2-CG 4.42Å; L1750-R1755 PolarHBondContact O-N 3.17Å; L1750-R1755 VanDerWaalsContact O-N 3.08Å; A1753-R1755 VanDerWaalsContact C-N 3.31Å; A1753-R1755 HydrophobicContact CB-CG 4.44Å; A1753-R1755 PolarHBondContact O-N 3.32Å; R1755-N1757 VanDerWaalsContact C-N 3.34Å; R1755-N1757 PolarHBondContact O-N 3.34Å; R1755-E1758 VanDerWaalsContact C-OE2 3.26Å; R1755-E1758 VanDerWaalsContact CA-OE2 3.27Å; R1755-E1758 WeakPolarHBondContact CA-OE2 3.2Å; R1755-E1758 HydrophobicContact CB-CB 4.4Å; R1755-E1758 VanDerWaalsContact CB-CD 3.49Å; R1755-E1758 HydrophobicContact CB-CG 4.4Å; R1755-E1758 VanDerWaalsContact CB-OE2 3.27Å; R1755-E1758 WeakPolarHBondContact CB-OE2 3.25Å; R1755-E1758 WeakPolarHBondContact CD-OE1 3.25Å; R1755-E1758 WeakPolarHBondContact CG-OE1 3.41Å; R1755-E1758 IonicContact CZ-OE1 3.99Å; R1755-E1758 IonicContact NE-OE1 3.2Å; R1755-E1758 IonicContact NH1-OE1 3.43Å; R1755-E1758 PolarHBondContact NH1-OE1 3.22Å; R1755-E1758 PolarHBondContact O-N 3.17Å; R1755-E1758 VanDerWaalsContact O-OE2 3.11Å; R1755-V1759 WeakPolarHBondContact O-CG2 3.37Å; R1755-V1759 PolarHBondContact O-N 3.23Å; R1755-V1759 VanDerWaalsContact O-N 3.09Å
1756	L	75.6	Confident	79.8	Confident	33 Å²	33	20.9 Å²	20.9	17%	0.173	11%	0.113	C	C	.	.	H	α-helix	trans	-70.4	-30.8	-172.7	-63.3	-177.4	0	0	0	112.9	H1751 G1754 E1758 V1759 V1760 Y1788 L1807	H1751-L1756 WeakPolarHBondContact ND1-CD2 3.3Å; G1754-L1756 VanDerWaalsContact C-N 3.27Å; G1754-L1756 PolarHBondContact O-N 3.12Å; G1754-L1756 VanDerWaalsContact O-N 3.08Å; L1756-E1758 VanDerWaalsContact C-N 3.31Å; L1756-E1758 PolarHBondContact O-N 3.08Å; L1756-V1759 PolarHBondContact O-N 3.19Å; L1756-V1760 VanDerWaalsContact O-CG2 3.26Å; L1756-V1760 WeakPolarHBondContact O-CG2 3.29Å; L1756-V1760 PolarHBondContact O-N 3.1Å; L1756-V1760 VanDerWaalsContact O-N 3.13Å; L1756-Y1788 HydrophobicContact CB-CE2 4.27Å; L1756-Y1788 HydrophobicContact CD2-CE2 4.19Å; L1756-Y1788 PolarHBondContact O-OH 2.9Å; L1756-L1807 HydrophobicContact CB-CD1 3.99Å; L1756-L1807 HydrophobicContact CD1-CD1 4.47Å; L1756-L1807 HydrophobicContact CD2-CD1 4.32Å; L1756-L1807 HydrophobicContact CG-CD1 4.43Å
1757	N	76.8	Confident	79.8	Confident	71.4 Å²	71.4	21.4 Å²	21.4	38%	0.382	12%	0.118	S	C	.	.	H	α-helix	trans	-63.6	-42.9	177.1	-70.9	-17.4	0	0	0	111	V1573 R1755 V1759 V1760 C1761 S1806	V1573-N1757 HydrophobicContact CG2-CB 4.07Å; R1755-N1757 VanDerWaalsContact C-N 3.34Å; R1755-N1757 PolarHBondContact O-N 3.34Å; N1757-V1759 VanDerWaalsContact C-N 3.34Å; N1757-V1760 WeakPolarHBondContact O-CB 3.44Å; N1757-V1760 PolarHBondContact O-N 3.11Å; N1757-C1761 PolarHBondContact O-N 3.27Å; N1757-C1761 PolarHBondContact O-SG 3.04Å; N1757-S1806 WeakPolarHBondContact OD1-CB 3.35Å; N1757-S1806 PolarHBondContact OD1-OG 3.27Å
1758	E	80	Confident	79.8	Confident	23.2 Å²	23.2	21.1 Å²	21.1	11%	0.108	12%	0.116	C	C	.	.	H	α-helix	trans	-67.8	-40	179.3	-59.6	91.8	144.7	0	0	111	W1568 L1571 L1750 R1755 L1756 V1760 C1761 L1762	W1568-E1758 HydrophobicContact CB-CG 4.31Å; W1568-E1758 HydrophobicContact CE3-CB 4.3Å; W1568-E1758 HydrophobicContact CE3-CG 4.35Å; L1571-E1758 HydrophobicContact CD1-CB 4.45Å; L1571-E1758 HydrophobicContact CD1-CG 4.28Å; L1750-E1758 HydrophobicContact CD1-CB 4.27Å; L1750-E1758 HydrophobicContact CD2-CB 4.45Å; R1755-E1758 VanDerWaalsContact C-OE2 3.26Å; R1755-E1758 VanDerWaalsContact CA-OE2 3.27Å; R1755-E1758 WeakPolarHBondContact CA-OE2 3.2Å; R1755-E1758 HydrophobicContact CB-CB 4.4Å; R1755-E1758 VanDerWaalsContact CB-CD 3.49Å; R1755-E1758 HydrophobicContact CB-CG 4.4Å; R1755-E1758 VanDerWaalsContact CB-OE2 3.27Å; R1755-E1758 WeakPolarHBondContact CB-OE2 3.25Å; R1755-E1758 WeakPolarHBondContact CD-OE1 3.25Å; R1755-E1758 WeakPolarHBondContact CG-OE1 3.41Å; R1755-E1758 IonicContact CZ-OE1 3.99Å; R1755-E1758 IonicContact NE-OE1 3.2Å; R1755-E1758 IonicContact NH1-OE1 3.43Å; R1755-E1758 PolarHBondContact NH1-OE1 3.22Å; R1755-E1758 PolarHBondContact O-N 3.17Å; R1755-E1758 VanDerWaalsContact O-OE2 3.11Å; L1756-E1758 VanDerWaalsContact C-N 3.31Å; L1756-E1758 PolarHBondContact O-N 3.08Å; E1758-V1760 VanDerWaalsContact C-N 3.33Å; E1758-V1760 PolarHBondContact O-N 3.05Å; E1758-C1761 PolarHBondContact O-N 3.03Å; E1758-L1762 WeakPolarHBondContact O-CB 3.32Å; E1758-L1762 WeakPolarHBondContact O-CG 3.37Å; E1758-L1762 PolarHBondContact O-N 3.06Å
1759	V	79.8	Confident	80	Confident	0.6 Å²	0.6	17.9 Å²	17.9	0%	0.004	10%	0.104	C	C	.	.	H	α-helix	trans	-58.9	-44.6	172.1	171	0	0	0	0	111.1	I1747 L1750 H1751 R1755 L1756 N1757 L1762 L1763 Y1788	I1747-V1759 HydrophobicContact CG2-CG1 3.9Å; I1747-V1759 HydrophobicContact CG2-CG2 4.32Å; L1750-V1759 HydrophobicContact CB-CG2 3.59Å; L1750-V1759 VanDerWaalsContact CB-CG2 3.47Å; L1750-V1759 HydrophobicContact CD1-CG2 4.38Å; H1751-V1759 HydrophobicContact CB-CG2 4.18Å; R1755-V1759 WeakPolarHBondContact O-CG2 3.37Å; R1755-V1759 PolarHBondContact O-N 3.23Å; R1755-V1759 VanDerWaalsContact O-N 3.09Å; L1756-V1759 PolarHBondContact O-N 3.19Å; N1757-V1759 VanDerWaalsContact C-N 3.34Å; V1759-L1762 PolarHBondContact O-N 3.09Å; V1759-L1763 HydrophobicContact CG1-CD1 3.75Å; V1759-L1763 HydrophobicContact CG1-CG 4.26Å; V1759-L1763 VanDerWaalsContact O-CB 3.31Å; V1759-L1763 WeakPolarHBondContact O-CB 3.27Å; V1759-L1763 VanDerWaalsContact O-CG 3.29Å; V1759-L1763 WeakPolarHBondContact O-CG 3.33Å; V1759-L1763 PolarHBondContact O-N 3.16Å; V1759-Y1788 HydrophobicContact CB-CD2 4.28Å; V1759-Y1788 HydrophobicContact CB-CE2 4.16Å; V1759-Y1788 HydrophobicContact CG1-CD2 3.67Å; V1759-Y1788 HydrophobicContact CG1-CE2 4.18Å; V1759-Y1788 HydrophobicContact CG1-CG 4.38Å
1760	V	79.6	Confident	79.9	Confident	0.6 Å²	0.6	19 Å²	19	0%	0.004	11%	0.11	C	C	.	.	H	α-helix	trans	-60.6	-50.6	176	175.2	0	0	0	0	110.5	L1575 L1756 N1757 E1758 L1762 L1763 T1764 Y1788 L1807 M1810 I1814	L1575-V1760 HydrophobicContact CD1-CG1 4.36Å; L1756-V1760 VanDerWaalsContact O-CG2 3.26Å; L1756-V1760 WeakPolarHBondContact O-CG2 3.29Å; L1756-V1760 PolarHBondContact O-N 3.1Å; L1756-V1760 VanDerWaalsContact O-N 3.13Å; N1757-V1760 WeakPolarHBondContact O-CB 3.44Å; N1757-V1760 PolarHBondContact O-N 3.11Å; E1758-V1760 VanDerWaalsContact C-N 3.33Å; E1758-V1760 PolarHBondContact O-N 3.05Å; V1760-L1762 VanDerWaalsContact C-N 3.31Å; V1760-L1762 PolarHBondContact O-N 3.07Å; V1760-L1763 PolarHBondContact O-N 3.16Å; V1760-L1763 VanDerWaalsContact O-N 3.1Å; V1760-T1764 HydrophobicContact CG1-CG2 4.28Å; V1760-T1764 WeakPolarHBondContact O-CB 3.33Å; V1760-T1764 WeakPolarHBondContact O-CG2 3.37Å; V1760-T1764 PolarHBondContact O-N 3.12Å; V1760-T1764 VanDerWaalsContact O-N 3.09Å; V1760-T1764 PolarHBondContact O-OG1 3.11Å; V1760-Y1788 HydrophobicContact CG2-CE1 3.91Å; V1760-Y1788 HydrophobicContact CG2-CE2 3.86Å; V1760-Y1788 VanDerWaalsContact CG2-CZ 3.43Å; V1760-Y1788 WeakPolarHBondContact CG2-OH 3.42Å; V1760-L1807 HydrophobicContact CG2-CB 4.45Å; V1760-L1807 HydrophobicContact CG2-CD1 3.45Å; V1760-L1807 VanDerWaalsContact CG2-CD1 3.45Å; V1760-L1807 HydrophobicContact CG2-CD2 4.32Å; V1760-L1807 HydrophobicContact CG2-CG 4.06Å; V1760-M1810 HydrophobicContact CB-CE 4.23Å; V1760-M1810 HydrophobicContact CB-SD 3.86Å; V1760-M1810 HydrophobicContact CG1-CB 3.79Å; V1760-M1810 HydrophobicContact CG1-CE 3.75Å; V1760-M1810 VanDerWaalsContact CG1-CE 3.41Å; V1760-M1810 HydrophobicContact CG1-CG 3.89Å; V1760-M1810 HydrophobicContact CG1-SD 4Å; V1760-M1810 VanDerWaalsContact CG1-SD 3.52Å; V1760-M1810 HydrophobicContact CG2-CB 4.28Å; V1760-M1810 HydrophobicContact CG2-CE 3.78Å; V1760-M1810 HydrophobicContact CG2-SD 4Å; V1760-I1814 HydrophobicContact CG1-CD1 4.23Å; V1760-I1814 HydrophobicContact CG1-CG1 4.29Å; V1760-I1814 HydrophobicContact CG2-CD1 4.18Å
1761	C	82.1	Confident	79.7	Confident	2 Å²	2	20.9 Å²	20.9	1%	0.014	12%	0.119	C	C	.	.	H	α-helix	trans	-57.2	-43.5	-179	-69.1	0	0	0	0	111.7	L1571 I1588 N1757 E1758 T1764 S1765	L1571-C1761 HydrophobicContact CB-CB 4.05Å; L1571-C1761 HydrophobicContact CD1-CB 4.04Å; I1588-C1761 HydrophobicContact CD1-CB 4.46Å; N1757-C1761 PolarHBondContact O-N 3.27Å; N1757-C1761 PolarHBondContact O-SG 3.04Å; E1758-C1761 PolarHBondContact O-N 3.03Å; C1761-T1764 WeakPolarHBondContact CA-OG1 3.49Å; C1761-T1764 PolarHBondContact O-N 3.13Å; C1761-T1764 PolarHBondContact O-OG1 3.29Å; C1761-S1765 VanDerWaalsContact O-CB 3.28Å; C1761-S1765 WeakPolarHBondContact O-CB 3.32Å; C1761-S1765 PolarHBondContact O-N 2.92Å; C1761-S1765 VanDerWaalsContact O-N 3.1Å; C1761-S1765 PolarHBondContact O-OG 3.26Å
1762	L	82.5	Confident	79.6	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65.8	-47	176.8	-72.7	174.5	0	0	0	113	W1568 I1588 L1746 L1750 E1758 V1759 V1760 T1764 S1765 F1768	W1568-L1762 HydrophobicContact CE3-CD2 4.42Å; W1568-L1762 HydrophobicContact CH2-CD1 4.01Å; W1568-L1762 HydrophobicContact CH2-CD2 4.04Å; W1568-L1762 HydrophobicContact CH2-CG 4.42Å; W1568-L1762 HydrophobicContact CZ3-CD1 4.01Å; W1568-L1762 HydrophobicContact CZ3-CD2 3.8Å; W1568-L1762 HydrophobicContact CZ3-CG 4.09Å; I1588-L1762 HydrophobicContact CD1-CD2 4.22Å; I1588-L1762 HydrophobicContact CG1-CD2 4.32Å; I1588-L1762 HydrophobicContact CG2-CD2 4.18Å; L1746-L1762 HydrophobicContact CD2-CD1 3.92Å; L1746-L1762 HydrophobicContact CG-CD1 4.19Å; L1750-L1762 HydrophobicContact CD1-CD1 3.39Å; L1750-L1762 VanDerWaalsContact CD1-CD1 3.42Å; E1758-L1762 WeakPolarHBondContact O-CB 3.32Å; E1758-L1762 WeakPolarHBondContact O-CG 3.37Å; E1758-L1762 PolarHBondContact O-N 3.06Å; V1759-L1762 PolarHBondContact O-N 3.09Å; V1760-L1762 VanDerWaalsContact C-N 3.31Å; V1760-L1762 PolarHBondContact O-N 3.07Å; L1762-T1764 PolarHBondContact O-N 3.16Å; L1762-T1764 VanDerWaalsContact O-N 3.15Å; L1762-S1765 WeakPolarHBondContact CA-OG 3.36Å; L1762-S1765 PolarHBondContact O-N 3.26Å; L1762-S1765 VanDerWaalsContact O-N 3.14Å; L1762-S1765 PolarHBondContact O-OG 3.28Å; L1762-F1768 HydrophobicContact CB-CD1 4.2Å; L1762-F1768 HydrophobicContact CB-CD2 4.48Å; L1762-F1768 HydrophobicContact CB-CE1 4.35Å; L1762-F1768 HydrophobicContact CB-CG 4.31Å; L1762-F1768 HydrophobicContact CB-CZ 4.46Å; L1762-F1768 HydrophobicContact CD1-CE2 4.44Å; L1762-F1768 HydrophobicContact CD2-CB 4.26Å; L1762-F1768 HydrophobicContact CD2-CD2 3.72Å; L1762-F1768 HydrophobicContact CD2-CE2 4.2Å; L1762-F1768 HydrophobicContact CD2-CG 3.97Å; L1762-F1768 VanDerWaalsContact O-CD1 3.31Å; L1762-F1768 WeakPolarHBondContact O-CD1 3.27Å
1763	L	82.8	Confident	79.7	Confident	0.2 Å²	0.2	16.2 Å²	16.2	0%	0.001	10%	0.097	C	C	.	.	H	α-helix	trans	-65.4	-22.3	178.9	-71.6	178.3	0	0	0	112.8	I1747 V1759 V1760 L1781 M1785 Y1788 I1814	I1747-L1763 HydrophobicContact CD1-CD2 3.73Å; I1747-L1763 HydrophobicContact CD1-CG 4.46Å; I1747-L1763 HydrophobicContact CG1-CD2 4.45Å; I1747-L1763 HydrophobicContact CG2-CD2 4.42Å; I1747-L1763 HydrophobicContact CG2-CG 4.46Å; V1759-L1763 HydrophobicContact CG1-CD1 3.75Å; V1759-L1763 HydrophobicContact CG1-CG 4.26Å; V1759-L1763 VanDerWaalsContact O-CB 3.31Å; V1759-L1763 WeakPolarHBondContact O-CB 3.27Å; V1759-L1763 VanDerWaalsContact O-CG 3.29Å; V1759-L1763 WeakPolarHBondContact O-CG 3.33Å; V1759-L1763 PolarHBondContact O-N 3.16Å; V1760-L1763 PolarHBondContact O-N 3.16Å; V1760-L1763 VanDerWaalsContact O-N 3.1Å; L1763-L1781 HydrophobicContact CD2-CD1 4.03Å; L1763-L1781 HydrophobicContact CD2-CG 4.47Å; L1763-M1785 HydrophobicContact CB-CE 3.96Å; L1763-M1785 HydrophobicContact CB-CG 4.46Å; L1763-M1785 HydrophobicContact CB-SD 3.89Å; L1763-M1785 HydrophobicContact CD1-CG 4.33Å; L1763-M1785 HydrophobicContact CD1-SD 4.04Å; L1763-M1785 HydrophobicContact CD2-CE 3.98Å; L1763-M1785 HydrophobicContact CD2-CG 3.9Å; L1763-M1785 HydrophobicContact CD2-SD 3.9Å; L1763-M1785 HydrophobicContact CG-CE 4.27Å; L1763-M1785 HydrophobicContact CG-CG 4.35Å; L1763-M1785 HydrophobicContact CG-SD 4.15Å; L1763-M1785 WeakPolarHBondContact O-CE 3.33Å; L1763-Y1788 HydrophobicContact CD1-CD2 4.04Å; L1763-Y1788 HydrophobicContact CD1-CE2 4.5Å; L1763-Y1788 HydrophobicContact CD1-CG 4.29Å; L1763-I1814 HydrophobicContact CD1-CD1 4.43Å; L1763-I1814 HydrophobicContact CD1-CG2 4.43Å
1764	T	81.8	Confident	79.5	Confident	7.6 Å²	7.6	20.2 Å²	20.2	5%	0.047	11%	0.114	C	C	.	.	H	α-helix	trans	-97.3	-4.9	176.8	58.1	0	0	0	0	114.1	P1574 L1575 V1760 C1761 L1762 P1766 M1810 I1814 M1817 W1847	P1574-T1764 WeakPolarHBondContact CG-OG1 3.43Å; L1575-T1764 HydrophobicContact CD1-CG2 4.35Å; L1575-T1764 WeakPolarHBondContact CD1-OG1 3.35Å; V1760-T1764 HydrophobicContact CG1-CG2 4.28Å; V1760-T1764 WeakPolarHBondContact O-CB 3.33Å; V1760-T1764 WeakPolarHBondContact O-CG2 3.37Å; V1760-T1764 PolarHBondContact O-N 3.12Å; V1760-T1764 VanDerWaalsContact O-N 3.09Å; V1760-T1764 PolarHBondContact O-OG1 3.11Å; C1761-T1764 WeakPolarHBondContact CA-OG1 3.49Å; C1761-T1764 PolarHBondContact O-N 3.13Å; C1761-T1764 PolarHBondContact O-OG1 3.29Å; L1762-T1764 PolarHBondContact O-N 3.16Å; L1762-T1764 VanDerWaalsContact O-N 3.15Å; T1764-P1766 VanDerWaalsContact O-CD 3.29Å; T1764-P1766 WeakPolarHBondContact O-CD 3.3Å; T1764-M1810 HydrophobicContact CG2-CE 3.99Å; T1764-I1814 HydrophobicContact CG2-CG1 4.26Å; T1764-M1817 WeakPolarHBondContact O-CE 3.4Å; T1764-W1847 HydrophobicContact CG2-CH2 3.66Å; T1764-W1847 HydrophobicContact CG2-CZ2 4.09Å
1765	S	83.3	Confident	79.2	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.007	11%	0.107	C	C	.	.			trans	-89.8	115.7	-174.2	131.4	0	0	0	0	112.7	E1585 I1588 C1761 L1762 A1767 F1768 L1769	E1585-S1765 VanDerWaalsContact OE1-CA 3.26Å; E1585-S1765 WeakPolarHBondContact OE1-CA 3.37Å; E1585-S1765 WeakPolarHBondContact OE1-CB 3.3Å; E1585-S1765 PolarHBondContact OE1-OG 3.2Å; E1585-S1765 PolarHBondContact OE2-OG 3.15Å; I1588-S1765 VanDerWaalsContact CD1-CB 3.49Å; I1588-S1765 VanDerWaalsContact CD1-OG 3.29Å; I1588-S1765 WeakPolarHBondContact CD1-OG 3.16Å; C1761-S1765 VanDerWaalsContact O-CB 3.28Å; C1761-S1765 WeakPolarHBondContact O-CB 3.32Å; C1761-S1765 PolarHBondContact O-N 2.92Å; C1761-S1765 VanDerWaalsContact O-N 3.1Å; C1761-S1765 PolarHBondContact O-OG 3.26Å; L1762-S1765 WeakPolarHBondContact CA-OG 3.36Å; L1762-S1765 PolarHBondContact O-N 3.26Å; L1762-S1765 VanDerWaalsContact O-N 3.14Å; L1762-S1765 PolarHBondContact O-OG 3.28Å; S1765-A1767 VanDerWaalsContact C-N 3.3Å; S1765-A1767 PolarHBondContact O-N 3.18Å; S1765-F1768 PolarHBondContact O-N 3.24Å; S1765-F1768 WeakPolarHBondContact OG-CB 3.37Å; S1765-F1768 PolarHBondContact OG-N 3.27Å; S1765-L1769 WeakPolarHBondContact O-CB 3.43Å; S1765-L1769 VanDerWaalsContact O-CG 3.28Å; S1765-L1769 WeakPolarHBondContact O-CG 3.37Å; S1765-L1769 PolarHBondContact O-N 3.03Å; S1765-L1769 VanDerWaalsContact O-N 3.11Å
1766	P	82.7	Confident	78.8	Confident	2.4 Å²	2.4	21.1 Å²	21.1	2%	0.016	13%	0.127	C	C	.	.	H	α-helix	trans	-55.3	-40.4	175.5	-31.4	40.3	0	0	0	113.9	E1585 T1764 F1768 L1769 I1770 F1835 I1851 C1855	E1585-P1766 WeakPolarHBondContact OE1-CD 3.3Å; E1585-P1766 WeakPolarHBondContact OE2-CD 3.36Å; T1764-P1766 VanDerWaalsContact O-CD 3.29Å; T1764-P1766 WeakPolarHBondContact O-CD 3.3Å; P1766-F1768 VanDerWaalsContact C-N 3.32Å; P1766-F1768 PolarHBondContact O-N 3.3Å; P1766-L1769 PolarHBondContact O-N 3.12Å; P1766-I1770 HydrophobicContact CB-CD1 4.48Å; P1766-I1770 WeakPolarHBondContact O-CB 3.41Å; P1766-I1770 WeakPolarHBondContact O-CD1 3.35Å; P1766-I1770 VanDerWaalsContact O-CG1 3.25Å; P1766-I1770 WeakPolarHBondContact O-CG1 3.28Å; P1766-I1770 PolarHBondContact O-N 3.06Å; P1766-F1835 HydrophobicContact CB-CD1 3.83Å; P1766-F1835 HydrophobicContact CB-CE1 3.63Å; P1766-F1835 HydrophobicContact CB-CE2 4.42Å; P1766-F1835 HydrophobicContact CB-CG 4.35Å; P1766-F1835 HydrophobicContact CB-CZ 4.06Å; P1766-F1835 HydrophobicContact CG-CD1 4.15Å; P1766-F1835 HydrophobicContact CG-CE1 3.48Å; P1766-F1835 VanDerWaalsContact CG-CE1 3.42Å; P1766-F1835 HydrophobicContact CG-CZ 3.91Å; P1766-I1851 HydrophobicContact CG-CG2 3.31Å; P1766-I1851 VanDerWaalsContact CG-CG2 3.43Å; P1766-C1855 VanDerWaalsContact CB-SG 3.56Å; P1766-C1855 VanDerWaalsContact CG-SG 3.52Å
1767	A	79.5	Confident	78.4	Confident	18.8 Å²	18.8	22.9 Å²	22.9	16%	0.155	13%	0.132	C	C	.	.	H	α-helix	trans	-59.5	-41.7	178.6	0	0	0	0	0	112.5	E1585 I1588 Y1589 S1765 H1771	E1585-A1767 VanDerWaalsContact OE2-CB 3.3Å; E1585-A1767 WeakPolarHBondContact OE2-CB 3.42Å; E1585-A1767 PolarHBondContact OE2-N 3.08Å; I1588-A1767 HydrophobicContact CG2-CB 4.47Å; Y1589-A1767 HydrophobicContact CD2-CB 4.37Å; S1765-A1767 VanDerWaalsContact C-N 3.3Å; S1765-A1767 PolarHBondContact O-N 3.18Å; A1767-H1771 WeakPolarHBondContact O-CB 3.41Å; A1767-H1771 PolarHBondContact O-N 3.01Å; A1767-H1771 VanDerWaalsContact O-N 3.13Å
1768	F	82.3	Confident	77.8	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-69.8	-44.6	175.9	178.1	-97.9	0	0	0	112	I1588 M1743 L1746 I1747 L1762 S1765 P1766 I1770 H1771 Q1772 L1781	I1588-F1768 HydrophobicContact CG2-CB 4.26Å; M1743-F1768 HydrophobicContact CE-CD2 3.58Å; M1743-F1768 VanDerWaalsContact CE-CD2 3.43Å; M1743-F1768 HydrophobicContact CE-CE2 3.55Å; M1743-F1768 VanDerWaalsContact CE-CE2 3.45Å; M1743-F1768 HydrophobicContact SD-CE2 4.49Å; L1746-F1768 HydrophobicContact CD2-CE2 4.18Å; I1747-F1768 HydrophobicContact CD1-CE1 3.67Å; I1747-F1768 VanDerWaalsContact CD1-CE1 3.45Å; I1747-F1768 HydrophobicContact CD1-CZ 3.7Å; I1747-F1768 VanDerWaalsContact CD1-CZ 3.49Å; I1747-F1768 HydrophobicContact CG1-CE1 4.15Å; I1747-F1768 HydrophobicContact CG1-CZ 3.78Å; L1762-F1768 HydrophobicContact CB-CD1 4.2Å; L1762-F1768 HydrophobicContact CB-CD2 4.48Å; L1762-F1768 HydrophobicContact CB-CE1 4.35Å; L1762-F1768 HydrophobicContact CB-CG 4.31Å; L1762-F1768 HydrophobicContact CB-CZ 4.46Å; L1762-F1768 HydrophobicContact CD1-CE2 4.44Å; L1762-F1768 HydrophobicContact CD2-CB 4.26Å; L1762-F1768 HydrophobicContact CD2-CD2 3.72Å; L1762-F1768 HydrophobicContact CD2-CE2 4.2Å; L1762-F1768 HydrophobicContact CD2-CG 3.97Å; L1762-F1768 VanDerWaalsContact O-CD1 3.31Å; L1762-F1768 WeakPolarHBondContact O-CD1 3.27Å; S1765-F1768 PolarHBondContact O-N 3.24Å; S1765-F1768 WeakPolarHBondContact OG-CB 3.37Å; S1765-F1768 PolarHBondContact OG-N 3.27Å; P1766-F1768 VanDerWaalsContact C-N 3.32Å; P1766-F1768 PolarHBondContact O-N 3.3Å; F1768-I1770 VanDerWaalsContact C-N 3.34Å; F1768-I1770 PolarHBondContact O-N 3.1Å; F1768-H1771 PolarHBondContact O-N 3.11Å; F1768-Q1772 HydrophobicContact CD1-CG 4.12Å; F1768-Q1772 HydrophobicContact CD2-CG 4.43Å; F1768-Q1772 HydrophobicContact CE1-CG 3.69Å; F1768-Q1772 HydrophobicContact CE2-CG 4.17Å; F1768-Q1772 VanDerWaalsContact CE2-NE2 3.32Å; F1768-Q1772 HydrophobicContact CG-CG 4.46Å; F1768-Q1772 HydrophobicContact CZ-CG 3.74Å; F1768-Q1772 WeakPolarHBondContact O-CG 3.37Å; F1768-Q1772 PolarHBondContact O-N 3.15Å; F1768-L1781 HydrophobicContact CD1-CD1 4.4Å; F1768-L1781 HydrophobicContact CE1-CD1 4.1Å
1769	L	83.4	Confident	77	Confident	0.4 Å²	0.4	23.9 Å²	23.9	0%	0.002	14%	0.138	C	C	.	.	H	α-helix	trans	-60.7	-45.4	-179.7	-65.3	174.3	0	0	0	111.8	S1765 P1766 H1771 Q1772 I1773 L1781 M1785 M1817 L1821 F1835	S1765-L1769 WeakPolarHBondContact O-CB 3.43Å; S1765-L1769 VanDerWaalsContact O-CG 3.28Å; S1765-L1769 WeakPolarHBondContact O-CG 3.37Å; S1765-L1769 PolarHBondContact O-N 3.03Å; S1765-L1769 VanDerWaalsContact O-N 3.11Å; P1766-L1769 PolarHBondContact O-N 3.12Å; L1769-H1771 VanDerWaalsContact C-N 3.34Å; L1769-H1771 PolarHBondContact O-N 3.31Å; L1769-Q1772 PolarHBondContact O-N 3.2Å; L1769-I1773 WeakPolarHBondContact O-CD1 3.05Å; L1769-I1773 VanDerWaalsContact O-CG1 3.28Å; L1769-I1773 WeakPolarHBondContact O-CG1 3.19Å; L1769-I1773 PolarHBondContact O-N 3.24Å; L1769-L1781 HydrophobicContact CD2-CD1 3.85Å; L1769-L1781 VanDerWaalsContact CD2-CD1 3.42Å; L1769-L1781 HydrophobicContact CD2-CD2 3.42Å; L1769-L1781 VanDerWaalsContact CD2-CD2 3.44Å; L1769-L1781 HydrophobicContact CD2-CG 4.12Å; L1769-M1785 HydrophobicContact CD2-CE 4Å; L1769-M1817 HydrophobicContact CD1-CE 4.09Å; L1769-M1817 HydrophobicContact CD1-CG 3.85Å; L1769-M1817 HydrophobicContact CD1-SD 3.6Å; L1769-M1817 VanDerWaalsContact CD1-SD 3.54Å; L1769-L1821 HydrophobicContact CD1-CD1 4.08Å; L1769-L1821 HydrophobicContact CD1-CD2 4.42Å; L1769-L1821 HydrophobicContact CD1-CG 4.45Å; L1769-L1821 HydrophobicContact CD2-CD1 3.91Å; L1769-L1821 HydrophobicContact CG-CD1 4.47Å; L1769-F1835 HydrophobicContact CB-CE2 4.26Å; L1769-F1835 HydrophobicContact CD1-CE2 4.16Å; L1769-F1835 HydrophobicContact CD1-CZ 4.27Å
1770	I	81.3	Confident	76.4	Confident	25.2 Å²	25.2	26.7 Å²	26.7	13%	0.129	16%	0.155	C	C	.	.	H	α-helix	trans	-59	-47.5	176.6	-71.7	167.3	0	0	0	110.3	P1766 F1768 Q1772 I1773 E1774 P1832 Y1833 F1835	P1766-I1770 HydrophobicContact CB-CD1 4.48Å; P1766-I1770 WeakPolarHBondContact O-CB 3.41Å; P1766-I1770 WeakPolarHBondContact O-CD1 3.35Å; P1766-I1770 VanDerWaalsContact O-CG1 3.25Å; P1766-I1770 WeakPolarHBondContact O-CG1 3.28Å; P1766-I1770 PolarHBondContact O-N 3.06Å; F1768-I1770 VanDerWaalsContact C-N 3.34Å; F1768-I1770 PolarHBondContact O-N 3.1Å; I1770-Q1772 VanDerWaalsContact C-N 3.33Å; I1770-Q1772 PolarHBondContact O-N 3.02Å; I1770-I1773 WeakPolarHBondContact O-CB 3.36Å; I1770-I1773 PolarHBondContact O-N 3.08Å; I1770-I1773 VanDerWaalsContact O-N 3.13Å; I1770-E1774 HydrophobicContact CG2-CG 4.42Å; I1770-E1774 WeakPolarHBondContact O-CG 3.47Å; I1770-E1774 PolarHBondContact O-N 3.4Å; I1770-P1832 HydrophobicContact CG2-CB 3.97Å; I1770-Y1833 HydrophobicContact CG2-CE1 4.46Å; I1770-F1835 HydrophobicContact CD1-CB 3.93Å; I1770-F1835 HydrophobicContact CD1-CG 4.22Å; I1770-F1835 HydrophobicContact CG1-CB 4.21Å; I1770-F1835 HydrophobicContact CG1-CD2 4.14Å; I1770-F1835 HydrophobicContact CG1-CG 4.26Å
1771	H	76.3	Confident	76.2	Confident	42.4 Å²	42.4	26.9 Å²	26.9	20%	0.196	16%	0.156	C	C	.	.	H	α-helix	trans	-64.3	-36.6	-179.5	-168.1	61.9	0	0	0	112.8	A1767 F1768 L1769 I1773 E1774 S1775	A1767-H1771 WeakPolarHBondContact O-CB 3.41Å; A1767-H1771 PolarHBondContact O-N 3.01Å; A1767-H1771 VanDerWaalsContact O-N 3.13Å; F1768-H1771 PolarHBondContact O-N 3.11Å; L1769-H1771 VanDerWaalsContact C-N 3.34Å; L1769-H1771 PolarHBondContact O-N 3.31Å; H1771-I1773 VanDerWaalsContact C-N 3.34Å; H1771-E1774 IonicContact ND1-OE2 3.22Å; H1771-E1774 PolarHBondContact ND1-OE2 3.28Å; H1771-S1775 VanDerWaalsContact O-CB 3.3Å; H1771-S1775 WeakPolarHBondContact O-CB 3.28Å; H1771-S1775 PolarHBondContact O-N 3.34Å; H1771-S1775 PolarHBondContact O-OG 3.31Å
1772	Q	77.7	Confident	75.7	Confident	6.6 Å²	6.6	28 Å²	28	3%	0.031	16%	0.162	C	C	.	.	H	α-helix	trans	-67.1	-35.4	173.5	-69.8	-70.9	-9.7	0	0	112.4	M1743 F1768 L1769 I1770 S1775 G1776 Y1777 G1778 L1781	M1743-Q1772 PolarHBondContact O-NE2 3.09Å; F1768-Q1772 HydrophobicContact CD1-CG 4.12Å; F1768-Q1772 HydrophobicContact CD2-CG 4.43Å; F1768-Q1772 HydrophobicContact CE1-CG 3.69Å; F1768-Q1772 HydrophobicContact CE2-CG 4.17Å; F1768-Q1772 VanDerWaalsContact CE2-NE2 3.32Å; F1768-Q1772 HydrophobicContact CG-CG 4.46Å; F1768-Q1772 HydrophobicContact CZ-CG 3.74Å; F1768-Q1772 WeakPolarHBondContact O-CG 3.37Å; F1768-Q1772 PolarHBondContact O-N 3.15Å; L1769-Q1772 PolarHBondContact O-N 3.2Å; I1770-Q1772 VanDerWaalsContact C-N 3.33Å; I1770-Q1772 PolarHBondContact O-N 3.02Å; Q1772-S1775 WeakPolarHBondContact CA-OG 3.14Å; Q1772-S1775 PolarHBondContact O-N 3.39Å; Q1772-S1775 PolarHBondContact O-OG 3.13Å; Q1772-S1775 VanDerWaalsContact O-OG 3.11Å; Q1772-G1776 PolarHBondContact O-N 3.19Å; Q1772-Y1777 CarbonylContact O-C 3.54Å; Q1772-Y1777 WeakPolarHBondContact O-CA 3.21Å; Q1772-Y1777 PolarHBondContact O-N 3.08Å; Q1772-G1778 PolarHBondContact O-N 3.23Å; Q1772-L1781 HydrophobicContact CB-CD1 3.83Å; Q1772-L1781 HydrophobicContact CB-CD2 4.04Å; Q1772-L1781 HydrophobicContact CG-CD1 4.05Å; Q1772-L1781 HydrophobicContact CG-CD2 4.43Å
1773	I	77.1	Confident	74.9	Confident	13.2 Å²	13.2	30.5 Å²	30.5	7%	0.068	18%	0.175	C	C	.	.	H	α-helix	trans	-70	-46.2	176.1	-67.7	166.4	0	0	0	110.5	L1769 I1770 H1771 S1775 G1776 L1821 Y1825 L1828 I1829 P1832	L1769-I1773 WeakPolarHBondContact O-CD1 3.05Å; L1769-I1773 VanDerWaalsContact O-CG1 3.28Å; L1769-I1773 WeakPolarHBondContact O-CG1 3.19Å; L1769-I1773 PolarHBondContact O-N 3.24Å; I1770-I1773 WeakPolarHBondContact O-CB 3.36Å; I1770-I1773 PolarHBondContact O-N 3.08Å; I1770-I1773 VanDerWaalsContact O-N 3.13Å; H1771-I1773 VanDerWaalsContact C-N 3.34Å; I1773-S1775 VanDerWaalsContact C-N 3.29Å; I1773-S1775 PolarHBondContact O-N 3.07Å; I1773-G1776 PolarHBondContact O-N 3.19Å; I1773-L1821 HydrophobicContact CD1-CD2 4.25Å; I1773-Y1825 HydrophobicContact CG1-CE2 4.45Å; I1773-L1828 HydrophobicContact CD1-CB 4.13Å; I1773-L1828 HydrophobicContact CD1-CD1 4.35Å; I1773-L1828 WeakPolarHBondContact CG2-O 3.46Å; I1773-I1829 HydrophobicContact CG2-CB 4.49Å; I1773-I1829 HydrophobicContact CG2-CG1 4.25Å; I1773-P1832 HydrophobicContact CG2-CB 4.46Å
1774	E	74.4	Confident	74.3	Confident	91 Å²	91	31.5 Å²	31.5	43%	0.425	18%	0.18	S	C	.	.	H	α-helix	trans	-59.5	-37.4	175.9	-74	-174	144.4	0	0	112.7	I1770 H1771 G1776 P1832 Y1833	I1770-E1774 HydrophobicContact CG2-CG 4.42Å; I1770-E1774 WeakPolarHBondContact O-CG 3.47Å; I1770-E1774 PolarHBondContact O-N 3.4Å; H1771-E1774 IonicContact ND1-OE2 3.22Å; H1771-E1774 PolarHBondContact ND1-OE2 3.28Å; E1774-G1776 PolarHBondContact O-N 3.14Å; E1774-P1832 HydrophobicContact CG-CB 4.14Å; E1774-P1832 HydrophobicContact CG-CG 3.88Å; E1774-Y1833 VanDerWaalsContact OE1-CE2 3.24Å; E1774-Y1833 WeakPolarHBondContact OE1-CE2 3.3Å; E1774-Y1833 VanDerWaalsContact OE1-CZ 3.23Å; E1774-Y1833 PolarHBondContact OE1-OH 3.15Å
1775	S	68.4	Low	74	Confident	50 Å²	50	31.2 Å²	31.2	35%	0.35	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-0.6	177.3	14.2	0	0	0	0	114	H1771 Q1772 I1773 Y1777	H1771-S1775 VanDerWaalsContact O-CB 3.3Å; H1771-S1775 WeakPolarHBondContact O-CB 3.28Å; H1771-S1775 PolarHBondContact O-N 3.34Å; H1771-S1775 PolarHBondContact O-OG 3.31Å; Q1772-S1775 WeakPolarHBondContact CA-OG 3.14Å; Q1772-S1775 PolarHBondContact O-N 3.39Å; Q1772-S1775 PolarHBondContact O-OG 3.13Å; Q1772-S1775 VanDerWaalsContact O-OG 3.11Å; I1773-S1775 VanDerWaalsContact C-N 3.29Å; I1773-S1775 PolarHBondContact O-N 3.07Å; S1775-Y1777 VanDerWaalsContact OG-CD2 3.27Å; S1775-Y1777 WeakPolarHBondContact OG-CD2 3.21Å
1776	G	67.4	Low	73.4	Confident	53.4 Å²	53.4	33.1 Å²	33.1	55%	0.551	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.4	12.8	178	0	0	0	0	0	115	Q1772 I1773 E1774	Q1772-G1776 PolarHBondContact O-N 3.19Å; I1773-G1776 PolarHBondContact O-N 3.19Å; E1774-G1776 PolarHBondContact O-N 3.14Å
1777	Y	66.5	Low	72.7	Confident	71.8 Å²	71.8	38.6 Å²	38.6	28%	0.282	21%	0.209	S	C	.	.			trans	-101	10.2	-177.8	-60.4	-55.5	0	0	0	114.1	K1744 Q1772 S1775 L1779 T1780 L1781	K1744-Y1777 HydrophobicContact CB-CD1 4.5Å; K1744-Y1777 HydrophobicContact CB-CD2 4.23Å; K1744-Y1777 HydrophobicContact CB-CE1 4.38Å; K1744-Y1777 HydrophobicContact CB-CE2 4.08Å; K1744-Y1777 HydrophobicContact CB-CG 4.41Å; K1744-Y1777 HydrophobicContact CD-CD1 4.17Å; K1744-Y1777 HydrophobicContact CD-CE1 3.61Å; K1744-Y1777 HydrophobicContact CD-CE2 4.29Å; K1744-Y1777 HydrophobicContact CG-CD1 3.99Å; K1744-Y1777 HydrophobicContact CG-CD2 4.15Å; K1744-Y1777 HydrophobicContact CG-CE1 3.88Å; K1744-Y1777 HydrophobicContact CG-CE2 4.22Å; K1744-Y1777 HydrophobicContact CG-CG 4.2Å; Q1772-Y1777 CarbonylContact O-C 3.54Å; Q1772-Y1777 WeakPolarHBondContact O-CA 3.21Å; Q1772-Y1777 PolarHBondContact O-N 3.08Å; S1775-Y1777 VanDerWaalsContact OG-CD2 3.27Å; S1775-Y1777 WeakPolarHBondContact OG-CD2 3.21Å; Y1777-L1779 VanDerWaalsContact C-N 3.31Å; Y1777-L1779 PolarHBondContact O-N 3.28Å; Y1777-L1779 VanDerWaalsContact O-N 3.08Å; Y1777-T1780 WeakPolarHBondContact CA-OG1 3.29Å; Y1777-T1780 WeakPolarHBondContact CB-OG1 3.46Å; Y1777-T1780 PolarHBondContact O-N 3.07Å; Y1777-T1780 VanDerWaalsContact O-N 3.07Å; Y1777-T1780 PolarHBondContact O-OG1 3.3Å; Y1777-L1781 WeakPolarHBondContact O-CB 3.45Å; Y1777-L1781 PolarHBondContact O-N 3.23Å
1778	G	65.3	Low	72.3	Confident	2.6 Å²	2.6	38.2 Å²	38.2	3%	0.027	20%	0.203	C	C	.	.	H	α-helix	trans	-58.2	-35.6	-177.9	0	0	0	0	0	115.1	Q1772 T1780 L1781 L1782 Y1825	Q1772-G1778 PolarHBondContact O-N 3.23Å; G1778-T1780 VanDerWaalsContact C-N 3.32Å; G1778-T1780 PolarHBondContact O-N 2.97Å; G1778-L1781 VanDerWaalsContact O-CB 3.24Å; G1778-L1781 WeakPolarHBondContact O-CB 3.45Å; G1778-L1781 PolarHBondContact O-N 3.19Å; G1778-L1782 PolarHBondContact O-N 2.94Å; G1778-L1782 VanDerWaalsContact O-N 3.13Å; G1778-Y1825 VanDerWaalsContact C-OH 3.27Å; G1778-Y1825 WeakPolarHBondContact CA-OH 3.29Å
1779	L	63	Low	71.6	Confident	111.6 Å²	111.6	39.1 Å²	39.1	58%	0.584	21%	0.208	S	C	*	.	H	α-helix	trans	-68.5	-39.5	176.4	-77.4	167.8	0	0	0	112.2	Y1777 L1781 L1782 D1783 Y1825	Y1777-L1779 VanDerWaalsContact C-N 3.31Å; Y1777-L1779 PolarHBondContact O-N 3.28Å; Y1777-L1779 VanDerWaalsContact O-N 3.08Å; L1779-L1781 VanDerWaalsContact C-N 3.26Å; L1779-L1781 PolarHBondContact O-N 3Å; L1779-L1782 PolarHBondContact O-N 3.13Å; L1779-D1783 PolarHBondContact O-N 2.97Å; L1779-Y1825 HydrophobicContact CD1-CE1 4.45Å; L1779-Y1825 HydrophobicContact CD2-CD1 4.2Å; L1779-Y1825 HydrophobicContact CD2-CE1 3.66Å; L1779-Y1825 VanDerWaalsContact CD2-CE1 3.48Å; L1779-Y1825 HydrophobicContact CG-CE1 3.82Å; L1779-Y1825 PolarHBondContact N-OH 2.98Å; L1779-Y1825 VanDerWaalsContact N-OH 3.12Å
1780	T	68	Low	70.6	Confident	59 Å²	59	42.5 Å²	42.5	36%	0.362	23%	0.229	S	C	.	.	H	α-helix	trans	-65.8	-28.5	176.5	44.2	0	0	0	0	111.8	Y1777 G1778 D1783 D1784	Y1777-T1780 WeakPolarHBondContact CA-OG1 3.29Å; Y1777-T1780 WeakPolarHBondContact CB-OG1 3.46Å; Y1777-T1780 PolarHBondContact O-N 3.07Å; Y1777-T1780 VanDerWaalsContact O-N 3.07Å; Y1777-T1780 PolarHBondContact O-OG1 3.3Å; G1778-T1780 VanDerWaalsContact C-N 3.32Å; G1778-T1780 PolarHBondContact O-N 2.97Å; T1780-D1783 WeakPolarHBondContact O-CB 3.25Å; T1780-D1783 PolarHBondContact O-N 3.39Å; T1780-D1784 VanDerWaalsContact O-CB 3.25Å; T1780-D1784 WeakPolarHBondContact O-CB 3.22Å; T1780-D1784 VanDerWaalsContact O-CG 3.3Å; T1780-D1784 PolarHBondContact O-N 3.04Å
1781	L	74	Confident	69.7	Low	5.8 Å²	5.8	43.6 Å²	43.6	3%	0.03	24%	0.237	C	C	.	.	H	α-helix	trans	-66.5	-39.8	178.2	-167.9	111.3	0	0	0	112.6	I1747 L1763 F1768 L1769 Q1772 Y1777 G1778 L1779 D1783 D1784 M1785 L1821	I1747-L1781 HydrophobicContact CD1-CD1 3.99Å; L1763-L1781 HydrophobicContact CD2-CD1 4.03Å; L1763-L1781 HydrophobicContact CD2-CG 4.47Å; F1768-L1781 HydrophobicContact CD1-CD1 4.4Å; F1768-L1781 HydrophobicContact CE1-CD1 4.1Å; L1769-L1781 HydrophobicContact CD2-CD1 3.85Å; L1769-L1781 VanDerWaalsContact CD2-CD1 3.42Å; L1769-L1781 HydrophobicContact CD2-CD2 3.42Å; L1769-L1781 VanDerWaalsContact CD2-CD2 3.44Å; L1769-L1781 HydrophobicContact CD2-CG 4.12Å; Q1772-L1781 HydrophobicContact CB-CD1 3.83Å; Q1772-L1781 HydrophobicContact CB-CD2 4.04Å; Q1772-L1781 HydrophobicContact CG-CD1 4.05Å; Q1772-L1781 HydrophobicContact CG-CD2 4.43Å; Y1777-L1781 WeakPolarHBondContact O-CB 3.45Å; Y1777-L1781 PolarHBondContact O-N 3.23Å; G1778-L1781 VanDerWaalsContact O-CB 3.24Å; G1778-L1781 WeakPolarHBondContact O-CB 3.45Å; G1778-L1781 PolarHBondContact O-N 3.19Å; L1779-L1781 VanDerWaalsContact C-N 3.26Å; L1779-L1781 PolarHBondContact O-N 3Å; L1781-D1783 VanDerWaalsContact C-N 3.31Å; L1781-D1783 PolarHBondContact O-N 2.9Å; L1781-D1784 PolarHBondContact O-N 3.34Å; L1781-M1785 HydrophobicContact CD2-CE 3.77Å; L1781-M1785 HydrophobicContact CD2-CG 4.14Å; L1781-M1785 HydrophobicContact CD2-SD 4.09Å; L1781-M1785 HydrophobicContact CG-CE 4.4Å; L1781-M1785 WeakPolarHBondContact O-CB 3.38Å; L1781-M1785 VanDerWaalsContact O-CG 3.29Å; L1781-M1785 WeakPolarHBondContact O-CG 3.27Å; L1781-M1785 PolarHBondContact O-N 3.28Å; L1781-L1821 HydrophobicContact CD2-CD1 3.94Å
1782	L	71.5	Confident	68.7	Low	24.8 Å²	24.8	42 Å²	42	13%	0.13	23%	0.23	C	C	.	.	H	α-helix	trans	-65.5	-38	174.4	-70.3	173.2	0	0	0	111.9	G1778 L1779 D1784 M1785 N1786 Q1818 L1821 Y1825	G1778-L1782 PolarHBondContact O-N 2.94Å; G1778-L1782 VanDerWaalsContact O-N 3.13Å; L1779-L1782 PolarHBondContact O-N 3.13Å; L1782-D1784 VanDerWaalsContact C-N 3.35Å; L1782-M1785 PolarHBondContact O-N 3.36Å; L1782-N1786 PolarHBondContact O-N 3.2Å; L1782-N1786 VanDerWaalsContact O-N 3.12Å; L1782-N1786 PolarHBondContact O-ND2 3.33Å; L1782-N1786 VanDerWaalsContact O-ND2 3.09Å; L1782-Q1818 HydrophobicContact CD2-CG 4Å; L1782-L1821 HydrophobicContact CD2-CB 4.11Å; L1782-Y1825 HydrophobicContact CD1-CD2 4.24Å; L1782-Y1825 HydrophobicContact CD1-CG 4.33Å
1783	D	66.7	Low	67.3	Low	52.4 Å²	52.4	45.3 Å²	45.3	28%	0.28	25%	0.251	S	S	.	.	H	α-helix	trans	-67.4	-40.1	174.3	-89.4	-4.9	0	0	0	112	L1779 T1780 L1781 N1786 R1787 K1940	L1779-D1783 PolarHBondContact O-N 2.97Å; T1780-D1783 WeakPolarHBondContact O-CB 3.25Å; T1780-D1783 PolarHBondContact O-N 3.39Å; L1781-D1783 VanDerWaalsContact C-N 3.31Å; L1781-D1783 PolarHBondContact O-N 2.9Å; D1783-N1786 WeakPolarHBondContact O-CB 3.4Å; D1783-N1786 PolarHBondContact O-N 3.13Å; D1783-R1787 WeakPolarHBondContact O-CG 3.35Å; D1783-R1787 PolarHBondContact O-N 3.26Å; D1783-K1940 WeakPolarHBondContact OD1-CD 3.11Å; D1783-K1940 VanDerWaalsContact OD1-CE 3.28Å; D1783-K1940 WeakPolarHBondContact OD1-CE 3.18Å; D1783-K1940 IonicContact OD1-NZ 3.31Å; D1783-K1940 PolarHBondContact OD1-NZ 3.26Å; D1783-K1940 IonicContact OD2-NZ 3.14Å; D1783-K1940 PolarHBondContact OD2-NZ 3.04Å
1784	D	70.8	Confident	65.9	Low	21.8 Å²	21.8	48 Å²	48	12%	0.117	28%	0.276	C	S	.	.	H	α-helix	trans	-69.7	-39.5	177.7	-74.3	-22.2	0	0	0	111.7	I1747 T1780 L1781 L1782 N1786 R1787 Y1788	I1747-D1784 HydrophobicContact CD1-CB 4.1Å; I1747-D1784 HydrophobicContact CG2-CB 4.05Å; T1780-D1784 VanDerWaalsContact O-CB 3.25Å; T1780-D1784 WeakPolarHBondContact O-CB 3.22Å; T1780-D1784 VanDerWaalsContact O-CG 3.3Å; T1780-D1784 PolarHBondContact O-N 3.04Å; L1781-D1784 PolarHBondContact O-N 3.34Å; L1782-D1784 VanDerWaalsContact C-N 3.35Å; D1784-N1786 VanDerWaalsContact C-N 3.32Å; D1784-N1786 PolarHBondContact O-N 3.16Å; D1784-R1787 WeakPolarHBondContact O-CB 3.33Å; D1784-R1787 PolarHBondContact O-N 3.25Å; D1784-R1787 VanDerWaalsContact O-N 3.14Å; D1784-R1787 WeakPolarHBondContact OD1-CD 3.38Å; D1784-R1787 IonicContact OD1-CZ 3.9Å; D1784-R1787 IonicContact OD1-NE 3.54Å; D1784-R1787 IonicContact OD1-NH1 3.52Å; D1784-R1787 PolarHBondContact OD1-NH1 2.99Å; D1784-R1787 VanDerWaalsContact OD1-NH1 3.13Å; D1784-Y1788 HydrophobicContact CB-CD2 4.38Å; D1784-Y1788 HydrophobicContact CB-CE2 3.92Å; D1784-Y1788 WeakPolarHBondContact O-CB 3.42Å; D1784-Y1788 WeakPolarHBondContact O-CD2 3.4Å; D1784-Y1788 WeakPolarHBondContact O-CE2 3.42Å; D1784-Y1788 PolarHBondContact O-N 3.05Å
1785	M	75.3	Confident	64.7	Low	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-55.6	-46.9	169.5	-75.2	-140.8	-175	0	0	111.6	L1763 L1769 L1781 L1782 R1787 Y1788 I1789 I1814 M1817 Q1818 L1821	L1763-M1785 HydrophobicContact CB-CE 3.96Å; L1763-M1785 HydrophobicContact CB-CG 4.46Å; L1763-M1785 HydrophobicContact CB-SD 3.89Å; L1763-M1785 HydrophobicContact CD1-CG 4.33Å; L1763-M1785 HydrophobicContact CD1-SD 4.04Å; L1763-M1785 HydrophobicContact CD2-CE 3.98Å; L1763-M1785 HydrophobicContact CD2-CG 3.9Å; L1763-M1785 HydrophobicContact CD2-SD 3.9Å; L1763-M1785 HydrophobicContact CG-CE 4.27Å; L1763-M1785 HydrophobicContact CG-CG 4.35Å; L1763-M1785 HydrophobicContact CG-SD 4.15Å; L1763-M1785 WeakPolarHBondContact O-CE 3.33Å; L1769-M1785 HydrophobicContact CD2-CE 4Å; L1781-M1785 HydrophobicContact CD2-CE 3.77Å; L1781-M1785 HydrophobicContact CD2-CG 4.14Å; L1781-M1785 HydrophobicContact CD2-SD 4.09Å; L1781-M1785 HydrophobicContact CG-CE 4.4Å; L1781-M1785 WeakPolarHBondContact O-CB 3.38Å; L1781-M1785 VanDerWaalsContact O-CG 3.29Å; L1781-M1785 WeakPolarHBondContact O-CG 3.27Å; L1781-M1785 PolarHBondContact O-N 3.28Å; L1782-M1785 PolarHBondContact O-N 3.36Å; M1785-R1787 VanDerWaalsContact C-N 3.32Å; M1785-R1787 PolarHBondContact O-N 2.91Å; M1785-Y1788 WeakPolarHBondContact O-CB 3.37Å; M1785-Y1788 PolarHBondContact O-N 3.19Å; M1785-I1789 WeakPolarHBondContact O-CD1 3.14Å; M1785-I1789 VanDerWaalsContact O-CG1 3.27Å; M1785-I1789 WeakPolarHBondContact O-CG1 3.33Å; M1785-I1789 PolarHBondContact O-N 3.13Å; M1785-I1789 VanDerWaalsContact O-N 3.11Å; M1785-I1814 HydrophobicContact CB-CG2 4.23Å; M1785-I1814 HydrophobicContact CG-CG2 4.18Å; M1785-I1814 HydrophobicContact SD-CB 4.49Å; M1785-I1814 HydrophobicContact SD-CG2 3.75Å; M1785-I1814 VanDerWaalsContact SD-CG2 3.51Å; M1785-M1817 HydrophobicContact CE-CB 4.22Å; M1785-M1817 HydrophobicContact CE-CG 4.04Å; M1785-Q1818 HydrophobicContact CB-CG 4.37Å; M1785-Q1818 HydrophobicContact SD-CB 3.87Å; M1785-Q1818 HydrophobicContact SD-CG 4.31Å; M1785-L1821 HydrophobicContact CE-CD1 3.95Å; M1785-L1821 HydrophobicContact SD-CD1 4.31Å
1786	N	70.4	Confident	63.5	Low	42.4 Å²	42.4	51.8 Å²	51.8	23%	0.227	29%	0.287	C	S	.	.	H	α-helix	trans	-62.3	-41.5	176.4	-83.6	-38.7	0	0	0	112.6	L1782 D1783 D1784 Y1788 I1789 T1790 Q1818 S1938	L1782-N1786 PolarHBondContact O-N 3.2Å; L1782-N1786 VanDerWaalsContact O-N 3.12Å; L1782-N1786 PolarHBondContact O-ND2 3.33Å; L1782-N1786 VanDerWaalsContact O-ND2 3.09Å; D1783-N1786 WeakPolarHBondContact O-CB 3.4Å; D1783-N1786 PolarHBondContact O-N 3.13Å; D1784-N1786 VanDerWaalsContact C-N 3.32Å; D1784-N1786 PolarHBondContact O-N 3.16Å; N1786-Y1788 VanDerWaalsContact C-N 3.32Å; N1786-Y1788 PolarHBondContact O-N 3.13Å; N1786-I1789 PolarHBondContact O-N 3.28Å; N1786-T1790 WeakPolarHBondContact O-CB 3.29Å; N1786-T1790 WeakPolarHBondContact O-CG2 3.29Å; N1786-T1790 PolarHBondContact O-N 2.88Å; N1786-T1790 VanDerWaalsContact O-N 3.1Å; N1786-T1790 PolarHBondContact O-OG1 3.14Å; N1786-Q1818 PolarHBondContact ND2-NE2 3.04Å; N1786-Q1818 PolarHBondContact OD1-NE2 3.34Å; N1786-S1938 VanDerWaalsContact ND2-CB 3.33Å; N1786-S1938 WeakPolarHBondContact ND2-CB 3.32Å
1787	R	67.9	Low	62.3	Low	116.6 Å²	116.6	57.8 Å²	57.8	44%	0.44	30%	0.301	S	S	.	.	H	α-helix	trans	-61.4	-44.2	175.7	-77.7	174.5	176.2	160.7	-0.4	111.7	D1783 D1784 M1785 I1789 T1790 T1791	D1783-R1787 WeakPolarHBondContact O-CG 3.35Å; D1783-R1787 PolarHBondContact O-N 3.26Å; D1784-R1787 WeakPolarHBondContact O-CB 3.33Å; D1784-R1787 PolarHBondContact O-N 3.25Å; D1784-R1787 VanDerWaalsContact O-N 3.14Å; D1784-R1787 WeakPolarHBondContact OD1-CD 3.38Å; D1784-R1787 IonicContact OD1-CZ 3.9Å; D1784-R1787 IonicContact OD1-NE 3.54Å; D1784-R1787 IonicContact OD1-NH1 3.52Å; D1784-R1787 PolarHBondContact OD1-NH1 2.99Å; D1784-R1787 VanDerWaalsContact OD1-NH1 3.13Å; M1785-R1787 VanDerWaalsContact C-N 3.32Å; M1785-R1787 PolarHBondContact O-N 2.91Å; R1787-I1789 VanDerWaalsContact C-N 3.31Å; R1787-I1789 PolarHBondContact O-N 3.16Å; R1787-T1790 WeakPolarHBondContact CA-OG1 3.37Å; R1787-T1790 PolarHBondContact O-N 2.97Å; R1787-T1790 VanDerWaalsContact O-N 3.11Å; R1787-T1790 PolarHBondContact O-OG1 3.18Å; R1787-T1790 VanDerWaalsContact O-OG1 3.1Å; R1787-T1791 WeakPolarHBondContact O-CB 3.31Å; R1787-T1791 VanDerWaalsContact O-CG2 3.31Å; R1787-T1791 WeakPolarHBondContact O-CG2 3.43Å; R1787-T1791 PolarHBondContact O-N 3.07Å; R1787-T1791 PolarHBondContact O-OG1 3.18Å
1788	Y	69.8	Low	61.2	Low	10.4 Å²	10.4	59.2 Å²	59.2	4%	0.041	32%	0.321	C	S	.	.	H	α-helix	trans	-66.4	-38.1	178.4	-102.1	-68.6	0	0	0	112.5	I1747 Y1748 H1751 L1756 V1759 V1760 L1763 D1784 M1785 N1786 T1790 T1791 T1792 L1807 I1814	I1747-Y1788 HydrophobicContact CB-CE2 4.22Å; I1747-Y1788 HydrophobicContact CG2-CD2 4.16Å; I1747-Y1788 HydrophobicContact CG2-CE1 4.47Å; I1747-Y1788 HydrophobicContact CG2-CE2 3.35Å; I1747-Y1788 PolarHBondContact O-OH 3.26Å; Y1748-Y1788 WeakPolarHBondContact CA-OH 3.48Å; Y1748-Y1788 PolarHBondContact N-OH 3.38Å; H1751-Y1788 HydrophobicContact CB-CD1 4.1Å; H1751-Y1788 HydrophobicContact CB-CE1 3.56Å; H1751-Y1788 AromaticContact CD2-CD1 3.28Å; H1751-Y1788 VanDerWaalsContact CD2-CD1 3.42Å; H1751-Y1788 WeakPolarHBondContact CD2-CD1 3.4Å; H1751-Y1788 AromaticContact CD2-CE1 3.41Å; H1751-Y1788 WeakPolarHBondContact CD2-CE1 3.28Å; H1751-Y1788 AromaticContact CG-CD1 3.73Å; H1751-Y1788 AromaticContact CG-CE1 3.31Å; H1751-Y1788 AromaticContact ND1-CE1 3.81Å; H1751-Y1788 AromaticContact NE2-CD1 3.65Å; H1751-Y1788 AromaticContact NE2-CE1 3.84Å; L1756-Y1788 HydrophobicContact CB-CE2 4.27Å; L1756-Y1788 HydrophobicContact CD2-CE2 4.19Å; L1756-Y1788 PolarHBondContact O-OH 2.9Å; V1759-Y1788 HydrophobicContact CB-CD2 4.28Å; V1759-Y1788 HydrophobicContact CB-CE2 4.16Å; V1759-Y1788 HydrophobicContact CG1-CD2 3.67Å; V1759-Y1788 HydrophobicContact CG1-CE2 4.18Å; V1759-Y1788 HydrophobicContact CG1-CG 4.38Å; V1760-Y1788 HydrophobicContact CG2-CE1 3.91Å; V1760-Y1788 HydrophobicContact CG2-CE2 3.86Å; V1760-Y1788 VanDerWaalsContact CG2-CZ 3.43Å; V1760-Y1788 WeakPolarHBondContact CG2-OH 3.42Å; L1763-Y1788 HydrophobicContact CD1-CD2 4.04Å; L1763-Y1788 HydrophobicContact CD1-CE2 4.5Å; L1763-Y1788 HydrophobicContact CD1-CG 4.29Å; D1784-Y1788 HydrophobicContact CB-CD2 4.38Å; D1784-Y1788 HydrophobicContact CB-CE2 3.92Å; D1784-Y1788 WeakPolarHBondContact O-CB 3.42Å; D1784-Y1788 WeakPolarHBondContact O-CD2 3.4Å; D1784-Y1788 WeakPolarHBondContact O-CE2 3.42Å; D1784-Y1788 PolarHBondContact O-N 3.05Å; M1785-Y1788 WeakPolarHBondContact O-CB 3.37Å; M1785-Y1788 PolarHBondContact O-N 3.19Å; N1786-Y1788 VanDerWaalsContact C-N 3.32Å; N1786-Y1788 PolarHBondContact O-N 3.13Å; Y1788-T1790 VanDerWaalsContact C-N 3.32Å; Y1788-T1790 PolarHBondContact O-N 3.25Å; Y1788-T1791 PolarHBondContact O-OG1 3.16Å; Y1788-T1791 VanDerWaalsContact O-OG1 3.11Å; Y1788-T1792 HydrophobicContact CD1-CG2 4.41Å; Y1788-T1792 HydrophobicContact CD2-CG2 4.49Å; Y1788-T1792 HydrophobicContact CE1-CG2 3.89Å; Y1788-T1792 HydrophobicContact CE2-CG2 3.99Å; Y1788-T1792 VanDerWaalsContact O-CB 3.31Å; Y1788-T1792 WeakPolarHBondContact O-CB 3.34Å; Y1788-T1792 VanDerWaalsContact O-CG2 3.29Å; Y1788-T1792 WeakPolarHBondContact O-CG2 3.4Å; Y1788-T1792 PolarHBondContact O-N 3.03Å; Y1788-T1792 VanDerWaalsContact O-N 3.15Å; Y1788-T1792 PolarHBondContact O-OG1 3.05Å; Y1788-T1792 VanDerWaalsContact O-OG1 3.1Å; Y1788-L1807 WeakPolarHBondContact OH-CD2 3.37Å; Y1788-I1814 HydrophobicContact CD1-CD1 3.43Å; Y1788-I1814 VanDerWaalsContact CD1-CD1 3.47Å; Y1788-I1814 HydrophobicContact CE1-CD1 3.38Å; Y1788-I1814 VanDerWaalsContact CE1-CD1 3.42Å; Y1788-I1814 HydrophobicContact CG-CD1 4.37Å
1789	I	69	Low	60.1	Low	19.2 Å²	19.2	66.5 Å²	66.5	10%	0.098	36%	0.355	C	S	.	.	H	α-helix	trans	-63.4	-40.3	174.6	-66.5	163.3	0	0	0	111.3	M1785 N1786 R1787 T1792 T1793 R1811 I1814 R1815 Q1818	M1785-I1789 WeakPolarHBondContact O-CD1 3.14Å; M1785-I1789 VanDerWaalsContact O-CG1 3.27Å; M1785-I1789 WeakPolarHBondContact O-CG1 3.33Å; M1785-I1789 PolarHBondContact O-N 3.13Å; M1785-I1789 VanDerWaalsContact O-N 3.11Å; N1786-I1789 PolarHBondContact O-N 3.28Å; R1787-I1789 VanDerWaalsContact C-N 3.31Å; R1787-I1789 PolarHBondContact O-N 3.16Å; I1789-T1792 PolarHBondContact O-OG1 3.11Å; I1789-T1793 WeakPolarHBondContact O-CG2 3.39Å; I1789-T1793 PolarHBondContact O-N 2.99Å; I1789-R1811 HydrophobicContact CG2-CG 4.47Å; I1789-I1814 HydrophobicContact CD1-CG2 4.09Å; I1789-I1814 HydrophobicContact CG1-CG2 4.14Å; I1789-R1815 HydrophobicContact CD1-CG 3.96Å; I1789-Q1818 VanDerWaalsContact CD1-OE1 3.24Å
1790	T	62.8	Low	58.9	Low	72.4 Å²	72.4	66.7 Å²	66.7	44%	0.444	37%	0.365	S	S	.	.	H	α-helix	trans	-81	-41.3	-176.1	49.5	0	0	0	0	113.7	N1786 R1787 Y1788 T1792 T1793 A1794	N1786-T1790 WeakPolarHBondContact O-CB 3.29Å; N1786-T1790 WeakPolarHBondContact O-CG2 3.29Å; N1786-T1790 PolarHBondContact O-N 2.88Å; N1786-T1790 VanDerWaalsContact O-N 3.1Å; N1786-T1790 PolarHBondContact O-OG1 3.14Å; R1787-T1790 WeakPolarHBondContact CA-OG1 3.37Å; R1787-T1790 PolarHBondContact O-N 2.97Å; R1787-T1790 VanDerWaalsContact O-N 3.11Å; R1787-T1790 PolarHBondContact O-OG1 3.18Å; R1787-T1790 VanDerWaalsContact O-OG1 3.1Å; Y1788-T1790 VanDerWaalsContact C-N 3.32Å; Y1788-T1790 PolarHBondContact O-N 3.25Å; T1790-T1792 VanDerWaalsContact C-N 3.3Å; T1790-T1792 PolarHBondContact O-N 3.24Å; T1790-T1793 WeakPolarHBondContact CA-OG1 3.29Å; T1790-T1793 PolarHBondContact O-N 3.18Å; T1790-T1793 VanDerWaalsContact O-N 3.14Å; T1790-T1793 PolarHBondContact O-OG1 3.02Å; T1790-A1794 PolarHBondContact O-N 3.19Å
1791	T	60.6	Low	57.9	Low	47.8 Å²	47.8	70.2 Å²	70.2	29%	0.293	38%	0.382	S	S	.	.	H	α-helix	trans	-65.8	-32.7	-178.4	48.7	0	0	0	0	113.1	H1751 R1787 Y1788 T1793 A1794 H1795	H1751-T1791 PolarHBondContact CE1-OG1 2.95Å; H1751-T1791 VanDerWaalsContact CE1-OG1 3.3Å; R1787-T1791 WeakPolarHBondContact O-CB 3.31Å; R1787-T1791 VanDerWaalsContact O-CG2 3.31Å; R1787-T1791 WeakPolarHBondContact O-CG2 3.43Å; R1787-T1791 PolarHBondContact O-N 3.07Å; R1787-T1791 PolarHBondContact O-OG1 3.18Å; Y1788-T1791 PolarHBondContact O-OG1 3.16Å; Y1788-T1791 VanDerWaalsContact O-OG1 3.11Å; T1791-T1793 VanDerWaalsContact C-N 3.29Å; T1791-T1793 PolarHBondContact O-N 3.02Å; T1791-A1794 PolarHBondContact O-N 3.28Å; T1791-H1795 PolarHBondContact O-CD2 3.19Å; T1791-H1795 PolarHBondContact O-N 3.22Å; T1791-H1795 VanDerWaalsContact O-N 3.13Å
1792	T	55.7	Low	56.4	Low	9.8 Å²	9.8	78.1 Å²	78.1	6%	0.06	42%	0.424	C	S	.	.	H	α-helix	trans	-65	-28.1	177.4	28.6	0	0	0	0	112.9	Y1788 I1789 T1790 A1794 H1795 H1796 L1807 R1811	Y1788-T1792 HydrophobicContact CD1-CG2 4.41Å; Y1788-T1792 HydrophobicContact CD2-CG2 4.49Å; Y1788-T1792 HydrophobicContact CE1-CG2 3.89Å; Y1788-T1792 HydrophobicContact CE2-CG2 3.99Å; Y1788-T1792 VanDerWaalsContact O-CB 3.31Å; Y1788-T1792 WeakPolarHBondContact O-CB 3.34Å; Y1788-T1792 VanDerWaalsContact O-CG2 3.29Å; Y1788-T1792 WeakPolarHBondContact O-CG2 3.4Å; Y1788-T1792 PolarHBondContact O-N 3.03Å; Y1788-T1792 VanDerWaalsContact O-N 3.15Å; Y1788-T1792 PolarHBondContact O-OG1 3.05Å; Y1788-T1792 VanDerWaalsContact O-OG1 3.1Å; I1789-T1792 PolarHBondContact O-OG1 3.11Å; T1790-T1792 VanDerWaalsContact C-N 3.3Å; T1790-T1792 PolarHBondContact O-N 3.24Å; T1792-A1794 VanDerWaalsContact C-N 3.34Å; T1792-A1794 PolarHBondContact O-N 3.12Å; T1792-H1795 PolarHBondContact O-N 2.66Å; T1792-H1796 PolarHBondContact O-CD2 3.35Å; T1792-H1796 PolarHBondContact O-N 3.12Å; T1792-L1807 HydrophobicContact CG2-CB 4.41Å; T1792-L1807 HydrophobicContact CG2-CD2 3.55Å; T1792-L1807 HydrophobicContact CG2-CG 4.41Å; T1792-R1811 PolarHBondContact O-NH2 3.49Å; T1792-R1811 PolarHBondContact OG1-NE 3.11Å; T1792-R1811 PolarHBondContact OG1-NH2 3.28Å
1793	T	49.7	Very low	55.3	Low	74.8 Å²	74.8	83.4 Å²	83.4	46%	0.459	45%	0.451	S	S	.	.	H	α-helix	trans	-72	-27.6	177.5	58.4	0	0	0	0	113.3	I1789 T1790 T1791 Q1797 R1811	I1789-T1793 WeakPolarHBondContact O-CG2 3.39Å; I1789-T1793 PolarHBondContact O-N 2.99Å; T1790-T1793 WeakPolarHBondContact CA-OG1 3.29Å; T1790-T1793 PolarHBondContact O-N 3.18Å; T1790-T1793 VanDerWaalsContact O-N 3.14Å; T1790-T1793 PolarHBondContact O-OG1 3.02Å; T1791-T1793 VanDerWaalsContact C-N 3.29Å; T1791-T1793 PolarHBondContact O-N 3.02Å; T1793-Q1797 PolarHBondContact O-N 3.2Å; T1793-R1811 VanDerWaalsContact N-NH2 3.16Å
1794	A	46.6	Very low	54.5	Low	71 Å²	71	85.5 Å²	85.5	59%	0.587	47%	0.468	S	S	*	.	H	α-helix	trans	-86	-34.9	-176.6	0	0	0	0	0	113.8	T1790 T1791 T1792 H1796	T1790-A1794 PolarHBondContact O-N 3.19Å; T1791-A1794 PolarHBondContact O-N 3.28Å; T1792-A1794 VanDerWaalsContact C-N 3.34Å; T1792-A1794 PolarHBondContact O-N 3.12Å; A1794-H1796 VanDerWaalsContact C-N 3.34Å; A1794-H1796 PolarHBondContact O-N 3.21Å
1795	H	48.3	Very low	53.8	Low	138.4 Å²	138.4	86.7 Å²	86.7	64%	0.641	48%	0.476	S	S	*	.	H	α-helix	trans	-83.5	-27.7	-175.6	-84	-63	0	0	0	114.6	T1791 T1792 Q1797 S1798	T1791-H1795 PolarHBondContact O-CD2 3.19Å; T1791-H1795 PolarHBondContact O-N 3.22Å; T1791-H1795 VanDerWaalsContact O-N 3.13Å; T1792-H1795 PolarHBondContact O-N 2.66Å; H1795-Q1797 VanDerWaalsContact C-N 3.33Å; H1795-Q1797 PolarHBondContact O-N 3.09Å; H1795-S1798 PolarHBondContact O-N 2.94Å; H1795-S1798 PolarHBondContact O-OG 2.91Å; H1795-S1798 VanDerWaalsContact O-OG 3.09Å
1796	H	44.4	Very low	53.1	Low	81.4 Å²	81.4	89.2 Å²	89.2	38%	0.377	49%	0.493	S	S	.	.	H	α-helix	trans	-87.8	-7.5	-176	-74.5	-64.4	0	0	0	115.3	T1792 A1794 S1798 E1799 T1805 D1808	T1792-H1796 PolarHBondContact O-CD2 3.35Å; T1792-H1796 PolarHBondContact O-N 3.12Å; A1794-H1796 VanDerWaalsContact C-N 3.34Å; A1794-H1796 PolarHBondContact O-N 3.21Å; H1796-S1798 PolarHBondContact O-N 3.13Å; H1796-S1798 VanDerWaalsContact O-N 3.09Å; H1796-E1799 PolarHBondContact O-N 3.05Å; H1796-T1805 PolarHBondContact CE1-OG1 3.46Å; H1796-D1808 IonicContact CD2-OD1 3.23Å
1797	Q	41.6	Very low	52.6	Low	179.8 Å²	179.8	88.3 Å²	88.3	84%	0.84	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-6	175.3	-70.7	-173.3	-2.5	0	0	113.8	T1793 H1795	T1793-Q1797 PolarHBondContact O-N 3.2Å; H1795-Q1797 VanDerWaalsContact C-N 3.33Å; H1795-Q1797 PolarHBondContact O-N 3.09Å
1798	S	42.9	Very low	52.4	Low	100.4 Å²	100.4	85.1 Å²	85.1	70%	0.702	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-7.5	-175.6	59.1	0	0	0	0	116.2	H1795 H1796	H1795-S1798 PolarHBondContact O-N 2.94Å; H1795-S1798 PolarHBondContact O-OG 2.91Å; H1795-S1798 VanDerWaalsContact O-OG 3.09Å; H1796-S1798 PolarHBondContact O-N 3.13Å; H1796-S1798 VanDerWaalsContact O-N 3.09Å
1799	E	42.5	Very low	52.2	Low	157.6 Å²	157.6	89.8 Å²	89.8	74%	0.736	51%	0.505	S	S	*	.			trans	-113.7	117.5	178.8	-70.7	-169.6	165.7	0	0	111.8	H1796 N1801	H1796-E1799 PolarHBondContact O-N 3.05Å; E1799-N1801 VanDerWaalsContact C-N 3.28Å; E1799-N1801 PolarHBondContact O-N 3.13Å
1800	S	38.7	Very low	52.3	Low	115.8 Å²	115.8	89.5 Å²	89.5	81%	0.81	50%	0.503	S	S	*	.			trans	-79.9	31.7	-167.3	60.6	0	0	0	0	115.5
1801	N	45.8	Very low	52.8	Low	132.2 Å²	132.2	87.7 Å²	87.7	71%	0.707	49%	0.489	S	S	*	.			trans	-119.9	110.5	-179.8	-71.9	-30.1	0	0	0	110.9	E1799 I1803	E1799-N1801 VanDerWaalsContact C-N 3.28Å; E1799-N1801 PolarHBondContact O-N 3.13Å; N1801-I1803 VanDerWaalsContact C-N 3.31Å; N1801-I1803 PolarHBondContact O-N 3.12Å
1802	N	43.9	Very low	53.5	Low	170.8 Å²	170.8	89.9 Å²	89.9	91%	0.913	50%	0.498	S	S	*	.			trans	-70.9	49	-175	-72.7	-18.8	0	0	0	114.6
1803	I	47.3	Very low	54.7	Low	136.6 Å²	136.6	91 Å²	91	70%	0.701	50%	0.502	S	S	*	.			trans	-105.1	115.2	171.6	-56.6	173.3	0	0	0	107	N1801 T1805	N1801-I1803 VanDerWaalsContact C-N 3.31Å; N1801-I1803 PolarHBondContact O-N 3.12Å; I1803-T1805 PolarHBondContact O-N 3.33Å; I1803-T1805 VanDerWaalsContact O-N 3.08Å
1804	P	49.7	Very low	56.1	Low	96.4 Å²	96.4	87.5 Å²	87.5	63%	0.626	48%	0.481	S	S	*	.			trans	-60.6	123	176.6	24.5	-31.6	0	0	0	108.8	D1808 L1809	P1804-D1808 WeakPolarHBondContact CA-OD2 3.45Å; P1804-D1808 HydrophobicContact CB-CB 4.41Å; P1804-L1809 HydrophobicContact CB-CD1 4.16Å; P1804-L1809 HydrophobicContact CG-CD1 3.98Å
1805	T	57	Low	57.5	Low	47.8 Å²	47.8	88.2 Å²	88.2	29%	0.293	47%	0.468	S	S	.	.			trans	-73	157.2	178.8	61.1	0	0	0	0	109.4	H1796 I1803 L1807 D1808 L1809	H1796-T1805 PolarHBondContact CE1-OG1 3.46Å; I1803-T1805 PolarHBondContact O-N 3.33Å; I1803-T1805 VanDerWaalsContact O-N 3.08Å; T1805-L1807 PolarHBondContact O-N 2.98Å; T1805-L1807 VanDerWaalsContact O-N 3.13Å; T1805-L1807 PolarHBondContact OG1-N 3.28Å; T1805-D1808 WeakPolarHBondContact CB-OD2 3.3Å; T1805-D1808 PolarHBondContact N-OD2 3.13Å; T1805-D1808 VanDerWaalsContact N-OD2 3.12Å; T1805-D1808 WeakPolarHBondContact O-CA 3.29Å; T1805-D1808 WeakPolarHBondContact O-CB 3.24Å; T1805-D1808 PolarHBondContact O-N 3.22Å; T1805-D1808 VanDerWaalsContact OG1-CG 3.3Å; T1805-D1808 PolarHBondContact OG1-N 3.08Å; T1805-D1808 PolarHBondContact OG1-OD2 3.07Å; T1805-D1808 VanDerWaalsContact OG1-OD2 3.09Å; T1805-L1809 PolarHBondContact O-N 3.33Å
1806	S	59.6	Low	59.1	Low	52.4 Å²	52.4	82 Å²	82	37%	0.366	44%	0.44	S	S	.	.	H	α-helix	trans	-54.6	-26.1	173.9	52.1	0	0	0	0	113	N1757 D1808 L1809 M1810	N1757-S1806 WeakPolarHBondContact OD1-CB 3.35Å; N1757-S1806 PolarHBondContact OD1-OG 3.27Å; S1806-D1808 VanDerWaalsContact C-N 3.35Å; S1806-L1809 PolarHBondContact O-N 3.3Å; S1806-M1810 VanDerWaalsContact O-CB 3.32Å; S1806-M1810 WeakPolarHBondContact O-CB 3.44Å; S1806-M1810 VanDerWaalsContact O-CG 3.29Å; S1806-M1810 WeakPolarHBondContact O-CG 3.4Å; S1806-M1810 PolarHBondContact O-N 3.1Å; S1806-M1810 VanDerWaalsContact O-N 3.12Å
1807	L	61.2	Low	60.9	Low	23 Å²	23	78.2 Å²	78.2	12%	0.12	42%	0.423	C	S	.	.	H	α-helix	trans	-66.9	-33.4	174.2	-104.5	111.3	0	0	0	113.1	L1756 V1760 Y1788 T1792 T1805 M1810 R1811	L1756-L1807 HydrophobicContact CB-CD1 3.99Å; L1756-L1807 HydrophobicContact CD1-CD1 4.47Å; L1756-L1807 HydrophobicContact CD2-CD1 4.32Å; L1756-L1807 HydrophobicContact CG-CD1 4.43Å; V1760-L1807 HydrophobicContact CG2-CB 4.45Å; V1760-L1807 HydrophobicContact CG2-CD1 3.45Å; V1760-L1807 VanDerWaalsContact CG2-CD1 3.45Å; V1760-L1807 HydrophobicContact CG2-CD2 4.32Å; V1760-L1807 HydrophobicContact CG2-CG 4.06Å; Y1788-L1807 WeakPolarHBondContact OH-CD2 3.37Å; T1792-L1807 HydrophobicContact CG2-CB 4.41Å; T1792-L1807 HydrophobicContact CG2-CD2 3.55Å; T1792-L1807 HydrophobicContact CG2-CG 4.41Å; T1805-L1807 PolarHBondContact O-N 2.98Å; T1805-L1807 VanDerWaalsContact O-N 3.13Å; T1805-L1807 PolarHBondContact OG1-N 3.28Å; L1807-M1810 HydrophobicContact CG-CE 4.42Å; L1807-M1810 CarbonylContact O-C 3.58Å; L1807-M1810 PolarHBondContact O-N 3.02Å; L1807-R1811 WeakPolarHBondContact O-CA 3.11Å; L1807-R1811 WeakPolarHBondContact O-CB 3.3Å; L1807-R1811 PolarHBondContact O-N 3.15Å; L1807-R1811 VanDerWaalsContact O-N 3.07Å
1808	D	64	Low	62.7	Low	49.6 Å²	49.6	70.8 Å²	70.8	27%	0.265	39%	0.388	S	S	.	.	H	α-helix	trans	-69.1	-43.5	179.1	-66.9	-56	0	0	0	111.2	H1796 P1804 T1805 S1806 M1810 R1811 D1812	H1796-D1808 IonicContact CD2-OD1 3.23Å; P1804-D1808 WeakPolarHBondContact CA-OD2 3.45Å; P1804-D1808 HydrophobicContact CB-CB 4.41Å; T1805-D1808 WeakPolarHBondContact CB-OD2 3.3Å; T1805-D1808 PolarHBondContact N-OD2 3.13Å; T1805-D1808 VanDerWaalsContact N-OD2 3.12Å; T1805-D1808 WeakPolarHBondContact O-CA 3.29Å; T1805-D1808 WeakPolarHBondContact O-CB 3.24Å; T1805-D1808 PolarHBondContact O-N 3.22Å; T1805-D1808 VanDerWaalsContact OG1-CG 3.3Å; T1805-D1808 PolarHBondContact OG1-N 3.08Å; T1805-D1808 PolarHBondContact OG1-OD2 3.07Å; T1805-D1808 VanDerWaalsContact OG1-OD2 3.09Å; S1806-D1808 VanDerWaalsContact C-N 3.35Å; D1808-M1810 VanDerWaalsContact C-N 3.26Å; D1808-M1810 PolarHBondContact O-N 3.1Å; D1808-R1811 VanDerWaalsContact O-CB 3.28Å; D1808-R1811 WeakPolarHBondContact O-CB 3.32Å; D1808-R1811 PolarHBondContact O-N 3.16Å; D1808-R1811 VanDerWaalsContact O-N 3.08Å; D1808-R1811 IonicContact OD1-CZ 3.31Å; D1808-R1811 IonicContact OD1-NH1 2.91Å; D1808-R1811 PolarHBondContact OD1-NH1 2.96Å; D1808-R1811 IonicContact OD1-NH2 3.21Å; D1808-R1811 PolarHBondContact OD1-NH2 3.13Å; D1808-D1812 PolarHBondContact O-N 2.55Å
1809	L	64.6	Low	64.2	Low	109.4 Å²	109.4	72.4 Å²	72.4	57%	0.573	38%	0.379	S	S	*	.	H	α-helix	trans	-61.5	-33.5	173.9	-127.8	100.2	0	0	0	112.2	P1804 T1805 S1806 R1811 K1813	P1804-L1809 HydrophobicContact CB-CD1 4.16Å; P1804-L1809 HydrophobicContact CG-CD1 3.98Å; T1805-L1809 PolarHBondContact O-N 3.33Å; S1806-L1809 PolarHBondContact O-N 3.3Å; L1809-R1811 VanDerWaalsContact C-N 3.3Å; L1809-R1811 PolarHBondContact O-N 2.82Å; L1809-K1813 PolarHBondContact O-N 3.47Å
1810	M	71.8	Confident	66	Low	11.2 Å²	11.2	64.9 Å²	64.9	6%	0.055	34%	0.344	C	S	.	.	H	α-helix	trans	-87.1	-13.9	-178.9	-67.9	-79.1	-61.4	0	0	113.3	V1573 P1574 L1575 V1760 T1764 S1806 L1807 D1808 D1812 K1813 I1814	V1573-M1810 HydrophobicContact CG1-CG 4.21Å; V1573-M1810 HydrophobicContact CG1-SD 4.13Å; P1574-M1810 HydrophobicContact CG-CE 3.76Å; L1575-M1810 HydrophobicContact CB-CE 3.91Å; L1575-M1810 HydrophobicContact CB-SD 4.47Å; L1575-M1810 HydrophobicContact CD1-CE 3.68Å; L1575-M1810 HydrophobicContact CG-CE 4.01Å; V1760-M1810 HydrophobicContact CB-CE 4.23Å; V1760-M1810 HydrophobicContact CB-SD 3.86Å; V1760-M1810 HydrophobicContact CG1-CB 3.79Å; V1760-M1810 HydrophobicContact CG1-CE 3.75Å; V1760-M1810 VanDerWaalsContact CG1-CE 3.41Å; V1760-M1810 HydrophobicContact CG1-CG 3.89Å; V1760-M1810 HydrophobicContact CG1-SD 4Å; V1760-M1810 VanDerWaalsContact CG1-SD 3.52Å; V1760-M1810 HydrophobicContact CG2-CB 4.28Å; V1760-M1810 HydrophobicContact CG2-CE 3.78Å; V1760-M1810 HydrophobicContact CG2-SD 4Å; T1764-M1810 HydrophobicContact CG2-CE 3.99Å; S1806-M1810 VanDerWaalsContact O-CB 3.32Å; S1806-M1810 WeakPolarHBondContact O-CB 3.44Å; S1806-M1810 VanDerWaalsContact O-CG 3.29Å; S1806-M1810 WeakPolarHBondContact O-CG 3.4Å; S1806-M1810 PolarHBondContact O-N 3.1Å; S1806-M1810 VanDerWaalsContact O-N 3.12Å; L1807-M1810 HydrophobicContact CG-CE 4.42Å; L1807-M1810 CarbonylContact O-C 3.58Å; L1807-M1810 PolarHBondContact O-N 3.02Å; D1808-M1810 VanDerWaalsContact C-N 3.26Å; D1808-M1810 PolarHBondContact O-N 3.1Å; M1810-D1812 VanDerWaalsContact C-N 3.27Å; M1810-D1812 PolarHBondContact O-N 3.18Å; M1810-K1813 HydrophobicContact CE-CB 3.98Å; M1810-K1813 HydrophobicContact CE-CD 3.92Å; M1810-K1813 HydrophobicContact CE-CG 4.36Å; M1810-K1813 WeakPolarHBondContact O-CB 3.42Å; M1810-K1813 PolarHBondContact O-N 3.22Å; M1810-K1813 VanDerWaalsContact O-N 3.12Å; M1810-K1813 HydrophobicContact SD-CD 3.7Å; M1810-K1813 VanDerWaalsContact SD-CD 3.56Å; M1810-I1814 WeakPolarHBondContact O-CB 3.37Å; M1810-I1814 WeakPolarHBondContact O-CG1 3.25Å; M1810-I1814 PolarHBondContact O-N 3.2Å
1811	R	73.2	Confident	67.9	Low	35.4 Å²	35.4	59.6 Å²	59.6	13%	0.134	31%	0.306	C	S	.	.	H	α-helix	trans	-61.5	-41.5	178.7	-172.9	-175.8	-75.3	129.4	1.1	111.7	I1789 T1792 T1793 L1807 D1808 L1809 K1813 I1814 R1815	I1789-R1811 HydrophobicContact CG2-CG 4.47Å; T1792-R1811 PolarHBondContact O-NH2 3.49Å; T1792-R1811 PolarHBondContact OG1-NE 3.11Å; T1792-R1811 PolarHBondContact OG1-NH2 3.28Å; T1793-R1811 VanDerWaalsContact N-NH2 3.16Å; L1807-R1811 WeakPolarHBondContact O-CA 3.11Å; L1807-R1811 WeakPolarHBondContact O-CB 3.3Å; L1807-R1811 PolarHBondContact O-N 3.15Å; L1807-R1811 VanDerWaalsContact O-N 3.07Å; D1808-R1811 VanDerWaalsContact O-CB 3.28Å; D1808-R1811 WeakPolarHBondContact O-CB 3.32Å; D1808-R1811 PolarHBondContact O-N 3.16Å; D1808-R1811 VanDerWaalsContact O-N 3.08Å; D1808-R1811 IonicContact OD1-CZ 3.31Å; D1808-R1811 IonicContact OD1-NH1 2.91Å; D1808-R1811 PolarHBondContact OD1-NH1 2.96Å; D1808-R1811 IonicContact OD1-NH2 3.21Å; D1808-R1811 PolarHBondContact OD1-NH2 3.13Å; L1809-R1811 VanDerWaalsContact C-N 3.3Å; L1809-R1811 PolarHBondContact O-N 2.82Å; R1811-K1813 VanDerWaalsContact C-N 3.31Å; R1811-I1814 PolarHBondContact O-N 3.25Å; R1811-R1815 WeakPolarHBondContact O-CD 3.4Å; R1811-R1815 VanDerWaalsContact O-CG 3.3Å; R1811-R1815 WeakPolarHBondContact O-CG 3.33Å; R1811-R1815 PolarHBondContact O-N 2.81Å; R1811-R1815 VanDerWaalsContact O-N 3.09Å
1812	D	75.9	Confident	69.1	Low	93.8 Å²	93.8	55.1 Å²	55.1	50%	0.502	29%	0.287	S	S	.	.	H	α-helix	trans	-69.5	-36.5	179.2	-70.3	-27.7	0	0	0	111.8	D1808 M1810 I1814 R1815 T1816	D1808-D1812 PolarHBondContact O-N 2.55Å; M1810-D1812 VanDerWaalsContact C-N 3.27Å; M1810-D1812 PolarHBondContact O-N 3.18Å; D1812-I1814 PolarHBondContact O-N 3.02Å; D1812-R1815 WeakPolarHBondContact O-CB 3.4Å; D1812-R1815 PolarHBondContact O-N 3.21Å; D1812-R1815 WeakPolarHBondContact OD1-CD 3.42Å; D1812-R1815 IonicContact OD1-CZ 3.15Å; D1812-R1815 IonicContact OD1-NE 2.9Å; D1812-R1815 IonicContact OD1-NH1 3.58Å; D1812-R1815 PolarHBondContact OD1-NH1 3.03Å; D1812-T1816 VanDerWaalsContact O-CB 3.31Å; D1812-T1816 WeakPolarHBondContact O-CB 3.28Å; D1812-T1816 VanDerWaalsContact O-CG2 3.24Å; D1812-T1816 WeakPolarHBondContact O-CG2 3.31Å; D1812-T1816 PolarHBondContact O-N 3.04Å; D1812-T1816 PolarHBondContact O-OG1 3.11Å
1813	K	79.2	Confident	70.4	Confident	32.4 Å²	32.4	48.8 Å²	48.8	14%	0.141	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-42	171.6	-73.2	179.1	172.6	-170.1	0	113	L1575 D1576 L1809 M1810 R1811 R1815 T1816 M1817 W1847	L1575-K1813 WeakPolarHBondContact O-CE 3.3Å; L1575-K1813 PolarHBondContact O-NZ 2.97Å; D1576-K1813 IonicContact OD1-NZ 3.05Å; D1576-K1813 PolarHBondContact OD1-NZ 3.04Å; L1809-K1813 PolarHBondContact O-N 3.47Å; M1810-K1813 HydrophobicContact CE-CB 3.98Å; M1810-K1813 HydrophobicContact CE-CD 3.92Å; M1810-K1813 HydrophobicContact CE-CG 4.36Å; M1810-K1813 WeakPolarHBondContact O-CB 3.42Å; M1810-K1813 PolarHBondContact O-N 3.22Å; M1810-K1813 VanDerWaalsContact O-N 3.12Å; M1810-K1813 HydrophobicContact SD-CD 3.7Å; M1810-K1813 VanDerWaalsContact SD-CD 3.56Å; R1811-K1813 VanDerWaalsContact C-N 3.31Å; K1813-R1815 VanDerWaalsContact C-N 3.3Å; K1813-R1815 PolarHBondContact O-N 3.37Å; K1813-T1816 WeakPolarHBondContact CA-OG1 3.4Å; K1813-T1816 PolarHBondContact O-N 3.2Å; K1813-T1816 VanDerWaalsContact O-N 3.15Å; K1813-T1816 PolarHBondContact O-OG1 3.36Å; K1813-M1817 WeakPolarHBondContact O-CB 3.49Å; K1813-M1817 PolarHBondContact O-N 3.12Å; K1813-W1847 VanDerWaalsContact C-CZ3 3.5Å; K1813-W1847 HydrophobicContact CB-CD2 4.21Å; K1813-W1847 HydrophobicContact CB-CE3 3.98Å; K1813-W1847 HydrophobicContact CB-CH2 3.62Å; K1813-W1847 HydrophobicContact CB-CZ2 3.84Å; K1813-W1847 HydrophobicContact CB-CZ3 3.7Å; K1813-W1847 HydrophobicContact CD-CD2 4Å; K1813-W1847 VanDerWaalsContact CD-CE2 3.48Å; K1813-W1847 HydrophobicContact CD-CE3 4.47Å; K1813-W1847 HydrophobicContact CD-CG 4.29Å; K1813-W1847 HydrophobicContact CD-CH2 4.42Å; K1813-W1847 HydrophobicContact CD-CZ2 3.82Å; K1813-W1847 VanDerWaalsContact CE-CD1 3.49Å; K1813-W1847 HydrophobicContact CG-CD2 3.76Å; K1813-W1847 HydrophobicContact CG-CE3 3.93Å; K1813-W1847 HydrophobicContact CG-CG 4.29Å; K1813-W1847 HydrophobicContact CG-CH2 4.21Å; K1813-W1847 HydrophobicContact CG-CZ2 4.01Å; K1813-W1847 HydrophobicContact CG-CZ3 4.17Å; K1813-W1847 VanDerWaalsContact NZ-NE1 3.19Å; K1813-W1847 WeakPolarHBondContact O-CZ3 3.34Å
1814	I	79.9	Confident	71.7	Confident	1.4 Å²	1.4	43.4 Å²	43.4	1%	0.007	23%	0.229	C	C	.	.	H	α-helix	trans	-63.4	-42.6	174.3	-69	171.2	0	0	0	110.7	V1760 L1763 T1764 M1785 Y1788 I1789 M1810 R1811 D1812 T1816 M1817 Q1818	V1760-I1814 HydrophobicContact CG1-CD1 4.23Å; V1760-I1814 HydrophobicContact CG1-CG1 4.29Å; V1760-I1814 HydrophobicContact CG2-CD1 4.18Å; L1763-I1814 HydrophobicContact CD1-CD1 4.43Å; L1763-I1814 HydrophobicContact CD1-CG2 4.43Å; T1764-I1814 HydrophobicContact CG2-CG1 4.26Å; M1785-I1814 HydrophobicContact CB-CG2 4.23Å; M1785-I1814 HydrophobicContact CG-CG2 4.18Å; M1785-I1814 HydrophobicContact SD-CB 4.49Å; M1785-I1814 HydrophobicContact SD-CG2 3.75Å; M1785-I1814 VanDerWaalsContact SD-CG2 3.51Å; Y1788-I1814 HydrophobicContact CD1-CD1 3.43Å; Y1788-I1814 VanDerWaalsContact CD1-CD1 3.47Å; Y1788-I1814 HydrophobicContact CE1-CD1 3.38Å; Y1788-I1814 VanDerWaalsContact CE1-CD1 3.42Å; Y1788-I1814 HydrophobicContact CG-CD1 4.37Å; I1789-I1814 HydrophobicContact CD1-CG2 4.09Å; I1789-I1814 HydrophobicContact CG1-CG2 4.14Å; M1810-I1814 WeakPolarHBondContact O-CB 3.37Å; M1810-I1814 WeakPolarHBondContact O-CG1 3.25Å; M1810-I1814 PolarHBondContact O-N 3.2Å; R1811-I1814 PolarHBondContact O-N 3.25Å; D1812-I1814 PolarHBondContact O-N 3.02Å; I1814-T1816 VanDerWaalsContact C-N 3.33Å; I1814-T1816 PolarHBondContact O-N 3.1Å; I1814-M1817 PolarHBondContact O-N 3.25Å; I1814-Q1818 VanDerWaalsContact O-CB 3.25Å; I1814-Q1818 WeakPolarHBondContact O-CB 3.31Å; I1814-Q1818 PolarHBondContact O-N 3.09Å
1815	R	77	Confident	72.8	Confident	87 Å²	87	40.5 Å²	40.5	33%	0.328	21%	0.206	S	C	.	.	H	α-helix	trans	-61.1	-40.3	174.7	-73.5	168.2	173.5	159.7	-6.5	112.3	I1789 R1811 D1812 K1813 Q1818 R1819	I1789-R1815 HydrophobicContact CD1-CG 3.96Å; R1811-R1815 WeakPolarHBondContact O-CD 3.4Å; R1811-R1815 VanDerWaalsContact O-CG 3.3Å; R1811-R1815 WeakPolarHBondContact O-CG 3.33Å; R1811-R1815 PolarHBondContact O-N 2.81Å; R1811-R1815 VanDerWaalsContact O-N 3.09Å; D1812-R1815 WeakPolarHBondContact O-CB 3.4Å; D1812-R1815 PolarHBondContact O-N 3.21Å; D1812-R1815 WeakPolarHBondContact OD1-CD 3.42Å; D1812-R1815 IonicContact OD1-CZ 3.15Å; D1812-R1815 IonicContact OD1-NE 2.9Å; D1812-R1815 IonicContact OD1-NH1 3.58Å; D1812-R1815 PolarHBondContact OD1-NH1 3.03Å; K1813-R1815 VanDerWaalsContact C-N 3.3Å; K1813-R1815 PolarHBondContact O-N 3.37Å; R1815-Q1818 WeakPolarHBondContact O-CB 3.34Å; R1815-Q1818 PolarHBondContact O-N 3.18Å; R1815-R1819 WeakPolarHBondContact O-CG 3.41Å; R1815-R1819 PolarHBondContact O-N 2.97Å
1816	T	80	Confident	73.3	Confident	8.2 Å²	8.2	42.9 Å²	42.9	5%	0.05	21%	0.214	C	C	.	.	H	α-helix	trans	-68	-44	178.6	-33.1	0	0	0	0	111.1	D1812 K1813 I1814 Q1818 R1819 F1820 D1845 W1847 I1848	D1812-T1816 VanDerWaalsContact O-CB 3.31Å; D1812-T1816 WeakPolarHBondContact O-CB 3.28Å; D1812-T1816 VanDerWaalsContact O-CG2 3.24Å; D1812-T1816 WeakPolarHBondContact O-CG2 3.31Å; D1812-T1816 PolarHBondContact O-N 3.04Å; D1812-T1816 PolarHBondContact O-OG1 3.11Å; K1813-T1816 WeakPolarHBondContact CA-OG1 3.4Å; K1813-T1816 PolarHBondContact O-N 3.2Å; K1813-T1816 VanDerWaalsContact O-N 3.15Å; K1813-T1816 PolarHBondContact O-OG1 3.36Å; I1814-T1816 VanDerWaalsContact C-N 3.33Å; I1814-T1816 PolarHBondContact O-N 3.1Å; T1816-Q1818 VanDerWaalsContact C-N 3.32Å; T1816-Q1818 PolarHBondContact O-N 3.16Å; T1816-R1819 PolarHBondContact O-N 3.02Å; T1816-R1819 PolarHBondContact OG1-NH1 3.08Å; T1816-F1820 WeakPolarHBondContact O-CB 3.5Å; T1816-F1820 PolarHBondContact O-N 3.11Å; T1816-F1820 VanDerWaalsContact O-N 3.11Å; T1816-D1845 WeakPolarHBondContact CB-OD2 3.37Å; T1816-D1845 HydrophobicContact CG2-CB 3.9Å; T1816-D1845 VanDerWaalsContact CG2-CB 3.46Å; T1816-D1845 VanDerWaalsContact CG2-CG 3.48Å; T1816-D1845 WeakPolarHBondContact CG2-OD1 3.46Å; T1816-D1845 WeakPolarHBondContact CG2-OD2 3.29Å; T1816-D1845 PolarHBondContact OG1-OD2 2.92Å; T1816-W1847 HydrophobicContact CG2-CE3 4.05Å; T1816-W1847 HydrophobicContact CG2-CZ3 4.27Å; T1816-W1847 VanDerWaalsContact OG1-CE3 3.31Å; T1816-W1847 WeakPolarHBondContact OG1-CZ3 3.16Å; T1816-I1848 HydrophobicContact CG2-CD1 3.54Å; T1816-I1848 VanDerWaalsContact CG2-CD1 3.45Å; T1816-I1848 HydrophobicContact CG2-CG1 3.57Å; T1816-I1848 VanDerWaalsContact CG2-CG1 3.44Å; T1816-I1848 WeakPolarHBondContact O-CD1 3.13Å
1817	M	82.8	Confident	74	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-60.9	-40.6	171.8	-173.5	60.1	76.2	0	0	111.9	T1764 L1769 M1785 K1813 I1814 R1819 F1820 L1821 F1835 W1847 I1851	T1764-M1817 WeakPolarHBondContact O-CE 3.4Å; L1769-M1817 HydrophobicContact CD1-CE 4.09Å; L1769-M1817 HydrophobicContact CD1-CG 3.85Å; L1769-M1817 HydrophobicContact CD1-SD 3.6Å; L1769-M1817 VanDerWaalsContact CD1-SD 3.54Å; M1785-M1817 HydrophobicContact CE-CB 4.22Å; M1785-M1817 HydrophobicContact CE-CG 4.04Å; K1813-M1817 WeakPolarHBondContact O-CB 3.49Å; K1813-M1817 PolarHBondContact O-N 3.12Å; I1814-M1817 PolarHBondContact O-N 3.25Å; M1817-R1819 PolarHBondContact O-N 3.29Å; M1817-F1820 WeakPolarHBondContact O-CB 3.35Å; M1817-F1820 PolarHBondContact O-N 3.28Å; M1817-F1820 HydrophobicContact SD-CD1 4.19Å; M1817-L1821 HydrophobicContact CG-CD1 4.16Å; M1817-L1821 HydrophobicContact CG-CG 4.43Å; M1817-L1821 WeakPolarHBondContact O-CB 3.31Å; M1817-L1821 VanDerWaalsContact O-CG 3.29Å; M1817-L1821 WeakPolarHBondContact O-CG 3.36Å; M1817-L1821 PolarHBondContact O-N 3.04Å; M1817-L1821 HydrophobicContact SD-CG 4.42Å; M1817-F1835 HydrophobicContact CE-CZ 4.13Å; M1817-F1835 HydrophobicContact SD-CE2 4.35Å; M1817-F1835 HydrophobicContact SD-CZ 3.89Å; M1817-W1847 HydrophobicContact CB-CH2 4.39Å; M1817-W1847 HydrophobicContact CB-CZ3 4.21Å; M1817-W1847 HydrophobicContact CE-CH2 4.29Å; M1817-W1847 HydrophobicContact CE-CZ3 4.31Å; M1817-I1851 HydrophobicContact CE-CD1 3.82Å
1818	Q	78.6	Confident	74.6	Confident	23.6 Å²	23.6	43.8 Å²	43.8	11%	0.11	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-43.7	176.4	-173.5	-173.6	11.2	0	0	111.9	L1782 M1785 N1786 I1789 I1814 R1815 T1816 F1820 L1821 A1822	L1782-Q1818 HydrophobicContact CD2-CG 4Å; M1785-Q1818 HydrophobicContact CB-CG 4.37Å; M1785-Q1818 HydrophobicContact SD-CB 3.87Å; M1785-Q1818 HydrophobicContact SD-CG 4.31Å; N1786-Q1818 PolarHBondContact ND2-NE2 3.04Å; N1786-Q1818 PolarHBondContact OD1-NE2 3.34Å; I1789-Q1818 VanDerWaalsContact CD1-OE1 3.24Å; I1814-Q1818 VanDerWaalsContact O-CB 3.25Å; I1814-Q1818 WeakPolarHBondContact O-CB 3.31Å; I1814-Q1818 PolarHBondContact O-N 3.09Å; R1815-Q1818 WeakPolarHBondContact O-CB 3.34Å; R1815-Q1818 PolarHBondContact O-N 3.18Å; T1816-Q1818 VanDerWaalsContact C-N 3.32Å; T1816-Q1818 PolarHBondContact O-N 3.16Å; Q1818-F1820 VanDerWaalsContact C-N 3.35Å; Q1818-L1821 PolarHBondContact O-N 3.31Å; Q1818-A1822 VanDerWaalsContact O-CB 3.25Å; Q1818-A1822 WeakPolarHBondContact O-CB 3.38Å; Q1818-A1822 PolarHBondContact O-N 3.06Å
1819	R	74.5	Confident	75.1	Confident	134.2 Å²	134.2	44.8 Å²	44.8	51%	0.506	22%	0.215	S	C	.	.	H	α-helix	trans	-61.8	-45.2	174.4	-71.1	175	-164.2	136.3	-1	111.4	R1815 T1816 M1817 L1821 A1822 S1823	R1815-R1819 WeakPolarHBondContact O-CG 3.41Å; R1815-R1819 PolarHBondContact O-N 2.97Å; T1816-R1819 PolarHBondContact O-N 3.02Å; T1816-R1819 PolarHBondContact OG1-NH1 3.08Å; M1817-R1819 PolarHBondContact O-N 3.29Å; R1819-L1821 VanDerWaalsContact C-N 3.33Å; R1819-L1821 PolarHBondContact O-N 3.16Å; R1819-A1822 PolarHBondContact O-N 3.29Å; R1819-S1823 WeakPolarHBondContact O-CB 3.4Å; R1819-S1823 PolarHBondContact O-N 2.93Å; R1819-S1823 PolarHBondContact O-OG 2.91Å; R1819-S1823 VanDerWaalsContact O-OG 3.12Å
1820	F	80.5	Confident	75.5	Confident	0.8 Å²	0.8	46.8 Å²	46.8	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-59.4	-47.3	177.4	175.4	-99.6	0	0	0	112.2	T1816 M1817 Q1818 A1822 S1823 N1824 L1828 F1835 L1838 A1839 Q1842 I1848	T1816-F1820 WeakPolarHBondContact O-CB 3.5Å; T1816-F1820 PolarHBondContact O-N 3.11Å; T1816-F1820 VanDerWaalsContact O-N 3.11Å; M1817-F1820 WeakPolarHBondContact O-CB 3.35Å; M1817-F1820 PolarHBondContact O-N 3.28Å; M1817-F1820 HydrophobicContact SD-CD1 4.19Å; Q1818-F1820 VanDerWaalsContact C-N 3.35Å; F1820-A1822 PolarHBondContact O-N 2.96Å; F1820-S1823 PolarHBondContact O-N 3.5Å; F1820-S1823 PolarHBondContact O-OG 3.09Å; F1820-S1823 VanDerWaalsContact O-OG 3.12Å; F1820-N1824 VanDerWaalsContact CD2-ND2 3.34Å; F1820-N1824 WeakPolarHBondContact CD2-ND2 3.29Å; F1820-N1824 VanDerWaalsContact CE2-ND2 3.29Å; F1820-N1824 WeakPolarHBondContact CE2-ND2 3.38Å; F1820-N1824 WeakPolarHBondContact O-CB 3.43Å; F1820-N1824 PolarHBondContact O-N 3.36Å; F1820-N1824 VanDerWaalsContact O-N 3.13Å; F1820-N1824 PolarHBondContact O-ND2 3.15Å; F1820-N1824 VanDerWaalsContact O-ND2 3.15Å; F1820-L1828 HydrophobicContact CE1-CD1 4.32Å; F1820-F1835 AromaticContact CD1-CE2 3.84Å; F1820-F1835 HydrophobicContact CD1-CE2 4.04Å; F1820-F1835 AromaticContact CD1-CZ 3.99Å; F1820-F1835 HydrophobicContact CD1-CZ 4.12Å; F1820-F1835 HydrophobicContact CE1-CD1 4.33Å; F1820-F1835 AromaticContact CE1-CD2 3.84Å; F1820-F1835 HydrophobicContact CE1-CD2 3.84Å; F1820-F1835 AromaticContact CE1-CE1 3.89Å; F1820-F1835 HydrophobicContact CE1-CE1 4.19Å; F1820-F1835 AromaticContact CE1-CE2 3.49Å; F1820-F1835 HydrophobicContact CE1-CE2 3.49Å; F1820-F1835 VanDerWaalsContact CE1-CE2 3.42Å; F1820-F1835 HydrophobicContact CE1-CG 4.34Å; F1820-F1835 AromaticContact CE1-CZ 3.67Å; F1820-F1835 HydrophobicContact CE1-CZ 3.67Å; F1820-F1835 HydrophobicContact CZ-CD1 4.5Å; F1820-F1835 HydrophobicContact CZ-CD2 4.41Å; F1820-F1835 HydrophobicContact CZ-CE1 4.39Å; F1820-F1835 HydrophobicContact CZ-CE2 4.29Å; F1820-F1835 HydrophobicContact CZ-CZ 4.46Å; F1820-L1838 HydrophobicContact CE2-CB 4.13Å; F1820-L1838 HydrophobicContact CZ-CB 3.84Å; F1820-A1839 HydrophobicContact CE1-CB 4.4Å; F1820-A1839 HydrophobicContact CE2-CB 4.11Å; F1820-A1839 HydrophobicContact CZ-CB 3.9Å; F1820-Q1842 HydrophobicContact CD2-CB 4.37Å; F1820-Q1842 HydrophobicContact CD2-CG 4.18Å; F1820-Q1842 HydrophobicContact CE2-CB 4.37Å; F1820-Q1842 HydrophobicContact CE2-CG 4.49Å; F1820-Q1842 VanDerWaalsContact CE2-OE1 3.32Å; F1820-I1848 HydrophobicContact CB-CD1 3.71Å; F1820-I1848 HydrophobicContact CB-CG1 4.4Å; F1820-I1848 HydrophobicContact CD1-CD1 4.43Å; F1820-I1848 HydrophobicContact CD2-CD1 4.37Å; F1820-I1848 HydrophobicContact CD2-CG2 3.73Å; F1820-I1848 HydrophobicContact CE2-CG2 4.04Å; F1820-I1848 HydrophobicContact CG-CD1 4.21Å; F1820-I1848 HydrophobicContact CG-CG2 4.14Å; F1820-I1848 HydrophobicContact CZ-CG2 4.47Å
1821	L	78.7	Confident	75.8	Confident	4.4 Å²	4.4	51 Å²	51	2%	0.023	24%	0.239	C	C	.	.	H	α-helix	trans	-64.3	-45.6	176.5	-71.8	172.9	0	0	0	110.9	L1769 I1773 L1781 L1782 M1785 M1817 Q1818 R1819 S1823 N1824 Y1825 L1828 F1835	L1769-L1821 HydrophobicContact CD1-CD1 4.08Å; L1769-L1821 HydrophobicContact CD1-CD2 4.42Å; L1769-L1821 HydrophobicContact CD1-CG 4.45Å; L1769-L1821 HydrophobicContact CD2-CD1 3.91Å; L1769-L1821 HydrophobicContact CG-CD1 4.47Å; I1773-L1821 HydrophobicContact CD1-CD2 4.25Å; L1781-L1821 HydrophobicContact CD2-CD1 3.94Å; L1782-L1821 HydrophobicContact CD2-CB 4.11Å; M1785-L1821 HydrophobicContact CE-CD1 3.95Å; M1785-L1821 HydrophobicContact SD-CD1 4.31Å; M1817-L1821 HydrophobicContact CG-CD1 4.16Å; M1817-L1821 HydrophobicContact CG-CG 4.43Å; M1817-L1821 WeakPolarHBondContact O-CB 3.31Å; M1817-L1821 VanDerWaalsContact O-CG 3.29Å; M1817-L1821 WeakPolarHBondContact O-CG 3.36Å; M1817-L1821 PolarHBondContact O-N 3.04Å; M1817-L1821 HydrophobicContact SD-CG 4.42Å; Q1818-L1821 PolarHBondContact O-N 3.31Å; R1819-L1821 VanDerWaalsContact C-N 3.33Å; R1819-L1821 PolarHBondContact O-N 3.16Å; L1821-S1823 VanDerWaalsContact C-N 3.31Å; L1821-S1823 PolarHBondContact O-N 2.99Å; L1821-N1824 CarbonylContact O-C 3.54Å; L1821-N1824 PolarHBondContact O-N 3.08Å; L1821-Y1825 VanDerWaalsContact O-CA 3.25Å; L1821-Y1825 WeakPolarHBondContact O-CA 3.45Å; L1821-Y1825 VanDerWaalsContact O-CB 3.24Å; L1821-Y1825 WeakPolarHBondContact O-CB 3.36Å; L1821-Y1825 PolarHBondContact O-N 3.03Å; L1821-L1828 HydrophobicContact CD2-CD1 3.86Å; L1821-F1835 HydrophobicContact CD2-CE2 4.16Å
1822	A	71.6	Confident	76	Confident	37 Å²	37	50.1 Å²	50.1	31%	0.306	24%	0.237	S	C	.	.	H	α-helix	trans	-62.4	-37.6	179.4	0	0	0	0	0	112.9	Q1818 R1819 F1820 L1939	Q1818-A1822 VanDerWaalsContact O-CB 3.25Å; Q1818-A1822 WeakPolarHBondContact O-CB 3.38Å; Q1818-A1822 PolarHBondContact O-N 3.06Å; R1819-A1822 PolarHBondContact O-N 3.29Å; F1820-A1822 PolarHBondContact O-N 2.96Å; A1822-L1939 HydrophobicContact CB-CD1 4.38Å
1823	S	70.9	Confident	76.1	Confident	40 Å²	40	53.2 Å²	53.2	28%	0.28	24%	0.243	S	C	.	.	H	α-helix	trans	-72.7	-32.5	177.4	59.5	0	0	0	0	113.4	R1819 F1820 L1821 Q1842	R1819-S1823 WeakPolarHBondContact O-CB 3.4Å; R1819-S1823 PolarHBondContact O-N 2.93Å; R1819-S1823 PolarHBondContact O-OG 2.91Å; R1819-S1823 VanDerWaalsContact O-OG 3.12Å; F1820-S1823 PolarHBondContact O-N 3.5Å; F1820-S1823 PolarHBondContact O-OG 3.09Å; F1820-S1823 VanDerWaalsContact O-OG 3.12Å; L1821-S1823 VanDerWaalsContact C-N 3.31Å; L1821-S1823 PolarHBondContact O-N 2.99Å; S1823-Q1842 PolarHBondContact OG-NE2 2.95Å; S1823-Q1842 VanDerWaalsContact OG-NE2 3.12Å
1824	N	74.8	Confident	76.1	Confident	21.8 Å²	21.8	52.7 Å²	52.7	12%	0.117	24%	0.244	C	C	.	.	H	α-helix	trans	-108.9	4	-173.7	-62.5	-67.6	0	0	0	114.3	F1820 L1821 E1826 F1827 L1828 L1838 Q1842	F1820-N1824 VanDerWaalsContact CD2-ND2 3.34Å; F1820-N1824 WeakPolarHBondContact CD2-ND2 3.29Å; F1820-N1824 VanDerWaalsContact CE2-ND2 3.29Å; F1820-N1824 WeakPolarHBondContact CE2-ND2 3.38Å; F1820-N1824 WeakPolarHBondContact O-CB 3.43Å; F1820-N1824 PolarHBondContact O-N 3.36Å; F1820-N1824 VanDerWaalsContact O-N 3.13Å; F1820-N1824 PolarHBondContact O-ND2 3.15Å; F1820-N1824 VanDerWaalsContact O-ND2 3.15Å; L1821-N1824 CarbonylContact O-C 3.54Å; L1821-N1824 PolarHBondContact O-N 3.08Å; N1824-E1826 VanDerWaalsContact C-N 3.31Å; N1824-E1826 PolarHBondContact O-N 3.15Å; N1824-E1826 VanDerWaalsContact O-N 3.16Å; N1824-F1827 PolarHBondContact O-N 3.1Å; N1824-F1827 VanDerWaalsContact O-N 3.1Å; N1824-L1828 HydrophobicContact CB-CD1 3.97Å; N1824-L1828 HydrophobicContact CB-CG 4.15Å; N1824-L1828 WeakPolarHBondContact O-CG 3.41Å; N1824-L1828 PolarHBondContact O-N 3.05Å; N1824-L1838 HydrophobicContact CB-CD1 3.94Å; N1824-Q1842 PolarHBondContact ND2-OE1 3.05Å
1825	Y	73.1	Confident	76.3	Confident	36.4 Å²	36.4	52.8 Å²	52.8	14%	0.143	24%	0.244	C	C	.	.	H	α-helix	trans	-54.1	-48.9	-165.9	-172.5	-118.9	0	0	0	113.3	I1773 G1778 L1779 L1782 L1821 F1827 L1828 I1829	I1773-Y1825 HydrophobicContact CG1-CE2 4.45Å; G1778-Y1825 VanDerWaalsContact C-OH 3.27Å; G1778-Y1825 WeakPolarHBondContact CA-OH 3.29Å; L1779-Y1825 HydrophobicContact CD1-CE1 4.45Å; L1779-Y1825 HydrophobicContact CD2-CD1 4.2Å; L1779-Y1825 HydrophobicContact CD2-CE1 3.66Å; L1779-Y1825 VanDerWaalsContact CD2-CE1 3.48Å; L1779-Y1825 HydrophobicContact CG-CE1 3.82Å; L1779-Y1825 PolarHBondContact N-OH 2.98Å; L1779-Y1825 VanDerWaalsContact N-OH 3.12Å; L1782-Y1825 HydrophobicContact CD1-CD2 4.24Å; L1782-Y1825 HydrophobicContact CD1-CG 4.33Å; L1821-Y1825 VanDerWaalsContact O-CA 3.25Å; L1821-Y1825 WeakPolarHBondContact O-CA 3.45Å; L1821-Y1825 VanDerWaalsContact O-CB 3.24Å; L1821-Y1825 WeakPolarHBondContact O-CB 3.36Å; L1821-Y1825 PolarHBondContact O-N 3.03Å; Y1825-F1827 VanDerWaalsContact C-N 3.3Å; Y1825-F1827 PolarHBondContact O-N 3.12Å; Y1825-L1828 PolarHBondContact O-N 2.98Å; Y1825-I1829 HydrophobicContact CD1-CD1 3.6Å; Y1825-I1829 HydrophobicContact CD1-CG1 4.44Å; Y1825-I1829 HydrophobicContact CD2-CD1 4.42Å; Y1825-I1829 HydrophobicContact CD2-CG1 4.28Å; Y1825-I1829 HydrophobicContact CE1-CD1 3.18Å; Y1825-I1829 HydrophobicContact CE1-CG1 4.03Å; Y1825-I1829 HydrophobicContact CE2-CD1 4.11Å; Y1825-I1829 HydrophobicContact CE2-CG1 4.05Å; Y1825-I1829 HydrophobicContact CG-CD1 4.21Å; Y1825-I1829 HydrophobicContact CG-CG1 4.48Å; Y1825-I1829 VanDerWaalsContact CZ-CD1 3.45Å; Y1825-I1829 VanDerWaalsContact O-CG1 3.28Å; Y1825-I1829 WeakPolarHBondContact O-CG1 3.38Å; Y1825-I1829 PolarHBondContact O-N 2.92Å
1826	E	67.3	Low	76.4	Confident	98.8 Å²	98.8	49.2 Å²	49.2	46%	0.462	23%	0.233	S	C	.	.	H	α-helix	trans	-63	-34.5	-179	-82.2	-170.5	162.3	0	0	113.3	N1824 I1829 K1830 K1898	N1824-E1826 VanDerWaalsContact C-N 3.31Å; N1824-E1826 PolarHBondContact O-N 3.15Å; N1824-E1826 VanDerWaalsContact O-N 3.16Å; E1826-I1829 PolarHBondContact O-N 3.21Å; E1826-K1830 PolarHBondContact O-N 3.12Å; E1826-K1830 IonicContact OE1-NZ 2.69Å; E1826-K1830 PolarHBondContact OE1-NZ 2.87Å; E1826-K1898 WeakPolarHBondContact OE1-CD 3.31Å; E1826-K1898 VanDerWaalsContact OE1-CE 3.27Å; E1826-K1898 WeakPolarHBondContact OE1-CE 3.37Å; E1826-K1898 WeakPolarHBondContact OE1-CG 3.42Å; E1826-K1898 IonicContact OE1-NZ 3.24Å; E1826-K1898 PolarHBondContact OE1-NZ 3.39Å; E1826-K1898 WeakPolarHBondContact OE2-CE 3.32Å; E1826-K1898 IonicContact OE2-NZ 3.59Å; E1826-K1898 PolarHBondContact OE2-NZ 2.88Å
1827	F	73.8	Confident	76.3	Confident	92.6 Å²	92.6	51.9 Å²	51.9	41%	0.406	25%	0.245	S	C	.	.	H	α-helix	trans	-74.3	-43.9	177.2	-172.9	-87.5	0	0	0	110.5	N1824 Y1825 I1829 K1830 H1831 L1838	N1824-F1827 PolarHBondContact O-N 3.1Å; N1824-F1827 VanDerWaalsContact O-N 3.1Å; Y1825-F1827 VanDerWaalsContact C-N 3.3Å; Y1825-F1827 PolarHBondContact O-N 3.12Å; F1827-I1829 VanDerWaalsContact C-N 3.3Å; F1827-I1829 PolarHBondContact O-N 2.95Å; F1827-K1830 PolarHBondContact O-N 3.23Å; F1827-K1830 VanDerWaalsContact O-N 3.11Å; F1827-H1831 HydrophobicContact CD1-CB 4.35Å; F1827-H1831 HydrophobicContact CE1-CB 3.97Å; F1827-H1831 AromaticContact CE1-CD2 3.97Å; F1827-H1831 AromaticContact CE2-CD2 3.91Å; F1827-H1831 HydrophobicContact CZ-CB 4.23Å; F1827-H1831 AromaticContact CZ-CD2 3.8Å; F1827-H1831 PolarHBondContact O-N 2.83Å; F1827-L1838 HydrophobicContact CB-CD1 4.31Å; F1827-L1838 HydrophobicContact CD1-CD1 3.47Å; F1827-L1838 HydrophobicContact CD1-CD2 4.36Å; F1827-L1838 HydrophobicContact CD1-CG 4.24Å; F1827-L1838 HydrophobicContact CE1-CD1 3.96Å; F1827-L1838 HydrophobicContact CE1-CD2 4.25Å; F1827-L1838 HydrophobicContact CE1-CG 4.22Å; F1827-L1838 HydrophobicContact CG-CD1 4.34Å
1828	L	74.9	Confident	76.2	Confident	0.6 Å²	0.6	53.4 Å²	53.4	0%	0.003	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-31.6	178.1	-68.8	172.2	0	0	0	112.8	I1773 F1820 L1821 N1824 Y1825 K1830 H1831 P1832 F1835 L1838	I1773-L1828 HydrophobicContact CD1-CB 4.13Å; I1773-L1828 HydrophobicContact CD1-CD1 4.35Å; I1773-L1828 WeakPolarHBondContact CG2-O 3.46Å; F1820-L1828 HydrophobicContact CE1-CD1 4.32Å; L1821-L1828 HydrophobicContact CD2-CD1 3.86Å; N1824-L1828 HydrophobicContact CB-CD1 3.97Å; N1824-L1828 HydrophobicContact CB-CG 4.15Å; N1824-L1828 WeakPolarHBondContact O-CG 3.41Å; N1824-L1828 PolarHBondContact O-N 3.05Å; Y1825-L1828 PolarHBondContact O-N 2.98Å; L1828-K1830 VanDerWaalsContact C-N 3.29Å; L1828-K1830 PolarHBondContact O-N 3.03Å; L1828-H1831 CarbonylContact O-C 3.42Å; L1828-P1832 VanDerWaalsContact O-CA 3.26Å; L1828-P1832 WeakPolarHBondContact O-CA 3.46Å; L1828-P1832 WeakPolarHBondContact O-CB 3.36Å; L1828-P1832 VanDerWaalsContact O-CD 3.31Å; L1828-P1832 WeakPolarHBondContact O-CD 3.32Å; L1828-P1832 VanDerWaalsContact O-CG 3.29Å; L1828-P1832 WeakPolarHBondContact O-CG 3.29Å; L1828-P1832 VanDerWaalsContact O-N 3.08Å; L1828-F1835 HydrophobicContact CD1-CD2 4.26Å; L1828-F1835 HydrophobicContact CD2-CB 3.97Å; L1828-F1835 HydrophobicContact CD2-CD2 4.18Å; L1828-F1835 HydrophobicContact CD2-CG 4.42Å; L1828-L1838 HydrophobicContact CD2-CD1 3.75Å; L1828-L1838 HydrophobicContact CG-CD1 4.07Å
1829	I	74.7	Confident	76.3	Confident	71.2 Å²	71.2	52.3 Å²	52.3	37%	0.365	25%	0.248	S	C	.	.	H	α-helix	trans	-60.6	-40.4	171.5	-70	161.3	0	0	0	111.4	I1773 Y1825 E1826 F1827	I1773-I1829 HydrophobicContact CG2-CB 4.49Å; I1773-I1829 HydrophobicContact CG2-CG1 4.25Å; Y1825-I1829 HydrophobicContact CD1-CD1 3.6Å; Y1825-I1829 HydrophobicContact CD1-CG1 4.44Å; Y1825-I1829 HydrophobicContact CD2-CD1 4.42Å; Y1825-I1829 HydrophobicContact CD2-CG1 4.28Å; Y1825-I1829 HydrophobicContact CE1-CD1 3.18Å; Y1825-I1829 HydrophobicContact CE1-CG1 4.03Å; Y1825-I1829 HydrophobicContact CE2-CD1 4.11Å; Y1825-I1829 HydrophobicContact CE2-CG1 4.05Å; Y1825-I1829 HydrophobicContact CG-CD1 4.21Å; Y1825-I1829 HydrophobicContact CG-CG1 4.48Å; Y1825-I1829 VanDerWaalsContact CZ-CD1 3.45Å; Y1825-I1829 VanDerWaalsContact O-CG1 3.28Å; Y1825-I1829 WeakPolarHBondContact O-CG1 3.38Å; Y1825-I1829 PolarHBondContact O-N 2.92Å; E1826-I1829 PolarHBondContact O-N 3.21Å; F1827-I1829 VanDerWaalsContact C-N 3.3Å; F1827-I1829 PolarHBondContact O-N 2.95Å
1830	K	73	Confident	76.4	Confident	151 Å²	151	46.9 Å²	46.9	66%	0.657	23%	0.229	S	C	*	.	H	α-helix	trans	-81.7	-36.6	-178.1	-66.6	177.4	-177.7	173	0	112.3	E1826 F1827 L1828	E1826-K1830 PolarHBondContact O-N 3.12Å; E1826-K1830 IonicContact OE1-NZ 2.69Å; E1826-K1830 PolarHBondContact OE1-NZ 2.87Å; F1827-K1830 PolarHBondContact O-N 3.23Å; F1827-K1830 VanDerWaalsContact O-N 3.11Å; L1828-K1830 VanDerWaalsContact C-N 3.29Å; L1828-K1830 PolarHBondContact O-N 3.03Å
1831	H	78	Confident	75.9	Confident	99.8 Å²	99.8	50.5 Å²	50.5	46%	0.462	25%	0.248	S	C	.	.			trans	-135.8	73	-175	-57.7	-57.7	0	0	0	110.9	F1827 L1828 Y1833 S1834	F1827-H1831 HydrophobicContact CD1-CB 4.35Å; F1827-H1831 HydrophobicContact CE1-CB 3.97Å; F1827-H1831 AromaticContact CE1-CD2 3.97Å; F1827-H1831 AromaticContact CE2-CD2 3.91Å; F1827-H1831 HydrophobicContact CZ-CB 4.23Å; F1827-H1831 AromaticContact CZ-CD2 3.8Å; F1827-H1831 PolarHBondContact O-N 2.83Å; L1828-H1831 CarbonylContact O-C 3.42Å; H1831-Y1833 VanDerWaalsContact C-N 3.29Å; H1831-Y1833 PolarHBondContact O-N 3.12Å; H1831-Y1833 VanDerWaalsContact O-N 3.15Å; H1831-S1834 PolarHBondContact O-N 2.9Å; H1831-S1834 VanDerWaalsContact O-N 3.14Å
1832	P	77	Confident	75.5	Confident	15.8 Å²	15.8	51.3 Å²	51.3	10%	0.103	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-61.3	-34.7	-174.1	-4.5	6.4	0	0	0	113.2	I1770 I1773 E1774 L1828 S1834 F1835	I1770-P1832 HydrophobicContact CG2-CB 3.97Å; I1773-P1832 HydrophobicContact CG2-CB 4.46Å; E1774-P1832 HydrophobicContact CG-CB 4.14Å; E1774-P1832 HydrophobicContact CG-CG 3.88Å; L1828-P1832 VanDerWaalsContact O-CA 3.26Å; L1828-P1832 WeakPolarHBondContact O-CA 3.46Å; L1828-P1832 WeakPolarHBondContact O-CB 3.36Å; L1828-P1832 VanDerWaalsContact O-CD 3.31Å; L1828-P1832 WeakPolarHBondContact O-CD 3.32Å; L1828-P1832 VanDerWaalsContact O-CG 3.29Å; L1828-P1832 WeakPolarHBondContact O-CG 3.29Å; L1828-P1832 VanDerWaalsContact O-N 3.08Å; P1832-S1834 VanDerWaalsContact C-N 3.3Å; P1832-S1834 PolarHBondContact O-N 3.25Å; P1832-F1835 WeakPolarHBondContact O-CB 3.32Å; P1832-F1835 PolarHBondContact O-N 3.13Å
1833	Y	78.1	Confident	74.9	Confident	158.6 Å²	158.6	55.3 Å²	55.3	62%	0.622	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-70.3	-17.2	-178.6	-61	-76.1	0	0	0	114.5	I1770 E1774 H1831 F1835 F1873	I1770-Y1833 HydrophobicContact CG2-CE1 4.46Å; E1774-Y1833 VanDerWaalsContact OE1-CE2 3.24Å; E1774-Y1833 WeakPolarHBondContact OE1-CE2 3.3Å; E1774-Y1833 VanDerWaalsContact OE1-CZ 3.23Å; E1774-Y1833 PolarHBondContact OE1-OH 3.15Å; H1831-Y1833 VanDerWaalsContact C-N 3.29Å; H1831-Y1833 PolarHBondContact O-N 3.12Å; H1831-Y1833 VanDerWaalsContact O-N 3.15Å; Y1833-F1835 PolarHBondContact O-N 3.12Å; Y1833-F1873 VanDerWaalsContact CB-CE1 3.44Å; Y1833-F1873 HydrophobicContact CD1-CZ 4.24Å; Y1833-F1873 HydrophobicContact CD2-CE1 4.35Å; Y1833-F1873 HydrophobicContact CD2-CZ 4.03Å; Y1833-F1873 HydrophobicContact CG-CE1 4Å; Y1833-F1873 AromaticContact CG-CZ 3.71Å; Y1833-F1873 HydrophobicContact CG-CZ 3.71Å
1834	S	79.7	Confident	74.4	Confident	23.2 Å²	23.2	57.3 Å²	57.3	16%	0.162	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-78.8	7.7	175.3	-69.8	0	0	0	0	113.3	H1831 P1832 A1836 E1837 L1838	H1831-S1834 PolarHBondContact O-N 2.9Å; H1831-S1834 VanDerWaalsContact O-N 3.14Å; P1832-S1834 VanDerWaalsContact C-N 3.3Å; P1832-S1834 PolarHBondContact O-N 3.25Å; S1834-A1836 VanDerWaalsContact C-N 3.31Å; S1834-A1836 PolarHBondContact O-N 3.08Å; S1834-E1837 WeakPolarHBondContact CA-OE2 3.38Å; S1834-E1837 VanDerWaalsContact CB-OE2 3.28Å; S1834-E1837 WeakPolarHBondContact CB-OE2 3.43Å; S1834-E1837 PolarHBondContact O-N 3.02Å; S1834-E1837 VanDerWaalsContact O-N 3.09Å; S1834-E1837 PolarHBondContact OG-OE2 3.25Å; S1834-L1838 WeakPolarHBondContact O-CG 3.39Å; S1834-L1838 PolarHBondContact O-N 2.94Å
1835	F	83.5	Confident	74.2	Confident	2.2 Å²	2.2	58.9 Å²	58.9	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-49.6	-47.2	173.2	-175.3	-76.1	0	0	0	112.5	P1766 L1769 I1770 M1817 F1820 L1821 L1828 P1832 Y1833 E1837 L1838 A1839 I1851	P1766-F1835 HydrophobicContact CB-CD1 3.83Å; P1766-F1835 HydrophobicContact CB-CE1 3.63Å; P1766-F1835 HydrophobicContact CB-CE2 4.42Å; P1766-F1835 HydrophobicContact CB-CG 4.35Å; P1766-F1835 HydrophobicContact CB-CZ 4.06Å; P1766-F1835 HydrophobicContact CG-CD1 4.15Å; P1766-F1835 HydrophobicContact CG-CE1 3.48Å; P1766-F1835 VanDerWaalsContact CG-CE1 3.42Å; P1766-F1835 HydrophobicContact CG-CZ 3.91Å; L1769-F1835 HydrophobicContact CB-CE2 4.26Å; L1769-F1835 HydrophobicContact CD1-CE2 4.16Å; L1769-F1835 HydrophobicContact CD1-CZ 4.27Å; I1770-F1835 HydrophobicContact CD1-CB 3.93Å; I1770-F1835 HydrophobicContact CD1-CG 4.22Å; I1770-F1835 HydrophobicContact CG1-CB 4.21Å; I1770-F1835 HydrophobicContact CG1-CD2 4.14Å; I1770-F1835 HydrophobicContact CG1-CG 4.26Å; M1817-F1835 HydrophobicContact CE-CZ 4.13Å; M1817-F1835 HydrophobicContact SD-CE2 4.35Å; M1817-F1835 HydrophobicContact SD-CZ 3.89Å; F1820-F1835 AromaticContact CD1-CE2 3.84Å; F1820-F1835 HydrophobicContact CD1-CE2 4.04Å; F1820-F1835 AromaticContact CD1-CZ 3.99Å; F1820-F1835 HydrophobicContact CD1-CZ 4.12Å; F1820-F1835 HydrophobicContact CE1-CD1 4.33Å; F1820-F1835 AromaticContact CE1-CD2 3.84Å; F1820-F1835 HydrophobicContact CE1-CD2 3.84Å; F1820-F1835 AromaticContact CE1-CE1 3.89Å; F1820-F1835 HydrophobicContact CE1-CE1 4.19Å; F1820-F1835 AromaticContact CE1-CE2 3.49Å; F1820-F1835 HydrophobicContact CE1-CE2 3.49Å; F1820-F1835 VanDerWaalsContact CE1-CE2 3.42Å; F1820-F1835 HydrophobicContact CE1-CG 4.34Å; F1820-F1835 AromaticContact CE1-CZ 3.67Å; F1820-F1835 HydrophobicContact CE1-CZ 3.67Å; F1820-F1835 HydrophobicContact CZ-CD1 4.5Å; F1820-F1835 HydrophobicContact CZ-CD2 4.41Å; F1820-F1835 HydrophobicContact CZ-CE1 4.39Å; F1820-F1835 HydrophobicContact CZ-CE2 4.29Å; F1820-F1835 HydrophobicContact CZ-CZ 4.46Å; L1821-F1835 HydrophobicContact CD2-CE2 4.16Å; L1828-F1835 HydrophobicContact CD1-CD2 4.26Å; L1828-F1835 HydrophobicContact CD2-CB 3.97Å; L1828-F1835 HydrophobicContact CD2-CD2 4.18Å; L1828-F1835 HydrophobicContact CD2-CG 4.42Å; P1832-F1835 WeakPolarHBondContact O-CB 3.32Å; P1832-F1835 PolarHBondContact O-N 3.13Å; Y1833-F1835 PolarHBondContact O-N 3.12Å; F1835-E1837 VanDerWaalsContact C-N 3.35Å; F1835-E1837 PolarHBondContact O-N 3.13Å; F1835-L1838 PolarHBondContact O-N 3.13Å; F1835-A1839 HydrophobicContact CD1-CB 4.39Å; F1835-A1839 HydrophobicContact CE1-CB 4.33Å; F1835-A1839 VanDerWaalsContact O-CB 3.27Å; F1835-A1839 WeakPolarHBondContact O-CB 3.23Å; F1835-A1839 PolarHBondContact O-N 3.09Å; F1835-I1851 HydrophobicContact CE1-CG2 4.25Å
1836	A	79.4	Confident	74.4	Confident	12.4 Å²	12.4	65 Å²	65	10%	0.102	32%	0.317	C	S	.	.	H	α-helix	trans	-65.1	-41.3	-178.2	0	0	0	0	0	112.1	S1834 A1839 I1840 C1855 L1856	S1834-A1836 VanDerWaalsContact C-N 3.31Å; S1834-A1836 PolarHBondContact O-N 3.08Å; A1836-A1839 PolarHBondContact O-N 3.13Å; A1836-I1840 WeakPolarHBondContact O-CB 3.29Å; A1836-I1840 WeakPolarHBondContact O-CD1 3.24Å; A1836-I1840 VanDerWaalsContact O-CG1 3.25Å; A1836-I1840 WeakPolarHBondContact O-CG1 3.36Å; A1836-I1840 PolarHBondContact O-N 2.95Å; A1836-C1855 HydrophobicContact CB-CB 3.86Å; A1836-L1856 HydrophobicContact CB-CD2 4.26Å; A1836-L1856 HydrophobicContact CB-CG 4.4Å
1837	E	77.3	Confident	75	Confident	64.2 Å²	64.2	61.7 Å²	61.7	30%	0.3	30%	0.3	S	S	.	.	H	α-helix	trans	-66.1	-42.7	178.4	-60.6	177.1	144.2	0	0	111.4	S1834 F1835 I1840 N1841 F1874 I1876	S1834-E1837 WeakPolarHBondContact CA-OE2 3.38Å; S1834-E1837 VanDerWaalsContact CB-OE2 3.28Å; S1834-E1837 WeakPolarHBondContact CB-OE2 3.43Å; S1834-E1837 PolarHBondContact O-N 3.02Å; S1834-E1837 VanDerWaalsContact O-N 3.09Å; S1834-E1837 PolarHBondContact OG-OE2 3.25Å; F1835-E1837 VanDerWaalsContact C-N 3.35Å; F1835-E1837 PolarHBondContact O-N 3.13Å; E1837-I1840 PolarHBondContact O-N 2.92Å; E1837-N1841 WeakPolarHBondContact O-CB 3.43Å; E1837-N1841 VanDerWaalsContact O-CG 3.26Å; E1837-N1841 PolarHBondContact O-N 3.14Å; E1837-N1841 VanDerWaalsContact O-N 3.11Å; E1837-N1841 PolarHBondContact O-ND2 3.06Å; E1837-F1874 HydrophobicContact CG-CD1 3.93Å; E1837-F1874 HydrophobicContact CG-CE1 3.61Å; E1837-F1874 HydrophobicContact CG-CG 4.24Å; E1837-F1874 HydrophobicContact CG-CZ 4.11Å; E1837-F1874 WeakPolarHBondContact OE1-CD1 3.49Å; E1837-F1874 WeakPolarHBondContact OE2-CD1 3.41Å; E1837-F1874 WeakPolarHBondContact OE2-CE1 3.28Å; E1837-I1876 HydrophobicContact CB-CD1 4.29Å
1838	L	80.5	Confident	75.5	Confident	32.4 Å²	32.4	57.4 Å²	57.4	17%	0.17	28%	0.281	C	S	.	.	H	α-helix	trans	-64.9	-44.7	175.4	-73.3	174.4	0	0	0	111.8	F1820 N1824 F1827 L1828 S1834 F1835 I1840 N1841 Q1842	F1820-L1838 HydrophobicContact CE2-CB 4.13Å; F1820-L1838 HydrophobicContact CZ-CB 3.84Å; N1824-L1838 HydrophobicContact CB-CD1 3.94Å; F1827-L1838 HydrophobicContact CB-CD1 4.31Å; F1827-L1838 HydrophobicContact CD1-CD1 3.47Å; F1827-L1838 HydrophobicContact CD1-CD2 4.36Å; F1827-L1838 HydrophobicContact CD1-CG 4.24Å; F1827-L1838 HydrophobicContact CE1-CD1 3.96Å; F1827-L1838 HydrophobicContact CE1-CD2 4.25Å; F1827-L1838 HydrophobicContact CE1-CG 4.22Å; F1827-L1838 HydrophobicContact CG-CD1 4.34Å; L1828-L1838 HydrophobicContact CD2-CD1 3.75Å; L1828-L1838 HydrophobicContact CG-CD1 4.07Å; S1834-L1838 WeakPolarHBondContact O-CG 3.39Å; S1834-L1838 PolarHBondContact O-N 2.94Å; F1835-L1838 PolarHBondContact O-N 3.13Å; L1838-I1840 VanDerWaalsContact C-N 3.27Å; L1838-I1840 PolarHBondContact O-N 3.23Å; L1838-N1841 CarbonylContact O-C 3.58Å; L1838-N1841 PolarHBondContact O-N 2.94Å; L1838-N1841 VanDerWaalsContact O-N 3.1Å; L1838-Q1842 WeakPolarHBondContact O-CB 3.4Å; L1838-Q1842 PolarHBondContact O-N 3Å
1839	A	81.1	Confident	75.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.5	-37.1	179.6	0	0	0	0	0	112.3	F1820 F1835 A1836 N1841 Q1842 I1848 H1849	F1820-A1839 HydrophobicContact CE1-CB 4.4Å; F1820-A1839 HydrophobicContact CE2-CB 4.11Å; F1820-A1839 HydrophobicContact CZ-CB 3.9Å; F1835-A1839 HydrophobicContact CD1-CB 4.39Å; F1835-A1839 HydrophobicContact CE1-CB 4.33Å; F1835-A1839 VanDerWaalsContact O-CB 3.27Å; F1835-A1839 WeakPolarHBondContact O-CB 3.23Å; F1835-A1839 PolarHBondContact O-N 3.09Å; A1836-A1839 PolarHBondContact O-N 3.13Å; A1839-N1841 VanDerWaalsContact C-N 3.3Å; A1839-N1841 PolarHBondContact O-N 3.18Å; A1839-Q1842 WeakPolarHBondContact O-CB 3.34Å; A1839-Q1842 PolarHBondContact O-N 2.94Å; A1839-I1848 HydrophobicContact CB-CG2 3.76Å; A1839-H1849 WeakPolarHBondContact O-CA 3.44Å
1840	I	76.8	Confident	75.8	Confident	21.6 Å²	21.6	59.3 Å²	59.3	11%	0.111	29%	0.292	C	S	.	.	H	α-helix	trans	-70.1	-32.7	175.6	-70.3	167.2	0	0	0	112	A1836 E1837 L1838 Q1842 H1849 Y1853 L1856 I1876	A1836-I1840 WeakPolarHBondContact O-CB 3.29Å; A1836-I1840 WeakPolarHBondContact O-CD1 3.24Å; A1836-I1840 VanDerWaalsContact O-CG1 3.25Å; A1836-I1840 WeakPolarHBondContact O-CG1 3.36Å; A1836-I1840 PolarHBondContact O-N 2.95Å; E1837-I1840 PolarHBondContact O-N 2.92Å; L1838-I1840 VanDerWaalsContact C-N 3.27Å; L1838-I1840 PolarHBondContact O-N 3.23Å; I1840-Q1842 VanDerWaalsContact C-N 3.32Å; I1840-Q1842 PolarHBondContact O-N 3.17Å; I1840-H1849 WeakPolarHBondContact CA-ND1 3.39Å; I1840-H1849 PolarHBondContact O-CD2 3.45Å; I1840-H1849 PolarHBondContact O-CE1 3.01Å; I1840-H1849 PolarHBondContact O-ND1 3.05Å; I1840-H1849 VanDerWaalsContact O-ND1 3.16Å; I1840-Y1853 HydrophobicContact CB-CE2 4.45Å; I1840-Y1853 HydrophobicContact CD1-CD1 4.28Å; I1840-Y1853 HydrophobicContact CD1-CD2 4.32Å; I1840-Y1853 HydrophobicContact CD1-CE1 4.48Å; I1840-Y1853 HydrophobicContact CD1-CE2 4.48Å; I1840-Y1853 HydrophobicContact CG1-CD2 3.75Å; I1840-Y1853 HydrophobicContact CG1-CE2 3.99Å; I1840-Y1853 HydrophobicContact CG1-CG 4.37Å; I1840-Y1853 HydrophobicContact CG2-CD2 4.48Å; I1840-Y1853 HydrophobicContact CG2-CE2 3.86Å; I1840-L1856 HydrophobicContact CD1-CB 4.2Å; I1840-L1856 HydrophobicContact CD1-CD1 3.53Å; I1840-L1856 HydrophobicContact CD1-CG 4.06Å; I1840-I1876 HydrophobicContact CG2-CD1 4.46Å; I1840-I1876 HydrophobicContact CG2-CG2 3.93Å
1841	N	70.2	Confident	76.2	Confident	77.4 Å²	77.4	52.4 Å²	52.4	41%	0.414	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-2.3	-178.7	-71.1	-46	0	0	0	113.9	E1837 L1838 A1839 D1843 R1875 I1876 K1877 Q1892	E1837-N1841 WeakPolarHBondContact O-CB 3.43Å; E1837-N1841 VanDerWaalsContact O-CG 3.26Å; E1837-N1841 PolarHBondContact O-N 3.14Å; E1837-N1841 VanDerWaalsContact O-N 3.11Å; E1837-N1841 PolarHBondContact O-ND2 3.06Å; L1838-N1841 CarbonylContact O-C 3.58Å; L1838-N1841 PolarHBondContact O-N 2.94Å; L1838-N1841 VanDerWaalsContact O-N 3.1Å; A1839-N1841 VanDerWaalsContact C-N 3.3Å; A1839-N1841 PolarHBondContact O-N 3.18Å; N1841-D1843 PolarHBondContact O-N 3.39Å; N1841-R1875 PolarHBondContact ND2-O 3.33Å; N1841-I1876 WeakPolarHBondContact ND2-CD1 3.48Å; N1841-I1876 VanDerWaalsContact ND2-CG1 3.34Å; N1841-I1876 WeakPolarHBondContact ND2-CG1 3.45Å; N1841-I1876 WeakPolarHBondContact OD1-CD1 3.38Å; N1841-I1876 VanDerWaalsContact OD1-CG1 3.3Å; N1841-I1876 WeakPolarHBondContact OD1-CG1 3.44Å; N1841-I1876 WeakPolarHBondContact OD1-CG2 3.37Å; N1841-K1877 PolarHBondContact OD1-N 2.97Å; N1841-Q1892 PolarHBondContact O-NE2 2.75Å
1842	Q	69.3	Low	76.2	Confident	20.8 Å²	20.8	47.7 Å²	47.7	10%	0.097	24%	0.24	C	C	.	.			trans	-96.8	101.8	-176.2	-155.7	132.4	6.4	0	0	111.6	F1820 S1823 N1824 L1838 A1839 I1840 V1844 I1848 Q1892	F1820-Q1842 HydrophobicContact CD2-CB 4.37Å; F1820-Q1842 HydrophobicContact CD2-CG 4.18Å; F1820-Q1842 HydrophobicContact CE2-CB 4.37Å; F1820-Q1842 HydrophobicContact CE2-CG 4.49Å; F1820-Q1842 VanDerWaalsContact CE2-OE1 3.32Å; S1823-Q1842 PolarHBondContact OG-NE2 2.95Å; S1823-Q1842 VanDerWaalsContact OG-NE2 3.12Å; N1824-Q1842 PolarHBondContact ND2-OE1 3.05Å; L1838-Q1842 WeakPolarHBondContact O-CB 3.4Å; L1838-Q1842 PolarHBondContact O-N 3Å; A1839-Q1842 WeakPolarHBondContact O-CB 3.34Å; A1839-Q1842 PolarHBondContact O-N 2.94Å; I1840-Q1842 VanDerWaalsContact C-N 3.32Å; I1840-Q1842 PolarHBondContact O-N 3.17Å; Q1842-V1844 VanDerWaalsContact C-N 3.28Å; Q1842-V1844 HydrophobicContact CB-CG2 4.07Å; Q1842-V1844 VanDerWaalsContact CD-CG2 3.42Å; Q1842-V1844 HydrophobicContact CG-CB 4.28Å; Q1842-V1844 HydrophobicContact CG-CG2 3.67Å; Q1842-V1844 VanDerWaalsContact CG-CG2 3.46Å; Q1842-V1844 VanDerWaalsContact NE2-CG2 3.31Å; Q1842-V1844 PolarHBondContact O-N 3.1Å; Q1842-I1848 HydrophobicContact CB-CG2 4.15Å; Q1842-I1848 HydrophobicContact CG-CD1 4.12Å; Q1842-I1848 HydrophobicContact CG-CG2 4.27Å; Q1842-Q1892 VanDerWaalsContact OE1-OE1 3.08Å
1843	D	59.9	Low	76.1	Confident	120 Å²	120	51.5 Å²	51.5	64%	0.642	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	17	-179.2	-115.7	-4.1	0	0	0	113.7	N1841 K1889 I1890	N1841-D1843 PolarHBondContact O-N 3.39Å; D1843-K1889 HydrophobicContact CB-CG 4.4Å; D1843-K1889 WeakPolarHBondContact OD2-CA 3.4Å; D1843-K1889 WeakPolarHBondContact OD2-CE 3.41Å; D1843-K1889 IonicContact OD2-NZ 2.97Å; D1843-K1889 PolarHBondContact OD2-NZ 3.4Å; D1843-I1890 PolarHBondContact OD2-N 3.37Å
1844	V	60.5	Low	75.8	Confident	82.2 Å²	82.2	44.6 Å²	44.6	50%	0.498	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-37.8	-173.6	-175.7	0	0	0	0	112.2	Q1842 I1848 Q1892	Q1842-V1844 VanDerWaalsContact C-N 3.28Å; Q1842-V1844 HydrophobicContact CB-CG2 4.07Å; Q1842-V1844 VanDerWaalsContact CD-CG2 3.42Å; Q1842-V1844 HydrophobicContact CG-CB 4.28Å; Q1842-V1844 HydrophobicContact CG-CG2 3.67Å; Q1842-V1844 VanDerWaalsContact CG-CG2 3.46Å; Q1842-V1844 VanDerWaalsContact NE2-CG2 3.31Å; Q1842-V1844 PolarHBondContact O-N 3.1Å; V1844-I1848 HydrophobicContact CB-CD1 4.27Å; V1844-I1848 HydrophobicContact CG1-CD1 4.08Å; V1844-Q1892 HydrophobicContact CG2-CB 4Å
1845	D	71	Confident	75.5	Confident	55.6 Å²	55.6	44.4 Å²	44.4	30%	0.297	23%	0.228	S	C	.	.			trans	-151	125.1	-175.8	-137.6	-49.4	0	0	0	111.1	T1816 W1847 I1848 H1849	T1816-D1845 WeakPolarHBondContact CB-OD2 3.37Å; T1816-D1845 HydrophobicContact CG2-CB 3.9Å; T1816-D1845 VanDerWaalsContact CG2-CB 3.46Å; T1816-D1845 VanDerWaalsContact CG2-CG 3.48Å; T1816-D1845 WeakPolarHBondContact CG2-OD1 3.46Å; T1816-D1845 WeakPolarHBondContact CG2-OD2 3.29Å; T1816-D1845 PolarHBondContact OG1-OD2 2.92Å; D1845-W1847 PolarHBondContact O-N 3.15Å; D1845-W1847 VanDerWaalsContact O-N 3.1Å; D1845-W1847 WeakPolarHBondContact OD1-CB 3.45Å; D1845-W1847 PolarHBondContact OD1-N 2.87Å; D1845-W1847 VanDerWaalsContact OD1-N 3.13Å; D1845-I1848 HydrophobicContact CB-CB 4.38Å; D1845-I1848 HydrophobicContact CB-CD1 3.91Å; D1845-I1848 HydrophobicContact CB-CG1 4.28Å; D1845-I1848 PolarHBondContact O-N 2.97Å; D1845-I1848 VanDerWaalsContact O-N 3.13Å; D1845-H1849 PolarHBondContact O-N 3.02Å
1846	E	76.7	Confident	74.9	Confident	163.8 Å²	163.8	45.9 Å²	45.9	77%	0.765	24%	0.235	S	C	*	.	H	α-helix	trans	-57.1	-30.9	-178.8	-173.7	177.8	-173.9	0	0	112.3	H1849 T1850	E1846-H1849 WeakPolarHBondContact O-CB 3.34Å; E1846-H1849 PolarHBondContact O-N 2.96Å; E1846-T1850 VanDerWaalsContact O-CB 3.26Å; E1846-T1850 WeakPolarHBondContact O-CB 3.21Å; E1846-T1850 PolarHBondContact O-N 3.04Å; E1846-T1850 PolarHBondContact O-OG1 3.25Å
1847	W	80.6	Confident	74.3	Confident	29.8 Å²	29.8	49 Å²	49	11%	0.113	25%	0.25	C	C	.	.	H	α-helix	trans	-69.8	-37.7	178	-178.3	66.8	0	0	0	112.8	L1575 T1764 K1813 T1816 M1817 D1845 H1849 T1850 I1851	L1575-W1847 HydrophobicContact CD1-CZ2 4.46Å; L1575-W1847 PolarHBondContact O-NE1 3.22Å; T1764-W1847 HydrophobicContact CG2-CH2 3.66Å; T1764-W1847 HydrophobicContact CG2-CZ2 4.09Å; K1813-W1847 VanDerWaalsContact C-CZ3 3.5Å; K1813-W1847 HydrophobicContact CB-CD2 4.21Å; K1813-W1847 HydrophobicContact CB-CE3 3.98Å; K1813-W1847 HydrophobicContact CB-CH2 3.62Å; K1813-W1847 HydrophobicContact CB-CZ2 3.84Å; K1813-W1847 HydrophobicContact CB-CZ3 3.7Å; K1813-W1847 HydrophobicContact CD-CD2 4Å; K1813-W1847 VanDerWaalsContact CD-CE2 3.48Å; K1813-W1847 HydrophobicContact CD-CE3 4.47Å; K1813-W1847 HydrophobicContact CD-CG 4.29Å; K1813-W1847 HydrophobicContact CD-CH2 4.42Å; K1813-W1847 HydrophobicContact CD-CZ2 3.82Å; K1813-W1847 VanDerWaalsContact CE-CD1 3.49Å; K1813-W1847 HydrophobicContact CG-CD2 3.76Å; K1813-W1847 HydrophobicContact CG-CE3 3.93Å; K1813-W1847 HydrophobicContact CG-CG 4.29Å; K1813-W1847 HydrophobicContact CG-CH2 4.21Å; K1813-W1847 HydrophobicContact CG-CZ2 4.01Å; K1813-W1847 HydrophobicContact CG-CZ3 4.17Å; K1813-W1847 VanDerWaalsContact NZ-NE1 3.19Å; K1813-W1847 WeakPolarHBondContact O-CZ3 3.34Å; T1816-W1847 HydrophobicContact CG2-CE3 4.05Å; T1816-W1847 HydrophobicContact CG2-CZ3 4.27Å; T1816-W1847 VanDerWaalsContact OG1-CE3 3.31Å; T1816-W1847 WeakPolarHBondContact OG1-CZ3 3.16Å; M1817-W1847 HydrophobicContact CB-CH2 4.39Å; M1817-W1847 HydrophobicContact CB-CZ3 4.21Å; M1817-W1847 HydrophobicContact CE-CH2 4.29Å; M1817-W1847 HydrophobicContact CE-CZ3 4.31Å; D1845-W1847 PolarHBondContact O-N 3.15Å; D1845-W1847 VanDerWaalsContact O-N 3.1Å; D1845-W1847 WeakPolarHBondContact OD1-CB 3.45Å; D1845-W1847 PolarHBondContact OD1-N 2.87Å; D1845-W1847 VanDerWaalsContact OD1-N 3.13Å; W1847-H1849 VanDerWaalsContact C-N 3.33Å; W1847-H1849 PolarHBondContact O-N 3.39Å; W1847-T1850 WeakPolarHBondContact O-CB 3.3Å; W1847-T1850 PolarHBondContact O-N 3.02Å; W1847-I1851 HydrophobicContact CD2-CD1 3.81Å; W1847-I1851 VanDerWaalsContact CE2-CD1 3.4Å; W1847-I1851 HydrophobicContact CE3-CD1 3.97Å; W1847-I1851 HydrophobicContact CG-CD1 4.37Å; W1847-I1851 HydrophobicContact CH2-CD1 3.59Å; W1847-I1851 HydrophobicContact CZ2-CD1 3.44Å; W1847-I1851 VanDerWaalsContact CZ2-CD1 3.45Å; W1847-I1851 HydrophobicContact CZ2-CG1 4.47Å; W1847-I1851 HydrophobicContact CZ3-CD1 3.86Å; W1847-I1851 WeakPolarHBondContact O-CB 3.34Å; W1847-I1851 WeakPolarHBondContact O-CG1 3.36Å; W1847-I1851 PolarHBondContact O-N 2.98Å; W1847-I1851 VanDerWaalsContact O-N 3.07Å
1848	I	82.5	Confident	73.7	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.015	25%	0.248	C	C	.	.	H	α-helix	trans	-65.7	-44.3	174.1	-66.9	168.6	0	0	0	109.9	T1816 F1820 A1839 Q1842 V1844 D1845 T1850 I1851 G1852	T1816-I1848 HydrophobicContact CG2-CD1 3.54Å; T1816-I1848 VanDerWaalsContact CG2-CD1 3.45Å; T1816-I1848 HydrophobicContact CG2-CG1 3.57Å; T1816-I1848 VanDerWaalsContact CG2-CG1 3.44Å; T1816-I1848 WeakPolarHBondContact O-CD1 3.13Å; F1820-I1848 HydrophobicContact CB-CD1 3.71Å; F1820-I1848 HydrophobicContact CB-CG1 4.4Å; F1820-I1848 HydrophobicContact CD1-CD1 4.43Å; F1820-I1848 HydrophobicContact CD2-CD1 4.37Å; F1820-I1848 HydrophobicContact CD2-CG2 3.73Å; F1820-I1848 HydrophobicContact CE2-CG2 4.04Å; F1820-I1848 HydrophobicContact CG-CD1 4.21Å; F1820-I1848 HydrophobicContact CG-CG2 4.14Å; F1820-I1848 HydrophobicContact CZ-CG2 4.47Å; A1839-I1848 HydrophobicContact CB-CG2 3.76Å; Q1842-I1848 HydrophobicContact CB-CG2 4.15Å; Q1842-I1848 HydrophobicContact CG-CD1 4.12Å; Q1842-I1848 HydrophobicContact CG-CG2 4.27Å; V1844-I1848 HydrophobicContact CB-CD1 4.27Å; V1844-I1848 HydrophobicContact CG1-CD1 4.08Å; D1845-I1848 HydrophobicContact CB-CB 4.38Å; D1845-I1848 HydrophobicContact CB-CD1 3.91Å; D1845-I1848 HydrophobicContact CB-CG1 4.28Å; D1845-I1848 PolarHBondContact O-N 2.97Å; D1845-I1848 VanDerWaalsContact O-N 3.13Å; I1848-T1850 VanDerWaalsContact C-N 3.3Å; I1848-T1850 PolarHBondContact O-N 3.02Å; I1848-I1851 CarbonylContact O-C 3.55Å; I1848-I1851 WeakPolarHBondContact O-CA 3.38Å; I1848-I1851 WeakPolarHBondContact O-CB 3.32Å; I1848-I1851 PolarHBondContact O-N 3.1Å; I1848-I1851 VanDerWaalsContact O-N 3.09Å; I1848-G1852 PolarHBondContact O-N 3.12Å
1849	H	78.1	Confident	72.5	Confident	63 Å²	63	48.2 Å²	48.2	29%	0.292	25%	0.254	S	S	.	.	H	α-helix	trans	-58	-44.3	176.7	-170.7	63.9	0	0	0	111.6	A1839 I1840 D1845 E1846 W1847 I1851 G1852 Y1853 I1876	A1839-H1849 WeakPolarHBondContact O-CA 3.44Å; I1840-H1849 WeakPolarHBondContact CA-ND1 3.39Å; I1840-H1849 PolarHBondContact O-CD2 3.45Å; I1840-H1849 PolarHBondContact O-CE1 3.01Å; I1840-H1849 PolarHBondContact O-ND1 3.05Å; I1840-H1849 VanDerWaalsContact O-ND1 3.16Å; D1845-H1849 PolarHBondContact O-N 3.02Å; E1846-H1849 WeakPolarHBondContact O-CB 3.34Å; E1846-H1849 PolarHBondContact O-N 2.96Å; W1847-H1849 VanDerWaalsContact C-N 3.33Å; W1847-H1849 PolarHBondContact O-N 3.39Å; H1849-I1851 VanDerWaalsContact C-N 3.33Å; H1849-I1851 PolarHBondContact O-N 3.09Å; H1849-G1852 PolarHBondContact O-N 2.96Å; H1849-Y1853 AromaticContact CD2-CD2 3.94Å; H1849-Y1853 AromaticContact CD2-CE2 3.48Å; H1849-Y1853 VanDerWaalsContact CD2-CE2 3.44Å; H1849-Y1853 WeakPolarHBondContact CD2-CE2 3.12Å; H1849-Y1853 AromaticContact CE1-CD2 3.55Å; H1849-Y1853 AromaticContact CE1-CE2 3.47Å; H1849-Y1853 WeakPolarHBondContact CE1-CE2 3.49Å; H1849-Y1853 AromaticContact ND1-CD2 3.78Å; H1849-Y1853 AromaticContact ND1-CE2 3.97Å; H1849-Y1853 AromaticContact NE2-CD2 3.92Å; H1849-Y1853 AromaticContact NE2-CE2 3.25Å; H1849-Y1853 WeakPolarHBondContact NE2-CE2 3.23Å; H1849-Y1853 AromaticContact NE2-CZ 3.83Å; H1849-Y1853 WeakPolarHBondContact O-CB 3.24Å; H1849-Y1853 VanDerWaalsContact O-CD2 3.31Å; H1849-Y1853 WeakPolarHBondContact O-CD2 3.2Å; H1849-Y1853 PolarHBondContact O-N 3.1Å; H1849-I1876 WeakPolarHBondContact CE1-CD1 3.35Å; H1849-I1876 WeakPolarHBondContact NE2-CD1 3.41Å
1850	T	78.2	Confident	71.1	Confident	48 Å²	48	52 Å²	52	29%	0.294	27%	0.274	S	S	.	.	H	α-helix	trans	-62	-40.2	176	-56.6	0	0	0	0	112.2	L1578 I1581 E1846 W1847 I1848 Y1853 A1854	L1578-T1850 HydrophobicContact CD1-CG2 3.89Å; I1581-T1850 HydrophobicContact CD1-CG2 4.36Å; E1846-T1850 VanDerWaalsContact O-CB 3.26Å; E1846-T1850 WeakPolarHBondContact O-CB 3.21Å; E1846-T1850 PolarHBondContact O-N 3.04Å; E1846-T1850 PolarHBondContact O-OG1 3.25Å; W1847-T1850 WeakPolarHBondContact O-CB 3.3Å; W1847-T1850 PolarHBondContact O-N 3.02Å; I1848-T1850 VanDerWaalsContact C-N 3.3Å; I1848-T1850 PolarHBondContact O-N 3.02Å; T1850-Y1853 PolarHBondContact O-N 3.15Å; T1850-A1854 WeakPolarHBondContact O-CB 3.41Å; T1850-A1854 PolarHBondContact O-N 3.08Å
1851	I	80.9	Confident	69.5	Low	6.8 Å²	6.8	58.1 Å²	58.1	4%	0.035	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-45.3	174.3	-71.9	168.1	0	0	0	111.2	I1581 P1766 M1817 F1835 W1847 I1848 H1849 Y1853 A1854 C1855	I1581-I1851 HydrophobicContact CD1-CG1 4.28Å; I1581-I1851 HydrophobicContact CG2-CG1 4.34Å; P1766-I1851 HydrophobicContact CG-CG2 3.31Å; P1766-I1851 VanDerWaalsContact CG-CG2 3.43Å; M1817-I1851 HydrophobicContact CE-CD1 3.82Å; F1835-I1851 HydrophobicContact CE1-CG2 4.25Å; W1847-I1851 HydrophobicContact CD2-CD1 3.81Å; W1847-I1851 VanDerWaalsContact CE2-CD1 3.4Å; W1847-I1851 HydrophobicContact CE3-CD1 3.97Å; W1847-I1851 HydrophobicContact CG-CD1 4.37Å; W1847-I1851 HydrophobicContact CH2-CD1 3.59Å; W1847-I1851 HydrophobicContact CZ2-CD1 3.44Å; W1847-I1851 VanDerWaalsContact CZ2-CD1 3.45Å; W1847-I1851 HydrophobicContact CZ2-CG1 4.47Å; W1847-I1851 HydrophobicContact CZ3-CD1 3.86Å; W1847-I1851 WeakPolarHBondContact O-CB 3.34Å; W1847-I1851 WeakPolarHBondContact O-CG1 3.36Å; W1847-I1851 PolarHBondContact O-N 2.98Å; W1847-I1851 VanDerWaalsContact O-N 3.07Å; I1848-I1851 CarbonylContact O-C 3.55Å; I1848-I1851 WeakPolarHBondContact O-CA 3.38Å; I1848-I1851 WeakPolarHBondContact O-CB 3.32Å; I1848-I1851 PolarHBondContact O-N 3.1Å; I1848-I1851 VanDerWaalsContact O-N 3.09Å; H1849-I1851 VanDerWaalsContact C-N 3.33Å; H1849-I1851 PolarHBondContact O-N 3.09Å; I1851-Y1853 VanDerWaalsContact C-N 3.28Å; I1851-Y1853 PolarHBondContact O-N 3.17Å; I1851-A1854 WeakPolarHBondContact O-CB 3.28Å; I1851-A1854 PolarHBondContact O-N 3.05Å; I1851-A1854 VanDerWaalsContact O-N 3.13Å; I1851-C1855 PolarHBondContact O-N 2.84Å; I1851-C1855 PolarHBondContact O-SG 2.92Å
1852	G	78.3	Confident	68.1	Low	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-57.6	-44.1	176.6	0	0	0	0	0	112	I1848 H1849 A1854 C1855 L1856	I1848-G1852 PolarHBondContact O-N 3.12Å; H1849-G1852 PolarHBondContact O-N 2.96Å; G1852-A1854 PolarHBondContact O-N 2.65Å; G1852-C1855 PolarHBondContact O-N 3.21Å; G1852-L1856 WeakPolarHBondContact O-CB 3.48Å; G1852-L1856 PolarHBondContact O-N 3.21Å; G1852-L1856 VanDerWaalsContact O-N 3.12Å
1853	Y	75.1	Confident	66.9	Low	96.6 Å²	96.6	64.2 Å²	64.2	38%	0.379	32%	0.323	S	S	.	.	H	α-helix	trans	-63.5	-42.4	173.3	-117.1	-85.3	0	0	0	113	I1840 H1849 T1850 I1851 C1855 L1856 L1857 L1878	I1840-Y1853 HydrophobicContact CB-CE2 4.45Å; I1840-Y1853 HydrophobicContact CD1-CD1 4.28Å; I1840-Y1853 HydrophobicContact CD1-CD2 4.32Å; I1840-Y1853 HydrophobicContact CD1-CE1 4.48Å; I1840-Y1853 HydrophobicContact CD1-CE2 4.48Å; I1840-Y1853 HydrophobicContact CG1-CD2 3.75Å; I1840-Y1853 HydrophobicContact CG1-CE2 3.99Å; I1840-Y1853 HydrophobicContact CG1-CG 4.37Å; I1840-Y1853 HydrophobicContact CG2-CD2 4.48Å; I1840-Y1853 HydrophobicContact CG2-CE2 3.86Å; H1849-Y1853 AromaticContact CD2-CD2 3.94Å; H1849-Y1853 AromaticContact CD2-CE2 3.48Å; H1849-Y1853 VanDerWaalsContact CD2-CE2 3.44Å; H1849-Y1853 WeakPolarHBondContact CD2-CE2 3.12Å; H1849-Y1853 AromaticContact CE1-CD2 3.55Å; H1849-Y1853 AromaticContact CE1-CE2 3.47Å; H1849-Y1853 WeakPolarHBondContact CE1-CE2 3.49Å; H1849-Y1853 AromaticContact ND1-CD2 3.78Å; H1849-Y1853 AromaticContact ND1-CE2 3.97Å; H1849-Y1853 AromaticContact NE2-CD2 3.92Å; H1849-Y1853 AromaticContact NE2-CE2 3.25Å; H1849-Y1853 WeakPolarHBondContact NE2-CE2 3.23Å; H1849-Y1853 AromaticContact NE2-CZ 3.83Å; H1849-Y1853 WeakPolarHBondContact O-CB 3.24Å; H1849-Y1853 VanDerWaalsContact O-CD2 3.31Å; H1849-Y1853 WeakPolarHBondContact O-CD2 3.2Å; H1849-Y1853 PolarHBondContact O-N 3.1Å; T1850-Y1853 PolarHBondContact O-N 3.15Å; I1851-Y1853 VanDerWaalsContact C-N 3.28Å; I1851-Y1853 PolarHBondContact O-N 3.17Å; Y1853-C1855 VanDerWaalsContact C-N 3.32Å; Y1853-C1855 PolarHBondContact O-N 3.14Å; Y1853-L1856 PolarHBondContact O-N 3.09Å; Y1853-L1857 HydrophobicContact CD1-CD1 3.73Å; Y1853-L1857 HydrophobicContact CD1-CG 4.39Å; Y1853-L1857 HydrophobicContact CE1-CD1 3.44Å; Y1853-L1857 HydrophobicContact CE1-CG 4.17Å; Y1853-L1857 WeakPolarHBondContact O-CB 3.24Å; Y1853-L1857 VanDerWaalsContact O-CG 3.28Å; Y1853-L1857 WeakPolarHBondContact O-CG 3.36Å; Y1853-L1857 PolarHBondContact O-N 3.22Å; Y1853-L1857 VanDerWaalsContact O-N 3.08Å; Y1853-L1878 HydrophobicContact CE2-CD1 3.79Å
1854	A	72.8	Confident	66	Low	12.6 Å²	12.6	67.2 Å²	67.2	10%	0.104	33%	0.33	C	S	.	.	H	α-helix	trans	-60.3	-41.1	176.4	0	0	0	0	0	111.9	L1578 I1581 M1582 T1850 I1851 G1852 L1857 S1858	L1578-A1854 HydrophobicContact CD1-CB 3.95Å; L1578-A1854 HydrophobicContact CD2-CB 4.46Å; L1578-A1854 HydrophobicContact CG-CB 4.12Å; I1581-A1854 HydrophobicContact CG2-CB 4Å; M1582-A1854 HydrophobicContact CG-CB 4.17Å; T1850-A1854 WeakPolarHBondContact O-CB 3.41Å; T1850-A1854 PolarHBondContact O-N 3.08Å; I1851-A1854 WeakPolarHBondContact O-CB 3.28Å; I1851-A1854 PolarHBondContact O-N 3.05Å; I1851-A1854 VanDerWaalsContact O-N 3.13Å; G1852-A1854 PolarHBondContact O-N 2.65Å; A1854-L1857 CarbonylContact O-C 3.53Å; A1854-L1857 PolarHBondContact O-N 3.16Å; A1854-S1858 WeakPolarHBondContact O-CB 3.25Å; A1854-S1858 PolarHBondContact O-N 3.16Å; A1854-S1858 VanDerWaalsContact O-N 3.1Å; A1854-S1858 PolarHBondContact O-OG 2.77Å; A1854-S1858 VanDerWaalsContact O-OG 3.1Å
1855	C	73.3	Confident	65.3	Low	20.8 Å²	20.8	69 Å²	69	14%	0.141	34%	0.336	C	S	.	.	H	α-helix	trans	-64	-44.3	175.6	-68.7	0	0	0	0	112.1	P1766 A1836 I1851 G1852 Y1853 L1857 S1858 S1859	P1766-C1855 VanDerWaalsContact CB-SG 3.56Å; P1766-C1855 VanDerWaalsContact CG-SG 3.52Å; A1836-C1855 HydrophobicContact CB-CB 3.86Å; I1851-C1855 PolarHBondContact O-N 2.84Å; I1851-C1855 PolarHBondContact O-SG 2.92Å; G1852-C1855 PolarHBondContact O-N 3.21Å; Y1853-C1855 VanDerWaalsContact C-N 3.32Å; Y1853-C1855 PolarHBondContact O-N 3.14Å; C1855-L1857 VanDerWaalsContact C-N 3.32Å; C1855-L1857 PolarHBondContact O-N 3.26Å; C1855-S1858 WeakPolarHBondContact CA-OG 3.48Å; C1855-S1858 PolarHBondContact O-N 3.04Å; C1855-S1858 VanDerWaalsContact O-N 3.14Å; C1855-S1858 PolarHBondContact O-OG 2.99Å; C1855-S1859 PolarHBondContact O-N 3.18Å; C1855-S1859 PolarHBondContact O-OG 2.86Å
1856	L	70	Confident	63.7	Low	33 Å²	33	72.5 Å²	72.5	17%	0.173	36%	0.355	C	S	.	.	H	α-helix	trans	-65.8	-32.4	177.2	-133.9	158.9	0	0	0	112.7	A1836 I1840 G1852 Y1853 S1859 N1860 F1874 I1876	A1836-L1856 HydrophobicContact CB-CD2 4.26Å; A1836-L1856 HydrophobicContact CB-CG 4.4Å; I1840-L1856 HydrophobicContact CD1-CB 4.2Å; I1840-L1856 HydrophobicContact CD1-CD1 3.53Å; I1840-L1856 HydrophobicContact CD1-CG 4.06Å; G1852-L1856 WeakPolarHBondContact O-CB 3.48Å; G1852-L1856 PolarHBondContact O-N 3.21Å; G1852-L1856 VanDerWaalsContact O-N 3.12Å; Y1853-L1856 PolarHBondContact O-N 3.09Å; L1856-S1859 PolarHBondContact O-OG 3.26Å; L1856-N1860 PolarHBondContact O-N 3.1Å; L1856-N1860 PolarHBondContact O-ND2 3.23Å; L1856-N1860 PolarHBondContact O-OD1 2.66Å; L1856-F1874 HydrophobicContact CD1-CD1 3.96Å; L1856-F1874 HydrophobicContact CD1-CD2 4.35Å; L1856-F1874 HydrophobicContact CD1-CE1 3.86Å; L1856-F1874 HydrophobicContact CD1-CE2 4.39Å; L1856-F1874 HydrophobicContact CD1-CG 4.01Å; L1856-F1874 HydrophobicContact CD1-CZ 4.12Å; L1856-F1874 HydrophobicContact CD2-CD1 3.52Å; L1856-F1874 HydrophobicContact CD2-CE1 4Å; L1856-F1874 HydrophobicContact CD2-CZ 4.21Å; L1856-F1874 HydrophobicContact CG-CZ 4.49Å; L1856-I1876 HydrophobicContact CD1-CD1 4.12Å
1857	L	67.8	Low	61.8	Low	77.2 Å²	77.2	67.5 Å²	67.5	40%	0.404	35%	0.347	S	S	.	.	H	α-helix	trans	-73.6	-30.3	173.9	-71.9	172.1	0	0	0	112.6	L1578 M1582 Y1853 A1854 C1855 N1860 Y1861	L1578-L1857 HydrophobicContact CD2-CD1 4.21Å; M1582-L1857 HydrophobicContact CE-CB 3.82Å; M1582-L1857 WeakPolarHBondContact CE-O 3.47Å; M1582-L1857 HydrophobicContact SD-CB 4.29Å; M1582-L1857 HydrophobicContact SD-CD1 4.31Å; Y1853-L1857 HydrophobicContact CD1-CD1 3.73Å; Y1853-L1857 HydrophobicContact CD1-CG 4.39Å; Y1853-L1857 HydrophobicContact CE1-CD1 3.44Å; Y1853-L1857 HydrophobicContact CE1-CG 4.17Å; Y1853-L1857 WeakPolarHBondContact O-CB 3.24Å; Y1853-L1857 VanDerWaalsContact O-CG 3.28Å; Y1853-L1857 WeakPolarHBondContact O-CG 3.36Å; Y1853-L1857 PolarHBondContact O-N 3.22Å; Y1853-L1857 VanDerWaalsContact O-N 3.08Å; A1854-L1857 CarbonylContact O-C 3.53Å; A1854-L1857 PolarHBondContact O-N 3.16Å; C1855-L1857 VanDerWaalsContact C-N 3.32Å; C1855-L1857 PolarHBondContact O-N 3.26Å; L1857-N1860 PolarHBondContact O-N 3.41Å; L1857-Y1861 PolarHBondContact O-N 3.12Å
1858	S	63.5	Low	59.7	Low	38.4 Å²	38.4	72.9 Å²	72.9	27%	0.269	38%	0.378	S	S	.	.	H	α-helix	trans	-81.4	-32.6	-180	68.2	0	0	0	0	113	A1854 C1855 N1860 Y1861 Q1862	A1854-S1858 WeakPolarHBondContact O-CB 3.25Å; A1854-S1858 PolarHBondContact O-N 3.16Å; A1854-S1858 VanDerWaalsContact O-N 3.1Å; A1854-S1858 PolarHBondContact O-OG 2.77Å; A1854-S1858 VanDerWaalsContact O-OG 3.1Å; C1855-S1858 WeakPolarHBondContact CA-OG 3.48Å; C1855-S1858 PolarHBondContact O-N 3.04Å; C1855-S1858 VanDerWaalsContact O-N 3.14Å; C1855-S1858 PolarHBondContact O-OG 2.99Å; S1858-N1860 VanDerWaalsContact C-N 3.35Å; S1858-N1860 PolarHBondContact O-N 3.07Å; S1858-Y1861 VanDerWaalsContact O-CB 3.3Å; S1858-Y1861 WeakPolarHBondContact O-CB 3.3Å; S1858-Y1861 PolarHBondContact O-N 3.03Å; S1858-Y1861 VanDerWaalsContact O-N 3.11Å; S1858-Q1862 PolarHBondContact O-N 3.27Å
1859	S	57	Low	57.5	Low	42.2 Å²	42.2	80.3 Å²	80.3	30%	0.295	42%	0.417	S	S	.	.	H	α-helix	trans	-53.6	-32.2	177.7	63.4	0	0	0	0	112.9	C1855 L1856 Y1861 Q1862 E1863 F1874	C1855-S1859 PolarHBondContact O-N 3.18Å; C1855-S1859 PolarHBondContact O-OG 2.86Å; L1856-S1859 PolarHBondContact O-OG 3.26Å; S1859-Y1861 VanDerWaalsContact C-N 3.26Å; S1859-Y1861 PolarHBondContact O-N 3.06Å; S1859-Y1861 VanDerWaalsContact O-N 3.14Å; S1859-Q1862 PolarHBondContact O-N 2.92Å; S1859-Q1862 VanDerWaalsContact O-N 3.08Å; S1859-E1863 PolarHBondContact O-N 3.25Å; S1859-E1863 VanDerWaalsContact O-N 3.16Å; S1859-F1874 VanDerWaalsContact OG-CE2 3.3Å; S1859-F1874 WeakPolarHBondContact OG-CE2 2.96Å; S1859-F1874 VanDerWaalsContact OG-CZ 3.26Å; S1859-F1874 WeakPolarHBondContact OG-CZ 3.32Å
1860	N	50.5	Low	55.4	Low	78.8 Å²	78.8	81.1 Å²	81.1	42%	0.421	43%	0.428	S	S	.	.	H	α-helix	trans	-50	-19.3	170.4	-68.8	-16.1	0	0	0	114.8	L1856 L1857 S1858 Q1862 R1875	L1856-N1860 PolarHBondContact O-N 3.1Å; L1856-N1860 PolarHBondContact O-ND2 3.23Å; L1856-N1860 PolarHBondContact O-OD1 2.66Å; L1857-N1860 PolarHBondContact O-N 3.41Å; S1858-N1860 VanDerWaalsContact C-N 3.35Å; S1858-N1860 PolarHBondContact O-N 3.07Å; N1860-Q1862 VanDerWaalsContact C-N 3.27Å; N1860-Q1862 PolarHBondContact O-N 2.88Å; N1860-R1875 PolarHBondContact OD1-NH2 3.27Å
1861	Y	42.9	Very low	53.3	Low	150.6 Å²	150.6	87.3 Å²	87.3	59%	0.591	45%	0.451	S	S	*	.	H	α-helix	trans	-76.4	-32.5	174.5	-110.2	-80.9	0	0	0	112.8	L1857 S1858 S1859 E1863 K1864 I1865	L1857-Y1861 PolarHBondContact O-N 3.12Å; S1858-Y1861 VanDerWaalsContact O-CB 3.3Å; S1858-Y1861 WeakPolarHBondContact O-CB 3.3Å; S1858-Y1861 PolarHBondContact O-N 3.03Å; S1858-Y1861 VanDerWaalsContact O-N 3.11Å; S1859-Y1861 VanDerWaalsContact C-N 3.26Å; S1859-Y1861 PolarHBondContact O-N 3.06Å; S1859-Y1861 VanDerWaalsContact O-N 3.14Å; Y1861-E1863 VanDerWaalsContact C-N 3.31Å; Y1861-E1863 PolarHBondContact O-N 2.9Å; Y1861-K1864 PolarHBondContact O-N 3.2Å; Y1861-K1864 VanDerWaalsContact O-N 3.12Å; Y1861-I1865 HydrophobicContact CD1-CD1 4.01Å; Y1861-I1865 HydrophobicContact CD1-CG1 4.34Å; Y1861-I1865 HydrophobicContact CG-CD1 4.33Å; Y1861-I1865 VanDerWaalsContact O-CG1 3.29Å; Y1861-I1865 WeakPolarHBondContact O-CG1 3.43Å; Y1861-I1865 PolarHBondContact O-N 3.4Å
1862	Q	42	Very low	51.1	Low	114 Å²	114	93.5 Å²	93.5	53%	0.533	49%	0.485	S	S	.	.	H	α-helix	trans	-69.8	-32.2	178.1	-74.7	-174.9	-22	0	0	112.8	S1858 S1859 N1860 K1864 I1865 N1866	S1858-Q1862 PolarHBondContact O-N 3.27Å; S1859-Q1862 PolarHBondContact O-N 2.92Å; S1859-Q1862 VanDerWaalsContact O-N 3.08Å; N1860-Q1862 VanDerWaalsContact C-N 3.27Å; N1860-Q1862 PolarHBondContact O-N 2.88Å; Q1862-K1864 VanDerWaalsContact C-N 3.28Å; Q1862-K1864 PolarHBondContact O-N 3.1Å; Q1862-K1864 VanDerWaalsContact O-N 3.15Å; Q1862-I1865 WeakPolarHBondContact O-CB 3.27Å; Q1862-I1865 PolarHBondContact O-N 3.18Å; Q1862-N1866 PolarHBondContact O-N 3.13Å; Q1862-N1866 VanDerWaalsContact O-N 3.09Å
1863	E	42.6	Very low	49.2	Very low	111.2 Å²	111.2	101 Å²	101	52%	0.52	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.7	175.6	-72.2	-169	157	0	0	113.4	S1859 Y1861 I1865 N1866 R1875	S1859-E1863 PolarHBondContact O-N 3.25Å; S1859-E1863 VanDerWaalsContact O-N 3.16Å; Y1861-E1863 VanDerWaalsContact C-N 3.31Å; Y1861-E1863 PolarHBondContact O-N 2.9Å; E1863-I1865 PolarHBondContact O-N 3.39Å; E1863-N1866 CarbonylContact O-C 3.57Å; E1863-N1866 PolarHBondContact O-N 3.31Å; E1863-R1875 IonicContact OE2-NH2 3.32Å
1864	K	42.4	Very low	47.5	Very low	184 Å²	184	101.1 Å²	101.1	80%	0.8	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-15	174.7	-83.2	-176.9	176.6	176.3	0	114.3	Y1861 Q1862 N1866	Y1861-K1864 PolarHBondContact O-N 3.2Å; Y1861-K1864 VanDerWaalsContact O-N 3.12Å; Q1862-K1864 VanDerWaalsContact C-N 3.28Å; Q1862-K1864 PolarHBondContact O-N 3.1Å; Q1862-K1864 VanDerWaalsContact O-N 3.15Å; K1864-N1866 VanDerWaalsContact C-N 3.32Å; K1864-N1866 PolarHBondContact O-N 3.4Å
1865	I	44.7	Very low	45.9	Very low	119.4 Å²	119.4	110.9 Å²	110.9	61%	0.612	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-31.3	-176.5	-64	174.4	0	0	0	111.4	Y1861 Q1862 E1863 G1867 C1870	Y1861-I1865 HydrophobicContact CD1-CD1 4.01Å; Y1861-I1865 HydrophobicContact CD1-CG1 4.34Å; Y1861-I1865 HydrophobicContact CG-CD1 4.33Å; Y1861-I1865 VanDerWaalsContact O-CG1 3.29Å; Y1861-I1865 WeakPolarHBondContact O-CG1 3.43Å; Y1861-I1865 PolarHBondContact O-N 3.4Å; Q1862-I1865 WeakPolarHBondContact O-CB 3.27Å; Q1862-I1865 PolarHBondContact O-N 3.18Å; E1863-I1865 PolarHBondContact O-N 3.39Å; I1865-G1867 PolarHBondContact O-N 3.11Å; I1865-C1870 HydrophobicContact CG1-CB 4.27Å; I1865-C1870 HydrophobicContact CG2-CB 4.25Å
1866	N	38.2	Very low	44.4	Very low	130.2 Å²	130.2	113.9 Å²	113.9	70%	0.696	57%	0.568	S	S	*	*	S	Bend	trans	-103.9	63	-179.8	-71.6	-18.8	0	0	0	111.6	Q1862 E1863 K1864 D1868	Q1862-N1866 PolarHBondContact O-N 3.13Å; Q1862-N1866 VanDerWaalsContact O-N 3.09Å; E1863-N1866 CarbonylContact O-C 3.57Å; E1863-N1866 PolarHBondContact O-N 3.31Å; K1864-N1866 VanDerWaalsContact C-N 3.32Å; K1864-N1866 PolarHBondContact O-N 3.4Å; N1866-D1868 VanDerWaalsContact C-N 3.3Å; N1866-D1868 PolarHBondContact O-N 3.06Å
1867	G	36.2	Very low	42.7	Very low	58.8 Å²	58.8	121.7 Å²	121.7	61%	0.606	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	61.7	-175.9	0	0	0	0	0	115.6	I1865 L1869 C1870	I1865-G1867 PolarHBondContact O-N 3.11Å; G1867-L1869 PolarHBondContact O-N 3.47Å; G1867-C1870 PolarHBondContact O-N 3.3Å
1868	D	37.1	Very low	41.2	Very low	142 Å²	142	123.8 Å²	123.8	76%	0.759	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.7	12.8	169.4	-100.7	-32	0	0	0	116.9	N1866 C1870 K1871	N1866-D1868 VanDerWaalsContact C-N 3.3Å; N1866-D1868 PolarHBondContact O-N 3.06Å; D1868-C1870 VanDerWaalsContact C-N 3.27Å; D1868-C1870 PolarHBondContact O-N 3.07Å; D1868-K1871 PolarHBondContact O-N 2.99Å; D1868-K1871 IonicContact OD1-NZ 2.68Å
1869	L	36.9	Very low	39.7	Very low	157.8 Å²	157.8	127.8 Å²	127.8	83%	0.826	63%	0.63	S	S	*	*	S	Bend	trans	-109	2.5	177.6	-83.2	141.5	0	0	0	117.5	G1867 K1871 N1872	G1867-L1869 PolarHBondContact O-N 3.47Å; L1869-K1871 PolarHBondContact O-N 3.42Å; L1869-K1871 VanDerWaalsContact O-N 3.16Å; L1869-N1872 PolarHBondContact O-N 3.02Å
1870	C	33.7	Very low	38.8	Very low	79.8 Å²	79.8	131.4 Å²	131.4	54%	0.539	65%	0.65	S	S	.	*			trans	-107.3	70.8	172.7	-71.8	0	0	0	0	111.7	I1865 G1867 D1868 N1872 F1874	I1865-C1870 HydrophobicContact CG1-CB 4.27Å; I1865-C1870 HydrophobicContact CG2-CB 4.25Å; G1867-C1870 PolarHBondContact O-N 3.3Å; D1868-C1870 VanDerWaalsContact C-N 3.27Å; D1868-C1870 PolarHBondContact O-N 3.07Å; C1870-N1872 VanDerWaalsContact C-N 3.27Å; C1870-N1872 PolarHBondContact O-N 2.82Å; C1870-F1874 WeakPolarHBondContact O-CD2 3.48Å
1871	K	32.9	Very low	38.1	Very low	178.2 Å²	178.2	133.6 Å²	133.6	78%	0.775	66%	0.662	S	S	*	*			trans	-91.2	32.9	175.1	-87	177.9	-178.9	165.4	0	113.2	D1868 L1869 F1873	D1868-K1871 PolarHBondContact O-N 2.99Å; D1868-K1871 IonicContact OD1-NZ 2.68Å; L1869-K1871 PolarHBondContact O-N 3.42Å; L1869-K1871 VanDerWaalsContact O-N 3.16Å; K1871-F1873 PolarHBondContact O-N 3.08Å
1872	N	34.9	Very low	37.8	Very low	137 Å²	137	131.9 Å²	131.9	73%	0.733	66%	0.663	S	S	*	*			trans	-95.5	43.2	-179.2	-71.1	-10.7	0	0	0	115	L1869 C1870 F1874	L1869-N1872 PolarHBondContact O-N 3.02Å; C1870-N1872 VanDerWaalsContact C-N 3.27Å; C1870-N1872 PolarHBondContact O-N 2.82Å; N1872-F1874 PolarHBondContact O-N 3.14Å
1873	F	38.7	Very low	37.4	Very low	158.8 Å²	158.8	134.6 Å²	134.6	70%	0.696	68%	0.681	S	S	*	*			trans	-107.5	78.3	177.2	-77.5	-79.6	0	0	0	114.5	Y1833 K1871 R1875	Y1833-F1873 VanDerWaalsContact CB-CE1 3.44Å; Y1833-F1873 HydrophobicContact CD1-CZ 4.24Å; Y1833-F1873 HydrophobicContact CD2-CE1 4.35Å; Y1833-F1873 HydrophobicContact CD2-CZ 4.03Å; Y1833-F1873 HydrophobicContact CG-CE1 4Å; Y1833-F1873 AromaticContact CG-CZ 3.71Å; Y1833-F1873 HydrophobicContact CG-CZ 3.71Å; K1871-F1873 PolarHBondContact O-N 3.08Å; F1873-R1875 PolarHBondContact O-N 2.94Å
1874	F	39.2	Very low	37	Very low	98.6 Å²	98.6	134.3 Å²	134.3	43%	0.432	69%	0.692	S	S	.	*			trans	-74.4	120.6	174.7	-60.7	-73.5	0	0	0	113.8	E1837 L1856 S1859 C1870 N1872 I1876	E1837-F1874 HydrophobicContact CG-CD1 3.93Å; E1837-F1874 HydrophobicContact CG-CE1 3.61Å; E1837-F1874 HydrophobicContact CG-CG 4.24Å; E1837-F1874 HydrophobicContact CG-CZ 4.11Å; E1837-F1874 WeakPolarHBondContact OE1-CD1 3.49Å; E1837-F1874 WeakPolarHBondContact OE2-CD1 3.41Å; E1837-F1874 WeakPolarHBondContact OE2-CE1 3.28Å; L1856-F1874 HydrophobicContact CD1-CD1 3.96Å; L1856-F1874 HydrophobicContact CD1-CD2 4.35Å; L1856-F1874 HydrophobicContact CD1-CE1 3.86Å; L1856-F1874 HydrophobicContact CD1-CE2 4.39Å; L1856-F1874 HydrophobicContact CD1-CG 4.01Å; L1856-F1874 HydrophobicContact CD1-CZ 4.12Å; L1856-F1874 HydrophobicContact CD2-CD1 3.52Å; L1856-F1874 HydrophobicContact CD2-CE1 4Å; L1856-F1874 HydrophobicContact CD2-CZ 4.21Å; L1856-F1874 HydrophobicContact CG-CZ 4.49Å; S1859-F1874 VanDerWaalsContact OG-CE2 3.3Å; S1859-F1874 WeakPolarHBondContact OG-CE2 2.96Å; S1859-F1874 VanDerWaalsContact OG-CZ 3.26Å; S1859-F1874 WeakPolarHBondContact OG-CZ 3.32Å; C1870-F1874 WeakPolarHBondContact O-CD2 3.48Å; N1872-F1874 PolarHBondContact O-N 3.14Å; F1874-I1876 HydrophobicContact CB-CD1 4.32Å; F1874-I1876 HydrophobicContact CB-CG1 4.21Å; F1874-I1876 PolarHBondContact O-N 3.15Å
1875	R	39.7	Very low	36.4	Very low	218.2 Å²	218.2	130.3 Å²	130.3	82%	0.823	69%	0.686	S	S	*	*			trans	-98.2	61	177	-94.5	-177	-179.6	179.6	1	112.3	N1841 N1860 E1863 F1873	N1841-R1875 PolarHBondContact ND2-O 3.33Å; N1860-R1875 PolarHBondContact OD1-NH2 3.27Å; E1863-R1875 IonicContact OE2-NH2 3.32Å; F1873-R1875 PolarHBondContact O-N 2.94Å
1876	I	40.6	Very low	36.1	Very low	83 Å²	83	132.3 Å²	132.3	43%	0.426	70%	0.696	S	S	.	*			trans	-96.8	117.5	177.4	-58.4	165.4	0	0	0	109.6	E1837 I1840 N1841 H1849 L1856 F1874 L1878	E1837-I1876 HydrophobicContact CB-CD1 4.29Å; I1840-I1876 HydrophobicContact CG2-CD1 4.46Å; I1840-I1876 HydrophobicContact CG2-CG2 3.93Å; N1841-I1876 WeakPolarHBondContact ND2-CD1 3.48Å; N1841-I1876 VanDerWaalsContact ND2-CG1 3.34Å; N1841-I1876 WeakPolarHBondContact ND2-CG1 3.45Å; N1841-I1876 WeakPolarHBondContact OD1-CD1 3.38Å; N1841-I1876 VanDerWaalsContact OD1-CG1 3.3Å; N1841-I1876 WeakPolarHBondContact OD1-CG1 3.44Å; N1841-I1876 WeakPolarHBondContact OD1-CG2 3.37Å; H1849-I1876 WeakPolarHBondContact CE1-CD1 3.35Å; H1849-I1876 WeakPolarHBondContact NE2-CD1 3.41Å; L1856-I1876 HydrophobicContact CD1-CD1 4.12Å; F1874-I1876 HydrophobicContact CB-CD1 4.32Å; F1874-I1876 HydrophobicContact CB-CG1 4.21Å; F1874-I1876 PolarHBondContact O-N 3.15Å; I1876-L1878 HydrophobicContact CG2-CD2 4.49Å; I1876-L1878 HydrophobicContact CG2-CG 4.15Å; I1876-L1878 PolarHBondContact O-N 2.93Å; I1876-L1878 VanDerWaalsContact O-N 3.17Å
1877	K	34.7	Very low	35.9	Very low	196.8 Å²	196.8	132 Å²	132	86%	0.856	69%	0.694	S	S	*	*			trans	-91.7	103.3	170.8	-150.7	-178.9	-178.5	-177.1	0	108.6	N1841 N1879	N1841-K1877 PolarHBondContact OD1-N 2.97Å; K1877-N1879 VanDerWaalsContact C-N 3.33Å; K1877-N1879 PolarHBondContact O-N 3.01Å; K1877-N1879 VanDerWaalsContact O-N 3.16Å
1878	L	36	Very low	35.9	Very low	122.4 Å²	122.4	133.2 Å²	133.2	64%	0.641	69%	0.691	S	S	*	*			trans	-63.7	112.6	169.8	-78.8	158.2	0	0	0	109	Y1853 I1876 T1880	Y1853-L1878 HydrophobicContact CE2-CD1 3.79Å; I1876-L1878 HydrophobicContact CG2-CD2 4.49Å; I1876-L1878 HydrophobicContact CG2-CG 4.15Å; I1876-L1878 PolarHBondContact O-N 2.93Å; I1876-L1878 VanDerWaalsContact O-N 3.17Å; L1878-T1880 HydrophobicContact CB-CG2 4.12Å; L1878-T1880 PolarHBondContact O-N 3.4Å
1879	N	33.8	Very low	35.9	Very low	121.8 Å²	121.8	133.8 Å²	133.8	65%	0.651	69%	0.686	S	S	*	*			trans	-81.5	102.1	172.8	-159.5	26.2	0	0	0	108.2	K1877 N1881 D1882	K1877-N1879 VanDerWaalsContact C-N 3.33Å; K1877-N1879 PolarHBondContact O-N 3.01Å; K1877-N1879 VanDerWaalsContact O-N 3.16Å; N1879-N1881 VanDerWaalsContact C-N 3.32Å; N1879-N1881 PolarHBondContact O-N 3.31Å; N1879-N1881 VanDerWaalsContact O-N 3.1Å; N1879-D1882 PolarHBondContact ND2-OD2 2.83Å; N1879-D1882 VanDerWaalsContact ND2-OD2 3.07Å
1880	T	37.6	Very low	36.2	Very low	117 Å²	117	131.4 Å²	131.4	72%	0.718	67%	0.674	S	S	*	*			trans	-76.4	18.9	-173	53.7	0	0	0	0	113.4	L1878 D1882	L1878-T1880 HydrophobicContact CB-CG2 4.12Å; L1878-T1880 PolarHBondContact O-N 3.4Å; T1880-D1882 PolarHBondContact O-N 3.16Å; T1880-D1882 PolarHBondContact OG1-OD2 2.86Å
1881	N	36.1	Very low	36.7	Very low	125.8 Å²	125.8	132.1 Å²	132.1	67%	0.673	67%	0.671	S	S	*	*			trans	-110	27.5	-171	-69.6	-1.3	0	0	0	113.5	N1879 N1883	N1879-N1881 VanDerWaalsContact C-N 3.32Å; N1879-N1881 PolarHBondContact O-N 3.31Å; N1879-N1881 VanDerWaalsContact O-N 3.1Å; N1881-N1883 VanDerWaalsContact C-N 3.27Å; N1881-N1883 PolarHBondContact O-N 3.17Å
1882	D	35	Very low	37.3	Very low	115 Å²	115	127.6 Å²	127.6	62%	0.615	65%	0.653	S	S	*	*			trans	-119.2	96.4	169.9	-75	-38.6	0	0	0	110.8	N1879 T1880 S1884	N1879-D1882 PolarHBondContact ND2-OD2 2.83Å; N1879-D1882 VanDerWaalsContact ND2-OD2 3.07Å; T1880-D1882 PolarHBondContact O-N 3.16Å; T1880-D1882 PolarHBondContact OG1-OD2 2.86Å; D1882-S1884 PolarHBondContact O-N 3.07Å; D1882-S1884 VanDerWaalsContact O-N 3.12Å
1883	N	34.3	Very low	37.9	Very low	170.4 Å²	170.4	123.5 Å²	123.5	91%	0.911	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	27.9	175.8	-81.1	-21.6	0	0	0	113.7	N1881	N1881-N1883 VanDerWaalsContact C-N 3.27Å; N1881-N1883 PolarHBondContact O-N 3.17Å
1884	S	34.1	Very low	38.5	Very low	105 Å²	105	121.3 Å²	121.3	73%	0.734	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.7	25.3	-176.3	61.9	0	0	0	0	115.9	D1882 I1886	D1882-S1884 PolarHBondContact O-N 3.07Å; D1882-S1884 VanDerWaalsContact O-N 3.12Å; S1884-I1886 PolarHBondContact O-N 3.3Å; S1884-I1886 VanDerWaalsContact O-N 3.14Å
1885	C	30.6	Very low	39	Very low	99.8 Å²	99.8	118.2 Å²	118.2	67%	0.674	62%	0.621	S	S	*	*			trans	-103.4	106.8	164.3	-85.3	0	0	0	0	110.1	L1887	C1885-L1887 HydrophobicContact CB-CD1 4.08Å; C1885-L1887 HydrophobicContact CB-CG 4.38Å; C1885-L1887 PolarHBondContact O-N 3.02Å; C1885-L1887 VanDerWaalsContact O-N 3.16Å
1886	I	37	Very low	39.7	Very low	162.2 Å²	162.2	111.5 Å²	111.5	83%	0.832	60%	0.6	S	S	*	*			trans	-74.2	82.8	166.7	-54.2	169.9	0	0	0	107.3	S1884 P1888	S1884-I1886 PolarHBondContact O-N 3.3Å; S1884-I1886 VanDerWaalsContact O-N 3.14Å; I1886-P1888 WeakPolarHBondContact O-CD 3.41Å
1887	L	33.9	Very low	40.4	Very low	123.8 Å²	123.8	109.5 Å²	109.5	65%	0.648	59%	0.589	S	S	*	*			trans	-64.1	133.3	166.7	-88.6	152.4	0	0	0	107.9	C1885 K1889	C1885-L1887 HydrophobicContact CB-CD1 4.08Å; C1885-L1887 HydrophobicContact CB-CG 4.38Å; C1885-L1887 PolarHBondContact O-N 3.02Å; C1885-L1887 VanDerWaalsContact O-N 3.16Å; L1887-K1889 PolarHBondContact O-N 2.94Å; L1887-K1889 VanDerWaalsContact O-N 3.1Å
1888	P	36.5	Very low	41.5	Very low	83.4 Å²	83.4	104.2 Å²	104.2	54%	0.542	57%	0.566	S	S	.	*			trans	-59.7	120.5	177.3	14.8	-19.6	0	0	0	109.4	I1886 I1890 Y2752 T2755	I1886-P1888 WeakPolarHBondContact O-CD 3.41Å; P1888-I1890 VanDerWaalsContact C-N 3.34Å; P1888-I1890 PolarHBondContact O-N 3.21Å; P1888-Y2752 HydrophobicContact CB-CE1 4.07Å; P1888-T2755 WeakPolarHBondContact CB-OG1 3.49Å; P1888-T2755 VanDerWaalsContact CG-OG1 3.3Å; P1888-T2755 WeakPolarHBondContact CG-OG1 3.4Å
1889	K	38.5	Very low	42.5	Very low	154 Å²	154	99.4 Å²	99.4	67%	0.67	54%	0.543	S	S	*	.			trans	-55.4	112.6	176.7	-119.7	-179.3	174	-175.4	0	108.8	D1843 L1887 I1891	D1843-K1889 HydrophobicContact CB-CG 4.4Å; D1843-K1889 WeakPolarHBondContact OD2-CA 3.4Å; D1843-K1889 WeakPolarHBondContact OD2-CE 3.41Å; D1843-K1889 IonicContact OD2-NZ 2.97Å; D1843-K1889 PolarHBondContact OD2-NZ 3.4Å; L1887-K1889 PolarHBondContact O-N 2.94Å; L1887-K1889 VanDerWaalsContact O-N 3.1Å; K1889-I1891 PolarHBondContact O-N 3.22Å
1890	I	42	Very low	43.5	Very low	108.4 Å²	108.4	97.4 Å²	97.4	56%	0.556	53%	0.534	S	S	*	.			trans	-77.1	114.7	173.1	-62.1	173.3	0	0	0	106.5	D1843 P1888 Q1892 S2757	D1843-I1890 PolarHBondContact OD2-N 3.37Å; P1888-I1890 VanDerWaalsContact C-N 3.34Å; P1888-I1890 PolarHBondContact O-N 3.21Å; I1890-Q1892 HydrophobicContact CG2-CG 4.46Å; I1890-Q1892 PolarHBondContact O-N 3.08Å; I1890-S2757 VanDerWaalsContact CG2-OG 3.27Å; I1890-S2757 WeakPolarHBondContact CG2-OG 3.33Å
1891	I	43.6	Very low	43.9	Very low	94 Å²	94	94.6 Å²	94.6	48%	0.482	52%	0.517	S	S	.	.			trans	-74.7	114.5	172.1	-62.6	174.5	0	0	0	106.6	K1889 A2754 L2756	K1889-I1891 PolarHBondContact O-N 3.22Å; I1891-A2754 HydrophobicContact CD1-CB 3.99Å; I1891-A2754 HydrophobicContact CG1-CB 4.36Å; I1891-L2756 HydrophobicContact CB-CD2 3.81Å; I1891-L2756 HydrophobicContact CD1-CD2 3.57Å; I1891-L2756 HydrophobicContact CG1-CD2 3.85Å; I1891-L2756 HydrophobicContact CG2-CD2 4.45Å
1892	Q	47.1	Very low	44.2	Very low	83.4 Å²	83.4	90.5 Å²	90.5	39%	0.39	50%	0.497	S	S	.	.			trans	-73.8	140	168.5	-72.5	177.5	-17.7	0	0	109.1	N1841 Q1842 V1844 I1890 I1894	N1841-Q1892 PolarHBondContact O-NE2 2.75Å; Q1842-Q1892 VanDerWaalsContact OE1-OE1 3.08Å; V1844-Q1892 HydrophobicContact CG2-CB 4Å; I1890-Q1892 HydrophobicContact CG2-CG 4.46Å; I1890-Q1892 PolarHBondContact O-N 3.08Å; Q1892-I1894 PolarHBondContact O-N 3.03Å
1893	P	46.4	Very low	44.6	Very low	52.4 Å²	52.4	89.4 Å²	89.4	34%	0.34	49%	0.491	S	S	.	.			trans	-63.2	135	177.1	26.7	-33.8	0	0	0	110.5	A1895 I1896 R2800	P1893-A1895 PolarHBondContact O-N 3.15Å; P1893-I1896 HydrophobicContact CB-CD1 4.48Å; P1893-I1896 HydrophobicContact CB-CG1 4.11Å; P1893-I1896 HydrophobicContact CG-CD1 3.79Å; P1893-I1896 HydrophobicContact CG-CG1 3.82Å; P1893-R2800 HydrophobicContact CB-CB 4.03Å; P1893-R2800 HydrophobicContact CB-CG 4.26Å
1894	I	51	Low	45	Very low	112 Å²	112	85.2 Å²	85.2	57%	0.574	47%	0.471	S	S	*	.	S	Bend	trans	-61.9	-33.8	179.7	-64.8	167.7	0	0	0	110.2	Q1892 I1896	Q1892-I1894 PolarHBondContact O-N 3.03Å; I1894-I1896 PolarHBondContact O-N 3.38Å; I1894-I1896 VanDerWaalsContact O-N 3.15Å
1895	A	49.5	Very low	45.4	Very low	34.4 Å²	34.4	83.3 Å²	83.3	28%	0.284	47%	0.469	S	S	.	.			trans	-140.5	142.3	175.6	0	0	0	0	0	111	P1893 L1939	P1893-A1895 PolarHBondContact O-N 3.15Å; A1895-L1939 HydrophobicContact CB-CB 4.37Å; A1895-L1939 HydrophobicContact CB-CD1 3.54Å; A1895-L1939 VanDerWaalsContact CB-CD1 3.46Å; A1895-L1939 HydrophobicContact CB-CD2 4.39Å; A1895-L1939 HydrophobicContact CB-CG 4.14Å
1896	I	55	Low	46.3	Very low	75.8 Å²	75.8	81.9 Å²	81.9	39%	0.389	46%	0.46	S	S	.	.			trans	-115.4	120.4	173.8	-56.9	173.8	0	0	0	107.6	P1893 I1894 K1898 D2798 I2799 R2800	P1893-I1896 HydrophobicContact CB-CD1 4.48Å; P1893-I1896 HydrophobicContact CB-CG1 4.11Å; P1893-I1896 HydrophobicContact CG-CD1 3.79Å; P1893-I1896 HydrophobicContact CG-CG1 3.82Å; I1894-I1896 PolarHBondContact O-N 3.38Å; I1894-I1896 VanDerWaalsContact O-N 3.15Å; I1896-K1898 HydrophobicContact CG2-CG 4.16Å; I1896-K1898 PolarHBondContact O-N 3.02Å; I1896-K1898 VanDerWaalsContact O-N 3.08Å; I1896-D2798 HydrophobicContact CG2-CB 3.97Å; I1896-I2799 CarbonylContact C-O 3.57Å; I1896-I2799 WeakPolarHBondContact CA-O 3.5Å; I1896-R2800 HydrophobicContact CG1-CG 4.26Å; I1896-R2800 HydrophobicContact CG2-CG 4.28Å
1897	H	55.9	Low	47.1	Very low	41.4 Å²	41.4	78.6 Å²	78.6	19%	0.192	44%	0.441	C	S	.	.			trans	-100.4	111.4	171.4	177.9	-73.8	0	0	0	109.4	Y1924 L1939 I2799	H1897-Y1924 AromaticContact CE1-CE1 3.7Å; H1897-Y1924 AromaticContact CE1-CZ 3.85Å; H1897-Y1924 PolarHBondContact CE1-OH 3.09Å; H1897-Y1924 AromaticContact ND1-CE1 3.81Å; H1897-L1939 HydrophobicContact CB-CB 4.05Å; H1897-L1939 HydrophobicContact CB-CD1 4.03Å; H1897-L1939 HydrophobicContact CB-CD2 4Å; H1897-L1939 HydrophobicContact CB-CG 4.32Å; H1897-L1939 PolarHBondContact CD2-O 3.19Å; H1897-L1939 PolarHBondContact CE1-O 2.97Å; H1897-L1939 PolarHBondContact ND1-O 2.75Å; H1897-I2799 HydrophobicContact CB-CB 4.35Å; H1897-I2799 PolarHBondContact N-O 2.92Å; H1897-I2799 PolarHBondContact O-N 2.99Å
1898	K	57.2	Low	48.5	Very low	85.2 Å²	85.2	73.5 Å²	73.5	37%	0.37	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-90.7	123	169.6	-64.3	-164	-176.7	178.9	0	109.3	E1826 I1896 V1900 C2797 D2798	E1826-K1898 WeakPolarHBondContact OE1-CD 3.31Å; E1826-K1898 VanDerWaalsContact OE1-CE 3.27Å; E1826-K1898 WeakPolarHBondContact OE1-CE 3.37Å; E1826-K1898 WeakPolarHBondContact OE1-CG 3.42Å; E1826-K1898 IonicContact OE1-NZ 3.24Å; E1826-K1898 PolarHBondContact OE1-NZ 3.39Å; E1826-K1898 WeakPolarHBondContact OE2-CE 3.32Å; E1826-K1898 IonicContact OE2-NZ 3.59Å; E1826-K1898 PolarHBondContact OE2-NZ 2.88Å; I1896-K1898 HydrophobicContact CG2-CG 4.16Å; I1896-K1898 PolarHBondContact O-N 3.02Å; I1896-K1898 VanDerWaalsContact O-N 3.08Å; K1898-V1900 PolarHBondContact O-N 3.18Å; K1898-C2797 VanDerWaalsContact CD-O 3.24Å; K1898-C2797 WeakPolarHBondContact CD-O 3.37Å; K1898-C2797 VanDerWaalsContact CG-O 3.3Å; K1898-C2797 WeakPolarHBondContact CG-O 3.46Å; K1898-D2798 HydrophobicContact CG-CB 4.26Å
1899	P	56.7	Low	50.1	Low	22.8 Å²	22.8	72.3 Å²	72.3	15%	0.148	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-62.2	139.3	176	26.4	-32.9	0	0	0	110.1	T1901 D1908 P1910 Y1924	P1899-T1901 PolarHBondContact O-N 3Å; P1899-D1908 WeakPolarHBondContact CG-O 3.3Å; P1899-P1910 HydrophobicContact CG-CB 4.44Å; P1899-P1910 HydrophobicContact CG-CG 4Å; P1899-Y1924 HydrophobicContact CB-CE1 4.35Å; P1899-Y1924 HydrophobicContact CB-CE2 3.78Å; P1899-Y1924 WeakPolarHBondContact CB-OH 3.35Å; P1899-Y1924 HydrophobicContact CG-CE2 4.48Å
1900	V	54.5	Low	51.8	Low	79 Å²	79	66.5 Å²	66.5	48%	0.479	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-69.9	120.2	-177.1	-179.1	0	0	0	0	109.4	D1354 K1898 P1902 T1941	D1354-V1900 HydrophobicContact CB-CG1 4.48Å; D1354-V1900 WeakPolarHBondContact OD2-CG1 3.3Å; K1898-V1900 PolarHBondContact O-N 3.18Å; V1900-P1902 VanDerWaalsContact O-CD 3.23Å; V1900-P1902 WeakPolarHBondContact O-CD 3.31Å; V1900-T1941 HydrophobicContact CG2-CG2 4.48Å
1901	T	46.2	Very low	53.5	Low	59 Å²	59	63.8 Å²	63.8	36%	0.362	37%	0.368	S	S	.	.			trans	-67.5	122.1	178.6	37.6	0	0	0	0	109.7	P1899 L1903 T1904 G1905 S1906 Q1907 D1908	P1899-T1901 PolarHBondContact O-N 3Å; T1901-L1903 PolarHBondContact O-N 3.18Å; T1901-T1904 PolarHBondContact OG1-N 3.21Å; T1901-T1904 PolarHBondContact OG1-OG1 2.9Å; T1901-G1905 PolarHBondContact O-N 2.91Å; T1901-G1905 PolarHBondContact OG1-N 2.84Å; T1901-G1905 VanDerWaalsContact OG1-N 3.09Å; T1901-S1906 WeakPolarHBondContact CG2-O 3.1Å; T1901-S1906 PolarHBondContact N-O 3.02Å; T1901-S1906 PolarHBondContact OG1-N 2.86Å; T1901-S1906 VanDerWaalsContact OG1-N 3.14Å; T1901-S1906 PolarHBondContact OG1-O 2.97Å; T1901-S1906 VanDerWaalsContact OG1-O 3.05Å; T1901-S1906 PolarHBondContact OG1-OG 3.38Å; T1901-Q1907 HydrophobicContact CG2-CB 4.02Å; T1901-Q1907 HydrophobicContact CG2-CG 3.93Å; T1901-D1908 HydrophobicContact CG2-CB 3.64Å
1902	P	43.9	Very low	55.2	Low	38.2 Å²	38.2	59.7 Å²	59.7	25%	0.248	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-62.5	133.4	166.9	26.7	-32.3	0	0	0	109.4	V1900 T1904 G1905 S1906 D1908	V1900-P1902 VanDerWaalsContact O-CD 3.23Å; V1900-P1902 WeakPolarHBondContact O-CD 3.31Å; P1902-T1904 PolarHBondContact O-N 3.11Å; P1902-G1905 PolarHBondContact O-N 2.9Å; P1902-S1906 WeakPolarHBondContact CG-O 3.49Å; P1902-D1908 HydrophobicContact CG-CB 3.96Å
1903	L	42.2	Very low	57	Low	91.8 Å²	91.8	58.9 Å²	58.9	48%	0.481	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-6.6	-173	-108.2	83.6	0	0	0	114.7	N1347 S1350 N1352 I1353 D1354 T1901 G1905 L1946	N1347-L1903 HydrophobicContact CB-CB 4.01Å; N1347-L1903 HydrophobicContact CB-CD2 4.47Å; N1347-L1903 PolarHBondContact ND2-O 3.12Å; N1347-L1903 WeakPolarHBondContact O-CD2 3.34Å; N1347-L1903 PolarHBondContact OD1-O 3.12Å; N1347-L1903 VanDerWaalsContact OD1-O 3.05Å; S1350-L1903 WeakPolarHBondContact OG-CD2 3.4Å; N1352-L1903 WeakPolarHBondContact O-CD1 3.49Å; I1353-L1903 HydrophobicContact CB-CD2 4Å; I1353-L1903 HydrophobicContact CD1-CD2 4.02Å; I1353-L1903 HydrophobicContact CG1-CD2 3.6Å; I1353-L1903 HydrophobicContact CG2-CD1 4.38Å; I1353-L1903 HydrophobicContact CG2-CD2 4.08Å; D1354-L1903 HydrophobicContact CB-CD1 4.3Å; T1901-L1903 PolarHBondContact O-N 3.18Å; L1903-G1905 PolarHBondContact O-N 3.16Å; L1903-L1946 HydrophobicContact CD1-CD1 4.04Å; L1903-L1946 HydrophobicContact CD1-CD2 4.42Å
1904	T	42.7	Very low	58.8	Low	82.2 Å²	82.2	58.6 Å²	58.6	50%	0.504	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-1.3	179.1	47.4	0	0	0	0	113.7	N1347 F1357 T1901 P1902 S1906	N1347-T1904 VanDerWaalsContact ND2-CG2 3.34Å; N1347-T1904 WeakPolarHBondContact ND2-CG2 3.3Å; N1347-T1904 PolarHBondContact ND2-N 2.81Å; N1347-T1904 WeakPolarHBondContact OD1-CA 3.36Å; F1357-T1904 HydrophobicContact CE2-CG2 4.49Å; T1901-T1904 PolarHBondContact OG1-N 3.21Å; T1901-T1904 PolarHBondContact OG1-OG1 2.9Å; P1902-T1904 PolarHBondContact O-N 3.11Å; T1904-S1906 VanDerWaalsContact C-N 3.26Å; T1904-S1906 PolarHBondContact O-N 2.98Å; T1904-S1906 VanDerWaalsContact O-N 3.09Å; T1904-S1906 PolarHBondContact OG1-O 3.19Å; T1904-S1906 PolarHBondContact OG1-OG 3Å
1905	G	43.2	Very low	60.3	Low	67 Å²	67	55.6 Å²	55.6	69%	0.691	33%	0.325	S	S	*	.	S	Bend	trans	73.2	-12.6	-177.8	0	0	0	0	0	114.1	T1901 P1902 L1903 Q1907	T1901-G1905 PolarHBondContact O-N 2.91Å; T1901-G1905 PolarHBondContact OG1-N 2.84Å; T1901-G1905 VanDerWaalsContact OG1-N 3.09Å; P1902-G1905 PolarHBondContact O-N 2.9Å; L1903-G1905 PolarHBondContact O-N 3.16Å; G1905-Q1907 PolarHBondContact O-N 2.91Å
1906	S	48.4	Very low	61.7	Low	69.6 Å²	69.6	54.6 Å²	54.6	49%	0.487	31%	0.314	S	S	.	.	S	Bend	trans	-81.9	120.4	169.2	60.3	0	0	0	0	109.7	T1901 P1902 T1904 D1908	T1901-S1906 WeakPolarHBondContact CG2-O 3.1Å; T1901-S1906 PolarHBondContact N-O 3.02Å; T1901-S1906 PolarHBondContact OG1-N 2.86Å; T1901-S1906 VanDerWaalsContact OG1-N 3.14Å; T1901-S1906 PolarHBondContact OG1-O 2.97Å; T1901-S1906 VanDerWaalsContact OG1-O 3.05Å; T1901-S1906 PolarHBondContact OG1-OG 3.38Å; P1902-S1906 WeakPolarHBondContact CG-O 3.49Å; T1904-S1906 VanDerWaalsContact C-N 3.26Å; T1904-S1906 PolarHBondContact O-N 2.98Å; T1904-S1906 VanDerWaalsContact O-N 3.09Å; T1904-S1906 PolarHBondContact OG1-O 3.19Å; T1904-S1906 PolarHBondContact OG1-OG 3Å; S1906-D1908 PolarHBondContact O-N 3.02Å
1907	Q	54.5	Low	62.5	Low	92 Å²	92	56.1 Å²	56.1	43%	0.43	32%	0.315	S	S	.	.			trans	-59.8	131.2	169.8	-65.6	-179.1	-15.9	0	0	109.3	T1901 G1905 I1909 I2795	T1901-Q1907 HydrophobicContact CG2-CB 4.02Å; T1901-Q1907 HydrophobicContact CG2-CG 3.93Å; G1905-Q1907 PolarHBondContact O-N 2.91Å; Q1907-I1909 VanDerWaalsContact C-N 3.29Å; Q1907-I1909 HydrophobicContact CB-CG1 4.33Å; Q1907-I1909 WeakPolarHBondContact O-CG1 3.34Å; Q1907-I1909 PolarHBondContact O-N 3.04Å; Q1907-I1909 VanDerWaalsContact O-N 3.11Å; Q1907-I2795 HydrophobicContact CB-CG2 4.35Å; Q1907-I2795 PolarHBondContact OE1-O 3.1Å
1908	D	62.6	Low	63.1	Low	18 Å²	18	56.6 Å²	56.6	10%	0.096	32%	0.321	C	S	.	.			trans	-82.8	117.1	173.9	-159.4	1.7	0	0	0	108	K1356 P1899 T1901 P1902 S1906 P1910 T1926 E1927 S1928 C2797	K1356-D1908 IonicContact NZ-OD2 3.38Å; K1356-D1908 PolarHBondContact NZ-OD2 2.86Å; P1899-D1908 WeakPolarHBondContact CG-O 3.3Å; T1901-D1908 HydrophobicContact CG2-CB 3.64Å; P1902-D1908 HydrophobicContact CG-CB 3.96Å; S1906-D1908 PolarHBondContact O-N 3.02Å; D1908-P1910 WeakPolarHBondContact O-CD 3.42Å; D1908-T1926 HydrophobicContact CB-CG2 4.13Å; D1908-T1926 VanDerWaalsContact CG-CB 3.47Å; D1908-T1926 WeakPolarHBondContact OD1-CB 3.25Å; D1908-T1926 PolarHBondContact OD1-OG1 2.8Å; D1908-T1926 VanDerWaalsContact OD1-OG1 3.08Å; D1908-T1926 WeakPolarHBondContact OD2-CB 3.3Å; D1908-T1926 WeakPolarHBondContact OD2-CG2 2.98Å; D1908-T1926 PolarHBondContact OD2-OG1 2.9Å; D1908-T1926 VanDerWaalsContact OD2-OG1 3.07Å; D1908-E1927 PolarHBondContact OD1-N 3.28Å; D1908-S1928 VanDerWaalsContact CG-OG 3.29Å; D1908-S1928 VanDerWaalsContact OD1-CB 3.32Å; D1908-S1928 WeakPolarHBondContact OD1-CB 3.35Å; D1908-S1928 PolarHBondContact OD1-N 3.38Å; D1908-S1928 VanDerWaalsContact OD1-N 3.11Å; D1908-S1928 PolarHBondContact OD1-OG 2.99Å; D1908-S1928 VanDerWaalsContact OD2-CB 3.26Å; D1908-S1928 WeakPolarHBondContact OD2-CB 3.35Å; D1908-S1928 PolarHBondContact OD2-N 3.41Å; D1908-S1928 PolarHBondContact OD2-OG 2.97Å; D1908-S1928 VanDerWaalsContact OD2-OG 3.06Å; D1908-C2797 PolarHBondContact O-SG 2.97Å
1909	I	70.3	Confident	63.8	Low	57.2 Å²	57.2	53.7 Å²	53.7	29%	0.293	32%	0.315	S	S	.	.			trans	-78.5	123.2	-172.6	-60.3	170.5	0	0	0	108.8	Q1907 I1911 T1926 E1927 L2193 I2795	Q1907-I1909 VanDerWaalsContact C-N 3.29Å; Q1907-I1909 HydrophobicContact CB-CG1 4.33Å; Q1907-I1909 WeakPolarHBondContact O-CG1 3.34Å; Q1907-I1909 PolarHBondContact O-N 3.04Å; Q1907-I1909 VanDerWaalsContact O-N 3.11Å; I1909-I1911 HydrophobicContact CG2-CG1 4.28Å; I1909-I1911 PolarHBondContact O-N 3.17Å; I1909-I1911 VanDerWaalsContact O-N 3.15Å; I1909-T1926 CarbonylContact O-C 3.51Å; I1909-T1926 VanDerWaalsContact O-CA 3.26Å; I1909-T1926 WeakPolarHBondContact O-CA 3.32Å; I1909-E1927 HydrophobicContact CB-CB 4.43Å; I1909-E1927 PolarHBondContact O-N 3.13Å; I1909-L2193 HydrophobicContact CD1-CD2 4.22Å; I1909-L2193 HydrophobicContact CG1-CD2 4.48Å; I1909-I2795 HydrophobicContact CD1-CG2 4.27Å; I1909-I2795 HydrophobicContact CG1-CG2 3.86Å
1910	P	74.4	Confident	64.6	Low	33.2 Å²	33.2	54.5 Å²	54.5	22%	0.216	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	118.1	169.7	29.9	-32.8	0	0	0	109.2	P1899 D1908 Y1924 G1925 C2765 V2785 C2797	P1899-P1910 HydrophobicContact CG-CB 4.44Å; P1899-P1910 HydrophobicContact CG-CG 4Å; D1908-P1910 WeakPolarHBondContact O-CD 3.42Å; P1910-Y1924 HydrophobicContact CB-CD2 3.95Å; P1910-Y1924 HydrophobicContact CB-CE2 4.47Å; P1910-Y1924 HydrophobicContact CB-CG 4.42Å; P1910-G1925 CarbonylContact C-O 3.57Å; P1910-G1925 WeakPolarHBondContact CA-O 3.37Å; P1910-C2765 PolarHBondContact O-SG 2.75Å; P1910-V2785 HydrophobicContact CB-CG1 3.76Å; P1910-V2785 HydrophobicContact CG-CG1 3.31Å; P1910-C2797 HydrophobicContact CG-CB 4.27Å
1911	I	77.1	Confident	65.8	Low	51.8 Å²	51.8	51 Å²	51	27%	0.266	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	-33.7	-176.6	-63.6	174	0	0	0	111.3	I1909 G1925 E1927 P1951 I1952	I1909-I1911 HydrophobicContact CG2-CG1 4.28Å; I1909-I1911 PolarHBondContact O-N 3.17Å; I1909-I1911 VanDerWaalsContact O-N 3.15Å; I1911-G1925 PolarHBondContact N-O 3.06Å; I1911-E1927 VanDerWaalsContact CD1-CA 3.45Å; I1911-E1927 HydrophobicContact CD1-CB 3.66Å; I1911-E1927 HydrophobicContact CD1-CG 3.89Å; I1911-E1927 HydrophobicContact CG1-CB 4.43Å; I1911-P1951 HydrophobicContact CD1-CB 3.97Å; I1911-I1952 VanDerWaalsContact CG2-O 3.29Å; I1911-I1952 WeakPolarHBondContact CG2-O 3.35Å
1912	A	80.4	Confident	67.5	Low	7.8 Å²	7.8	49.2 Å²	49.2	6%	0.064	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	142.8	178.6	0	0	0	0	0	110	Y1924 G1925 I1952 L1955	A1912-Y1924 CarbonylContact O-C 3.49Å; A1912-Y1924 VanDerWaalsContact O-CA 3.3Å; A1912-Y1924 WeakPolarHBondContact O-CA 3.36Å; A1912-Y1924 WeakPolarHBondContact O-CB 3.21Å; A1912-G1925 PolarHBondContact N-O 3.06Å; A1912-G1925 VanDerWaalsContact N-O 3.14Å; A1912-G1925 PolarHBondContact O-N 3.13Å; A1912-I1952 HydrophobicContact CB-CG2 4.05Å; A1912-L1955 HydrophobicContact CB-CD1 4.3Å; A1912-L1955 HydrophobicContact CB-CG 4.1Å
1913	I	85.8	Confident	69.5	Low	65.4 Å²	65.4	47.4 Å²	47.4	34%	0.335	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	142.1	177	-148.1	167.3	0	0	0	109.2	L1922 A1923 I2783 V2785 I2799	I1913-L1922 HydrophobicContact CD1-CD1 3.89Å; I1913-L1922 HydrophobicContact CD1-CD2 4.24Å; I1913-L1922 HydrophobicContact CD1-CG 4.23Å; I1913-L1922 HydrophobicContact CG1-CD1 4.02Å; I1913-L1922 HydrophobicContact CG1-CD2 4.38Å; I1913-L1922 HydrophobicContact CG1-CG 4.26Å; I1913-L1922 HydrophobicContact CG2-CD1 3.53Å; I1913-A1923 CarbonylContact C-O 3.55Å; I1913-A1923 WeakPolarHBondContact CA-O 3.29Å; I1913-A1923 WeakPolarHBondContact CG1-O 3.38Å; I1913-I2783 HydrophobicContact CD1-CG2 3.73Å; I1913-V2785 HydrophobicContact CB-CG2 3.79Å; I1913-V2785 HydrophobicContact CD1-CG2 3.18Å; I1913-V2785 HydrophobicContact CG1-CG2 4.08Å; I1913-V2785 HydrophobicContact CG2-CG2 3.77Å; I1913-I2799 HydrophobicContact CD1-CD1 4.29Å; I1913-I2799 HydrophobicContact CD1-CG2 3.95Å
1914	E	83.8	Confident	71.6	Confident	47.4 Å²	47.4	43.4 Å²	43.4	22%	0.221	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	142.3	174.2	-174.4	72.1	162.3	0	0	109.3	A1923 L1955 C1956 F1957 S2768	E1914-A1923 PolarHBondContact N-O 3.05Å; E1914-A1923 PolarHBondContact O-N 3.01Å; E1914-A1923 VanDerWaalsContact O-O 3.12Å; E1914-L1955 HydrophobicContact CB-CB 3.92Å; E1914-C1956 WeakPolarHBondContact OE1-CA 3.47Å; E1914-F1957 HydrophobicContact CB-CD2 4.32Å; E1914-F1957 HydrophobicContact CB-CE2 4.28Å; E1914-F1957 HydrophobicContact CG-CD2 3.62Å; E1914-F1957 VanDerWaalsContact CG-CD2 3.44Å; E1914-F1957 HydrophobicContact CG-CE2 4.04Å; E1914-F1957 HydrophobicContact CG-CG 4.39Å; E1914-S2768 WeakPolarHBondContact OE2-CB 3.37Å; E1914-S2768 PolarHBondContact OE2-OG 3.15Å
1915	L	82.4	Confident	73.5	Confident	49.4 Å²	49.4	39.5 Å²	39.5	26%	0.259	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	142	173.5	-82.9	162.7	0	0	0	110	L1922 V1936 F1957 S2768 T2770 I2783	L1915-L1922 HydrophobicContact CD2-CB 4.03Å; L1915-L1922 HydrophobicContact CD2-CD1 3.78Å; L1915-L1922 HydrophobicContact CD2-CG 4.29Å; L1915-L1922 HydrophobicContact CG-CD1 3.9Å; L1915-V1936 HydrophobicContact CD2-CG2 3.95Å; L1915-F1957 VanDerWaalsContact C-CE2 3.45Å; L1915-S2768 PolarHBondContact N-OG 3.14Å; L1915-T2770 HydrophobicContact CB-CG2 3.58Å; L1915-T2770 HydrophobicContact CD1-CG2 4.08Å; L1915-T2770 HydrophobicContact CG-CG2 4.43Å; L1915-I2783 HydrophobicContact CD1-CB 4.25Å; L1915-I2783 HydrophobicContact CD1-CD1 4.02Å; L1915-I2783 HydrophobicContact CD1-CG1 4.03Å; L1915-I2783 HydrophobicContact CD2-CD1 3.85Å; L1915-I2783 HydrophobicContact CG-CD1 4.16Å
1916	D	78.5	Confident	75.3	Confident	12 Å²	12	36.4 Å²	36.4	6%	0.064	20%	0.195	C	C	.	.			trans	-66.3	161.6	170.3	99.1	-37.1	0	0	0	111	T1918 G1919 I1920 L1921 F1957 T2770	D1916-T1918 VanDerWaalsContact C-N 3.27Å; D1916-T1918 VanDerWaalsContact CG-OG1 3.28Å; D1916-T1918 PolarHBondContact O-N 2.92Å; D1916-T1918 WeakPolarHBondContact OD1-CG2 3.39Å; D1916-T1918 PolarHBondContact OD1-N 2.85Å; D1916-T1918 PolarHBondContact OD1-OG1 3.27Å; D1916-T1918 WeakPolarHBondContact OD2-CA 3.43Å; D1916-T1918 WeakPolarHBondContact OD2-CB 3.33Å; D1916-T1918 PolarHBondContact OD2-N 3.16Å; D1916-T1918 PolarHBondContact OD2-OG1 3.17Å; D1916-G1919 PolarHBondContact O-N 3.01Å; D1916-G1919 VanDerWaalsContact OD1-C 3.29Å; D1916-G1919 VanDerWaalsContact OD1-CA 3.29Å; D1916-G1919 WeakPolarHBondContact OD1-CA 3.27Å; D1916-G1919 PolarHBondContact OD1-N 3.13Å; D1916-I1920 PolarHBondContact OD1-N 3.09Å; D1916-L1921 HydrophobicContact CB-CB 4.04Å; D1916-L1921 WeakPolarHBondContact CB-O 3.12Å; D1916-L1921 VanDerWaalsContact CG-N 3.25Å; D1916-L1921 PolarHBondContact N-O 3.18Å; D1916-L1921 PolarHBondContact OD1-N 2.95Å; D1916-L1921 VanDerWaalsContact OD1-N 3.09Å; D1916-L1921 WeakPolarHBondContact OD2-CB 3.12Å; D1916-L1921 PolarHBondContact OD2-N 2.87Å; D1916-L1921 VanDerWaalsContact OD2-N 3.1Å; D1916-F1957 HydrophobicContact CB-CD2 4.16Å; D1916-F1957 HydrophobicContact CB-CE1 4.49Å; D1916-F1957 HydrophobicContact CB-CE2 4.12Å; D1916-F1957 HydrophobicContact CB-CG 4.45Å; D1916-F1957 HydrophobicContact CB-CZ 4.28Å; D1916-F1957 VanDerWaalsContact N-CE2 3.29Å; D1916-T2770 WeakPolarHBondContact O-CG2 3.22Å
1917	R	71.2	Confident	76.7	Confident	108.2 Å²	108.2	37.8 Å²	37.8	41%	0.408	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.9	179.8	-73.1	-175.3	-166.2	164.5	11.5	114.3	G1919 D1959 E1960 V1961 P2029	R1917-G1919 VanDerWaalsContact C-N 3.32Å; R1917-D1959 VanDerWaalsContact CB-OD2 3.29Å; R1917-D1959 WeakPolarHBondContact CB-OD2 3.4Å; R1917-D1959 WeakPolarHBondContact CD-OD2 3.45Å; R1917-D1959 WeakPolarHBondContact CG-OD2 3.28Å; R1917-D1959 IonicContact CZ-OD2 3.08Å; R1917-D1959 VanDerWaalsContact NE-CG 3.31Å; R1917-D1959 IonicContact NE-OD2 2.91Å; R1917-D1959 PolarHBondContact NE-OD2 3.14Å; R1917-D1959 PolarHBondContact NH2-O 3.19Å; R1917-D1959 IonicContact NH2-OD2 2.86Å; R1917-D1959 PolarHBondContact NH2-OD2 2.94Å; R1917-E1960 PolarHBondContact NH1-O 2.94Å; R1917-V1961 VanDerWaalsContact NH1-CG2 3.28Å; R1917-P2029 VanDerWaalsContact NH2-CG 3.31Å
1918	T	68.7	Low	77.5	Confident	50.6 Å²	50.6	35.9 Å²	35.9	31%	0.31	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-17	-179.7	69.9	0	0	0	0	113.2	D1916 I1920 L2773	D1916-T1918 VanDerWaalsContact C-N 3.27Å; D1916-T1918 VanDerWaalsContact CG-OG1 3.28Å; D1916-T1918 PolarHBondContact O-N 2.92Å; D1916-T1918 WeakPolarHBondContact OD1-CG2 3.39Å; D1916-T1918 PolarHBondContact OD1-N 2.85Å; D1916-T1918 PolarHBondContact OD1-OG1 3.27Å; D1916-T1918 WeakPolarHBondContact OD2-CA 3.43Å; D1916-T1918 WeakPolarHBondContact OD2-CB 3.33Å; D1916-T1918 PolarHBondContact OD2-N 3.16Å; D1916-T1918 PolarHBondContact OD2-OG1 3.17Å; T1918-I1920 VanDerWaalsContact C-N 3.29Å; T1918-I1920 PolarHBondContact O-N 2.87Å; T1918-I1920 WeakPolarHBondContact OG1-CB 3.33Å; T1918-I1920 WeakPolarHBondContact OG1-CD1 3.34Å; T1918-I1920 VanDerWaalsContact OG1-CG1 3.25Å; T1918-I1920 WeakPolarHBondContact OG1-CG1 3.23Å; T1918-I1920 PolarHBondContact OG1-N 3.1Å; T1918-I1920 VanDerWaalsContact OG1-N 3.09Å; T1918-L2773 HydrophobicContact CG2-CD1 4.37Å; T1918-L2773 WeakPolarHBondContact O-CD1 3.46Å
1919	G	71.6	Confident	78.2	Confident	24.4 Å²	24.4	35.1 Å²	35.1	25%	0.252	19%	0.186	S	C	.	.	S	Bend	trans	73.2	13	-173.3	0	0	0	0	0	113.9	D1916 R1917 V1936	D1916-G1919 PolarHBondContact O-N 3.01Å; D1916-G1919 VanDerWaalsContact OD1-C 3.29Å; D1916-G1919 VanDerWaalsContact OD1-CA 3.29Å; D1916-G1919 WeakPolarHBondContact OD1-CA 3.27Å; D1916-G1919 PolarHBondContact OD1-N 3.13Å; R1917-G1919 VanDerWaalsContact C-N 3.32Å; G1919-V1936 WeakPolarHBondContact O-CB 3.21Å; G1919-V1936 WeakPolarHBondContact O-CG2 3.42Å
1920	I	74.4	Confident	78.7	Confident	41.2 Å²	41.2	32.8 Å²	32.8	21%	0.211	18%	0.175	C	C	.	.	S	Bend	trans	-87.9	-34.6	179.7	-61.1	172	0	0	0	110.7	D1916 T1918 E1935 V1936 P1972 V1999 L2773	D1916-I1920 PolarHBondContact OD1-N 3.09Å; T1918-I1920 VanDerWaalsContact C-N 3.29Å; T1918-I1920 PolarHBondContact O-N 2.87Å; T1918-I1920 WeakPolarHBondContact OG1-CB 3.33Å; T1918-I1920 WeakPolarHBondContact OG1-CD1 3.34Å; T1918-I1920 VanDerWaalsContact OG1-CG1 3.25Å; T1918-I1920 WeakPolarHBondContact OG1-CG1 3.23Å; T1918-I1920 PolarHBondContact OG1-N 3.1Å; T1918-I1920 VanDerWaalsContact OG1-N 3.09Å; I1920-E1935 CarbonylContact O-C 3.6Å; I1920-E1935 WeakPolarHBondContact O-CA 3.35Å; I1920-V1936 WeakPolarHBondContact O-CG2 3.38Å; I1920-V1936 PolarHBondContact O-N 3.01Å; I1920-P1972 HydrophobicContact CD1-CG 4.28Å; I1920-V1999 HydrophobicContact CG2-CG1 4.09Å; I1920-L2773 HydrophobicContact CD1-CD2 4.4Å
1921	L	79	Confident	79.2	Confident	3.8 Å²	3.8	31.2 Å²	31.2	2%	0.02	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.8	-175.5	-61.3	176.5	0	0	0	111.2	D1916 V1933 V1934 L1942 L1976 I1996 V1999	D1916-L1921 HydrophobicContact CB-CB 4.04Å; D1916-L1921 WeakPolarHBondContact CB-O 3.12Å; D1916-L1921 VanDerWaalsContact CG-N 3.25Å; D1916-L1921 PolarHBondContact N-O 3.18Å; D1916-L1921 PolarHBondContact OD1-N 2.95Å; D1916-L1921 VanDerWaalsContact OD1-N 3.09Å; D1916-L1921 WeakPolarHBondContact OD2-CB 3.12Å; D1916-L1921 PolarHBondContact OD2-N 2.87Å; D1916-L1921 VanDerWaalsContact OD2-N 3.1Å; L1921-V1933 HydrophobicContact CB-CG1 4.4Å; L1921-V1933 HydrophobicContact CD2-CG1 4.31Å; L1921-V1934 WeakPolarHBondContact CA-O 3.41Å; L1921-L1942 HydrophobicContact CD2-CD1 3.4Å; L1921-L1942 VanDerWaalsContact CD2-CD1 3.45Å; L1921-L1976 HydrophobicContact CD1-CD2 3.8Å; L1921-I1996 HydrophobicContact CD1-CD1 4.41Å; L1921-I1996 HydrophobicContact CD1-CG1 3.89Å; L1921-V1999 HydrophobicContact CD2-CG2 4.42Å
1922	L	83	Confident	79.5	Confident	22.2 Å²	22.2	28.9 Å²	28.9	12%	0.116	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	125.5	173.1	179.7	96.8	0	0	0	108.9	I1913 L1915 Y1924 V1933 V1934 V1936 I2783 I2799	I1913-L1922 HydrophobicContact CD1-CD1 3.89Å; I1913-L1922 HydrophobicContact CD1-CD2 4.24Å; I1913-L1922 HydrophobicContact CD1-CG 4.23Å; I1913-L1922 HydrophobicContact CG1-CD1 4.02Å; I1913-L1922 HydrophobicContact CG1-CD2 4.38Å; I1913-L1922 HydrophobicContact CG1-CG 4.26Å; I1913-L1922 HydrophobicContact CG2-CD1 3.53Å; L1915-L1922 HydrophobicContact CD2-CB 4.03Å; L1915-L1922 HydrophobicContact CD2-CD1 3.78Å; L1915-L1922 HydrophobicContact CD2-CG 4.29Å; L1915-L1922 HydrophobicContact CG-CD1 3.9Å; L1922-Y1924 HydrophobicContact CD2-CD1 3.82Å; L1922-V1933 CarbonylContact O-C 3.53Å; L1922-V1933 VanDerWaalsContact O-CA 3.29Å; L1922-V1933 WeakPolarHBondContact O-CA 3.3Å; L1922-V1934 HydrophobicContact CB-CB 4.41Å; L1922-V1934 HydrophobicContact CD2-CB 4.41Å; L1922-V1934 PolarHBondContact N-O 3.22Å; L1922-V1934 PolarHBondContact O-N 3.1Å; L1922-V1936 HydrophobicContact CB-CG2 3.82Å; L1922-I2783 HydrophobicContact CD1-CD1 3.76Å; L1922-I2783 HydrophobicContact CD1-CG2 4.35Å; L1922-I2783 HydrophobicContact CD2-CD1 3.86Å; L1922-I2783 HydrophobicContact CD2-CG2 4.45Å; L1922-I2783 HydrophobicContact CG-CD1 4.32Å; L1922-I2799 HydrophobicContact CD2-CG2 4.13Å
1923	A	85.5	Confident	79.6	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.4	170.6	0	0	0	0	0	109.9	I1913 E1914 T1932 V1933 L1955 F1957 L1978	I1913-A1923 CarbonylContact C-O 3.55Å; I1913-A1923 WeakPolarHBondContact CA-O 3.29Å; I1913-A1923 WeakPolarHBondContact CG1-O 3.38Å; E1914-A1923 PolarHBondContact N-O 3.05Å; E1914-A1923 PolarHBondContact O-N 3.01Å; E1914-A1923 VanDerWaalsContact O-O 3.12Å; A1923-T1932 CarbonylContact C-O 3.55Å; A1923-T1932 VanDerWaalsContact CA-O 3.29Å; A1923-T1932 WeakPolarHBondContact CA-O 3.3Å; A1923-V1933 HydrophobicContact CB-CG2 4.23Å; A1923-L1955 HydrophobicContact CB-CD1 4.15Å; A1923-L1955 WeakPolarHBondContact O-CD1 3.26Å; A1923-F1957 HydrophobicContact CB-CE1 4.47Å; A1923-F1957 HydrophobicContact CB-CE2 4.02Å; A1923-F1957 HydrophobicContact CB-CZ 3.63Å; A1923-L1978 HydrophobicContact CB-CD1 4.19Å; A1923-L1978 HydrophobicContact CB-CD2 3.8Å
1924	Y	85.7	Confident	79.2	Confident	8.8 Å²	8.8	25.4 Å²	25.4	4%	0.035	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	146.7	170.5	69.8	-95.5	0	0	0	111.9	H1897 P1899 P1910 A1912 L1922 T1926 V1931 T1932 V1934 I2799	H1897-Y1924 AromaticContact CE1-CE1 3.7Å; H1897-Y1924 AromaticContact CE1-CZ 3.85Å; H1897-Y1924 PolarHBondContact CE1-OH 3.09Å; H1897-Y1924 AromaticContact ND1-CE1 3.81Å; P1899-Y1924 HydrophobicContact CB-CE1 4.35Å; P1899-Y1924 HydrophobicContact CB-CE2 3.78Å; P1899-Y1924 WeakPolarHBondContact CB-OH 3.35Å; P1899-Y1924 HydrophobicContact CG-CE2 4.48Å; P1910-Y1924 HydrophobicContact CB-CD2 3.95Å; P1910-Y1924 HydrophobicContact CB-CE2 4.47Å; P1910-Y1924 HydrophobicContact CB-CG 4.42Å; A1912-Y1924 CarbonylContact O-C 3.49Å; A1912-Y1924 VanDerWaalsContact O-CA 3.3Å; A1912-Y1924 WeakPolarHBondContact O-CA 3.36Å; A1912-Y1924 WeakPolarHBondContact O-CB 3.21Å; L1922-Y1924 HydrophobicContact CD2-CD1 3.82Å; Y1924-T1926 HydrophobicContact CD2-CG2 3.91Å; Y1924-T1926 HydrophobicContact CE2-CG2 3.81Å; Y1924-V1931 CarbonylContact O-C 3.49Å; Y1924-V1931 WeakPolarHBondContact O-CA 3.4Å; Y1924-T1932 VanDerWaalsContact CD1-OG1 3.26Å; Y1924-T1932 WeakPolarHBondContact CD1-OG1 3.31Å; Y1924-T1932 VanDerWaalsContact CD2-OG1 3.22Å; Y1924-T1932 WeakPolarHBondContact CD2-OG1 3.23Å; Y1924-T1932 HydrophobicContact CE1-CG2 3.87Å; Y1924-T1932 WeakPolarHBondContact CE1-OG1 3.39Å; Y1924-T1932 HydrophobicContact CE2-CG2 4.23Å; Y1924-T1932 WeakPolarHBondContact CE2-OG1 3.4Å; Y1924-T1932 VanDerWaalsContact CG-OG1 3.26Å; Y1924-T1932 PolarHBondContact N-O 3.06Å; Y1924-T1932 PolarHBondContact O-N 3.08Å; Y1924-T1932 PolarHBondContact O-OG1 3.27Å; Y1924-T1932 VanDerWaalsContact O-OG1 3.06Å; Y1924-T1932 WeakPolarHBondContact OH-CG2 3.46Å; Y1924-T1932 PolarHBondContact OH-OG1 2.92Å; Y1924-V1934 HydrophobicContact CD1-CG2 4.31Å; Y1924-V1934 HydrophobicContact CE1-CG2 3.72Å; Y1924-I2799 HydrophobicContact CD1-CD1 3.65Å; Y1924-I2799 HydrophobicContact CE1-CD1 4.11Å; Y1924-I2799 HydrophobicContact CG-CD1 3.96Å
1925	G	83.1	Confident	78.8	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134.5	-178.4	0	0	0	0	0	110.4	P1910 I1911 A1912 T1930	P1910-G1925 CarbonylContact C-O 3.57Å; P1910-G1925 WeakPolarHBondContact CA-O 3.37Å; I1911-G1925 PolarHBondContact N-O 3.06Å; A1912-G1925 PolarHBondContact N-O 3.06Å; A1912-G1925 VanDerWaalsContact N-O 3.14Å; A1912-G1925 PolarHBondContact O-N 3.13Å; G1925-T1930 CarbonylContact C-O 3.55Å; G1925-T1930 VanDerWaalsContact CA-O 3.31Å; G1925-T1930 WeakPolarHBondContact CA-O 3.29Å
1926	T	81	Confident	78.3	Confident	2.2 Å²	2.2	24.4 Å²	24.4	1%	0.013	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	167.9	-170.6	66.3	0	0	0	0	113.9	D1908 I1909 Y1924 S1928 G1929 T1930 I1952	D1908-T1926 HydrophobicContact CB-CG2 4.13Å; D1908-T1926 VanDerWaalsContact CG-CB 3.47Å; D1908-T1926 WeakPolarHBondContact OD1-CB 3.25Å; D1908-T1926 PolarHBondContact OD1-OG1 2.8Å; D1908-T1926 VanDerWaalsContact OD1-OG1 3.08Å; D1908-T1926 WeakPolarHBondContact OD2-CB 3.3Å; D1908-T1926 WeakPolarHBondContact OD2-CG2 2.98Å; D1908-T1926 PolarHBondContact OD2-OG1 2.9Å; D1908-T1926 VanDerWaalsContact OD2-OG1 3.07Å; I1909-T1926 CarbonylContact O-C 3.51Å; I1909-T1926 VanDerWaalsContact O-CA 3.26Å; I1909-T1926 WeakPolarHBondContact O-CA 3.32Å; Y1924-T1926 HydrophobicContact CD2-CG2 3.91Å; Y1924-T1926 HydrophobicContact CE2-CG2 3.81Å; T1926-S1928 VanDerWaalsContact C-N 3.31Å; T1926-S1928 PolarHBondContact O-N 3.23Å; T1926-S1928 PolarHBondContact OG1-OG 3.23Å; T1926-G1929 PolarHBondContact O-N 3.12Å; T1926-G1929 VanDerWaalsContact O-N 3.11Å; T1926-T1930 PolarHBondContact N-O 2.89Å; T1926-T1930 WeakPolarHBondContact OG1-CA 3.23Å; T1926-T1930 WeakPolarHBondContact OG1-CB 3.39Å; T1926-T1930 PolarHBondContact OG1-N 3.15Å; T1926-T1930 PolarHBondContact OG1-O 3.11Å; T1926-T1930 PolarHBondContact OG1-OG1 3.13Å; T1926-I1952 PolarHBondContact O-N 3.09Å
1927	E	77.7	Confident	77.6	Confident	98.8 Å²	98.8	30.9 Å²	30.9	46%	0.462	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-35.9	173.2	-164	175.2	174.7	0	0	112.3	D1908 I1909 I1911 G1929 P1951	D1908-E1927 PolarHBondContact OD1-N 3.28Å; I1909-E1927 HydrophobicContact CB-CB 4.43Å; I1909-E1927 PolarHBondContact O-N 3.13Å; I1911-E1927 VanDerWaalsContact CD1-CA 3.45Å; I1911-E1927 HydrophobicContact CD1-CB 3.66Å; I1911-E1927 HydrophobicContact CD1-CG 3.89Å; I1911-E1927 HydrophobicContact CG1-CB 4.43Å; E1927-G1929 PolarHBondContact O-N 3.03Å; E1927-G1929 VanDerWaalsContact O-N 3.13Å; E1927-P1951 HydrophobicContact CG-CB 4.44Å; E1927-P1951 HydrophobicContact CG-CG 3.91Å; E1927-P1951 VanDerWaalsContact O-CA 3.3Å; E1927-P1951 WeakPolarHBondContact O-CA 3.26Å; E1927-P1951 WeakPolarHBondContact O-CD 3.41Å; E1927-P1951 VanDerWaalsContact O-CG 3.27Å; E1927-P1951 WeakPolarHBondContact O-CG 3.31Å
1928	S	71.7	Confident	77.1	Confident	50.6 Å²	50.6	27.2 Å²	27.2	35%	0.354	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	0.6	174.6	82	0	0	0	0	114.8	K1356 Q1360 D1908 T1926 T1930	K1356-S1928 PolarHBondContact NZ-OG 2.9Å; K1356-S1928 VanDerWaalsContact NZ-OG 3.11Å; Q1360-S1928 PolarHBondContact NE2-OG 2.96Å; D1908-S1928 VanDerWaalsContact CG-OG 3.29Å; D1908-S1928 VanDerWaalsContact OD1-CB 3.32Å; D1908-S1928 WeakPolarHBondContact OD1-CB 3.35Å; D1908-S1928 PolarHBondContact OD1-N 3.38Å; D1908-S1928 VanDerWaalsContact OD1-N 3.11Å; D1908-S1928 PolarHBondContact OD1-OG 2.99Å; D1908-S1928 VanDerWaalsContact OD2-CB 3.26Å; D1908-S1928 WeakPolarHBondContact OD2-CB 3.35Å; D1908-S1928 PolarHBondContact OD2-N 3.41Å; D1908-S1928 PolarHBondContact OD2-OG 2.97Å; D1908-S1928 VanDerWaalsContact OD2-OG 3.06Å; T1926-S1928 VanDerWaalsContact C-N 3.31Å; T1926-S1928 PolarHBondContact O-N 3.23Å; T1926-S1928 PolarHBondContact OG1-OG 3.23Å; S1928-T1930 WeakPolarHBondContact OG-CG2 3.4Å
1929	G	77.8	Confident	76.9	Confident	1.2 Å²	1.2	26.8 Å²	26.8	1%	0.012	15%	0.147	C	C	.	.	S	Bend	trans	82.3	17.5	179.4	0	0	0	0	0	114.7	T1926 E1927 H1948 M1950 I1952	T1926-G1929 PolarHBondContact O-N 3.12Å; T1926-G1929 VanDerWaalsContact O-N 3.11Å; E1927-G1929 PolarHBondContact O-N 3.03Å; E1927-G1929 VanDerWaalsContact O-N 3.13Å; G1929-H1948 WeakPolarHBondContact O-CB 3.49Å; G1929-M1950 VanDerWaalsContact CA-O 3.3Å; G1929-M1950 WeakPolarHBondContact CA-O 3.36Å; G1929-I1952 VanDerWaalsContact C-CD1 3.4Å; G1929-I1952 WeakPolarHBondContact O-CD1 3.34Å
1930	T	80.4	Confident	76.6	Confident	9 Å²	9	29.9 Å²	29.9	6%	0.055	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	136.3	175.6	68.7	0	0	0	0	112.3	K1356 G1925 T1926 S1928 F1945 L1946 I1952	K1356-T1930 HydrophobicContact CD-CG2 4.18Å; K1356-T1930 PolarHBondContact NZ-OG1 3.05Å; G1925-T1930 CarbonylContact C-O 3.55Å; G1925-T1930 VanDerWaalsContact CA-O 3.31Å; G1925-T1930 WeakPolarHBondContact CA-O 3.29Å; T1926-T1930 PolarHBondContact N-O 2.89Å; T1926-T1930 WeakPolarHBondContact OG1-CA 3.23Å; T1926-T1930 WeakPolarHBondContact OG1-CB 3.39Å; T1926-T1930 PolarHBondContact OG1-N 3.15Å; T1926-T1930 PolarHBondContact OG1-O 3.11Å; T1926-T1930 PolarHBondContact OG1-OG1 3.13Å; S1928-T1930 WeakPolarHBondContact OG-CG2 3.4Å; T1930-F1945 WeakPolarHBondContact CA-O 3.39Å; T1930-L1946 HydrophobicContact CG2-CD1 3.85Å; T1930-L1946 HydrophobicContact CG2-CD2 3.62Å; T1930-L1946 VanDerWaalsContact CG2-CD2 3.45Å; T1930-L1946 HydrophobicContact CG2-CG 3.85Å; T1930-I1952 VanDerWaalsContact O-CD1 3.27Å; T1930-I1952 WeakPolarHBondContact O-CD1 3.3Å
1931	V	85.2	Confident	76.5	Confident	0.4 Å²	0.4	31.1 Å²	31.1	0%	0.002	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	125.6	170.8	-176.1	0	0	0	0	107.7	Y1924 S1944 F1945 I1952 L1955 L1978	Y1924-V1931 CarbonylContact O-C 3.49Å; Y1924-V1931 WeakPolarHBondContact O-CA 3.4Å; V1931-S1944 CarbonylContact O-C 3.54Å; V1931-S1944 VanDerWaalsContact O-CA 3.28Å; V1931-S1944 WeakPolarHBondContact O-CA 3.37Å; V1931-F1945 HydrophobicContact CB-CB 4.22Å; V1931-F1945 HydrophobicContact CB-CD2 4.17Å; V1931-F1945 HydrophobicContact CG1-CD2 4.22Å; V1931-F1945 PolarHBondContact N-O 3.12Å; V1931-F1945 VanDerWaalsContact N-O 3.11Å; V1931-F1945 WeakPolarHBondContact O-CD2 3.34Å; V1931-F1945 PolarHBondContact O-N 3.22Å; V1931-I1952 HydrophobicContact CB-CD1 4.34Å; V1931-I1952 HydrophobicContact CG2-CD1 3.41Å; V1931-I1952 VanDerWaalsContact CG2-CD1 3.42Å; V1931-I1952 HydrophobicContact CG2-CG1 4.23Å; V1931-L1955 HydrophobicContact CB-CD2 4.48Å; V1931-L1955 HydrophobicContact CG1-CD1 4.36Å; V1931-L1955 HydrophobicContact CG1-CD2 3.94Å; V1931-L1955 HydrophobicContact CG2-CD2 4.19Å; V1931-L1978 HydrophobicContact CG1-CD2 3.61Å
1932	T	82.1	Confident	76.2	Confident	3.2 Å²	3.2	32.3 Å²	32.3	2%	0.02	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	142.5	-179.5	49.3	0	0	0	0	110.1	A1923 Y1924 V1934 T1941 C1943 S1944	A1923-T1932 CarbonylContact C-O 3.55Å; A1923-T1932 VanDerWaalsContact CA-O 3.29Å; A1923-T1932 WeakPolarHBondContact CA-O 3.3Å; Y1924-T1932 VanDerWaalsContact CD1-OG1 3.26Å; Y1924-T1932 WeakPolarHBondContact CD1-OG1 3.31Å; Y1924-T1932 VanDerWaalsContact CD2-OG1 3.22Å; Y1924-T1932 WeakPolarHBondContact CD2-OG1 3.23Å; Y1924-T1932 HydrophobicContact CE1-CG2 3.87Å; Y1924-T1932 WeakPolarHBondContact CE1-OG1 3.39Å; Y1924-T1932 HydrophobicContact CE2-CG2 4.23Å; Y1924-T1932 WeakPolarHBondContact CE2-OG1 3.4Å; Y1924-T1932 VanDerWaalsContact CG-OG1 3.26Å; Y1924-T1932 PolarHBondContact N-O 3.06Å; Y1924-T1932 PolarHBondContact O-N 3.08Å; Y1924-T1932 PolarHBondContact O-OG1 3.27Å; Y1924-T1932 VanDerWaalsContact O-OG1 3.06Å; Y1924-T1932 WeakPolarHBondContact OH-CG2 3.46Å; Y1924-T1932 PolarHBondContact OH-OG1 2.92Å; T1932-V1934 HydrophobicContact CG2-CG2 4.27Å; T1932-T1941 HydrophobicContact CG2-CG2 3.82Å; T1932-C1943 WeakPolarHBondContact CA-O 3.46Å; T1932-S1944 VanDerWaalsContact CG2-OG 3.24Å; T1932-S1944 WeakPolarHBondContact CG2-OG 3.34Å; T1932-S1944 WeakPolarHBondContact OG1-CB 3.22Å; T1932-S1944 PolarHBondContact OG1-OG 3.43Å
1933	V	83.2	Confident	75.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.6	179.1	-176	0	0	0	0	109.3	L1921 L1922 A1923 T1941 L1942 C1943 F1945 L1978 L1992	L1921-V1933 HydrophobicContact CB-CG1 4.4Å; L1921-V1933 HydrophobicContact CD2-CG1 4.31Å; L1922-V1933 CarbonylContact O-C 3.53Å; L1922-V1933 VanDerWaalsContact O-CA 3.29Å; L1922-V1933 WeakPolarHBondContact O-CA 3.3Å; A1923-V1933 HydrophobicContact CB-CG2 4.23Å; V1933-T1941 CarbonylContact O-C 3.49Å; V1933-L1942 PolarHBondContact O-N 3.16Å; V1933-C1943 PolarHBondContact N-O 3.19Å; V1933-C1943 PolarHBondContact O-N 3.08Å; V1933-F1945 HydrophobicContact CG2-CE2 4.01Å; V1933-L1978 HydrophobicContact CG2-CD2 4.28Å; V1933-L1992 HydrophobicContact CG1-CD2 4.49Å; V1933-L1992 HydrophobicContact CG2-CD1 4.29Å; V1933-L1992 HydrophobicContact CG2-CD2 4.05Å
1934	V	77.8	Confident	75.5	Confident	0.6 Å²	0.6	34.2 Å²	34.2	0%	0.004	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	140.1	-174	-179.3	0	0	0	0	109.4	L1921 L1922 Y1924 T1932 L1939 K1940 T1941	L1921-V1934 WeakPolarHBondContact CA-O 3.41Å; L1922-V1934 HydrophobicContact CB-CB 4.41Å; L1922-V1934 HydrophobicContact CD2-CB 4.41Å; L1922-V1934 PolarHBondContact N-O 3.22Å; L1922-V1934 PolarHBondContact O-N 3.1Å; Y1924-V1934 HydrophobicContact CD1-CG2 4.31Å; Y1924-V1934 HydrophobicContact CE1-CG2 3.72Å; T1932-V1934 HydrophobicContact CG2-CG2 4.27Å; V1934-L1939 VanDerWaalsContact CG1-C 3.49Å; V1934-L1939 HydrophobicContact CG1-CD2 4.33Å; V1934-K1940 CarbonylContact C-O 3.47Å; V1934-K1940 VanDerWaalsContact CA-O 3.27Å; V1934-K1940 WeakPolarHBondContact CA-O 3.42Å; V1934-T1941 HydrophobicContact CG2-CG2 4.06Å
1935	E	75	Confident	75.1	Confident	35.6 Å²	35.6	34.1 Å²	34.1	17%	0.166	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	121.2	167.5	178.9	178.2	-148.6	0	0	109.7	I1920 Q1937 S1938 L1939 K1940 L1942 V1999	I1920-E1935 CarbonylContact O-C 3.6Å; I1920-E1935 WeakPolarHBondContact O-CA 3.35Å; E1935-Q1937 VanDerWaalsContact C-N 3.32Å; E1935-Q1937 HydrophobicContact CG-CB 4.44Å; E1935-Q1937 PolarHBondContact O-N 2.89Å; E1935-S1938 WeakPolarHBondContact CB-OG 3.36Å; E1935-S1938 VanDerWaalsContact CD-OG 3.31Å; E1935-S1938 WeakPolarHBondContact CG-OG 2.87Å; E1935-S1938 PolarHBondContact O-N 3.02Å; E1935-S1938 VanDerWaalsContact OE2-CB 3.31Å; E1935-S1938 WeakPolarHBondContact OE2-CB 3.27Å; E1935-S1938 PolarHBondContact OE2-OG 3Å; E1935-L1939 VanDerWaalsContact O-CA 3.23Å; E1935-L1939 WeakPolarHBondContact O-CA 3.36Å; E1935-L1939 PolarHBondContact O-N 3.24Å; E1935-K1940 PolarHBondContact N-O 3.11Å; E1935-L1942 HydrophobicContact CB-CD1 4.05Å; E1935-L1942 HydrophobicContact CB-CD2 4.13Å; E1935-L1942 HydrophobicContact CB-CG 4.11Å; E1935-V1999 HydrophobicContact CG-CG1 4.43Å; E1935-V1999 WeakPolarHBondContact OE1-CG1 3.33Å
1936	V	71	Confident	74.7	Confident	38.8 Å²	38.8	37.7 Å²	37.7	24%	0.235	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-33.9	-173.1	175.2	0	0	0	0	112.5	L1915 G1919 I1920 L1922 L2781 I2783	L1915-V1936 HydrophobicContact CD2-CG2 3.95Å; G1919-V1936 WeakPolarHBondContact O-CB 3.21Å; G1919-V1936 WeakPolarHBondContact O-CG2 3.42Å; I1920-V1936 WeakPolarHBondContact O-CG2 3.38Å; I1920-V1936 PolarHBondContact O-N 3.01Å; L1922-V1936 HydrophobicContact CB-CG2 3.82Å; V1936-L2781 HydrophobicContact CG1-CD2 3.95Å; V1936-I2783 HydrophobicContact CG1-CD1 4.35Å; V1936-I2783 HydrophobicContact CG2-CD1 4.32Å
1937	Q	63.7	Low	74.1	Confident	150.2 Å²	150.2	38.9 Å²	38.9	70%	0.702	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-39.1	-176.8	-65.5	-173.6	3.7	0	0	113.6	E1935	E1935-Q1937 VanDerWaalsContact C-N 3.32Å; E1935-Q1937 HydrophobicContact CG-CB 4.44Å; E1935-Q1937 PolarHBondContact O-N 2.89Å
1938	S	60.6	Low	74.2	Confident	30 Å²	30	34.7 Å²	34.7	21%	0.21	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-13	-177.2	67.7	0	0	0	0	113	N1786 E1935 K1940	N1786-S1938 VanDerWaalsContact ND2-CB 3.33Å; N1786-S1938 WeakPolarHBondContact ND2-CB 3.32Å; E1935-S1938 WeakPolarHBondContact CB-OG 3.36Å; E1935-S1938 VanDerWaalsContact CD-OG 3.31Å; E1935-S1938 WeakPolarHBondContact CG-OG 2.87Å; E1935-S1938 PolarHBondContact O-N 3.02Å; E1935-S1938 VanDerWaalsContact OE2-CB 3.31Å; E1935-S1938 WeakPolarHBondContact OE2-CB 3.27Å; E1935-S1938 PolarHBondContact OE2-OG 3Å; S1938-K1940 PolarHBondContact O-N 3.07Å; S1938-K1940 VanDerWaalsContact O-N 3.11Å; S1938-K1940 VanDerWaalsContact OG-CB 3.23Å; S1938-K1940 WeakPolarHBondContact OG-CB 3.38Å; S1938-K1940 PolarHBondContact OG-N 3.11Å; S1938-K1940 VanDerWaalsContact OG-N 3.14Å
1939	L	65.5	Low	74.4	Confident	41.8 Å²	41.8	38.3 Å²	38.3	22%	0.219	21%	0.211	C	C	.	.			trans	53.1	20.6	-166.4	-67	-177	0	0	0	114	A1822 A1895 H1897 V1934 E1935 T1941	A1822-L1939 HydrophobicContact CB-CD1 4.38Å; A1895-L1939 HydrophobicContact CB-CB 4.37Å; A1895-L1939 HydrophobicContact CB-CD1 3.54Å; A1895-L1939 VanDerWaalsContact CB-CD1 3.46Å; A1895-L1939 HydrophobicContact CB-CD2 4.39Å; A1895-L1939 HydrophobicContact CB-CG 4.14Å; H1897-L1939 HydrophobicContact CB-CB 4.05Å; H1897-L1939 HydrophobicContact CB-CD1 4.03Å; H1897-L1939 HydrophobicContact CB-CD2 4Å; H1897-L1939 HydrophobicContact CB-CG 4.32Å; H1897-L1939 PolarHBondContact CD2-O 3.19Å; H1897-L1939 PolarHBondContact CE1-O 2.97Å; H1897-L1939 PolarHBondContact ND1-O 2.75Å; V1934-L1939 VanDerWaalsContact CG1-C 3.49Å; V1934-L1939 HydrophobicContact CG1-CD2 4.33Å; E1935-L1939 VanDerWaalsContact O-CA 3.23Å; E1935-L1939 WeakPolarHBondContact O-CA 3.36Å; E1935-L1939 PolarHBondContact O-N 3.24Å; L1939-T1941 PolarHBondContact O-N 2.72Å
1940	K	65.5	Low	74.6	Confident	89.8 Å²	89.8	42.7 Å²	42.7	39%	0.39	23%	0.233	S	C	.	.			trans	-76.7	127.3	178	-173.4	172.1	-176.5	162.9	0	110.3	D1783 V1934 E1935 S1938 L1942	D1783-K1940 WeakPolarHBondContact OD1-CD 3.11Å; D1783-K1940 VanDerWaalsContact OD1-CE 3.28Å; D1783-K1940 WeakPolarHBondContact OD1-CE 3.18Å; D1783-K1940 IonicContact OD1-NZ 3.31Å; D1783-K1940 PolarHBondContact OD1-NZ 3.26Å; D1783-K1940 IonicContact OD2-NZ 3.14Å; D1783-K1940 PolarHBondContact OD2-NZ 3.04Å; V1934-K1940 CarbonylContact C-O 3.47Å; V1934-K1940 VanDerWaalsContact CA-O 3.27Å; V1934-K1940 WeakPolarHBondContact CA-O 3.42Å; E1935-K1940 PolarHBondContact N-O 3.11Å; S1938-K1940 PolarHBondContact O-N 3.07Å; S1938-K1940 VanDerWaalsContact O-N 3.11Å; S1938-K1940 VanDerWaalsContact OG-CB 3.23Å; S1938-K1940 WeakPolarHBondContact OG-CB 3.38Å; S1938-K1940 PolarHBondContact OG-N 3.11Å; S1938-K1940 VanDerWaalsContact OG-N 3.14Å; K1940-L1942 VanDerWaalsContact C-N 3.34Å; K1940-L1942 HydrophobicContact CD-CD2 4.44Å; K1940-L1942 PolarHBondContact O-N 2.97Å; K1940-L1942 VanDerWaalsContact O-N 3.13Å
1941	T	72.3	Confident	74.7	Confident	65.4 Å²	65.4	43.1 Å²	43.1	40%	0.401	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	111.8	166.2	52.2	0	0	0	0	109.2	V1900 T1932 V1933 V1934 L1939 C1943	V1900-T1941 HydrophobicContact CG2-CG2 4.48Å; T1932-T1941 HydrophobicContact CG2-CG2 3.82Å; V1933-T1941 CarbonylContact O-C 3.49Å; V1934-T1941 HydrophobicContact CG2-CG2 4.06Å; L1939-T1941 PolarHBondContact O-N 2.72Å; T1941-C1943 PolarHBondContact O-N 2.97Å
1942	L	73.4	Confident	74.8	Confident	29.4 Å²	29.4	43.1 Å²	43.1	15%	0.154	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-40.9	-178.7	-62.3	176.2	0	0	0	111.3	L1921 V1933 E1935 K1940 V1995 V1999 S2006	L1921-L1942 HydrophobicContact CD2-CD1 3.4Å; L1921-L1942 VanDerWaalsContact CD2-CD1 3.45Å; V1933-L1942 PolarHBondContact O-N 3.16Å; E1935-L1942 HydrophobicContact CB-CD1 4.05Å; E1935-L1942 HydrophobicContact CB-CD2 4.13Å; E1935-L1942 HydrophobicContact CB-CG 4.11Å; K1940-L1942 VanDerWaalsContact C-N 3.34Å; K1940-L1942 HydrophobicContact CD-CD2 4.44Å; K1940-L1942 PolarHBondContact O-N 2.97Å; K1940-L1942 VanDerWaalsContact O-N 3.13Å; L1942-V1995 HydrophobicContact CB-CG1 3.79Å; L1942-V1995 HydrophobicContact CD1-CG1 3.59Å; L1942-V1995 VanDerWaalsContact CD1-CG1 3.43Å; L1942-V1995 HydrophobicContact CG-CG1 4.32Å; L1942-V1999 HydrophobicContact CD1-CG2 3.53Å; L1942-V1999 VanDerWaalsContact CD1-CG2 3.46Å; L1942-V1999 HydrophobicContact CD2-CG2 3.93Å; L1942-V1999 HydrophobicContact CG-CG2 4.37Å; L1942-S2006 WeakPolarHBondContact O-CB 3.16Å
1943	C	74.4	Confident	75.1	Confident	14.8 Å²	14.8	45 Å²	45	10%	0.1	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	159.9	176.3	57.9	0	0	0	0	111.3	T1932 V1933 T1941 F1945 V1995	T1932-C1943 WeakPolarHBondContact CA-O 3.46Å; V1933-C1943 PolarHBondContact N-O 3.19Å; V1933-C1943 PolarHBondContact O-N 3.08Å; T1941-C1943 PolarHBondContact O-N 2.97Å; C1943-F1945 HydrophobicContact CB-CE1 3.55Å; C1943-F1945 HydrophobicContact CB-CZ 4.09Å; C1943-F1945 VanDerWaalsContact SG-CE2 3.58Å; C1943-F1945 VanDerWaalsContact SG-CZ 3.58Å; C1943-F1945 WeakPolarHBondContact SG-CZ 3.25Å; C1943-V1995 HydrophobicContact CB-CG2 4.31Å; C1943-V1995 VanDerWaalsContact SG-CG2 3.55Å
1944	S	77.5	Confident	75.3	Confident	46.6 Å²	46.6	45.8 Å²	45.8	33%	0.326	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	130.8	174	-63.1	0	0	0	0	109.1	K1356 V1931 T1932	K1356-S1944 WeakPolarHBondContact CE-OG 3.47Å; K1356-S1944 PolarHBondContact NZ-OG 2.88Å; V1931-S1944 CarbonylContact O-C 3.54Å; V1931-S1944 VanDerWaalsContact O-CA 3.28Å; V1931-S1944 WeakPolarHBondContact O-CA 3.37Å; T1932-S1944 VanDerWaalsContact CG2-OG 3.24Å; T1932-S1944 WeakPolarHBondContact CG2-OG 3.34Å; T1932-S1944 WeakPolarHBondContact OG1-CB 3.22Å; T1932-S1944 PolarHBondContact OG1-OG 3.43Å
1945	F	77.7	Confident	75.9	Confident	6.8 Å²	6.8	46.2 Å²	46.2	3%	0.03	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.3	-176.8	-51.8	-71.3	0	0	0	110.5	T1930 V1931 V1933 C1943 L1978 W1990 L1992 S2008	T1930-F1945 WeakPolarHBondContact CA-O 3.39Å; V1931-F1945 HydrophobicContact CB-CB 4.22Å; V1931-F1945 HydrophobicContact CB-CD2 4.17Å; V1931-F1945 HydrophobicContact CG1-CD2 4.22Å; V1931-F1945 PolarHBondContact N-O 3.12Å; V1931-F1945 VanDerWaalsContact N-O 3.11Å; V1931-F1945 WeakPolarHBondContact O-CD2 3.34Å; V1931-F1945 PolarHBondContact O-N 3.22Å; V1933-F1945 HydrophobicContact CG2-CE2 4.01Å; C1943-F1945 HydrophobicContact CB-CE1 3.55Å; C1943-F1945 HydrophobicContact CB-CZ 4.09Å; C1943-F1945 VanDerWaalsContact SG-CE2 3.58Å; C1943-F1945 VanDerWaalsContact SG-CZ 3.58Å; C1943-F1945 WeakPolarHBondContact SG-CZ 3.25Å; F1945-L1978 HydrophobicContact CE2-CD2 4.26Å; F1945-W1990 HydrophobicContact CB-CD2 4.03Å; F1945-W1990 HydrophobicContact CB-CE3 3.88Å; F1945-W1990 HydrophobicContact CB-CH2 3.75Å; F1945-W1990 HydrophobicContact CB-CZ2 4.01Å; F1945-W1990 HydrophobicContact CB-CZ3 3.67Å; F1945-W1990 HydrophobicContact CD1-CB 4.46Å; F1945-W1990 AromaticContact CD1-CD2 3.85Å; F1945-W1990 HydrophobicContact CD1-CD2 3.95Å; F1945-W1990 AromaticContact CD1-CE3 3.38Å; F1945-W1990 HydrophobicContact CD1-CE3 3.38Å; F1945-W1990 VanDerWaalsContact CD1-CE3 3.43Å; F1945-W1990 HydrophobicContact CD1-CG 4.37Å; F1945-W1990 AromaticContact CD1-CZ3 3.8Å; F1945-W1990 HydrophobicContact CD1-CZ3 3.8Å; F1945-W1990 HydrophobicContact CD2-CB 4.27Å; F1945-W1990 AromaticContact CD2-CD2 3.99Å; F1945-W1990 HydrophobicContact CD2-CD2 4.24Å; F1945-W1990 HydrophobicContact CD2-CE3 4.28Å; F1945-W1990 AromaticContact CD2-CG 3.99Å; F1945-W1990 HydrophobicContact CD2-CG 4.23Å; F1945-W1990 HydrophobicContact CE1-CB 4.22Å; F1945-W1990 HydrophobicContact CE1-CD2 4.33Å; F1945-W1990 AromaticContact CE1-CE3 3.92Å; F1945-W1990 HydrophobicContact CE1-CE3 3.98Å; F1945-W1990 HydrophobicContact CE1-CG 4.34Å; F1945-W1990 HydrophobicContact CE2-CB 4.27Å; F1945-W1990 HydrophobicContact CE2-CG 4.24Å; F1945-W1990 AromaticContact CG-CD2 3.83Å; F1945-W1990 HydrophobicContact CG-CD2 3.83Å; F1945-W1990 AromaticContact CG-CE3 3.66Å; F1945-W1990 HydrophobicContact CG-CE3 3.74Å; F1945-W1990 HydrophobicContact CG-CG 4.33Å; F1945-W1990 HydrophobicContact CG-CH2 4.47Å; F1945-W1990 AromaticContact CG-CZ3 3.96Å; F1945-W1990 HydrophobicContact CG-CZ3 4.03Å; F1945-W1990 HydrophobicContact CZ-CB 4.11Å; F1945-W1990 HydrophobicContact CZ-CG 4.32Å; F1945-L1992 HydrophobicContact CE2-CD2 3.79Å; F1945-L1992 HydrophobicContact CE2-CG 4.49Å; F1945-L1992 HydrophobicContact CZ-CD2 3.64Å; F1945-L1992 VanDerWaalsContact CZ-CD2 3.47Å; F1945-L1992 HydrophobicContact CZ-CG 4.33Å; F1945-S2008 WeakPolarHBondContact CD1-OG 3.23Å; F1945-S2008 WeakPolarHBondContact CE1-OG 3.4Å; F1945-S2008 VanDerWaalsContact CZ-CB 3.4Å; F1945-S2008 VanDerWaalsContact CZ-OG 3.31Å; F1945-S2008 WeakPolarHBondContact CZ-OG 3.21Å
1946	L	74.3	Confident	76.6	Confident	76.8 Å²	76.8	44.9 Å²	44.9	40%	0.402	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.4	168.9	-85	119.6	0	0	0	108.5	I1359 Q1360 E1393 L1903 T1930	I1359-L1946 HydrophobicContact CG2-CD2 3.84Å; Q1360-L1946 HydrophobicContact CG-CD1 4.25Å; Q1360-L1946 HydrophobicContact CG-CD2 4.2Å; E1393-L1946 HydrophobicContact CB-CD1 4.41Å; E1393-L1946 PolarHBondContact OE1-N 3.49Å; E1393-L1946 WeakPolarHBondContact OE2-CD1 3.27Å; L1903-L1946 HydrophobicContact CD1-CD1 4.04Å; L1903-L1946 HydrophobicContact CD1-CD2 4.42Å; T1930-L1946 HydrophobicContact CG2-CD1 3.85Å; T1930-L1946 HydrophobicContact CG2-CD2 3.62Å; T1930-L1946 VanDerWaalsContact CG2-CD2 3.45Å; T1930-L1946 HydrophobicContact CG2-CG 3.85Å
1947	G	68.8	Low	77.4	Confident	27.4 Å²	27.4	43.4 Å²	43.4	28%	0.282	24%	0.238	S	C	.	.			trans	-175.2	-26.6	179.3	0	0	0	0	0	115	L1988	G1947-L1988 VanDerWaalsContact C-CD1 3.48Å
1948	H	79.4	Confident	78.4	Confident	9.4 Å²	9.4	36.4 Å²	36.4	4%	0.044	21%	0.205	C	C	.	.			trans	-82.8	147.8	166.8	-66.1	-66.7	0	0	0	110.6	G1929 S1980 S1982 D1984 S1986 L1988	G1929-H1948 WeakPolarHBondContact O-CB 3.49Å; H1948-S1980 PolarHBondContact CD2-OG 3.16Å; H1948-S1980 VanDerWaalsContact NE2-C 3.33Å; H1948-S1980 VanDerWaalsContact NE2-CB 3.32Å; H1948-S1980 WeakPolarHBondContact NE2-CB 3.31Å; H1948-S1980 PolarHBondContact NE2-O 3.12Å; H1948-S1980 PolarHBondContact NE2-OG 3.09Å; H1948-S1982 VanDerWaalsContact CG-CB 3.47Å; H1948-S1982 WeakPolarHBondContact ND1-CB 3.3Å; H1948-D1984 WeakPolarHBondContact CA-OD2 3.4Å; H1948-D1984 IonicContact ND1-OD1 3.33Å; H1948-D1984 IonicContact ND1-OD2 3.24Å; H1948-S1986 PolarHBondContact CE1-OG 3.22Å; H1948-S1986 VanDerWaalsContact CE1-OG 3.3Å; H1948-S1986 PolarHBondContact ND1-OG 3.02Å; H1948-L1988 VanDerWaalsContact CE1-CG 3.44Å; H1948-L1988 WeakPolarHBondContact CE1-CG 3.33Å
1949	N	77.1	Confident	79	Confident	128 Å²	128	35.7 Å²	35.7	68%	0.684	20%	0.199	S	C	*	.	S	Bend	trans	-97.3	-4.8	178	-67.4	-40.8	0	0	0	112.9	D1984	N1949-D1984 PolarHBondContact N-OD2 3.17Å
1950	M	81.3	Confident	79	Confident	92.6 Å²	92.6	36.2 Å²	36.2	46%	0.456	20%	0.2	S	C	.	.	S	Bend	trans	-145.1	166.5	-169.8	-74.3	-70.6	147.5	0	0	110.4	G1929 I1952 S1982 Q1983 D1984	G1929-M1950 VanDerWaalsContact CA-O 3.3Å; G1929-M1950 WeakPolarHBondContact CA-O 3.36Å; M1950-I1952 PolarHBondContact O-N 3.15Å; M1950-S1982 VanDerWaalsContact C-OG 3.3Å; M1950-S1982 PolarHBondContact O-OG 3.09Å; M1950-Q1983 HydrophobicContact CB-CB 4.06Å; M1950-D1984 HydrophobicContact CB-CB 3.85Å; M1950-D1984 HydrophobicContact CG-CB 3.86Å
1951	P	83.8	Confident	78.6	Confident	18 Å²	18	34.8 Å²	34.8	12%	0.117	20%	0.199	C	C	.	.			trans	-48.3	137.7	-178.4	-30.7	34.2	0	0	0	114.5	I1911 E1927 S1982 Q1983	I1911-P1951 HydrophobicContact CD1-CB 3.97Å; E1927-P1951 HydrophobicContact CG-CB 4.44Å; E1927-P1951 HydrophobicContact CG-CG 3.91Å; E1927-P1951 VanDerWaalsContact O-CA 3.3Å; E1927-P1951 WeakPolarHBondContact O-CA 3.26Å; E1927-P1951 WeakPolarHBondContact O-CD 3.41Å; E1927-P1951 VanDerWaalsContact O-CG 3.27Å; E1927-P1951 WeakPolarHBondContact O-CG 3.31Å; P1951-S1982 VanDerWaalsContact O-CA 3.32Å; P1951-S1982 WeakPolarHBondContact O-CA 3.29Å; P1951-S1982 PolarHBondContact O-OG 3.06Å; P1951-S1982 VanDerWaalsContact O-OG 3.08Å; P1951-Q1983 PolarHBondContact O-N 3.26Å; P1951-Q1983 VanDerWaalsContact O-N 3.08Å
1952	I	87.2	Confident	77.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	128.4	174.5	-64.5	157.2	0	0	0	109.3	I1911 A1912 T1926 G1929 T1930 V1931 M1950 L1955 T1981	I1911-I1952 VanDerWaalsContact CG2-O 3.29Å; I1911-I1952 WeakPolarHBondContact CG2-O 3.35Å; A1912-I1952 HydrophobicContact CB-CG2 4.05Å; T1926-I1952 PolarHBondContact O-N 3.09Å; G1929-I1952 VanDerWaalsContact C-CD1 3.4Å; G1929-I1952 WeakPolarHBondContact O-CD1 3.34Å; T1930-I1952 VanDerWaalsContact O-CD1 3.27Å; T1930-I1952 WeakPolarHBondContact O-CD1 3.3Å; V1931-I1952 HydrophobicContact CB-CD1 4.34Å; V1931-I1952 HydrophobicContact CG2-CD1 3.41Å; V1931-I1952 VanDerWaalsContact CG2-CD1 3.42Å; V1931-I1952 HydrophobicContact CG2-CG1 4.23Å; M1950-I1952 PolarHBondContact O-N 3.15Å; I1952-L1955 HydrophobicContact CG2-CD2 4.05Å; I1952-L1955 HydrophobicContact CG2-CG 4.18Å; I1952-T1981 CarbonylContact C-O 3.59Å; I1952-T1981 WeakPolarHBondContact CA-O 3.37Å; I1952-T1981 WeakPolarHBondContact CG2-O 3.49Å
1953	L	87.6	Confident	76.1	Confident	42.2 Å²	42.2	40.7 Å²	40.7	22%	0.221	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-28.2	-173.1	-61.1	-179.8	0	0	0	113.3	T1981 Q1983 P2021 V2022 T2023	L1953-T1981 PolarHBondContact N-O 3.05Å; L1953-Q1983 HydrophobicContact CD1-CB 4.03Å; L1953-Q1983 HydrophobicContact CG-CB 4.36Å; L1953-P2021 HydrophobicContact CD1-CB 3.98Å; L1953-V2022 WeakPolarHBondContact CD1-O 3.27Å; L1953-T2023 HydrophobicContact CD1-CG2 4.4Å
1954	S	88.1	Confident	74.5	Confident	17 Å²	17	43.6 Å²	43.6	12%	0.119	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	145.2	178	171.9	0	0	0	0	111.1	T1981 S2025	S1954-T1981 WeakPolarHBondContact CA-OG1 3.06Å; S1954-T1981 VanDerWaalsContact CB-OG1 3.29Å; S1954-T1981 WeakPolarHBondContact CB-OG1 3.34Å; S1954-T1981 PolarHBondContact N-OG1 3.14Å; S1954-T1981 VanDerWaalsContact N-OG1 3.16Å; S1954-T1981 PolarHBondContact O-N 3.29Å; S1954-T1981 PolarHBondContact O-OG1 3.3Å; S1954-S2025 PolarHBondContact OG-N 3.12Å; S1954-S2025 VanDerWaalsContact OG-N 3.13Å; S1954-S2025 PolarHBondContact OG-OG 3.13Å
1955	L	90	Very high	72.5	Confident	9 Å²	9	45.8 Å²	45.8	5%	0.047	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	147.9	173	-69.5	175.1	0	0	0	109.2	A1912 E1914 A1923 V1931 I1952 L1978 V1979	A1912-L1955 HydrophobicContact CB-CD1 4.3Å; A1912-L1955 HydrophobicContact CB-CG 4.1Å; E1914-L1955 HydrophobicContact CB-CB 3.92Å; A1923-L1955 HydrophobicContact CB-CD1 4.15Å; A1923-L1955 WeakPolarHBondContact O-CD1 3.26Å; V1931-L1955 HydrophobicContact CB-CD2 4.48Å; V1931-L1955 HydrophobicContact CG1-CD1 4.36Å; V1931-L1955 HydrophobicContact CG1-CD2 3.94Å; V1931-L1955 HydrophobicContact CG2-CD2 4.19Å; I1952-L1955 HydrophobicContact CG2-CD2 4.05Å; I1952-L1955 HydrophobicContact CG2-CG 4.18Å; L1955-L1978 HydrophobicContact CB-CD1 4.43Å; L1955-L1978 HydrophobicContact CD2-CD1 4.46Å; L1955-L1978 HydrophobicContact CD2-CD2 4.48Å; L1955-V1979 CarbonylContact C-O 3.52Å; L1955-V1979 WeakPolarHBondContact CA-O 3.23Å
1956	C	89.7	Confident	70.6	Confident	9.2 Å²	9.2	52 Å²	52	6%	0.062	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	126	175.9	-170.5	0	0	0	0	111.4	E1914 V1979 S2025 W2027	E1914-C1956 WeakPolarHBondContact OE1-CA 3.47Å; C1956-V1979 HydrophobicContact CB-CB 4.45Å; C1956-V1979 PolarHBondContact N-O 3.06Å; C1956-V1979 PolarHBondContact O-N 3.09Å; C1956-S2025 VanDerWaalsContact CB-OG 3.32Å; C1956-S2025 WeakPolarHBondContact CB-OG 3.32Å; C1956-W2027 VanDerWaalsContact SG-CB 3.55Å
1957	F	88.3	Confident	68.6	Low	7.8 Å²	7.8	57.2 Å²	57.2	3%	0.034	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	138.9	174.5	-75.2	-75.5	0	0	0	112.2	E1914 L1915 D1916 A1923 D1959 L1976 L1978 L1992	E1914-F1957 HydrophobicContact CB-CD2 4.32Å; E1914-F1957 HydrophobicContact CB-CE2 4.28Å; E1914-F1957 HydrophobicContact CG-CD2 3.62Å; E1914-F1957 VanDerWaalsContact CG-CD2 3.44Å; E1914-F1957 HydrophobicContact CG-CE2 4.04Å; E1914-F1957 HydrophobicContact CG-CG 4.39Å; L1915-F1957 VanDerWaalsContact C-CE2 3.45Å; D1916-F1957 HydrophobicContact CB-CD2 4.16Å; D1916-F1957 HydrophobicContact CB-CE1 4.49Å; D1916-F1957 HydrophobicContact CB-CE2 4.12Å; D1916-F1957 HydrophobicContact CB-CG 4.45Å; D1916-F1957 HydrophobicContact CB-CZ 4.28Å; D1916-F1957 VanDerWaalsContact N-CE2 3.29Å; A1923-F1957 HydrophobicContact CB-CE1 4.47Å; A1923-F1957 HydrophobicContact CB-CE2 4.02Å; A1923-F1957 HydrophobicContact CB-CZ 3.63Å; F1957-D1959 WeakPolarHBondContact CB-OD1 3.42Å; F1957-L1976 HydrophobicContact CB-CD1 4.41Å; F1957-L1976 HydrophobicContact CD1-CD1 3.97Å; F1957-L1976 HydrophobicContact CD1-CD2 3.99Å; F1957-L1976 HydrophobicContact CD1-CG 4.16Å; F1957-L1976 HydrophobicContact CE1-CD2 3.97Å; F1957-L1976 HydrophobicContact CG-CD1 4.47Å; F1957-L1978 HydrophobicContact CD1-CB 4.29Å; F1957-L1978 HydrophobicContact CD1-CD1 3.89Å; F1957-L1978 HydrophobicContact CD2-CD1 4.36Å; F1957-L1978 HydrophobicContact CE1-CB 4.3Å; F1957-L1978 HydrophobicContact CE1-CD1 3.92Å; F1957-L1978 HydrophobicContact CE1-CG 4.47Å; F1957-L1978 HydrophobicContact CE2-CD1 4.36Å; F1957-L1978 HydrophobicContact CG-CD1 4.15Å; F1957-L1978 HydrophobicContact CZ-CD1 4.19Å; F1957-L1992 HydrophobicContact CD1-CD1 4.3Å; F1957-L1992 HydrophobicContact CE1-CD1 3.63Å
1958	L	84.8	Confident	66.9	Low	3 Å²	3	59.9 Å²	59.9	2%	0.016	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	88.7	176.6	-55.9	177.8	0	0	0	109.4	W1977 V1979 I1989 W2027 L2034 V2048 F2053	L1958-W1977 HydrophobicContact CB-CB 4.07Å; L1958-W1977 HydrophobicContact CD1-CB 3.93Å; L1958-W1977 HydrophobicContact CD1-CE3 4.12Å; L1958-W1977 HydrophobicContact CG-CB 4.4Å; L1958-W1977 PolarHBondContact N-O 3.03Å; L1958-W1977 PolarHBondContact O-N 3.12Å; L1958-V1979 HydrophobicContact CD1-CG2 3.52Å; L1958-V1979 VanDerWaalsContact CD1-CG2 3.45Å; L1958-V1979 HydrophobicContact CD2-CG2 3.82Å; L1958-V1979 HydrophobicContact CG-CG2 3.7Å; L1958-I1989 HydrophobicContact CD1-CD1 4.46Å; L1958-I1989 HydrophobicContact CD1-CG2 4.07Å; L1958-W2027 HydrophobicContact CB-CZ2 4.34Å; L1958-W2027 HydrophobicContact CD2-CB 4.03Å; L1958-W2027 HydrophobicContact CD2-CD2 3.3Å; L1958-W2027 VanDerWaalsContact CD2-CD2 3.44Å; L1958-W2027 HydrophobicContact CD2-CE3 3.32Å; L1958-W2027 VanDerWaalsContact CD2-CE3 3.47Å; L1958-W2027 HydrophobicContact CD2-CG 3.65Å; L1958-W2027 HydrophobicContact CD2-CH2 4.18Å; L1958-W2027 HydrophobicContact CD2-CZ2 4.2Å; L1958-W2027 HydrophobicContact CD2-CZ3 3.78Å; L1958-W2027 HydrophobicContact CG-CD2 4.44Å; L1958-L2034 HydrophobicContact CD2-CD1 4.39Å; L1958-V2048 HydrophobicContact CD1-CG1 4.34Å; L1958-F2053 HydrophobicContact CB-CE2 4.4Å; L1958-F2053 HydrophobicContact CB-CZ 4.37Å; L1958-F2053 WeakPolarHBondContact O-CE2 3.26Å; L1958-F2053 VanDerWaalsContact O-CZ 3.25Å; L1958-F2053 WeakPolarHBondContact O-CZ 3.46Å
1959	D	73.2	Confident	65.1	Low	14.4 Å²	14.4	70.4 Å²	70.4	8%	0.077	38%	0.378	C	S	.	.			trans	-99.1	138.2	177.7	-32.3	-58.1	0	0	0	111	R1917 F1957 L1976 W2027	R1917-D1959 VanDerWaalsContact CB-OD2 3.29Å; R1917-D1959 WeakPolarHBondContact CB-OD2 3.4Å; R1917-D1959 WeakPolarHBondContact CD-OD2 3.45Å; R1917-D1959 WeakPolarHBondContact CG-OD2 3.28Å; R1917-D1959 IonicContact CZ-OD2 3.08Å; R1917-D1959 VanDerWaalsContact NE-CG 3.31Å; R1917-D1959 IonicContact NE-OD2 2.91Å; R1917-D1959 PolarHBondContact NE-OD2 3.14Å; R1917-D1959 PolarHBondContact NH2-O 3.19Å; R1917-D1959 IonicContact NH2-OD2 2.86Å; R1917-D1959 PolarHBondContact NH2-OD2 2.94Å; F1957-D1959 WeakPolarHBondContact CB-OD1 3.42Å; D1959-L1976 HydrophobicContact CB-CD1 4.35Å; D1959-L1976 WeakPolarHBondContact OD1-CD1 3.4Å; D1959-W2027 PolarHBondContact O-NE1 3.2Å; D1959-W2027 VanDerWaalsContact O-NE1 3.07Å
1960	E	64.6	Low	63.3	Low	52.8 Å²	52.8	68.1 Å²	68.1	25%	0.247	37%	0.373	C	S	.	.			trans	-80.5	145.7	172.4	-165.5	157.9	-148.8	0	0	110.3	R1917 R2032 F2053 G2054	R1917-E1960 PolarHBondContact NH1-O 2.94Å; E1960-R2032 IonicContact OE1-CZ 3.46Å; E1960-R2032 IonicContact OE1-NE 3.2Å; E1960-R2032 PolarHBondContact OE1-NE 3.13Å; E1960-R2032 IonicContact OE1-NH1 3.54Å; E1960-R2032 PolarHBondContact OE1-NH1 3.2Å; E1960-R2032 IonicContact OE1-NH2 3.63Å; E1960-R2032 PolarHBondContact OE1-NH2 3.1Å; E1960-F2053 HydrophobicContact CB-CE1 4.04Å; E1960-F2053 HydrophobicContact CB-CZ 4.28Å; E1960-G2054 WeakPolarHBondContact OE2-CA 3.42Å
1961	V	57.7	Low	61.4	Low	59.8 Å²	59.8	69.7 Å²	69.7	36%	0.362	38%	0.381	S	S	.	.			trans	-108.3	101.7	170.4	177.3	0	0	0	0	107	R1917 S1963 P2029 Y2089	R1917-V1961 VanDerWaalsContact NH1-CG2 3.28Å; V1961-S1963 PolarHBondContact O-N 3.02Å; V1961-S1963 VanDerWaalsContact O-N 3.14Å; V1961-P2029 HydrophobicContact CG2-CB 3.83Å; V1961-P2029 HydrophobicContact CG2-CG 4.22Å; V1961-Y2089 HydrophobicContact CB-CE1 4.38Å; V1961-Y2089 HydrophobicContact CG1-CD1 4.16Å; V1961-Y2089 HydrophobicContact CG1-CE1 3.98Å; V1961-Y2089 HydrophobicContact CG2-CE1 4.11Å
1962	D	50.2	Low	59.6	Low	95.2 Å²	95.2	70.9 Å²	70.9	51%	0.509	39%	0.39	S	S	.	.			trans	-61.2	115.5	168.4	-84.5	-22.7	0	0	0	108.4	S1964 R1967	D1962-S1964 PolarHBondContact O-N 2.96Å; D1962-S1964 VanDerWaalsContact O-N 3.12Å; D1962-R1967 IonicContact OD2-CZ 3.17Å; D1962-R1967 IonicContact OD2-NH1 3.08Å; D1962-R1967 PolarHBondContact OD2-NH1 3.08Å
1963	S	43.5	Very low	57.9	Low	123.2 Å²	123.2	72.8 Å²	72.8	86%	0.862	40%	0.403	S	S	*	.	S	Bend	trans	-71.6	-1.4	-178	54.7	0	0	0	0	114	V1961 T1965	V1961-S1963 PolarHBondContact O-N 3.02Å; V1961-S1963 VanDerWaalsContact O-N 3.14Å; S1963-T1965 PolarHBondContact O-N 3.1Å; S1963-T1965 VanDerWaalsContact O-N 3.09Å
1964	S	39.1	Very low	56.4	Low	76 Å²	76	74.3 Å²	74.3	53%	0.531	42%	0.417	S	S	.	.	S	Bend	trans	-93.4	78.4	-178.3	55.4	0	0	0	0	112.2	D1962 T1966	D1962-S1964 PolarHBondContact O-N 2.96Å; D1962-S1964 VanDerWaalsContact O-N 3.12Å; S1964-T1966 PolarHBondContact O-N 2.62Å
1965	T	36.4	Very low	55.4	Low	92.8 Å²	92.8	75.9 Å²	75.9	57%	0.569	42%	0.422	S	S	*	.			trans	-49.7	117	164.8	46	0	0	0	0	114.2	S1963 R1967	S1963-T1965 PolarHBondContact O-N 3.1Å; S1963-T1965 VanDerWaalsContact O-N 3.09Å; T1965-R1967 PolarHBondContact O-N 2.97Å; T1965-R1967 PolarHBondContact OG1-NE 3.44Å
1966	T	37	Very low	54.8	Low	137.6 Å²	137.6	75.6 Å²	75.6	84%	0.844	42%	0.421	S	S	*	.			trans	35.4	58.2	165.1	57.3	0	0	0	0	114.4	S1964	S1964-T1966 PolarHBondContact O-N 2.62Å
1967	R	32	Very low	54.6	Low	186 Å²	186	76.1 Å²	76.1	70%	0.702	42%	0.421	S	S	*	.			trans	-110.8	132.5	155.4	-82.5	179.1	178.8	169	1.8	109.7	D1962 T1965 I1971	D1962-R1967 IonicContact OD2-CZ 3.17Å; D1962-R1967 IonicContact OD2-NH1 3.08Å; D1962-R1967 PolarHBondContact OD2-NH1 3.08Å; T1965-R1967 PolarHBondContact O-N 2.97Å; T1965-R1967 PolarHBondContact OG1-NE 3.44Å; R1967-I1971 HydrophobicContact CG-CD1 4.48Å
1968	S	33.8	Very low	54.6	Low	83.8 Å²	83.8	75.7 Å²	75.7	59%	0.586	42%	0.42	S	S	*	.			trans	-58.1	146.5	175.5	47.8	0	0	0	0	111.4	S1970 I1971	S1968-S1970 VanDerWaalsContact C-N 3.26Å; S1968-S1970 PolarHBondContact O-N 3.4Å; S1968-S1970 PolarHBondContact O-OG 3.17Å; S1968-S1970 PolarHBondContact OG-OG 2.92Å; S1968-I1971 PolarHBondContact O-N 3.31Å
1969	Y	41.6	Very low	54.9	Low	229.6 Å²	229.6	75.6 Å²	75.6	90%	0.9	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.8	29.3	175.8	-69.9	-86.8	0	0	0	115.1
1970	S	39.6	Very low	55.7	Low	81 Å²	81	74.9 Å²	74.9	57%	0.566	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	10.7	-172.6	58.1	0	0	0	0	114.4	S1968 P1972	S1968-S1970 VanDerWaalsContact C-N 3.26Å; S1968-S1970 PolarHBondContact O-N 3.4Å; S1968-S1970 PolarHBondContact O-OG 3.17Å; S1968-S1970 PolarHBondContact OG-OG 2.92Å; S1970-P1972 WeakPolarHBondContact O-CD 3.39Å
1971	I	41.2	Very low	56.9	Low	124.6 Å²	124.6	72.4 Å²	72.4	64%	0.639	40%	0.404	S	S	*	.			trans	-109.7	116.6	178.7	-53	165.9	0	0	0	110.2	R1967 S1968 S1973	R1967-I1971 HydrophobicContact CG-CD1 4.48Å; S1968-I1971 PolarHBondContact O-N 3.31Å; I1971-S1973 PolarHBondContact O-N 2.82Å
1972	P	45.9	Very low	58.4	Low	44.4 Å²	44.4	69.5 Å²	69.5	29%	0.288	39%	0.386	S	S	.	.			trans	-63	145	175.9	7.7	-7.4	0	0	0	111.2	I1920 S1970 S1974 I1996 T2000	I1920-P1972 HydrophobicContact CD1-CG 4.28Å; S1970-P1972 WeakPolarHBondContact O-CD 3.39Å; P1972-S1974 PolarHBondContact O-N 3.04Å; P1972-I1996 HydrophobicContact CB-CD1 4.28Å; P1972-I1996 HydrophobicContact CB-CG1 4.41Å; P1972-I1996 HydrophobicContact CB-CG2 3.81Å; P1972-I1996 HydrophobicContact CG-CG2 4.03Å; P1972-T2000 HydrophobicContact CB-CG2 4.44Å; P1972-T2000 HydrophobicContact CG-CG2 3.84Å
1973	S	51.1	Low	60.2	Low	38.6 Å²	38.6	69.5 Å²	69.5	27%	0.27	38%	0.383	S	S	.	.			trans	-56	138.5	176.8	51.6	0	0	0	0	110.9	I1971 Q1975 I1996	I1971-S1973 PolarHBondContact O-N 2.82Å; S1973-Q1975 WeakPolarHBondContact CB-O 3.37Å; S1973-Q1975 PolarHBondContact O-N 3.1Å; S1973-Q1975 VanDerWaalsContact O-N 3.14Å; S1973-Q1975 PolarHBondContact OG-O 3.06Å; S1973-I1996 VanDerWaalsContact O-CD1 3.29Å; S1973-I1996 WeakPolarHBondContact O-CD1 3.23Å
1974	S	56	Low	62.1	Low	74.6 Å²	74.6	65.8 Å²	65.8	52%	0.522	35%	0.354	S	S	.	.	S	Bend	trans	-66	-13.2	-174.7	61	0	0	0	0	114.4	P1972 K1997	P1972-S1974 PolarHBondContact O-N 3.04Å; S1974-K1997 WeakPolarHBondContact O-CE 3.33Å
1975	Q	67	Low	64.3	Low	50.8 Å²	50.8	63 Å²	63	24%	0.237	34%	0.335	C	S	.	.			trans	-130	132.5	176.2	-63.6	-180	7.9	0	0	109.4	S1973 S1993 S2055	S1973-Q1975 WeakPolarHBondContact CB-O 3.37Å; S1973-Q1975 PolarHBondContact O-N 3.1Å; S1973-Q1975 VanDerWaalsContact O-N 3.14Å; S1973-Q1975 PolarHBondContact OG-O 3.06Å; Q1975-S1993 VanDerWaalsContact CA-OG 3.29Å; Q1975-S1993 WeakPolarHBondContact CA-OG 3.32Å; Q1975-S2055 PolarHBondContact NE2-O 2.85Å
1976	L	77.4	Confident	66.6	Low	3.4 Å²	3.4	59.5 Å²	59.5	2%	0.018	32%	0.315	C	S	.	.			trans	-141.4	126.7	173.1	177	73.9	0	0	0	108.1	L1921 F1957 D1959 L1992 S1993 I1996	L1921-L1976 HydrophobicContact CD1-CD2 3.8Å; F1957-L1976 HydrophobicContact CB-CD1 4.41Å; F1957-L1976 HydrophobicContact CD1-CD1 3.97Å; F1957-L1976 HydrophobicContact CD1-CD2 3.99Å; F1957-L1976 HydrophobicContact CD1-CG 4.16Å; F1957-L1976 HydrophobicContact CE1-CD2 3.97Å; F1957-L1976 HydrophobicContact CG-CD1 4.47Å; D1959-L1976 HydrophobicContact CB-CD1 4.35Å; D1959-L1976 WeakPolarHBondContact OD1-CD1 3.4Å; L1976-L1992 HydrophobicContact CB-CB 4.36Å; L1976-L1992 HydrophobicContact CD2-CB 4.06Å; L1976-L1992 HydrophobicContact CD2-CD1 4.08Å; L1976-L1992 HydrophobicContact CG-CB 4.26Å; L1976-L1992 HydrophobicContact CG-CD1 4.31Å; L1976-L1992 CarbonylContact O-C 3.54Å; L1976-L1992 WeakPolarHBondContact O-CA 3.25Å; L1976-L1992 VanDerWaalsContact O-CB 3.32Å; L1976-L1992 WeakPolarHBondContact O-CB 3.35Å; L1976-L1992 PolarHBondContact O-N 3.13Å; L1976-S1993 PolarHBondContact N-OG 3.23Å; L1976-S1993 PolarHBondContact O-N 2.93Å; L1976-I1996 HydrophobicContact CB-CD1 3.3Å; L1976-I1996 VanDerWaalsContact CB-CD1 3.44Å; L1976-I1996 HydrophobicContact CB-CG1 4.2Å; L1976-I1996 HydrophobicContact CD1-CD1 4.32Å; L1976-I1996 HydrophobicContact CD2-CD1 3.61Å; L1976-I1996 VanDerWaalsContact CD2-CD1 3.45Å; L1976-I1996 HydrophobicContact CD2-CG1 4.09Å; L1976-I1996 HydrophobicContact CG-CD1 3.99Å
1977	W	85.9	Confident	69.1	Low	18.6 Å²	18.6	53 Å²	53	7%	0.07	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	156	173.7	-54.8	-22.4	0	0	0	110.8	L1958 I1989 W1990 D1991 L2011 V2048 L2051 F2053	L1958-W1977 HydrophobicContact CB-CB 4.07Å; L1958-W1977 HydrophobicContact CD1-CB 3.93Å; L1958-W1977 HydrophobicContact CD1-CE3 4.12Å; L1958-W1977 HydrophobicContact CG-CB 4.4Å; L1958-W1977 PolarHBondContact N-O 3.03Å; L1958-W1977 PolarHBondContact O-N 3.12Å; W1977-I1989 HydrophobicContact CB-CG2 4.08Å; W1977-I1989 HydrophobicContact CD2-CG2 4.49Å; W1977-I1989 HydrophobicContact CE3-CG2 4.18Å; W1977-I1989 HydrophobicContact CG-CG2 4.47Å; W1977-W1990 CarbonylContact C-O 3.52Å; W1977-W1990 VanDerWaalsContact CA-O 3.24Å; W1977-W1990 WeakPolarHBondContact CA-O 3.3Å; W1977-W1990 WeakPolarHBondContact CB-O 3.36Å; W1977-D1991 VanDerWaalsContact CD1-OD1 3.3Å; W1977-D1991 PolarHBondContact NE1-OD1 3.03Å; W1977-L2011 HydrophobicContact CB-CD1 4.39Å; W1977-L2011 VanDerWaalsContact CD1-CD1 3.47Å; W1977-L2011 HydrophobicContact CD2-CD1 3.6Å; W1977-L2011 VanDerWaalsContact CD2-CD1 3.43Å; W1977-L2011 HydrophobicContact CE3-CD1 4.09Å; W1977-L2011 HydrophobicContact CG-CD1 3.66Å; W1977-L2011 HydrophobicContact CH2-CD1 4.27Å; W1977-L2011 HydrophobicContact CZ2-CD1 4.02Å; W1977-L2011 HydrophobicContact CZ3-CD1 4.09Å; W1977-V2048 HydrophobicContact CE3-CG1 4.17Å; W1977-V2048 HydrophobicContact CZ3-CG1 3.76Å; W1977-L2051 HydrophobicContact CE3-CD1 4.41Å; W1977-L2051 HydrophobicContact CH2-CB 4.06Å; W1977-L2051 HydrophobicContact CH2-CD1 4.35Å; W1977-L2051 HydrophobicContact CZ3-CB 3.85Å; W1977-L2051 HydrophobicContact CZ3-CD1 3.73Å; W1977-L2051 HydrophobicContact CZ3-CG 4.37Å; W1977-F2053 AromaticContact CD2-CD2 3.6Å; W1977-F2053 HydrophobicContact CD2-CD2 3.6Å; W1977-F2053 AromaticContact CD2-CE2 3.98Å; W1977-F2053 HydrophobicContact CD2-CE2 3.98Å; W1977-F2053 AromaticContact CE2-CD2 3.8Å; W1977-F2053 HydrophobicContact CE3-CB 4.42Å; W1977-F2053 AromaticContact CE3-CD2 3.49Å; W1977-F2053 HydrophobicContact CE3-CD2 3.49Å; W1977-F2053 VanDerWaalsContact CE3-CD2 3.49Å; W1977-F2053 HydrophobicContact CE3-CE1 4.18Å; W1977-F2053 HydrophobicContact CE3-CE2 4.13Å; W1977-F2053 HydrophobicContact CE3-CG 4.29Å; W1977-F2053 HydrophobicContact CE3-CZ 4.19Å; W1977-F2053 HydrophobicContact CG-CD2 4.33Å; W1977-F2053 HydrophobicContact CG-CE2 4.24Å; W1977-F2053 HydrophobicContact CH2-CB 3.69Å; W1977-F2053 AromaticContact CH2-CD1 3.79Å; W1977-F2053 HydrophobicContact CH2-CD1 3.79Å; W1977-F2053 AromaticContact CH2-CD2 3.84Å; W1977-F2053 HydrophobicContact CH2-CD2 4.1Å; W1977-F2053 AromaticContact CH2-CE1 3.41Å; W1977-F2053 HydrophobicContact CH2-CE1 3.41Å; W1977-F2053 AromaticContact CH2-CE2 3.99Å; W1977-F2053 HydrophobicContact CH2-CE2 4.04Å; W1977-F2053 HydrophobicContact CH2-CG 4.26Å; W1977-F2053 AromaticContact CH2-CZ 3.56Å; W1977-F2053 HydrophobicContact CH2-CZ 3.56Å; W1977-F2053 HydrophobicContact CZ2-CB 4.41Å; W1977-F2053 AromaticContact CZ2-CD1 3.97Å; W1977-F2053 HydrophobicContact CZ2-CD1 4.15Å; W1977-F2053 AromaticContact CZ2-CD2 3.92Å; W1977-F2053 HydrophobicContact CZ2-CD2 3.92Å; W1977-F2053 AromaticContact CZ2-CE1 3.83Å; W1977-F2053 HydrophobicContact CZ2-CE1 3.98Å; W1977-F2053 HydrophobicContact CZ2-CZ 4.44Å; W1977-F2053 HydrophobicContact CZ3-CB 3.69Å; W1977-F2053 HydrophobicContact CZ3-CD1 4.31Å; W1977-F2053 AromaticContact CZ3-CD2 3.62Å; W1977-F2053 HydrophobicContact CZ3-CD2 3.62Å; W1977-F2053 AromaticContact CZ3-CE1 3.63Å; W1977-F2053 HydrophobicContact CZ3-CE1 3.63Å; W1977-F2053 HydrophobicContact CZ3-CE2 4.13Å; W1977-F2053 HydrophobicContact CZ3-CG 4.05Å; W1977-F2053 AromaticContact CZ3-CZ 3.44Å; W1977-F2053 HydrophobicContact CZ3-CZ 3.44Å
1978	L	89.1	Confident	71.7	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.6	176.9	175.7	67.3	0	0	0	109.2	A1923 V1931 V1933 F1945 L1955 F1957 I1989 W1990 L1992	A1923-L1978 HydrophobicContact CB-CD1 4.19Å; A1923-L1978 HydrophobicContact CB-CD2 3.8Å; V1931-L1978 HydrophobicContact CG1-CD2 3.61Å; V1933-L1978 HydrophobicContact CG2-CD2 4.28Å; F1945-L1978 HydrophobicContact CE2-CD2 4.26Å; L1955-L1978 HydrophobicContact CB-CD1 4.43Å; L1955-L1978 HydrophobicContact CD2-CD1 4.46Å; L1955-L1978 HydrophobicContact CD2-CD2 4.48Å; F1957-L1978 HydrophobicContact CD1-CB 4.29Å; F1957-L1978 HydrophobicContact CD1-CD1 3.89Å; F1957-L1978 HydrophobicContact CD2-CD1 4.36Å; F1957-L1978 HydrophobicContact CE1-CB 4.3Å; F1957-L1978 HydrophobicContact CE1-CD1 3.92Å; F1957-L1978 HydrophobicContact CE1-CG 4.47Å; F1957-L1978 HydrophobicContact CE2-CD1 4.36Å; F1957-L1978 HydrophobicContact CG-CD1 4.15Å; F1957-L1978 HydrophobicContact CZ-CD1 4.19Å; L1978-I1989 CarbonylContact O-C 3.52Å; L1978-I1989 WeakPolarHBondContact O-CA 3.35Å; L1978-W1990 HydrophobicContact CB-CB 4.4Å; L1978-W1990 PolarHBondContact N-O 3.01Å; L1978-W1990 VanDerWaalsContact O-CD1 3.25Å; L1978-W1990 PolarHBondContact O-N 3.12Å; L1978-L1992 HydrophobicContact CB-CD1 3.66Å; L1978-L1992 HydrophobicContact CB-CG 4.38Å; L1978-L1992 HydrophobicContact CD2-CD1 4.24Å; L1978-L1992 HydrophobicContact CG-CD1 4.48Å
1979	V	90.1	Very high	74.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	135.4	171.2	-177.8	0	0	0	0	109.1	L1955 C1956 L1958 T1981 I1987 L1988 I1989 L2034	L1955-V1979 CarbonylContact C-O 3.52Å; L1955-V1979 WeakPolarHBondContact CA-O 3.23Å; C1956-V1979 HydrophobicContact CB-CB 4.45Å; C1956-V1979 PolarHBondContact N-O 3.06Å; C1956-V1979 PolarHBondContact O-N 3.09Å; L1958-V1979 HydrophobicContact CD1-CG2 3.52Å; L1958-V1979 VanDerWaalsContact CD1-CG2 3.45Å; L1958-V1979 HydrophobicContact CD2-CG2 3.82Å; L1958-V1979 HydrophobicContact CG-CG2 3.7Å; V1979-T1981 HydrophobicContact CG1-CG2 4.37Å; V1979-I1987 HydrophobicContact CG1-CG2 3.88Å; V1979-L1988 WeakPolarHBondContact CA-O 3.33Å; V1979-I1989 HydrophobicContact CG2-CD1 4.47Å; V1979-I1989 HydrophobicContact CG2-CG1 4.23Å; V1979-L2034 HydrophobicContact CB-CD1 4.47Å; V1979-L2034 HydrophobicContact CG1-CD1 4.34Å; V1979-L2034 HydrophobicContact CG1-CD2 4.15Å; V1979-L2034 HydrophobicContact CG2-CD1 4.07Å; V1979-L2034 HydrophobicContact CG2-CD2 4.05Å
1980	S	91.1	Very high	76.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	141.6	168.8	60.3	0	0	0	0	111.2	H1948 I1987 L1988 W1990	H1948-S1980 PolarHBondContact CD2-OG 3.16Å; H1948-S1980 VanDerWaalsContact NE2-C 3.33Å; H1948-S1980 VanDerWaalsContact NE2-CB 3.32Å; H1948-S1980 WeakPolarHBondContact NE2-CB 3.31Å; H1948-S1980 PolarHBondContact NE2-O 3.12Å; H1948-S1980 PolarHBondContact NE2-OG 3.09Å; S1980-I1987 WeakPolarHBondContact O-CA 3.35Å; S1980-L1988 PolarHBondContact N-O 2.93Å; S1980-L1988 PolarHBondContact O-N 2.98Å; S1980-W1990 PolarHBondContact OG-NE1 3.32Å
1981	T	89.9	Confident	78.3	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	142.4	177.7	66.6	0	0	0	0	109.9	I1952 L1953 S1954 V1979 I1987 V2022	I1952-T1981 CarbonylContact C-O 3.59Å; I1952-T1981 WeakPolarHBondContact CA-O 3.37Å; I1952-T1981 WeakPolarHBondContact CG2-O 3.49Å; L1953-T1981 PolarHBondContact N-O 3.05Å; S1954-T1981 WeakPolarHBondContact CA-OG1 3.06Å; S1954-T1981 VanDerWaalsContact CB-OG1 3.29Å; S1954-T1981 WeakPolarHBondContact CB-OG1 3.34Å; S1954-T1981 PolarHBondContact N-OG1 3.14Å; S1954-T1981 VanDerWaalsContact N-OG1 3.16Å; S1954-T1981 PolarHBondContact O-N 3.29Å; S1954-T1981 PolarHBondContact O-OG1 3.3Å; V1979-T1981 HydrophobicContact CG1-CG2 4.37Å; T1981-I1987 HydrophobicContact CG2-CG1 4.12Å; T1981-I1987 HydrophobicContact CG2-CG2 4.38Å; T1981-V2022 WeakPolarHBondContact CB-O 3.31Å; T1981-V2022 HydrophobicContact CG2-CB 4.49Å; T1981-V2022 HydrophobicContact CG2-CG1 3.78Å; T1981-V2022 PolarHBondContact OG1-O 3.41Å
1982	S	88.6	Confident	80.1	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	161.4	-173.7	171.1	0	0	0	0	112.8	H1948 M1950 P1951 D1984 A1985 S1986 V2022	H1948-S1982 VanDerWaalsContact CG-CB 3.47Å; H1948-S1982 WeakPolarHBondContact ND1-CB 3.3Å; M1950-S1982 VanDerWaalsContact C-OG 3.3Å; M1950-S1982 PolarHBondContact O-OG 3.09Å; P1951-S1982 VanDerWaalsContact O-CA 3.32Å; P1951-S1982 WeakPolarHBondContact O-CA 3.29Å; P1951-S1982 PolarHBondContact O-OG 3.06Å; P1951-S1982 VanDerWaalsContact O-OG 3.08Å; S1982-D1984 VanDerWaalsContact CB-OD1 3.3Å; S1982-D1984 WeakPolarHBondContact CB-OD1 3.43Å; S1982-D1984 PolarHBondContact O-N 3.05Å; S1982-D1984 VanDerWaalsContact OG-CG 3.29Å; S1982-D1984 PolarHBondContact OG-N 3.15Å; S1982-D1984 VanDerWaalsContact OG-N 3.17Å; S1982-D1984 PolarHBondContact OG-OD1 3.07Å; S1982-D1984 PolarHBondContact OG-OD2 3.3Å; S1982-A1985 PolarHBondContact O-N 3.19Å; S1982-A1985 VanDerWaalsContact O-N 3.14Å; S1982-S1986 PolarHBondContact N-O 3.17Å; S1982-V2022 PolarHBondContact O-N 3.14Å
1983	Q	87.3	Confident	81.4	Confident	93.8 Å²	93.8	19.6 Å²	19.6	44%	0.438	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.7	170.4	-176.5	175.5	-11.5	0	0	113.3	M1950 P1951 L1953 A1985 P2021	M1950-Q1983 HydrophobicContact CB-CB 4.06Å; P1951-Q1983 PolarHBondContact O-N 3.26Å; P1951-Q1983 VanDerWaalsContact O-N 3.08Å; L1953-Q1983 HydrophobicContact CD1-CB 4.03Å; L1953-Q1983 HydrophobicContact CG-CB 4.36Å; Q1983-A1985 PolarHBondContact O-N 3.24Å; Q1983-A1985 VanDerWaalsContact O-N 3.16Å; Q1983-P2021 HydrophobicContact CB-CB 4.45Å; Q1983-P2021 HydrophobicContact CB-CG 4.45Å; Q1983-P2021 HydrophobicContact CG-CB 4.23Å; Q1983-P2021 HydrophobicContact CG-CG 3.82Å; Q1983-P2021 WeakPolarHBondContact O-CG 3.26Å
1984	D	84.3	Confident	82.2	Confident	47 Å²	47	20.3 Å²	20.3	25%	0.251	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	6.8	171.9	63.8	19	0	0	0	114.6	H1948 N1949 M1950 S1982 S1986	H1948-D1984 WeakPolarHBondContact CA-OD2 3.4Å; H1948-D1984 IonicContact ND1-OD1 3.33Å; H1948-D1984 IonicContact ND1-OD2 3.24Å; N1949-D1984 PolarHBondContact N-OD2 3.17Å; M1950-D1984 HydrophobicContact CB-CB 3.85Å; M1950-D1984 HydrophobicContact CG-CB 3.86Å; S1982-D1984 VanDerWaalsContact CB-OD1 3.3Å; S1982-D1984 WeakPolarHBondContact CB-OD1 3.43Å; S1982-D1984 PolarHBondContact O-N 3.05Å; S1982-D1984 VanDerWaalsContact OG-CG 3.29Å; S1982-D1984 PolarHBondContact OG-N 3.15Å; S1982-D1984 VanDerWaalsContact OG-N 3.17Å; S1982-D1984 PolarHBondContact OG-OD1 3.07Å; S1982-D1984 PolarHBondContact OG-OD2 3.3Å; D1984-S1986 VanDerWaalsContact CG-OG 3.29Å; D1984-S1986 PolarHBondContact O-N 3.21Å; D1984-S1986 WeakPolarHBondContact OD1-CA 3.4Å; D1984-S1986 VanDerWaalsContact OD1-CB 3.22Å; D1984-S1986 WeakPolarHBondContact OD1-CB 3.24Å; D1984-S1986 PolarHBondContact OD1-N 2.97Å; D1984-S1986 PolarHBondContact OD1-OG 3.23Å; D1984-S1986 PolarHBondContact OD2-OG 3.07Å
1985	A	84.8	Confident	82.8	Confident	17.2 Å²	17.2	16.8 Å²	16.8	14%	0.142	9%	0.088	C	C	.	.	S	Bend	trans	65.2	11.1	-175.9	0	0	0	0	0	115.1	S1982 Q1983 H2018 K2020	S1982-A1985 PolarHBondContact O-N 3.19Å; S1982-A1985 VanDerWaalsContact O-N 3.14Å; Q1983-A1985 PolarHBondContact O-N 3.24Å; Q1983-A1985 VanDerWaalsContact O-N 3.16Å; A1985-H2018 HydrophobicContact CB-CB 4.46Å; A1985-K2020 WeakPolarHBondContact CB-O 3.22Å
1986	S	85.2	Confident	82.7	Confident	19.4 Å²	19.4	15.2 Å²	15.2	14%	0.136	8%	0.081	C	C	.	.			trans	-90.3	149.4	173	74.7	0	0	0	0	112.2	H1948 S1982 D1984	H1948-S1986 PolarHBondContact CE1-OG 3.22Å; H1948-S1986 VanDerWaalsContact CE1-OG 3.3Å; H1948-S1986 PolarHBondContact ND1-OG 3.02Å; S1982-S1986 PolarHBondContact N-O 3.17Å; D1984-S1986 VanDerWaalsContact CG-OG 3.29Å; D1984-S1986 PolarHBondContact O-N 3.21Å; D1984-S1986 WeakPolarHBondContact OD1-CA 3.4Å; D1984-S1986 VanDerWaalsContact OD1-CB 3.22Å; D1984-S1986 WeakPolarHBondContact OD1-CB 3.24Å; D1984-S1986 PolarHBondContact OD1-N 2.97Å; D1984-S1986 PolarHBondContact OD1-OG 3.23Å; D1984-S1986 PolarHBondContact OD2-OG 3.07Å
1987	I	88.8	Confident	82	Confident	0.8 Å²	0.8	19.9 Å²	19.9	0%	0.004	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	121.4	175.6	-61.2	154.4	0	0	0	105.8	V1979 S1980 T1981 S2013 L2014 V2022 T2036 W2046	V1979-I1987 HydrophobicContact CG1-CG2 3.88Å; S1980-I1987 WeakPolarHBondContact O-CA 3.35Å; T1981-I1987 HydrophobicContact CG2-CG1 4.12Å; T1981-I1987 HydrophobicContact CG2-CG2 4.38Å; I1987-S2013 WeakPolarHBondContact O-CA 3.17Å; I1987-L2014 HydrophobicContact CB-CB 4.01Å; I1987-L2014 HydrophobicContact CG2-CB 4.14Å; I1987-L2014 HydrophobicContact CG2-CD1 4.08Å; I1987-L2014 HydrophobicContact CG2-CG 4.44Å; I1987-L2014 PolarHBondContact O-N 3.18Å; I1987-V2022 HydrophobicContact CD1-CG1 4.26Å; I1987-V2022 HydrophobicContact CD1-CG2 4.18Å; I1987-V2022 HydrophobicContact CG1-CB 4.4Å; I1987-V2022 HydrophobicContact CG1-CG1 4.07Å; I1987-V2022 HydrophobicContact CG1-CG2 4.14Å; I1987-T2036 HydrophobicContact CD1-CG2 3.88Å; I1987-T2036 HydrophobicContact CG1-CG2 4.36Å; I1987-T2036 HydrophobicContact CG2-CG2 4.41Å; I1987-W2046 HydrophobicContact CD1-CZ2 3.93Å
1988	L	87.3	Confident	80.8	Confident	4 Å²	4	20.1 Å²	20.1	2%	0.021	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	143.4	-176.8	-58.9	-177.8	0	0	0	110.1	G1947 H1948 V1979 S1980 W1990 Q2010 S2013	G1947-L1988 VanDerWaalsContact C-CD1 3.48Å; H1948-L1988 VanDerWaalsContact CE1-CG 3.44Å; H1948-L1988 WeakPolarHBondContact CE1-CG 3.33Å; V1979-L1988 WeakPolarHBondContact CA-O 3.33Å; S1980-L1988 PolarHBondContact N-O 2.93Å; S1980-L1988 PolarHBondContact O-N 2.98Å; L1988-W1990 HydrophobicContact CB-CZ2 3.9Å; L1988-W1990 HydrophobicContact CD1-CH2 3.95Å; L1988-W1990 HydrophobicContact CD1-CZ2 3.53Å; L1988-W1990 VanDerWaalsContact CD1-CZ2 3.47Å; L1988-W1990 HydrophobicContact CG-CZ2 4.31Å; L1988-Q2010 VanDerWaalsContact CD2-NE2 3.34Å; L1988-S2013 VanDerWaalsContact CD2-CB 3.47Å; L1988-S2013 WeakPolarHBondContact CD2-OG 3.34Å
1989	I	87.1	Confident	79.3	Confident	0.4 Å²	0.4	22 Å²	22	0%	0.002	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.2	173.7	-50.4	-169.4	0	0	0	108.7	L1958 W1977 L1978 V1979 Q2010 L2011 C2012 L2014 L2034 L2051	L1958-I1989 HydrophobicContact CD1-CD1 4.46Å; L1958-I1989 HydrophobicContact CD1-CG2 4.07Å; W1977-I1989 HydrophobicContact CB-CG2 4.08Å; W1977-I1989 HydrophobicContact CD2-CG2 4.49Å; W1977-I1989 HydrophobicContact CE3-CG2 4.18Å; W1977-I1989 HydrophobicContact CG-CG2 4.47Å; L1978-I1989 CarbonylContact O-C 3.52Å; L1978-I1989 WeakPolarHBondContact O-CA 3.35Å; V1979-I1989 HydrophobicContact CG2-CD1 4.47Å; V1979-I1989 HydrophobicContact CG2-CG1 4.23Å; I1989-Q2010 CarbonylContact O-C 3.55Å; I1989-L2011 HydrophobicContact CB-CB 4.46Å; I1989-L2011 HydrophobicContact CG2-CB 4.39Å; I1989-L2011 HydrophobicContact CG2-CD1 4.11Å; I1989-L2011 PolarHBondContact O-N 3.1Å; I1989-C2012 HydrophobicContact CB-CB 4.19Å; I1989-C2012 HydrophobicContact CD1-CB 4.22Å; I1989-C2012 HydrophobicContact CG1-CB 4.24Å; I1989-C2012 PolarHBondContact N-O 3.08Å; I1989-C2012 VanDerWaalsContact N-O 3.1Å; I1989-C2012 PolarHBondContact O-N 2.94Å; I1989-L2014 HydrophobicContact CD1-CD1 3.99Å; I1989-L2014 HydrophobicContact CD1-CG 4.48Å; I1989-L2014 HydrophobicContact CG1-CD1 4.29Å; I1989-L2034 HydrophobicContact CD1-CD2 4.42Å; I1989-L2051 HydrophobicContact CD1-CD1 4.35Å
1990	W	85	Confident	77.6	Confident	6.8 Å²	6.8	25.6 Å²	25.6	3%	0.026	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	138.2	-176.1	-50.1	97.3	0	0	0	111	F1945 W1977 L1978 S1980 L1988 Q2010	F1945-W1990 HydrophobicContact CB-CD2 4.03Å; F1945-W1990 HydrophobicContact CB-CE3 3.88Å; F1945-W1990 HydrophobicContact CB-CH2 3.75Å; F1945-W1990 HydrophobicContact CB-CZ2 4.01Å; F1945-W1990 HydrophobicContact CB-CZ3 3.67Å; F1945-W1990 HydrophobicContact CD1-CB 4.46Å; F1945-W1990 AromaticContact CD1-CD2 3.85Å; F1945-W1990 HydrophobicContact CD1-CD2 3.95Å; F1945-W1990 AromaticContact CD1-CE3 3.38Å; F1945-W1990 HydrophobicContact CD1-CE3 3.38Å; F1945-W1990 VanDerWaalsContact CD1-CE3 3.43Å; F1945-W1990 HydrophobicContact CD1-CG 4.37Å; F1945-W1990 AromaticContact CD1-CZ3 3.8Å; F1945-W1990 HydrophobicContact CD1-CZ3 3.8Å; F1945-W1990 HydrophobicContact CD2-CB 4.27Å; F1945-W1990 AromaticContact CD2-CD2 3.99Å; F1945-W1990 HydrophobicContact CD2-CD2 4.24Å; F1945-W1990 HydrophobicContact CD2-CE3 4.28Å; F1945-W1990 AromaticContact CD2-CG 3.99Å; F1945-W1990 HydrophobicContact CD2-CG 4.23Å; F1945-W1990 HydrophobicContact CE1-CB 4.22Å; F1945-W1990 HydrophobicContact CE1-CD2 4.33Å; F1945-W1990 AromaticContact CE1-CE3 3.92Å; F1945-W1990 HydrophobicContact CE1-CE3 3.98Å; F1945-W1990 HydrophobicContact CE1-CG 4.34Å; F1945-W1990 HydrophobicContact CE2-CB 4.27Å; F1945-W1990 HydrophobicContact CE2-CG 4.24Å; F1945-W1990 AromaticContact CG-CD2 3.83Å; F1945-W1990 HydrophobicContact CG-CD2 3.83Å; F1945-W1990 AromaticContact CG-CE3 3.66Å; F1945-W1990 HydrophobicContact CG-CE3 3.74Å; F1945-W1990 HydrophobicContact CG-CG 4.33Å; F1945-W1990 HydrophobicContact CG-CH2 4.47Å; F1945-W1990 AromaticContact CG-CZ3 3.96Å; F1945-W1990 HydrophobicContact CG-CZ3 4.03Å; F1945-W1990 HydrophobicContact CZ-CB 4.11Å; F1945-W1990 HydrophobicContact CZ-CG 4.32Å; W1977-W1990 CarbonylContact C-O 3.52Å; W1977-W1990 VanDerWaalsContact CA-O 3.24Å; W1977-W1990 WeakPolarHBondContact CA-O 3.3Å; W1977-W1990 WeakPolarHBondContact CB-O 3.36Å; L1978-W1990 HydrophobicContact CB-CB 4.4Å; L1978-W1990 PolarHBondContact N-O 3.01Å; L1978-W1990 VanDerWaalsContact O-CD1 3.25Å; L1978-W1990 PolarHBondContact O-N 3.12Å; S1980-W1990 PolarHBondContact OG-NE1 3.32Å; L1988-W1990 HydrophobicContact CB-CZ2 3.9Å; L1988-W1990 HydrophobicContact CD1-CH2 3.95Å; L1988-W1990 HydrophobicContact CD1-CZ2 3.53Å; L1988-W1990 VanDerWaalsContact CD1-CZ2 3.47Å; L1988-W1990 HydrophobicContact CG-CZ2 4.31Å; W1990-Q2010 HydrophobicContact CE3-CB 3.87Å; W1990-Q2010 HydrophobicContact CE3-CG 4.26Å; W1990-Q2010 HydrophobicContact CH2-CB 4.47Å; W1990-Q2010 HydrophobicContact CH2-CG 4.45Å; W1990-Q2010 HydrophobicContact CZ3-CB 3.71Å; W1990-Q2010 HydrophobicContact CZ3-CG 4.1Å
1991	D	81.3	Confident	75.6	Confident	27.2 Å²	27.2	29.6 Å²	29.6	15%	0.145	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	118.4	172.5	-169.2	7.2	0	0	0	111.6	W1977 S1993 S2008 S2009 L2011	W1977-D1991 VanDerWaalsContact CD1-OD1 3.3Å; W1977-D1991 PolarHBondContact NE1-OD1 3.03Å; D1991-S1993 WeakPolarHBondContact OD1-CB 3.37Å; D1991-S1993 PolarHBondContact OD1-N 3.22Å; D1991-S1993 PolarHBondContact OD1-OG 2.97Å; D1991-S2008 WeakPolarHBondContact O-CA 3.31Å; D1991-S2008 VanDerWaalsContact O-CB 3.23Å; D1991-S2008 WeakPolarHBondContact O-CB 3.33Å; D1991-S2009 PolarHBondContact N-O 3.3Å; D1991-L2011 HydrophobicContact CB-CD1 3.76Å; D1991-L2011 HydrophobicContact CB-CD2 4.17Å; D1991-L2011 HydrophobicContact CB-CG 3.84Å
1992	L	79.5	Confident	73.6	Confident	0.2 Å²	0.2	32.2 Å²	32.2	0%	0.001	19%	0.193	C	C	.	.			trans	-107	6.1	176	-64.5	174.4	0	0	0	113	V1933 F1945 F1957 L1976 L1978 N1994 V1995 I1996	V1933-L1992 HydrophobicContact CG1-CD2 4.49Å; V1933-L1992 HydrophobicContact CG2-CD1 4.29Å; V1933-L1992 HydrophobicContact CG2-CD2 4.05Å; F1945-L1992 HydrophobicContact CE2-CD2 3.79Å; F1945-L1992 HydrophobicContact CE2-CG 4.49Å; F1945-L1992 HydrophobicContact CZ-CD2 3.64Å; F1945-L1992 VanDerWaalsContact CZ-CD2 3.47Å; F1945-L1992 HydrophobicContact CZ-CG 4.33Å; F1957-L1992 HydrophobicContact CD1-CD1 4.3Å; F1957-L1992 HydrophobicContact CE1-CD1 3.63Å; L1976-L1992 HydrophobicContact CB-CB 4.36Å; L1976-L1992 HydrophobicContact CD2-CB 4.06Å; L1976-L1992 HydrophobicContact CD2-CD1 4.08Å; L1976-L1992 HydrophobicContact CG-CB 4.26Å; L1976-L1992 HydrophobicContact CG-CD1 4.31Å; L1976-L1992 CarbonylContact O-C 3.54Å; L1976-L1992 WeakPolarHBondContact O-CA 3.25Å; L1976-L1992 VanDerWaalsContact O-CB 3.32Å; L1976-L1992 WeakPolarHBondContact O-CB 3.35Å; L1976-L1992 PolarHBondContact O-N 3.13Å; L1978-L1992 HydrophobicContact CB-CD1 3.66Å; L1978-L1992 HydrophobicContact CB-CG 4.38Å; L1978-L1992 HydrophobicContact CD2-CD1 4.24Å; L1978-L1992 HydrophobicContact CG-CD1 4.48Å; L1992-N1994 VanDerWaalsContact C-N 3.27Å; L1992-N1994 PolarHBondContact O-N 3.17Å; L1992-N1994 VanDerWaalsContact O-N 3.15Å; L1992-V1995 HydrophobicContact CB-CB 4.44Å; L1992-V1995 HydrophobicContact CB-CG2 4.38Å; L1992-V1995 HydrophobicContact CD2-CB 4.24Å; L1992-V1995 HydrophobicContact CD2-CG1 4.44Å; L1992-V1995 HydrophobicContact CD2-CG2 3.93Å; L1992-V1995 WeakPolarHBondContact O-CA 3.35Å; L1992-V1995 VanDerWaalsContact O-CB 3.3Å; L1992-V1995 WeakPolarHBondContact O-CB 3.3Å; L1992-V1995 PolarHBondContact O-N 3.07Å; L1992-I1996 PolarHBondContact O-N 3.21Å; L1992-I1996 VanDerWaalsContact O-N 3.12Å
1993	S	73	Confident	71.6	Confident	8.6 Å²	8.6	37.1 Å²	37.1	6%	0.06	22%	0.218	C	C	.	.	H	α-helix	trans	-59.2	-32.9	-177	-51	0	0	0	0	113.1	Q1975 L1976 D1991 V1995 K1997	Q1975-S1993 VanDerWaalsContact CA-OG 3.29Å; Q1975-S1993 WeakPolarHBondContact CA-OG 3.32Å; L1976-S1993 PolarHBondContact N-OG 3.23Å; L1976-S1993 PolarHBondContact O-N 2.93Å; D1991-S1993 WeakPolarHBondContact OD1-CB 3.37Å; D1991-S1993 PolarHBondContact OD1-N 3.22Å; D1991-S1993 PolarHBondContact OD1-OG 2.97Å; S1993-V1995 VanDerWaalsContact C-N 3.34Å; S1993-K1997 VanDerWaalsContact O-CD 3.27Å; S1993-K1997 WeakPolarHBondContact O-CD 3.41Å; S1993-K1997 WeakPolarHBondContact O-CE 3.15Å; S1993-K1997 VanDerWaalsContact O-CG 3.3Å; S1993-K1997 WeakPolarHBondContact O-CG 3.25Å; S1993-K1997 PolarHBondContact O-N 3.15Å; S1993-K1997 PolarHBondContact O-NZ 3.23Å
1994	N	67.7	Low	69.6	Low	54.2 Å²	54.2	38.6 Å²	38.6	29%	0.29	23%	0.234	S	C	.	.	H	α-helix	trans	-77.7	-29.2	174.8	-68.3	-24	0	0	0	112.6	L1992 K1997 S1998 T2007	L1992-N1994 VanDerWaalsContact C-N 3.27Å; L1992-N1994 PolarHBondContact O-N 3.17Å; L1992-N1994 VanDerWaalsContact O-N 3.15Å; N1994-K1997 PolarHBondContact O-N 3.23Å; N1994-S1998 PolarHBondContact O-N 3.19Å; N1994-T2007 WeakPolarHBondContact CB-O 3.3Å; N1994-T2007 PolarHBondContact ND2-O 3.07Å
1995	V	68.6	Low	67.7	Low	1.2 Å²	1.2	40.4 Å²	40.4	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-69.2	-45.2	178.9	-178.7	0	0	0	0	110	L1942 C1943 L1992 S1993 K1997 S1998 V1999	L1942-V1995 HydrophobicContact CB-CG1 3.79Å; L1942-V1995 HydrophobicContact CD1-CG1 3.59Å; L1942-V1995 VanDerWaalsContact CD1-CG1 3.43Å; L1942-V1995 HydrophobicContact CG-CG1 4.32Å; C1943-V1995 HydrophobicContact CB-CG2 4.31Å; C1943-V1995 VanDerWaalsContact SG-CG2 3.55Å; L1992-V1995 HydrophobicContact CB-CB 4.44Å; L1992-V1995 HydrophobicContact CB-CG2 4.38Å; L1992-V1995 HydrophobicContact CD2-CB 4.24Å; L1992-V1995 HydrophobicContact CD2-CG1 4.44Å; L1992-V1995 HydrophobicContact CD2-CG2 3.93Å; L1992-V1995 WeakPolarHBondContact O-CA 3.35Å; L1992-V1995 VanDerWaalsContact O-CB 3.3Å; L1992-V1995 WeakPolarHBondContact O-CB 3.3Å; L1992-V1995 PolarHBondContact O-N 3.07Å; S1993-V1995 VanDerWaalsContact C-N 3.34Å; V1995-K1997 VanDerWaalsContact C-N 3.29Å; V1995-K1997 PolarHBondContact O-N 3.2Å; V1995-S1998 WeakPolarHBondContact CA-OG 3.16Å; V1995-S1998 WeakPolarHBondContact O-CB 3.34Å; V1995-S1998 PolarHBondContact O-N 3.15Å; V1995-S1998 VanDerWaalsContact O-N 3.1Å; V1995-S1998 PolarHBondContact O-OG 3.19Å; V1995-V1999 WeakPolarHBondContact O-CG2 3.21Å; V1995-V1999 PolarHBondContact O-N 2.99Å; V1995-V1999 VanDerWaalsContact O-N 3.14Å
1996	I	65.8	Low	66	Low	16.6 Å²	16.6	42.6 Å²	42.6	9%	0.085	26%	0.261	C	S	.	.	H	α-helix	trans	-56.4	-44.9	172	-69.7	179.8	0	0	0	111.1	L1921 P1972 S1973 L1976 L1992 S1998 V1999 T2000	L1921-I1996 HydrophobicContact CD1-CD1 4.41Å; L1921-I1996 HydrophobicContact CD1-CG1 3.89Å; P1972-I1996 HydrophobicContact CB-CD1 4.28Å; P1972-I1996 HydrophobicContact CB-CG1 4.41Å; P1972-I1996 HydrophobicContact CB-CG2 3.81Å; P1972-I1996 HydrophobicContact CG-CG2 4.03Å; S1973-I1996 VanDerWaalsContact O-CD1 3.29Å; S1973-I1996 WeakPolarHBondContact O-CD1 3.23Å; L1976-I1996 HydrophobicContact CB-CD1 3.3Å; L1976-I1996 VanDerWaalsContact CB-CD1 3.44Å; L1976-I1996 HydrophobicContact CB-CG1 4.2Å; L1976-I1996 HydrophobicContact CD1-CD1 4.32Å; L1976-I1996 HydrophobicContact CD2-CD1 3.61Å; L1976-I1996 VanDerWaalsContact CD2-CD1 3.45Å; L1976-I1996 HydrophobicContact CD2-CG1 4.09Å; L1976-I1996 HydrophobicContact CG-CD1 3.99Å; L1992-I1996 PolarHBondContact O-N 3.21Å; L1992-I1996 VanDerWaalsContact O-N 3.12Å; I1996-S1998 VanDerWaalsContact C-N 3.31Å; I1996-S1998 PolarHBondContact O-N 3.2Å; I1996-V1999 PolarHBondContact O-N 2.97Å; I1996-T2000 HydrophobicContact CG2-CG2 4.2Å; I1996-T2000 WeakPolarHBondContact O-CB 3.43Å; I1996-T2000 WeakPolarHBondContact O-CG2 3.37Å; I1996-T2000 PolarHBondContact O-N 3.17Å; I1996-T2000 PolarHBondContact O-OG1 3.12Å
1997	K	62.7	Low	64.4	Low	101.2 Å²	101.2	45.6 Å²	45.6	44%	0.44	28%	0.278	S	S	.	.	H	α-helix	trans	-64	-33.7	178.6	-70.4	172.1	-171.1	167.8	0	112.3	S1974 S1993 N1994 V1995 T2000 C2001	S1974-K1997 WeakPolarHBondContact O-CE 3.33Å; S1993-K1997 VanDerWaalsContact O-CD 3.27Å; S1993-K1997 WeakPolarHBondContact O-CD 3.41Å; S1993-K1997 WeakPolarHBondContact O-CE 3.15Å; S1993-K1997 VanDerWaalsContact O-CG 3.3Å; S1993-K1997 WeakPolarHBondContact O-CG 3.25Å; S1993-K1997 PolarHBondContact O-N 3.15Å; S1993-K1997 PolarHBondContact O-NZ 3.23Å; N1994-K1997 PolarHBondContact O-N 3.23Å; V1995-K1997 VanDerWaalsContact C-N 3.29Å; V1995-K1997 PolarHBondContact O-N 3.2Å; K1997-T2000 WeakPolarHBondContact CA-OG1 3.34Å; K1997-T2000 PolarHBondContact O-OG1 3.05Å; K1997-C2001 WeakPolarHBondContact O-CA 3.21Å; K1997-C2001 VanDerWaalsContact O-CB 3.24Å; K1997-C2001 WeakPolarHBondContact O-CB 3.36Å; K1997-C2001 PolarHBondContact O-N 3.2Å
1998	S	60.3	Low	62.9	Low	22.8 Å²	22.8	46.8 Å²	46.8	16%	0.159	29%	0.287	C	S	.	.	H	α-helix	trans	-66.6	-40.9	175.2	71.1	0	0	0	0	112.4	N1994 V1995 I1996 G2002 I2003	N1994-S1998 PolarHBondContact O-N 3.19Å; V1995-S1998 WeakPolarHBondContact CA-OG 3.16Å; V1995-S1998 WeakPolarHBondContact O-CB 3.34Å; V1995-S1998 PolarHBondContact O-N 3.15Å; V1995-S1998 VanDerWaalsContact O-N 3.1Å; V1995-S1998 PolarHBondContact O-OG 3.19Å; I1996-S1998 VanDerWaalsContact C-N 3.31Å; I1996-S1998 PolarHBondContact O-N 3.2Å; S1998-G2002 VanDerWaalsContact O-CA 3.26Å; S1998-G2002 WeakPolarHBondContact O-CA 3.42Å; S1998-G2002 PolarHBondContact O-N 3.12Å; S1998-I2003 VanDerWaalsContact CA-O 3.28Å; S1998-I2003 WeakPolarHBondContact CA-O 3.38Å; S1998-I2003 VanDerWaalsContact CB-O 3.25Å; S1998-I2003 WeakPolarHBondContact CB-O 3.32Å
1999	V	58.1	Low	61.9	Low	40.8 Å²	40.8	49.4 Å²	49.4	25%	0.247	31%	0.306	C	S	.	.	H	α-helix	trans	-69.2	-45	176.8	175.1	0	0	0	0	111.1	I1920 L1921 E1935 L1942 V1995 I1996 C2001	I1920-V1999 HydrophobicContact CG2-CG1 4.09Å; L1921-V1999 HydrophobicContact CD2-CG2 4.42Å; E1935-V1999 HydrophobicContact CG-CG1 4.43Å; E1935-V1999 WeakPolarHBondContact OE1-CG1 3.33Å; L1942-V1999 HydrophobicContact CD1-CG2 3.53Å; L1942-V1999 VanDerWaalsContact CD1-CG2 3.46Å; L1942-V1999 HydrophobicContact CD2-CG2 3.93Å; L1942-V1999 HydrophobicContact CG-CG2 4.37Å; V1995-V1999 WeakPolarHBondContact O-CG2 3.21Å; V1995-V1999 PolarHBondContact O-N 2.99Å; V1995-V1999 VanDerWaalsContact O-N 3.14Å; I1996-V1999 PolarHBondContact O-N 2.97Å; V1999-C2001 VanDerWaalsContact C-N 3.34Å; V1999-C2001 PolarHBondContact O-N 2.93Å
2000	T	54	Low	61.2	Low	75 Å²	75	52.6 Å²	52.6	46%	0.46	32%	0.32	S	S	.	.	H	α-helix	trans	-79.7	-27	-175.2	52.7	0	0	0	0	114.5	P1972 I1996 K1997	P1972-T2000 HydrophobicContact CB-CG2 4.44Å; P1972-T2000 HydrophobicContact CG-CG2 3.84Å; I1996-T2000 HydrophobicContact CG2-CG2 4.2Å; I1996-T2000 WeakPolarHBondContact O-CB 3.43Å; I1996-T2000 WeakPolarHBondContact O-CG2 3.37Å; I1996-T2000 PolarHBondContact O-N 3.17Å; I1996-T2000 PolarHBondContact O-OG1 3.12Å; K1997-T2000 WeakPolarHBondContact CA-OG1 3.34Å; K1997-T2000 PolarHBondContact O-OG1 3.05Å
2001	C	48.7	Very low	60.6	Low	85.4 Å²	85.4	54.9 Å²	54.9	58%	0.577	33%	0.333	S	S	*	.	H	α-helix	trans	-115.2	-3.8	-177.1	-56.8	0	0	0	0	114.2	K1997 V1999 I2003	K1997-C2001 WeakPolarHBondContact O-CA 3.21Å; K1997-C2001 VanDerWaalsContact O-CB 3.24Å; K1997-C2001 WeakPolarHBondContact O-CB 3.36Å; K1997-C2001 PolarHBondContact O-N 3.2Å; V1999-C2001 VanDerWaalsContact C-N 3.34Å; V1999-C2001 PolarHBondContact O-N 2.93Å; C2001-I2003 VanDerWaalsContact C-N 3.29Å; C2001-I2003 HydrophobicContact CB-CD1 4.03Å; C2001-I2003 HydrophobicContact CB-CG1 4.09Å; C2001-I2003 PolarHBondContact O-N 3.28Å
2002	G	48	Very low	60.2	Low	54.6 Å²	54.6	53.8 Å²	53.8	56%	0.563	33%	0.328	S	S	*	.			trans	69.8	14.3	-179.1	0	0	0	0	0	115.2	S1998	S1998-G2002 VanDerWaalsContact O-CA 3.26Å; S1998-G2002 WeakPolarHBondContact O-CA 3.42Å; S1998-G2002 PolarHBondContact O-N 3.12Å
2003	I	46.6	Very low	60.3	Low	102.2 Å²	102.2	56 Å²	56	52%	0.524	34%	0.343	S	S	.	.			trans	-89.7	119.4	-176	-57.2	172.9	0	0	0	109.9	S1998 C2001 T2005	S1998-I2003 VanDerWaalsContact CA-O 3.28Å; S1998-I2003 WeakPolarHBondContact CA-O 3.38Å; S1998-I2003 VanDerWaalsContact CB-O 3.25Å; S1998-I2003 WeakPolarHBondContact CB-O 3.32Å; C2001-I2003 VanDerWaalsContact C-N 3.29Å; C2001-I2003 HydrophobicContact CB-CD1 4.03Å; C2001-I2003 HydrophobicContact CB-CG1 4.09Å; C2001-I2003 PolarHBondContact O-N 3.28Å; I2003-T2005 VanDerWaalsContact C-N 3.31Å; I2003-T2005 HydrophobicContact CG2-CG2 4.32Å; I2003-T2005 PolarHBondContact O-N 3.09Å
2004	T	45.2	Very low	60.4	Low	125.4 Å²	125.4	55.8 Å²	55.8	77%	0.769	34%	0.341	S	S	*	.			trans	-79.9	44	-171.2	53.2	0	0	0	0	114.8	S2006	T2004-S2006 PolarHBondContact O-N 2.86Å
2005	T	44.3	Very low	60.6	Low	84.2 Å²	84.2	54.6 Å²	54.6	52%	0.517	34%	0.341	S	S	.	.			trans	-111.6	83.5	174.6	56.1	0	0	0	0	111	I2003 T2007	I2003-T2005 VanDerWaalsContact C-N 3.31Å; I2003-T2005 HydrophobicContact CG2-CG2 4.32Å; I2003-T2005 PolarHBondContact O-N 3.09Å; T2005-T2007 VanDerWaalsContact C-N 3.27Å; T2005-T2007 PolarHBondContact O-N 3.17Å; T2005-T2007 VanDerWaalsContact O-N 3.1Å
2006	S	49	Very low	60.8	Low	64.6 Å²	64.6	57.7 Å²	57.7	45%	0.452	37%	0.374	S	S	.	.			trans	-83.3	41.4	-178.8	56.5	0	0	0	0	113.7	L1942 T2004 S2008	L1942-S2006 WeakPolarHBondContact O-CB 3.16Å; T2004-S2006 PolarHBondContact O-N 2.86Å; S2006-S2008 VanDerWaalsContact C-N 3.28Å; S2006-S2008 PolarHBondContact O-N 3.13Å; S2006-S2008 VanDerWaalsContact O-N 3.15Å
2007	T	51.1	Low	61.5	Low	81 Å²	81	59.6 Å²	59.6	50%	0.497	38%	0.38	S	S	.	.			trans	-82.7	91.3	171.7	52.8	0	0	0	0	109.7	N1994 T2005	N1994-T2007 WeakPolarHBondContact CB-O 3.3Å; N1994-T2007 PolarHBondContact ND2-O 3.07Å; T2005-T2007 VanDerWaalsContact C-N 3.27Å; T2005-T2007 PolarHBondContact O-N 3.17Å; T2005-T2007 VanDerWaalsContact O-N 3.1Å
2008	S	58.3	Low	62.6	Low	26.6 Å²	26.6	55.1 Å²	55.1	19%	0.186	36%	0.361	C	S	.	.			trans	-90.9	150.1	162.8	53.9	0	0	0	0	109.7	F1945 D1991 S2006	F1945-S2008 WeakPolarHBondContact CD1-OG 3.23Å; F1945-S2008 WeakPolarHBondContact CE1-OG 3.4Å; F1945-S2008 VanDerWaalsContact CZ-CB 3.4Å; F1945-S2008 VanDerWaalsContact CZ-OG 3.31Å; F1945-S2008 WeakPolarHBondContact CZ-OG 3.21Å; D1991-S2008 WeakPolarHBondContact O-CA 3.31Å; D1991-S2008 VanDerWaalsContact O-CB 3.23Å; D1991-S2008 WeakPolarHBondContact O-CB 3.33Å; S2006-S2008 VanDerWaalsContact C-N 3.28Å; S2006-S2008 PolarHBondContact O-N 3.13Å; S2006-S2008 VanDerWaalsContact O-N 3.15Å
2009	S	65.4	Low	63.8	Low	58.6 Å²	58.6	60.6 Å²	60.6	41%	0.41	39%	0.389	S	S	.	.			trans	-134.7	149.4	179.2	58.8	0	0	0	0	111.6	D1991 L2011	D1991-S2009 PolarHBondContact N-O 3.3Å; S2009-L2011 PolarHBondContact O-N 2.92Å
2010	Q	72.1	Confident	65.2	Low	67 Å²	67	63.9 Å²	63.9	31%	0.313	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	120.5	165	-171.7	-171.2	-29	0	0	109.2	L1988 I1989 W1990 C2012	L1988-Q2010 VanDerWaalsContact CD2-NE2 3.34Å; I1989-Q2010 CarbonylContact O-C 3.55Å; W1990-Q2010 HydrophobicContact CE3-CB 3.87Å; W1990-Q2010 HydrophobicContact CE3-CG 4.26Å; W1990-Q2010 HydrophobicContact CH2-CB 4.47Å; W1990-Q2010 HydrophobicContact CH2-CG 4.45Å; W1990-Q2010 HydrophobicContact CZ3-CB 3.71Å; W1990-Q2010 HydrophobicContact CZ3-CG 4.1Å; Q2010-C2012 PolarHBondContact NE2-O 3.12Å; Q2010-C2012 VanDerWaalsContact NE2-O 3.14Å
2011	L	72.2	Confident	66.8	Low	55.4 Å²	55.4	61.8 Å²	61.8	29%	0.29	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-46.8	179	-73.6	163.2	0	0	0	111.5	W1977 I1989 D1991 S2009	W1977-L2011 HydrophobicContact CB-CD1 4.39Å; W1977-L2011 VanDerWaalsContact CD1-CD1 3.47Å; W1977-L2011 HydrophobicContact CD2-CD1 3.6Å; W1977-L2011 VanDerWaalsContact CD2-CD1 3.43Å; W1977-L2011 HydrophobicContact CE3-CD1 4.09Å; W1977-L2011 HydrophobicContact CG-CD1 3.66Å; W1977-L2011 HydrophobicContact CH2-CD1 4.27Å; W1977-L2011 HydrophobicContact CZ2-CD1 4.02Å; W1977-L2011 HydrophobicContact CZ3-CD1 4.09Å; I1989-L2011 HydrophobicContact CB-CB 4.46Å; I1989-L2011 HydrophobicContact CG2-CB 4.39Å; I1989-L2011 HydrophobicContact CG2-CD1 4.11Å; I1989-L2011 PolarHBondContact O-N 3.1Å; D1991-L2011 HydrophobicContact CB-CD1 3.76Å; D1991-L2011 HydrophobicContact CB-CD2 4.17Å; D1991-L2011 HydrophobicContact CB-CG 3.84Å; S2009-L2011 PolarHBondContact O-N 2.92Å
2012	C	74.4	Confident	68.7	Low	4.4 Å²	4.4	57.7 Å²	57.7	3%	0.03	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	163.5	-177.8	81.3	0	0	0	0	112.1	I1989 Q2010 L2014 K2065	I1989-C2012 HydrophobicContact CB-CB 4.19Å; I1989-C2012 HydrophobicContact CD1-CB 4.22Å; I1989-C2012 HydrophobicContact CG1-CB 4.24Å; I1989-C2012 PolarHBondContact N-O 3.08Å; I1989-C2012 VanDerWaalsContact N-O 3.1Å; I1989-C2012 PolarHBondContact O-N 2.94Å; Q2010-C2012 PolarHBondContact NE2-O 3.12Å; Q2010-C2012 VanDerWaalsContact NE2-O 3.14Å; C2012-L2014 VanDerWaalsContact SG-CD2 3.53Å; C2012-K2065 PolarHBondContact SG-O 2.79Å
2013	S	79.7	Confident	70.7	Confident	46.8 Å²	46.8	55.9 Å²	55.9	33%	0.327	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	124	166.3	178.8	0	0	0	0	108.4	I1987 L1988 G2015	I1987-S2013 WeakPolarHBondContact O-CA 3.17Å; L1988-S2013 VanDerWaalsContact CD2-CB 3.47Å; L1988-S2013 WeakPolarHBondContact CD2-OG 3.34Å; S2013-G2015 VanDerWaalsContact C-N 3.3Å; S2013-G2015 PolarHBondContact O-N 3.36Å; S2013-G2015 PolarHBondContact OG-N 3.32Å
2014	L	76.6	Confident	72.7	Confident	4.4 Å²	4.4	51.7 Å²	51.7	2%	0.023	32%	0.317	C	S	.	.			trans	-95.7	34.5	178.6	-58	177.5	0	0	0	111.6	I1987 I1989 C2012 L2034 W2046 I2067	I1987-L2014 HydrophobicContact CB-CB 4.01Å; I1987-L2014 HydrophobicContact CG2-CB 4.14Å; I1987-L2014 HydrophobicContact CG2-CD1 4.08Å; I1987-L2014 HydrophobicContact CG2-CG 4.44Å; I1987-L2014 PolarHBondContact O-N 3.18Å; I1989-L2014 HydrophobicContact CD1-CD1 3.99Å; I1989-L2014 HydrophobicContact CD1-CG 4.48Å; I1989-L2014 HydrophobicContact CG1-CD1 4.29Å; C2012-L2014 VanDerWaalsContact SG-CD2 3.53Å; L2014-L2034 HydrophobicContact CD1-CD2 4.22Å; L2014-W2046 HydrophobicContact CB-CE3 4.4Å; L2014-W2046 HydrophobicContact CB-CH2 3.99Å; L2014-W2046 HydrophobicContact CB-CZ2 4.27Å; L2014-W2046 HydrophobicContact CB-CZ3 4.01Å; L2014-W2046 HydrophobicContact CD1-CD2 3.96Å; L2014-W2046 HydrophobicContact CD1-CE3 4.03Å; L2014-W2046 HydrophobicContact CD1-CG 4.23Å; L2014-W2046 HydrophobicContact CD1-CZ3 4.39Å; L2014-W2046 HydrophobicContact CD2-CE3 4.12Å; L2014-W2046 HydrophobicContact CD2-CZ3 4.17Å; L2014-W2046 HydrophobicContact CG-CE3 4.4Å; L2014-W2046 HydrophobicContact CG-CZ3 4.37Å; L2014-W2046 WeakPolarHBondContact O-CH2 3.36Å; L2014-I2067 HydrophobicContact CD2-CB 3.78Å; L2014-I2067 HydrophobicContact CD2-CD1 3.94Å; L2014-I2067 HydrophobicContact CD2-CG1 4.08Å; L2014-I2067 HydrophobicContact CD2-CG2 4.38Å
2015	G	72	Confident	74.9	Confident	27.4 Å²	27.4	46.2 Å²	46.2	28%	0.282	28%	0.283	S	S	.	.			trans	-75.9	158.9	-179	0	0	0	0	0	114.7	S2013	S2013-G2015 VanDerWaalsContact C-N 3.3Å; S2013-G2015 PolarHBondContact O-N 3.36Å; S2013-G2015 PolarHBondContact OG-N 3.32Å
2016	G	71.4	Confident	77.1	Confident	68 Å²	68	42.8 Å²	42.8	70%	0.701	26%	0.263	S	S	*	.	S	Bend	trans	92.3	8.6	173	0	0	0	0	0	115.9
2017	Y	82.1	Confident	79	Confident	55.2 Å²	55.2	40.8 Å²	40.8	22%	0.216	25%	0.246	C	C	.	.	S	Bend	trans	-109.7	-33.9	176.3	-70.9	-78.3	0	0	0	113.8	W2046 I2067 K2068 P2069 K2072	Y2017-W2046 AromaticContact CD2-CH2 3.48Å; Y2017-W2046 HydrophobicContact CD2-CH2 3.48Å; Y2017-W2046 VanDerWaalsContact CD2-CH2 3.45Å; Y2017-W2046 AromaticContact CD2-CZ3 3.81Å; Y2017-W2046 HydrophobicContact CD2-CZ3 3.81Å; Y2017-W2046 HydrophobicContact CE2-CH2 4.25Å; Y2017-W2046 HydrophobicContact CE2-CZ3 4.12Å; Y2017-W2046 AromaticContact CG-CH2 3.82Å; Y2017-W2046 HydrophobicContact CG-CH2 3.82Å; Y2017-W2046 HydrophobicContact CG-CZ3 4.39Å; Y2017-I2067 VanDerWaalsContact CE2-O 3.26Å; Y2017-I2067 WeakPolarHBondContact CE2-O 2.86Å; Y2017-K2068 WeakPolarHBondContact OH-CA 3.43Å; Y2017-K2068 VanDerWaalsContact OH-CG 3.24Å; Y2017-K2068 WeakPolarHBondContact OH-CG 3.37Å; Y2017-P2069 VanDerWaalsContact CD1-CD 3.5Å; Y2017-P2069 HydrophobicContact CD1-CG 3.7Å; Y2017-P2069 HydrophobicContact CD2-CG 4.48Å; Y2017-P2069 HydrophobicContact CE1-CG 3.91Å; Y2017-P2069 HydrophobicContact CG-CG 4.09Å; Y2017-K2072 PolarHBondContact O-NZ 2.85Å
2018	H	85.1	Confident	80.7	Confident	7.2 Å²	7.2	37 Å²	37	3%	0.033	22%	0.222	C	C	.	.			trans	-91.1	141.8	165.3	-73.4	-82.6	0	0	0	109.3	A1985 V2022 T2036 D2040 L2042 C2044	A1985-H2018 HydrophobicContact CB-CB 4.46Å; H2018-V2022 HydrophobicContact CB-CG2 3.66Å; H2018-T2036 PolarHBondContact NE2-OG1 2.91Å; H2018-D2040 WeakPolarHBondContact CA-OD2 3.31Å; H2018-D2040 VanDerWaalsContact CB-OD2 3.26Å; H2018-D2040 WeakPolarHBondContact CB-OD2 3.42Å; H2018-D2040 IonicContact CE1-OD1 3.47Å; H2018-D2040 IonicContact CG-OD2 3.24Å; H2018-D2040 IonicContact ND1-OD1 3.35Å; H2018-D2040 PolarHBondContact ND1-OD1 3Å; H2018-D2040 VanDerWaalsContact ND1-OD1 3.12Å; H2018-D2040 IonicContact ND1-OD2 3.37Å; H2018-D2040 PolarHBondContact ND1-OD2 3.13Å; H2018-D2040 VanDerWaalsContact ND1-OD2 3.16Å; H2018-L2042 PolarHBondContact CE1-O 3.16Å; H2018-C2044 PolarHBondContact NE2-SG 2.88Å
2019	N	84.6	Confident	81.5	Confident	138.8 Å²	138.8	36.2 Å²	36.2	74%	0.742	22%	0.217	S	C	*	.	S	Bend	trans	-107.4	0.7	-179.1	-67.5	-14	0	0	0	112.6	D2040	N2019-D2040 PolarHBondContact N-OD2 3.17Å; N2019-D2040 VanDerWaalsContact N-OD2 3.09Å
2020	K	87.3	Confident	81.9	Confident	110.6 Å²	110.6	39.1 Å²	39.1	48%	0.481	22%	0.222	S	C	.	.	S	Bend	trans	-144.4	168.5	-175.7	-79.2	-172.1	178.5	-178.9	0	109.6	A1985 V2022 L2039 D2040	A1985-K2020 WeakPolarHBondContact CB-O 3.22Å; K2020-V2022 PolarHBondContact O-N 2.95Å; K2020-L2039 HydrophobicContact CB-CB 4.19Å; K2020-L2039 VanDerWaalsContact CD-C 3.44Å; K2020-L2039 HydrophobicContact CD-CB 4.21Å; K2020-L2039 VanDerWaalsContact CD-O 3.28Å; K2020-L2039 WeakPolarHBondContact CD-O 3.33Å; K2020-L2039 PolarHBondContact NZ-O 3.24Å; K2020-D2040 HydrophobicContact CB-CB 3.94Å; K2020-D2040 HydrophobicContact CD-CB 4.23Å; K2020-D2040 HydrophobicContact CG-CB 4.27Å
2021	P	88.5	Confident	82	Confident	30 Å²	30	40.1 Å²	40.1	20%	0.195	22%	0.223	C	C	.	.			trans	-44.5	130	177.4	-33.6	37.3	0	0	0	113.7	L1953 Q1983 T2023 G2038 L2039	L1953-P2021 HydrophobicContact CD1-CB 3.98Å; Q1983-P2021 HydrophobicContact CB-CB 4.45Å; Q1983-P2021 HydrophobicContact CB-CG 4.45Å; Q1983-P2021 HydrophobicContact CG-CB 4.23Å; Q1983-P2021 HydrophobicContact CG-CG 3.82Å; Q1983-P2021 WeakPolarHBondContact O-CG 3.26Å; P2021-T2023 PolarHBondContact O-N 2.87Å; P2021-G2038 VanDerWaalsContact O-CA 3.26Å; P2021-G2038 WeakPolarHBondContact O-CA 3.32Å; P2021-L2039 HydrophobicContact CB-CD1 3.97Å; P2021-L2039 HydrophobicContact CB-CG 4.29Å; P2021-L2039 HydrophobicContact CG-CD1 4.09Å; P2021-L2039 PolarHBondContact O-N 3.14Å
2022	V	89.5	Confident	82.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	106.2	175.7	-179.3	0	0	0	0	107.8	L1953 T1981 S1982 I1987 H2018 K2020 T2036 G2037	L1953-V2022 WeakPolarHBondContact CD1-O 3.27Å; T1981-V2022 WeakPolarHBondContact CB-O 3.31Å; T1981-V2022 HydrophobicContact CG2-CB 4.49Å; T1981-V2022 HydrophobicContact CG2-CG1 3.78Å; T1981-V2022 PolarHBondContact OG1-O 3.41Å; S1982-V2022 PolarHBondContact O-N 3.14Å; I1987-V2022 HydrophobicContact CD1-CG1 4.26Å; I1987-V2022 HydrophobicContact CD1-CG2 4.18Å; I1987-V2022 HydrophobicContact CG1-CB 4.4Å; I1987-V2022 HydrophobicContact CG1-CG1 4.07Å; I1987-V2022 HydrophobicContact CG1-CG2 4.14Å; H2018-V2022 HydrophobicContact CB-CG2 3.66Å; K2020-V2022 PolarHBondContact O-N 2.95Å; V2022-T2036 HydrophobicContact CG1-CG2 4.48Å; V2022-G2037 CarbonylContact C-O 3.56Å; V2022-G2037 WeakPolarHBondContact CA-O 3.33Å; V2022-G2037 WeakPolarHBondContact CG1-O 3.39Å
2023	T	88.1	Confident	82.9	Confident	15.4 Å²	15.4	41.6 Å²	41.6	9%	0.094	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-26.8	-166.9	47.3	0	0	0	0	113.7	L1953 P2021 G2037 L2039 I2079	L1953-T2023 HydrophobicContact CD1-CG2 4.4Å; P2021-T2023 PolarHBondContact O-N 2.87Å; T2023-G2037 PolarHBondContact N-O 2.98Å; T2023-G2037 PolarHBondContact OG1-O 3.15Å; T2023-L2039 HydrophobicContact CG2-CD1 4.45Å; T2023-L2039 HydrophobicContact CG2-CD2 3.7Å; T2023-L2039 HydrophobicContact CG2-CG 3.75Å; T2023-I2079 WeakPolarHBondContact CB-O 3.41Å; T2023-I2079 PolarHBondContact OG1-O 3.11Å
2024	V	89.5	Confident	83.3	Confident	15.6 Å²	15.6	39.3 Å²	39.3	10%	0.095	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	145.7	-172.8	63.6	0	0	0	0	112.4	T2036 G2037 I2079 I2082	V2024-T2036 WeakPolarHBondContact O-CA 3.37Å; V2024-G2037 PolarHBondContact N-O 2.97Å; V2024-G2037 PolarHBondContact O-N 3.03Å; V2024-I2079 HydrophobicContact CG1-CG2 4.21Å; V2024-I2082 HydrophobicContact CG1-CB 4.03Å; V2024-I2082 HydrophobicContact CG1-CD1 3.9Å; V2024-I2082 HydrophobicContact CG1-CG1 3.71Å; V2024-I2082 HydrophobicContact CG2-CB 4.32Å
2025	S	91.2	Very high	84	Confident	9.6 Å²	9.6	39.1 Å²	39.1	7%	0.067	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	146.9	169.3	60.8	0	0	0	0	111	S1954 C1956 A2035	S1954-S2025 PolarHBondContact OG-N 3.12Å; S1954-S2025 VanDerWaalsContact OG-N 3.13Å; S1954-S2025 PolarHBondContact OG-OG 3.13Å; C1956-S2025 VanDerWaalsContact CB-OG 3.32Å; C1956-S2025 WeakPolarHBondContact CB-OG 3.32Å; S2025-A2035 CarbonylContact C-O 3.52Å; S2025-A2035 VanDerWaalsContact CA-O 3.28Å; S2025-A2035 WeakPolarHBondContact CA-O 3.27Å
2026	A	90.6	Very high	85	Confident	11.4 Å²	11.4	37.8 Å²	37.8	9%	0.094	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	145.6	175	0	0	0	0	0	110.9	L2034 A2035 I2082 F2084	A2026-L2034 WeakPolarHBondContact O-CA 3.49Å; A2026-L2034 WeakPolarHBondContact O-CD1 3.3Å; A2026-A2035 PolarHBondContact N-O 3.25Å; A2026-A2035 PolarHBondContact O-N 2.96Å; A2026-I2082 HydrophobicContact CB-CG2 4.11Å; A2026-F2084 HydrophobicContact CB-CD2 3.85Å; A2026-F2084 HydrophobicContact CB-CE2 4.03Å; A2026-F2084 WeakPolarHBondContact O-CE2 3.4Å
2027	W	89.2	Confident	85.9	Confident	23.2 Å²	23.2	34.6 Å²	34.6	9%	0.088	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	137.2	-177.5	177.9	-128.2	0	0	0	113	C1956 L1958 D1959 R2032 L2033 L2034 V2048 F2053 F2084	C1956-W2027 VanDerWaalsContact SG-CB 3.55Å; L1958-W2027 HydrophobicContact CB-CZ2 4.34Å; L1958-W2027 HydrophobicContact CD2-CB 4.03Å; L1958-W2027 HydrophobicContact CD2-CD2 3.3Å; L1958-W2027 VanDerWaalsContact CD2-CD2 3.44Å; L1958-W2027 HydrophobicContact CD2-CE3 3.32Å; L1958-W2027 VanDerWaalsContact CD2-CE3 3.47Å; L1958-W2027 HydrophobicContact CD2-CG 3.65Å; L1958-W2027 HydrophobicContact CD2-CH2 4.18Å; L1958-W2027 HydrophobicContact CD2-CZ2 4.2Å; L1958-W2027 HydrophobicContact CD2-CZ3 3.78Å; L1958-W2027 HydrophobicContact CG-CD2 4.44Å; D1959-W2027 PolarHBondContact O-NE1 3.2Å; D1959-W2027 VanDerWaalsContact O-NE1 3.07Å; W2027-R2032 VanDerWaalsContact CH2-C 3.44Å; W2027-R2032 HydrophobicContact CH2-CB 3.83Å; W2027-R2032 HydrophobicContact CH2-CG 4.42Å; W2027-R2032 HydrophobicContact CZ2-CB 4.35Å; W2027-R2032 HydrophobicContact CZ2-CG 4.46Å; W2027-R2032 WeakPolarHBondContact CZ3-O 3.36Å; W2027-L2033 VanDerWaalsContact CE3-C 3.42Å; W2027-L2033 VanDerWaalsContact CE3-O 3.22Å; W2027-L2033 VanDerWaalsContact CZ3-C 3.46Å; W2027-L2034 HydrophobicContact CE3-CB 4.01Å; W2027-L2034 HydrophobicContact CZ3-CB 4.15Å; W2027-V2048 HydrophobicContact CH2-CB 3.85Å; W2027-V2048 HydrophobicContact CH2-CG1 4.17Å; W2027-V2048 HydrophobicContact CH2-CG2 4.15Å; W2027-V2048 HydrophobicContact CZ3-CB 3.91Å; W2027-V2048 HydrophobicContact CZ3-CG1 4.39Å; W2027-V2048 HydrophobicContact CZ3-CG2 3.68Å; W2027-F2053 HydrophobicContact CH2-CD1 4.48Å; W2027-F2053 HydrophobicContact CH2-CE1 4.46Å; W2027-F2053 HydrophobicContact CZ2-CD1 4.36Å; W2027-F2053 AromaticContact CZ2-CE1 3.84Å; W2027-F2053 HydrophobicContact CZ2-CE1 3.92Å; W2027-F2053 HydrophobicContact CZ2-CZ 4.4Å; W2027-F2084 WeakPolarHBondContact O-CD2 3.38Å
2028	H	85.7	Confident	86.3	Confident	0.4 Å²	0.4	31.9 Å²	31.9	0%	0.002	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	99.2	171.5	-170.5	-46.9	0	0	0	110.2	K2030 R2031 R2032 L2033 F2084 D2104	H2028-K2030 PolarHBondContact ND1-N 2.92Å; H2028-K2030 PolarHBondContact O-N 3.04Å; H2028-R2031 PolarHBondContact ND1-N 3.37Å; H2028-R2031 PolarHBondContact O-N 2.99Å; H2028-R2032 WeakPolarHBondContact O-CA 3.39Å; H2028-R2032 PolarHBondContact O-N 3.14Å; H2028-R2032 VanDerWaalsContact O-N 3.12Å; H2028-L2033 HydrophobicContact CB-CB 4.27Å; H2028-L2033 WeakPolarHBondContact CB-O 3.37Å; H2028-L2033 PolarHBondContact N-O 3.13Å; H2028-L2033 PolarHBondContact O-N 3.26Å; H2028-L2033 VanDerWaalsContact O-N 3.16Å; H2028-F2084 HydrophobicContact CB-CD1 4.26Å; H2028-F2084 HydrophobicContact CB-CD2 3.88Å; H2028-F2084 HydrophobicContact CB-CE1 4.23Å; H2028-F2084 HydrophobicContact CB-CE2 3.85Å; H2028-F2084 HydrophobicContact CB-CG 4.08Å; H2028-F2084 HydrophobicContact CB-CZ 4.03Å; H2028-F2084 AromaticContact CD2-CD1 3.81Å; H2028-D2104 IonicContact NE2-OD1 3.4Å
2029	P	76.6	Confident	86.4	Confident	11.8 Å²	11.8	33.5 Å²	33.5	8%	0.077	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-47.4	-169.1	21.7	-33.8	0	0	0	114.4	R1917 V1961 R2031 R2032 L2086 Y2089	R1917-P2029 VanDerWaalsContact NH2-CG 3.31Å; V1961-P2029 HydrophobicContact CG2-CB 3.83Å; V1961-P2029 HydrophobicContact CG2-CG 4.22Å; P2029-R2031 PolarHBondContact O-N 3Å; P2029-R2031 VanDerWaalsContact O-N 3.15Å; P2029-R2032 PolarHBondContact O-N 3Å; P2029-L2086 HydrophobicContact CG-CD2 4.27Å; P2029-Y2089 WeakPolarHBondContact CG-OH 3.49Å
2030	K	73.4	Confident	86.7	Confident	118 Å²	118	28.2 Å²	28.2	51%	0.513	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-37.9	-176.8	-178.4	180	-179.5	-179.6	0	113.9	H2028 R2032 P2087 Y2089 L2102	H2028-K2030 PolarHBondContact ND1-N 2.92Å; H2028-K2030 PolarHBondContact O-N 3.04Å; K2030-R2032 VanDerWaalsContact C-N 3.28Å; K2030-R2032 PolarHBondContact O-N 2.71Å; K2030-P2087 HydrophobicContact CD-CG 4.39Å; K2030-Y2089 VanDerWaalsContact CB-OH 3.27Å; K2030-Y2089 WeakPolarHBondContact CB-OH 3.37Å; K2030-Y2089 HydrophobicContact CD-CD2 4.43Å; K2030-Y2089 HydrophobicContact CD-CE1 4.12Å; K2030-Y2089 HydrophobicContact CD-CE2 3.61Å; K2030-Y2089 VanDerWaalsContact NZ-CE2 3.25Å; K2030-Y2089 PolarHBondContact NZ-OH 2.96Å; K2030-L2102 VanDerWaalsContact NZ-CD1 3.31Å
2031	R	73.8	Confident	86.8	Confident	88.6 Å²	88.6	24.3 Å²	24.3	33%	0.334	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-5.3	177.6	-69	-175.1	175.5	-109.1	0.4	113.2	H2028 P2029 L2033 D2104 L2120 I2121	H2028-R2031 PolarHBondContact ND1-N 3.37Å; H2028-R2031 PolarHBondContact O-N 2.99Å; P2029-R2031 PolarHBondContact O-N 3Å; P2029-R2031 VanDerWaalsContact O-N 3.15Å; R2031-L2033 HydrophobicContact CB-CB 4.18Å; R2031-L2033 HydrophobicContact CB-CD1 3.77Å; R2031-L2033 HydrophobicContact CB-CG 3.87Å; R2031-L2033 HydrophobicContact CG-CD1 4.4Å; R2031-L2033 PolarHBondContact O-N 2.96Å; R2031-D2104 IonicContact CZ-OD2 3.22Å; R2031-D2104 IonicContact NE-OD2 3.04Å; R2031-D2104 PolarHBondContact NE-OD2 3.08Å; R2031-D2104 IonicContact NH2-OD2 3.24Å; R2031-D2104 PolarHBondContact NH2-OD2 3.2Å; R2031-L2120 PolarHBondContact NH1-O 3.12Å; R2031-I2121 VanDerWaalsContact NH2-CG1 3.3Å
2032	R	79.4	Confident	86.9	Confident	78.4 Å²	78.4	24 Å²	24	30%	0.296	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	40.9	-170.8	-59	-178.8	-180	-168.7	-2	112.6	E1960 W2027 H2028 P2029 K2030 V2048 F2053 G2054	E1960-R2032 IonicContact OE1-CZ 3.46Å; E1960-R2032 IonicContact OE1-NE 3.2Å; E1960-R2032 PolarHBondContact OE1-NE 3.13Å; E1960-R2032 IonicContact OE1-NH1 3.54Å; E1960-R2032 PolarHBondContact OE1-NH1 3.2Å; E1960-R2032 IonicContact OE1-NH2 3.63Å; E1960-R2032 PolarHBondContact OE1-NH2 3.1Å; W2027-R2032 VanDerWaalsContact CH2-C 3.44Å; W2027-R2032 HydrophobicContact CH2-CB 3.83Å; W2027-R2032 HydrophobicContact CH2-CG 4.42Å; W2027-R2032 HydrophobicContact CZ2-CB 4.35Å; W2027-R2032 HydrophobicContact CZ2-CG 4.46Å; W2027-R2032 WeakPolarHBondContact CZ3-O 3.36Å; H2028-R2032 WeakPolarHBondContact O-CA 3.39Å; H2028-R2032 PolarHBondContact O-N 3.14Å; H2028-R2032 VanDerWaalsContact O-N 3.12Å; P2029-R2032 PolarHBondContact O-N 3Å; K2030-R2032 VanDerWaalsContact C-N 3.28Å; K2030-R2032 PolarHBondContact O-N 2.71Å; R2032-V2048 PolarHBondContact O-N 3.09Å; R2032-F2053 HydrophobicContact CG-CD1 4.27Å; R2032-F2053 PolarHBondContact NH1-O 2.91Å; R2032-F2053 PolarHBondContact NH2-O 2.75Å; R2032-G2054 PolarHBondContact NH2-O 3.23Å
2033	L	86	Confident	87	Confident	11.8 Å²	11.8	24 Å²	24	6%	0.062	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	124	-176.7	-109.3	137.5	0	0	0	110.6	W2027 H2028 R2031 L2045 W2046 E2047 F2084 L2120 M2123	W2027-L2033 VanDerWaalsContact CE3-C 3.42Å; W2027-L2033 VanDerWaalsContact CE3-O 3.22Å; W2027-L2033 VanDerWaalsContact CZ3-C 3.46Å; H2028-L2033 HydrophobicContact CB-CB 4.27Å; H2028-L2033 WeakPolarHBondContact CB-O 3.37Å; H2028-L2033 PolarHBondContact N-O 3.13Å; H2028-L2033 PolarHBondContact O-N 3.26Å; H2028-L2033 VanDerWaalsContact O-N 3.16Å; R2031-L2033 HydrophobicContact CB-CB 4.18Å; R2031-L2033 HydrophobicContact CB-CD1 3.77Å; R2031-L2033 HydrophobicContact CB-CG 3.87Å; R2031-L2033 HydrophobicContact CG-CD1 4.4Å; R2031-L2033 PolarHBondContact O-N 2.96Å; L2033-L2045 HydrophobicContact CD1-CB 4.24Å; L2033-L2045 HydrophobicContact CD2-CB 4.44Å; L2033-L2045 HydrophobicContact CD2-CD1 4.33Å; L2033-L2045 HydrophobicContact CD2-CD2 4.18Å; L2033-L2045 HydrophobicContact CG-CB 4.47Å; L2033-W2046 WeakPolarHBondContact CA-O 3.31Å; L2033-E2047 HydrophobicContact CD1-CB 4.46Å; L2033-E2047 HydrophobicContact CD2-CB 4.19Å; L2033-E2047 HydrophobicContact CD2-CG 4.39Å; L2033-F2084 HydrophobicContact CD2-CE1 4.32Å; L2033-F2084 HydrophobicContact CD2-CZ 4.26Å; L2033-L2120 HydrophobicContact CD2-CD2 4.12Å; L2033-M2123 HydrophobicContact CD1-CE 4.29Å; L2033-M2123 HydrophobicContact CD2-CE 4.49Å
2034	L	89.4	Confident	87.1	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.2	169.8	173.1	72.5	0	0	0	108.6	L1958 V1979 I1989 L2014 A2026 W2027 T2036 L2045 W2046 V2048	L1958-L2034 HydrophobicContact CD2-CD1 4.39Å; V1979-L2034 HydrophobicContact CB-CD1 4.47Å; V1979-L2034 HydrophobicContact CG1-CD1 4.34Å; V1979-L2034 HydrophobicContact CG1-CD2 4.15Å; V1979-L2034 HydrophobicContact CG2-CD1 4.07Å; V1979-L2034 HydrophobicContact CG2-CD2 4.05Å; I1989-L2034 HydrophobicContact CD1-CD2 4.42Å; L2014-L2034 HydrophobicContact CD1-CD2 4.22Å; A2026-L2034 WeakPolarHBondContact O-CA 3.49Å; A2026-L2034 WeakPolarHBondContact O-CD1 3.3Å; W2027-L2034 HydrophobicContact CE3-CB 4.01Å; W2027-L2034 HydrophobicContact CZ3-CB 4.15Å; L2034-T2036 HydrophobicContact CD2-CG2 4.39Å; L2034-T2036 HydrophobicContact CG-CG2 4.3Å; L2034-L2045 CarbonylContact O-C 3.55Å; L2034-L2045 WeakPolarHBondContact O-CA 3.43Å; L2034-W2046 HydrophobicContact CB-CB 4.21Å; L2034-W2046 HydrophobicContact CD2-CB 4.45Å; L2034-W2046 HydrophobicContact CD2-CG 4.4Å; L2034-W2046 PolarHBondContact N-O 3.21Å; L2034-W2046 VanDerWaalsContact O-CD1 3.29Å; L2034-W2046 PolarHBondContact O-N 2.95Å; L2034-V2048 HydrophobicContact CB-CG2 3.99Å
2035	A	91.2	Very high	87.1	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	137	169.8	0	0	0	0	0	110	S2025 A2026 C2044 L2045 I2082 F2084 L2106	S2025-A2035 CarbonylContact C-O 3.52Å; S2025-A2035 VanDerWaalsContact CA-O 3.28Å; S2025-A2035 WeakPolarHBondContact CA-O 3.27Å; A2026-A2035 PolarHBondContact N-O 3.25Å; A2026-A2035 PolarHBondContact O-N 2.96Å; A2035-C2044 WeakPolarHBondContact CA-O 3.37Å; A2035-L2045 HydrophobicContact CB-CD2 3.59Å; A2035-I2082 HydrophobicContact CB-CG2 4.2Å; A2035-F2084 HydrophobicContact CB-CE1 4.49Å; A2035-F2084 HydrophobicContact CB-CE2 3.78Å; A2035-F2084 HydrophobicContact CB-CZ 3.59Å; A2035-F2084 VanDerWaalsContact CB-CZ 3.5Å; A2035-L2106 HydrophobicContact CB-CD1 4.29Å
2036	T	92.3	Very high	86.9	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	138.7	171.8	60.5	0	0	0	0	110.7	I1987 H2018 V2022 V2024 L2034 I2043 C2044 W2046	I1987-T2036 HydrophobicContact CD1-CG2 3.88Å; I1987-T2036 HydrophobicContact CG1-CG2 4.36Å; I1987-T2036 HydrophobicContact CG2-CG2 4.41Å; H2018-T2036 PolarHBondContact NE2-OG1 2.91Å; V2022-T2036 HydrophobicContact CG1-CG2 4.48Å; V2024-T2036 WeakPolarHBondContact O-CA 3.37Å; L2034-T2036 HydrophobicContact CD2-CG2 4.39Å; L2034-T2036 HydrophobicContact CG-CG2 4.3Å; T2036-I2043 CarbonylContact O-C 3.58Å; T2036-I2043 VanDerWaalsContact O-CA 3.3Å; T2036-I2043 WeakPolarHBondContact O-CA 3.36Å; T2036-C2044 PolarHBondContact N-O 3.09Å; T2036-C2044 PolarHBondContact O-N 3.18Å; T2036-W2046 PolarHBondContact OG1-NE1 3.13Å
2037	G	90.5	Very high	86.5	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	148.1	177	0	0	0	0	0	111.4	V2022 T2023 V2024	V2022-G2037 CarbonylContact C-O 3.56Å; V2022-G2037 WeakPolarHBondContact CA-O 3.33Å; V2022-G2037 WeakPolarHBondContact CG1-O 3.39Å; T2023-G2037 PolarHBondContact N-O 2.98Å; T2023-G2037 PolarHBondContact OG1-O 3.15Å; V2024-G2037 PolarHBondContact N-O 2.97Å; V2024-G2037 PolarHBondContact O-N 3.03Å
2038	G	89.4	Confident	85.8	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	174	-178.6	0	0	0	0	0	115	P2021 D2040 C2041 L2042 I2079	P2021-G2038 VanDerWaalsContact O-CA 3.26Å; P2021-G2038 WeakPolarHBondContact O-CA 3.32Å; G2038-D2040 WeakPolarHBondContact CA-OD1 3.38Å; G2038-D2040 PolarHBondContact O-N 3Å; G2038-C2041 PolarHBondContact O-N 2.96Å; G2038-C2041 VanDerWaalsContact O-N 3.16Å; G2038-L2042 PolarHBondContact N-O 3.04Å; G2038-I2079 PolarHBondContact O-N 3.04Å
2039	L	89	Confident	84.8	Confident	40.2 Å²	40.2	26.7 Å²	26.7	21%	0.21	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-0.5	175.2	-60.1	-177	0	0	0	113.5	K2020 P2021 T2023 C2041 S2078 W2111	K2020-L2039 HydrophobicContact CB-CB 4.19Å; K2020-L2039 VanDerWaalsContact CD-C 3.44Å; K2020-L2039 HydrophobicContact CD-CB 4.21Å; K2020-L2039 VanDerWaalsContact CD-O 3.28Å; K2020-L2039 WeakPolarHBondContact CD-O 3.33Å; K2020-L2039 PolarHBondContact NZ-O 3.24Å; P2021-L2039 HydrophobicContact CB-CD1 3.97Å; P2021-L2039 HydrophobicContact CB-CG 4.29Å; P2021-L2039 HydrophobicContact CG-CD1 4.09Å; P2021-L2039 PolarHBondContact O-N 3.14Å; T2023-L2039 HydrophobicContact CG2-CD1 4.45Å; T2023-L2039 HydrophobicContact CG2-CD2 3.7Å; T2023-L2039 HydrophobicContact CG2-CG 3.75Å; L2039-C2041 VanDerWaalsContact C-N 3.26Å; L2039-S2078 PolarHBondContact O-OG 3.03Å; L2039-S2078 VanDerWaalsContact O-OG 3.09Å; L2039-W2111 HydrophobicContact CD1-CZ2 4.43Å; L2039-W2111 HydrophobicContact CD2-CH2 4.28Å; L2039-W2111 HydrophobicContact CD2-CZ2 3.69Å; L2039-W2111 VanDerWaalsContact CD2-CZ2 3.5Å
2040	D	89.1	Confident	83.8	Confident	27.4 Å²	27.4	32.8 Å²	32.8	15%	0.147	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	6	169	51.8	6.4	0	0	0	113.4	H2018 N2019 K2020 G2038 L2042	H2018-D2040 WeakPolarHBondContact CA-OD2 3.31Å; H2018-D2040 VanDerWaalsContact CB-OD2 3.26Å; H2018-D2040 WeakPolarHBondContact CB-OD2 3.42Å; H2018-D2040 IonicContact CE1-OD1 3.47Å; H2018-D2040 IonicContact CG-OD2 3.24Å; H2018-D2040 IonicContact ND1-OD1 3.35Å; H2018-D2040 PolarHBondContact ND1-OD1 3Å; H2018-D2040 VanDerWaalsContact ND1-OD1 3.12Å; H2018-D2040 IonicContact ND1-OD2 3.37Å; H2018-D2040 PolarHBondContact ND1-OD2 3.13Å; H2018-D2040 VanDerWaalsContact ND1-OD2 3.16Å; N2019-D2040 PolarHBondContact N-OD2 3.17Å; N2019-D2040 VanDerWaalsContact N-OD2 3.09Å; K2020-D2040 HydrophobicContact CB-CB 3.94Å; K2020-D2040 HydrophobicContact CD-CB 4.23Å; K2020-D2040 HydrophobicContact CG-CB 4.27Å; G2038-D2040 WeakPolarHBondContact CA-OD1 3.38Å; G2038-D2040 PolarHBondContact O-N 3Å; D2040-L2042 HydrophobicContact CB-CD1 4.31Å; D2040-L2042 HydrophobicContact CB-CG 4.28Å; D2040-L2042 PolarHBondContact O-N 3.12Å; D2040-L2042 WeakPolarHBondContact OD1-CB 3.44Å; D2040-L2042 PolarHBondContact OD1-N 3.3Å
2041	C	90.6	Very high	83	Confident	27.6 Å²	27.6	28.5 Å²	28.5	19%	0.186	14%	0.14	C	C	.	.	S	Bend	trans	62.1	22.2	-179.4	-42	0	0	0	0	112.9	G2038 L2039 I2075 S2077 S2078	G2038-C2041 PolarHBondContact O-N 2.96Å; G2038-C2041 VanDerWaalsContact O-N 3.16Å; L2039-C2041 VanDerWaalsContact C-N 3.26Å; C2041-I2075 WeakPolarHBondContact CB-O 3.28Å; C2041-I2075 PolarHBondContact O-N 3.15Å; C2041-S2077 VanDerWaalsContact CB-O 3.3Å; C2041-S2077 WeakPolarHBondContact CB-O 3.32Å; C2041-S2077 PolarHBondContact SG-O 3.09Å; C2041-S2078 PolarHBondContact SG-N 3.21Å; C2041-S2078 VanDerWaalsContact SG-N 3.36Å
2042	L	90.6	Very high	81.8	Confident	25.2 Å²	25.2	25.4 Å²	25.4	13%	0.132	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	139	178.3	-71	170.8	0	0	0	110.8	H2018 G2038 D2040 K2072 N2074 I2079	H2018-L2042 PolarHBondContact CE1-O 3.16Å; G2038-L2042 PolarHBondContact N-O 3.04Å; D2040-L2042 HydrophobicContact CB-CD1 4.31Å; D2040-L2042 HydrophobicContact CB-CG 4.28Å; D2040-L2042 PolarHBondContact O-N 3.12Å; D2040-L2042 WeakPolarHBondContact OD1-CB 3.44Å; D2040-L2042 PolarHBondContact OD1-N 3.3Å; L2042-K2072 HydrophobicContact CD2-CB 4.36Å; L2042-K2072 HydrophobicContact CD2-CD 4.47Å; L2042-N2074 HydrophobicContact CD2-CB 4.4Å; L2042-N2074 VanDerWaalsContact CD2-OD1 3.32Å; L2042-N2074 WeakPolarHBondContact CD2-OD1 3.34Å; L2042-N2074 WeakPolarHBondContact CG-OD1 3.44Å; L2042-I2079 VanDerWaalsContact C-CD1 3.5Å; L2042-I2079 VanDerWaalsContact O-CD1 3.24Å; L2042-I2079 WeakPolarHBondContact O-CD1 3.35Å
2043	I	90.6	Very high	80.4	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.9	159.3	-54.7	170.6	0	0	0	107.8	T2036 L2045 K2072 L2073 I2075 I2079 I2082 L2106 V2108 Y2118	T2036-I2043 CarbonylContact O-C 3.58Å; T2036-I2043 VanDerWaalsContact O-CA 3.3Å; T2036-I2043 WeakPolarHBondContact O-CA 3.36Å; I2043-L2045 HydrophobicContact CG2-CD2 4.17Å; I2043-L2045 HydrophobicContact CG2-CG 4.49Å; I2043-K2072 CarbonylContact O-C 3.57Å; I2043-K2072 VanDerWaalsContact O-CA 3.3Å; I2043-K2072 WeakPolarHBondContact O-CA 3.31Å; I2043-L2073 HydrophobicContact CB-CB 4.24Å; I2043-L2073 HydrophobicContact CD1-CB 4.4Å; I2043-L2073 HydrophobicContact CD1-CD1 4.35Å; I2043-L2073 PolarHBondContact N-O 3.12Å; I2043-L2073 PolarHBondContact O-N 3.11Å; I2043-I2075 HydrophobicContact CD1-CD1 3.53Å; I2043-I2075 VanDerWaalsContact CD1-CD1 3.43Å; I2043-I2075 HydrophobicContact CD1-CG1 4.41Å; I2043-I2075 HydrophobicContact CG1-CD1 4.14Å; I2043-I2079 HydrophobicContact CD1-CD1 4.34Å; I2043-I2079 HydrophobicContact CG1-CD1 3.54Å; I2043-I2079 VanDerWaalsContact CG1-CD1 3.46Å; I2043-I2082 HydrophobicContact CD1-CD1 4.49Å; I2043-I2082 HydrophobicContact CG1-CD1 4.3Å; I2043-I2082 HydrophobicContact CG2-CD1 4.3Å; I2043-L2106 HydrophobicContact CD1-CD2 4.42Å; I2043-L2106 HydrophobicContact CG2-CD2 4.46Å; I2043-V2108 HydrophobicContact CD1-CB 4.33Å; I2043-V2108 HydrophobicContact CD1-CG1 3.98Å; I2043-V2108 HydrophobicContact CD1-CG2 3.48Å; I2043-V2108 VanDerWaalsContact CD1-CG2 3.45Å; I2043-Y2118 HydrophobicContact CD1-CE2 4.38Å
2044	C	90.4	Very high	78.4	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.5	168.1	-65.2	0	0	0	0	109.4	H2018 A2035 T2036 W2046 P2069	H2018-C2044 PolarHBondContact NE2-SG 2.88Å; A2035-C2044 WeakPolarHBondContact CA-O 3.37Å; T2036-C2044 PolarHBondContact N-O 3.09Å; T2036-C2044 PolarHBondContact O-N 3.18Å; C2044-W2046 HydrophobicContact CB-CD2 4.44Å; C2044-W2046 HydrophobicContact CB-CH2 4.46Å; C2044-W2046 HydrophobicContact CB-CZ2 3.58Å; C2044-W2046 PolarHBondContact O-NE1 3.28Å; C2044-P2069 HydrophobicContact CB-CB 4.04Å
2045	L	89.3	Confident	76	Confident	0.4 Å²	0.4	27.3 Å²	27.3	0%	0.002	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	129.3	170.7	-61.3	179.8	0	0	0	108.8	L2033 L2034 A2035 I2043 P2069 S2070 K2071 F2084 L2106 L2120 M2123	L2033-L2045 HydrophobicContact CD1-CB 4.24Å; L2033-L2045 HydrophobicContact CD2-CB 4.44Å; L2033-L2045 HydrophobicContact CD2-CD1 4.33Å; L2033-L2045 HydrophobicContact CD2-CD2 4.18Å; L2033-L2045 HydrophobicContact CG-CB 4.47Å; L2034-L2045 CarbonylContact O-C 3.55Å; L2034-L2045 WeakPolarHBondContact O-CA 3.43Å; A2035-L2045 HydrophobicContact CB-CD2 3.59Å; I2043-L2045 HydrophobicContact CG2-CD2 4.17Å; I2043-L2045 HydrophobicContact CG2-CG 4.49Å; L2045-P2069 CarbonylContact O-C 3.56Å; L2045-P2069 VanDerWaalsContact O-C 3.28Å; L2045-P2069 WeakPolarHBondContact O-CA 3.39Å; L2045-P2069 WeakPolarHBondContact O-CB 3.43Å; L2045-S2070 WeakPolarHBondContact O-CB 3.04Å; L2045-S2070 PolarHBondContact O-N 3.04Å; L2045-S2070 PolarHBondContact O-OG 2.87Å; L2045-K2071 HydrophobicContact CB-CB 4.49Å; L2045-K2071 HydrophobicContact CD1-CB 4.43Å; L2045-K2071 PolarHBondContact N-O 2.99Å; L2045-K2071 PolarHBondContact O-N 3.15Å; L2045-F2084 HydrophobicContact CD2-CZ 4.45Å; L2045-L2106 HydrophobicContact CD2-CD2 4.38Å; L2045-L2120 HydrophobicContact CD1-CD2 4.39Å; L2045-M2123 HydrophobicContact CD1-CE 3.62Å; L2045-M2123 HydrophobicContact CD1-SD 3.6Å; L2045-M2123 VanDerWaalsContact CD1-SD 3.58Å
2046	W	86.9	Confident	73.2	Confident	0.8 Å²	0.8	35.8 Å²	35.8	0%	0.003	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.3	-175.1	-44.5	85.8	0	0	0	109.5	I1987 L2014 Y2017 L2033 L2034 T2036 C2044 V2048 P2069	I1987-W2046 HydrophobicContact CD1-CZ2 3.93Å; L2014-W2046 HydrophobicContact CB-CE3 4.4Å; L2014-W2046 HydrophobicContact CB-CH2 3.99Å; L2014-W2046 HydrophobicContact CB-CZ2 4.27Å; L2014-W2046 HydrophobicContact CB-CZ3 4.01Å; L2014-W2046 HydrophobicContact CD1-CD2 3.96Å; L2014-W2046 HydrophobicContact CD1-CE3 4.03Å; L2014-W2046 HydrophobicContact CD1-CG 4.23Å; L2014-W2046 HydrophobicContact CD1-CZ3 4.39Å; L2014-W2046 HydrophobicContact CD2-CE3 4.12Å; L2014-W2046 HydrophobicContact CD2-CZ3 4.17Å; L2014-W2046 HydrophobicContact CG-CE3 4.4Å; L2014-W2046 HydrophobicContact CG-CZ3 4.37Å; L2014-W2046 WeakPolarHBondContact O-CH2 3.36Å; Y2017-W2046 AromaticContact CD2-CH2 3.48Å; Y2017-W2046 HydrophobicContact CD2-CH2 3.48Å; Y2017-W2046 VanDerWaalsContact CD2-CH2 3.45Å; Y2017-W2046 AromaticContact CD2-CZ3 3.81Å; Y2017-W2046 HydrophobicContact CD2-CZ3 3.81Å; Y2017-W2046 HydrophobicContact CE2-CH2 4.25Å; Y2017-W2046 HydrophobicContact CE2-CZ3 4.12Å; Y2017-W2046 AromaticContact CG-CH2 3.82Å; Y2017-W2046 HydrophobicContact CG-CH2 3.82Å; Y2017-W2046 HydrophobicContact CG-CZ3 4.39Å; L2033-W2046 WeakPolarHBondContact CA-O 3.31Å; L2034-W2046 HydrophobicContact CB-CB 4.21Å; L2034-W2046 HydrophobicContact CD2-CB 4.45Å; L2034-W2046 HydrophobicContact CD2-CG 4.4Å; L2034-W2046 PolarHBondContact N-O 3.21Å; L2034-W2046 VanDerWaalsContact O-CD1 3.29Å; L2034-W2046 PolarHBondContact O-N 2.95Å; T2036-W2046 PolarHBondContact OG1-NE1 3.13Å; C2044-W2046 HydrophobicContact CB-CD2 4.44Å; C2044-W2046 HydrophobicContact CB-CH2 4.46Å; C2044-W2046 HydrophobicContact CB-CZ2 3.58Å; C2044-W2046 PolarHBondContact O-NE1 3.28Å; W2046-V2048 PolarHBondContact O-N 3.14Å; W2046-P2069 HydrophobicContact CD2-CB 4.16Å; W2046-P2069 HydrophobicContact CE3-CB 3.9Å; W2046-P2069 HydrophobicContact CH2-CB 4.23Å; W2046-P2069 HydrophobicContact CH2-CG 4.35Å; W2046-P2069 HydrophobicContact CZ2-CB 4.44Å; W2046-P2069 HydrophobicContact CZ3-CB 3.95Å; W2046-P2069 HydrophobicContact CZ3-CG 4.19Å
2047	E	82.6	Confident	70.4	Confident	101.2 Å²	101.2	43.9 Å²	43.9	47%	0.473	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	104.2	175.1	-167.9	167.4	173.7	0	0	108.8	L2033 G2049 E2050	L2033-E2047 HydrophobicContact CD1-CB 4.46Å; L2033-E2047 HydrophobicContact CD2-CB 4.19Å; L2033-E2047 HydrophobicContact CD2-CG 4.39Å; E2047-G2049 VanDerWaalsContact C-N 3.34Å; E2047-G2049 PolarHBondContact O-N 3.13Å; E2047-E2050 PolarHBondContact O-N 2.78Å
2048	V	75.8	Confident	67.6	Low	1.4 Å²	1.4	50.2 Å²	50.2	1%	0.008	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-80.7	-10.3	-173.1	179.9	0	0	0	0	111	L1958 W1977 W2027 R2032 L2034 W2046 E2050 L2051 F2053	L1958-V2048 HydrophobicContact CD1-CG1 4.34Å; W1977-V2048 HydrophobicContact CE3-CG1 4.17Å; W1977-V2048 HydrophobicContact CZ3-CG1 3.76Å; W2027-V2048 HydrophobicContact CH2-CB 3.85Å; W2027-V2048 HydrophobicContact CH2-CG1 4.17Å; W2027-V2048 HydrophobicContact CH2-CG2 4.15Å; W2027-V2048 HydrophobicContact CZ3-CB 3.91Å; W2027-V2048 HydrophobicContact CZ3-CG1 4.39Å; W2027-V2048 HydrophobicContact CZ3-CG2 3.68Å; R2032-V2048 PolarHBondContact O-N 3.09Å; L2034-V2048 HydrophobicContact CB-CG2 3.99Å; W2046-V2048 PolarHBondContact O-N 3.14Å; V2048-E2050 VanDerWaalsContact C-N 3.25Å; V2048-E2050 PolarHBondContact O-N 3Å; V2048-E2050 VanDerWaalsContact O-N 3.12Å; V2048-L2051 HydrophobicContact CG1-CD1 3.97Å; V2048-L2051 WeakPolarHBondContact O-CB 3.28Å; V2048-L2051 PolarHBondContact O-N 2.99Å; V2048-L2051 VanDerWaalsContact O-N 3.12Å; V2048-F2053 HydrophobicContact CG1-CB 4.2Å; V2048-F2053 HydrophobicContact CG1-CD2 4.49Å; V2048-F2053 HydrophobicContact CG1-CE2 4.17Å; V2048-F2053 HydrophobicContact CG1-CG 4.47Å
2049	G	63.4	Low	64.8	Low	28 Å²	28	54 Å²	54	29%	0.289	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-56.1	-31.4	175.4	0	0	0	0	0	114.3	E2047 L2051 G2052	E2047-G2049 VanDerWaalsContact C-N 3.34Å; E2047-G2049 PolarHBondContact O-N 3.13Å; G2049-L2051 VanDerWaalsContact C-N 3.27Å; G2049-L2051 PolarHBondContact O-N 3.11Å; G2049-G2052 PolarHBondContact O-N 2.81Å; G2049-G2052 VanDerWaalsContact O-N 3.17Å
2050	E	56.7	Low	62	Low	138.8 Å²	138.8	59.2 Å²	59.2	65%	0.649	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-67.3	-18.9	178.7	-66.6	-166.4	154.9	0	0	114	E2047 V2048 G2052 Y2056	E2047-E2050 PolarHBondContact O-N 2.78Å; V2048-E2050 VanDerWaalsContact C-N 3.25Å; V2048-E2050 PolarHBondContact O-N 3Å; V2048-E2050 VanDerWaalsContact O-N 3.12Å; E2050-G2052 VanDerWaalsContact C-N 3.27Å; E2050-G2052 PolarHBondContact O-N 3.1Å; E2050-Y2056 PolarHBondContact O-OH 2.8Å
2051	L	56.9	Low	59.4	Low	28.6 Å²	28.6	62.4 Å²	62.4	15%	0.15	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-74.8	19.4	170.7	-73.7	162.4	0	0	0	111.1	W1977 I1989 V2048 G2049 F2053 Y2056 I2067	W1977-L2051 HydrophobicContact CE3-CD1 4.41Å; W1977-L2051 HydrophobicContact CH2-CB 4.06Å; W1977-L2051 HydrophobicContact CH2-CD1 4.35Å; W1977-L2051 HydrophobicContact CZ3-CB 3.85Å; W1977-L2051 HydrophobicContact CZ3-CD1 3.73Å; W1977-L2051 HydrophobicContact CZ3-CG 4.37Å; I1989-L2051 HydrophobicContact CD1-CD1 4.35Å; V2048-L2051 HydrophobicContact CG1-CD1 3.97Å; V2048-L2051 WeakPolarHBondContact O-CB 3.28Å; V2048-L2051 PolarHBondContact O-N 2.99Å; V2048-L2051 VanDerWaalsContact O-N 3.12Å; G2049-L2051 VanDerWaalsContact C-N 3.27Å; G2049-L2051 PolarHBondContact O-N 3.11Å; L2051-F2053 WeakPolarHBondContact O-CD2 3.2Å; L2051-F2053 PolarHBondContact O-N 3.25Å; L2051-Y2056 HydrophobicContact CB-CE2 4.49Å; L2051-Y2056 HydrophobicContact CD2-CE2 4.16Å; L2051-I2067 HydrophobicContact CD1-CD1 3.52Å; L2051-I2067 HydrophobicContact CD2-CD1 3.89Å; L2051-I2067 HydrophobicContact CD2-CG1 4.17Å; L2051-I2067 HydrophobicContact CG-CD1 3.52Å; L2051-I2067 VanDerWaalsContact CG-CD1 3.46Å; L2051-I2067 HydrophobicContact CG-CG1 4.37Å
2052	G	48.7	Very low	56.8	Low	24 Å²	24	67.2 Å²	67.2	25%	0.247	39%	0.391	C	S	.	.			trans	46	55.7	-179.1	0	0	0	0	0	113.9	G2049 E2050 G2054 S2055 Y2056	G2049-G2052 PolarHBondContact O-N 2.81Å; G2049-G2052 VanDerWaalsContact O-N 3.17Å; E2050-G2052 VanDerWaalsContact C-N 3.27Å; E2050-G2052 PolarHBondContact O-N 3.1Å; G2052-G2054 PolarHBondContact O-N 3.08Å; G2052-S2055 WeakPolarHBondContact O-CB 3.36Å; G2052-S2055 PolarHBondContact O-N 2.91Å; G2052-S2055 VanDerWaalsContact O-N 3.12Å; G2052-S2055 PolarHBondContact O-OG 2.91Å; G2052-Y2056 VanDerWaalsContact O-CD2 3.3Å; G2052-Y2056 WeakPolarHBondContact O-CD2 3.39Å
2053	F	48.4	Very low	54.2	Low	28.6 Å²	28.6	68.8 Å²	68.8	13%	0.125	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	112.9	170.8	-115.9	-98.8	0	0	0	109.1	L1958 E1960 W1977 W2027 R2032 V2048 L2051 S2055	L1958-F2053 HydrophobicContact CB-CE2 4.4Å; L1958-F2053 HydrophobicContact CB-CZ 4.37Å; L1958-F2053 WeakPolarHBondContact O-CE2 3.26Å; L1958-F2053 VanDerWaalsContact O-CZ 3.25Å; L1958-F2053 WeakPolarHBondContact O-CZ 3.46Å; E1960-F2053 HydrophobicContact CB-CE1 4.04Å; E1960-F2053 HydrophobicContact CB-CZ 4.28Å; W1977-F2053 AromaticContact CD2-CD2 3.6Å; W1977-F2053 HydrophobicContact CD2-CD2 3.6Å; W1977-F2053 AromaticContact CD2-CE2 3.98Å; W1977-F2053 HydrophobicContact CD2-CE2 3.98Å; W1977-F2053 AromaticContact CE2-CD2 3.8Å; W1977-F2053 HydrophobicContact CE3-CB 4.42Å; W1977-F2053 AromaticContact CE3-CD2 3.49Å; W1977-F2053 HydrophobicContact CE3-CD2 3.49Å; W1977-F2053 VanDerWaalsContact CE3-CD2 3.49Å; W1977-F2053 HydrophobicContact CE3-CE1 4.18Å; W1977-F2053 HydrophobicContact CE3-CE2 4.13Å; W1977-F2053 HydrophobicContact CE3-CG 4.29Å; W1977-F2053 HydrophobicContact CE3-CZ 4.19Å; W1977-F2053 HydrophobicContact CG-CD2 4.33Å; W1977-F2053 HydrophobicContact CG-CE2 4.24Å; W1977-F2053 HydrophobicContact CH2-CB 3.69Å; W1977-F2053 AromaticContact CH2-CD1 3.79Å; W1977-F2053 HydrophobicContact CH2-CD1 3.79Å; W1977-F2053 AromaticContact CH2-CD2 3.84Å; W1977-F2053 HydrophobicContact CH2-CD2 4.1Å; W1977-F2053 AromaticContact CH2-CE1 3.41Å; W1977-F2053 HydrophobicContact CH2-CE1 3.41Å; W1977-F2053 AromaticContact CH2-CE2 3.99Å; W1977-F2053 HydrophobicContact CH2-CE2 4.04Å; W1977-F2053 HydrophobicContact CH2-CG 4.26Å; W1977-F2053 AromaticContact CH2-CZ 3.56Å; W1977-F2053 HydrophobicContact CH2-CZ 3.56Å; W1977-F2053 HydrophobicContact CZ2-CB 4.41Å; W1977-F2053 AromaticContact CZ2-CD1 3.97Å; W1977-F2053 HydrophobicContact CZ2-CD1 4.15Å; W1977-F2053 AromaticContact CZ2-CD2 3.92Å; W1977-F2053 HydrophobicContact CZ2-CD2 3.92Å; W1977-F2053 AromaticContact CZ2-CE1 3.83Å; W1977-F2053 HydrophobicContact CZ2-CE1 3.98Å; W1977-F2053 HydrophobicContact CZ2-CZ 4.44Å; W1977-F2053 HydrophobicContact CZ3-CB 3.69Å; W1977-F2053 HydrophobicContact CZ3-CD1 4.31Å; W1977-F2053 AromaticContact CZ3-CD2 3.62Å; W1977-F2053 HydrophobicContact CZ3-CD2 3.62Å; W1977-F2053 AromaticContact CZ3-CE1 3.63Å; W1977-F2053 HydrophobicContact CZ3-CE1 3.63Å; W1977-F2053 HydrophobicContact CZ3-CE2 4.13Å; W1977-F2053 HydrophobicContact CZ3-CG 4.05Å; W1977-F2053 AromaticContact CZ3-CZ 3.44Å; W1977-F2053 HydrophobicContact CZ3-CZ 3.44Å; W2027-F2053 HydrophobicContact CH2-CD1 4.48Å; W2027-F2053 HydrophobicContact CH2-CE1 4.46Å; W2027-F2053 HydrophobicContact CZ2-CD1 4.36Å; W2027-F2053 AromaticContact CZ2-CE1 3.84Å; W2027-F2053 HydrophobicContact CZ2-CE1 3.92Å; W2027-F2053 HydrophobicContact CZ2-CZ 4.4Å; R2032-F2053 HydrophobicContact CG-CD1 4.27Å; R2032-F2053 PolarHBondContact NH1-O 2.91Å; R2032-F2053 PolarHBondContact NH2-O 2.75Å; V2048-F2053 HydrophobicContact CG1-CB 4.2Å; V2048-F2053 HydrophobicContact CG1-CD2 4.49Å; V2048-F2053 HydrophobicContact CG1-CE2 4.17Å; V2048-F2053 HydrophobicContact CG1-CG 4.47Å; L2051-F2053 WeakPolarHBondContact O-CD2 3.2Å; L2051-F2053 PolarHBondContact O-N 3.25Å; F2053-S2055 VanDerWaalsContact C-N 3.34Å; F2053-S2055 PolarHBondContact O-N 3.45Å
2054	G	45.1	Very low	51.9	Low	41.4 Å²	41.4	73.1 Å²	73.1	43%	0.427	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	7.4	179.2	0	0	0	0	0	116.6	E1960 R2032 G2052	E1960-G2054 WeakPolarHBondContact OE2-CA 3.42Å; R2032-G2054 PolarHBondContact NH2-O 3.23Å; G2052-G2054 PolarHBondContact O-N 3.08Å
2055	S	38.6	Very low	49.9	Very low	60 Å²	60	79.4 Å²	79.4	42%	0.42	47%	0.47	S	S	.	.			trans	-111	91.1	178.1	87.2	0	0	0	0	113.6	Q1975 G2052 F2053 F2057 T2058	Q1975-S2055 PolarHBondContact NE2-O 2.85Å; G2052-S2055 WeakPolarHBondContact O-CB 3.36Å; G2052-S2055 PolarHBondContact O-N 2.91Å; G2052-S2055 VanDerWaalsContact O-N 3.12Å; G2052-S2055 PolarHBondContact O-OG 2.91Å; F2053-S2055 VanDerWaalsContact C-N 3.34Å; F2053-S2055 PolarHBondContact O-N 3.45Å; S2055-F2057 VanDerWaalsContact C-N 3.27Å; S2055-F2057 PolarHBondContact O-N 3.33Å; S2055-T2058 PolarHBondContact O-N 2.82Å
2056	Y	32.1	Very low	48.2	Very low	177.4 Å²	177.4	87.8 Å²	87.8	70%	0.696	51%	0.507	S	S	*	.			trans	-75.2	43.4	179.2	-74.2	-84.9	0	0	0	112.8	E2050 L2051 G2052 T2058	E2050-Y2056 PolarHBondContact O-OH 2.8Å; L2051-Y2056 HydrophobicContact CB-CE2 4.49Å; L2051-Y2056 HydrophobicContact CD2-CE2 4.16Å; G2052-Y2056 VanDerWaalsContact O-CD2 3.3Å; G2052-Y2056 WeakPolarHBondContact O-CD2 3.39Å; Y2056-T2058 PolarHBondContact O-N 3.19Å
2057	F	33.3	Very low	47.3	Very low	170.8 Å²	170.8	88.4 Å²	88.4	75%	0.749	51%	0.51	S	S	*	.			trans	-83.7	59.8	176.7	-89.4	-76	0	0	0	113.2	S2055 S2059	S2055-F2057 VanDerWaalsContact C-N 3.27Å; S2055-F2057 PolarHBondContact O-N 3.33Å; F2057-S2059 VanDerWaalsContact C-N 3.32Å; F2057-S2059 PolarHBondContact O-N 3.09Å
2058	T	31.5	Very low	46.6	Very low	132.6 Å²	132.6	91.2 Å²	91.2	81%	0.813	52%	0.52	S	S	*	.			trans	-96.2	72.3	167.9	53.8	0	0	0	0	111.7	S2055 Y2056 T2060	S2055-T2058 PolarHBondContact O-N 2.82Å; Y2056-T2058 PolarHBondContact O-N 3.19Å; T2058-T2060 PolarHBondContact O-N 3.3Å; T2058-T2060 VanDerWaalsContact O-N 3.12Å
2059	S	31.3	Very low	46.6	Very low	79.8 Å²	79.8	92 Å²	92	56%	0.558	53%	0.525	S	S	*	.			trans	-119.8	109	171.7	83.3	0	0	0	0	112.6	F2057 S2061	F2057-S2059 VanDerWaalsContact C-N 3.32Å; F2057-S2059 PolarHBondContact O-N 3.09Å; S2059-S2061 PolarHBondContact O-N 3.3Å
2060	T	30.6	Very low	47.3	Very low	149.6 Å²	149.6	93.6 Å²	93.6	92%	0.918	53%	0.533	S	S	*	.			trans	-79.4	76.5	164.5	44.7	0	0	0	0	112.1	T2058	T2058-T2060 PolarHBondContact O-N 3.3Å; T2058-T2060 VanDerWaalsContact O-N 3.12Å
2061	S	34.3	Very low	48.6	Very low	93.8 Å²	93.8	91 Å²	91	66%	0.656	52%	0.519	S	S	*	.			trans	-140.5	107.1	162.5	56.8	0	0	0	0	110.3	S2059 G2063	S2059-S2061 PolarHBondContact O-N 3.3Å; S2061-G2063 VanDerWaalsContact C-N 3.32Å; S2061-G2063 PolarHBondContact O-N 2.95Å; S2061-G2063 VanDerWaalsContact O-N 3.13Å
2062	S	35.2	Very low	49.9	Very low	128.8 Å²	128.8	94.2 Å²	94.2	90%	0.901	53%	0.532	S	S	*	.			trans	-80.7	72.5	-175.9	60.4	0	0	0	0	113.1
2063	G	35.6	Very low	51.7	Low	57.8 Å²	57.8	94.1 Å²	94.1	60%	0.596	53%	0.525	S	S	*	.			trans	-148.2	120.8	174.4	0	0	0	0	0	112.4	S2061 K2065	S2061-G2063 VanDerWaalsContact C-N 3.32Å; S2061-G2063 PolarHBondContact O-N 2.95Å; S2061-G2063 VanDerWaalsContact O-N 3.13Å; G2063-K2065 PolarHBondContact O-N 3.04Å; G2063-K2065 VanDerWaalsContact O-N 3.15Å
2064	C	42.6	Very low	53.5	Low	90.4 Å²	90.4	98.7 Å²	98.7	61%	0.611	55%	0.551	S	S	*	*			trans	-59.5	106.9	172.3	-85.1	0	0	0	0	110.1	I1423 K2066	I1423-C2064 HydrophobicContact CG1-CB 4.43Å; C2064-K2066 PolarHBondContact O-N 3Å; C2064-K2066 VanDerWaalsContact O-N 3.12Å
2065	K	49.9	Very low	55.5	Low	132.8 Å²	132.8	97.6 Å²	97.6	58%	0.577	54%	0.536	S	S	*	.			trans	-68.9	120.9	173.7	-71.5	-179.2	179.8	175.7	0	109.3	C2012 G2063 I2067	C2012-K2065 PolarHBondContact SG-O 2.79Å; G2063-K2065 PolarHBondContact O-N 3.04Å; G2063-K2065 VanDerWaalsContact O-N 3.15Å; K2065-I2067 PolarHBondContact O-N 3.04Å
2066	K	53	Low	57.6	Low	178 Å²	178	104.5 Å²	104.5	77%	0.774	56%	0.558	S	S	*	*			trans	-78.2	108.6	168.5	-73.2	-172.9	176.4	-174.3	0	109.2	C2064 K2068	C2064-K2066 PolarHBondContact O-N 3Å; C2064-K2066 VanDerWaalsContact O-N 3.12Å; K2066-K2068 PolarHBondContact O-N 3.06Å
2067	I	66.7	Low	60.3	Low	13 Å²	13	96.7 Å²	96.7	7%	0.067	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-75.3	137	171.6	-49.4	170.2	0	0	0	107.9	L2014 Y2017 L2051 K2065	L2014-I2067 HydrophobicContact CD2-CB 3.78Å; L2014-I2067 HydrophobicContact CD2-CD1 3.94Å; L2014-I2067 HydrophobicContact CD2-CG1 4.08Å; L2014-I2067 HydrophobicContact CD2-CG2 4.38Å; Y2017-I2067 VanDerWaalsContact CE2-O 3.26Å; Y2017-I2067 WeakPolarHBondContact CE2-O 2.86Å; L2051-I2067 HydrophobicContact CD1-CD1 3.52Å; L2051-I2067 HydrophobicContact CD2-CD1 3.89Å; L2051-I2067 HydrophobicContact CD2-CG1 4.17Å; L2051-I2067 HydrophobicContact CG-CD1 3.52Å; L2051-I2067 VanDerWaalsContact CG-CD1 3.46Å; L2051-I2067 HydrophobicContact CG-CG1 4.37Å; K2065-I2067 PolarHBondContact O-N 3.04Å
2068	K	69.7	Low	62.9	Low	158.6 Å²	158.6	89.8 Å²	89.8	69%	0.69	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-90.1	143.2	171.1	-57.7	-167	175.4	172.8	0	108.9	Y2017 K2066 S2070	Y2017-K2068 WeakPolarHBondContact OH-CA 3.43Å; Y2017-K2068 VanDerWaalsContact OH-CG 3.24Å; Y2017-K2068 WeakPolarHBondContact OH-CG 3.37Å; K2066-K2068 PolarHBondContact O-N 3.06Å; K2068-S2070 PolarHBondContact O-N 3.09Å
2069	P	75.9	Confident	65.7	Low	19 Å²	19	83.5 Å²	83.5	12%	0.123	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-63	130	172.7	26.9	-32.3	0	0	0	109	Y2017 C2044 L2045 W2046 K2071 K2072	Y2017-P2069 VanDerWaalsContact CD1-CD 3.5Å; Y2017-P2069 HydrophobicContact CD1-CG 3.7Å; Y2017-P2069 HydrophobicContact CD2-CG 4.48Å; Y2017-P2069 HydrophobicContact CE1-CG 3.91Å; Y2017-P2069 HydrophobicContact CG-CG 4.09Å; C2044-P2069 HydrophobicContact CB-CB 4.04Å; L2045-P2069 CarbonylContact O-C 3.56Å; L2045-P2069 VanDerWaalsContact O-C 3.28Å; L2045-P2069 WeakPolarHBondContact O-CA 3.39Å; L2045-P2069 WeakPolarHBondContact O-CB 3.43Å; W2046-P2069 HydrophobicContact CD2-CB 4.16Å; W2046-P2069 HydrophobicContact CE3-CB 3.9Å; W2046-P2069 HydrophobicContact CH2-CB 4.23Å; W2046-P2069 HydrophobicContact CH2-CG 4.35Å; W2046-P2069 HydrophobicContact CZ2-CB 4.44Å; W2046-P2069 HydrophobicContact CZ3-CB 3.95Å; W2046-P2069 HydrophobicContact CZ3-CG 4.19Å; P2069-K2071 VanDerWaalsContact C-N 3.29Å; P2069-K2071 PolarHBondContact O-N 3.06Å; P2069-K2072 HydrophobicContact CB-CG 4.46Å; P2069-K2072 HydrophobicContact CG-CD 4.44Å; P2069-K2072 VanDerWaalsContact CG-CE 3.48Å; P2069-K2072 HydrophobicContact CG-CG 4.12Å
2070	S	77.9	Confident	68.4	Low	62.6 Å²	62.6	81 Å²	81	44%	0.438	44%	0.444	S	S	.	.	S	Bend	trans	-61.5	-34.7	179.1	62.4	0	0	0	0	111.5	L2045 K2068	L2045-S2070 WeakPolarHBondContact O-CB 3.04Å; L2045-S2070 PolarHBondContact O-N 3.04Å; L2045-S2070 PolarHBondContact O-OG 2.87Å; K2068-S2070 PolarHBondContact O-N 3.09Å
2071	K	82.8	Confident	71.1	Confident	83.6 Å²	83.6	74.3 Å²	74.3	36%	0.363	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	149	172.7	-157.7	161	-174.4	173.4	0	111.5	L2045 P2069 L2073 M2123	L2045-K2071 HydrophobicContact CB-CB 4.49Å; L2045-K2071 HydrophobicContact CD1-CB 4.43Å; L2045-K2071 PolarHBondContact N-O 2.99Å; L2045-K2071 PolarHBondContact O-N 3.15Å; P2069-K2071 VanDerWaalsContact C-N 3.29Å; P2069-K2071 PolarHBondContact O-N 3.06Å; K2071-L2073 HydrophobicContact CD-CD2 4.12Å; K2071-L2073 HydrophobicContact CG-CD2 4.36Å; K2071-M2123 HydrophobicContact CD-CB 3.88Å; K2071-M2123 HydrophobicContact CD-CG 4.02Å; K2071-M2123 HydrophobicContact CD-SD 4.31Å; K2071-M2123 VanDerWaalsContact NZ-CB 3.28Å; K2071-M2123 PolarHBondContact NZ-O 3.02Å
2072	K	85.3	Confident	73.9	Confident	95.6 Å²	95.6	70.3 Å²	70.3	42%	0.416	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136	168.4	-62.5	-170.8	180	-169.8	0	109.7	Y2017 L2042 I2043 P2069	Y2017-K2072 PolarHBondContact O-NZ 2.85Å; L2042-K2072 HydrophobicContact CD2-CB 4.36Å; L2042-K2072 HydrophobicContact CD2-CD 4.47Å; I2043-K2072 CarbonylContact O-C 3.57Å; I2043-K2072 VanDerWaalsContact O-CA 3.3Å; I2043-K2072 WeakPolarHBondContact O-CA 3.31Å; P2069-K2072 HydrophobicContact CB-CG 4.46Å; P2069-K2072 HydrophobicContact CG-CD 4.44Å; P2069-K2072 VanDerWaalsContact CG-CE 3.48Å; P2069-K2072 HydrophobicContact CG-CG 4.12Å
2073	L	85.6	Confident	76.5	Confident	21.6 Å²	21.6	65.1 Å²	65.1	11%	0.113	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128.9	173	-56.8	170.7	0	0	0	108.5	I2043 K2071 Y2118	I2043-L2073 HydrophobicContact CB-CB 4.24Å; I2043-L2073 HydrophobicContact CD1-CB 4.4Å; I2043-L2073 HydrophobicContact CD1-CD1 4.35Å; I2043-L2073 PolarHBondContact N-O 3.12Å; I2043-L2073 PolarHBondContact O-N 3.11Å; K2071-L2073 HydrophobicContact CD-CD2 4.12Å; K2071-L2073 HydrophobicContact CG-CD2 4.36Å; L2073-Y2118 HydrophobicContact CD1-CD1 4Å; L2073-Y2118 HydrophobicContact CD1-CD2 4.34Å; L2073-Y2118 HydrophobicContact CD1-CE1 4.25Å; L2073-Y2118 HydrophobicContact CD1-CG 4.21Å; L2073-Y2118 HydrophobicContact CD2-CD1 4.5Å; L2073-Y2118 HydrophobicContact CD2-CE1 4.36Å
2074	N	85.8	Confident	79.1	Confident	126.2 Å²	126.2	62.9 Å²	62.9	68%	0.675	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	130.6	177.7	-68.9	2.5	0	0	0	109.5	L2042	L2042-N2074 HydrophobicContact CD2-CB 4.4Å; L2042-N2074 VanDerWaalsContact CD2-OD1 3.32Å; L2042-N2074 WeakPolarHBondContact CD2-OD1 3.34Å; L2042-N2074 WeakPolarHBondContact CG-OD1 3.44Å
2075	I	86.8	Confident	81.1	Confident	18.2 Å²	18.2	59.2 Å²	59.2	9%	0.093	29%	0.285	C	S	.	.			trans	-115.2	161.2	176.6	-61.6	-179.1	0	0	0	108.7	C2041 I2043 S2077 I2079 V2108 H2116 Y2118	C2041-I2075 WeakPolarHBondContact CB-O 3.28Å; C2041-I2075 PolarHBondContact O-N 3.15Å; I2043-I2075 HydrophobicContact CD1-CD1 3.53Å; I2043-I2075 VanDerWaalsContact CD1-CD1 3.43Å; I2043-I2075 HydrophobicContact CD1-CG1 4.41Å; I2043-I2075 HydrophobicContact CG1-CD1 4.14Å; I2075-S2077 VanDerWaalsContact C-N 3.34Å; I2075-I2079 HydrophobicContact CD1-CD1 4.33Å; I2075-I2079 HydrophobicContact CD1-CG1 4.48Å; I2075-V2108 HydrophobicContact CD1-CB 4.38Å; I2075-V2108 HydrophobicContact CD1-CG1 3.85Å; I2075-V2108 HydrophobicContact CD1-CG2 4.49Å; I2075-H2116 HydrophobicContact CD1-CB 4.42Å; I2075-H2116 VanDerWaalsContact CG2-CD2 3.49Å; I2075-H2116 WeakPolarHBondContact CG2-CD2 3.33Å; I2075-H2116 WeakPolarHBondContact CG2-NE2 3.3Å; I2075-Y2118 HydrophobicContact CD1-CE2 4.05Å
2076	K	83.9	Confident	82.2	Confident	204 Å²	204	56.2 Å²	56.2	89%	0.887	28%	0.275	S	S	*	.	S	Bend	trans	-81.4	-15	-178.7	-67.6	-174.3	178	-178.1	0	114.2
2077	S	87.8	Confident	82.6	Confident	14.6 Å²	14.6	48.7 Å²	48.7	10%	0.102	24%	0.244	C	C	.	.	S	Bend	trans	-130	154.9	-174.5	139.2	0	0	0	0	111.3	C2041 I2075 C2110 W2111 D2112	C2041-S2077 VanDerWaalsContact CB-O 3.3Å; C2041-S2077 WeakPolarHBondContact CB-O 3.32Å; C2041-S2077 PolarHBondContact SG-O 3.09Å; I2075-S2077 VanDerWaalsContact C-N 3.34Å; S2077-C2110 VanDerWaalsContact OG-CB 3.22Å; S2077-C2110 WeakPolarHBondContact OG-CB 3.39Å; S2077-C2110 PolarHBondContact OG-SG 3.15Å; S2077-W2111 PolarHBondContact OG-N 2.89Å; S2077-D2112 VanDerWaalsContact CB-CG 3.45Å; S2077-D2112 VanDerWaalsContact CB-OD2 3.27Å; S2077-D2112 WeakPolarHBondContact CB-OD2 3.37Å; S2077-D2112 PolarHBondContact OG-N 2.75Å; S2077-D2112 PolarHBondContact OG-OD2 2.99Å
2078	S	89.3	Confident	82.2	Confident	26 Å²	26	50.8 Å²	50.8	18%	0.182	26%	0.256	C	S	.	.			trans	-64.2	141.6	177.7	-63	0	0	0	0	111	L2039 C2041 C2110 W2111	L2039-S2078 PolarHBondContact O-OG 3.03Å; L2039-S2078 VanDerWaalsContact O-OG 3.09Å; C2041-S2078 PolarHBondContact SG-N 3.21Å; C2041-S2078 VanDerWaalsContact SG-N 3.36Å; S2078-C2110 CarbonylContact O-C 3.55Å; S2078-C2110 VanDerWaalsContact O-CA 3.28Å; S2078-C2110 WeakPolarHBondContact O-CA 3.34Å; S2078-W2111 PolarHBondContact O-N 3.03Å
2079	I	89.5	Confident	81.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	134.1	-174.1	-59.6	156.8	0	0	0	109.3	T2023 V2024 G2038 L2042 I2043 I2075 I2082 V2108	T2023-I2079 WeakPolarHBondContact CB-O 3.41Å; T2023-I2079 PolarHBondContact OG1-O 3.11Å; V2024-I2079 HydrophobicContact CG1-CG2 4.21Å; G2038-I2079 PolarHBondContact O-N 3.04Å; L2042-I2079 VanDerWaalsContact C-CD1 3.5Å; L2042-I2079 VanDerWaalsContact O-CD1 3.24Å; L2042-I2079 WeakPolarHBondContact O-CD1 3.35Å; I2043-I2079 HydrophobicContact CD1-CD1 4.34Å; I2043-I2079 HydrophobicContact CG1-CD1 3.54Å; I2043-I2079 VanDerWaalsContact CG1-CD1 3.46Å; I2075-I2079 HydrophobicContact CD1-CD1 4.33Å; I2075-I2079 HydrophobicContact CD1-CG1 4.48Å; I2079-I2082 HydrophobicContact CG2-CD1 4.06Å; I2079-I2082 HydrophobicContact CG2-CG1 3.87Å; I2079-V2108 HydrophobicContact CD1-CG1 4.33Å; I2079-V2108 HydrophobicContact CG1-CG1 4.04Å; I2079-V2108 HydrophobicContact CG2-CG1 3.78Å
2080	N	87.2	Confident	80	Confident	27.2 Å²	27.2	52.1 Å²	52.1	15%	0.145	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	-34	177.1	-115.7	2.4	0	0	0	113.2	G2109 W2111 I2136 K2198	N2080-G2109 PolarHBondContact N-O 2.92Å; N2080-W2111 VanDerWaalsContact CG-NE1 3.25Å; N2080-W2111 VanDerWaalsContact ND2-CE3 3.26Å; N2080-W2111 PolarHBondContact ND2-NE1 2.9Å; N2080-W2111 VanDerWaalsContact ND2-NE1 3.12Å; N2080-W2111 PolarHBondContact OD1-NE1 2.8Å; N2080-I2136 VanDerWaalsContact CB-O 3.27Å; N2080-I2136 WeakPolarHBondContact CB-O 3.32Å; N2080-I2136 PolarHBondContact ND2-O 2.95Å; N2080-K2198 PolarHBondContact O-NZ 3.22Å; N2080-K2198 PolarHBondContact OD1-NZ 3.03Å
2081	S	89	Confident	78.3	Confident	8 Å²	8	51.6 Å²	51.6	6%	0.056	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	145.1	-174.3	94.5	0	0	0	0	111.4	V2108 G2109 L2139	S2081-V2108 WeakPolarHBondContact O-CA 3.36Å; S2081-G2109 PolarHBondContact N-O 3.19Å; S2081-G2109 PolarHBondContact O-N 3.17Å; S2081-L2139 WeakPolarHBondContact OG-CG 3.35Å; S2081-L2139 PolarHBondContact OG-N 3.07Å
2082	I	91.9	Very high	76.4	Confident	10 Å²	10	53 Å²	53	5%	0.051	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	138.7	178.1	-69.5	-180	0	0	0	107.6	V2024 A2026 A2035 I2043 I2079 L2106 A2107 V2108	V2024-I2082 HydrophobicContact CG1-CB 4.03Å; V2024-I2082 HydrophobicContact CG1-CD1 3.9Å; V2024-I2082 HydrophobicContact CG1-CG1 3.71Å; V2024-I2082 HydrophobicContact CG2-CB 4.32Å; A2026-I2082 HydrophobicContact CB-CG2 4.11Å; A2035-I2082 HydrophobicContact CB-CG2 4.2Å; I2043-I2082 HydrophobicContact CD1-CD1 4.49Å; I2043-I2082 HydrophobicContact CG1-CD1 4.3Å; I2043-I2082 HydrophobicContact CG2-CD1 4.3Å; I2079-I2082 HydrophobicContact CG2-CD1 4.06Å; I2079-I2082 HydrophobicContact CG2-CG1 3.87Å; I2082-L2106 HydrophobicContact CG2-CD1 3.39Å; I2082-L2106 VanDerWaalsContact CG2-CD1 3.46Å; I2082-L2106 HydrophobicContact CG2-CG 4.34Å; I2082-A2107 WeakPolarHBondContact CA-O 3.11Å; I2082-V2108 HydrophobicContact CG1-CG1 4.22Å; I2082-V2108 HydrophobicContact CG1-CG2 4.45Å
2083	S	91	Very high	74.5	Confident	20.2 Å²	20.2	52.4 Å²	52.4	14%	0.141	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	138.9	175.1	-160.3	0	0	0	0	111.5	A2107 Y2141	S2083-A2107 PolarHBondContact N-O 2.98Å; S2083-A2107 PolarHBondContact O-N 3.12Å; S2083-Y2141 WeakPolarHBondContact O-CE2 3.37Å; S2083-Y2141 WeakPolarHBondContact OG-CD2 3.48Å; S2083-Y2141 PolarHBondContact OG-N 3.36Å
2084	F	88.8	Confident	72.6	Confident	11.6 Å²	11.6	55.2 Å²	55.2	5%	0.051	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	136.5	174.3	-77.3	-65.9	0	0	0	111.1	A2026 W2027 H2028 L2033 A2035 L2045 L2086 L2106 L2120 Y2141	A2026-F2084 HydrophobicContact CB-CD2 3.85Å; A2026-F2084 HydrophobicContact CB-CE2 4.03Å; A2026-F2084 WeakPolarHBondContact O-CE2 3.4Å; W2027-F2084 WeakPolarHBondContact O-CD2 3.38Å; H2028-F2084 HydrophobicContact CB-CD1 4.26Å; H2028-F2084 HydrophobicContact CB-CD2 3.88Å; H2028-F2084 HydrophobicContact CB-CE1 4.23Å; H2028-F2084 HydrophobicContact CB-CE2 3.85Å; H2028-F2084 HydrophobicContact CB-CG 4.08Å; H2028-F2084 HydrophobicContact CB-CZ 4.03Å; H2028-F2084 AromaticContact CD2-CD1 3.81Å; L2033-F2084 HydrophobicContact CD2-CE1 4.32Å; L2033-F2084 HydrophobicContact CD2-CZ 4.26Å; A2035-F2084 HydrophobicContact CB-CE1 4.49Å; A2035-F2084 HydrophobicContact CB-CE2 3.78Å; A2035-F2084 HydrophobicContact CB-CZ 3.59Å; A2035-F2084 VanDerWaalsContact CB-CZ 3.5Å; L2045-F2084 HydrophobicContact CD2-CZ 4.45Å; F2084-L2086 HydrophobicContact CB-CD2 4.27Å; F2084-L2086 PolarHBondContact O-N 3.06Å; F2084-L2106 HydrophobicContact CD1-CB 4.41Å; F2084-L2106 HydrophobicContact CD1-CD1 3.67Å; F2084-L2106 HydrophobicContact CE1-CB 4.4Å; F2084-L2106 HydrophobicContact CE1-CD1 3.59Å; F2084-L2106 HydrophobicContact CE1-CG 4.41Å; F2084-L2106 HydrophobicContact CE2-CD1 4.44Å; F2084-L2106 HydrophobicContact CG-CD1 4.26Å; F2084-L2106 HydrophobicContact CZ-CD1 4.12Å; F2084-L2120 HydrophobicContact CD1-CD1 3.67Å; F2084-L2120 HydrophobicContact CE1-CD1 3.62Å; F2084-L2120 VanDerWaalsContact CE1-CD1 3.48Å; F2084-L2120 HydrophobicContact CE1-CD2 3.91Å; F2084-L2120 HydrophobicContact CE1-CG 4.38Å; F2084-Y2141 VanDerWaalsContact C-CD2 3.46Å; F2084-Y2141 VanDerWaalsContact O-CD2 3.25Å; F2084-Y2141 WeakPolarHBondContact O-CD2 3.3Å
2085	R	84.4	Confident	70.7	Confident	13.4 Å²	13.4	57.6 Å²	57.6	5%	0.051	31%	0.306	C	S	.	.			trans	-79.7	110.4	165.5	-169.9	178.2	178.4	168.2	1.4	109.1	R2103 V2105 Y2141 N2145 G2146 A2163 D2164	R2085-R2103 WeakPolarHBondContact CB-O 3.36Å; R2085-R2103 WeakPolarHBondContact CD-O 3.45Å; R2085-R2103 WeakPolarHBondContact CG-O 3.5Å; R2085-R2103 VanDerWaalsContact CZ-CD 3.45Å; R2085-R2103 VanDerWaalsContact NH2-NH1 3.12Å; R2085-V2105 HydrophobicContact CB-CB 4.18Å; R2085-V2105 WeakPolarHBondContact CB-O 3.29Å; R2085-V2105 PolarHBondContact N-O 3.26Å; R2085-Y2141 HydrophobicContact CB-CD1 4.19Å; R2085-Y2141 HydrophobicContact CB-CD2 4.17Å; R2085-Y2141 HydrophobicContact CB-CE1 4.01Å; R2085-Y2141 HydrophobicContact CB-CE2 3.98Å; R2085-Y2141 HydrophobicContact CB-CG 4.26Å; R2085-Y2141 HydrophobicContact CG-CD1 4.14Å; R2085-Y2141 HydrophobicContact CG-CE1 4.13Å; R2085-Y2141 HydrophobicContact CG-CG 4.43Å; R2085-N2145 PolarHBondContact NE-O 3.07Å; R2085-N2145 PolarHBondContact NH2-O 3.1Å; R2085-G2146 VanDerWaalsContact CZ-O 3.29Å; R2085-G2146 PolarHBondContact NE-O 3Å; R2085-G2146 VanDerWaalsContact NE-O 3.13Å; R2085-G2146 PolarHBondContact NH2-O 3.17Å; R2085-A2163 VanDerWaalsContact NH1-C 3.25Å; R2085-A2163 PolarHBondContact NH1-O 3.1Å; R2085-D2164 IonicContact CZ-OD1 3.35Å; R2085-D2164 IonicContact CZ-OD2 3.38Å; R2085-D2164 IonicContact NH1-OD1 3.34Å; R2085-D2164 PolarHBondContact NH1-OD1 3.14Å; R2085-D2164 IonicContact NH1-OD2 2.73Å; R2085-D2164 PolarHBondContact NH1-OD2 2.78Å; R2085-D2164 VanDerWaalsContact NH2-CG 3.3Å; R2085-D2164 IonicContact NH2-OD1 3.15Å; R2085-D2164 PolarHBondContact NH2-OD1 3.11Å; R2085-D2164 IonicContact NH2-OD2 3.24Å; R2085-D2164 PolarHBondContact NH2-OD2 3.2Å
2086	L	73.7	Confident	68.7	Low	69.2 Å²	69.2	61.5 Å²	61.5	36%	0.362	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-91.9	135	180	-60.4	176.1	0	0	0	111	P2029 F2084	P2029-L2086 HydrophobicContact CG-CD2 4.27Å; F2084-L2086 HydrophobicContact CB-CD2 4.27Å; F2084-L2086 PolarHBondContact O-N 3.06Å
2087	P	61.9	Low	66.9	Low	19.6 Å²	19.6	55.5 Å²	55.5	13%	0.127	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-71.2	150.4	170.8	28.4	-32.8	0	0	0	111.4	K2030 Y2089 L2102 R2103	K2030-P2087 HydrophobicContact CD-CG 4.39Å; P2087-Y2089 HydrophobicContact CB-CD2 4.45Å; P2087-Y2089 HydrophobicContact CB-CE2 3.74Å; P2087-Y2089 HydrophobicContact CG-CD2 4.44Å; P2087-Y2089 HydrophobicContact CG-CE1 4.2Å; P2087-Y2089 HydrophobicContact CG-CE2 3.47Å; P2087-Y2089 VanDerWaalsContact CG-CE2 3.47Å; P2087-Y2089 WeakPolarHBondContact CG-OH 3.21Å; P2087-Y2089 WeakPolarHBondContact O-CD2 3.38Å; P2087-Y2089 VanDerWaalsContact O-CE2 3.23Å; P2087-Y2089 WeakPolarHBondContact O-CE2 3.35Å; P2087-L2102 HydrophobicContact CB-CD2 4.13Å; P2087-R2103 HydrophobicContact CB-CB 4.43Å
2088	N	57.5	Low	64.9	Low	57.6 Å²	57.6	58.2 Å²	58.2	31%	0.308	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-88	125.2	179.8	-154.8	-7.3	0	0	0	110.8	A2090 E2094 P2143 N2145	N2088-A2090 VanDerWaalsContact C-N 3.29Å; N2088-A2090 PolarHBondContact O-N 3.2Å; N2088-A2090 WeakPolarHBondContact OD1-CB 3.24Å; N2088-A2090 PolarHBondContact OD1-N 2.79Å; N2088-A2090 VanDerWaalsContact OD1-N 3.11Å; N2088-E2094 VanDerWaalsContact O-OE2 3.08Å; N2088-P2143 PolarHBondContact OD1-O 2.8Å; N2088-P2143 VanDerWaalsContact OD1-O 3.08Å; N2088-N2145 WeakPolarHBondContact CA-OD1 3.4Å; N2088-N2145 HydrophobicContact CB-CB 4.31Å; N2088-N2145 VanDerWaalsContact CB-CG 3.47Å; N2088-N2145 WeakPolarHBondContact CB-OD1 3.4Å; N2088-N2145 PolarHBondContact N-OD1 3.16Å; N2088-N2145 VanDerWaalsContact N-OD1 3.12Å; N2088-N2145 PolarHBondContact ND2-OD1 3.02Å
2089	Y	51.5	Low	62.8	Low	116.2 Å²	116.2	61.6 Å²	61.6	46%	0.456	35%	0.351	S	S	.	.			trans	-91.9	-0.5	-178.5	-57.8	-79.5	0	0	0	113.9	V1961 P2029 K2030 P2087 S2091	V1961-Y2089 HydrophobicContact CB-CE1 4.38Å; V1961-Y2089 HydrophobicContact CG1-CD1 4.16Å; V1961-Y2089 HydrophobicContact CG1-CE1 3.98Å; V1961-Y2089 HydrophobicContact CG2-CE1 4.11Å; P2029-Y2089 WeakPolarHBondContact CG-OH 3.49Å; K2030-Y2089 VanDerWaalsContact CB-OH 3.27Å; K2030-Y2089 WeakPolarHBondContact CB-OH 3.37Å; K2030-Y2089 HydrophobicContact CD-CD2 4.43Å; K2030-Y2089 HydrophobicContact CD-CE1 4.12Å; K2030-Y2089 HydrophobicContact CD-CE2 3.61Å; K2030-Y2089 VanDerWaalsContact NZ-CE2 3.25Å; K2030-Y2089 PolarHBondContact NZ-OH 2.96Å; P2087-Y2089 HydrophobicContact CB-CD2 4.45Å; P2087-Y2089 HydrophobicContact CB-CE2 3.74Å; P2087-Y2089 HydrophobicContact CG-CD2 4.44Å; P2087-Y2089 HydrophobicContact CG-CE1 4.2Å; P2087-Y2089 HydrophobicContact CG-CE2 3.47Å; P2087-Y2089 VanDerWaalsContact CG-CE2 3.47Å; P2087-Y2089 WeakPolarHBondContact CG-OH 3.21Å; P2087-Y2089 WeakPolarHBondContact O-CD2 3.38Å; P2087-Y2089 VanDerWaalsContact O-CE2 3.23Å; P2087-Y2089 WeakPolarHBondContact O-CE2 3.35Å; Y2089-S2091 VanDerWaalsContact C-N 3.34Å; Y2089-S2091 PolarHBondContact O-N 2.97Å
2090	A	47.6	Very low	60.7	Low	88.8 Å²	88.8	69.4 Å²	69.4	73%	0.734	39%	0.388	S	S	*	.	S	Bend	trans	-79	-12.7	-167.7	0	0	0	0	0	115.5	N2088	N2088-A2090 VanDerWaalsContact C-N 3.29Å; N2088-A2090 PolarHBondContact O-N 3.2Å; N2088-A2090 WeakPolarHBondContact OD1-CB 3.24Å; N2088-A2090 PolarHBondContact OD1-N 2.79Å; N2088-A2090 VanDerWaalsContact OD1-N 3.11Å
2091	S	42.8	Very low	58.8	Low	51.2 Å²	51.2	76.4 Å²	76.4	36%	0.358	41%	0.413	S	S	.	.			trans	-113.6	109	-179.4	62.9	0	0	0	0	112	Y2089 S2093 E2094	Y2089-S2091 VanDerWaalsContact C-N 3.34Å; Y2089-S2091 PolarHBondContact O-N 2.97Å; S2091-S2093 VanDerWaalsContact CB-OG 3.23Å; S2091-S2093 WeakPolarHBondContact CB-OG 3.05Å; S2091-S2093 PolarHBondContact O-N 3.05Å; S2091-S2093 PolarHBondContact OG-OG 3.38Å; S2091-E2094 PolarHBondContact O-N 3.16Å; S2091-E2094 VanDerWaalsContact O-N 3.12Å
2092	D	44	Very low	57	Low	112.8 Å²	112.8	78.5 Å²	78.5	60%	0.603	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-57.2	-11.6	173.8	-89.9	-47.5	0	0	0	113.6	E2094 K2095	D2092-E2094 VanDerWaalsContact C-N 3.28Å; D2092-E2094 PolarHBondContact O-N 3.15Å; D2092-E2094 VanDerWaalsContact O-N 3.17Å; D2092-K2095 WeakPolarHBondContact O-CB 3.27Å; D2092-K2095 PolarHBondContact O-N 3.13Å; D2092-K2095 WeakPolarHBondContact OD1-CD 3.2Å; D2092-K2095 VanDerWaalsContact OD1-CE 3.22Å; D2092-K2095 WeakPolarHBondContact OD1-CE 3.23Å; D2092-K2095 IonicContact OD1-NZ 3.14Å; D2092-K2095 PolarHBondContact OD1-NZ 3.14Å
2093	S	45	Very low	55.5	Low	83.2 Å²	83.2	84.2 Å²	84.2	58%	0.582	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-70.7	-2.2	174.3	53.9	0	0	0	0	113.9	S2091 K2095 S2096	S2091-S2093 VanDerWaalsContact CB-OG 3.23Å; S2091-S2093 WeakPolarHBondContact CB-OG 3.05Å; S2091-S2093 PolarHBondContact O-N 3.05Å; S2091-S2093 PolarHBondContact OG-OG 3.38Å; S2093-K2095 VanDerWaalsContact C-N 3.3Å; S2093-K2095 PolarHBondContact O-N 3.18Å; S2093-S2096 PolarHBondContact O-OG 2.87Å; S2093-S2096 VanDerWaalsContact O-OG 3.08Å
2094	E	44.5	Very low	54.7	Low	82 Å²	82	83.6 Å²	83.6	38%	0.383	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-75.4	-5.1	178.4	-73.7	-166.2	168.6	0	0	114.1	N2088 S2091 D2092 S2096 I2097 N2145	N2088-E2094 VanDerWaalsContact O-OE2 3.08Å; S2091-E2094 PolarHBondContact O-N 3.16Å; S2091-E2094 VanDerWaalsContact O-N 3.12Å; D2092-E2094 VanDerWaalsContact C-N 3.28Å; D2092-E2094 PolarHBondContact O-N 3.15Å; D2092-E2094 VanDerWaalsContact O-N 3.17Å; E2094-S2096 PolarHBondContact O-N 3.21Å; E2094-S2096 VanDerWaalsContact O-N 3.14Å; E2094-I2097 HydrophobicContact CB-CD1 4.22Å; E2094-I2097 HydrophobicContact CG-CD1 3.96Å; E2094-I2097 PolarHBondContact O-N 3.01Å; E2094-I2097 VanDerWaalsContact O-N 3.16Å; E2094-N2145 PolarHBondContact OE1-ND2 3.15Å; E2094-N2145 VanDerWaalsContact OE1-ND2 3.09Å
2095	K	47.6	Very low	54.6	Low	175 Å²	175	83.6 Å²	83.6	76%	0.761	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-72.8	-12.2	-179.7	-73.9	177	177.3	163.3	0	114.8	D2092 S2093	D2092-K2095 WeakPolarHBondContact O-CB 3.27Å; D2092-K2095 PolarHBondContact O-N 3.13Å; D2092-K2095 WeakPolarHBondContact OD1-CD 3.2Å; D2092-K2095 VanDerWaalsContact OD1-CE 3.22Å; D2092-K2095 WeakPolarHBondContact OD1-CE 3.23Å; D2092-K2095 IonicContact OD1-NZ 3.14Å; D2092-K2095 PolarHBondContact OD1-NZ 3.14Å; S2093-K2095 VanDerWaalsContact C-N 3.3Å; S2093-K2095 PolarHBondContact O-N 3.18Å
2096	S	44.2	Very low	54.8	Low	100.6 Å²	100.6	83 Å²	83	70%	0.703	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-101.1	-1.1	178.3	57.8	0	0	0	0	114.7	S2093 E2094 P2098	S2093-S2096 PolarHBondContact O-OG 2.87Å; S2093-S2096 VanDerWaalsContact O-OG 3.08Å; E2094-S2096 PolarHBondContact O-N 3.21Å; E2094-S2096 VanDerWaalsContact O-N 3.14Å; S2096-P2098 WeakPolarHBondContact O-CD 3.31Å
2097	I	46.6	Very low	55.7	Low	77.4 Å²	77.4	79.7 Å²	79.7	40%	0.397	42%	0.421	S	S	.	.	S	Bend	trans	-85.2	122.4	-179.2	-57.8	174.3	0	0	0	108.9	E2094 Y2101	E2094-I2097 HydrophobicContact CB-CD1 4.22Å; E2094-I2097 HydrophobicContact CG-CD1 3.96Å; E2094-I2097 PolarHBondContact O-N 3.01Å; E2094-I2097 VanDerWaalsContact O-N 3.16Å; I2097-Y2101 VanDerWaalsContact CG2-CB 3.46Å; I2097-Y2101 HydrophobicContact CG2-CD2 4.41Å; I2097-Y2101 HydrophobicContact CG2-CG 4.35Å
2098	P	44.1	Very low	57.1	Low	71.6 Å²	71.6	78.7 Å²	78.7	47%	0.465	42%	0.415	S	S	.	.			trans	-59.9	144	177.5	-2.4	5.5	0	0	0	110.8	S2096 E2100 Y2101	S2096-P2098 WeakPolarHBondContact O-CD 3.31Å; P2098-E2100 PolarHBondContact O-N 3.15Å; P2098-E2100 VanDerWaalsContact O-N 3.11Å; P2098-Y2101 HydrophobicContact CB-CD2 3.97Å; P2098-Y2101 HydrophobicContact CB-CE2 4.37Å; P2098-Y2101 HydrophobicContact CG-CD2 3.95Å; P2098-Y2101 HydrophobicContact CG-CE2 4.16Å; P2098-Y2101 PolarHBondContact O-N 3.09Å; P2098-Y2101 VanDerWaalsContact O-N 3.14Å
2099	P	46.3	Very low	58.7	Low	98.6 Å²	98.6	76 Å²	76	64%	0.64	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-61.1	-4.8	-170.7	23.8	-33.8	0	0	0	113.7	Y2101 L2102	P2099-Y2101 VanDerWaalsContact C-N 3.25Å; P2099-Y2101 PolarHBondContact O-N 3.14Å; P2099-L2102 HydrophobicContact CB-CD1 4.33Å; P2099-L2102 WeakPolarHBondContact O-CB 3.4Å; P2099-L2102 PolarHBondContact O-N 3.06Å
2100	E	45	Very low	60.6	Low	163.4 Å²	163.4	70.5 Å²	70.5	76%	0.764	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-52.4	-18.4	171.3	-60.5	-177.6	170.7	0	0	115.6	P2098 L2102 I2121	P2098-E2100 PolarHBondContact O-N 3.15Å; P2098-E2100 VanDerWaalsContact O-N 3.11Å; E2100-L2102 PolarHBondContact O-N 2.92Å; E2100-I2121 WeakPolarHBondContact O-CD1 3.44Å
2101	Y	46.7	Very low	62.6	Low	173.2 Å²	173.2	72.7 Å²	72.7	68%	0.679	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-90	-7.1	179.5	-72.2	-85.7	0	0	0	114.2	I2097 P2098 P2099 R2103	I2097-Y2101 VanDerWaalsContact CG2-CB 3.46Å; I2097-Y2101 HydrophobicContact CG2-CD2 4.41Å; I2097-Y2101 HydrophobicContact CG2-CG 4.35Å; P2098-Y2101 HydrophobicContact CB-CD2 3.97Å; P2098-Y2101 HydrophobicContact CB-CE2 4.37Å; P2098-Y2101 HydrophobicContact CG-CD2 3.95Å; P2098-Y2101 HydrophobicContact CG-CE2 4.16Å; P2098-Y2101 PolarHBondContact O-N 3.09Å; P2098-Y2101 VanDerWaalsContact O-N 3.14Å; P2099-Y2101 VanDerWaalsContact C-N 3.25Å; P2099-Y2101 PolarHBondContact O-N 3.14Å; Y2101-R2103 VanDerWaalsContact C-N 3.34Å; Y2101-R2103 WeakPolarHBondContact O-CG 3.45Å; Y2101-R2103 PolarHBondContact O-N 3.09Å; Y2101-R2103 VanDerWaalsContact O-N 3.16Å
2102	L	51.2	Low	64.7	Low	53 Å²	53	74 Å²	74	28%	0.277	37%	0.371	S	S	.	.			trans	-76.7	93.8	175.8	-75.3	167.6	0	0	0	110.7	K2030 P2087 P2099 E2100 D2104 I2121	K2030-L2102 VanDerWaalsContact NZ-CD1 3.31Å; P2087-L2102 HydrophobicContact CB-CD2 4.13Å; P2099-L2102 HydrophobicContact CB-CD1 4.33Å; P2099-L2102 WeakPolarHBondContact O-CB 3.4Å; P2099-L2102 PolarHBondContact O-N 3.06Å; E2100-L2102 PolarHBondContact O-N 2.92Å; L2102-D2104 PolarHBondContact O-N 3.04Å; L2102-I2121 VanDerWaalsContact O-CD1 3.25Å; L2102-I2121 WeakPolarHBondContact O-CD1 3.3Å
2103	R	61	Low	66.7	Low	128.6 Å²	128.6	68.7 Å²	68.7	49%	0.485	34%	0.342	S	S	.	.			trans	-79.8	49.8	-174.8	-65	-173.4	177.3	-175	-6	112.5	R2085 P2087 Y2101 V2105 D2164	R2085-R2103 WeakPolarHBondContact CB-O 3.36Å; R2085-R2103 WeakPolarHBondContact CD-O 3.45Å; R2085-R2103 WeakPolarHBondContact CG-O 3.5Å; R2085-R2103 VanDerWaalsContact CZ-CD 3.45Å; R2085-R2103 VanDerWaalsContact NH2-NH1 3.12Å; P2087-R2103 HydrophobicContact CB-CB 4.43Å; Y2101-R2103 VanDerWaalsContact C-N 3.34Å; Y2101-R2103 WeakPolarHBondContact O-CG 3.45Å; Y2101-R2103 PolarHBondContact O-N 3.09Å; Y2101-R2103 VanDerWaalsContact O-N 3.16Å; R2103-V2105 HydrophobicContact CB-CG2 4.16Å; R2103-V2105 PolarHBondContact O-N 3.19Å; R2103-V2105 VanDerWaalsContact O-N 3.09Å; R2103-D2164 VanDerWaalsContact CD-OD1 3.23Å; R2103-D2164 WeakPolarHBondContact CD-OD1 3.49Å; R2103-D2164 IonicContact CZ-OD1 3.42Å; R2103-D2164 IonicContact CZ-OD2 3.41Å; R2103-D2164 IonicContact NE-OD1 3.75Å; R2103-D2164 VanDerWaalsContact NH1-CB 3.27Å; R2103-D2164 PolarHBondContact NH1-O 3.07Å; R2103-D2164 IonicContact NH1-OD1 2.91Å; R2103-D2164 PolarHBondContact NH1-OD1 3Å; R2103-D2164 IonicContact NH1-OD2 3.61Å; R2103-D2164 PolarHBondContact NH1-OD2 3.36Å; R2103-D2164 IonicContact NH2-OD1 2.66Å; R2103-D2164 IonicContact NH2-OD2 2.65Å; R2103-D2164 PolarHBondContact NH2-OD2 2.97Å
2104	D	75	Confident	68.9	Low	8.8 Å²	8.8	65.1 Å²	65.1	5%	0.047	32%	0.318	C	S	.	.			trans	-77.2	92.3	174.9	-68.2	-13	0	0	0	109.4	H2028 R2031 L2102 L2120	H2028-D2104 IonicContact NE2-OD1 3.4Å; R2031-D2104 IonicContact CZ-OD2 3.22Å; R2031-D2104 IonicContact NE-OD2 3.04Å; R2031-D2104 PolarHBondContact NE-OD2 3.08Å; R2031-D2104 IonicContact NH2-OD2 3.24Å; R2031-D2104 PolarHBondContact NH2-OD2 3.2Å; L2102-D2104 PolarHBondContact O-N 3.04Å; D2104-L2120 HydrophobicContact CB-CB 3.98Å; D2104-L2120 HydrophobicContact CB-CD1 3.99Å; D2104-L2120 HydrophobicContact CB-CG 4.42Å; D2104-L2120 WeakPolarHBondContact O-CB 3.33Å; D2104-L2120 WeakPolarHBondContact O-CG 3.11Å; D2104-L2120 PolarHBondContact O-N 3.11Å
2105	V	85.4	Confident	71.2	Confident	10.8 Å²	10.8	61.2 Å²	61.2	7%	0.065	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140	-175.9	178.3	0	0	0	0	110.6	R2085 R2103 F2117 Y2118 I2126	R2085-V2105 HydrophobicContact CB-CB 4.18Å; R2085-V2105 WeakPolarHBondContact CB-O 3.29Å; R2085-V2105 PolarHBondContact N-O 3.26Å; R2103-V2105 HydrophobicContact CB-CG2 4.16Å; R2103-V2105 PolarHBondContact O-N 3.19Å; R2103-V2105 VanDerWaalsContact O-N 3.09Å; V2105-F2117 HydrophobicContact CG1-CB 4.28Å; V2105-F2117 HydrophobicContact CG1-CD1 4.15Å; V2105-Y2118 CarbonylContact C-O 3.51Å; V2105-Y2118 WeakPolarHBondContact CA-O 3.32Å; V2105-I2126 HydrophobicContact CG1-CD1 4.04Å; V2105-I2126 HydrophobicContact CG2-CD1 3.95Å
2106	L	89.8	Confident	73.3	Confident	0.8 Å²	0.8	54 Å²	54	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	124	172.2	-178.7	66.7	0	0	0	109.5	A2035 I2043 L2045 I2082 F2084 V2108 F2117 Y2118 L2120	A2035-L2106 HydrophobicContact CB-CD1 4.29Å; I2043-L2106 HydrophobicContact CD1-CD2 4.42Å; I2043-L2106 HydrophobicContact CG2-CD2 4.46Å; L2045-L2106 HydrophobicContact CD2-CD2 4.38Å; I2082-L2106 HydrophobicContact CG2-CD1 3.39Å; I2082-L2106 VanDerWaalsContact CG2-CD1 3.46Å; I2082-L2106 HydrophobicContact CG2-CG 4.34Å; F2084-L2106 HydrophobicContact CD1-CB 4.41Å; F2084-L2106 HydrophobicContact CD1-CD1 3.67Å; F2084-L2106 HydrophobicContact CE1-CB 4.4Å; F2084-L2106 HydrophobicContact CE1-CD1 3.59Å; F2084-L2106 HydrophobicContact CE1-CG 4.41Å; F2084-L2106 HydrophobicContact CE2-CD1 4.44Å; F2084-L2106 HydrophobicContact CG-CD1 4.26Å; F2084-L2106 HydrophobicContact CZ-CD1 4.12Å; L2106-V2108 HydrophobicContact CD2-CG2 4.3Å; L2106-V2108 HydrophobicContact CG-CG2 4.13Å; L2106-F2117 CarbonylContact O-C 3.43Å; L2106-F2117 WeakPolarHBondContact O-CA 3.4Å; L2106-Y2118 PolarHBondContact N-O 3.16Å; L2106-Y2118 PolarHBondContact O-N 2.94Å; L2106-L2120 HydrophobicContact CB-CD1 4.49Å; L2106-L2120 HydrophobicContact CB-CD2 4.28Å; L2106-L2120 HydrophobicContact CB-CG 4.42Å
2107	A	91.7	Very high	75.5	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	140	170.2	0	0	0	0	0	110.7	I2082 S2083 V2115 H2116 F2117 L2139 Y2141 L2149	I2082-A2107 WeakPolarHBondContact CA-O 3.11Å; S2083-A2107 PolarHBondContact N-O 2.98Å; S2083-A2107 PolarHBondContact O-N 3.12Å; A2107-V2115 HydrophobicContact CB-CG1 4.35Å; A2107-H2116 WeakPolarHBondContact CA-O 3.33Å; A2107-F2117 HydrophobicContact CB-CD1 4.08Å; A2107-F2117 HydrophobicContact CB-CE1 3.92Å; A2107-L2139 HydrophobicContact CB-CD1 4.15Å; A2107-Y2141 HydrophobicContact CB-CE2 3.68Å; A2107-Y2141 WeakPolarHBondContact CB-OH 3.25Å; A2107-L2149 HydrophobicContact CB-CD1 4.39Å; A2107-L2149 HydrophobicContact CB-CD2 4.06Å
2108	V	92.4	Very high	77.5	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	122.1	-174.3	-174.7	0	0	0	0	109.2	I2043 I2075 I2079 S2081 I2082 L2106 V2115 H2116 Y2118	I2043-V2108 HydrophobicContact CD1-CB 4.33Å; I2043-V2108 HydrophobicContact CD1-CG1 3.98Å; I2043-V2108 HydrophobicContact CD1-CG2 3.48Å; I2043-V2108 VanDerWaalsContact CD1-CG2 3.45Å; I2075-V2108 HydrophobicContact CD1-CB 4.38Å; I2075-V2108 HydrophobicContact CD1-CG1 3.85Å; I2075-V2108 HydrophobicContact CD1-CG2 4.49Å; I2079-V2108 HydrophobicContact CD1-CG1 4.33Å; I2079-V2108 HydrophobicContact CG1-CG1 4.04Å; I2079-V2108 HydrophobicContact CG2-CG1 3.78Å; S2081-V2108 WeakPolarHBondContact O-CA 3.36Å; I2082-V2108 HydrophobicContact CG1-CG1 4.22Å; I2082-V2108 HydrophobicContact CG1-CG2 4.45Å; L2106-V2108 HydrophobicContact CD2-CG2 4.3Å; L2106-V2108 HydrophobicContact CG-CG2 4.13Å; V2108-V2115 CarbonylContact O-C 3.57Å; V2108-V2115 VanDerWaalsContact O-CA 3.25Å; V2108-V2115 WeakPolarHBondContact O-CA 3.35Å; V2108-H2116 HydrophobicContact CB-CB 4.42Å; V2108-H2116 PolarHBondContact N-O 3.06Å; V2108-H2116 PolarHBondContact O-N 3.15Å; V2108-Y2118 HydrophobicContact CG2-CD2 4.17Å; V2108-Y2118 HydrophobicContact CG2-CE2 4.27Å
2109	G	91.1	Very high	79.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.1	-178	0	0	0	0	0	111.4	N2080 S2081 L2139	N2080-G2109 PolarHBondContact N-O 2.92Å; S2081-G2109 PolarHBondContact N-O 3.19Å; S2081-G2109 PolarHBondContact O-N 3.17Å; G2109-L2139 VanDerWaalsContact N-CD1 3.28Å
2110	C	91.5	Very high	81.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	163	-170.9	-67.4	0	0	0	0	113.3	S2077 S2078 D2112 G2113 S2114 H2116 I2136	S2077-C2110 VanDerWaalsContact OG-CB 3.22Å; S2077-C2110 WeakPolarHBondContact OG-CB 3.39Å; S2077-C2110 PolarHBondContact OG-SG 3.15Å; S2078-C2110 CarbonylContact O-C 3.55Å; S2078-C2110 VanDerWaalsContact O-CA 3.28Å; S2078-C2110 WeakPolarHBondContact O-CA 3.34Å; C2110-D2112 WeakPolarHBondContact CB-OD1 3.24Å; C2110-D2112 PolarHBondContact O-N 3.09Å; C2110-G2113 PolarHBondContact O-N 2.98Å; C2110-S2114 WeakPolarHBondContact CB-O 3.29Å; C2110-S2114 PolarHBondContact N-O 2.88Å; C2110-H2116 PolarHBondContact SG-CD2 2.91Å; C2110-H2116 VanDerWaalsContact SG-CD2 3.51Å; C2110-I2136 PolarHBondContact O-N 3.01Å; C2110-I2136 VanDerWaalsContact O-N 3.1Å
2111	W	88.3	Confident	82.6	Confident	136.2 Å²	136.2	36.3 Å²	36.3	52%	0.516	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.1	177.9	-94.4	17.6	0	0	0	114.2	L2039 S2077 S2078 N2080 G2113 A2135	L2039-W2111 HydrophobicContact CD1-CZ2 4.43Å; L2039-W2111 HydrophobicContact CD2-CH2 4.28Å; L2039-W2111 HydrophobicContact CD2-CZ2 3.69Å; L2039-W2111 VanDerWaalsContact CD2-CZ2 3.5Å; S2077-W2111 PolarHBondContact OG-N 2.89Å; S2078-W2111 PolarHBondContact O-N 3.03Å; N2080-W2111 VanDerWaalsContact CG-NE1 3.25Å; N2080-W2111 VanDerWaalsContact ND2-CE3 3.26Å; N2080-W2111 PolarHBondContact ND2-NE1 2.9Å; N2080-W2111 VanDerWaalsContact ND2-NE1 3.12Å; N2080-W2111 PolarHBondContact OD1-NE1 2.8Å; W2111-G2113 VanDerWaalsContact C-N 3.26Å; W2111-G2113 PolarHBondContact O-N 3.15Å; W2111-A2135 HydrophobicContact CB-CB 4.44Å; W2111-A2135 HydrophobicContact CD2-CB 4.07Å; W2111-A2135 HydrophobicContact CG-CB 4.07Å; W2111-A2135 VanDerWaalsContact O-CA 3.27Å; W2111-A2135 WeakPolarHBondContact O-CA 3.34Å; W2111-A2135 VanDerWaalsContact O-CB 3.32Å; W2111-A2135 WeakPolarHBondContact O-CB 3.29Å
2112	D	87.9	Confident	83.9	Confident	79 Å²	79	31.3 Å²	31.3	42%	0.422	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	8.3	178.4	61.4	4.3	0	0	0	113.6	S2077 C2110 S2114	S2077-D2112 VanDerWaalsContact CB-CG 3.45Å; S2077-D2112 VanDerWaalsContact CB-OD2 3.27Å; S2077-D2112 WeakPolarHBondContact CB-OD2 3.37Å; S2077-D2112 PolarHBondContact OG-N 2.75Å; S2077-D2112 PolarHBondContact OG-OD2 2.99Å; C2110-D2112 WeakPolarHBondContact CB-OD1 3.24Å; C2110-D2112 PolarHBondContact O-N 3.09Å; D2112-S2114 VanDerWaalsContact C-N 3.3Å; D2112-S2114 VanDerWaalsContact CG-OG 3.26Å; D2112-S2114 PolarHBondContact O-N 3.02Å; D2112-S2114 VanDerWaalsContact OD1-CB 3.27Å; D2112-S2114 WeakPolarHBondContact OD1-CB 3.3Å; D2112-S2114 PolarHBondContact OD1-N 3.14Å; D2112-S2114 VanDerWaalsContact OD1-N 3.15Å; D2112-S2114 PolarHBondContact OD1-OG 3.05Å; D2112-S2114 PolarHBondContact OD2-OG 3.1Å
2113	G	86.6	Confident	85.1	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	77.2	7.6	-178.1	0	0	0	0	0	114.6	C2110 W2111 I2131 S2132 S2134 I2136	C2110-G2113 PolarHBondContact O-N 2.98Å; W2111-G2113 VanDerWaalsContact C-N 3.26Å; W2111-G2113 PolarHBondContact O-N 3.15Å; G2113-I2131 PolarHBondContact O-N 3.15Å; G2113-S2132 WeakPolarHBondContact CA-O 3.33Å; G2113-S2132 PolarHBondContact O-N 3.13Å; G2113-S2134 WeakPolarHBondContact CA-O 3.4Å; G2113-I2136 VanDerWaalsContact C-CD1 3.43Å; G2113-I2136 WeakPolarHBondContact O-CD1 3.39Å
2114	S	90.8	Very high	86	Confident	8.6 Å²	8.6	27.2 Å²	27.2	6%	0.06	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	147.2	176.9	77.1	0	0	0	0	113.7	C2110 D2112 H2116 L2129 I2136	C2110-S2114 WeakPolarHBondContact CB-O 3.29Å; C2110-S2114 PolarHBondContact N-O 2.88Å; D2112-S2114 VanDerWaalsContact C-N 3.3Å; D2112-S2114 VanDerWaalsContact CG-OG 3.26Å; D2112-S2114 PolarHBondContact O-N 3.02Å; D2112-S2114 VanDerWaalsContact OD1-CB 3.27Å; D2112-S2114 WeakPolarHBondContact OD1-CB 3.3Å; D2112-S2114 PolarHBondContact OD1-N 3.14Å; D2112-S2114 VanDerWaalsContact OD1-N 3.15Å; D2112-S2114 PolarHBondContact OD1-OG 3.05Å; D2112-S2114 PolarHBondContact OD2-OG 3.1Å; S2114-H2116 PolarHBondContact OG-NE2 3Å; S2114-L2129 CarbonylContact C-O 3.56Å; S2114-L2129 VanDerWaalsContact CA-O 3.26Å; S2114-L2129 WeakPolarHBondContact CA-O 3.34Å; S2114-I2136 VanDerWaalsContact C-CD1 3.45Å; S2114-I2136 VanDerWaalsContact O-CD1 3.27Å; S2114-I2136 WeakPolarHBondContact O-CD1 3.36Å
2115	V	91.7	Very high	86.4	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	125.2	169.2	-179.1	0	0	0	0	109.6	A2107 V2108 F2117 S2128 L2129 I2131 I2136 L2139 I2151	A2107-V2115 HydrophobicContact CB-CG1 4.35Å; V2108-V2115 CarbonylContact O-C 3.57Å; V2108-V2115 VanDerWaalsContact O-CA 3.25Å; V2108-V2115 WeakPolarHBondContact O-CA 3.35Å; V2115-F2117 HydrophobicContact CB-CE2 4.26Å; V2115-F2117 HydrophobicContact CB-CZ 4.37Å; V2115-F2117 HydrophobicContact CG1-CD2 4.4Å; V2115-F2117 HydrophobicContact CG1-CE1 4.12Å; V2115-F2117 HydrophobicContact CG1-CE2 3.75Å; V2115-F2117 HydrophobicContact CG1-CZ 3.59Å; V2115-F2117 VanDerWaalsContact CG1-CZ 3.49Å; V2115-S2128 WeakPolarHBondContact O-CA 3.37Å; V2115-L2129 PolarHBondContact N-O 3.06Å; V2115-L2129 PolarHBondContact O-N 3.14Å; V2115-I2131 HydrophobicContact CB-CD1 3.7Å; V2115-I2131 VanDerWaalsContact CB-CD1 3.49Å; V2115-I2131 HydrophobicContact CG2-CD1 3.42Å; V2115-I2131 VanDerWaalsContact CG2-CD1 3.47Å; V2115-I2131 HydrophobicContact CG2-CG1 4.25Å; V2115-I2136 HydrophobicContact CB-CD1 4.37Å; V2115-I2136 HydrophobicContact CG2-CD1 3.39Å; V2115-I2136 VanDerWaalsContact CG2-CD1 3.43Å; V2115-I2136 HydrophobicContact CG2-CG1 4.25Å; V2115-L2139 HydrophobicContact CG1-CD1 4.36Å; V2115-L2139 HydrophobicContact CG1-CD2 4.45Å; V2115-L2139 HydrophobicContact CG2-CD2 4.06Å; V2115-I2151 HydrophobicContact CG2-CD1 4.14Å; V2115-I2151 HydrophobicContact CG2-CG1 4.29Å; V2115-I2151 HydrophobicContact CG2-CG2 4.37Å
2116	H	91.5	Very high	86.4	Confident	24.2 Å²	24.2	36.5 Å²	36.5	11%	0.112	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	140.5	175	-60.1	-65.7	0	0	0	111.1	I2075 A2107 V2108 C2110 S2114 Y2118 S2128	I2075-H2116 HydrophobicContact CD1-CB 4.42Å; I2075-H2116 VanDerWaalsContact CG2-CD2 3.49Å; I2075-H2116 WeakPolarHBondContact CG2-CD2 3.33Å; I2075-H2116 WeakPolarHBondContact CG2-NE2 3.3Å; A2107-H2116 WeakPolarHBondContact CA-O 3.33Å; V2108-H2116 HydrophobicContact CB-CB 4.42Å; V2108-H2116 PolarHBondContact N-O 3.06Å; V2108-H2116 PolarHBondContact O-N 3.15Å; C2110-H2116 PolarHBondContact SG-CD2 2.91Å; C2110-H2116 VanDerWaalsContact SG-CD2 3.51Å; S2114-H2116 PolarHBondContact OG-NE2 3Å; H2116-Y2118 HydrophobicContact CB-CD2 4.48Å; H2116-Y2118 HydrophobicContact CB-CE2 3.73Å; H2116-S2128 PolarHBondContact CE1-OG 3.27Å; H2116-S2128 WeakPolarHBondContact ND1-CB 3.37Å; H2116-S2128 PolarHBondContact ND1-OG 3.21Å
2117	F	90.6	Very high	86.2	Confident	0.6 Å²	0.6	40.2 Å²	40.2	0%	0.003	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.7	179.5	-62.2	-85.3	0	0	0	110.8	V2105 L2106 A2107 V2115 I2126 K2127 L2129 L2149 L2161 F2166	V2105-F2117 HydrophobicContact CG1-CB 4.28Å; V2105-F2117 HydrophobicContact CG1-CD1 4.15Å; L2106-F2117 CarbonylContact O-C 3.43Å; L2106-F2117 WeakPolarHBondContact O-CA 3.4Å; A2107-F2117 HydrophobicContact CB-CD1 4.08Å; A2107-F2117 HydrophobicContact CB-CE1 3.92Å; V2115-F2117 HydrophobicContact CB-CE2 4.26Å; V2115-F2117 HydrophobicContact CB-CZ 4.37Å; V2115-F2117 HydrophobicContact CG1-CD2 4.4Å; V2115-F2117 HydrophobicContact CG1-CE1 4.12Å; V2115-F2117 HydrophobicContact CG1-CE2 3.75Å; V2115-F2117 HydrophobicContact CG1-CZ 3.59Å; V2115-F2117 VanDerWaalsContact CG1-CZ 3.49Å; F2117-I2126 HydrophobicContact CB-CB 4.18Å; F2117-I2126 HydrophobicContact CB-CD1 4.46Å; F2117-I2126 PolarHBondContact O-N 3.07Å; F2117-K2127 HydrophobicContact CB-CB 4.44Å; F2117-K2127 HydrophobicContact CD2-CB 4.36Å; F2117-K2127 PolarHBondContact N-O 2.96Å; F2117-L2129 HydrophobicContact CE2-CD1 3.8Å; F2117-L2129 HydrophobicContact CE2-CG 4.09Å; F2117-L2129 HydrophobicContact CZ-CD1 4.41Å; F2117-L2149 HydrophobicContact CE1-CD2 3.52Å; F2117-L2149 VanDerWaalsContact CE1-CD2 3.48Å; F2117-L2149 HydrophobicContact CZ-CD2 3.69Å; F2117-L2161 HydrophobicContact CE2-CD1 4.4Å; F2117-L2161 HydrophobicContact CZ-CD1 4.19Å; F2117-F2166 HydrophobicContact CB-CE1 4.2Å; F2117-F2166 AromaticContact CD1-CD1 3.92Å; F2117-F2166 HydrophobicContact CD1-CD1 4.02Å; F2117-F2166 AromaticContact CD1-CE1 3.47Å; F2117-F2166 HydrophobicContact CD1-CE1 3.47Å; F2117-F2166 VanDerWaalsContact CD1-CE1 3.45Å; F2117-F2166 HydrophobicContact CD1-CZ 4.42Å; F2117-F2166 AromaticContact CD2-CD1 3.99Å; F2117-F2166 HydrophobicContact CD2-CD1 4.09Å; F2117-F2166 HydrophobicContact CD2-CE1 4.14Å; F2117-F2166 AromaticContact CE1-CD1 3.9Å; F2117-F2166 HydrophobicContact CE1-CD1 3.92Å; F2117-F2166 AromaticContact CE1-CE1 3.76Å; F2117-F2166 HydrophobicContact CE1-CE1 3.76Å; F2117-F2166 AromaticContact CE2-CD1 3.94Å; F2117-F2166 HydrophobicContact CE2-CD1 4.03Å; F2117-F2166 HydrophobicContact CE2-CE1 4.3Å; F2117-F2166 AromaticContact CG-CD1 3.93Å; F2117-F2166 HydrophobicContact CG-CD1 4.08Å; F2117-F2166 AromaticContact CG-CE1 3.66Å; F2117-F2166 HydrophobicContact CG-CE1 3.66Å; F2117-F2166 HydrophobicContact CG-CZ 4.41Å; F2117-F2166 AromaticContact CZ-CD1 3.91Å; F2117-F2166 HydrophobicContact CZ-CD1 3.93Å; F2117-F2166 HydrophobicContact CZ-CE1 4.23Å
2118	Y	88.5	Confident	86	Confident	25.2 Å²	25.2	42.4 Å²	42.4	10%	0.099	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	139.1	178.2	-65	-91.6	0	0	0	111.1	I2043 L2073 I2075 V2105 L2106 V2108 H2116 S2124 W2125	I2043-Y2118 HydrophobicContact CD1-CE2 4.38Å; L2073-Y2118 HydrophobicContact CD1-CD1 4Å; L2073-Y2118 HydrophobicContact CD1-CD2 4.34Å; L2073-Y2118 HydrophobicContact CD1-CE1 4.25Å; L2073-Y2118 HydrophobicContact CD1-CG 4.21Å; L2073-Y2118 HydrophobicContact CD2-CD1 4.5Å; L2073-Y2118 HydrophobicContact CD2-CE1 4.36Å; I2075-Y2118 HydrophobicContact CD1-CE2 4.05Å; V2105-Y2118 CarbonylContact C-O 3.51Å; V2105-Y2118 WeakPolarHBondContact CA-O 3.32Å; L2106-Y2118 PolarHBondContact N-O 3.16Å; L2106-Y2118 PolarHBondContact O-N 2.94Å; V2108-Y2118 HydrophobicContact CG2-CD2 4.17Å; V2108-Y2118 HydrophobicContact CG2-CE2 4.27Å; H2116-Y2118 HydrophobicContact CB-CD2 4.48Å; H2116-Y2118 HydrophobicContact CB-CE2 3.73Å; Y2118-S2124 CarbonylContact C-O 3.59Å; Y2118-S2124 VanDerWaalsContact CA-O 3.29Å; Y2118-S2124 WeakPolarHBondContact CA-O 3.38Å; Y2118-W2125 HydrophobicContact CD1-CB 4.11Å; Y2118-W2125 HydrophobicContact CE1-CB 3.82Å; Y2118-W2125 HydrophobicContact CE1-CG 4.48Å
2119	S	85.1	Confident	85.8	Confident	21.4 Å²	21.4	43.7 Å²	43.7	15%	0.15	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	129	171.8	167.3	0	0	0	0	108.8	I2121 S2122 M2123 S2124	S2119-I2121 VanDerWaalsContact C-N 3.32Å; S2119-I2121 PolarHBondContact O-N 3.43Å; S2119-I2121 PolarHBondContact OG-N 2.91Å; S2119-S2122 VanDerWaalsContact CB-OG 3.26Å; S2119-S2122 WeakPolarHBondContact CB-OG 3.34Å; S2119-S2122 PolarHBondContact OG-N 3.01Å; S2119-S2122 PolarHBondContact OG-OG 3.1Å; S2119-M2123 WeakPolarHBondContact O-CA 3.42Å; S2119-M2123 PolarHBondContact O-N 3Å; S2119-S2124 PolarHBondContact N-O 2.95Å; S2119-S2124 PolarHBondContact O-N 2.87Å
2120	L	80.9	Confident	85.6	Confident	4.6 Å²	4.6	47.4 Å²	47.4	2%	0.024	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-17.9	178.8	-66.7	166.7	0	0	0	113	R2031 L2033 L2045 F2084 D2104 L2106 M2123	R2031-L2120 PolarHBondContact NH1-O 3.12Å; L2033-L2120 HydrophobicContact CD2-CD2 4.12Å; L2045-L2120 HydrophobicContact CD1-CD2 4.39Å; F2084-L2120 HydrophobicContact CD1-CD1 3.67Å; F2084-L2120 HydrophobicContact CE1-CD1 3.62Å; F2084-L2120 VanDerWaalsContact CE1-CD1 3.48Å; F2084-L2120 HydrophobicContact CE1-CD2 3.91Å; F2084-L2120 HydrophobicContact CE1-CG 4.38Å; D2104-L2120 HydrophobicContact CB-CB 3.98Å; D2104-L2120 HydrophobicContact CB-CD1 3.99Å; D2104-L2120 HydrophobicContact CB-CG 4.42Å; D2104-L2120 WeakPolarHBondContact O-CB 3.33Å; D2104-L2120 WeakPolarHBondContact O-CG 3.11Å; D2104-L2120 PolarHBondContact O-N 3.11Å; L2106-L2120 HydrophobicContact CB-CD1 4.49Å; L2106-L2120 HydrophobicContact CB-CD2 4.28Å; L2106-L2120 HydrophobicContact CB-CG 4.42Å; L2120-M2123 HydrophobicContact CB-CE 4.46Å; L2120-M2123 HydrophobicContact CD2-CE 4.21Å; L2120-M2123 HydrophobicContact CD2-SD 4.35Å; L2120-M2123 WeakPolarHBondContact O-CE 3.33Å
2121	I	76.1	Confident	85.3	Confident	87.6 Å²	87.6	48.8 Å²	48.8	45%	0.449	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-57	176.7	-61.2	168.9	0	0	0	109.5	R2031 E2100 L2102 S2119 M2123	R2031-I2121 VanDerWaalsContact NH2-CG1 3.3Å; E2100-I2121 WeakPolarHBondContact O-CD1 3.44Å; L2102-I2121 VanDerWaalsContact O-CD1 3.25Å; L2102-I2121 WeakPolarHBondContact O-CD1 3.3Å; S2119-I2121 VanDerWaalsContact C-N 3.32Å; S2119-I2121 PolarHBondContact O-N 3.43Å; S2119-I2121 PolarHBondContact OG-N 2.91Å; I2121-M2123 VanDerWaalsContact C-N 3.3Å; I2121-M2123 PolarHBondContact O-N 2.93Å
2122	S	74.9	Confident	85	Confident	68.6 Å²	68.6	43.1 Å²	43.1	48%	0.48	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-13.5	-179.8	55.8	0	0	0	0	113	S2119 S2124	S2119-S2122 VanDerWaalsContact CB-OG 3.26Å; S2119-S2122 WeakPolarHBondContact CB-OG 3.34Å; S2119-S2122 PolarHBondContact OG-N 3.01Å; S2119-S2122 PolarHBondContact OG-OG 3.1Å; S2122-S2124 PolarHBondContact O-N 2.96Å; S2122-S2124 VanDerWaalsContact O-N 3.11Å; S2122-S2124 PolarHBondContact OG-N 3.1Å; S2122-S2124 PolarHBondContact OG-OG 3.09Å
2123	M	75.8	Confident	84.7	Confident	40.6 Å²	40.6	44.8 Å²	44.8	20%	0.2	26%	0.256	C	S	.	.			trans	51.1	30	-169.9	-67.5	-72.2	-174.2	0	0	112.4	L2033 L2045 K2071 S2119 L2120 I2121	L2033-M2123 HydrophobicContact CD1-CE 4.29Å; L2033-M2123 HydrophobicContact CD2-CE 4.49Å; L2045-M2123 HydrophobicContact CD1-CE 3.62Å; L2045-M2123 HydrophobicContact CD1-SD 3.6Å; L2045-M2123 VanDerWaalsContact CD1-SD 3.58Å; K2071-M2123 HydrophobicContact CD-CB 3.88Å; K2071-M2123 HydrophobicContact CD-CG 4.02Å; K2071-M2123 HydrophobicContact CD-SD 4.31Å; K2071-M2123 VanDerWaalsContact NZ-CB 3.28Å; K2071-M2123 PolarHBondContact NZ-O 3.02Å; S2119-M2123 WeakPolarHBondContact O-CA 3.42Å; S2119-M2123 PolarHBondContact O-N 3Å; L2120-M2123 HydrophobicContact CB-CE 4.46Å; L2120-M2123 HydrophobicContact CD2-CE 4.21Å; L2120-M2123 HydrophobicContact CD2-SD 4.35Å; L2120-M2123 WeakPolarHBondContact O-CE 3.33Å; I2121-M2123 VanDerWaalsContact C-N 3.3Å; I2121-M2123 PolarHBondContact O-N 2.93Å
2124	S	81	Confident	84.5	Confident	53.8 Å²	53.8	45.4 Å²	45.4	38%	0.376	26%	0.26	S	S	.	.			trans	-102.8	150.5	-179.4	69.7	0	0	0	0	110.7	Y2118 S2119 S2122 I2126	Y2118-S2124 CarbonylContact C-O 3.59Å; Y2118-S2124 VanDerWaalsContact CA-O 3.29Å; Y2118-S2124 WeakPolarHBondContact CA-O 3.38Å; S2119-S2124 PolarHBondContact N-O 2.95Å; S2119-S2124 PolarHBondContact O-N 2.87Å; S2122-S2124 PolarHBondContact O-N 2.96Å; S2122-S2124 VanDerWaalsContact O-N 3.11Å; S2122-S2124 PolarHBondContact OG-N 3.1Å; S2122-S2124 PolarHBondContact OG-OG 3.09Å; S2124-I2126 PolarHBondContact O-N 3.04Å
2125	W	83.6	Confident	84.3	Confident	154 Å²	154	45.8 Å²	45.8	58%	0.583	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.8	134.7	166.5	160.2	89.6	0	0	0	109.5	Y2118 K2127	Y2118-W2125 HydrophobicContact CD1-CB 4.11Å; Y2118-W2125 HydrophobicContact CE1-CB 3.82Å; Y2118-W2125 HydrophobicContact CE1-CG 4.48Å; W2125-K2127 VanDerWaalsContact CE2-C 3.45Å; W2125-K2127 VanDerWaalsContact CZ2-CA 3.48Å; W2125-K2127 VanDerWaalsContact NE1-C 3.31Å; W2125-K2127 PolarHBondContact NE1-O 3Å; W2125-K2127 VanDerWaalsContact NE1-O 3.15Å
2126	I	85.4	Confident	84.2	Confident	62 Å²	62	45.8 Å²	45.8	32%	0.318	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-55.5	176.6	-56.4	170.8	0	0	0	109.3	V2105 F2117 S2124 F2166	V2105-I2126 HydrophobicContact CG1-CD1 4.04Å; V2105-I2126 HydrophobicContact CG2-CD1 3.95Å; F2117-I2126 HydrophobicContact CB-CB 4.18Å; F2117-I2126 HydrophobicContact CB-CD1 4.46Å; F2117-I2126 PolarHBondContact O-N 3.07Å; S2124-I2126 PolarHBondContact O-N 3.04Å; I2126-F2166 HydrophobicContact CD1-CZ 4.29Å; I2126-F2166 HydrophobicContact CG2-CE2 4.03Å; I2126-F2166 HydrophobicContact CG2-CZ 4.19Å
2127	K	85.6	Confident	83.9	Confident	77.2 Å²	77.2	45.5 Å²	45.5	34%	0.336	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	157.4	-171.7	-156.1	173.4	-174.7	-176.5	0	110.8	F2117 W2125 L2129 F2166	F2117-K2127 HydrophobicContact CB-CB 4.44Å; F2117-K2127 HydrophobicContact CD2-CB 4.36Å; F2117-K2127 PolarHBondContact N-O 2.96Å; W2125-K2127 VanDerWaalsContact CE2-C 3.45Å; W2125-K2127 VanDerWaalsContact CZ2-CA 3.48Å; W2125-K2127 VanDerWaalsContact NE1-C 3.31Å; W2125-K2127 PolarHBondContact NE1-O 3Å; W2125-K2127 VanDerWaalsContact NE1-O 3.15Å; K2127-L2129 HydrophobicContact CD-CD2 4.06Å; K2127-L2129 HydrophobicContact CD-CG 4.42Å; K2127-L2129 HydrophobicContact CG-CD2 4.35Å; K2127-F2166 HydrophobicContact CD-CB 3.95Å; K2127-F2166 HydrophobicContact CD-CD2 4.23Å; K2127-F2166 HydrophobicContact CD-CG 4.09Å; K2127-F2166 PolarHBondContact NZ-O 2.93Å
2128	S	87.8	Confident	83.8	Confident	45.8 Å²	45.8	46 Å²	46	32%	0.32	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	136.4	167.6	-173.4	0	0	0	0	108.4	V2115 H2116	V2115-S2128 WeakPolarHBondContact O-CA 3.37Å; H2116-S2128 PolarHBondContact CE1-OG 3.27Å; H2116-S2128 WeakPolarHBondContact ND1-CB 3.37Å; H2116-S2128 PolarHBondContact ND1-OG 3.21Å
2129	L	88	Confident	84	Confident	28 Å²	28	45.4 Å²	45.4	15%	0.147	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.5	176.4	-61.6	178.2	0	0	0	108.7	S2114 V2115 F2117 K2127 I2131 L2161 F2166 F2704	S2114-L2129 CarbonylContact C-O 3.56Å; S2114-L2129 VanDerWaalsContact CA-O 3.26Å; S2114-L2129 WeakPolarHBondContact CA-O 3.34Å; V2115-L2129 PolarHBondContact N-O 3.06Å; V2115-L2129 PolarHBondContact O-N 3.14Å; F2117-L2129 HydrophobicContact CE2-CD1 3.8Å; F2117-L2129 HydrophobicContact CE2-CG 4.09Å; F2117-L2129 HydrophobicContact CZ-CD1 4.41Å; K2127-L2129 HydrophobicContact CD-CD2 4.06Å; K2127-L2129 HydrophobicContact CD-CG 4.42Å; K2127-L2129 HydrophobicContact CG-CD2 4.35Å; L2129-I2131 HydrophobicContact CB-CD1 4.02Å; L2129-I2131 HydrophobicContact CB-CG1 3.92Å; L2129-I2131 HydrophobicContact CD1-CD1 4.41Å; L2129-I2131 PolarHBondContact O-N 3.06Å; L2129-L2161 HydrophobicContact CD1-CD1 3.86Å; L2129-L2161 HydrophobicContact CD1-CD2 4.27Å; L2129-F2166 HydrophobicContact CD1-CB 4.33Å; L2129-F2704 HydrophobicContact CB-CE2 4.1Å; L2129-F2704 HydrophobicContact CD2-CE2 4.45Å
2130	A	87	Confident	84.2	Confident	78.4 Å²	78.4	44.8 Å²	44.8	65%	0.648	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	107.4	164.9	0	0	0	0	0	107.8	F2704	A2130-F2704 HydrophobicContact CB-CB 3.75Å; A2130-F2704 HydrophobicContact CB-CD2 3.55Å; A2130-F2704 HydrophobicContact CB-CE2 4.39Å; A2130-F2704 HydrophobicContact CB-CG 3.8Å; A2130-F2704 WeakPolarHBondContact O-CD1 3.46Å; A2130-F2704 WeakPolarHBondContact O-CD2 3.12Å; A2130-F2704 WeakPolarHBondContact O-CE1 3.26Å; A2130-F2704 VanDerWaalsContact O-CE2 3.3Å; A2130-F2704 WeakPolarHBondContact O-CE2 3.36Å; A2130-F2704 WeakPolarHBondContact O-CG 3.27Å; A2130-F2704 VanDerWaalsContact O-CZ 3.31Å; A2130-F2704 WeakPolarHBondContact O-CZ 3.43Å
2131	I	84.1	Confident	84.6	Confident	29 Å²	29	45.7 Å²	45.7	15%	0.149	27%	0.266	C	S	.	.			trans	-100.1	-41.1	-170	-66.2	155.4	0	0	0	111.2	G2113 V2115 L2129 I2151 F2159 L2161	G2113-I2131 PolarHBondContact O-N 3.15Å; V2115-I2131 HydrophobicContact CB-CD1 3.7Å; V2115-I2131 VanDerWaalsContact CB-CD1 3.49Å; V2115-I2131 HydrophobicContact CG2-CD1 3.42Å; V2115-I2131 VanDerWaalsContact CG2-CD1 3.47Å; V2115-I2131 HydrophobicContact CG2-CG1 4.25Å; L2129-I2131 HydrophobicContact CB-CD1 4.02Å; L2129-I2131 HydrophobicContact CB-CG1 3.92Å; L2129-I2131 HydrophobicContact CD1-CD1 4.41Å; L2129-I2131 PolarHBondContact O-N 3.06Å; I2131-I2151 HydrophobicContact CD1-CD1 3.68Å; I2131-I2151 HydrophobicContact CD1-CG1 4.17Å; I2131-I2151 HydrophobicContact CG1-CD1 4.36Å; I2131-I2151 HydrophobicContact CG2-CD1 4.42Å; I2131-I2151 HydrophobicContact CG2-CG2 4.39Å; I2131-F2159 HydrophobicContact CG2-CB 4.04Å; I2131-F2159 HydrophobicContact CG2-CD1 4.21Å; I2131-F2159 HydrophobicContact CG2-CD2 3.77Å; I2131-F2159 HydrophobicContact CG2-CE1 4.24Å; I2131-F2159 HydrophobicContact CG2-CE2 4.22Å; I2131-F2159 HydrophobicContact CG2-CG 3.75Å; I2131-F2159 HydrophobicContact CG2-CZ 4.49Å; I2131-L2161 HydrophobicContact CD1-CD1 3.95Å; I2131-L2161 HydrophobicContact CD1-CG 4.35Å; I2131-L2161 HydrophobicContact CG1-CD1 4.47Å
2132	S	83.1	Confident	84.9	Confident	16.2 Å²	16.2	41.7 Å²	41.7	11%	0.113	25%	0.246	C	C	.	.			trans	-127.2	162.8	175.4	-174.4	0	0	0	0	110.1	G2113 S2134 D2153	G2113-S2132 WeakPolarHBondContact CA-O 3.33Å; G2113-S2132 PolarHBondContact O-N 3.13Å; S2132-S2134 VanDerWaalsContact C-N 3.28Å; S2132-S2134 PolarHBondContact OG-N 3.03Å; S2132-S2134 VanDerWaalsContact OG-N 3.13Å; S2132-S2134 PolarHBondContact OG-OG 3.25Å; S2132-D2153 VanDerWaalsContact CB-OD2 3.27Å; S2132-D2153 WeakPolarHBondContact CB-OD2 3.39Å; S2132-D2153 PolarHBondContact OG-OD2 2.98Å
2133	S	81	Confident	84.9	Confident	114.4 Å²	114.4	40.5 Å²	40.5	80%	0.8	24%	0.237	S	C	*	.	S	Bend	trans	-81.9	-10.1	164.8	49.5	0	0	0	0	112.6
2134	S	83.1	Confident	84.5	Confident	13.6 Å²	13.6	40.9 Å²	40.9	10%	0.095	24%	0.239	C	C	.	.	S	Bend	trans	-107.7	157.3	-178.8	127.1	0	0	0	0	112	G2113 S2132 I2136 D2153 R2154 E2155	G2113-S2134 WeakPolarHBondContact CA-O 3.4Å; S2132-S2134 VanDerWaalsContact C-N 3.28Å; S2132-S2134 PolarHBondContact OG-N 3.03Å; S2132-S2134 VanDerWaalsContact OG-N 3.13Å; S2132-S2134 PolarHBondContact OG-OG 3.25Å; S2134-I2136 PolarHBondContact O-N 3.11Å; S2134-D2153 VanDerWaalsContact OG-CB 3.25Å; S2134-D2153 WeakPolarHBondContact OG-CB 3.38Å; S2134-D2153 PolarHBondContact OG-OD2 3.22Å; S2134-R2154 PolarHBondContact OG-N 3.03Å; S2134-E2155 WeakPolarHBondContact CB-OE1 3.43Å; S2134-E2155 PolarHBondContact OG-N 2.82Å
2135	A	86.4	Confident	83.8	Confident	16.6 Å²	16.6	40.3 Å²	40.3	14%	0.137	23%	0.232	C	C	.	.			trans	-59.9	136.6	-176.4	0	0	0	0	0	112.1	W2111 C2137 D2153 R2154	W2111-A2135 HydrophobicContact CB-CB 4.44Å; W2111-A2135 HydrophobicContact CD2-CB 4.07Å; W2111-A2135 HydrophobicContact CG-CB 4.07Å; W2111-A2135 VanDerWaalsContact O-CA 3.27Å; W2111-A2135 WeakPolarHBondContact O-CA 3.34Å; W2111-A2135 VanDerWaalsContact O-CB 3.32Å; W2111-A2135 WeakPolarHBondContact O-CB 3.29Å; A2135-C2137 PolarHBondContact O-N 3.09Å; A2135-D2153 CarbonylContact O-C 3.51Å; A2135-D2153 VanDerWaalsContact O-CA 3.29Å; A2135-D2153 WeakPolarHBondContact O-CA 3.26Å; A2135-R2154 HydrophobicContact CB-CB 4.46Å; A2135-R2154 PolarHBondContact O-N 2.94Å
2136	I	89.2	Confident	83.3	Confident	0.6 Å²	0.6	33 Å²	33	0%	0.003	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	123.6	175.8	-59.7	-155.6	0	0	0	109.2	N2080 C2110 G2113 S2114 V2115 S2134 L2139 I2151 L2152 D2153	N2080-I2136 VanDerWaalsContact CB-O 3.27Å; N2080-I2136 WeakPolarHBondContact CB-O 3.32Å; N2080-I2136 PolarHBondContact ND2-O 2.95Å; C2110-I2136 PolarHBondContact O-N 3.01Å; C2110-I2136 VanDerWaalsContact O-N 3.1Å; G2113-I2136 VanDerWaalsContact C-CD1 3.43Å; G2113-I2136 WeakPolarHBondContact O-CD1 3.39Å; S2114-I2136 VanDerWaalsContact C-CD1 3.45Å; S2114-I2136 VanDerWaalsContact O-CD1 3.27Å; S2114-I2136 WeakPolarHBondContact O-CD1 3.36Å; V2115-I2136 HydrophobicContact CB-CD1 4.37Å; V2115-I2136 HydrophobicContact CG2-CD1 3.39Å; V2115-I2136 VanDerWaalsContact CG2-CD1 3.43Å; V2115-I2136 HydrophobicContact CG2-CG1 4.25Å; S2134-I2136 PolarHBondContact O-N 3.11Å; I2136-L2139 HydrophobicContact CG2-CD2 4.14Å; I2136-L2139 HydrophobicContact CG2-CG 4.2Å; I2136-I2151 HydrophobicContact CD1-CG2 4.02Å; I2136-I2151 HydrophobicContact CG1-CG2 4.24Å; I2136-I2151 HydrophobicContact CG2-CG2 3.94Å; I2136-L2152 CarbonylContact C-O 3.55Å; I2136-D2153 HydrophobicContact CD1-CB 4.41Å
2137	C	85.8	Confident	82.8	Confident	16.4 Å²	16.4	36 Å²	36	11%	0.111	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-42.4	179.7	-70.1	0	0	0	0	112.2	A2135 L2152 R2154 Q2197 K2198 G2199	A2135-C2137 PolarHBondContact O-N 3.09Å; C2137-L2152 HydrophobicContact CB-CG 4.45Å; C2137-L2152 PolarHBondContact N-O 3.22Å; C2137-R2154 VanDerWaalsContact SG-CA 3.53Å; C2137-Q2197 PolarHBondContact SG-O 3.16Å; C2137-K2198 HydrophobicContact CB-CG 4.3Å; C2137-K2198 WeakPolarHBondContact O-CE 3.06Å; C2137-G2199 WeakPolarHBondContact CB-O 3.37Å
2138	S	88.2	Confident	82.7	Confident	12.4 Å²	12.4	33.4 Å²	33.4	9%	0.087	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	149.3	-174.2	-166.3	0	0	0	0	112.7	L2152 L2201	S2138-L2152 PolarHBondContact N-O 3.08Å; S2138-L2152 PolarHBondContact O-N 3.11Å; S2138-L2201 WeakPolarHBondContact O-CD2 3.42Å; S2138-L2201 PolarHBondContact OG-N 3.01Å; S2138-L2201 VanDerWaalsContact OG-N 3.15Å
2139	L	91.3	Very high	82.7	Confident	11.2 Å²	11.2	31.3 Å²	31.3	6%	0.059	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134.6	173.9	-69.8	177.8	0	0	0	109.6	S2081 A2107 G2109 V2115 I2136 L2149 A2150 I2151	S2081-L2139 WeakPolarHBondContact OG-CG 3.35Å; S2081-L2139 PolarHBondContact OG-N 3.07Å; A2107-L2139 HydrophobicContact CB-CD1 4.15Å; G2109-L2139 VanDerWaalsContact N-CD1 3.28Å; V2115-L2139 HydrophobicContact CG1-CD1 4.36Å; V2115-L2139 HydrophobicContact CG1-CD2 4.45Å; V2115-L2139 HydrophobicContact CG2-CD2 4.06Å; I2136-L2139 HydrophobicContact CG2-CD2 4.14Å; I2136-L2139 HydrophobicContact CG2-CG 4.2Å; L2139-L2149 HydrophobicContact CB-CD1 4.42Å; L2139-L2149 HydrophobicContact CD2-CD1 4.32Å; L2139-A2150 WeakPolarHBondContact CA-O 3.38Å; L2139-I2151 HydrophobicContact CD2-CB 3.98Å; L2139-I2151 HydrophobicContact CD2-CD1 4.48Å; L2139-I2151 HydrophobicContact CD2-CG1 3.37Å; L2139-I2151 HydrophobicContact CD2-CG2 3.97Å
2140	A	90	Very high	82.8	Confident	10.6 Å²	10.6	30 Å²	30	9%	0.088	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	132	173.9	0	0	0	0	0	110.9	L2149 A2150 L2201 F2203	A2140-L2149 WeakPolarHBondContact O-CA 3.4Å; A2140-L2149 VanDerWaalsContact O-CD1 3.3Å; A2140-L2149 WeakPolarHBondContact O-CD1 3.33Å; A2140-A2150 PolarHBondContact N-O 3.08Å; A2140-A2150 VanDerWaalsContact N-O 3.08Å; A2140-A2150 PolarHBondContact O-N 2.95Å; A2140-L2201 HydrophobicContact CB-CB 4.3Å; A2140-L2201 HydrophobicContact CB-CD1 3.32Å; A2140-L2201 HydrophobicContact CB-CG 4.48Å; A2140-F2203 HydrophobicContact CB-CD2 3.88Å; A2140-F2203 HydrophobicContact CB-CE2 4.17Å; A2140-F2203 VanDerWaalsContact O-CE2 3.31Å; A2140-F2203 WeakPolarHBondContact O-CE2 3.26Å
2141	Y	89.3	Confident	82.9	Confident	21.8 Å²	21.8	26.2 Å²	26.2	9%	0.085	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	144.6	166.1	-82.6	-74.8	0	0	0	110.9	S2083 F2084 R2085 A2107 G2146 L2148 L2149 A2163 F2203	S2083-Y2141 WeakPolarHBondContact O-CE2 3.37Å; S2083-Y2141 WeakPolarHBondContact OG-CD2 3.48Å; S2083-Y2141 PolarHBondContact OG-N 3.36Å; F2084-Y2141 VanDerWaalsContact C-CD2 3.46Å; F2084-Y2141 VanDerWaalsContact O-CD2 3.25Å; F2084-Y2141 WeakPolarHBondContact O-CD2 3.3Å; R2085-Y2141 HydrophobicContact CB-CD1 4.19Å; R2085-Y2141 HydrophobicContact CB-CD2 4.17Å; R2085-Y2141 HydrophobicContact CB-CE1 4.01Å; R2085-Y2141 HydrophobicContact CB-CE2 3.98Å; R2085-Y2141 HydrophobicContact CB-CG 4.26Å; R2085-Y2141 HydrophobicContact CG-CD1 4.14Å; R2085-Y2141 HydrophobicContact CG-CE1 4.13Å; R2085-Y2141 HydrophobicContact CG-CG 4.43Å; A2107-Y2141 HydrophobicContact CB-CE2 3.68Å; A2107-Y2141 WeakPolarHBondContact CB-OH 3.25Å; Y2141-G2146 WeakPolarHBondContact CD1-O 3.06Å; Y2141-L2148 WeakPolarHBondContact CA-O 3.3Å; Y2141-L2149 HydrophobicContact CD1-CB 4.08Å; Y2141-L2149 HydrophobicContact CD1-CD1 4.14Å; Y2141-L2149 HydrophobicContact CD2-CD1 4.13Å; Y2141-L2149 HydrophobicContact CE1-CB 3.87Å; Y2141-L2149 HydrophobicContact CE1-CD1 4.09Å; Y2141-L2149 HydrophobicContact CE1-CD2 4.38Å; Y2141-L2149 HydrophobicContact CE1-CG 4.36Å; Y2141-L2149 HydrophobicContact CE2-CD1 4.09Å; Y2141-L2149 HydrophobicContact CG-CD1 4.17Å; Y2141-A2163 HydrophobicContact CD1-CB 4.3Å; Y2141-A2163 HydrophobicContact CE1-CB 3.72Å; Y2141-F2203 WeakPolarHBondContact O-CD2 3.44Å
2142	S	83.4	Confident	83.1	Confident	5 Å²	5	24.9 Å²	24.9	4%	0.035	14%	0.142	C	C	.	.			trans	-69.9	143.2	173.3	61.9	0	0	0	0	111.7	N2144 G2146 R2147 L2148	S2142-N2144 VanDerWaalsContact C-N 3.32Å; S2142-N2144 WeakPolarHBondContact CB-OD1 3.32Å; S2142-N2144 PolarHBondContact O-N 3.21Å; S2142-N2144 VanDerWaalsContact O-N 3.13Å; S2142-N2144 PolarHBondContact OG-OD1 2.89Å; S2142-N2144 VanDerWaalsContact OG-OD1 3.04Å; S2142-G2146 WeakPolarHBondContact O-CA 3.4Å; S2142-G2146 PolarHBondContact O-N 3.29Å; S2142-R2147 PolarHBondContact OG-N 3.17Å; S2142-L2148 WeakPolarHBondContact CB-O 3.45Å; S2142-L2148 PolarHBondContact N-O 3.19Å; S2142-L2148 WeakPolarHBondContact OG-CA 3.47Å; S2142-L2148 WeakPolarHBondContact OG-CB 3.45Å; S2142-L2148 PolarHBondContact OG-N 3.15Å; S2142-L2148 VanDerWaalsContact OG-N 3.11Å; S2142-L2148 PolarHBondContact OG-O 2.81Å
2143	P	74.1	Confident	83.2	Confident	43.4 Å²	43.4	24.1 Å²	24.1	28%	0.282	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-17.6	179.8	26.9	-35.3	0	0	0	113.9	N2088 N2145 S2204 P2206 G2208	N2088-P2143 PolarHBondContact OD1-O 2.8Å; N2088-P2143 VanDerWaalsContact OD1-O 3.08Å; P2143-N2145 VanDerWaalsContact C-N 3.3Å; P2143-N2145 PolarHBondContact O-N 3.13Å; P2143-N2145 VanDerWaalsContact O-N 3.08Å; P2143-S2204 WeakPolarHBondContact CG-O 3.47Å; P2143-P2206 VanDerWaalsContact CB-O 3.32Å; P2143-P2206 WeakPolarHBondContact CB-O 3.36Å; P2143-P2206 VanDerWaalsContact CG-O 3.27Å; P2143-P2206 WeakPolarHBondContact CG-O 3.29Å; P2143-G2208 VanDerWaalsContact CD-CA 3.47Å; P2143-G2208 VanDerWaalsContact CG-N 3.28Å
2144	N	66.8	Low	83.1	Confident	48.2 Å²	48.2	24.4 Å²	24.4	26%	0.258	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	71.7	177.8	21.1	-6.1	0	0	0	112.2	S2142 G2146 R2147 T2207	S2142-N2144 VanDerWaalsContact C-N 3.32Å; S2142-N2144 WeakPolarHBondContact CB-OD1 3.32Å; S2142-N2144 PolarHBondContact O-N 3.21Å; S2142-N2144 VanDerWaalsContact O-N 3.13Å; S2142-N2144 PolarHBondContact OG-OD1 2.89Å; S2142-N2144 VanDerWaalsContact OG-OD1 3.04Å; N2144-G2146 PolarHBondContact O-N 3.32Å; N2144-G2146 VanDerWaalsContact O-N 3.14Å; N2144-R2147 WeakPolarHBondContact O-CG 3.38Å; N2144-R2147 PolarHBondContact O-N 3.36Å; N2144-T2207 PolarHBondContact ND2-O 2.94Å; N2144-T2207 PolarHBondContact OD1-O 2.99Å
2145	N	67.1	Low	82.6	Confident	41.2 Å²	41.2	28.6 Å²	28.6	22%	0.22	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	63	14.7	-175.7	-60.7	19.3	0	0	0	114.3	R2085 N2088 E2094 P2143 R2147	R2085-N2145 PolarHBondContact NE-O 3.07Å; R2085-N2145 PolarHBondContact NH2-O 3.1Å; N2088-N2145 WeakPolarHBondContact CA-OD1 3.4Å; N2088-N2145 HydrophobicContact CB-CB 4.31Å; N2088-N2145 VanDerWaalsContact CB-CG 3.47Å; N2088-N2145 WeakPolarHBondContact CB-OD1 3.4Å; N2088-N2145 PolarHBondContact N-OD1 3.16Å; N2088-N2145 VanDerWaalsContact N-OD1 3.12Å; N2088-N2145 PolarHBondContact ND2-OD1 3.02Å; E2094-N2145 PolarHBondContact OE1-ND2 3.15Å; E2094-N2145 VanDerWaalsContact OE1-ND2 3.09Å; P2143-N2145 VanDerWaalsContact C-N 3.3Å; P2143-N2145 PolarHBondContact O-N 3.13Å; P2143-N2145 VanDerWaalsContact O-N 3.08Å; N2145-R2147 VanDerWaalsContact C-N 3.33Å; N2145-R2147 HydrophobicContact CB-CG 4.33Å; N2145-R2147 PolarHBondContact O-N 3.1Å
2146	G	72.4	Confident	82	Confident	0.4 Å²	0.4	28.4 Å²	28.4	0%	0.004	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	30.5	-175.5	0	0	0	0	0	113.8	R2085 Y2141 S2142 N2144 L2148 A2163	R2085-G2146 VanDerWaalsContact CZ-O 3.29Å; R2085-G2146 PolarHBondContact NE-O 3Å; R2085-G2146 VanDerWaalsContact NE-O 3.13Å; R2085-G2146 PolarHBondContact NH2-O 3.17Å; Y2141-G2146 WeakPolarHBondContact CD1-O 3.06Å; S2142-G2146 WeakPolarHBondContact O-CA 3.4Å; S2142-G2146 PolarHBondContact O-N 3.29Å; N2144-G2146 PolarHBondContact O-N 3.32Å; N2144-G2146 VanDerWaalsContact O-N 3.14Å; G2146-L2148 PolarHBondContact O-N 3.11Å; G2146-A2163 WeakPolarHBondContact O-CB 3.28Å
2147	R	76.2	Confident	81.4	Confident	126.6 Å²	126.6	30.1 Å²	30.1	48%	0.478	15%	0.146	S	C	.	.			trans	-62.2	-30.6	179.5	-73.9	-177.8	179.4	-173.9	1.4	112.7	S2142 N2144 N2145 A2163 E2560	S2142-R2147 PolarHBondContact OG-N 3.17Å; N2144-R2147 WeakPolarHBondContact O-CG 3.38Å; N2144-R2147 PolarHBondContact O-N 3.36Å; N2145-R2147 VanDerWaalsContact C-N 3.33Å; N2145-R2147 HydrophobicContact CB-CG 4.33Å; N2145-R2147 PolarHBondContact O-N 3.1Å; R2147-A2163 WeakPolarHBondContact O-CB 3.29Å; R2147-A2163 PolarHBondContact O-N 3.1Å; R2147-E2560 IonicContact NH1-OE2 3.15Å; R2147-E2560 PolarHBondContact NH1-OE2 3.18Å
2148	L	82.4	Confident	81.2	Confident	22.6 Å²	22.6	29.4 Å²	29.4	12%	0.118	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	141.9	177.5	-56.5	175.4	0	0	0	110.4	Y2141 S2142 G2146 I2160 L2161 L2169 F2203 A2228	Y2141-L2148 WeakPolarHBondContact CA-O 3.3Å; S2142-L2148 WeakPolarHBondContact CB-O 3.45Å; S2142-L2148 PolarHBondContact N-O 3.19Å; S2142-L2148 WeakPolarHBondContact OG-CA 3.47Å; S2142-L2148 WeakPolarHBondContact OG-CB 3.45Å; S2142-L2148 PolarHBondContact OG-N 3.15Å; S2142-L2148 VanDerWaalsContact OG-N 3.11Å; S2142-L2148 PolarHBondContact OG-O 2.81Å; G2146-L2148 PolarHBondContact O-N 3.11Å; L2148-I2160 HydrophobicContact CB-CG2 4.41Å; L2148-I2160 HydrophobicContact CD2-CG2 4.15Å; L2148-L2161 WeakPolarHBondContact CA-O 3.38Å; L2148-L2169 HydrophobicContact CD2-CD1 3.41Å; L2148-L2169 VanDerWaalsContact CD2-CD1 3.43Å; L2148-F2203 HydrophobicContact CB-CZ 4.33Å; L2148-A2228 HydrophobicContact CD1-CB 4.48Å; L2148-A2228 WeakPolarHBondContact CD1-O 3.49Å
2149	L	88.7	Confident	81	Confident	0.2 Å²	0.2	29.2 Å²	29.2	0%	0.001	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	122.5	166.7	173.9	65.6	0	0	0	108.3	A2107 F2117 L2139 A2140 Y2141 I2151 L2161 A2163	A2107-L2149 HydrophobicContact CB-CD1 4.39Å; A2107-L2149 HydrophobicContact CB-CD2 4.06Å; F2117-L2149 HydrophobicContact CE1-CD2 3.52Å; F2117-L2149 VanDerWaalsContact CE1-CD2 3.48Å; F2117-L2149 HydrophobicContact CZ-CD2 3.69Å; L2139-L2149 HydrophobicContact CB-CD1 4.42Å; L2139-L2149 HydrophobicContact CD2-CD1 4.32Å; A2140-L2149 WeakPolarHBondContact O-CA 3.4Å; A2140-L2149 VanDerWaalsContact O-CD1 3.3Å; A2140-L2149 WeakPolarHBondContact O-CD1 3.33Å; Y2141-L2149 HydrophobicContact CD1-CB 4.08Å; Y2141-L2149 HydrophobicContact CD1-CD1 4.14Å; Y2141-L2149 HydrophobicContact CD2-CD1 4.13Å; Y2141-L2149 HydrophobicContact CE1-CB 3.87Å; Y2141-L2149 HydrophobicContact CE1-CD1 4.09Å; Y2141-L2149 HydrophobicContact CE1-CD2 4.38Å; Y2141-L2149 HydrophobicContact CE1-CG 4.36Å; Y2141-L2149 HydrophobicContact CE2-CD1 4.09Å; Y2141-L2149 HydrophobicContact CG-CD1 4.17Å; L2149-I2151 HydrophobicContact CD2-CD1 4.38Å; L2149-I2151 HydrophobicContact CD2-CG1 4.31Å; L2149-I2151 HydrophobicContact CG-CD1 4.21Å; L2149-I2151 HydrophobicContact CG-CG1 4.26Å; L2149-L2161 HydrophobicContact CB-CB 4.38Å; L2149-L2161 HydrophobicContact CD2-CD1 4.32Å; L2149-L2161 PolarHBondContact N-O 3.11Å; L2149-L2161 PolarHBondContact O-N 2.97Å; L2149-A2163 HydrophobicContact CB-CB 4.45Å
2150	A	89.1	Confident	80.7	Confident	0.2 Å²	0.2	28.8 Å²	28.8	0%	0.002	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	138.6	171.9	0	0	0	0	0	110.3	L2139 A2140 F2159 L2201 F2203 L2211	L2139-A2150 WeakPolarHBondContact CA-O 3.38Å; A2140-A2150 PolarHBondContact N-O 3.08Å; A2140-A2150 VanDerWaalsContact N-O 3.08Å; A2140-A2150 PolarHBondContact O-N 2.95Å; A2150-F2159 WeakPolarHBondContact CA-O 3.42Å; A2150-L2201 HydrophobicContact CB-CD1 3.84Å; A2150-F2203 HydrophobicContact CB-CE2 3.65Å; A2150-F2203 HydrophobicContact CB-CZ 3.73Å; A2150-L2211 HydrophobicContact CB-CD1 3.65Å; A2150-L2211 HydrophobicContact CB-CD2 3.85Å; A2150-L2211 HydrophobicContact CB-CG 4.41Å
2151	I	90.2	Very high	80.5	Confident	0.4 Å²	0.4	28.5 Å²	28.5	0%	0.002	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	136.5	-177.8	-58.9	132.6	0	0	0	108	V2115 I2131 I2136 L2139 L2149 S2158 F2159 L2161 L2201	V2115-I2151 HydrophobicContact CG2-CD1 4.14Å; V2115-I2151 HydrophobicContact CG2-CG1 4.29Å; V2115-I2151 HydrophobicContact CG2-CG2 4.37Å; I2131-I2151 HydrophobicContact CD1-CD1 3.68Å; I2131-I2151 HydrophobicContact CD1-CG1 4.17Å; I2131-I2151 HydrophobicContact CG1-CD1 4.36Å; I2131-I2151 HydrophobicContact CG2-CD1 4.42Å; I2131-I2151 HydrophobicContact CG2-CG2 4.39Å; I2136-I2151 HydrophobicContact CD1-CG2 4.02Å; I2136-I2151 HydrophobicContact CG1-CG2 4.24Å; I2136-I2151 HydrophobicContact CG2-CG2 3.94Å; L2139-I2151 HydrophobicContact CD2-CB 3.98Å; L2139-I2151 HydrophobicContact CD2-CD1 4.48Å; L2139-I2151 HydrophobicContact CD2-CG1 3.37Å; L2139-I2151 HydrophobicContact CD2-CG2 3.97Å; L2149-I2151 HydrophobicContact CD2-CD1 4.38Å; L2149-I2151 HydrophobicContact CD2-CG1 4.31Å; L2149-I2151 HydrophobicContact CG-CD1 4.21Å; L2149-I2151 HydrophobicContact CG-CG1 4.26Å; I2151-S2158 CarbonylContact O-C 3.45Å; I2151-S2158 VanDerWaalsContact O-CA 3.23Å; I2151-S2158 WeakPolarHBondContact O-CA 3.34Å; I2151-F2159 HydrophobicContact CB-CB 4.34Å; I2151-F2159 HydrophobicContact CD1-CB 4.44Å; I2151-F2159 HydrophobicContact CG2-CD2 4.37Å; I2151-F2159 PolarHBondContact N-O 3.09Å; I2151-F2159 PolarHBondContact O-N 2.94Å; I2151-L2161 HydrophobicContact CD1-CB 4.43Å; I2151-L2161 HydrophobicContact CD1-CD1 3.51Å; I2151-L2161 HydrophobicContact CD1-CG 3.69Å; I2151-L2201 VanDerWaalsContact C-CD1 3.43Å; I2151-L2201 VanDerWaalsContact C-CD2 3.49Å
2152	L	87	Confident	80	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132	173.3	175.3	63.9	0	0	0	109.4	I2136 C2137 S2138 Q2157 G2199 L2201 Q2213	I2136-L2152 CarbonylContact C-O 3.55Å; C2137-L2152 HydrophobicContact CB-CG 4.45Å; C2137-L2152 PolarHBondContact N-O 3.22Å; S2138-L2152 PolarHBondContact N-O 3.08Å; S2138-L2152 PolarHBondContact O-N 3.11Å; L2152-Q2157 WeakPolarHBondContact CA-O 3.25Å; L2152-G2199 VanDerWaalsContact CD2-C 3.46Å; L2152-L2201 HydrophobicContact CB-CB 4.41Å; L2152-L2201 HydrophobicContact CB-CD1 3.46Å; L2152-L2201 HydrophobicContact CB-CD2 3.98Å; L2152-L2201 HydrophobicContact CB-CG 3.76Å; L2152-L2201 HydrophobicContact CD2-CB 4.48Å; L2152-L2201 HydrophobicContact CD2-CD2 4.31Å; L2152-L2201 HydrophobicContact CD2-CG 4.04Å; L2152-L2201 HydrophobicContact CG-CG 4.41Å; L2152-Q2213 HydrophobicContact CD1-CG 4.3Å; L2152-Q2213 VanDerWaalsContact CD1-NE2 3.32Å; L2152-Q2213 HydrophobicContact CD2-CG 4.2Å
2153	D	84.7	Confident	79.8	Confident	1.2 Å²	1.2	28.6 Å²	28.6	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	173.1	173.8	80.8	2.9	0	0	0	112.8	S2132 S2134 A2135 I2136 E2155 G2156 Q2157 F2159	S2132-D2153 VanDerWaalsContact CB-OD2 3.27Å; S2132-D2153 WeakPolarHBondContact CB-OD2 3.39Å; S2132-D2153 PolarHBondContact OG-OD2 2.98Å; S2134-D2153 VanDerWaalsContact OG-CB 3.25Å; S2134-D2153 WeakPolarHBondContact OG-CB 3.38Å; S2134-D2153 PolarHBondContact OG-OD2 3.22Å; A2135-D2153 CarbonylContact O-C 3.51Å; A2135-D2153 VanDerWaalsContact O-CA 3.29Å; A2135-D2153 WeakPolarHBondContact O-CA 3.26Å; I2136-D2153 HydrophobicContact CD1-CB 4.41Å; D2153-E2155 VanDerWaalsContact C-N 3.26Å; D2153-E2155 PolarHBondContact O-N 3.09Å; D2153-E2155 WeakPolarHBondContact OD1-CA 3.35Å; D2153-E2155 WeakPolarHBondContact OD1-CB 3.18Å; D2153-E2155 PolarHBondContact OD1-N 2.93Å; D2153-E2155 VanDerWaalsContact OD1-N 3.11Å; D2153-G2156 PolarHBondContact O-N 3.17Å; D2153-G2156 VanDerWaalsContact O-N 3.12Å; D2153-G2156 PolarHBondContact OD1-N 3.05Å; D2153-G2156 VanDerWaalsContact OD1-N 3.11Å; D2153-Q2157 PolarHBondContact N-O 3.09Å; D2153-Q2157 VanDerWaalsContact N-O 3.1Å; D2153-Q2157 WeakPolarHBondContact OD1-CA 3.12Å; D2153-Q2157 WeakPolarHBondContact OD1-CB 3.38Å; D2153-Q2157 PolarHBondContact OD1-N 3.24Å; D2153-Q2157 WeakPolarHBondContact OD2-CB 3.33Å; D2153-Q2157 WeakPolarHBondContact OD2-CG 3.36Å; D2153-F2159 HydrophobicContact CB-CE2 4.29Å
2154	R	79.3	Confident	79.8	Confident	119 Å²	119	29.3 Å²	29.3	45%	0.449	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-24.6	-179.2	-176	-178.4	156.8	-164.1	-1.6	113.3	S2134 A2135 C2137 G2156 Q2197	S2134-R2154 PolarHBondContact OG-N 3.03Å; A2135-R2154 HydrophobicContact CB-CB 4.46Å; A2135-R2154 PolarHBondContact O-N 2.94Å; C2137-R2154 VanDerWaalsContact SG-CA 3.53Å; R2154-G2156 VanDerWaalsContact C-N 3.3Å; R2154-G2156 PolarHBondContact O-N 3.14Å; R2154-Q2197 HydrophobicContact CG-CB 4.34Å; R2154-Q2197 HydrophobicContact CG-CG 4.47Å; R2154-Q2197 VanDerWaalsContact CZ-OE1 3.25Å
2155	E	73.3	Confident	80	Confident	101.8 Å²	101.8	29.9 Å²	29.9	48%	0.476	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-5.9	175.9	-66.3	-142	178.6	0	0	112.4	S2134 D2153 Q2157 G2217	S2134-E2155 WeakPolarHBondContact CB-OE1 3.43Å; S2134-E2155 PolarHBondContact OG-N 2.82Å; D2153-E2155 VanDerWaalsContact C-N 3.26Å; D2153-E2155 PolarHBondContact O-N 3.09Å; D2153-E2155 WeakPolarHBondContact OD1-CA 3.35Å; D2153-E2155 WeakPolarHBondContact OD1-CB 3.18Å; D2153-E2155 PolarHBondContact OD1-N 2.93Å; D2153-E2155 VanDerWaalsContact OD1-N 3.11Å; E2155-Q2157 VanDerWaalsContact C-N 3.31Å; E2155-Q2157 HydrophobicContact CB-CG 4.12Å; E2155-Q2157 PolarHBondContact OE2-NE2 3.06Å; E2155-G2217 PolarHBondContact O-N 2.86Å; E2155-G2217 VanDerWaalsContact O-N 3.08Å
2156	G	72.8	Confident	80.5	Confident	13.2 Å²	13.2	29.4 Å²	29.4	14%	0.136	14%	0.139	C	C	.	.	S	Bend	trans	89.6	7.8	-179.6	0	0	0	0	0	114.3	D2153 R2154 S2158 Q2213 G2216	D2153-G2156 PolarHBondContact O-N 3.17Å; D2153-G2156 VanDerWaalsContact O-N 3.12Å; D2153-G2156 PolarHBondContact OD1-N 3.05Å; D2153-G2156 VanDerWaalsContact OD1-N 3.11Å; R2154-G2156 VanDerWaalsContact C-N 3.3Å; R2154-G2156 PolarHBondContact O-N 3.14Å; G2156-S2158 PolarHBondContact O-N 3.38Å; G2156-Q2213 PolarHBondContact O-NE2 3.31Å; G2156-G2216 VanDerWaalsContact CA-C 3.47Å
2157	Q	77	Confident	80.5	Confident	36.2 Å²	36.2	32 Å²	32	17%	0.169	15%	0.154	C	C	.	.			trans	-81.2	122.5	179	-47.1	-178.4	14.8	0	0	108.4	L2152 D2153 E2155 F2159 R2171 T2173	L2152-Q2157 WeakPolarHBondContact CA-O 3.25Å; D2153-Q2157 PolarHBondContact N-O 3.09Å; D2153-Q2157 VanDerWaalsContact N-O 3.1Å; D2153-Q2157 WeakPolarHBondContact OD1-CA 3.12Å; D2153-Q2157 WeakPolarHBondContact OD1-CB 3.38Å; D2153-Q2157 PolarHBondContact OD1-N 3.24Å; D2153-Q2157 WeakPolarHBondContact OD2-CB 3.33Å; D2153-Q2157 WeakPolarHBondContact OD2-CG 3.36Å; E2155-Q2157 VanDerWaalsContact C-N 3.31Å; E2155-Q2157 HydrophobicContact CB-CG 4.12Å; E2155-Q2157 PolarHBondContact OE2-NE2 3.06Å; Q2157-F2159 HydrophobicContact CB-CE1 4.3Å; Q2157-F2159 HydrophobicContact CB-CE2 3.78Å; Q2157-F2159 HydrophobicContact CB-CZ 3.71Å; Q2157-F2159 HydrophobicContact CG-CZ 4.38Å; Q2157-F2159 WeakPolarHBondContact O-CE2 3.28Å; Q2157-F2159 VanDerWaalsContact OE1-CZ 3.27Å; Q2157-R2171 VanDerWaalsContact CG-NH2 3.27Å; Q2157-R2171 VanDerWaalsContact OE1-CZ 3.3Å; Q2157-R2171 VanDerWaalsContact OE1-NE 3.12Å; Q2157-R2171 VanDerWaalsContact OE1-NH1 3.12Å; Q2157-R2171 VanDerWaalsContact OE1-NH2 3.12Å; Q2157-T2173 HydrophobicContact CB-CG2 4.38Å; Q2157-T2173 HydrophobicContact CG-CG2 4.19Å
2158	S	82.3	Confident	80.4	Confident	0.8 Å²	0.8	29.9 Å²	29.9	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	138.8	171.4	47.5	0	0	0	0	111	I2151 G2156 R2171 L2172 Q2213	I2151-S2158 CarbonylContact O-C 3.45Å; I2151-S2158 VanDerWaalsContact O-CA 3.23Å; I2151-S2158 WeakPolarHBondContact O-CA 3.34Å; G2156-S2158 PolarHBondContact O-N 3.38Å; S2158-R2171 CarbonylContact O-C 3.51Å; S2158-R2171 WeakPolarHBondContact O-CA 3.49Å; S2158-R2171 WeakPolarHBondContact O-CG 3.44Å; S2158-L2172 PolarHBondContact N-O 3.07Å; S2158-L2172 VanDerWaalsContact N-O 3.14Å; S2158-L2172 WeakPolarHBondContact O-CA 3.44Å; S2158-L2172 WeakPolarHBondContact O-CB 3.23Å; S2158-L2172 PolarHBondContact O-N 2.99Å; S2158-L2172 VanDerWaalsContact OG-CB 3.3Å; S2158-L2172 WeakPolarHBondContact OG-CB 3.38Å; S2158-L2172 VanDerWaalsContact OG-CD1 3.28Å; S2158-L2172 WeakPolarHBondContact OG-CD1 3.23Å; S2158-L2172 PolarHBondContact OG-O 3.27Å; S2158-Q2213 PolarHBondContact OG-OE1 3.16Å
2159	F	84.7	Confident	79.8	Confident	8.6 Å²	8.6	30.3 Å²	30.3	4%	0.038	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.9	-177	-52.8	-86.5	0	0	0	109.1	I2131 A2150 I2151 D2153 Q2157 Y2168 R2171	I2131-F2159 HydrophobicContact CG2-CB 4.04Å; I2131-F2159 HydrophobicContact CG2-CD1 4.21Å; I2131-F2159 HydrophobicContact CG2-CD2 3.77Å; I2131-F2159 HydrophobicContact CG2-CE1 4.24Å; I2131-F2159 HydrophobicContact CG2-CE2 4.22Å; I2131-F2159 HydrophobicContact CG2-CG 3.75Å; I2131-F2159 HydrophobicContact CG2-CZ 4.49Å; A2150-F2159 WeakPolarHBondContact CA-O 3.42Å; I2151-F2159 HydrophobicContact CB-CB 4.34Å; I2151-F2159 HydrophobicContact CD1-CB 4.44Å; I2151-F2159 HydrophobicContact CG2-CD2 4.37Å; I2151-F2159 PolarHBondContact N-O 3.09Å; I2151-F2159 PolarHBondContact O-N 2.94Å; D2153-F2159 HydrophobicContact CB-CE2 4.29Å; Q2157-F2159 HydrophobicContact CB-CE1 4.3Å; Q2157-F2159 HydrophobicContact CB-CE2 3.78Å; Q2157-F2159 HydrophobicContact CB-CZ 3.71Å; Q2157-F2159 HydrophobicContact CG-CZ 4.38Å; Q2157-F2159 WeakPolarHBondContact O-CE2 3.28Å; Q2157-F2159 VanDerWaalsContact OE1-CZ 3.27Å; F2159-Y2168 HydrophobicContact CB-CE2 4.17Å; F2159-Y2168 AromaticContact CD1-CE2 3.71Å; F2159-Y2168 HydrophobicContact CD1-CE2 3.71Å; F2159-Y2168 WeakPolarHBondContact CD1-OH 3.45Å; F2159-Y2168 HydrophobicContact CE1-CE2 4.46Å; F2159-Y2168 HydrophobicContact CG-CE2 4.33Å; F2159-R2171 HydrophobicContact CD1-CB 4.34Å; F2159-R2171 HydrophobicContact CD1-CG 3.87Å; F2159-R2171 HydrophobicContact CE1-CB 4.49Å; F2159-R2171 HydrophobicContact CE1-CG 3.79Å; F2159-R2171 HydrophobicContact CZ-CG 4.5Å
2160	I	84.9	Confident	78.8	Confident	4 Å²	4	30.9 Å²	30.9	2%	0.021	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.8	176.7	-56.4	-178.5	0	0	0	109.2	L2148 L2169 G2170 L2172 L2211 T2750	L2148-I2160 HydrophobicContact CB-CG2 4.41Å; L2148-I2160 HydrophobicContact CD2-CG2 4.15Å; I2160-L2169 HydrophobicContact CB-CB 4.44Å; I2160-L2169 HydrophobicContact CG2-CB 4.28Å; I2160-L2169 HydrophobicContact CG2-CD1 3.99Å; I2160-L2169 WeakPolarHBondContact O-CB 3.35Å; I2160-L2169 PolarHBondContact O-N 3.11Å; I2160-G2170 PolarHBondContact N-O 3.07Å; I2160-G2170 PolarHBondContact O-N 2.94Å; I2160-L2172 HydrophobicContact CD1-CD1 4.01Å; I2160-L2172 HydrophobicContact CD1-CD2 3.92Å; I2160-L2172 HydrophobicContact CD1-CG 4.35Å; I2160-L2172 HydrophobicContact CG1-CD1 4.2Å; I2160-L2172 HydrophobicContact CG1-CD2 4.3Å; I2160-L2172 HydrophobicContact CG1-CG 4.48Å; I2160-L2211 HydrophobicContact CD1-CD2 4.34Å; I2160-L2211 HydrophobicContact CG1-CD2 4.5Å; I2160-T2750 HydrophobicContact CD1-CG2 3.56Å
2161	L	83.9	Confident	78	Confident	4 Å²	4	36.3 Å²	36.3	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	145.5	171.9	-61.8	179.2	0	0	0	110.7	F2117 L2129 I2131 L2148 L2149 I2151 A2163 V2167 Y2168	F2117-L2161 HydrophobicContact CE2-CD1 4.4Å; F2117-L2161 HydrophobicContact CZ-CD1 4.19Å; L2129-L2161 HydrophobicContact CD1-CD1 3.86Å; L2129-L2161 HydrophobicContact CD1-CD2 4.27Å; I2131-L2161 HydrophobicContact CD1-CD1 3.95Å; I2131-L2161 HydrophobicContact CD1-CG 4.35Å; I2131-L2161 HydrophobicContact CG1-CD1 4.47Å; L2148-L2161 WeakPolarHBondContact CA-O 3.38Å; L2149-L2161 HydrophobicContact CB-CB 4.38Å; L2149-L2161 HydrophobicContact CD2-CD1 4.32Å; L2149-L2161 PolarHBondContact N-O 3.11Å; L2149-L2161 PolarHBondContact O-N 2.97Å; I2151-L2161 HydrophobicContact CD1-CB 4.43Å; I2151-L2161 HydrophobicContact CD1-CD1 3.51Å; I2151-L2161 HydrophobicContact CD1-CG 3.69Å; L2161-A2163 PolarHBondContact O-N 3.05Å; L2161-V2167 WeakPolarHBondContact CA-O 3.33Å; L2161-Y2168 HydrophobicContact CD2-CD2 3.97Å; L2161-Y2168 HydrophobicContact CD2-CG 4.41Å
2162	N	78.8	Confident	76.9	Confident	26 Å²	26	36.9 Å²	36.9	14%	0.139	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	118.2	159.7	-176.4	-40.8	0	0	0	108.1	D2164 T2165 F2166 V2167 L2169	N2162-D2164 VanDerWaalsContact C-N 3.3Å; N2162-D2164 PolarHBondContact O-N 3.06Å; N2162-D2164 WeakPolarHBondContact OD1-CA 3.32Å; N2162-D2164 VanDerWaalsContact OD1-CB 3.26Å; N2162-D2164 WeakPolarHBondContact OD1-CB 3.32Å; N2162-D2164 PolarHBondContact OD1-N 2.95Å; N2162-T2165 WeakPolarHBondContact CB-OG1 3.36Å; N2162-T2165 VanDerWaalsContact CG-OG1 3.3Å; N2162-T2165 PolarHBondContact OD1-N 3.18Å; N2162-T2165 PolarHBondContact OD1-OG1 3.16Å; N2162-F2166 VanDerWaalsContact O-CA 3.24Å; N2162-F2166 WeakPolarHBondContact O-CA 3.33Å; N2162-F2166 PolarHBondContact O-N 2.89Å; N2162-V2167 PolarHBondContact N-O 3.21Å; N2162-V2167 PolarHBondContact O-N 2.99Å; N2162-L2169 HydrophobicContact CB-CD1 3.93Å; N2162-L2169 HydrophobicContact CB-CD2 4.05Å; N2162-L2169 HydrophobicContact CB-CG 4.02Å
2163	A	80.4	Confident	75.6	Confident	3.2 Å²	3.2	39.4 Å²	39.4	3%	0.026	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-15.4	-176.4	0	0	0	0	0	114.2	R2085 Y2141 G2146 R2147 L2149 L2161	R2085-A2163 VanDerWaalsContact NH1-C 3.25Å; R2085-A2163 PolarHBondContact NH1-O 3.1Å; Y2141-A2163 HydrophobicContact CD1-CB 4.3Å; Y2141-A2163 HydrophobicContact CE1-CB 3.72Å; G2146-A2163 WeakPolarHBondContact O-CB 3.28Å; R2147-A2163 WeakPolarHBondContact O-CB 3.29Å; R2147-A2163 PolarHBondContact O-N 3.1Å; L2149-A2163 HydrophobicContact CB-CB 4.45Å; L2161-A2163 PolarHBondContact O-N 3.05Å
2164	D	73.9	Confident	74.1	Confident	56.6 Å²	56.6	42.2 Å²	42.2	30%	0.303	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-40.4	178.9	-70.2	-33.1	0	0	0	111.8	R2085 R2103 N2162	R2085-D2164 IonicContact CZ-OD1 3.35Å; R2085-D2164 IonicContact CZ-OD2 3.38Å; R2085-D2164 IonicContact NH1-OD1 3.34Å; R2085-D2164 PolarHBondContact NH1-OD1 3.14Å; R2085-D2164 IonicContact NH1-OD2 2.73Å; R2085-D2164 PolarHBondContact NH1-OD2 2.78Å; R2085-D2164 VanDerWaalsContact NH2-CG 3.3Å; R2085-D2164 IonicContact NH2-OD1 3.15Å; R2085-D2164 PolarHBondContact NH2-OD1 3.11Å; R2085-D2164 IonicContact NH2-OD2 3.24Å; R2085-D2164 PolarHBondContact NH2-OD2 3.2Å; R2103-D2164 VanDerWaalsContact CD-OD1 3.23Å; R2103-D2164 WeakPolarHBondContact CD-OD1 3.49Å; R2103-D2164 IonicContact CZ-OD1 3.42Å; R2103-D2164 IonicContact CZ-OD2 3.41Å; R2103-D2164 IonicContact NE-OD1 3.75Å; R2103-D2164 VanDerWaalsContact NH1-CB 3.27Å; R2103-D2164 PolarHBondContact NH1-O 3.07Å; R2103-D2164 IonicContact NH1-OD1 2.91Å; R2103-D2164 PolarHBondContact NH1-OD1 3Å; R2103-D2164 IonicContact NH1-OD2 3.61Å; R2103-D2164 PolarHBondContact NH1-OD2 3.36Å; R2103-D2164 IonicContact NH2-OD1 2.66Å; R2103-D2164 IonicContact NH2-OD2 2.65Å; R2103-D2164 PolarHBondContact NH2-OD2 2.97Å; N2162-D2164 VanDerWaalsContact C-N 3.3Å; N2162-D2164 PolarHBondContact O-N 3.06Å; N2162-D2164 WeakPolarHBondContact OD1-CA 3.32Å; N2162-D2164 VanDerWaalsContact OD1-CB 3.26Å; N2162-D2164 WeakPolarHBondContact OD1-CB 3.32Å; N2162-D2164 PolarHBondContact OD1-N 2.95Å
2165	T	71.2	Confident	72.4	Confident	61.2 Å²	61.2	43.1 Å²	43.1	38%	0.375	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-12	-177.9	57.9	0	0	0	0	112.9	N2162 V2167	N2162-T2165 WeakPolarHBondContact CB-OG1 3.36Å; N2162-T2165 VanDerWaalsContact CG-OG1 3.3Å; N2162-T2165 PolarHBondContact OD1-N 3.18Å; N2162-T2165 PolarHBondContact OD1-OG1 3.16Å; T2165-V2167 PolarHBondContact O-N 2.99Å; T2165-V2167 WeakPolarHBondContact OG1-CB 3.36Å; T2165-V2167 VanDerWaalsContact OG1-CG2 3.29Å; T2165-V2167 WeakPolarHBondContact OG1-CG2 3.27Å; T2165-V2167 PolarHBondContact OG1-N 3.29Å
2166	F	77.2	Confident	70.7	Confident	32.2 Å²	32.2	41.7 Å²	41.7	14%	0.141	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	33.9	-169.3	-53.1	-76.8	0	0	0	112.4	F2117 I2126 K2127 L2129 N2162	F2117-F2166 HydrophobicContact CB-CE1 4.2Å; F2117-F2166 AromaticContact CD1-CD1 3.92Å; F2117-F2166 HydrophobicContact CD1-CD1 4.02Å; F2117-F2166 AromaticContact CD1-CE1 3.47Å; F2117-F2166 HydrophobicContact CD1-CE1 3.47Å; F2117-F2166 VanDerWaalsContact CD1-CE1 3.45Å; F2117-F2166 HydrophobicContact CD1-CZ 4.42Å; F2117-F2166 AromaticContact CD2-CD1 3.99Å; F2117-F2166 HydrophobicContact CD2-CD1 4.09Å; F2117-F2166 HydrophobicContact CD2-CE1 4.14Å; F2117-F2166 AromaticContact CE1-CD1 3.9Å; F2117-F2166 HydrophobicContact CE1-CD1 3.92Å; F2117-F2166 AromaticContact CE1-CE1 3.76Å; F2117-F2166 HydrophobicContact CE1-CE1 3.76Å; F2117-F2166 AromaticContact CE2-CD1 3.94Å; F2117-F2166 HydrophobicContact CE2-CD1 4.03Å; F2117-F2166 HydrophobicContact CE2-CE1 4.3Å; F2117-F2166 AromaticContact CG-CD1 3.93Å; F2117-F2166 HydrophobicContact CG-CD1 4.08Å; F2117-F2166 AromaticContact CG-CE1 3.66Å; F2117-F2166 HydrophobicContact CG-CE1 3.66Å; F2117-F2166 HydrophobicContact CG-CZ 4.41Å; F2117-F2166 AromaticContact CZ-CD1 3.91Å; F2117-F2166 HydrophobicContact CZ-CD1 3.93Å; F2117-F2166 HydrophobicContact CZ-CE1 4.23Å; I2126-F2166 HydrophobicContact CD1-CZ 4.29Å; I2126-F2166 HydrophobicContact CG2-CE2 4.03Å; I2126-F2166 HydrophobicContact CG2-CZ 4.19Å; K2127-F2166 HydrophobicContact CD-CB 3.95Å; K2127-F2166 HydrophobicContact CD-CD2 4.23Å; K2127-F2166 HydrophobicContact CD-CG 4.09Å; K2127-F2166 PolarHBondContact NZ-O 2.93Å; L2129-F2166 HydrophobicContact CD1-CB 4.33Å; N2162-F2166 VanDerWaalsContact O-CA 3.24Å; N2162-F2166 WeakPolarHBondContact O-CA 3.33Å; N2162-F2166 PolarHBondContact O-N 2.89Å
2167	V	71.9	Confident	68.7	Low	53.6 Å²	53.6	46.6 Å²	46.6	33%	0.325	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	138.6	177.8	172.4	0	0	0	0	109.6	L2161 N2162 T2165 L2169	L2161-V2167 WeakPolarHBondContact CA-O 3.33Å; N2162-V2167 PolarHBondContact N-O 3.21Å; N2162-V2167 PolarHBondContact O-N 2.99Å; T2165-V2167 PolarHBondContact O-N 2.99Å; T2165-V2167 WeakPolarHBondContact OG1-CB 3.36Å; T2165-V2167 VanDerWaalsContact OG1-CG2 3.29Å; T2165-V2167 WeakPolarHBondContact OG1-CG2 3.27Å; T2165-V2167 PolarHBondContact OG1-N 3.29Å; V2167-L2169 PolarHBondContact O-N 3.1Å
2168	Y	73.8	Confident	66.5	Low	83.4 Å²	83.4	50.9 Å²	50.9	33%	0.327	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	120.1	173.3	-175.9	-97.3	0	0	0	111.2	F2159 L2161 G2170 R2171 R2548 L2717	F2159-Y2168 HydrophobicContact CB-CE2 4.17Å; F2159-Y2168 AromaticContact CD1-CE2 3.71Å; F2159-Y2168 HydrophobicContact CD1-CE2 3.71Å; F2159-Y2168 WeakPolarHBondContact CD1-OH 3.45Å; F2159-Y2168 HydrophobicContact CE1-CE2 4.46Å; F2159-Y2168 HydrophobicContact CG-CE2 4.33Å; L2161-Y2168 HydrophobicContact CD2-CD2 3.97Å; L2161-Y2168 HydrophobicContact CD2-CG 4.41Å; Y2168-G2170 VanDerWaalsContact CZ-C 3.43Å; Y2168-G2170 VanDerWaalsContact OH-C 3.31Å; Y2168-R2171 WeakPolarHBondContact OH-CA 3.24Å; Y2168-R2171 VanDerWaalsContact OH-CB 3.23Å; Y2168-R2171 WeakPolarHBondContact OH-CB 3.38Å; Y2168-R2171 PolarHBondContact OH-N 3.01Å; Y2168-R2171 VanDerWaalsContact OH-N 3.17Å; Y2168-R2548 PolarHBondContact O-NH1 3.19Å; Y2168-L2717 HydrophobicContact CE1-CD2 4.23Å
2169	L	70.1	Confident	64	Low	29.8 Å²	29.8	55.6 Å²	55.6	16%	0.156	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-39.1	-179	-64.8	179.8	0	0	0	112	L2148 I2160 N2162 V2167 L2230 P2233 I2558	L2148-L2169 HydrophobicContact CD2-CD1 3.41Å; L2148-L2169 VanDerWaalsContact CD2-CD1 3.43Å; I2160-L2169 HydrophobicContact CB-CB 4.44Å; I2160-L2169 HydrophobicContact CG2-CB 4.28Å; I2160-L2169 HydrophobicContact CG2-CD1 3.99Å; I2160-L2169 WeakPolarHBondContact O-CB 3.35Å; I2160-L2169 PolarHBondContact O-N 3.11Å; N2162-L2169 HydrophobicContact CB-CD1 3.93Å; N2162-L2169 HydrophobicContact CB-CD2 4.05Å; N2162-L2169 HydrophobicContact CB-CG 4.02Å; V2167-L2169 PolarHBondContact O-N 3.1Å; L2169-L2230 HydrophobicContact CB-CD1 4.25Å; L2169-L2230 HydrophobicContact CD1-CD1 3.97Å; L2169-L2230 HydrophobicContact CD2-CD1 4.43Å; L2169-L2230 HydrophobicContact CG-CD1 4.44Å; L2169-P2233 HydrophobicContact CD2-CB 3.69Å; L2169-P2233 HydrophobicContact CD2-CG 4.48Å; L2169-I2558 HydrophobicContact CD1-CG2 4.48Å; L2169-I2558 HydrophobicContact CD2-CG1 4.44Å; L2169-I2558 HydrophobicContact CD2-CG2 3.37Å
2170	G	68.3	Low	61.4	Low	14.2 Å²	14.2	59.7 Å²	59.7	15%	0.146	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.5	169.8	179.3	0	0	0	0	0	114	I2160 Y2168	I2160-G2170 PolarHBondContact N-O 3.07Å; I2160-G2170 PolarHBondContact O-N 2.94Å; Y2168-G2170 VanDerWaalsContact CZ-C 3.43Å; Y2168-G2170 VanDerWaalsContact OH-C 3.31Å
2171	R	72.1	Confident	59	Low	113.4 Å²	113.4	64.9 Å²	64.9	43%	0.428	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	140.8	169.9	-158.5	174.3	160.8	-177.9	-12.6	108.5	Q2157 S2158 F2159 Y2168 T2173	Q2157-R2171 VanDerWaalsContact CG-NH2 3.27Å; Q2157-R2171 VanDerWaalsContact OE1-CZ 3.3Å; Q2157-R2171 VanDerWaalsContact OE1-NE 3.12Å; Q2157-R2171 VanDerWaalsContact OE1-NH1 3.12Å; Q2157-R2171 VanDerWaalsContact OE1-NH2 3.12Å; S2158-R2171 CarbonylContact O-C 3.51Å; S2158-R2171 WeakPolarHBondContact O-CA 3.49Å; S2158-R2171 WeakPolarHBondContact O-CG 3.44Å; F2159-R2171 HydrophobicContact CD1-CB 4.34Å; F2159-R2171 HydrophobicContact CD1-CG 3.87Å; F2159-R2171 HydrophobicContact CE1-CB 4.49Å; F2159-R2171 HydrophobicContact CE1-CG 3.79Å; F2159-R2171 HydrophobicContact CZ-CG 4.5Å; Y2168-R2171 WeakPolarHBondContact OH-CA 3.24Å; Y2168-R2171 VanDerWaalsContact OH-CB 3.23Å; Y2168-R2171 WeakPolarHBondContact OH-CB 3.38Å; Y2168-R2171 PolarHBondContact OH-N 3.01Å; Y2168-R2171 VanDerWaalsContact OH-N 3.17Å; R2171-T2173 HydrophobicContact CG-CG2 3.94Å; R2171-T2173 VanDerWaalsContact NE-CG2 3.27Å
2172	L	67.7	Low	56.5	Low	13.4 Å²	13.4	70.7 Å²	70.7	7%	0.07	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	111	167.4	-48.2	179.6	0	0	0	106.9	S2158 I2160 L2211 W2226 T2750	S2158-L2172 PolarHBondContact N-O 3.07Å; S2158-L2172 VanDerWaalsContact N-O 3.14Å; S2158-L2172 WeakPolarHBondContact O-CA 3.44Å; S2158-L2172 WeakPolarHBondContact O-CB 3.23Å; S2158-L2172 PolarHBondContact O-N 2.99Å; S2158-L2172 VanDerWaalsContact OG-CB 3.3Å; S2158-L2172 WeakPolarHBondContact OG-CB 3.38Å; S2158-L2172 VanDerWaalsContact OG-CD1 3.28Å; S2158-L2172 WeakPolarHBondContact OG-CD1 3.23Å; S2158-L2172 PolarHBondContact OG-O 3.27Å; I2160-L2172 HydrophobicContact CD1-CD1 4.01Å; I2160-L2172 HydrophobicContact CD1-CD2 3.92Å; I2160-L2172 HydrophobicContact CD1-CG 4.35Å; I2160-L2172 HydrophobicContact CG1-CD1 4.2Å; I2160-L2172 HydrophobicContact CG1-CD2 4.3Å; I2160-L2172 HydrophobicContact CG1-CG 4.48Å; L2172-L2211 HydrophobicContact CD1-CD2 3.91Å; L2172-W2226 HydrophobicContact CB-CD2 4.32Å; L2172-W2226 HydrophobicContact CB-CE3 4.25Å; L2172-W2226 HydrophobicContact CB-CH2 4.08Å; L2172-W2226 HydrophobicContact CB-CZ2 4.07Å; L2172-W2226 HydrophobicContact CB-CZ3 4.04Å; L2172-W2226 HydrophobicContact CD1-CB 4.12Å; L2172-W2226 HydrophobicContact CD1-CD2 3.86Å; L2172-W2226 HydrophobicContact CD1-CE3 4.16Å; L2172-W2226 HydrophobicContact CD1-CG 3.77Å; L2172-W2226 HydrophobicContact CD2-CD2 4.41Å; L2172-W2226 HydrophobicContact CD2-CE3 4.17Å; L2172-T2750 WeakPolarHBondContact CD1-OG1 3.14Å; L2172-T2750 HydrophobicContact CD2-CG2 4.15Å; L2172-T2750 WeakPolarHBondContact CD2-OG1 3.48Å
2173	T	58.7	Low	54.4	Low	52 Å²	52	77.4 Å²	77.4	32%	0.319	42%	0.421	S	S	.	.			trans	-119.6	134.9	174.1	45	0	0	0	0	109.3	Q2157 R2171 N2175	Q2157-T2173 HydrophobicContact CB-CG2 4.38Å; Q2157-T2173 HydrophobicContact CG-CG2 4.19Å; R2171-T2173 HydrophobicContact CG-CG2 3.94Å; R2171-T2173 VanDerWaalsContact NE-CG2 3.27Å; T2173-N2175 VanDerWaalsContact C-N 3.32Å; T2173-N2175 WeakPolarHBondContact CB-OD1 3.31Å; T2173-N2175 PolarHBondContact O-N 3.17Å; T2173-N2175 PolarHBondContact OG1-OD1 2.91Å; T2173-N2175 VanDerWaalsContact OG1-OD1 3.11Å
2174	E	54.7	Low	52.2	Low	60.4 Å²	60.4	86 Å²	86	28%	0.282	46%	0.458	S	S	.	.			trans	-68.2	105.3	162.6	-80.6	-173.2	162.3	0	0	107.9	V2176 S2218 S2219 N2224 W2226	E2174-V2176 HydrophobicContact CB-CG2 4.09Å; E2174-V2176 HydrophobicContact CG-CG2 4.16Å; E2174-V2176 PolarHBondContact O-N 3.21Å; E2174-V2176 WeakPolarHBondContact OE2-CG2 3.33Å; E2174-S2218 PolarHBondContact OE2-OG 3.48Å; E2174-S2219 WeakPolarHBondContact OE1-CB 3.42Å; E2174-S2219 WeakPolarHBondContact OE2-CB 3.21Å; E2174-S2219 PolarHBondContact OE2-OG 3.01Å; E2174-S2219 VanDerWaalsContact OE2-OG 3.07Å; E2174-N2224 VanDerWaalsContact CD-ND2 3.31Å; E2174-N2224 PolarHBondContact OE1-ND2 3.21Å; E2174-N2224 PolarHBondContact OE1-OD1 3.02Å; E2174-N2224 PolarHBondContact OE2-ND2 2.8Å; E2174-W2226 HydrophobicContact CG-CH2 4.47Å; E2174-W2226 HydrophobicContact CG-CZ2 4.31Å
2175	N	41.9	Very low	50.1	Low	136.2 Å²	136.2	89.1 Å²	89.1	73%	0.728	48%	0.479	S	S	*	.			trans	-78.6	48.6	170.7	-74.7	-4.4	0	0	0	110.6	T2173 S2177	T2173-N2175 VanDerWaalsContact C-N 3.32Å; T2173-N2175 WeakPolarHBondContact CB-OD1 3.31Å; T2173-N2175 PolarHBondContact O-N 3.17Å; T2173-N2175 PolarHBondContact OG1-OD1 2.91Å; T2173-N2175 VanDerWaalsContact OG1-OD1 3.11Å; N2175-S2177 PolarHBondContact O-N 3.18Å
2176	V	38.9	Very low	48.2	Very low	72.8 Å²	72.8	90.9 Å²	90.9	44%	0.441	49%	0.494	S	S	.	.			trans	-94.4	90.5	175.5	-167.6	0	0	0	0	108.2	E2174 F2178	E2174-V2176 HydrophobicContact CB-CG2 4.09Å; E2174-V2176 HydrophobicContact CG-CG2 4.16Å; E2174-V2176 PolarHBondContact O-N 3.21Å; E2174-V2176 WeakPolarHBondContact OE2-CG2 3.33Å; V2176-F2178 VanDerWaalsContact C-N 3.32Å; V2176-F2178 HydrophobicContact CB-CD2 4.23Å; V2176-F2178 HydrophobicContact CB-CE2 4.1Å; V2176-F2178 HydrophobicContact CB-CZ 4.4Å; V2176-F2178 HydrophobicContact CG1-CD1 4.22Å; V2176-F2178 HydrophobicContact CG1-CD2 3.46Å; V2176-F2178 HydrophobicContact CG1-CE1 4.17Å; V2176-F2178 HydrophobicContact CG1-CE2 3.26Å; V2176-F2178 VanDerWaalsContact CG1-CE2 3.48Å; V2176-F2178 HydrophobicContact CG1-CG 4.1Å; V2176-F2178 HydrophobicContact CG1-CZ 3.75Å; V2176-F2178 VanDerWaalsContact CG1-CZ 3.43Å; V2176-F2178 HydrophobicContact CG2-CE2 4.38Å; V2176-F2178 WeakPolarHBondContact O-CD2 3.45Å; V2176-F2178 PolarHBondContact O-N 3.01Å
2177	S	29.3	Very low	46.1	Very low	117 Å²	117	96.8 Å²	96.8	82%	0.818	53%	0.526	S	S	*	.			trans	-70.1	82	166	57.3	0	0	0	0	109.1	N2175 S2179	N2175-S2177 PolarHBondContact O-N 3.18Å; S2177-S2179 PolarHBondContact O-N 2.84Å; S2177-S2179 VanDerWaalsContact O-N 3.14Å
2178	F	32.3	Very low	44.3	Very low	125.4 Å²	125.4	100.7 Å²	100.7	55%	0.55	55%	0.545	S	S	*	.			trans	-68	120	164.6	-77.9	-74.3	0	0	0	108.2	V2176 S2180 I2181	V2176-F2178 VanDerWaalsContact C-N 3.32Å; V2176-F2178 HydrophobicContact CB-CD2 4.23Å; V2176-F2178 HydrophobicContact CB-CE2 4.1Å; V2176-F2178 HydrophobicContact CB-CZ 4.4Å; V2176-F2178 HydrophobicContact CG1-CD1 4.22Å; V2176-F2178 HydrophobicContact CG1-CD2 3.46Å; V2176-F2178 HydrophobicContact CG1-CE1 4.17Å; V2176-F2178 HydrophobicContact CG1-CE2 3.26Å; V2176-F2178 VanDerWaalsContact CG1-CE2 3.48Å; V2176-F2178 HydrophobicContact CG1-CG 4.1Å; V2176-F2178 HydrophobicContact CG1-CZ 3.75Å; V2176-F2178 VanDerWaalsContact CG1-CZ 3.43Å; V2176-F2178 HydrophobicContact CG2-CE2 4.38Å; V2176-F2178 WeakPolarHBondContact O-CD2 3.45Å; V2176-F2178 PolarHBondContact O-N 3.01Å; F2178-S2180 PolarHBondContact O-N 3.08Å; F2178-I2181 HydrophobicContact CD1-CD1 3.98Å; F2178-I2181 HydrophobicContact CE1-CD1 4.49Å
2179	S	30.2	Very low	42.4	Very low	99.2 Å²	99.2	105.8 Å²	105.8	69%	0.694	57%	0.572	S	S	*	*			trans	-53.2	124.3	161.7	51.2	0	0	0	0	108.4	S2177 I2181	S2177-S2179 PolarHBondContact O-N 2.84Å; S2177-S2179 VanDerWaalsContact O-N 3.14Å; S2179-I2181 PolarHBondContact O-N 3.03Å
2180	S	29.4	Very low	40.6	Very low	96.6 Å²	96.6	111.7 Å²	111.7	68%	0.676	60%	0.603	S	S	*	*			trans	-30.7	96	178	27.8	0	0	0	0	113.5	F2178 N2182	F2178-S2180 PolarHBondContact O-N 3.08Å; S2180-N2182 WeakPolarHBondContact CB-OD1 3.26Å; S2180-N2182 PolarHBondContact O-N 3.14Å
2181	I	33.7	Very low	38.7	Very low	112.4 Å²	112.4	118.6 Å²	118.6	58%	0.576	63%	0.631	S	S	*	*			trans	-77.8	78.3	165.4	-57.8	173.7	0	0	0	106.7	F2178 S2179 E2183 F2184	F2178-I2181 HydrophobicContact CD1-CD1 3.98Å; F2178-I2181 HydrophobicContact CE1-CD1 4.49Å; S2179-I2181 PolarHBondContact O-N 3.03Å; I2181-E2183 HydrophobicContact CG2-CB 4.11Å; I2181-E2183 HydrophobicContact CG2-CG 4.39Å; I2181-E2183 PolarHBondContact O-N 3.1Å; I2181-E2183 VanDerWaalsContact O-N 3.12Å; I2181-F2184 HydrophobicContact CG2-CB 4.47Å; I2181-F2184 HydrophobicContact CG2-CD2 3.7Å; I2181-F2184 HydrophobicContact CG2-CE2 4.47Å; I2181-F2184 HydrophobicContact CG2-CG 4.49Å
2182	N	31.5	Very low	36.7	Very low	126.4 Å²	126.4	121.3 Å²	121.3	68%	0.676	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-78.4	23.5	176.2	-76.7	-4.4	0	0	0	112.5	S2180 F2184 T2185	S2180-N2182 WeakPolarHBondContact CB-OD1 3.26Å; S2180-N2182 PolarHBondContact O-N 3.14Å; N2182-F2184 VanDerWaalsContact C-N 3.31Å; N2182-F2184 PolarHBondContact O-N 3.3Å; N2182-T2185 PolarHBondContact O-OG1 3.14Å; N2182-T2185 VanDerWaalsContact O-OG1 3.11Å
2183	E	34.3	Very low	34.8	Very low	166.8 Å²	166.8	128.1 Å²	128.1	78%	0.779	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-101.4	8.1	-176.5	-85.3	-176.9	163.7	0	0	114.7	I2181	I2181-E2183 HydrophobicContact CG2-CB 4.11Å; I2181-E2183 HydrophobicContact CG2-CG 4.39Å; I2181-E2183 PolarHBondContact O-N 3.1Å; I2181-E2183 VanDerWaalsContact O-N 3.12Å
2184	F	35	Very low	33.6	Very low	183.8 Å²	183.8	131.6 Å²	131.6	81%	0.806	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-113	26	171.7	-80.5	-78.8	0	0	0	113.7	I2181 N2182 S2186	I2181-F2184 HydrophobicContact CG2-CB 4.47Å; I2181-F2184 HydrophobicContact CG2-CD2 3.7Å; I2181-F2184 HydrophobicContact CG2-CE2 4.47Å; I2181-F2184 HydrophobicContact CG2-CG 4.49Å; N2182-F2184 VanDerWaalsContact C-N 3.31Å; N2182-F2184 PolarHBondContact O-N 3.3Å; F2184-S2186 PolarHBondContact O-N 3.01Å
2185	T	30.2	Very low	32.6	Very low	121.2 Å²	121.2	132.2 Å²	132.2	74%	0.744	71%	0.709	S	S	*	*			trans	-101.4	58	175.8	50.9	0	0	0	0	112.6	N2182	N2182-T2185 PolarHBondContact O-OG1 3.14Å; N2182-T2185 VanDerWaalsContact O-OG1 3.11Å
2186	S	30.8	Very low	32.4	Very low	97.8 Å²	97.8	128.2 Å²	128.2	68%	0.684	69%	0.692	S	S	*	*	S	Bend	trans	-129.6	99.3	167.7	58	0	0	0	0	114.2	F2184	F2184-S2186 PolarHBondContact O-N 3.01Å
2187	L	34.5	Very low	32.9	Very low	157 Å²	157	129.8 Å²	129.8	82%	0.822	69%	0.694	S	S	*	*	S	Bend	trans	94	90.3	165.8	-103.9	83.5	0	0	0	115.9	E2189	L2187-E2189 PolarHBondContact O-N 2.81Å
2188	D	33.7	Very low	34.3	Very low	135 Å²	135	128.8 Å²	128.8	72%	0.722	68%	0.675	S	S	*	*			trans	138.5	72.8	148.6	-72.8	-17.8	0	0	0	115.2	L2190 H2191	D2188-L2190 PolarHBondContact O-N 3.08Å; D2188-H2191 PolarHBondContact O-N 2.87Å
2189	E	32.8	Very low	36.1	Very low	190.4 Å²	190.4	123 Å²	123	89%	0.89	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	41.9	174	-65.8	-175.3	142.2	0	0	114.1	L2187	L2187-E2189 PolarHBondContact O-N 2.81Å
2190	L	32.4	Very low	38.4	Very low	154.4 Å²	154.4	120.7 Å²	120.7	81%	0.808	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.7	-1.3	169.9	-90.9	157.4	0	0	0	117.1	D2188 H2192	D2188-L2190 PolarHBondContact O-N 3.08Å; L2190-H2192 PolarHBondContact O-N 2.61Å
2191	H	29.5	Very low	41.2	Very low	159.6 Å²	159.6	116.5 Å²	116.5	74%	0.739	60%	0.602	S	S	*	*	S	Bend	trans	-113.2	90.1	178	-73.4	-77.1	0	0	0	113.4	D2188 L2193 L2194	D2188-H2191 PolarHBondContact O-N 2.87Å; H2191-L2193 PolarHBondContact O-N 3.13Å; H2191-L2193 VanDerWaalsContact O-N 3.07Å; H2191-L2194 HydrophobicContact CB-CD1 4.08Å
2192	H	28.7	Very low	43.7	Very low	169.4 Å²	169.4	112.5 Å²	112.5	78%	0.784	58%	0.584	S	S	*	*			trans	-12.5	96.2	160.5	-70.3	-74.7	0	0	0	115	L2190 L2194	L2190-H2192 PolarHBondContact O-N 2.61Å; H2192-L2194 HydrophobicContact CB-CD2 4.16Å; H2192-L2194 HydrophobicContact CB-CG 3.93Å; H2192-L2194 WeakPolarHBondContact O-CG 3.16Å; H2192-L2194 PolarHBondContact O-N 3.17Å; H2192-L2194 VanDerWaalsContact O-N 3.12Å
2193	L	28.8	Very low	46.3	Very low	156.6 Å²	156.6	106.9 Å²	106.9	82%	0.82	55%	0.554	S	S	*	*			trans	-24.7	81	151.8	-76.3	161.8	0	0	0	111.7	I1909 H2191 P2195	I1909-L2193 HydrophobicContact CD1-CD2 4.22Å; I1909-L2193 HydrophobicContact CG1-CD2 4.48Å; H2191-L2193 PolarHBondContact O-N 3.13Å; H2191-L2193 VanDerWaalsContact O-N 3.07Å; L2193-P2195 WeakPolarHBondContact O-CD 3.43Å; L2193-P2195 VanDerWaalsContact O-N 3.13Å
2194	L	32.4	Very low	48.4	Very low	124.8 Å²	124.8	99.2 Å²	99.2	65%	0.653	52%	0.518	S	S	*	.			trans	-46.1	129	172	-75.2	150.2	0	0	0	111.2	H2191 H2192 S2196	H2191-L2194 HydrophobicContact CB-CD1 4.08Å; H2192-L2194 HydrophobicContact CB-CD2 4.16Å; H2192-L2194 HydrophobicContact CB-CG 3.93Å; H2192-L2194 WeakPolarHBondContact O-CG 3.16Å; H2192-L2194 PolarHBondContact O-N 3.17Å; H2192-L2194 VanDerWaalsContact O-N 3.12Å; L2194-S2196 VanDerWaalsContact C-N 3.26Å; L2194-S2196 WeakPolarHBondContact CB-OG 3.21Å; L2194-S2196 PolarHBondContact O-N 2.82Å
2195	P	33.3	Very low	50.1	Low	73.8 Å²	73.8	95.6 Å²	95.6	48%	0.479	50%	0.502	S	S	.	.			trans	-72.3	98.7	179.6	7.2	-2.3	0	0	0	111.3	L2193 Q2197 K2198 V2220	L2193-P2195 WeakPolarHBondContact O-CD 3.43Å; L2193-P2195 VanDerWaalsContact O-N 3.13Å; P2195-Q2197 HydrophobicContact CG-CG 4.15Å; P2195-Q2197 WeakPolarHBondContact O-CG 3.32Å; P2195-Q2197 PolarHBondContact O-N 3.22Å; P2195-Q2197 VanDerWaalsContact O-N 3.07Å; P2195-K2198 WeakPolarHBondContact O-CB 3.29Å; P2195-K2198 PolarHBondContact O-N 3.31Å; P2195-V2220 HydrophobicContact CB-CB 4.16Å; P2195-V2220 HydrophobicContact CB-CG1 3.08Å; P2195-V2220 HydrophobicContact CB-CG2 3.97Å; P2195-V2220 HydrophobicContact CG-CG1 3.67Å; P2195-V2220 HydrophobicContact CG-CG2 4.38Å
2196	S	38.7	Very low	51.6	Low	52 Å²	52	93.7 Å²	93.7	36%	0.364	49%	0.492	S	S	.	.			trans	-61.2	66.5	-176.4	55.6	0	0	0	0	112.9	L2194 K2198 G2216 I2763	L2194-S2196 VanDerWaalsContact C-N 3.26Å; L2194-S2196 WeakPolarHBondContact CB-OG 3.21Å; L2194-S2196 PolarHBondContact O-N 2.82Å; S2196-K2198 VanDerWaalsContact C-N 3.31Å; S2196-K2198 PolarHBondContact O-N 3.09Å; S2196-G2216 PolarHBondContact OG-N 3.47Å; S2196-I2763 VanDerWaalsContact CB-CG2 3.4Å
2197	Q	50	Low	53.3	Low	105.8 Å²	105.8	91.6 Å²	91.6	49%	0.494	48%	0.475	S	S	.	.	S	Bend	trans	-81.3	-2.3	-177.1	-62.6	-169.9	-2.6	0	0	114.5	C2137 R2154 P2195 G2199	C2137-Q2197 PolarHBondContact SG-O 3.16Å; R2154-Q2197 HydrophobicContact CG-CB 4.34Å; R2154-Q2197 HydrophobicContact CG-CG 4.47Å; R2154-Q2197 VanDerWaalsContact CZ-OE1 3.25Å; P2195-Q2197 HydrophobicContact CG-CG 4.15Å; P2195-Q2197 WeakPolarHBondContact O-CG 3.32Å; P2195-Q2197 PolarHBondContact O-N 3.22Å; P2195-Q2197 VanDerWaalsContact O-N 3.07Å; Q2197-G2199 PolarHBondContact O-N 2.84Å; Q2197-G2199 VanDerWaalsContact O-N 3.13Å
2198	K	59	Low	55	Low	97.4 Å²	97.4	84.1 Å²	84.1	42%	0.423	44%	0.436	S	S	.	.			trans	-100.5	85.8	179.2	-110	-174.1	176.9	-174.8	0	110.7	N2080 C2137 P2195 S2196	N2080-K2198 PolarHBondContact O-NZ 3.22Å; N2080-K2198 PolarHBondContact OD1-NZ 3.03Å; C2137-K2198 HydrophobicContact CB-CG 4.3Å; C2137-K2198 WeakPolarHBondContact O-CE 3.06Å; P2195-K2198 WeakPolarHBondContact O-CB 3.29Å; P2195-K2198 PolarHBondContact O-N 3.31Å; S2196-K2198 VanDerWaalsContact C-N 3.31Å; S2196-K2198 PolarHBondContact O-N 3.09Å
2199	G	70.1	Confident	56.9	Low	3.6 Å²	3.6	81.9 Å²	81.9	4%	0.037	42%	0.418	C	S	.	.			trans	-73.8	149.8	167.1	0	0	0	0	0	112.2	C2137 L2152 Q2197 T2214	C2137-G2199 WeakPolarHBondContact CB-O 3.37Å; L2152-G2199 VanDerWaalsContact CD2-C 3.46Å; Q2197-G2199 PolarHBondContact O-N 2.84Å; Q2197-G2199 VanDerWaalsContact O-N 3.13Å; G2199-T2214 CarbonylContact C-O 3.56Å; G2199-T2214 WeakPolarHBondContact CA-O 3.29Å
2200	V	78.6	Confident	59	Low	50.6 Å²	50.6	73.9 Å²	73.9	31%	0.307	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.6	179.9	-175.2	0	0	0	0	110	Q2213 T2214 L2767	V2200-Q2213 WeakPolarHBondContact O-CA 3.38Å; V2200-T2214 WeakPolarHBondContact CB-OG1 3.32Å; V2200-T2214 PolarHBondContact N-O 3.16Å; V2200-T2214 VanDerWaalsContact N-O 3.13Å; V2200-T2214 PolarHBondContact N-OG1 3.17Å; V2200-T2214 PolarHBondContact O-N 3.09Å; V2200-T2214 PolarHBondContact O-OG1 3.16Å; V2200-L2767 HydrophobicContact CB-CD1 4.33Å; V2200-L2767 HydrophobicContact CB-CG 4.49Å; V2200-L2767 HydrophobicContact CG1-CB 4.19Å; V2200-L2767 HydrophobicContact CG1-CD1 4.46Å
2201	L	86.6	Confident	61.4	Low	7.8 Å²	7.8	66.6 Å²	66.6	4%	0.041	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	139.9	172.9	-58.7	163.3	0	0	0	110.9	S2138 A2140 A2150 I2151 L2152 L2211 I2212 Q2213	S2138-L2201 WeakPolarHBondContact O-CD2 3.42Å; S2138-L2201 PolarHBondContact OG-N 3.01Å; S2138-L2201 VanDerWaalsContact OG-N 3.15Å; A2140-L2201 HydrophobicContact CB-CB 4.3Å; A2140-L2201 HydrophobicContact CB-CD1 3.32Å; A2140-L2201 HydrophobicContact CB-CG 4.48Å; A2150-L2201 HydrophobicContact CB-CD1 3.84Å; I2151-L2201 VanDerWaalsContact C-CD1 3.43Å; I2151-L2201 VanDerWaalsContact C-CD2 3.49Å; L2152-L2201 HydrophobicContact CB-CB 4.41Å; L2152-L2201 HydrophobicContact CB-CD1 3.46Å; L2152-L2201 HydrophobicContact CB-CD2 3.98Å; L2152-L2201 HydrophobicContact CB-CG 3.76Å; L2152-L2201 HydrophobicContact CD2-CB 4.48Å; L2152-L2201 HydrophobicContact CD2-CD2 4.31Å; L2152-L2201 HydrophobicContact CD2-CG 4.04Å; L2152-L2201 HydrophobicContact CG-CG 4.41Å; L2201-L2211 HydrophobicContact CB-CD1 4.36Å; L2201-L2211 HydrophobicContact CD1-CD1 4.03Å; L2201-L2211 HydrophobicContact CD2-CD1 4.19Å; L2201-L2211 HydrophobicContact CD2-CD2 4.23Å; L2201-L2211 HydrophobicContact CD2-CG 4.29Å; L2201-I2212 CarbonylContact C-O 3.55Å; L2201-I2212 VanDerWaalsContact CA-O 3.3Å; L2201-I2212 WeakPolarHBondContact CA-O 3.28Å; L2201-Q2213 HydrophobicContact CD2-CB 3.67Å; L2201-Q2213 HydrophobicContact CD2-CG 3.92Å
2202	C	86.5	Confident	64	Low	28.2 Å²	28.2	59.6 Å²	59.6	19%	0.191	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	146.4	168.1	110.6	0	0	0	0	111.5	I2212 L2767	C2202-I2212 PolarHBondContact N-O 3.04Å; C2202-I2212 WeakPolarHBondContact O-CB 3.34Å; C2202-I2212 PolarHBondContact O-N 3Å; C2202-L2767 HydrophobicContact CB-CB 3.77Å; C2202-L2767 HydrophobicContact CB-CD1 4.18Å
2203	F	85.6	Confident	66.5	Low	9.2 Å²	9.2	51.7 Å²	51.7	4%	0.04	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	145	169.3	-78.2	-83.2	0	0	0	110.7	A2140 Y2141 L2148 A2150 K2205 Y2210 L2211 A2228	A2140-F2203 HydrophobicContact CB-CD2 3.88Å; A2140-F2203 HydrophobicContact CB-CE2 4.17Å; A2140-F2203 VanDerWaalsContact O-CE2 3.31Å; A2140-F2203 WeakPolarHBondContact O-CE2 3.26Å; Y2141-F2203 WeakPolarHBondContact O-CD2 3.44Å; L2148-F2203 HydrophobicContact CB-CZ 4.33Å; A2150-F2203 HydrophobicContact CB-CE2 3.65Å; A2150-F2203 HydrophobicContact CB-CZ 3.73Å; F2203-K2205 PolarHBondContact O-N 3.08Å; F2203-Y2210 CarbonylContact C-O 3.54Å; F2203-Y2210 VanDerWaalsContact CA-O 3.29Å; F2203-Y2210 WeakPolarHBondContact CA-O 3.34Å; F2203-L2211 HydrophobicContact CD1-CB 4.18Å; F2203-L2211 HydrophobicContact CD1-CD1 4.24Å; F2203-L2211 HydrophobicContact CD2-CD1 4.22Å; F2203-L2211 HydrophobicContact CE1-CB 4.05Å; F2203-L2211 HydrophobicContact CE1-CD1 4.07Å; F2203-L2211 HydrophobicContact CE1-CD2 4.47Å; F2203-L2211 HydrophobicContact CE1-CG 4.43Å; F2203-L2211 HydrophobicContact CE2-CD1 4.03Å; F2203-L2211 HydrophobicContact CG-CD1 4.33Å; F2203-L2211 HydrophobicContact CZ-CB 4.48Å; F2203-L2211 HydrophobicContact CZ-CD1 3.97Å; F2203-L2211 HydrophobicContact CZ-CD2 4.41Å; F2203-A2228 HydrophobicContact CD1-CB 4.06Å; F2203-A2228 HydrophobicContact CE1-CB 3.64Å
2204	S	78.3	Confident	68.8	Low	4.8 Å²	4.8	44.8 Å²	44.8	3%	0.034	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-64.1	129.8	171.8	64.4	0	0	0	0	111.1	P2143 G2208 R2209 Y2210	P2143-S2204 WeakPolarHBondContact CG-O 3.47Å; S2204-G2208 VanDerWaalsContact O-CA 3.25Å; S2204-G2208 WeakPolarHBondContact O-CA 3.35Å; S2204-G2208 PolarHBondContact O-N 3.13Å; S2204-R2209 PolarHBondContact OG-N 3.2Å; S2204-R2209 VanDerWaalsContact OG-N 3.13Å; S2204-Y2210 PolarHBondContact N-O 3.12Å; S2204-Y2210 PolarHBondContact OG-N 3.08Å; S2204-Y2210 PolarHBondContact OG-O 3.15Å
2205	K	71.6	Confident	70.2	Confident	107.2 Å²	107.2	39.6 Å²	39.6	47%	0.466	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	144.2	176.8	-64.7	176	-173.1	165	0	110.2	F2203 C2769 K2771 T2780	F2203-K2205 PolarHBondContact O-N 3.08Å; K2205-C2769 VanDerWaalsContact CD-O 3.29Å; K2205-C2769 WeakPolarHBondContact CD-O 3.49Å; K2205-K2771 PolarHBondContact O-N 3.14Å; K2205-T2780 VanDerWaalsContact O-CG2 3.23Å; K2205-T2780 WeakPolarHBondContact O-CG2 3.4Å
2206	P	61.9	Low	71.4	Confident	81.4 Å²	81.4	36.5 Å²	36.5	53%	0.529	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	cis	-90.8	-15.8	3.4	34.8	-35	0	0	0	114.5	P2143 G2208 K2771	P2143-P2206 VanDerWaalsContact CB-O 3.32Å; P2143-P2206 WeakPolarHBondContact CB-O 3.36Å; P2143-P2206 VanDerWaalsContact CG-O 3.27Å; P2143-P2206 WeakPolarHBondContact CG-O 3.29Å; P2206-G2208 PolarHBondContact O-N 2.86Å; P2206-K2771 HydrophobicContact CG-CD 4.46Å
2207	T	65.4	Low	72.1	Confident	54.2 Å²	54.2	35.9 Å²	35.9	33%	0.333	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-22.2	-166.4	56	0	0	0	0	114.7	N2144 R2209 D2778	N2144-T2207 PolarHBondContact ND2-O 2.94Å; N2144-T2207 PolarHBondContact OD1-O 2.99Å; T2207-R2209 PolarHBondContact O-N 3.27Å; T2207-R2209 VanDerWaalsContact O-N 3.15Å; T2207-R2209 WeakPolarHBondContact OG1-CB 3.49Å; T2207-R2209 PolarHBondContact OG1-N 3.14Å; T2207-D2778 WeakPolarHBondContact CG2-OD1 3.39Å
2208	G	71.8	Confident	72.2	Confident	0.8 Å²	0.8	35.5 Å²	35.5	1%	0.008	21%	0.206	C	C	.	.			trans	72	14.4	-174	0	0	0	0	0	113.7	P2143 S2204 P2206 Y2210 A2228	P2143-G2208 VanDerWaalsContact CD-CA 3.47Å; P2143-G2208 VanDerWaalsContact CG-N 3.28Å; S2204-G2208 VanDerWaalsContact O-CA 3.25Å; S2204-G2208 WeakPolarHBondContact O-CA 3.35Å; S2204-G2208 PolarHBondContact O-N 3.13Å; P2206-G2208 PolarHBondContact O-N 2.86Å; G2208-Y2210 VanDerWaalsContact C-N 3.3Å; G2208-Y2210 PolarHBondContact O-N 2.99Å; G2208-A2228 VanDerWaalsContact O-CB 3.28Å; G2208-A2228 WeakPolarHBondContact O-CB 3.32Å
2209	R	71.9	Confident	71.9	Confident	88 Å²	88	31.6 Å²	31.6	33%	0.332	19%	0.191	S	C	.	.			trans	-60.6	-36.6	-174.9	179.5	174.3	175.3	168.1	-0.5	113.8	S2204 T2207 N2227 A2228 H2229 D2778	S2204-R2209 PolarHBondContact OG-N 3.2Å; S2204-R2209 VanDerWaalsContact OG-N 3.13Å; T2207-R2209 PolarHBondContact O-N 3.27Å; T2207-R2209 VanDerWaalsContact O-N 3.15Å; T2207-R2209 WeakPolarHBondContact OG1-CB 3.49Å; T2207-R2209 PolarHBondContact OG1-N 3.14Å; R2209-N2227 PolarHBondContact O-OD1 3.29Å; R2209-N2227 VanDerWaalsContact O-OD1 3.1Å; R2209-A2228 WeakPolarHBondContact O-CB 3.33Å; R2209-A2228 PolarHBondContact O-N 2.92Å; R2209-H2229 WeakPolarHBondContact CA-CE1 3.46Å; R2209-H2229 WeakPolarHBondContact CA-ND1 3.3Å; R2209-D2778 WeakPolarHBondContact CD-OD2 3.38Å; R2209-D2778 IonicContact CZ-OD2 3.6Å; R2209-D2778 IonicContact NE-OD2 3.07Å; R2209-D2778 IonicContact NH1-OD2 3.27Å; R2209-D2778 PolarHBondContact NH1-OD2 3.05Å
2210	Y	78	Confident	71.4	Confident	22.8 Å²	22.8	35.2 Å²	35.2	9%	0.089	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	139.9	-179.2	-58	-71.8	0	0	0	110.7	F2203 S2204 G2208 V2225 W2226 H2753 L2804 P2805	F2203-Y2210 CarbonylContact C-O 3.54Å; F2203-Y2210 VanDerWaalsContact CA-O 3.29Å; F2203-Y2210 WeakPolarHBondContact CA-O 3.34Å; S2204-Y2210 PolarHBondContact N-O 3.12Å; S2204-Y2210 PolarHBondContact OG-N 3.08Å; S2204-Y2210 PolarHBondContact OG-O 3.15Å; G2208-Y2210 VanDerWaalsContact C-N 3.3Å; G2208-Y2210 PolarHBondContact O-N 2.99Å; Y2210-V2225 HydrophobicContact CD1-CG1 3.92Å; Y2210-V2225 HydrophobicContact CG-CG1 4.1Å; Y2210-W2226 CarbonylContact C-O 3.54Å; Y2210-W2226 VanDerWaalsContact CA-O 3.26Å; Y2210-W2226 WeakPolarHBondContact CA-O 3.36Å; Y2210-H2753 HydrophobicContact CD1-CB 4.45Å; Y2210-H2753 AromaticContact CD1-CD2 3.73Å; Y2210-H2753 HydrophobicContact CE1-CB 4.28Å; Y2210-H2753 AromaticContact CE1-CD2 3.16Å; Y2210-H2753 WeakPolarHBondContact CE1-CD2 3.44Å; Y2210-H2753 AromaticContact CE1-CG 3.69Å; Y2210-H2753 AromaticContact CE1-NE2 3.52Å; Y2210-H2753 WeakPolarHBondContact CE1-NE2 3.39Å; Y2210-H2753 AromaticContact CZ-CD2 3.73Å; Y2210-H2753 AromaticContact CZ-NE2 3.62Å; Y2210-H2753 PolarHBondContact OH-NE2 3.1Å; Y2210-L2804 HydrophobicContact CD2-CB 4.35Å; Y2210-L2804 HydrophobicContact CE2-CB 4.3Å; Y2210-P2805 HydrophobicContact CE2-CB 4.49Å; Y2210-P2805 HydrophobicContact CE2-CG 4.11Å; Y2210-P2805 WeakPolarHBondContact OH-CB 3.32Å; Y2210-P2805 VanDerWaalsContact OH-CG 3.32Å; Y2210-P2805 WeakPolarHBondContact OH-CG 3.45Å
2211	L	83.3	Confident	70.5	Confident	0.8 Å²	0.8	33.9 Å²	33.9	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121.9	166.9	174.5	65.3	0	0	0	107.5	A2150 I2160 L2172 L2201 F2203 W2226 A2228	A2150-L2211 HydrophobicContact CB-CD1 3.65Å; A2150-L2211 HydrophobicContact CB-CD2 3.85Å; A2150-L2211 HydrophobicContact CB-CG 4.41Å; I2160-L2211 HydrophobicContact CD1-CD2 4.34Å; I2160-L2211 HydrophobicContact CG1-CD2 4.5Å; L2172-L2211 HydrophobicContact CD1-CD2 3.91Å; L2201-L2211 HydrophobicContact CB-CD1 4.36Å; L2201-L2211 HydrophobicContact CD1-CD1 4.03Å; L2201-L2211 HydrophobicContact CD2-CD1 4.19Å; L2201-L2211 HydrophobicContact CD2-CD2 4.23Å; L2201-L2211 HydrophobicContact CD2-CG 4.29Å; F2203-L2211 HydrophobicContact CD1-CB 4.18Å; F2203-L2211 HydrophobicContact CD1-CD1 4.24Å; F2203-L2211 HydrophobicContact CD2-CD1 4.22Å; F2203-L2211 HydrophobicContact CE1-CB 4.05Å; F2203-L2211 HydrophobicContact CE1-CD1 4.07Å; F2203-L2211 HydrophobicContact CE1-CD2 4.47Å; F2203-L2211 HydrophobicContact CE1-CG 4.43Å; F2203-L2211 HydrophobicContact CE2-CD1 4.03Å; F2203-L2211 HydrophobicContact CG-CD1 4.33Å; F2203-L2211 HydrophobicContact CZ-CB 4.48Å; F2203-L2211 HydrophobicContact CZ-CD1 3.97Å; F2203-L2211 HydrophobicContact CZ-CD2 4.41Å; L2211-W2226 HydrophobicContact CB-CB 4.34Å; L2211-W2226 PolarHBondContact N-O 3.24Å; L2211-W2226 PolarHBondContact O-N 3.11Å; L2211-A2228 HydrophobicContact CB-CB 4.31Å
2212	I	83.3	Confident	69.4	Low	11.6 Å²	11.6	38.4 Å²	38.4	6%	0.059	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.9	-175.4	-56.6	156.3	0	0	0	107.9	L2201 C2202 I2223 N2224 V2225 L2767 C2769 L2782 L2804	L2201-I2212 CarbonylContact C-O 3.55Å; L2201-I2212 VanDerWaalsContact CA-O 3.3Å; L2201-I2212 WeakPolarHBondContact CA-O 3.28Å; C2202-I2212 PolarHBondContact N-O 3.04Å; C2202-I2212 WeakPolarHBondContact O-CB 3.34Å; C2202-I2212 PolarHBondContact O-N 3Å; I2212-I2223 HydrophobicContact CG2-CG2 3.53Å; I2212-I2223 VanDerWaalsContact CG2-CG2 3.46Å; I2212-N2224 CarbonylContact C-O 3.38Å; I2212-N2224 WeakPolarHBondContact CA-O 3.43Å; I2212-V2225 HydrophobicContact CG1-CG1 4.3Å; I2212-V2225 HydrophobicContact CG1-CG2 4.37Å; I2212-L2767 HydrophobicContact CG2-CD1 4Å; I2212-L2767 HydrophobicContact CG2-CD2 4.26Å; I2212-C2769 HydrophobicContact CD1-CB 4.49Å; I2212-C2769 WeakPolarHBondContact CD1-SG 3.31Å; I2212-L2782 HydrophobicContact CD1-CD1 4.11Å; I2212-L2782 HydrophobicContact CD1-CD2 4.24Å; I2212-L2782 HydrophobicContact CD1-CG 4.45Å; I2212-L2782 HydrophobicContact CG1-CD2 4.32Å; I2212-L2782 HydrophobicContact CG2-CD1 4.2Å; I2212-L2782 HydrophobicContact CG2-CD2 3.88Å; I2212-L2804 HydrophobicContact CD1-CD1 4.07Å; I2212-L2804 HydrophobicContact CG1-CD1 4.34Å
2213	Q	81.7	Confident	68.8	Low	5.2 Å²	5.2	38.2 Å²	38.2	2%	0.024	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.9	-177.6	175.2	178.5	-13.5	0	0	110.3	L2152 G2156 S2158 V2200 L2201 G2215 I2223 N2224 W2226	L2152-Q2213 HydrophobicContact CD1-CG 4.3Å; L2152-Q2213 VanDerWaalsContact CD1-NE2 3.32Å; L2152-Q2213 HydrophobicContact CD2-CG 4.2Å; G2156-Q2213 PolarHBondContact O-NE2 3.31Å; S2158-Q2213 PolarHBondContact OG-OE1 3.16Å; V2200-Q2213 WeakPolarHBondContact O-CA 3.38Å; L2201-Q2213 HydrophobicContact CD2-CB 3.67Å; L2201-Q2213 HydrophobicContact CD2-CG 3.92Å; Q2213-G2215 WeakPolarHBondContact CG-O 3.19Å; Q2213-G2215 PolarHBondContact NE2-O 2.85Å; Q2213-I2223 CarbonylContact O-C 3.54Å; Q2213-I2223 WeakPolarHBondContact O-CA 3.36Å; Q2213-I2223 WeakPolarHBondContact O-CG2 3.2Å; Q2213-N2224 HydrophobicContact CB-CB 4.42Å; Q2213-N2224 PolarHBondContact N-O 3.09Å; Q2213-N2224 PolarHBondContact O-N 3.22Å; Q2213-W2226 VanDerWaalsContact OE1-NE1 3.12Å
2214	T	76	Confident	68.2	Low	11.6 Å²	11.6	38.2 Å²	38.2	7%	0.071	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	135	167.1	49.4	0	0	0	0	110.3	G2199 V2200 I2223 P2764 L2767	G2199-T2214 CarbonylContact C-O 3.56Å; G2199-T2214 WeakPolarHBondContact CA-O 3.29Å; V2200-T2214 WeakPolarHBondContact CB-OG1 3.32Å; V2200-T2214 PolarHBondContact N-O 3.16Å; V2200-T2214 VanDerWaalsContact N-O 3.13Å; V2200-T2214 PolarHBondContact N-OG1 3.17Å; V2200-T2214 PolarHBondContact O-N 3.09Å; V2200-T2214 PolarHBondContact O-OG1 3.16Å; T2214-I2223 HydrophobicContact CG2-CB 4.35Å; T2214-I2223 HydrophobicContact CG2-CD1 4.12Å; T2214-I2223 HydrophobicContact CG2-CG1 3.89Å; T2214-I2223 HydrophobicContact CG2-CG2 4.14Å; T2214-P2764 HydrophobicContact CG2-CB 3.62Å; T2214-P2764 HydrophobicContact CG2-CG 3.99Å; T2214-L2767 HydrophobicContact CG2-CD1 3.69Å; T2214-L2767 HydrophobicContact CG2-CD2 3.63Å; T2214-L2767 HydrophobicContact CG2-CG 3.64Å; T2214-L2767 VanDerWaalsContact OG1-CD1 3.3Å; T2214-L2767 WeakPolarHBondContact OG1-CD1 3.35Å
2215	G	63.6	Low	68.1	Low	14.2 Å²	14.2	38.9 Å²	38.9	15%	0.146	23%	0.226	C	C	.	.			trans	68.3	168.8	175.3	0	0	0	0	0	115.2	Q2213 S2219	Q2213-G2215 WeakPolarHBondContact CG-O 3.19Å; Q2213-G2215 PolarHBondContact NE2-O 2.85Å; G2215-S2219 WeakPolarHBondContact CA-OG 3.42Å; G2215-S2219 PolarHBondContact O-OG 3.38Å; G2215-S2219 VanDerWaalsContact O-OG 3.12Å
2216	G	57.7	Low	68.3	Low	10.2 Å²	10.2	34.8 Å²	34.8	11%	0.105	21%	0.208	C	C	.	.			trans	98.7	133.1	-171.1	0	0	0	0	0	112.5	G2156 S2196 S2218 S2219	G2156-G2216 VanDerWaalsContact CA-C 3.47Å; S2196-G2216 PolarHBondContact OG-N 3.47Å; G2216-S2218 PolarHBondContact O-N 2.96Å; G2216-S2219 PolarHBondContact N-OG 3.38Å; G2216-S2219 PolarHBondContact O-N 3.09Å; G2216-S2219 VanDerWaalsContact O-N 3.17Å; G2216-S2219 PolarHBondContact O-OG 3.2Å
2217	G	54	Low	68.6	Low	37.6 Å²	37.6	32.8 Å²	32.8	39%	0.388	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	74	-157	-175.2	0	0	0	0	0	113.7	E2155 S2219 V2220	E2155-G2217 PolarHBondContact O-N 2.86Å; E2155-G2217 VanDerWaalsContact O-N 3.08Å; G2217-S2219 VanDerWaalsContact C-N 3.28Å; G2217-S2219 PolarHBondContact O-N 2.98Å; G2217-S2219 VanDerWaalsContact O-N 3.16Å; G2217-V2220 WeakPolarHBondContact O-CG2 3.17Å
2218	S	52.4	Low	68.9	Low	99 Å²	99	30.4 Å²	30.4	69%	0.692	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-74.4	-6.8	-177.6	97.5	0	0	0	0	114.7	E2174 G2216 V2220	E2174-S2218 PolarHBondContact OE2-OG 3.48Å; G2216-S2218 PolarHBondContact O-N 2.96Å; S2218-V2220 VanDerWaalsContact C-N 3.3Å; S2218-V2220 PolarHBondContact O-N 3.09Å; S2218-V2220 VanDerWaalsContact O-N 3.16Å
2219	S	51.8	Low	68.5	Low	15.4 Å²	15.4	34.3 Å²	34.3	11%	0.108	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-102.9	55.2	-170	50.7	0	0	0	0	113.8	E2174 G2215 G2216 G2217 G2221 R2222	E2174-S2219 WeakPolarHBondContact OE1-CB 3.42Å; E2174-S2219 WeakPolarHBondContact OE2-CB 3.21Å; E2174-S2219 PolarHBondContact OE2-OG 3.01Å; E2174-S2219 VanDerWaalsContact OE2-OG 3.07Å; G2215-S2219 WeakPolarHBondContact CA-OG 3.42Å; G2215-S2219 PolarHBondContact O-OG 3.38Å; G2215-S2219 VanDerWaalsContact O-OG 3.12Å; G2216-S2219 PolarHBondContact N-OG 3.38Å; G2216-S2219 PolarHBondContact O-N 3.09Å; G2216-S2219 VanDerWaalsContact O-N 3.17Å; G2216-S2219 PolarHBondContact O-OG 3.2Å; G2217-S2219 VanDerWaalsContact C-N 3.28Å; G2217-S2219 PolarHBondContact O-N 2.98Å; G2217-S2219 VanDerWaalsContact O-N 3.16Å; S2219-G2221 PolarHBondContact O-N 3.14Å; S2219-R2222 PolarHBondContact O-N 3.24Å; S2219-R2222 VanDerWaalsContact OG-CD 3.3Å; S2219-R2222 WeakPolarHBondContact OG-CD 3.18Å; S2219-R2222 PolarHBondContact OG-NE 3.04Å
2220	V	58.6	Low	68	Low	79 Å²	79	31.3 Å²	31.3	48%	0.479	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	132.2	177	179.8	0	0	0	0	110.7	P2195 G2217 S2218 I2763	P2195-V2220 HydrophobicContact CB-CB 4.16Å; P2195-V2220 HydrophobicContact CB-CG1 3.08Å; P2195-V2220 HydrophobicContact CB-CG2 3.97Å; P2195-V2220 HydrophobicContact CG-CG1 3.67Å; P2195-V2220 HydrophobicContact CG-CG2 4.38Å; G2217-V2220 WeakPolarHBondContact O-CG2 3.17Å; S2218-V2220 VanDerWaalsContact C-N 3.3Å; S2218-V2220 PolarHBondContact O-N 3.09Å; S2218-V2220 VanDerWaalsContact O-N 3.16Å; V2220-I2763 HydrophobicContact CG1-CG1 4.26Å
2221	G	59.9	Low	67	Low	22.8 Å²	22.8	30.9 Å²	30.9	24%	0.235	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	1.5	177.3	0	0	0	0	0	116.1	S2219 H2759 L2762	S2219-G2221 PolarHBondContact O-N 3.14Å; G2221-H2759 VanDerWaalsContact CA-O 3.23Å; G2221-H2759 WeakPolarHBondContact CA-O 3.21Å; G2221-L2762 WeakPolarHBondContact CA-O 3.17Å
2222	R	64.6	Low	65.8	Low	102.8 Å²	102.8	31.6 Å²	31.6	39%	0.388	20%	0.195	S	C	.	.			trans	-100.8	150.1	176.4	-64.6	-175.9	-179.4	179.2	1.4	112.2	S2219 T2755	S2219-R2222 PolarHBondContact O-N 3.24Å; S2219-R2222 VanDerWaalsContact OG-CD 3.3Å; S2219-R2222 WeakPolarHBondContact OG-CD 3.18Å; S2219-R2222 PolarHBondContact OG-NE 3.04Å; R2222-T2755 HydrophobicContact CB-CG2 4.01Å; R2222-T2755 HydrophobicContact CG-CG2 4.04Å
2223	I	73.3	Confident	64.7	Low	23.8 Å²	23.8	33.8 Å²	33.8	12%	0.122	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.8	170.2	-49.5	-176.8	0	0	0	108	I2212 Q2213 T2214 V2225 T2755 L2756 L2767 L2782 S2784 W2802	I2212-I2223 HydrophobicContact CG2-CG2 3.53Å; I2212-I2223 VanDerWaalsContact CG2-CG2 3.46Å; Q2213-I2223 CarbonylContact O-C 3.54Å; Q2213-I2223 WeakPolarHBondContact O-CA 3.36Å; Q2213-I2223 WeakPolarHBondContact O-CG2 3.2Å; T2214-I2223 HydrophobicContact CG2-CB 4.35Å; T2214-I2223 HydrophobicContact CG2-CD1 4.12Å; T2214-I2223 HydrophobicContact CG2-CG1 3.89Å; T2214-I2223 HydrophobicContact CG2-CG2 4.14Å; I2223-V2225 HydrophobicContact CG2-CG2 4.45Å; I2223-T2755 CarbonylContact O-C 3.55Å; I2223-T2755 WeakPolarHBondContact O-CA 3.34Å; I2223-L2756 HydrophobicContact CB-CB 4.05Å; I2223-L2756 HydrophobicContact CB-CD1 4.08Å; I2223-L2756 HydrophobicContact CB-CG 4.16Å; I2223-L2756 HydrophobicContact CD1-CB 4.38Å; I2223-L2756 HydrophobicContact CD1-CD1 4.24Å; I2223-L2756 HydrophobicContact CG1-CB 4.36Å; I2223-L2756 HydrophobicContact CG2-CD1 4.05Å; I2223-L2756 HydrophobicContact CG2-CG 4.5Å; I2223-L2756 PolarHBondContact N-O 2.81Å; I2223-L2756 VanDerWaalsContact N-O 3.14Å; I2223-L2756 PolarHBondContact O-N 3.17Å; I2223-L2767 HydrophobicContact CD1-CD2 4.3Å; I2223-L2767 HydrophobicContact CG2-CD2 4.21Å; I2223-L2782 HydrophobicContact CG2-CD2 4.47Å; I2223-S2784 VanDerWaalsContact CD1-OG 3.28Å; I2223-S2784 WeakPolarHBondContact CD1-OG 3.37Å; I2223-W2802 HydrophobicContact CD1-CZ2 4.38Å
2224	N	73.9	Confident	63.7	Low	8.8 Å²	8.8	37.9 Å²	37.9	5%	0.047	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	129.7	-179.8	-68.8	-28.8	0	0	0	110.2	E2174 I2212 Q2213 W2226 Y2752 T2755	E2174-N2224 VanDerWaalsContact CD-ND2 3.31Å; E2174-N2224 PolarHBondContact OE1-ND2 3.21Å; E2174-N2224 PolarHBondContact OE1-OD1 3.02Å; E2174-N2224 PolarHBondContact OE2-ND2 2.8Å; I2212-N2224 CarbonylContact C-O 3.38Å; I2212-N2224 WeakPolarHBondContact CA-O 3.43Å; Q2213-N2224 HydrophobicContact CB-CB 4.42Å; Q2213-N2224 PolarHBondContact N-O 3.09Å; Q2213-N2224 PolarHBondContact O-N 3.22Å; N2224-W2226 HydrophobicContact CB-CZ2 4.35Å; N2224-Y2752 HydrophobicContact CB-CE2 3.95Å; N2224-Y2752 WeakPolarHBondContact OD1-CE2 3.5Å; N2224-Y2752 PolarHBondContact OD1-OH 2.73Å; N2224-T2755 PolarHBondContact OD1-OG1 2.78Å
2225	V	76.4	Confident	62.8	Low	20.2 Å²	20.2	39.2 Å²	39.2	12%	0.122	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	115.3	176.1	-173.9	0	0	0	0	108.2	Y2210 I2212 I2223 H2753 A2754 L2756 L2804	Y2210-V2225 HydrophobicContact CD1-CG1 3.92Å; Y2210-V2225 HydrophobicContact CG-CG1 4.1Å; I2212-V2225 HydrophobicContact CG1-CG1 4.3Å; I2212-V2225 HydrophobicContact CG1-CG2 4.37Å; I2223-V2225 HydrophobicContact CG2-CG2 4.45Å; V2225-H2753 HydrophobicContact CB-CB 4.44Å; V2225-H2753 HydrophobicContact CG1-CB 4.22Å; V2225-H2753 WeakPolarHBondContact O-CA 3.41Å; V2225-H2753 VanDerWaalsContact O-CB 3.3Å; V2225-H2753 WeakPolarHBondContact O-CB 3.3Å; V2225-H2753 PolarHBondContact O-N 3.13Å; V2225-A2754 WeakPolarHBondContact CA-O 3.2Å; V2225-A2754 HydrophobicContact CB-CB 4.44Å; V2225-A2754 WeakPolarHBondContact CB-O 3.31Å; V2225-A2754 PolarHBondContact N-O 3.13Å; V2225-A2754 PolarHBondContact O-N 2.98Å; V2225-L2756 HydrophobicContact CG2-CD1 4.05Å; V2225-L2756 HydrophobicContact CG2-CD2 4.06Å; V2225-L2756 HydrophobicContact CG2-CG 4.06Å; V2225-L2804 HydrophobicContact CG1-CD1 4.04Å; V2225-L2804 HydrophobicContact CG1-CD2 4.38Å; V2225-L2804 HydrophobicContact CG2-CD1 4.29Å; V2225-L2804 HydrophobicContact CG2-CD2 4.38Å
2226	W	74.3	Confident	62.8	Low	21 Å²	21	43.1 Å²	43.1	8%	0.08	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	146.6	177.9	-51.3	93.7	0	0	0	109.8	L2172 E2174 Y2210 L2211 Q2213 N2224 A2228 G2751 Y2752	L2172-W2226 HydrophobicContact CB-CD2 4.32Å; L2172-W2226 HydrophobicContact CB-CE3 4.25Å; L2172-W2226 HydrophobicContact CB-CH2 4.08Å; L2172-W2226 HydrophobicContact CB-CZ2 4.07Å; L2172-W2226 HydrophobicContact CB-CZ3 4.04Å; L2172-W2226 HydrophobicContact CD1-CB 4.12Å; L2172-W2226 HydrophobicContact CD1-CD2 3.86Å; L2172-W2226 HydrophobicContact CD1-CE3 4.16Å; L2172-W2226 HydrophobicContact CD1-CG 3.77Å; L2172-W2226 HydrophobicContact CD2-CD2 4.41Å; L2172-W2226 HydrophobicContact CD2-CE3 4.17Å; E2174-W2226 HydrophobicContact CG-CH2 4.47Å; E2174-W2226 HydrophobicContact CG-CZ2 4.31Å; Y2210-W2226 CarbonylContact C-O 3.54Å; Y2210-W2226 VanDerWaalsContact CA-O 3.26Å; Y2210-W2226 WeakPolarHBondContact CA-O 3.36Å; L2211-W2226 HydrophobicContact CB-CB 4.34Å; L2211-W2226 PolarHBondContact N-O 3.24Å; L2211-W2226 PolarHBondContact O-N 3.11Å; Q2213-W2226 VanDerWaalsContact OE1-NE1 3.12Å; N2224-W2226 HydrophobicContact CB-CZ2 4.35Å; W2226-A2228 PolarHBondContact O-N 3.1Å; W2226-G2751 CarbonylContact C-O 3.51Å; W2226-Y2752 HydrophobicContact CD2-CD2 4.18Å; W2226-Y2752 AromaticContact CE3-CD2 3.86Å; W2226-Y2752 HydrophobicContact CE3-CD2 4.04Å; W2226-Y2752 AromaticContact CH2-CD2 3.87Å; W2226-Y2752 HydrophobicContact CH2-CD2 4.07Å; W2226-Y2752 HydrophobicContact CH2-CE2 4.42Å; W2226-Y2752 HydrophobicContact CZ2-CD2 4.18Å; W2226-Y2752 HydrophobicContact CZ2-CE2 4.4Å; W2226-Y2752 AromaticContact CZ3-CD2 3.7Å; W2226-Y2752 HydrophobicContact CZ3-CD2 3.87Å; W2226-Y2752 HydrophobicContact CZ3-CG 4.47Å
2227	N	69.8	Low	63.4	Low	38.8 Å²	38.8	46.2 Å²	46.2	21%	0.207	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	115.7	165.6	-175.1	0.7	0	0	0	108.8	R2209 H2229 L2230 T2750 G2751	R2209-N2227 PolarHBondContact O-OD1 3.29Å; R2209-N2227 VanDerWaalsContact O-OD1 3.1Å; N2227-H2229 VanDerWaalsContact C-N 3.29Å; N2227-H2229 PolarHBondContact O-N 3.34Å; N2227-H2229 VanDerWaalsContact O-N 3.13Å; N2227-H2229 WeakPolarHBondContact OD1-CB 3.46Å; N2227-H2229 PolarHBondContact OD1-N 3.15Å; N2227-H2229 VanDerWaalsContact OD1-N 3.12Å; N2227-H2229 PolarHBondContact OD1-ND1 2.95Å; N2227-H2229 VanDerWaalsContact OD1-ND1 3.11Å; N2227-L2230 HydrophobicContact CB-CD1 3.85Å; N2227-L2230 HydrophobicContact CB-CG 4.17Å; N2227-L2230 PolarHBondContact O-N 3.2Å; N2227-T2750 WeakPolarHBondContact O-CB 3.42Å; N2227-T2750 VanDerWaalsContact O-CG2 3.28Å; N2227-T2750 WeakPolarHBondContact O-CG2 3.2Å; N2227-G2751 WeakPolarHBondContact CB-O 3.21Å; N2227-G2751 PolarHBondContact N-O 3.23Å
2228	A	70.2	Confident	64.5	Low	3.8 Å²	3.8	46.2 Å²	46.2	3%	0.031	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	-17.9	-178.2	0	0	0	0	0	113.6	L2148 F2203 G2208 R2209 L2211 W2226 L2230	L2148-A2228 HydrophobicContact CD1-CB 4.48Å; L2148-A2228 WeakPolarHBondContact CD1-O 3.49Å; F2203-A2228 HydrophobicContact CD1-CB 4.06Å; F2203-A2228 HydrophobicContact CE1-CB 3.64Å; G2208-A2228 VanDerWaalsContact O-CB 3.28Å; G2208-A2228 WeakPolarHBondContact O-CB 3.32Å; R2209-A2228 WeakPolarHBondContact O-CB 3.33Å; R2209-A2228 PolarHBondContact O-N 2.92Å; L2211-A2228 HydrophobicContact CB-CB 4.31Å; W2226-A2228 PolarHBondContact O-N 3.1Å; A2228-L2230 PolarHBondContact O-N 2.95Å
2229	H	64.8	Low	65.6	Low	82.2 Å²	82.2	45.4 Å²	45.4	38%	0.381	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	105.7	174.3	-62.8	88.2	0	0	0	110.1	R2209 N2227 G2231	R2209-H2229 WeakPolarHBondContact CA-CE1 3.46Å; R2209-H2229 WeakPolarHBondContact CA-ND1 3.3Å; N2227-H2229 VanDerWaalsContact C-N 3.29Å; N2227-H2229 PolarHBondContact O-N 3.34Å; N2227-H2229 VanDerWaalsContact O-N 3.13Å; N2227-H2229 WeakPolarHBondContact OD1-CB 3.46Å; N2227-H2229 PolarHBondContact OD1-N 3.15Å; N2227-H2229 VanDerWaalsContact OD1-N 3.12Å; N2227-H2229 PolarHBondContact OD1-ND1 2.95Å; N2227-H2229 VanDerWaalsContact OD1-ND1 3.11Å; H2229-G2231 PolarHBondContact O-N 3.43Å
2230	L	60.9	Low	66.7	Low	25.2 Å²	25.2	45.3 Å²	45.3	13%	0.132	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	131.8	171.8	-65.9	168.6	0	0	0	109.7	L2169 N2227 A2228 I2558 S2559 M2561 T2750	L2169-L2230 HydrophobicContact CB-CD1 4.25Å; L2169-L2230 HydrophobicContact CD1-CD1 3.97Å; L2169-L2230 HydrophobicContact CD2-CD1 4.43Å; L2169-L2230 HydrophobicContact CG-CD1 4.44Å; N2227-L2230 HydrophobicContact CB-CD1 3.85Å; N2227-L2230 HydrophobicContact CB-CG 4.17Å; N2227-L2230 PolarHBondContact O-N 3.2Å; A2228-L2230 PolarHBondContact O-N 2.95Å; L2230-I2558 HydrophobicContact CD1-CD1 4.48Å; L2230-I2558 HydrophobicContact CD1-CG2 4.32Å; L2230-S2559 PolarHBondContact O-OG 2.87Å; L2230-M2561 WeakPolarHBondContact O-CE 3.1Å; L2230-M2561 WeakPolarHBondContact O-CG 3.44Å; L2230-T2750 HydrophobicContact CD2-CG2 4.07Å
2231	G	57	Low	67.2	Low	14.8 Å²	14.8	46.8 Å²	46.8	15%	0.153	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	121.5	65.7	-174.3	0	0	0	0	0	111.7	H2229 M2561 Y2745 E2746 L2749	H2229-G2231 PolarHBondContact O-N 3.43Å; G2231-M2561 VanDerWaalsContact CA-CE 3.46Å; G2231-M2561 WeakPolarHBondContact O-CE 3.5Å; G2231-Y2745 VanDerWaalsContact O-CD1 3.3Å; G2231-Y2745 WeakPolarHBondContact O-CD1 3.35Å; G2231-E2746 WeakPolarHBondContact CA-O 3.43Å; G2231-E2746 PolarHBondContact N-O 3.24Å; G2231-L2749 PolarHBondContact N-O 2.91Å
2232	A	57	Low	67.4	Low	15.6 Å²	15.6	47.6 Å²	47.6	13%	0.129	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	132.5	174.3	0	0	0	0	0	109.6	E2234 Y2745 E2746 L2749 G2751	A2232-E2234 PolarHBondContact O-N 2.83Å; A2232-Y2745 CarbonylContact O-C 3.56Å; A2232-Y2745 VanDerWaalsContact O-CA 3.25Å; A2232-Y2745 WeakPolarHBondContact O-CA 3.37Å; A2232-E2746 PolarHBondContact N-O 3.35Å; A2232-E2746 PolarHBondContact O-N 3.18Å; A2232-L2749 HydrophobicContact CB-CB 3.78Å; A2232-L2749 HydrophobicContact CB-CD2 4.08Å; A2232-L2749 HydrophobicContact CB-CG 4.38Å; A2232-L2749 PolarHBondContact N-O 3.2Å; A2232-G2751 VanDerWaalsContact CB-CA 3.49Å; A2232-G2751 VanDerWaalsContact CB-N 3.34Å
2233	P	60.4	Low	67	Low	58.8 Å²	58.8	49.7 Å²	49.7	38%	0.382	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	132.9	170.1	29.5	-32.5	0	0	0	110.1	L2169 G2235 R2743 V2744 Y2745	L2169-P2233 HydrophobicContact CD2-CB 3.69Å; L2169-P2233 HydrophobicContact CD2-CG 4.48Å; P2233-G2235 VanDerWaalsContact C-N 3.28Å; P2233-G2235 PolarHBondContact O-N 3.06Å; P2233-R2743 HydrophobicContact CB-CG 4.26Å; P2233-V2744 WeakPolarHBondContact CA-O 3.46Å; P2233-Y2745 HydrophobicContact CB-CD1 4.01Å; P2233-Y2745 HydrophobicContact CB-CE1 3.93Å
2234	E	60.3	Low	66.1	Low	91 Å²	91	54.4 Å²	54.4	43%	0.425	29%	0.293	S	S	.	.			trans	-73.1	58.1	169.7	-106.1	-169.4	153.5	0	0	109.9	A2232 K2724 V2744 E2746	A2232-E2234 PolarHBondContact O-N 2.83Å; E2234-K2724 VanDerWaalsContact OE1-CE 3.29Å; E2234-K2724 WeakPolarHBondContact OE1-CE 3.15Å; E2234-K2724 IonicContact OE1-NZ 3.15Å; E2234-K2724 PolarHBondContact OE1-NZ 3.45Å; E2234-K2724 VanDerWaalsContact OE2-CD 3.32Å; E2234-K2724 WeakPolarHBondContact OE2-CD 3.24Å; E2234-K2724 WeakPolarHBondContact OE2-CE 3.31Å; E2234-K2724 IonicContact OE2-NZ 3.79Å; E2234-K2724 PolarHBondContact OE2-NZ 3.16Å; E2234-V2744 HydrophobicContact CB-CB 4.35Å; E2234-V2744 HydrophobicContact CG-CG1 4.45Å; E2234-V2744 PolarHBondContact N-O 3.26Å; E2234-V2744 VanDerWaalsContact OE2-CG1 3.26Å; E2234-V2744 WeakPolarHBondContact OE2-CG1 3.29Å; E2234-E2746 HydrophobicContact CG-CG 4.01Å
2235	G	58.9	Low	65	Low	39 Å²	39	63.5 Å²	63.5	40%	0.402	33%	0.332	S	S	.	.	S	Bend	trans	145.1	-175.3	-179.5	0	0	0	0	0	113.9	P2233 W2237 R2743	P2233-G2235 VanDerWaalsContact C-N 3.28Å; P2233-G2235 PolarHBondContact O-N 3.06Å; G2235-W2237 PolarHBondContact O-N 2.86Å; G2235-W2237 VanDerWaalsContact O-N 3.15Å; G2235-R2743 VanDerWaalsContact O-CZ 3.28Å; G2235-R2743 PolarHBondContact O-NE 3.01Å; G2235-R2743 VanDerWaalsContact O-NE 3.16Å; G2235-R2743 PolarHBondContact O-NH2 3.48Å
2236	P	63.3	Low	63.5	Low	95.8 Å²	95.8	71.7 Å²	71.7	62%	0.622	37%	0.369	S	S	*	.	S	Bend	trans	-66.9	170.6	177	29.7	-34.8	0	0	0	111.6	I2238 R2743	P2236-I2238 HydrophobicContact CG-CD1 4.47Å; P2236-I2238 HydrophobicContact CG-CG1 4.5Å; P2236-I2238 WeakPolarHBondContact O-CG1 3.13Å; P2236-I2238 PolarHBondContact O-N 3.2Å; P2236-R2743 VanDerWaalsContact C-NE 3.32Å; P2236-R2743 PolarHBondContact O-NE 2.93Å
2237	W	70.4	Confident	62.5	Low	74.8 Å²	74.8	76.8 Å²	76.8	28%	0.283	40%	0.395	S	S	.	.			trans	-72	129.5	165.7	-75.1	98.6	0	0	0	108.4	G2235 N2239 I2563 I2727 Q2729 Q2741 R2743 Y2745	G2235-W2237 PolarHBondContact O-N 2.86Å; G2235-W2237 VanDerWaalsContact O-N 3.15Å; W2237-N2239 PolarHBondContact O-N 2.79Å; W2237-I2563 HydrophobicContact CH2-CG2 4Å; W2237-I2563 HydrophobicContact CZ2-CG2 3.83Å; W2237-I2727 HydrophobicContact CH2-CG2 4.1Å; W2237-I2727 HydrophobicContact CZ3-CG2 4.45Å; W2237-Q2729 HydrophobicContact CH2-CG 3.92Å; W2237-Q2729 HydrophobicContact CZ3-CG 3.87Å; W2237-Q2741 HydrophobicContact CB-CB 4.41Å; W2237-Q2741 VanDerWaalsContact CB-OE1 3.31Å; W2237-Q2741 HydrophobicContact CD2-CG 4.2Å; W2237-Q2741 HydrophobicContact CE3-CB 4.1Å; W2237-Q2741 HydrophobicContact CE3-CG 3.69Å; W2237-Q2741 VanDerWaalsContact CG-NE2 3.35Å; W2237-Q2741 HydrophobicContact CZ3-CG 4.2Å; W2237-R2743 VanDerWaalsContact CD1-CZ 3.4Å; W2237-R2743 HydrophobicContact CD2-CB 3.96Å; W2237-R2743 HydrophobicContact CE3-CB 3.58Å; W2237-R2743 HydrophobicContact CG-CB 4.5Å; W2237-R2743 HydrophobicContact CH2-CB 4.35Å; W2237-R2743 HydrophobicContact CZ3-CB 3.8Å; W2237-Y2745 WeakPolarHBondContact CZ2-OH 3.38Å
2238	I	75.6	Confident	61.7	Low	38.6 Å²	38.6	85.5 Å²	85.5	20%	0.198	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	109.7	179.2	-62.9	172	0	0	0	107.8	P2236 V2240 I2279 Q2741 F2742	P2236-I2238 HydrophobicContact CG-CD1 4.47Å; P2236-I2238 HydrophobicContact CG-CG1 4.5Å; P2236-I2238 WeakPolarHBondContact O-CG1 3.13Å; P2236-I2238 PolarHBondContact O-N 3.2Å; I2238-V2240 HydrophobicContact CG2-CG2 3.85Å; I2238-V2240 PolarHBondContact O-N 3.26Å; I2238-I2279 VanDerWaalsContact CD1-O 3.28Å; I2238-I2279 WeakPolarHBondContact CD1-O 3.25Å; I2238-Q2741 CarbonylContact O-C 3.58Å; I2238-Q2741 VanDerWaalsContact O-CA 3.25Å; I2238-Q2741 WeakPolarHBondContact O-CA 3.31Å; I2238-F2742 HydrophobicContact CB-CD1 4.3Å; I2238-F2742 HydrophobicContact CB-CD2 4.49Å; I2238-F2742 HydrophobicContact CB-CE1 3.96Å; I2238-F2742 HydrophobicContact CB-CE2 4.17Å; I2238-F2742 HydrophobicContact CB-CZ 3.89Å; I2238-F2742 HydrophobicContact CD1-CE2 3.83Å; I2238-F2742 HydrophobicContact CD1-CZ 3.98Å; I2238-F2742 HydrophobicContact CG1-CE2 4.48Å; I2238-F2742 HydrophobicContact CG1-CZ 4.49Å; I2238-F2742 HydrophobicContact CG2-CD1 4.37Å; I2238-F2742 HydrophobicContact CG2-CE1 3.62Å; I2238-F2742 HydrophobicContact CG2-CE2 4.37Å; I2238-F2742 HydrophobicContact CG2-CZ 3.62Å; I2238-F2742 PolarHBondContact N-O 3.27Å; I2238-F2742 PolarHBondContact O-N 3.08Å
2239	N	77.3	Confident	61.2	Low	81.6 Å²	81.6	92.7 Å²	92.7	44%	0.436	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	118.3	178.7	-68.1	10.9	0	0	0	109.7	W2237 I2241 E2739 Q2741	W2237-N2239 PolarHBondContact O-N 2.79Å; N2239-I2241 HydrophobicContact CB-CG1 4.46Å; N2239-I2241 PolarHBondContact O-N 3.25Å; N2239-I2241 VanDerWaalsContact O-N 3.09Å; N2239-E2739 PolarHBondContact ND2-OE2 3.35Å; N2239-Q2741 VanDerWaalsContact OD1-CB 3.24Å; N2239-Q2741 WeakPolarHBondContact OD1-CB 3.25Å; N2239-Q2741 PolarHBondContact OD1-OE1 2.77Å
2240	V	73.9	Confident	61.2	Low	13.4 Å²	13.4	91.8 Å²	91.8	8%	0.081	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	95.1	176	-175.8	0	0	0	0	108.7	I2238 R2242 I2267 W2269 V2277 T2284 F2740 F2742	I2238-V2240 HydrophobicContact CG2-CG2 3.85Å; I2238-V2240 PolarHBondContact O-N 3.26Å; V2240-R2242 PolarHBondContact O-N 3.04Å; V2240-I2267 HydrophobicContact CB-CD1 4.32Å; V2240-I2267 HydrophobicContact CG1-CD1 4.11Å; V2240-I2267 HydrophobicContact CG2-CD1 4.06Å; V2240-W2269 HydrophobicContact CG1-CH2 4.39Å; V2240-W2269 HydrophobicContact CG1-CZ2 4.25Å; V2240-V2277 HydrophobicContact CG1-CG2 3.94Å; V2240-V2277 HydrophobicContact CG2-CG1 4.16Å; V2240-V2277 HydrophobicContact CG2-CG2 4.29Å; V2240-T2284 HydrophobicContact CG1-CG2 4.2Å; V2240-F2740 HydrophobicContact CB-CD1 4.18Å; V2240-F2740 HydrophobicContact CG2-CD1 4.09Å; V2240-F2740 HydrophobicContact CG2-CE1 4.42Å; V2240-F2740 PolarHBondContact N-O 2.96Å; V2240-F2742 HydrophobicContact CG2-CD1 3.89Å; V2240-F2742 HydrophobicContact CG2-CE1 3.62Å
2241	I	68.3	Low	61.6	Low	109 Å²	109	92.6 Å²	92.6	56%	0.559	47%	0.468	S	S	*	.			trans	-88.6	115.7	178.9	-56.1	174.4	0	0	0	109.3	N2239 N2243	N2239-I2241 HydrophobicContact CB-CG1 4.46Å; N2239-I2241 PolarHBondContact O-N 3.25Å; N2239-I2241 VanDerWaalsContact O-N 3.09Å; I2241-N2243 PolarHBondContact O-N 3.16Å
2242	R	65.6	Low	62.6	Low	40.4 Å²	40.4	93.9 Å²	93.9	15%	0.152	47%	0.472	C	S	.	.			trans	-85.8	112.3	172.6	-157.8	176.6	-177	-163.5	-2.3	110.3	V2240 K2244 W2269 D2271 L2273 D2289	V2240-R2242 PolarHBondContact O-N 3.04Å; R2242-K2244 PolarHBondContact O-N 3.13Å; R2242-K2244 VanDerWaalsContact O-N 3.09Å; R2242-W2269 HydrophobicContact CB-CH2 4.49Å; R2242-D2271 IonicContact CZ-OD1 3.22Å; R2242-D2271 IonicContact CZ-OD2 3.2Å; R2242-D2271 VanDerWaalsContact CZ-OD2 3.27Å; R2242-D2271 VanDerWaalsContact NH1-CG 3.25Å; R2242-D2271 IonicContact NH1-OD1 3Å; R2242-D2271 PolarHBondContact NH1-OD1 3.12Å; R2242-D2271 IonicContact NH1-OD2 2.9Å; R2242-D2271 PolarHBondContact NH1-OD2 3.16Å; R2242-D2271 IonicContact NH2-OD2 2.99Å; R2242-D2271 PolarHBondContact NH2-OD2 2.99Å; R2242-L2273 VanDerWaalsContact NH2-CB 3.31Å; R2242-D2289 IonicContact CZ-OD1 3.47Å; R2242-D2289 IonicContact CZ-OD2 3.33Å; R2242-D2289 IonicContact NE-OD2 4Å; R2242-D2289 IonicContact NH2-OD1 3.49Å; R2242-D2289 PolarHBondContact NH2-OD1 3.26Å; R2242-D2289 IonicContact NH2-OD2 3.17Å; R2242-D2289 PolarHBondContact NH2-OD2 3.38Å
2243	N	56	Low	63.9	Low	147.2 Å²	147.2	93.7 Å²	93.7	79%	0.787	47%	0.47	S	S	*	.			trans	-63.6	99.2	-178.8	-79.9	-31	0	0	0	112.3	I2241 K2245	I2241-N2243 PolarHBondContact O-N 3.16Å; N2243-K2245 VanDerWaalsContact C-N 3.33Å; N2243-K2245 PolarHBondContact O-N 3.33Å; N2243-K2245 VanDerWaalsContact O-N 3.12Å
2244	K	53.5	Low	65.1	Low	123.2 Å²	123.2	93 Å²	93	54%	0.536	46%	0.464	S	S	.	.			trans	-87.5	96.8	170.8	-71.1	-175.3	177.3	179.5	0	110.8	R2242 E2246 D2271 D2289	R2242-K2244 PolarHBondContact O-N 3.13Å; R2242-K2244 VanDerWaalsContact O-N 3.09Å; K2244-E2246 VanDerWaalsContact C-N 3.31Å; K2244-E2246 PolarHBondContact O-N 3.28Å; K2244-D2271 IonicContact NZ-OD2 2.68Å; K2244-D2271 PolarHBondContact NZ-OD2 2.91Å; K2244-D2289 WeakPolarHBondContact CE-OD1 3.47Å; K2244-D2289 WeakPolarHBondContact CE-OD2 3.46Å; K2244-D2289 IonicContact NZ-OD1 3.16Å; K2244-D2289 PolarHBondContact NZ-OD1 2.75Å; K2244-D2289 IonicContact NZ-OD2 3.07Å; K2244-D2289 PolarHBondContact NZ-OD2 2.87Å
2245	K	50.5	Low	66.4	Low	199.8 Å²	199.8	89.4 Å²	89.4	87%	0.869	45%	0.449	S	S	*	.	S	Bend	trans	-83	0.9	176.5	-76.7	-173.5	174.9	-179	0	113.6	N2243	N2243-K2245 VanDerWaalsContact C-N 3.33Å; N2243-K2245 PolarHBondContact O-N 3.33Å; N2243-K2245 VanDerWaalsContact O-N 3.12Å
2246	E	46.6	Very low	67.9	Low	191.2 Å²	191.2	87.9 Å²	87.9	89%	0.893	43%	0.431	S	S	*	.	S	Bend	trans	-153.5	8.6	-173	-71.6	-177.8	160.3	0	0	118.6	K2244	K2244-E2246 VanDerWaalsContact C-N 3.31Å; K2244-E2246 PolarHBondContact O-N 3.28Å
2247	M	52.2	Low	69.2	Low	129.2 Å²	129.2	83.4 Å²	83.4	64%	0.636	40%	0.402	S	S	*	.			trans	-106.6	134.8	-176.4	-73.4	-93.9	-179.3	0	0	114.1	Q2249	M2247-Q2249 VanDerWaalsContact C-N 3.3Å; M2247-Q2249 PolarHBondContact O-N 3.12Å
2248	K	52.5	Low	70	Confident	221 Å²	221	80.7 Å²	80.7	96%	0.961	39%	0.393	S	S	*	.	S	Bend	trans	-79.9	-9.8	174.6	-76.8	-177.2	176.8	177.8	0	114.2
2249	Q	59.2	Low	70.4	Confident	155 Å²	155	79.2 Å²	79.2	72%	0.724	39%	0.385	S	S	*	.	S	Bend	trans	-96.2	145.7	-177.1	-90.4	174.5	-24.9	0	0	111.5	M2247 I2251	M2247-Q2249 VanDerWaalsContact C-N 3.3Å; M2247-Q2249 PolarHBondContact O-N 3.12Å; Q2249-I2251 PolarHBondContact O-N 3.05Å
2250	T	65	Low	70.5	Confident	63.6 Å²	63.6	79.7 Å²	79.7	39%	0.39	39%	0.387	S	S	.	.			trans	-69.3	116	174.1	49.2	0	0	0	0	109.7	L2252 N2270 N2736	T2250-L2252 PolarHBondContact O-N 3.42Å; T2250-N2270 PolarHBondContact O-ND2 3.17Å; T2250-N2736 HydrophobicContact CG2-CB 4.13Å; T2250-N2736 WeakPolarHBondContact CG2-O 3.36Å
2251	I	70.9	Confident	70.6	Confident	41.2 Å²	41.2	81.4 Å²	81.4	21%	0.211	40%	0.399	C	S	.	.			trans	-80.9	125.4	177.1	-59	172.9	0	0	0	108.3	Q2249 W2269 N2270	Q2249-I2251 PolarHBondContact O-N 3.05Å; I2251-W2269 HydrophobicContact CG2-CB 4.48Å; I2251-W2269 HydrophobicContact CG2-CD2 4.24Å; I2251-W2269 HydrophobicContact CG2-CE3 3.65Å; I2251-W2269 HydrophobicContact CG2-CZ3 4.25Å; I2251-N2270 WeakPolarHBondContact CA-OD1 3.38Å
2252	L	78	Confident	71.1	Confident	42.8 Å²	42.8	76.5 Å²	76.5	22%	0.224	38%	0.375	C	S	.	.			trans	-124.9	135.5	-176.2	-74.2	170.5	0	0	0	109.9	T2250 W2269 N2270 Q2738	T2250-L2252 PolarHBondContact O-N 3.42Å; L2252-W2269 CarbonylContact O-C 3.54Å; L2252-W2269 VanDerWaalsContact O-CA 3.32Å; L2252-W2269 WeakPolarHBondContact O-CA 3.38Å; L2252-N2270 HydrophobicContact CB-CB 4.18Å; L2252-N2270 VanDerWaalsContact N-CG 3.34Å; L2252-N2270 PolarHBondContact N-ND2 3.02Å; L2252-N2270 PolarHBondContact N-OD1 3.22Å; L2252-N2270 VanDerWaalsContact N-OD1 3.13Å; L2252-N2270 PolarHBondContact O-N 3.01Å; L2252-N2270 PolarHBondContact O-OD1 3.13Å; L2252-Q2738 VanDerWaalsContact CD1-OE1 3.25Å; L2252-Q2738 HydrophobicContact CD2-CB 3.77Å; L2252-Q2738 HydrophobicContact CD2-CG 3.87Å; L2252-Q2738 VanDerWaalsContact CD2-CG 3.5Å; L2252-Q2738 VanDerWaalsContact CD2-OE1 3.31Å; L2252-Q2738 VanDerWaalsContact CG-OE1 3.22Å
2253	A	83.4	Confident	71.8	Confident	11.6 Å²	11.6	78.6 Å²	78.6	10%	0.096	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	127.1	165.7	0	0	0	0	0	108.9	I2267 G2268 W2269 L2582 T2730 F2740	A2253-I2267 HydrophobicContact CB-CG2 3.79Å; A2253-G2268 WeakPolarHBondContact CA-O 3.39Å; A2253-W2269 HydrophobicContact CB-CE3 4.02Å; A2253-W2269 HydrophobicContact CB-CH2 4.4Å; A2253-W2269 HydrophobicContact CB-CZ3 3.85Å; A2253-L2582 HydrophobicContact CB-CD2 4.47Å; A2253-T2730 HydrophobicContact CB-CG2 3.88Å; A2253-T2730 WeakPolarHBondContact O-CG2 3.42Å; A2253-F2740 HydrophobicContact CB-CB 3.75Å; A2253-F2740 HydrophobicContact CB-CD2 3.63Å; A2253-F2740 HydrophobicContact CB-CE2 4.39Å; A2253-F2740 HydrophobicContact CB-CG 3.74Å
2254	T	85.5	Confident	73.2	Confident	42.6 Å²	42.6	72.2 Å²	72.2	26%	0.261	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-26	-173	51.2	0	0	0	0	112.7	G2268 N2270 S2300 V2301 L2582	T2254-G2268 PolarHBondContact N-O 3.11Å; T2254-G2268 PolarHBondContact OG1-O 2.9Å; T2254-G2268 VanDerWaalsContact OG1-O 3.09Å; T2254-N2270 HydrophobicContact CG2-CB 3.78Å; T2254-S2300 WeakPolarHBondContact CG2-OG 3.38Å; T2254-V2301 VanDerWaalsContact CB-O 3.25Å; T2254-V2301 WeakPolarHBondContact CB-O 3.32Å; T2254-V2301 PolarHBondContact OG1-O 3.06Å; T2254-L2582 VanDerWaalsContact C-CD1 3.47Å; T2254-L2582 WeakPolarHBondContact O-CD1 3.36Å
2255	T	87.8	Confident	74.9	Confident	15.6 Å²	15.6	66.6 Å²	66.6	10%	0.096	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	162.5	176.2	-167.7	0	0	0	0	109.7	G2268 V2301 Q2302 I2304 K2584	T2255-G2268 PolarHBondContact O-N 2.97Å; T2255-V2301 HydrophobicContact CG2-CB 4.48Å; T2255-V2301 HydrophobicContact CG2-CG1 4.09Å; T2255-Q2302 WeakPolarHBondContact CB-O 3.37Å; T2255-Q2302 WeakPolarHBondContact CG2-O 3.4Å; T2255-Q2302 PolarHBondContact OG1-O 2.93Å; T2255-I2304 HydrophobicContact CG2-CB 4.09Å; T2255-I2304 HydrophobicContact CG2-CD1 3.97Å; T2255-I2304 HydrophobicContact CG2-CG1 3.68Å; T2255-K2584 PolarHBondContact OG1-NZ 2.95Å
2256	Y	90.8	Very high	76.8	Confident	8.8 Å²	8.8	57.3 Å²	57.3	4%	0.035	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	161.4	169.8	66	-98.2	0	0	0	111.9	I2265 I2266 L2582 K2584 Q2586 L2726 G2728 F2740	Y2256-I2265 HydrophobicContact CD1-CD1 4.49Å; Y2256-I2265 HydrophobicContact CD2-CD1 3.78Å; Y2256-I2265 HydrophobicContact CD2-CG1 4.15Å; Y2256-I2265 HydrophobicContact CD2-CG2 3.81Å; Y2256-I2265 HydrophobicContact CE2-CD1 4.24Å; Y2256-I2265 HydrophobicContact CG-CD1 4.07Å; Y2256-I2265 HydrophobicContact CG-CG1 4.37Å; Y2256-I2265 HydrophobicContact CG-CG2 4.06Å; Y2256-I2266 CarbonylContact C-O 3.56Å; Y2256-I2266 WeakPolarHBondContact CA-O 3.34Å; Y2256-I2266 VanDerWaalsContact CB-O 3.31Å; Y2256-I2266 WeakPolarHBondContact CB-O 3.22Å; Y2256-L2582 HydrophobicContact CD1-CD2 3.82Å; Y2256-L2582 HydrophobicContact CE1-CD2 4.01Å; Y2256-L2582 VanDerWaalsContact CE1-CD2 3.49Å; Y2256-K2584 HydrophobicContact CD1-CB 4.42Å; Y2256-K2584 HydrophobicContact CD1-CD 4.45Å; Y2256-K2584 HydrophobicContact CD2-CD 4.47Å; Y2256-K2584 HydrophobicContact CE1-CB 3.72Å; Y2256-K2584 HydrophobicContact CE1-CD 4.4Å; Y2256-K2584 HydrophobicContact CE1-CG 4.4Å; Y2256-K2584 HydrophobicContact CE2-CB 4.37Å; Y2256-K2584 HydrophobicContact CE2-CD 4.39Å; Y2256-K2584 HydrophobicContact CE2-CG 4.39Å; Y2256-K2584 WeakPolarHBondContact O-CD 3.37Å; Y2256-K2584 WeakPolarHBondContact O-CE 3.31Å; Y2256-K2584 PolarHBondContact O-NZ 3.21Å; Y2256-K2584 PolarHBondContact OH-O 3.23Å; Y2256-Q2586 HydrophobicContact CE2-CG 4.43Å; Y2256-L2726 HydrophobicContact CD2-CD2 4.39Å; Y2256-L2726 HydrophobicContact CE2-CD2 3.62Å; Y2256-L2726 PolarHBondContact OH-O 3.41Å; Y2256-L2726 VanDerWaalsContact OH-O 3.13Å; Y2256-G2728 PolarHBondContact OH-N 3Å; Y2256-F2740 AromaticContact CD1-CE2 3.94Å; Y2256-F2740 HydrophobicContact CD1-CE2 3.94Å; Y2256-F2740 AromaticContact CD1-CZ 3.78Å; Y2256-F2740 HydrophobicContact CD1-CZ 3.78Å; Y2256-F2740 HydrophobicContact CE1-CE2 4.21Å; Y2256-F2740 HydrophobicContact CE1-CZ 4.13Å; Y2256-F2740 HydrophobicContact CG-CZ 4.41Å
2257	A	89.7	Confident	78.9	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.008	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	147.2	170.5	0	0	0	0	0	110.6	I2265 I2266 I2304 C2306 Q2586	A2257-I2265 CarbonylContact O-C 3.54Å; A2257-I2266 PolarHBondContact N-O 3.1Å; A2257-I2266 PolarHBondContact O-N 3.14Å; A2257-I2304 HydrophobicContact CB-CB 4.36Å; A2257-I2304 HydrophobicContact CB-CG2 3.81Å; A2257-C2306 HydrophobicContact CB-CB 4.35Å; A2257-Q2586 VanDerWaalsContact CA-OE1 3.24Å
2258	I	87.5	Confident	80.6	Confident	17.8 Å²	17.8	42.2 Å²	42.2	9%	0.091	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	145.6	171.7	-60.1	168.2	0	0	0	109	H2264 I2265 I2279 C2306 Q2586 F2588 L2726	I2258-H2264 WeakPolarHBondContact CA-O 3.24Å; I2258-I2265 HydrophobicContact CG1-CD1 4.33Å; I2258-I2265 HydrophobicContact CG1-CG1 4.3Å; I2258-I2279 HydrophobicContact CG1-CD1 4.41Å; I2258-I2279 HydrophobicContact CG2-CD1 3.97Å; I2258-C2306 VanDerWaalsContact O-CB 3.29Å; I2258-C2306 WeakPolarHBondContact O-CB 3.38Å; I2258-C2306 PolarHBondContact O-SG 3.41Å; I2258-Q2586 HydrophobicContact CD1-CB 3.61Å; I2258-Q2586 HydrophobicContact CG1-CB 4.32Å; I2258-Q2586 VanDerWaalsContact CG1-OE1 3.25Å; I2258-F2588 HydrophobicContact CD1-CB 4.47Å; I2258-F2588 HydrophobicContact CD1-CD1 3.93Å; I2258-F2588 HydrophobicContact CD1-CE1 4.26Å; I2258-F2588 HydrophobicContact CD1-CG 4.26Å; I2258-L2726 HydrophobicContact CD1-CB 3.63Å; I2258-L2726 HydrophobicContact CD1-CD1 3.9Å; I2258-L2726 HydrophobicContact CD1-CD2 4.25Å; I2258-L2726 HydrophobicContact CD1-CG 4.18Å; I2258-L2726 HydrophobicContact CG1-CD1 4.31Å
2259	D	84.6	Confident	82.3	Confident	6.4 Å²	6.4	32.2 Å²	32.2	3%	0.034	17%	0.171	C	C	.	.			trans	-71.8	162.7	173.9	90.9	-16.7	0	0	0	112.3	S2261 G2262 K2263 H2264 N2316 F2334	D2259-S2261 VanDerWaalsContact C-N 3.29Å; D2259-S2261 VanDerWaalsContact CG-OG 3.31Å; D2259-S2261 PolarHBondContact O-N 3.22Å; D2259-S2261 VanDerWaalsContact O-N 3.1Å; D2259-S2261 VanDerWaalsContact OD1-C 3.32Å; D2259-S2261 VanDerWaalsContact OD1-CA 3.26Å; D2259-S2261 WeakPolarHBondContact OD1-CA 3.33Å; D2259-S2261 WeakPolarHBondContact OD1-CB 3.36Å; D2259-S2261 PolarHBondContact OD1-N 3.01Å; D2259-S2261 PolarHBondContact OD1-OG 3.14Å; D2259-S2261 WeakPolarHBondContact OD2-CB 3.31Å; D2259-S2261 PolarHBondContact OD2-OG 3.05Å; D2259-G2262 PolarHBondContact O-N 2.93Å; D2259-G2262 VanDerWaalsContact O-N 3.11Å; D2259-G2262 PolarHBondContact OD1-N 3.09Å; D2259-K2263 PolarHBondContact OD1-N 3.02Å; D2259-H2264 HydrophobicContact CB-CB 4.21Å; D2259-H2264 PolarHBondContact N-O 3.28Å; D2259-H2264 PolarHBondContact OD1-N 2.96Å; D2259-H2264 IonicContact OD1-ND1 2.7Å; D2259-H2264 IonicContact OD2-CE1 3.35Å; D2259-H2264 IonicContact OD2-CG 3.07Å; D2259-H2264 PolarHBondContact OD2-N 3.43Å; D2259-H2264 VanDerWaalsContact OD2-N 3.1Å; D2259-H2264 IonicContact OD2-ND1 3.05Å; D2259-H2264 PolarHBondContact OD2-ND1 3.04Å; D2259-N2316 WeakPolarHBondContact CB-ND2 3.49Å; D2259-N2316 PolarHBondContact OD1-ND2 2.97Å; D2259-F2334 HydrophobicContact CB-CE2 4.39Å
2260	I	79.1	Confident	83.5	Confident	93.4 Å²	93.4	26.9 Å²	26.9	48%	0.479	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-26.7	-177.4	-126.2	100.9	0	0	0	113	G2262 G2307 I2308 N2316	I2260-G2262 VanDerWaalsContact C-N 3.34Å; I2260-G2262 PolarHBondContact O-N 3.09Å; I2260-G2307 WeakPolarHBondContact CD1-O 3.33Å; I2260-I2308 HydrophobicContact CD1-CB 3.95Å; I2260-I2308 HydrophobicContact CD1-CD1 4.44Å; I2260-I2308 HydrophobicContact CD1-CG1 3.78Å; I2260-I2308 VanDerWaalsContact CD1-CG1 3.42Å; I2260-I2308 VanDerWaalsContact CD1-N 3.27Å; I2260-I2308 HydrophobicContact CG1-CD1 4.38Å; I2260-I2308 HydrophobicContact CG1-CG1 4.14Å; I2260-N2316 VanDerWaalsContact CB-OD1 3.31Å; I2260-N2316 WeakPolarHBondContact CB-OD1 3.35Å; I2260-N2316 VanDerWaalsContact CD1-OD1 3.27Å; I2260-N2316 WeakPolarHBondContact CD1-OD1 3.38Å; I2260-N2316 WeakPolarHBondContact CG1-OD1 3.27Å; I2260-N2316 VanDerWaalsContact CG2-OD1 3.31Å; I2260-N2316 WeakPolarHBondContact CG2-OD1 3.46Å; I2260-N2316 PolarHBondContact N-OD1 3.07Å
2261	S	75.9	Confident	84.3	Confident	48 Å²	48	25.5 Å²	25.5	34%	0.336	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-10.4	179	82.8	0	0	0	0	114.1	D2259 K2263	D2259-S2261 VanDerWaalsContact C-N 3.29Å; D2259-S2261 VanDerWaalsContact CG-OG 3.31Å; D2259-S2261 PolarHBondContact O-N 3.22Å; D2259-S2261 VanDerWaalsContact O-N 3.1Å; D2259-S2261 VanDerWaalsContact OD1-C 3.32Å; D2259-S2261 VanDerWaalsContact OD1-CA 3.26Å; D2259-S2261 WeakPolarHBondContact OD1-CA 3.33Å; D2259-S2261 WeakPolarHBondContact OD1-CB 3.36Å; D2259-S2261 PolarHBondContact OD1-N 3.01Å; D2259-S2261 PolarHBondContact OD1-OG 3.14Å; D2259-S2261 WeakPolarHBondContact OD2-CB 3.31Å; D2259-S2261 PolarHBondContact OD2-OG 3.05Å; S2261-K2263 VanDerWaalsContact C-N 3.28Å; S2261-K2263 PolarHBondContact O-N 3.34Å; S2261-K2263 WeakPolarHBondContact OG-CB 3.29Å; S2261-K2263 WeakPolarHBondContact OG-CD 3.14Å; S2261-K2263 PolarHBondContact OG-N 3.05Å
2262	G	78.1	Confident	84.8	Confident	6.2 Å²	6.2	23.8 Å²	23.8	6%	0.064	13%	0.13	C	C	.	.	S	Bend	trans	68.3	18.9	-177.7	0	0	0	0	0	114.1	D2259 I2260 I2279 F2588	D2259-G2262 PolarHBondContact O-N 2.93Å; D2259-G2262 VanDerWaalsContact O-N 3.11Å; D2259-G2262 PolarHBondContact OD1-N 3.09Å; I2260-G2262 VanDerWaalsContact C-N 3.34Å; I2260-G2262 PolarHBondContact O-N 3.09Å; G2262-I2279 WeakPolarHBondContact O-CD1 3.36Å; G2262-F2588 VanDerWaalsContact O-CE2 3.31Å; G2262-F2588 WeakPolarHBondContact O-CE2 3.44Å
2263	K	80.8	Confident	85.2	Confident	85.6 Å²	85.6	23.5 Å²	23.5	37%	0.372	13%	0.129	S	C	.	.	S	Bend	trans	-104.4	-27.9	-177	-66.1	175.3	-175.8	173.7	0	112.7	D2259 S2261 L2278 I2279 Y2590 C2593	D2259-K2263 PolarHBondContact OD1-N 3.02Å; S2261-K2263 VanDerWaalsContact C-N 3.28Å; S2261-K2263 PolarHBondContact O-N 3.34Å; S2261-K2263 WeakPolarHBondContact OG-CB 3.29Å; S2261-K2263 WeakPolarHBondContact OG-CD 3.14Å; S2261-K2263 PolarHBondContact OG-N 3.05Å; K2263-L2278 WeakPolarHBondContact O-CD1 3.25Å; K2263-I2279 WeakPolarHBondContact O-CB 3.4Å; K2263-I2279 WeakPolarHBondContact O-CG1 3.3Å; K2263-I2279 PolarHBondContact O-N 3.2Å; K2263-Y2590 HydrophobicContact CG-CE2 4.41Å; K2263-C2593 PolarHBondContact NZ-SG 3.17Å
2264	H	86.3	Confident	85.5	Confident	11.8 Å²	11.8	23.1 Å²	23.1	6%	0.055	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	142.1	-171.5	-49.2	101.7	0	0	0	112.1	I2258 D2259 I2276 V2277 I2285 F2334	I2258-H2264 WeakPolarHBondContact CA-O 3.24Å; D2259-H2264 HydrophobicContact CB-CB 4.21Å; D2259-H2264 PolarHBondContact N-O 3.28Å; D2259-H2264 PolarHBondContact OD1-N 2.96Å; D2259-H2264 IonicContact OD1-ND1 2.7Å; D2259-H2264 IonicContact OD2-CE1 3.35Å; D2259-H2264 IonicContact OD2-CG 3.07Å; D2259-H2264 PolarHBondContact OD2-N 3.43Å; D2259-H2264 VanDerWaalsContact OD2-N 3.1Å; D2259-H2264 IonicContact OD2-ND1 3.05Å; D2259-H2264 PolarHBondContact OD2-ND1 3.04Å; H2264-I2276 HydrophobicContact CB-CG2 3.95Å; H2264-V2277 CarbonylContact C-O 3.54Å; H2264-V2277 VanDerWaalsContact CA-O 3.3Å; H2264-V2277 WeakPolarHBondContact CA-O 3.38Å; H2264-I2285 VanDerWaalsContact CD2-CD1 3.43Å; H2264-I2285 WeakPolarHBondContact CD2-CD1 3.39Å; H2264-F2334 HydrophobicContact CB-CE1 4.49Å; H2264-F2334 HydrophobicContact CB-CZ 4.14Å; H2264-F2334 AromaticContact CD2-CZ 3.86Å; H2264-F2334 AromaticContact CE1-CD1 3.78Å; H2264-F2334 AromaticContact CE1-CD2 3.88Å; H2264-F2334 AromaticContact CE1-CE1 3.81Å; H2264-F2334 AromaticContact CE1-CE2 3.78Å; H2264-F2334 AromaticContact CE1-CG 3.8Å; H2264-F2334 AromaticContact CE1-CZ 3.76Å; H2264-F2334 AromaticContact CG-CE1 3.93Å; H2264-F2334 AromaticContact CG-CZ 3.67Å; H2264-F2334 AromaticContact ND1-CD2 3.87Å; H2264-F2334 AromaticContact ND1-CE1 3.86Å; H2264-F2334 AromaticContact ND1-CE2 3.47Å; H2264-F2334 WeakPolarHBondContact ND1-CE2 3.34Å; H2264-F2334 AromaticContact ND1-CG 3.97Å; H2264-F2334 AromaticContact ND1-CZ 3.48Å; H2264-F2334 VanDerWaalsContact ND1-CZ 3.31Å; H2264-F2334 WeakPolarHBondContact ND1-CZ 3.45Å; H2264-F2334 AromaticContact NE2-CD1 3.96Å; H2264-F2334 AromaticContact NE2-CE1 3.84Å; H2264-F2334 AromaticContact NE2-CZ 3.83Å
2265	I	89	Confident	85.6	Confident	7 Å²	7	21.2 Å²	21.2	4%	0.036	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	129.3	171	-158.3	176.4	0	0	0	109.7	Y2256 A2257 I2258 I2267 I2276 V2277 I2279 L2726 F2740 F2742	Y2256-I2265 HydrophobicContact CD1-CD1 4.49Å; Y2256-I2265 HydrophobicContact CD2-CD1 3.78Å; Y2256-I2265 HydrophobicContact CD2-CG1 4.15Å; Y2256-I2265 HydrophobicContact CD2-CG2 3.81Å; Y2256-I2265 HydrophobicContact CE2-CD1 4.24Å; Y2256-I2265 HydrophobicContact CG-CD1 4.07Å; Y2256-I2265 HydrophobicContact CG-CG1 4.37Å; Y2256-I2265 HydrophobicContact CG-CG2 4.06Å; A2257-I2265 CarbonylContact O-C 3.54Å; I2258-I2265 HydrophobicContact CG1-CD1 4.33Å; I2258-I2265 HydrophobicContact CG1-CG1 4.3Å; I2265-I2267 HydrophobicContact CB-CG1 4.35Å; I2265-I2267 HydrophobicContact CD1-CG1 4.34Å; I2265-I2267 HydrophobicContact CG1-CG1 4.19Å; I2265-I2267 HydrophobicContact CG2-CD1 4.42Å; I2265-I2267 HydrophobicContact CG2-CG1 4.24Å; I2265-I2276 CarbonylContact O-C 3.52Å; I2265-I2276 VanDerWaalsContact O-CA 3.31Å; I2265-I2276 WeakPolarHBondContact O-CA 3.39Å; I2265-V2277 HydrophobicContact CG2-CB 3.72Å; I2265-V2277 HydrophobicContact CG2-CG1 4.34Å; I2265-V2277 PolarHBondContact N-O 3.22Å; I2265-V2277 PolarHBondContact O-N 3.04Å; I2265-I2279 HydrophobicContact CB-CD1 4.38Å; I2265-I2279 HydrophobicContact CB-CG1 4.1Å; I2265-I2279 HydrophobicContact CD1-CG1 4.1Å; I2265-I2279 HydrophobicContact CG1-CD1 4.1Å; I2265-I2279 HydrophobicContact CG1-CG1 3.47Å; I2265-I2279 VanDerWaalsContact CG1-CG1 3.47Å; I2265-I2279 HydrophobicContact CG2-CG1 4.24Å; I2265-L2726 HydrophobicContact CD1-CD1 4.05Å; I2265-L2726 HydrophobicContact CD1-CD2 3.86Å; I2265-L2726 HydrophobicContact CG1-CD1 3.98Å; I2265-F2740 HydrophobicContact CD1-CE1 4.42Å; I2265-F2740 HydrophobicContact CD1-CZ 4.32Å; I2265-F2742 HydrophobicContact CD1-CB 4.41Å; I2265-F2742 HydrophobicContact CD1-CD1 3.63Å; I2265-F2742 HydrophobicContact CD1-CD2 3.61Å; I2265-F2742 HydrophobicContact CD1-CE1 3.64Å; I2265-F2742 HydrophobicContact CD1-CE2 3.64Å; I2265-F2742 HydrophobicContact CD1-CG 4.03Å; I2265-F2742 HydrophobicContact CD1-CZ 3.64Å; I2265-F2742 HydrophobicContact CG2-CE1 4.27Å; I2265-F2742 HydrophobicContact CG2-CZ 4.29Å
2266	I	90.2	Very high	85.6	Confident	2.6 Å²	2.6	20.5 Å²	20.5	1%	0.013	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	114.6	174.1	-52.3	173.8	0	0	0	107.6	Y2256 A2257 F2274 T2275 I2276 I2304 C2306 V2318 F2332	Y2256-I2266 CarbonylContact C-O 3.56Å; Y2256-I2266 WeakPolarHBondContact CA-O 3.34Å; Y2256-I2266 VanDerWaalsContact CB-O 3.31Å; Y2256-I2266 WeakPolarHBondContact CB-O 3.22Å; A2257-I2266 PolarHBondContact N-O 3.1Å; A2257-I2266 PolarHBondContact O-N 3.14Å; I2266-F2274 HydrophobicContact CG2-CB 4.46Å; I2266-F2274 HydrophobicContact CG2-CD2 4.07Å; I2266-T2275 CarbonylContact C-O 3.55Å; I2266-T2275 WeakPolarHBondContact CA-O 3.19Å; I2266-I2276 HydrophobicContact CD1-CD1 4.43Å; I2266-I2276 HydrophobicContact CG1-CD1 4.42Å; I2266-I2276 HydrophobicContact CG1-CG1 4.19Å; I2266-I2276 HydrophobicContact CG1-CG2 4.44Å; I2266-I2276 HydrophobicContact CG2-CG1 4.44Å; I2266-I2304 HydrophobicContact CB-CG2 4.41Å; I2266-I2304 HydrophobicContact CG2-CD1 4.18Å; I2266-I2304 HydrophobicContact CG2-CG2 4.2Å; I2266-C2306 VanDerWaalsContact CD1-SG 3.6Å; I2266-C2306 WeakPolarHBondContact CD1-SG 3.23Å; I2266-V2318 HydrophobicContact CD1-CG1 4.29Å; I2266-V2318 HydrophobicContact CD1-CG2 3.93Å; I2266-F2332 HydrophobicContact CD1-CD2 3.94Å; I2266-F2332 HydrophobicContact CD1-CE2 3.75Å; I2266-F2332 HydrophobicContact CG1-CE2 4.28Å
2267	I	89.6	Confident	85.5	Confident	3.8 Å²	3.8	20.1 Å²	20.1	2%	0.019	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.9	-177.2	-56	165.2	0	0	0	108.5	V2240 A2253 I2265 W2269 F2274 T2275 V2277 F2740	V2240-I2267 HydrophobicContact CB-CD1 4.32Å; V2240-I2267 HydrophobicContact CG1-CD1 4.11Å; V2240-I2267 HydrophobicContact CG2-CD1 4.06Å; A2253-I2267 HydrophobicContact CB-CG2 3.79Å; I2265-I2267 HydrophobicContact CB-CG1 4.35Å; I2265-I2267 HydrophobicContact CD1-CG1 4.34Å; I2265-I2267 HydrophobicContact CG1-CG1 4.19Å; I2265-I2267 HydrophobicContact CG2-CD1 4.42Å; I2265-I2267 HydrophobicContact CG2-CG1 4.24Å; I2267-W2269 HydrophobicContact CB-CZ2 4.31Å; I2267-W2269 HydrophobicContact CD1-CZ2 4.46Å; I2267-W2269 HydrophobicContact CG2-CD2 4.25Å; I2267-W2269 HydrophobicContact CG2-CH2 4.22Å; I2267-W2269 HydrophobicContact CG2-CZ2 3.76Å; I2267-F2274 CarbonylContact O-C 3.55Å; I2267-F2274 WeakPolarHBondContact O-CA 3.47Å; I2267-F2274 VanDerWaalsContact O-CB 3.31Å; I2267-F2274 WeakPolarHBondContact O-CB 3.38Å; I2267-T2275 PolarHBondContact N-O 3.25Å; I2267-T2275 PolarHBondContact O-N 3.16Å; I2267-V2277 HydrophobicContact CD1-CB 4.35Å; I2267-V2277 HydrophobicContact CD1-CG2 3.97Å; I2267-F2740 HydrophobicContact CD1-CD1 3.7Å; I2267-F2740 HydrophobicContact CD1-CE1 3.5Å; I2267-F2740 VanDerWaalsContact CD1-CE1 3.49Å; I2267-F2740 HydrophobicContact CD1-CZ 4.49Å; I2267-F2740 HydrophobicContact CG1-CD1 4.42Å; I2267-F2740 HydrophobicContact CG1-CE1 3.94Å; I2267-F2740 HydrophobicContact CG1-CZ 4.47Å; I2267-F2740 HydrophobicContact CG2-CD1 4.48Å
2268	G	88.8	Confident	85.2	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	138.9	171.9	0	0	0	0	0	111.2	A2253 T2254 T2255	A2253-G2268 WeakPolarHBondContact CA-O 3.39Å; T2254-G2268 PolarHBondContact N-O 3.11Å; T2254-G2268 PolarHBondContact OG1-O 2.9Å; T2254-G2268 VanDerWaalsContact OG1-O 3.09Å; T2255-G2268 PolarHBondContact O-N 2.97Å
2269	W	87.8	Confident	84.9	Confident	10.6 Å²	10.6	22 Å²	22	4%	0.04	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	158.4	-175.4	-56.6	97.2	0	0	0	111.8	V2240 R2242 I2251 L2252 A2253 I2267 D2271 G2272 L2273 T2275 V2301 F2740	V2240-W2269 HydrophobicContact CG1-CH2 4.39Å; V2240-W2269 HydrophobicContact CG1-CZ2 4.25Å; R2242-W2269 HydrophobicContact CB-CH2 4.49Å; I2251-W2269 HydrophobicContact CG2-CB 4.48Å; I2251-W2269 HydrophobicContact CG2-CD2 4.24Å; I2251-W2269 HydrophobicContact CG2-CE3 3.65Å; I2251-W2269 HydrophobicContact CG2-CZ3 4.25Å; L2252-W2269 CarbonylContact O-C 3.54Å; L2252-W2269 VanDerWaalsContact O-CA 3.32Å; L2252-W2269 WeakPolarHBondContact O-CA 3.38Å; A2253-W2269 HydrophobicContact CB-CE3 4.02Å; A2253-W2269 HydrophobicContact CB-CH2 4.4Å; A2253-W2269 HydrophobicContact CB-CZ3 3.85Å; I2267-W2269 HydrophobicContact CB-CZ2 4.31Å; I2267-W2269 HydrophobicContact CD1-CZ2 4.46Å; I2267-W2269 HydrophobicContact CG2-CD2 4.25Å; I2267-W2269 HydrophobicContact CG2-CH2 4.22Å; I2267-W2269 HydrophobicContact CG2-CZ2 3.76Å; W2269-D2271 VanDerWaalsContact CB-OD1 3.28Å; W2269-D2271 WeakPolarHBondContact CB-OD1 3.4Å; W2269-D2271 PolarHBondContact O-N 3.18Å; W2269-G2272 PolarHBondContact O-N 3.06Å; W2269-L2273 WeakPolarHBondContact CB-O 3.29Å; W2269-L2273 VanDerWaalsContact CD1-O 3.29Å; W2269-L2273 PolarHBondContact N-O 3.32Å; W2269-T2275 PolarHBondContact NE1-OG1 3.21Å; W2269-V2301 PolarHBondContact O-N 3.07Å; W2269-V2301 VanDerWaalsContact O-N 3.1Å; W2269-F2740 HydrophobicContact CH2-CB 4.27Å; W2269-F2740 HydrophobicContact CZ3-CB 4.38Å
2270	N	85.6	Confident	84.5	Confident	43.8 Å²	43.8	26.2 Å²	26.2	23%	0.234	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-14.2	178.3	69.3	-26.4	0	0	0	114.6	T2250 I2251 L2252 T2254 G2272 S2300	T2250-N2270 PolarHBondContact O-ND2 3.17Å; I2251-N2270 WeakPolarHBondContact CA-OD1 3.38Å; L2252-N2270 HydrophobicContact CB-CB 4.18Å; L2252-N2270 VanDerWaalsContact N-CG 3.34Å; L2252-N2270 PolarHBondContact N-ND2 3.02Å; L2252-N2270 PolarHBondContact N-OD1 3.22Å; L2252-N2270 VanDerWaalsContact N-OD1 3.13Å; L2252-N2270 PolarHBondContact O-N 3.01Å; L2252-N2270 PolarHBondContact O-OD1 3.13Å; T2254-N2270 HydrophobicContact CG2-CB 3.78Å; N2270-G2272 VanDerWaalsContact C-N 3.28Å; N2270-G2272 PolarHBondContact O-N 2.86Å; N2270-S2300 WeakPolarHBondContact CA-OG 3.28Å; N2270-S2300 VanDerWaalsContact O-CA 3.27Å; N2270-S2300 WeakPolarHBondContact O-CA 3.24Å; N2270-S2300 VanDerWaalsContact O-CB 3.31Å; N2270-S2300 WeakPolarHBondContact O-CB 3.34Å; N2270-S2300 PolarHBondContact O-N 3.28Å
2271	D	81.3	Confident	84.3	Confident	34 Å²	34	25.7 Å²	25.7	18%	0.182	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	5	175.1	68.3	-8.3	0	0	0	113.5	R2242 K2244 W2269 L2273 N2298	R2242-D2271 IonicContact CZ-OD1 3.22Å; R2242-D2271 IonicContact CZ-OD2 3.2Å; R2242-D2271 VanDerWaalsContact CZ-OD2 3.27Å; R2242-D2271 VanDerWaalsContact NH1-CG 3.25Å; R2242-D2271 IonicContact NH1-OD1 3Å; R2242-D2271 PolarHBondContact NH1-OD1 3.12Å; R2242-D2271 IonicContact NH1-OD2 2.9Å; R2242-D2271 PolarHBondContact NH1-OD2 3.16Å; R2242-D2271 IonicContact NH2-OD2 2.99Å; R2242-D2271 PolarHBondContact NH2-OD2 2.99Å; K2244-D2271 IonicContact NZ-OD2 2.68Å; K2244-D2271 PolarHBondContact NZ-OD2 2.91Å; W2269-D2271 VanDerWaalsContact CB-OD1 3.28Å; W2269-D2271 WeakPolarHBondContact CB-OD1 3.4Å; W2269-D2271 PolarHBondContact O-N 3.18Å; D2271-L2273 VanDerWaalsContact C-N 3.3Å; D2271-L2273 PolarHBondContact O-N 3.38Å; D2271-L2273 WeakPolarHBondContact OD1-CB 3.32Å; D2271-L2273 PolarHBondContact OD1-N 3.04Å; D2271-L2273 VanDerWaalsContact OD1-N 3.16Å; D2271-L2273 WeakPolarHBondContact OD2-CD1 3.14Å; D2271-N2298 CarbonylContact O-C 3.56Å; D2271-N2298 WeakPolarHBondContact O-CA 3.44Å
2272	G	81.9	Confident	84.3	Confident	5.8 Å²	5.8	24.1 Å²	24.1	6%	0.06	13%	0.133	C	C	.	.	S	Bend	trans	88.3	0.5	177.1	0	0	0	0	0	115.4	W2269 N2270 S2299 V2301 W2322	W2269-G2272 PolarHBondContact O-N 3.06Å; N2270-G2272 VanDerWaalsContact C-N 3.28Å; N2270-G2272 PolarHBondContact O-N 2.86Å; G2272-S2299 WeakPolarHBondContact CA-O 3.33Å; G2272-S2299 PolarHBondContact N-O 3.23Å; G2272-V2301 VanDerWaalsContact C-CG2 3.48Å; G2272-V2301 WeakPolarHBondContact O-CG2 3.38Å; G2272-W2322 PolarHBondContact O-NE1 2.94Å; G2272-W2322 VanDerWaalsContact O-NE1 3.08Å
2273	L	86.6	Confident	84.4	Confident	38 Å²	38	29.6 Å²	29.6	20%	0.199	16%	0.157	C	C	.	.			trans	-99	162.6	179.8	-62	164.3	0	0	0	110.9	R2242 W2269 D2271 S2288 D2289 I2295 V2301	R2242-L2273 VanDerWaalsContact NH2-CB 3.31Å; W2269-L2273 WeakPolarHBondContact CB-O 3.29Å; W2269-L2273 VanDerWaalsContact CD1-O 3.29Å; W2269-L2273 PolarHBondContact N-O 3.32Å; D2271-L2273 VanDerWaalsContact C-N 3.3Å; D2271-L2273 PolarHBondContact O-N 3.38Å; D2271-L2273 WeakPolarHBondContact OD1-CB 3.32Å; D2271-L2273 PolarHBondContact OD1-N 3.04Å; D2271-L2273 VanDerWaalsContact OD1-N 3.16Å; D2271-L2273 WeakPolarHBondContact OD2-CD1 3.14Å; L2273-S2288 VanDerWaalsContact CA-OG 3.32Å; L2273-S2288 WeakPolarHBondContact CA-OG 3.34Å; L2273-S2288 WeakPolarHBondContact CB-OG 3.27Å; L2273-S2288 VanDerWaalsContact CD2-OG 3.25Å; L2273-S2288 WeakPolarHBondContact CD2-OG 3.23Å; L2273-D2289 HydrophobicContact CD1-CB 4.25Å; L2273-D2289 WeakPolarHBondContact CD1-OD1 3.34Å; L2273-I2295 HydrophobicContact CD2-CG2 4.32Å; L2273-V2301 WeakPolarHBondContact O-CG2 3.34Å
2274	F	88.2	Confident	84.4	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.009	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	153.9	171.3	67.2	-92.8	0	0	0	111.7	I2266 I2267 F2286 S2288 L2291 I2295 I2304 V2320 Y2330 F2332	I2266-F2274 HydrophobicContact CG2-CB 4.46Å; I2266-F2274 HydrophobicContact CG2-CD2 4.07Å; I2267-F2274 CarbonylContact O-C 3.55Å; I2267-F2274 WeakPolarHBondContact O-CA 3.47Å; I2267-F2274 VanDerWaalsContact O-CB 3.31Å; I2267-F2274 WeakPolarHBondContact O-CB 3.38Å; F2274-F2286 HydrophobicContact CE2-CD1 4.32Å; F2274-F2286 AromaticContact CE2-CE1 3.79Å; F2274-F2286 HydrophobicContact CE2-CE1 4.03Å; F2274-F2286 HydrophobicContact CZ-CE1 4.42Å; F2274-S2288 PolarHBondContact N-OG 2.97Å; F2274-S2288 WeakPolarHBondContact O-CB 3.35Å; F2274-S2288 PolarHBondContact O-N 2.95Å; F2274-S2288 PolarHBondContact O-OG 3.19Å; F2274-L2291 HydrophobicContact CZ-CD1 4.35Å; F2274-I2295 HydrophobicContact CE1-CD1 4.29Å; F2274-I2304 HydrophobicContact CB-CD1 4.3Å; F2274-V2320 HydrophobicContact CD1-CG2 4.48Å; F2274-Y2330 HydrophobicContact CE1-CE2 4.26Å; F2274-Y2330 HydrophobicContact CZ-CE2 4.4Å; F2274-F2332 HydrophobicContact CE2-CE1 4.26Å; F2274-F2332 HydrophobicContact CE2-CE2 4.35Å; F2274-F2332 AromaticContact CE2-CZ 3.62Å; F2274-F2332 HydrophobicContact CE2-CZ 3.62Å; F2274-F2332 HydrophobicContact CZ-CE1 4.4Å; F2274-F2332 AromaticContact CZ-CZ 3.87Å; F2274-F2332 HydrophobicContact CZ-CZ 3.87Å
2275	T	88.3	Confident	84.2	Confident	3.6 Å²	3.6	31.2 Å²	31.2	2%	0.022	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	144.3	179.6	53.3	0	0	0	0	110.9	I2266 I2267 W2269 F2286	I2266-T2275 CarbonylContact C-O 3.55Å; I2266-T2275 WeakPolarHBondContact CA-O 3.19Å; I2267-T2275 PolarHBondContact N-O 3.25Å; I2267-T2275 PolarHBondContact O-N 3.16Å; W2269-T2275 PolarHBondContact NE1-OG1 3.21Å; T2275-F2286 CarbonylContact C-O 3.54Å; T2275-F2286 VanDerWaalsContact CA-O 3.26Å; T2275-F2286 WeakPolarHBondContact CA-O 3.41Å; T2275-F2286 WeakPolarHBondContact CB-O 3.4Å
2276	I	88.4	Confident	84	Confident	0.4 Å²	0.4	32.1 Å²	32.1	0%	0.002	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.8	174.2	-50.4	-178.1	0	0	0	108.5	H2264 I2265 I2266 T2284 I2285 F2286 F2332 F2334 V2358 I2360	H2264-I2276 HydrophobicContact CB-CG2 3.95Å; I2265-I2276 CarbonylContact O-C 3.52Å; I2265-I2276 VanDerWaalsContact O-CA 3.31Å; I2265-I2276 WeakPolarHBondContact O-CA 3.39Å; I2266-I2276 HydrophobicContact CD1-CD1 4.43Å; I2266-I2276 HydrophobicContact CG1-CD1 4.42Å; I2266-I2276 HydrophobicContact CG1-CG1 4.19Å; I2266-I2276 HydrophobicContact CG1-CG2 4.44Å; I2266-I2276 HydrophobicContact CG2-CG1 4.44Å; I2276-T2284 CarbonylContact O-C 3.49Å; I2276-I2285 PolarHBondContact O-N 3.16Å; I2276-F2286 HydrophobicContact CB-CB 4.09Å; I2276-F2286 HydrophobicContact CD1-CB 4.22Å; I2276-F2286 HydrophobicContact CD1-CD1 4.2Å; I2276-F2286 HydrophobicContact CD1-CG 4.47Å; I2276-F2286 HydrophobicContact CG1-CB 4.19Å; I2276-F2286 HydrophobicContact CG1-CD1 4.24Å; I2276-F2286 PolarHBondContact N-O 3.05Å; I2276-F2286 PolarHBondContact O-N 3.01Å; I2276-F2286 VanDerWaalsContact O-N 3.16Å; I2276-F2332 HydrophobicContact CD1-CD1 3.64Å; I2276-F2332 HydrophobicContact CD1-CD2 4.19Å; I2276-F2332 HydrophobicContact CD1-CE1 3.95Å; I2276-F2332 HydrophobicContact CD1-CE2 4.1Å; I2276-F2332 HydrophobicContact CD1-CG 4.43Å; I2276-F2332 HydrophobicContact CD1-CZ 4.39Å; I2276-F2334 HydrophobicContact CG2-CE1 4.28Å; I2276-F2334 HydrophobicContact CG2-CZ 4.27Å; I2276-V2358 HydrophobicContact CD1-CG1 4.38Å; I2276-I2360 HydrophobicContact CD1-CD1 4.33Å
2277	V	87.3	Confident	83.6	Confident	0.2 Å²	0.2	33.1 Å²	33.1	0%	0.001	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.2	-174	-178.2	0	0	0	0	109.8	V2240 H2264 I2265 I2267 G2282 E2283 T2284 F2742	V2240-V2277 HydrophobicContact CG1-CG2 3.94Å; V2240-V2277 HydrophobicContact CG2-CG1 4.16Å; V2240-V2277 HydrophobicContact CG2-CG2 4.29Å; H2264-V2277 CarbonylContact C-O 3.54Å; H2264-V2277 VanDerWaalsContact CA-O 3.3Å; H2264-V2277 WeakPolarHBondContact CA-O 3.38Å; I2265-V2277 HydrophobicContact CG2-CB 3.72Å; I2265-V2277 HydrophobicContact CG2-CG1 4.34Å; I2265-V2277 PolarHBondContact N-O 3.22Å; I2265-V2277 PolarHBondContact O-N 3.04Å; I2267-V2277 HydrophobicContact CD1-CB 4.35Å; I2267-V2277 HydrophobicContact CD1-CG2 3.97Å; V2277-G2282 VanDerWaalsContact CG1-C 3.41Å; V2277-G2282 VanDerWaalsContact CG1-O 3.27Å; V2277-G2282 WeakPolarHBondContact CG1-O 3.35Å; V2277-E2283 CarbonylContact C-O 3.57Å; V2277-E2283 VanDerWaalsContact CA-O 3.31Å; V2277-E2283 WeakPolarHBondContact CA-O 3.36Å; V2277-E2283 WeakPolarHBondContact CG1-O 3.39Å; V2277-T2284 HydrophobicContact CG2-CG2 4.02Å; V2277-F2742 HydrophobicContact CG1-CE1 4.27Å; V2277-F2742 HydrophobicContact CG1-CZ 4.49Å
2278	L	84.3	Confident	83.2	Confident	37.2 Å²	37.2	33.2 Å²	33.2	20%	0.195	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	128.6	173.5	-170.5	67.6	0	0	0	110.3	K2263 T2280 N2281 G2282 E2283 I2285	K2263-L2278 WeakPolarHBondContact O-CD1 3.25Å; L2278-T2280 VanDerWaalsContact C-N 3.31Å; L2278-T2280 VanDerWaalsContact CD2-OG1 3.25Å; L2278-T2280 WeakPolarHBondContact CD2-OG1 3.29Å; L2278-T2280 WeakPolarHBondContact CG-OG1 3.33Å; L2278-T2280 PolarHBondContact O-N 3.25Å; L2278-N2281 WeakPolarHBondContact CB-OD1 3.35Å; L2278-N2281 WeakPolarHBondContact CD2-OD1 3.36Å; L2278-G2282 VanDerWaalsContact O-CA 3.28Å; L2278-G2282 WeakPolarHBondContact O-CA 3.37Å; L2278-G2282 PolarHBondContact O-N 2.94Å; L2278-E2283 PolarHBondContact N-O 3.14Å; L2278-I2285 HydrophobicContact CB-CD1 4.09Å; L2278-I2285 HydrophobicContact CB-CG1 4.33Å; L2278-I2285 HydrophobicContact CD1-CD1 4.34Å
2279	I	81.8	Confident	82.5	Confident	21 Å²	21	36.7 Å²	36.7	11%	0.108	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-30.7	-174.6	-69.6	171.2	0	0	0	112.2	I2238 I2258 G2262 K2263 I2265 F2588 L2726 F2742 V2744	I2238-I2279 VanDerWaalsContact CD1-O 3.28Å; I2238-I2279 WeakPolarHBondContact CD1-O 3.25Å; I2258-I2279 HydrophobicContact CG1-CD1 4.41Å; I2258-I2279 HydrophobicContact CG2-CD1 3.97Å; G2262-I2279 WeakPolarHBondContact O-CD1 3.36Å; K2263-I2279 WeakPolarHBondContact O-CB 3.4Å; K2263-I2279 WeakPolarHBondContact O-CG1 3.3Å; K2263-I2279 PolarHBondContact O-N 3.2Å; I2265-I2279 HydrophobicContact CB-CD1 4.38Å; I2265-I2279 HydrophobicContact CB-CG1 4.1Å; I2265-I2279 HydrophobicContact CD1-CG1 4.1Å; I2265-I2279 HydrophobicContact CG1-CD1 4.1Å; I2265-I2279 HydrophobicContact CG1-CG1 3.47Å; I2265-I2279 VanDerWaalsContact CG1-CG1 3.47Å; I2265-I2279 HydrophobicContact CG2-CG1 4.24Å; I2279-F2588 HydrophobicContact CD1-CZ 4.48Å; I2279-F2588 HydrophobicContact CG2-CZ 4.4Å; I2279-L2726 HydrophobicContact CD1-CD1 3.89Å; I2279-L2726 HydrophobicContact CG1-CD1 4Å; I2279-L2726 HydrophobicContact CG2-CD1 4.15Å; I2279-F2742 HydrophobicContact CB-CE2 4.49Å; I2279-F2742 HydrophobicContact CG2-CE2 4.36Å; I2279-F2742 WeakPolarHBondContact O-CE2 3.33Å; I2279-V2744 HydrophobicContact CG2-CG2 3.7Å
2280	T	74.2	Confident	81.4	Confident	95 Å²	95	44.3 Å²	44.3	58%	0.583	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-34	-172.8	52.9	0	0	0	0	114.2	L2278	L2278-T2280 VanDerWaalsContact C-N 3.31Å; L2278-T2280 VanDerWaalsContact CD2-OG1 3.25Å; L2278-T2280 WeakPolarHBondContact CD2-OG1 3.29Å; L2278-T2280 WeakPolarHBondContact CG-OG1 3.33Å; L2278-T2280 PolarHBondContact O-N 3.25Å
2281	N	75.1	Confident	80.5	Confident	83.8 Å²	83.8	44.4 Å²	44.4	45%	0.448	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.3	-9	-174.9	69	-4.1	0	0	0	114.2	L2278 E2283	L2278-N2281 WeakPolarHBondContact CB-OD1 3.35Å; L2278-N2281 WeakPolarHBondContact CD2-OD1 3.36Å; N2281-E2283 VanDerWaalsContact C-N 3.3Å; N2281-E2283 WeakPolarHBondContact ND2-CB 3.39Å; N2281-E2283 WeakPolarHBondContact ND2-CG 3.44Å; N2281-E2283 PolarHBondContact ND2-OE2 3.16Å; N2281-E2283 VanDerWaalsContact ND2-OE2 3.11Å; N2281-E2283 VanDerWaalsContact OD1-CB 3.24Å; N2281-E2283 WeakPolarHBondContact OD1-CB 3.36Å; N2281-E2283 PolarHBondContact OD1-N 2.93Å
2282	G	76.2	Confident	79.2	Confident	14.2 Å²	14.2	48.8 Å²	48.8	15%	0.146	26%	0.258	C	S	.	.			trans	78.8	11.1	-177.6	0	0	0	0	0	115.5	V2277 L2278 T2284	V2277-G2282 VanDerWaalsContact CG1-C 3.41Å; V2277-G2282 VanDerWaalsContact CG1-O 3.27Å; V2277-G2282 WeakPolarHBondContact CG1-O 3.35Å; L2278-G2282 VanDerWaalsContact O-CA 3.28Å; L2278-G2282 WeakPolarHBondContact O-CA 3.37Å; L2278-G2282 PolarHBondContact O-N 2.94Å; G2282-T2284 PolarHBondContact O-N 3.41Å
2283	E	79.9	Confident	77.7	Confident	121.6 Å²	121.6	53.4 Å²	53.4	57%	0.568	29%	0.287	S	S	*	.			trans	-74	130.7	-177.9	-156.4	177.3	173.8	0	0	111.8	V2277 L2278 N2281 I2285	V2277-E2283 CarbonylContact C-O 3.57Å; V2277-E2283 VanDerWaalsContact CA-O 3.31Å; V2277-E2283 WeakPolarHBondContact CA-O 3.36Å; V2277-E2283 WeakPolarHBondContact CG1-O 3.39Å; L2278-E2283 PolarHBondContact N-O 3.14Å; N2281-E2283 VanDerWaalsContact C-N 3.3Å; N2281-E2283 WeakPolarHBondContact ND2-CB 3.39Å; N2281-E2283 WeakPolarHBondContact ND2-CG 3.44Å; N2281-E2283 PolarHBondContact ND2-OE2 3.16Å; N2281-E2283 VanDerWaalsContact ND2-OE2 3.11Å; N2281-E2283 VanDerWaalsContact OD1-CB 3.24Å; N2281-E2283 WeakPolarHBondContact OD1-CB 3.36Å; N2281-E2283 PolarHBondContact OD1-N 2.93Å; E2283-I2285 PolarHBondContact O-N 2.91Å; E2283-I2285 VanDerWaalsContact O-N 3.15Å
2284	T	81.3	Confident	76.1	Confident	77.4 Å²	77.4	57.4 Å²	57.4	48%	0.475	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	101.7	177.2	55.5	0	0	0	0	110.3	V2240 I2276 V2277 G2282	V2240-T2284 HydrophobicContact CG1-CG2 4.2Å; I2276-T2284 CarbonylContact O-C 3.49Å; V2277-T2284 HydrophobicContact CG2-CG2 4.02Å; G2282-T2284 PolarHBondContact O-N 3.41Å
2285	I	82.9	Confident	74.5	Confident	52.8 Å²	52.8	58.6 Å²	58.6	27%	0.271	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	-41.4	178.6	-49.6	177.2	0	0	0	110.6	H2264 I2276 L2278 E2283 F2334 V2358	H2264-I2285 VanDerWaalsContact CD2-CD1 3.43Å; H2264-I2285 WeakPolarHBondContact CD2-CD1 3.39Å; I2276-I2285 PolarHBondContact O-N 3.16Å; L2278-I2285 HydrophobicContact CB-CD1 4.09Å; L2278-I2285 HydrophobicContact CB-CG1 4.33Å; L2278-I2285 HydrophobicContact CD1-CD1 4.34Å; E2283-I2285 PolarHBondContact O-N 2.91Å; E2283-I2285 VanDerWaalsContact O-N 3.15Å; I2285-F2334 HydrophobicContact CD1-CE1 4.37Å; I2285-V2358 HydrophobicContact CB-CG2 4.43Å; I2285-V2358 HydrophobicContact CG2-CG2 3.4Å; I2285-V2358 VanDerWaalsContact CG2-CG2 3.47Å
2286	F	83.3	Confident	72.9	Confident	26.6 Å²	26.6	64.9 Å²	64.9	12%	0.117	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	146.8	-175.7	-178.9	-96.1	0	0	0	112.3	F2274 T2275 I2276 S2288 K2290 L2291 V2358 I2360	F2274-F2286 HydrophobicContact CE2-CD1 4.32Å; F2274-F2286 AromaticContact CE2-CE1 3.79Å; F2274-F2286 HydrophobicContact CE2-CE1 4.03Å; F2274-F2286 HydrophobicContact CZ-CE1 4.42Å; T2275-F2286 CarbonylContact C-O 3.54Å; T2275-F2286 VanDerWaalsContact CA-O 3.26Å; T2275-F2286 WeakPolarHBondContact CA-O 3.41Å; T2275-F2286 WeakPolarHBondContact CB-O 3.4Å; I2276-F2286 HydrophobicContact CB-CB 4.09Å; I2276-F2286 HydrophobicContact CD1-CB 4.22Å; I2276-F2286 HydrophobicContact CD1-CD1 4.2Å; I2276-F2286 HydrophobicContact CD1-CG 4.47Å; I2276-F2286 HydrophobicContact CG1-CB 4.19Å; I2276-F2286 HydrophobicContact CG1-CD1 4.24Å; I2276-F2286 PolarHBondContact N-O 3.05Å; I2276-F2286 PolarHBondContact O-N 3.01Å; I2276-F2286 VanDerWaalsContact O-N 3.16Å; F2286-S2288 VanDerWaalsContact CE1-N 3.29Å; F2286-K2290 HydrophobicContact CD2-CD 4.44Å; F2286-K2290 HydrophobicContact CE2-CB 4.18Å; F2286-K2290 HydrophobicContact CE2-CD 4.25Å; F2286-K2290 HydrophobicContact CZ-CB 4.39Å; F2286-L2291 HydrophobicContact CE1-CD1 4.11Å; F2286-L2291 HydrophobicContact CZ-CD1 3.78Å; F2286-L2291 HydrophobicContact CZ-CD2 4.23Å; F2286-L2291 HydrophobicContact CZ-CG 3.92Å; F2286-V2358 HydrophobicContact CB-CG2 4.47Å; F2286-I2360 HydrophobicContact CD1-CD1 3.5Å; F2286-I2360 VanDerWaalsContact CD1-CD1 3.5Å; F2286-I2360 HydrophobicContact CD2-CD1 3.8Å; F2286-I2360 HydrophobicContact CE1-CD1 3.27Å; F2286-I2360 HydrophobicContact CE2-CD1 3.59Å; F2286-I2360 VanDerWaalsContact CE2-CD1 3.46Å; F2286-I2360 HydrophobicContact CG-CD1 3.77Å; F2286-I2360 HydrophobicContact CZ-CD1 3.32Å
2287	S	82.8	Confident	71.6	Confident	23.4 Å²	23.4	66.5 Å²	66.5	16%	0.164	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	133.7	170.2	179.1	0	0	0	0	109.1	D2289 K2290	S2287-D2289 WeakPolarHBondContact CB-OD1 3.29Å; S2287-D2289 PolarHBondContact O-N 3.14Å; S2287-D2289 VanDerWaalsContact OG-CG 3.26Å; S2287-D2289 PolarHBondContact OG-N 3.07Å; S2287-D2289 PolarHBondContact OG-OD1 3.04Å; S2287-D2289 PolarHBondContact OG-OD2 3.06Å; S2287-K2290 PolarHBondContact O-N 2.95Å; S2287-K2290 VanDerWaalsContact O-N 3.16Å
2288	S	80.8	Confident	70.8	Confident	5.6 Å²	5.6	72.9 Å²	72.9	4%	0.039	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-67.3	-5.9	-178.2	61.8	0	0	0	0	114.1	L2273 F2274 F2286 K2290 L2291 I2292	L2273-S2288 VanDerWaalsContact CA-OG 3.32Å; L2273-S2288 WeakPolarHBondContact CA-OG 3.34Å; L2273-S2288 WeakPolarHBondContact CB-OG 3.27Å; L2273-S2288 VanDerWaalsContact CD2-OG 3.25Å; L2273-S2288 WeakPolarHBondContact CD2-OG 3.23Å; F2274-S2288 PolarHBondContact N-OG 2.97Å; F2274-S2288 WeakPolarHBondContact O-CB 3.35Å; F2274-S2288 PolarHBondContact O-N 2.95Å; F2274-S2288 PolarHBondContact O-OG 3.19Å; F2286-S2288 VanDerWaalsContact CE1-N 3.29Å; S2288-K2290 PolarHBondContact O-N 3.08Å; S2288-K2290 VanDerWaalsContact O-N 3.1Å; S2288-L2291 WeakPolarHBondContact O-CA 3.17Å; S2288-L2291 WeakPolarHBondContact O-CB 3.3Å; S2288-L2291 PolarHBondContact O-N 3.05Å; S2288-I2292 PolarHBondContact O-N 2.74Å
2289	D	74.3	Confident	70.7	Confident	74.6 Å²	74.6	72.2 Å²	72.2	40%	0.399	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-56.7	-23	169.4	-16.6	-21.2	0	0	0	112.8	R2242 K2244 L2273 S2287 L2291 I2292	R2242-D2289 IonicContact CZ-OD1 3.47Å; R2242-D2289 IonicContact CZ-OD2 3.33Å; R2242-D2289 IonicContact NE-OD2 4Å; R2242-D2289 IonicContact NH2-OD1 3.49Å; R2242-D2289 PolarHBondContact NH2-OD1 3.26Å; R2242-D2289 IonicContact NH2-OD2 3.17Å; R2242-D2289 PolarHBondContact NH2-OD2 3.38Å; K2244-D2289 WeakPolarHBondContact CE-OD1 3.47Å; K2244-D2289 WeakPolarHBondContact CE-OD2 3.46Å; K2244-D2289 IonicContact NZ-OD1 3.16Å; K2244-D2289 PolarHBondContact NZ-OD1 2.75Å; K2244-D2289 IonicContact NZ-OD2 3.07Å; K2244-D2289 PolarHBondContact NZ-OD2 2.87Å; L2273-D2289 HydrophobicContact CD1-CB 4.25Å; L2273-D2289 WeakPolarHBondContact CD1-OD1 3.34Å; S2287-D2289 WeakPolarHBondContact CB-OD1 3.29Å; S2287-D2289 PolarHBondContact O-N 3.14Å; S2287-D2289 VanDerWaalsContact OG-CG 3.26Å; S2287-D2289 PolarHBondContact OG-N 3.07Å; S2287-D2289 PolarHBondContact OG-OD1 3.04Å; S2287-D2289 PolarHBondContact OG-OD2 3.06Å; D2289-L2291 VanDerWaalsContact C-N 3.34Å; D2289-L2291 PolarHBondContact O-N 2.9Å; D2289-I2292 HydrophobicContact CB-CD1 3.86Å; D2289-I2292 HydrophobicContact CB-CG1 4.46Å; D2289-I2292 VanDerWaalsContact O-CD1 3.28Å; D2289-I2292 WeakPolarHBondContact O-CD1 3.19Å; D2289-I2292 VanDerWaalsContact O-CG1 3.3Å; D2289-I2292 WeakPolarHBondContact O-CG1 3.3Å
2290	K	64.4	Low	70.9	Confident	169.6 Å²	169.6	72.6 Å²	72.6	74%	0.737	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-80.6	-13.3	174.2	-64.7	-177.9	-179	177.2	0	114.1	F2286 S2287 S2288 I2292	F2286-K2290 HydrophobicContact CD2-CD 4.44Å; F2286-K2290 HydrophobicContact CE2-CB 4.18Å; F2286-K2290 HydrophobicContact CE2-CD 4.25Å; F2286-K2290 HydrophobicContact CZ-CB 4.39Å; S2287-K2290 PolarHBondContact O-N 2.95Å; S2287-K2290 VanDerWaalsContact O-N 3.16Å; S2288-K2290 PolarHBondContact O-N 3.08Å; S2288-K2290 VanDerWaalsContact O-N 3.1Å; K2290-I2292 PolarHBondContact O-N 3.25Å
2291	L	66.2	Low	71.6	Confident	46.2 Å²	46.2	68.1 Å²	68.1	24%	0.242	37%	0.366	C	S	.	.	S	Bend	trans	-89.3	89	177	-67.8	164.2	0	0	0	109.5	F2274 F2286 S2288 D2289 P2293 L2294 I2295 I2360	F2274-L2291 HydrophobicContact CZ-CD1 4.35Å; F2286-L2291 HydrophobicContact CE1-CD1 4.11Å; F2286-L2291 HydrophobicContact CZ-CD1 3.78Å; F2286-L2291 HydrophobicContact CZ-CD2 4.23Å; F2286-L2291 HydrophobicContact CZ-CG 3.92Å; S2288-L2291 WeakPolarHBondContact O-CA 3.17Å; S2288-L2291 WeakPolarHBondContact O-CB 3.3Å; S2288-L2291 PolarHBondContact O-N 3.05Å; D2289-L2291 VanDerWaalsContact C-N 3.34Å; D2289-L2291 PolarHBondContact O-N 2.9Å; L2291-P2293 VanDerWaalsContact C-N 3.32Å; L2291-P2293 VanDerWaalsContact O-CD 3.32Å; L2291-P2293 WeakPolarHBondContact O-CD 3.44Å; L2291-P2293 VanDerWaalsContact O-N 3.13Å; L2291-L2294 HydrophobicContact CD2-CD1 4.13Å; L2291-L2294 WeakPolarHBondContact O-CA 3.26Å; L2291-L2294 WeakPolarHBondContact O-CB 3.14Å; L2291-L2294 PolarHBondContact O-N 2.88Å; L2291-I2295 HydrophobicContact CB-CD1 3.96Å; L2291-I2295 HydrophobicContact CB-CG1 4.35Å; L2291-I2295 HydrophobicContact CD1-CD1 4.47Å; L2291-I2295 PolarHBondContact O-N 3.15Å; L2291-I2360 HydrophobicContact CD1-CD1 4.38Å; L2291-I2360 HydrophobicContact CD1-CG2 4.36Å; L2291-I2360 HydrophobicContact CD2-CG2 4.43Å
2292	I	55	Low	72.3	Confident	124.8 Å²	124.8	66.7 Å²	66.7	64%	0.64	36%	0.357	S	S	*	.			trans	-51.7	86.1	177.4	-66.2	167.6	0	0	0	110.3	S2288 D2289 K2290 L2294 I2295	S2288-I2292 PolarHBondContact O-N 2.74Å; D2289-I2292 HydrophobicContact CB-CD1 3.86Å; D2289-I2292 HydrophobicContact CB-CG1 4.46Å; D2289-I2292 VanDerWaalsContact O-CD1 3.28Å; D2289-I2292 WeakPolarHBondContact O-CD1 3.19Å; D2289-I2292 VanDerWaalsContact O-CG1 3.3Å; D2289-I2292 WeakPolarHBondContact O-CG1 3.3Å; K2290-I2292 PolarHBondContact O-N 3.25Å; I2292-L2294 VanDerWaalsContact C-N 3.28Å; I2292-L2294 PolarHBondContact O-N 2.94Å; I2292-L2294 VanDerWaalsContact O-N 3.16Å; I2292-I2295 CarbonylContact O-C 3.57Å; I2292-I2295 PolarHBondContact O-N 3.29Å
2293	P	50.2	Low	73	Confident	102.4 Å²	102.4	66.3 Å²	66.3	67%	0.665	35%	0.352	S	S	*	.			trans	-66.5	58.7	177	26.5	-33.1	0	0	0	109.8	L2291 I2295	L2291-P2293 VanDerWaalsContact C-N 3.32Å; L2291-P2293 VanDerWaalsContact O-CD 3.32Å; L2291-P2293 WeakPolarHBondContact O-CD 3.44Å; L2291-P2293 VanDerWaalsContact O-N 3.13Å; P2293-I2295 PolarHBondContact O-N 3.13Å
2294	L	53.5	Low	73.6	Confident	122.6 Å²	122.6	60.7 Å²	60.7	64%	0.642	33%	0.326	S	S	*	.	S	Bend	trans	-79.1	-18.5	174.9	-86	128.5	0	0	0	111.4	L2291 I2292 R2328 P2362	L2291-L2294 HydrophobicContact CD2-CD1 4.13Å; L2291-L2294 WeakPolarHBondContact O-CA 3.26Å; L2291-L2294 WeakPolarHBondContact O-CB 3.14Å; L2291-L2294 PolarHBondContact O-N 2.88Å; I2292-L2294 VanDerWaalsContact C-N 3.28Å; I2292-L2294 PolarHBondContact O-N 2.94Å; I2292-L2294 VanDerWaalsContact O-N 3.16Å; L2294-R2328 PolarHBondContact O-NH1 3.01Å; L2294-P2362 HydrophobicContact CD1-CG 4.31Å; L2294-P2362 HydrophobicContact CD2-CG 4.35Å
2295	I	54.2	Low	74.1	Confident	27.4 Å²	27.4	58.2 Å²	58.2	14%	0.141	31%	0.312	C	S	.	.	S	Bend	trans	-135.9	113.2	-177.2	-53.5	174.6	0	0	0	109.6	L2273 F2274 L2291 I2292 P2293 D2297 W2322 R2328 T2365 W2367 N2376	L2273-I2295 HydrophobicContact CD2-CG2 4.32Å; F2274-I2295 HydrophobicContact CE1-CD1 4.29Å; L2291-I2295 HydrophobicContact CB-CD1 3.96Å; L2291-I2295 HydrophobicContact CB-CG1 4.35Å; L2291-I2295 HydrophobicContact CD1-CD1 4.47Å; L2291-I2295 PolarHBondContact O-N 3.15Å; I2292-I2295 CarbonylContact O-C 3.57Å; I2292-I2295 PolarHBondContact O-N 3.29Å; P2293-I2295 PolarHBondContact O-N 3.13Å; I2295-D2297 HydrophobicContact CG2-CB 4.02Å; I2295-D2297 PolarHBondContact O-N 3.16Å; I2295-W2322 HydrophobicContact CG2-CZ2 4.28Å; I2295-R2328 VanDerWaalsContact CD1-NH2 3.29Å; I2295-T2365 HydrophobicContact CD1-CG2 4.48Å; I2295-W2367 HydrophobicContact CD1-CH2 4.23Å; I2295-W2367 HydrophobicContact CD1-CZ2 3.63Å; I2295-W2367 VanDerWaalsContact CD1-CZ2 3.41Å; I2295-W2367 HydrophobicContact CG1-CZ2 4.5Å; I2295-W2367 HydrophobicContact CG2-CH2 4.4Å; I2295-W2367 HydrophobicContact CG2-CZ2 4.12Å; I2295-N2376 WeakPolarHBondContact CG2-OD1 3.34Å
2296	N	55.5	Low	74.4	Confident	136.8 Å²	136.8	56.7 Å²	56.7	73%	0.732	31%	0.305	S	S	*	.			trans	-77.4	12.8	178.8	-82.7	-8.5	0	0	0	114.7	N2298	N2296-N2298 PolarHBondContact O-N 2.97Å; N2296-N2298 VanDerWaalsContact O-N 3.12Å
2297	D	60.4	Low	74.5	Confident	33.4 Å²	33.4	55.7 Å²	55.7	18%	0.179	30%	0.303	C	S	.	.			trans	-83.5	94.2	-178.5	-88.6	-34.5	0	0	0	111	I2295 S2299 W2322 S2324 R2328 W2367	I2295-D2297 HydrophobicContact CG2-CB 4.02Å; I2295-D2297 PolarHBondContact O-N 3.16Å; D2297-S2299 PolarHBondContact O-N 2.95Å; D2297-S2299 VanDerWaalsContact O-N 3.13Å; D2297-W2322 HydrophobicContact CB-CG 4.3Å; D2297-S2324 VanDerWaalsContact OD1-CB 3.27Å; D2297-S2324 WeakPolarHBondContact OD1-CB 3.3Å; D2297-S2324 PolarHBondContact OD1-OG 3.14Å; D2297-S2324 WeakPolarHBondContact OD2-CB 3.31Å; D2297-S2324 PolarHBondContact OD2-OG 2.97Å; D2297-S2324 VanDerWaalsContact OD2-OG 3.1Å; D2297-R2328 IonicContact OD2-CZ 3.05Å; D2297-R2328 IonicContact OD2-NE 3.6Å; D2297-R2328 IonicContact OD2-NH1 4Å; D2297-R2328 PolarHBondContact OD2-NH1 2.98Å; D2297-R2328 IonicContact OD2-NH2 3.18Å; D2297-R2328 PolarHBondContact OD2-NH2 2.95Å; D2297-W2367 HydrophobicContact CB-CH2 4.45Å; D2297-W2367 WeakPolarHBondContact OD1-CH2 3.39Å; D2297-W2367 VanDerWaalsContact OD1-CZ3 3.3Å; D2297-W2367 WeakPolarHBondContact OD1-CZ3 3.49Å; D2297-W2367 VanDerWaalsContact OD2-CH2 3.25Å; D2297-W2367 WeakPolarHBondContact OD2-CH2 3.31Å; D2297-W2367 WeakPolarHBondContact OD2-CZ3 3.17Å
2298	N	69.8	Low	74.4	Confident	134.4 Å²	134.4	57.7 Å²	57.7	72%	0.719	31%	0.311	S	S	*	.			trans	-74	28.2	168.5	-69	-11.6	0	0	0	112.4	D2271 N2296	D2271-N2298 CarbonylContact O-C 3.56Å; D2271-N2298 WeakPolarHBondContact O-CA 3.44Å; N2296-N2298 PolarHBondContact O-N 2.97Å; N2296-N2298 VanDerWaalsContact O-N 3.12Å
2299	S	82.1	Confident	74.4	Confident	22 Å²	22	57.7 Å²	57.7	15%	0.154	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-86.8	144.8	-178.2	72.6	0	0	0	0	109.7	G2272 D2297 V2301 W2322 S2323 S2324	G2272-S2299 WeakPolarHBondContact CA-O 3.33Å; G2272-S2299 PolarHBondContact N-O 3.23Å; D2297-S2299 PolarHBondContact O-N 2.95Å; D2297-S2299 VanDerWaalsContact O-N 3.13Å; S2299-V2301 PolarHBondContact O-N 3.06Å; S2299-W2322 VanDerWaalsContact O-CD1 3.32Å; S2299-W2322 WeakPolarHBondContact OG-CB 3.28Å; S2299-S2323 VanDerWaalsContact CB-OG 3.31Å; S2299-S2323 WeakPolarHBondContact CB-OG 3.31Å; S2299-S2323 PolarHBondContact OG-OG 3.41Å; S2299-S2324 WeakPolarHBondContact OG-CB 3.42Å; S2299-S2324 PolarHBondContact OG-N 3.12Å; S2299-S2324 VanDerWaalsContact OG-N 3.12Å; S2299-S2324 PolarHBondContact OG-OG 3.07Å
2300	S	86.7	Confident	74.3	Confident	29.6 Å²	29.6	55.2 Å²	55.2	21%	0.207	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-57.1	135	-177.3	176.2	0	0	0	0	112.4	T2254 N2270 Q2302 W2322 S2323	T2254-S2300 WeakPolarHBondContact CG2-OG 3.38Å; N2270-S2300 WeakPolarHBondContact CA-OG 3.28Å; N2270-S2300 VanDerWaalsContact O-CA 3.27Å; N2270-S2300 WeakPolarHBondContact O-CA 3.24Å; N2270-S2300 VanDerWaalsContact O-CB 3.31Å; N2270-S2300 WeakPolarHBondContact O-CB 3.34Å; N2270-S2300 PolarHBondContact O-N 3.28Å; S2300-Q2302 PolarHBondContact O-N 2.86Å; S2300-W2322 CarbonylContact O-C 3.57Å; S2300-W2322 WeakPolarHBondContact O-CA 3.39Å; S2300-S2323 PolarHBondContact N-OG 2.96Å; S2300-S2323 VanDerWaalsContact N-OG 3.09Å; S2300-S2323 WeakPolarHBondContact O-CB 3.43Å; S2300-S2323 PolarHBondContact O-N 3.05Å; S2300-S2323 PolarHBondContact O-OG 3.04Å; S2300-S2323 VanDerWaalsContact O-OG 3.11Å
2301	V	89.1	Confident	74.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	131.8	165.5	-173.9	0	0	0	0	108.3	T2254 T2255 W2269 G2272 L2273 S2299 I2304 V2320	T2254-V2301 VanDerWaalsContact CB-O 3.25Å; T2254-V2301 WeakPolarHBondContact CB-O 3.32Å; T2254-V2301 PolarHBondContact OG1-O 3.06Å; T2255-V2301 HydrophobicContact CG2-CB 4.48Å; T2255-V2301 HydrophobicContact CG2-CG1 4.09Å; W2269-V2301 PolarHBondContact O-N 3.07Å; W2269-V2301 VanDerWaalsContact O-N 3.1Å; G2272-V2301 VanDerWaalsContact C-CG2 3.48Å; G2272-V2301 WeakPolarHBondContact O-CG2 3.38Å; L2273-V2301 WeakPolarHBondContact O-CG2 3.34Å; S2299-V2301 PolarHBondContact O-N 3.06Å; V2301-I2304 HydrophobicContact CG1-CD1 3.92Å; V2301-I2304 HydrophobicContact CG1-CG1 3.75Å; V2301-V2320 HydrophobicContact CG1-CG1 3.75Å
2302	Q	89.3	Confident	74.9	Confident	55.4 Å²	55.4	53 Å²	53	26%	0.259	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-38.7	-177.8	-75.7	-178.7	-22.5	0	0	112.5	T2255 S2300 G2321 S2323 G2382 T2384	T2255-Q2302 WeakPolarHBondContact CB-O 3.37Å; T2255-Q2302 WeakPolarHBondContact CG2-O 3.4Å; T2255-Q2302 PolarHBondContact OG1-O 2.93Å; S2300-Q2302 PolarHBondContact O-N 2.86Å; Q2302-G2321 PolarHBondContact N-O 3.28Å; Q2302-S2323 VanDerWaalsContact CD-CA 3.5Å; Q2302-S2323 VanDerWaalsContact NE2-CB 3.31Å; Q2302-G2382 VanDerWaalsContact CD-O 3.31Å; Q2302-G2382 PolarHBondContact NE2-O 3.04Å; Q2302-G2382 PolarHBondContact OE1-O 2.9Å; Q2302-G2382 VanDerWaalsContact OE1-O 3.06Å; Q2302-T2384 VanDerWaalsContact CB-O 3.24Å; Q2302-T2384 WeakPolarHBondContact CB-O 3.35Å; Q2302-T2384 VanDerWaalsContact OE1-N 3.09Å; Q2302-T2384 PolarHBondContact OE1-O 3Å; Q2302-T2384 VanDerWaalsContact OE1-O 3.08Å
2303	A	90.6	Very high	75.4	Confident	5 Å²	5	54.3 Å²	54.3	4%	0.041	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	133	-178.1	0	0	0	0	0	111	V2320 G2321 T2384 A2387	A2303-V2320 CarbonylContact O-C 3.53Å; A2303-V2320 WeakPolarHBondContact O-CA 3.32Å; A2303-G2321 PolarHBondContact N-O 3.02Å; A2303-G2321 VanDerWaalsContact N-O 3.12Å; A2303-G2321 PolarHBondContact O-N 2.9Å; A2303-T2384 HydrophobicContact CB-CG2 4.44Å; A2303-A2387 HydrophobicContact CB-CB 3.83Å
2304	I	92.5	Very high	76.3	Confident	5.6 Å²	5.6	56.4 Å²	56.4	3%	0.029	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	134.2	167.2	-61.3	178.7	0	0	0	107.6	T2255 A2257 I2266 F2274 V2301 V2318 I2319 V2320	T2255-I2304 HydrophobicContact CG2-CB 4.09Å; T2255-I2304 HydrophobicContact CG2-CD1 3.97Å; T2255-I2304 HydrophobicContact CG2-CG1 3.68Å; A2257-I2304 HydrophobicContact CB-CB 4.36Å; A2257-I2304 HydrophobicContact CB-CG2 3.81Å; I2266-I2304 HydrophobicContact CB-CG2 4.41Å; I2266-I2304 HydrophobicContact CG2-CD1 4.18Å; I2266-I2304 HydrophobicContact CG2-CG2 4.2Å; F2274-I2304 HydrophobicContact CB-CD1 4.3Å; V2301-I2304 HydrophobicContact CG1-CD1 3.92Å; V2301-I2304 HydrophobicContact CG1-CG1 3.75Å; I2304-V2318 HydrophobicContact CG2-CG1 4.1Å; I2304-I2319 WeakPolarHBondContact CA-O 3.12Å; I2304-V2320 HydrophobicContact CG1-CG1 4.22Å; I2304-V2320 HydrophobicContact CG1-CG2 4.38Å
2305	S	91.7	Very high	77.6	Confident	24.2 Å²	24.2	50.6 Å²	50.6	17%	0.169	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	145.7	167.7	-168.6	0	0	0	0	110.7	V2318 I2319 A2387 A2389	S2305-V2318 WeakPolarHBondContact O-CA 3.26Å; S2305-I2319 PolarHBondContact N-O 2.98Å; S2305-I2319 VanDerWaalsContact N-O 3.1Å; S2305-I2319 PolarHBondContact O-N 3.09Å; S2305-A2387 VanDerWaalsContact CB-O 3.29Å; S2305-A2387 WeakPolarHBondContact CB-O 3.17Å; S2305-A2389 PolarHBondContact OG-N 2.97Å
2306	C	89.3	Confident	79.1	Confident	20.8 Å²	20.8	49.5 Å²	49.5	14%	0.141	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	147.1	172.8	-72.7	0	0	0	0	109.5	A2257 I2258 I2266 N2316 L2317 V2318	A2257-C2306 HydrophobicContact CB-CB 4.35Å; I2258-C2306 VanDerWaalsContact O-CB 3.29Å; I2258-C2306 WeakPolarHBondContact O-CB 3.38Å; I2258-C2306 PolarHBondContact O-SG 3.41Å; I2266-C2306 VanDerWaalsContact CD1-SG 3.6Å; I2266-C2306 WeakPolarHBondContact CD1-SG 3.23Å; C2306-N2316 PolarHBondContact SG-OD1 2.92Å; C2306-L2317 CarbonylContact C-O 3.56Å; C2306-L2317 WeakPolarHBondContact CA-O 3.26Å; C2306-V2318 HydrophobicContact CB-CG2 4.3Å; C2306-V2318 VanDerWaalsContact SG-CG2 3.52Å
2307	G	85.1	Confident	80.6	Confident	6.4 Å²	6.4	43 Å²	43	7%	0.066	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	174.5	171.7	0	0	0	0	0	109.8	I2260 N2316 L2317 A2389	I2260-G2307 WeakPolarHBondContact CD1-O 3.33Å; G2307-N2316 CarbonylContact O-C 3.55Å; G2307-N2316 VanDerWaalsContact O-CA 3.31Å; G2307-N2316 WeakPolarHBondContact O-CA 3.25Å; G2307-L2317 PolarHBondContact N-O 3.25Å; G2307-L2317 PolarHBondContact O-N 3.01Å; G2307-A2389 WeakPolarHBondContact CA-O 3.34Å
2308	I	82	Confident	82.1	Confident	65.4 Å²	65.4	41.4 Å²	41.4	34%	0.335	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	138.4	178.8	-61.1	169.1	0	0	0	108.5	I2260 L2317 D2391	I2260-I2308 HydrophobicContact CD1-CB 3.95Å; I2260-I2308 HydrophobicContact CD1-CD1 4.44Å; I2260-I2308 HydrophobicContact CD1-CG1 3.78Å; I2260-I2308 VanDerWaalsContact CD1-CG1 3.42Å; I2260-I2308 VanDerWaalsContact CD1-N 3.27Å; I2260-I2308 HydrophobicContact CG1-CD1 4.38Å; I2260-I2308 HydrophobicContact CG1-CG1 4.14Å; I2308-L2317 WeakPolarHBondContact O-CB 3.07Å; I2308-D2391 WeakPolarHBondContact CB-OD1 3.41Å; I2308-D2391 WeakPolarHBondContact CD1-OD1 3.33Å; I2308-D2391 CarbonylContact O-C 3.59Å; I2308-D2391 VanDerWaalsContact O-CA 3.3Å; I2308-D2391 WeakPolarHBondContact O-CA 3.44Å; I2308-D2391 VanDerWaalsContact O-O 3.07Å
2309	S	80	Confident	83.1	Confident	4.6 Å²	4.6	35 Å²	35	3%	0.032	18%	0.184	C	C	.	.			trans	-75.1	139.3	173.7	176.5	0	0	0	0	111	Y2311 A2315 H2331	S2309-Y2311 PolarHBondContact O-N 3.17Å; S2309-Y2311 VanDerWaalsContact O-N 3.08Å; S2309-Y2311 VanDerWaalsContact OG-CD2 3.31Å; S2309-Y2311 WeakPolarHBondContact OG-CD2 3.31Å; S2309-Y2311 PolarHBondContact OG-N 3.09Å; S2309-Y2311 VanDerWaalsContact OG-N 3.14Å; S2309-A2315 VanDerWaalsContact CB-C 3.44Å; S2309-A2315 WeakPolarHBondContact CB-O 3.26Å; S2309-A2315 PolarHBondContact N-O 3.2Å; S2309-H2331 PolarHBondContact OG-CD2 2.95Å; S2309-H2331 PolarHBondContact OG-CE1 3.03Å; S2309-H2331 PolarHBondContact OG-ND1 2.86Å; S2309-H2331 PolarHBondContact OG-NE2 2.91Å
2310	P	71.7	Confident	83.6	Confident	21.8 Å²	21.8	34 Å²	34	14%	0.142	18%	0.177	C	C	.	.	S	Bend	trans	-74.3	-3.6	174.6	32.2	-36.1	0	0	0	113.5	D2391 F2392 V2408	P2310-D2391 WeakPolarHBondContact CB-O 3.26Å; P2310-D2391 VanDerWaalsContact CD-O 3.28Å; P2310-D2391 WeakPolarHBondContact CD-O 3.34Å; P2310-F2392 HydrophobicContact CB-CD1 3.34Å; P2310-F2392 VanDerWaalsContact CB-CD1 3.43Å; P2310-F2392 HydrophobicContact CB-CE1 3.37Å; P2310-F2392 VanDerWaalsContact CB-CE1 3.5Å; P2310-F2392 HydrophobicContact CB-CG 4.3Å; P2310-F2392 HydrophobicContact CB-CZ 4.27Å; P2310-F2392 HydrophobicContact CG-CD1 4.4Å; P2310-V2408 HydrophobicContact CG-CB 4.37Å; P2310-V2408 HydrophobicContact CG-CG1 3.91Å
2311	Y	73.7	Confident	83.8	Confident	31.4 Å²	31.4	32.6 Å²	32.6	12%	0.123	17%	0.167	C	C	.	.	S	Bend	trans	-103.3	-35	-172.2	-52.8	-64.1	0	0	0	113.9	S2309 H2331 L2363 V2408 G2409 S2410 V2411 L2412 P2415	S2309-Y2311 PolarHBondContact O-N 3.17Å; S2309-Y2311 VanDerWaalsContact O-N 3.08Å; S2309-Y2311 VanDerWaalsContact OG-CD2 3.31Å; S2309-Y2311 WeakPolarHBondContact OG-CD2 3.31Å; S2309-Y2311 PolarHBondContact OG-N 3.09Å; S2309-Y2311 VanDerWaalsContact OG-N 3.14Å; Y2311-H2331 HydrophobicContact CD2-CB 4.33Å; Y2311-H2331 AromaticContact CD2-CD2 3.54Å; Y2311-H2331 VanDerWaalsContact CD2-CD2 3.49Å; Y2311-H2331 WeakPolarHBondContact CD2-CD2 3.16Å; Y2311-H2331 AromaticContact CD2-CE1 3.79Å; Y2311-H2331 AromaticContact CD2-CG 3.81Å; Y2311-H2331 AromaticContact CD2-ND1 3.6Å; Y2311-H2331 AromaticContact CD2-NE2 3.91Å; Y2311-H2331 HydrophobicContact CE2-CB 4.41Å; Y2311-L2363 HydrophobicContact CE2-CD1 4.02Å; Y2311-L2363 HydrophobicContact CE2-CD2 3.95Å; Y2311-V2408 HydrophobicContact CE2-CG1 4.23Å; Y2311-V2408 VanDerWaalsContact OH-CG1 3.26Å; Y2311-V2408 WeakPolarHBondContact OH-CG1 3.35Å; Y2311-G2409 VanDerWaalsContact CE1-O 3.27Å; Y2311-G2409 WeakPolarHBondContact CE1-O 3.44Å; Y2311-G2409 VanDerWaalsContact CZ-O 3.28Å; Y2311-G2409 PolarHBondContact OH-O 2.99Å; Y2311-S2410 VanDerWaalsContact CD1-O 3.31Å; Y2311-S2410 WeakPolarHBondContact CD1-O 3.4Å; Y2311-S2410 VanDerWaalsContact CE1-C 3.46Å; Y2311-V2411 VanDerWaalsContact CE1-C 3.5Å; Y2311-L2412 HydrophobicContact CD1-CB 3.77Å; Y2311-L2412 HydrophobicContact CD1-CD1 4.18Å; Y2311-L2412 HydrophobicContact CD2-CB 4.4Å; Y2311-L2412 HydrophobicContact CD2-CD1 3.67Å; Y2311-L2412 VanDerWaalsContact CE1-CA 3.42Å; Y2311-L2412 HydrophobicContact CE1-CB 3.94Å; Y2311-L2412 HydrophobicContact CE1-CD1 4.23Å; Y2311-L2412 HydrophobicContact CE2-CB 4.49Å; Y2311-L2412 HydrophobicContact CE2-CD1 3.67Å; Y2311-L2412 HydrophobicContact CG-CB 3.99Å; Y2311-L2412 HydrophobicContact CG-CD1 3.98Å; Y2311-L2412 HydrophobicContact CG-CG 4.48Å; Y2311-P2415 WeakPolarHBondContact OH-CB 3.27Å
2312	Y	71.4	Confident	83.9	Confident	139 Å²	139	32.9 Å²	32.9	55%	0.545	17%	0.169	S	C	.	.			trans	-150.5	139.4	-178.6	-60.1	-76.2	0	0	0	110.1	D2314 A2315 H2331 L2412	Y2312-D2314 VanDerWaalsContact C-N 3.29Å; Y2312-D2314 PolarHBondContact O-N 3.19Å; Y2312-A2315 HydrophobicContact CD2-CB 4.46Å; Y2312-A2315 WeakPolarHBondContact O-CB 3.33Å; Y2312-A2315 PolarHBondContact O-N 3.07Å; Y2312-A2315 VanDerWaalsContact O-N 3.1Å; Y2312-H2331 AromaticContact CD2-CE1 3.82Å; Y2312-H2331 AromaticContact CD2-NE2 3.85Å; Y2312-H2331 AromaticContact CE2-CE1 3.98Å; Y2312-L2412 HydrophobicContact CE2-CD2 4.46Å
2313	D	64.5	Low	83.8	Confident	153 Å²	153	31.9 Å²	31.9	82%	0.818	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-31.7	-178.7	-60.7	-33.5	0	0	0	112.9	A2315	D2313-A2315 VanDerWaalsContact C-N 3.32Å; D2313-A2315 PolarHBondContact O-N 3.27Å
2314	D	69.7	Low	83.6	Confident	146.4 Å²	146.4	32.1 Å²	32.1	78%	0.783	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	12.8	178.3	-71.5	-31.9	0	0	0	113.8	Y2312	Y2312-D2314 VanDerWaalsContact C-N 3.29Å; Y2312-D2314 PolarHBondContact O-N 3.19Å
2315	A	80	Confident	83.3	Confident	0.4 Å²	0.4	31.9 Å²	31.9	0%	0.003	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	152	-177.4	0	0	0	0	0	112.9	S2309 Y2312 D2313 H2331 F2332	S2309-A2315 VanDerWaalsContact CB-C 3.44Å; S2309-A2315 WeakPolarHBondContact CB-O 3.26Å; S2309-A2315 PolarHBondContact N-O 3.2Å; Y2312-A2315 HydrophobicContact CD2-CB 4.46Å; Y2312-A2315 WeakPolarHBondContact O-CB 3.33Å; Y2312-A2315 PolarHBondContact O-N 3.07Å; Y2312-A2315 VanDerWaalsContact O-N 3.1Å; D2313-A2315 VanDerWaalsContact C-N 3.32Å; D2313-A2315 PolarHBondContact O-N 3.27Å; A2315-H2331 WeakPolarHBondContact CB-CE1 3.22Å; A2315-H2331 WeakPolarHBondContact CB-NE2 3.29Å; A2315-F2332 CarbonylContact C-O 3.54Å; A2315-F2332 VanDerWaalsContact CA-O 3.28Å; A2315-F2332 WeakPolarHBondContact CA-O 3.38Å; A2315-F2332 VanDerWaalsContact CB-O 3.28Å; A2315-F2332 WeakPolarHBondContact CB-O 3.25Å
2316	N	85	Confident	83.2	Confident	4.2 Å²	4.2	30.8 Å²	30.8	2%	0.022	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	131	-178.4	-61.7	-82.4	0	0	0	110.5	D2259 I2260 C2306 G2307 V2318 F2332 F2334	D2259-N2316 WeakPolarHBondContact CB-ND2 3.49Å; D2259-N2316 PolarHBondContact OD1-ND2 2.97Å; I2260-N2316 VanDerWaalsContact CB-OD1 3.31Å; I2260-N2316 WeakPolarHBondContact CB-OD1 3.35Å; I2260-N2316 VanDerWaalsContact CD1-OD1 3.27Å; I2260-N2316 WeakPolarHBondContact CD1-OD1 3.38Å; I2260-N2316 WeakPolarHBondContact CG1-OD1 3.27Å; I2260-N2316 VanDerWaalsContact CG2-OD1 3.31Å; I2260-N2316 WeakPolarHBondContact CG2-OD1 3.46Å; I2260-N2316 PolarHBondContact N-OD1 3.07Å; C2306-N2316 PolarHBondContact SG-OD1 2.92Å; G2307-N2316 CarbonylContact O-C 3.55Å; G2307-N2316 VanDerWaalsContact O-CA 3.31Å; G2307-N2316 WeakPolarHBondContact O-CA 3.25Å; N2316-V2318 HydrophobicContact CB-CG2 4.1Å; N2316-F2332 HydrophobicContact CB-CB 4.4Å; N2316-F2332 PolarHBondContact N-O 3.05Å; N2316-F2332 PolarHBondContact O-N 2.88Å; N2316-F2334 WeakPolarHBondContact ND2-CE2 3.34Å
2317	L	88.7	Confident	83.2	Confident	0.4 Å²	0.4	29.9 Å²	29.9	0%	0.002	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	121.4	160.1	177	64.4	0	0	0	108.1	C2306 G2307 I2308 L2329 L2363 V2408	C2306-L2317 CarbonylContact C-O 3.56Å; C2306-L2317 WeakPolarHBondContact CA-O 3.26Å; G2307-L2317 PolarHBondContact N-O 3.25Å; G2307-L2317 PolarHBondContact O-N 3.01Å; I2308-L2317 WeakPolarHBondContact O-CB 3.07Å; L2317-L2329 HydrophobicContact CD1-CB 4.47Å; L2317-L2363 HydrophobicContact CD1-CD1 3.72Å; L2317-V2408 HydrophobicContact CD1-CG2 4.26Å; L2317-V2408 HydrophobicContact CD2-CG2 4.1Å
2318	V	90.2	Very high	83.4	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	124	-178.9	-178.8	0	0	0	0	110.3	I2266 I2304 S2305 C2306 N2316 V2320 L2329 Y2330 F2332	I2266-V2318 HydrophobicContact CD1-CG1 4.29Å; I2266-V2318 HydrophobicContact CD1-CG2 3.93Å; I2304-V2318 HydrophobicContact CG2-CG1 4.1Å; S2305-V2318 WeakPolarHBondContact O-CA 3.26Å; C2306-V2318 HydrophobicContact CB-CG2 4.3Å; C2306-V2318 VanDerWaalsContact SG-CG2 3.52Å; N2316-V2318 HydrophobicContact CB-CG2 4.1Å; V2318-V2320 HydrophobicContact CG1-CG2 4.08Å; V2318-L2329 CarbonylContact O-C 3.56Å; V2318-L2329 WeakPolarHBondContact O-CA 3.42Å; V2318-Y2330 PolarHBondContact N-O 3.03Å; V2318-Y2330 PolarHBondContact O-N 2.99Å; V2318-F2332 HydrophobicContact CB-CD2 3.95Å; V2318-F2332 HydrophobicContact CB-CE2 3.69Å; V2318-F2332 VanDerWaalsContact CB-CE2 3.43Å; V2318-F2332 HydrophobicContact CB-CZ 4.26Å; V2318-F2332 HydrophobicContact CG1-CD2 4.45Å; V2318-F2332 HydrophobicContact CG1-CE2 3.9Å; V2318-F2332 HydrophobicContact CG1-CZ 4.34Å; V2318-F2332 HydrophobicContact CG2-CB 4.42Å; V2318-F2332 HydrophobicContact CG2-CD1 4.45Å; V2318-F2332 HydrophobicContact CG2-CD2 3.36Å; V2318-F2332 VanDerWaalsContact CG2-CD2 3.45Å; V2318-F2332 HydrophobicContact CG2-CE2 3.56Å; V2318-F2332 VanDerWaalsContact CG2-CE2 3.42Å; V2318-F2332 HydrophobicContact CG2-CG 4.14Å; V2318-F2332 HydrophobicContact CG2-CZ 4.28Å
2319	I	92.2	Very high	83.8	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	130.4	170.8	-178.3	164	0	0	0	109.2	I2304 S2305 V2327 R2328 L2329 A2387 A2389 A2394 Y2406	I2304-I2319 WeakPolarHBondContact CA-O 3.12Å; S2305-I2319 PolarHBondContact N-O 2.98Å; S2305-I2319 VanDerWaalsContact N-O 3.1Å; S2305-I2319 PolarHBondContact O-N 3.09Å; I2319-V2327 HydrophobicContact CD1-CG1 3.64Å; I2319-V2327 HydrophobicContact CG1-CG1 3.84Å; I2319-R2328 WeakPolarHBondContact CA-O 3.41Å; I2319-L2329 HydrophobicContact CB-CD2 3.73Å; I2319-L2329 HydrophobicContact CD1-CD2 3.93Å; I2319-L2329 HydrophobicContact CG1-CD2 3.8Å; I2319-A2387 HydrophobicContact CB-CB 4.49Å; I2319-A2387 HydrophobicContact CD1-CB 4.01Å; I2319-A2387 HydrophobicContact CG1-CB 4.03Å; I2319-A2387 HydrophobicContact CG2-CB 3.76Å; I2319-A2389 HydrophobicContact CG2-CB 4.04Å; I2319-A2394 HydrophobicContact CB-CB 4.26Å; I2319-A2394 HydrophobicContact CD1-CB 3.86Å; I2319-Y2406 HydrophobicContact CD1-CD2 4.42Å; I2319-Y2406 HydrophobicContact CD1-CE2 4.29Å
2320	V	91.7	Very high	84.2	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	133.6	175	-174.6	0	0	0	0	108.4	F2274 V2301 A2303 I2304 V2318 W2322 V2327 R2328 Y2330	F2274-V2320 HydrophobicContact CD1-CG2 4.48Å; V2301-V2320 HydrophobicContact CG1-CG1 3.75Å; A2303-V2320 CarbonylContact O-C 3.53Å; A2303-V2320 WeakPolarHBondContact O-CA 3.32Å; I2304-V2320 HydrophobicContact CG1-CG1 4.22Å; I2304-V2320 HydrophobicContact CG1-CG2 4.38Å; V2318-V2320 HydrophobicContact CG1-CG2 4.08Å; V2320-W2322 HydrophobicContact CB-CE3 4.4Å; V2320-W2322 HydrophobicContact CB-CH2 3.57Å; V2320-W2322 VanDerWaalsContact CB-CH2 3.5Å; V2320-W2322 HydrophobicContact CB-CZ2 4.23Å; V2320-W2322 HydrophobicContact CB-CZ3 3.7Å; V2320-W2322 HydrophobicContact CG1-CD2 4.21Å; V2320-W2322 HydrophobicContact CG1-CE3 4.08Å; V2320-W2322 HydrophobicContact CG1-CH2 3.43Å; V2320-W2322 VanDerWaalsContact CG1-CH2 3.48Å; V2320-W2322 HydrophobicContact CG1-CZ2 3.58Å; V2320-W2322 HydrophobicContact CG1-CZ3 3.68Å; V2320-W2322 VanDerWaalsContact CG1-CZ3 3.5Å; V2320-W2322 VanDerWaalsContact O-CZ3 3.26Å; V2320-W2322 WeakPolarHBondContact O-CZ3 3.39Å; V2320-V2327 CarbonylContact O-C 3.56Å; V2320-V2327 WeakPolarHBondContact O-CA 3.29Å; V2320-R2328 PolarHBondContact N-O 3.03Å; V2320-R2328 PolarHBondContact O-N 3.25Å; V2320-Y2330 HydrophobicContact CB-CE2 4.32Å; V2320-Y2330 HydrophobicContact CG2-CD2 4.04Å; V2320-Y2330 HydrophobicContact CG2-CE2 3.99Å
2321	G	91	Very high	84.9	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.9	179.4	0	0	0	0	0	111.4	Q2302 A2303 A2326	Q2302-G2321 PolarHBondContact N-O 3.28Å; A2303-G2321 PolarHBondContact N-O 3.02Å; A2303-G2321 VanDerWaalsContact N-O 3.12Å; A2303-G2321 PolarHBondContact O-N 2.9Å; G2321-A2326 WeakPolarHBondContact CA-O 3.35Å
2322	W	90.6	Very high	85.5	Confident	7.6 Å²	7.6	25.9 Å²	25.9	3%	0.029	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	159.2	-176.5	-71.5	-99.4	0	0	0	112.5	G2272 I2295 D2297 S2299 S2300 V2320 S2324 G2325 A2326 R2328 Y2330 T2384	G2272-W2322 PolarHBondContact O-NE1 2.94Å; G2272-W2322 VanDerWaalsContact O-NE1 3.08Å; I2295-W2322 HydrophobicContact CG2-CZ2 4.28Å; D2297-W2322 HydrophobicContact CB-CG 4.3Å; S2299-W2322 VanDerWaalsContact O-CD1 3.32Å; S2299-W2322 WeakPolarHBondContact OG-CB 3.28Å; S2300-W2322 CarbonylContact O-C 3.57Å; S2300-W2322 WeakPolarHBondContact O-CA 3.39Å; V2320-W2322 HydrophobicContact CB-CE3 4.4Å; V2320-W2322 HydrophobicContact CB-CH2 3.57Å; V2320-W2322 VanDerWaalsContact CB-CH2 3.5Å; V2320-W2322 HydrophobicContact CB-CZ2 4.23Å; V2320-W2322 HydrophobicContact CB-CZ3 3.7Å; V2320-W2322 HydrophobicContact CG1-CD2 4.21Å; V2320-W2322 HydrophobicContact CG1-CE3 4.08Å; V2320-W2322 HydrophobicContact CG1-CH2 3.43Å; V2320-W2322 VanDerWaalsContact CG1-CH2 3.48Å; V2320-W2322 HydrophobicContact CG1-CZ2 3.58Å; V2320-W2322 HydrophobicContact CG1-CZ3 3.68Å; V2320-W2322 VanDerWaalsContact CG1-CZ3 3.5Å; V2320-W2322 VanDerWaalsContact O-CZ3 3.26Å; V2320-W2322 WeakPolarHBondContact O-CZ3 3.39Å; W2322-S2324 WeakPolarHBondContact CB-OG 3.46Å; W2322-S2324 PolarHBondContact O-N 3.02Å; W2322-G2325 WeakPolarHBondContact O-CA 3.44Å; W2322-G2325 PolarHBondContact O-N 3.11Å; W2322-A2326 HydrophobicContact CB-CB 4.29Å; W2322-A2326 HydrophobicContact CD2-CB 4.48Å; W2322-A2326 HydrophobicContact CE3-CB 4.1Å; W2322-A2326 PolarHBondContact N-O 3.06Å; W2322-R2328 HydrophobicContact CE3-CG 4.39Å; W2322-R2328 HydrophobicContact CH2-CB 3.75Å; W2322-R2328 VanDerWaalsContact CH2-CD 3.48Å; W2322-R2328 HydrophobicContact CH2-CG 3.72Å; W2322-R2328 HydrophobicContact CZ3-CB 3.56Å; W2322-R2328 HydrophobicContact CZ3-CG 3.43Å; W2322-R2328 VanDerWaalsContact CZ3-CG 3.42Å; W2322-Y2330 HydrophobicContact CH2-CE2 4.17Å; W2322-T2384 WeakPolarHBondContact O-CB 3.4Å; W2322-T2384 PolarHBondContact O-N 2.99Å; W2322-T2384 VanDerWaalsContact O-N 3.12Å; W2322-T2384 PolarHBondContact O-OG1 3.14Å
2323	S	88.8	Confident	86	Confident	33.2 Å²	33.2	19.9 Å²	19.9	23%	0.232	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-15.9	174.3	59.6	0	0	0	0	114.3	S2299 S2300 Q2302 G2325 G2379 G2383	S2299-S2323 VanDerWaalsContact CB-OG 3.31Å; S2299-S2323 WeakPolarHBondContact CB-OG 3.31Å; S2299-S2323 PolarHBondContact OG-OG 3.41Å; S2300-S2323 PolarHBondContact N-OG 2.96Å; S2300-S2323 VanDerWaalsContact N-OG 3.09Å; S2300-S2323 WeakPolarHBondContact O-CB 3.43Å; S2300-S2323 PolarHBondContact O-N 3.05Å; S2300-S2323 PolarHBondContact O-OG 3.04Å; S2300-S2323 VanDerWaalsContact O-OG 3.11Å; Q2302-S2323 VanDerWaalsContact CD-CA 3.5Å; Q2302-S2323 VanDerWaalsContact NE2-CB 3.31Å; S2323-G2325 PolarHBondContact O-N 3.21Å; S2323-G2379 VanDerWaalsContact O-CA 3.32Å; S2323-G2379 WeakPolarHBondContact O-CA 3.41Å; S2323-G2383 WeakPolarHBondContact O-CA 3.3Å
2324	S	86.3	Confident	86.6	Confident	10.4 Å²	10.4	14.5 Å²	14.5	7%	0.073	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-9.6	165.4	54	0	0	0	0	113.1	D2297 S2299 W2322 A2326 S2370 G2377 T2378 G2379	D2297-S2324 VanDerWaalsContact OD1-CB 3.27Å; D2297-S2324 WeakPolarHBondContact OD1-CB 3.3Å; D2297-S2324 PolarHBondContact OD1-OG 3.14Å; D2297-S2324 WeakPolarHBondContact OD2-CB 3.31Å; D2297-S2324 PolarHBondContact OD2-OG 2.97Å; D2297-S2324 VanDerWaalsContact OD2-OG 3.1Å; S2299-S2324 WeakPolarHBondContact OG-CB 3.42Å; S2299-S2324 PolarHBondContact OG-N 3.12Å; S2299-S2324 VanDerWaalsContact OG-N 3.12Å; S2299-S2324 PolarHBondContact OG-OG 3.07Å; W2322-S2324 WeakPolarHBondContact CB-OG 3.46Å; W2322-S2324 PolarHBondContact O-N 3.02Å; S2324-A2326 VanDerWaalsContact C-N 3.3Å; S2324-A2326 PolarHBondContact OG-N 3.33Å; S2324-S2370 VanDerWaalsContact O-CB 3.31Å; S2324-S2370 WeakPolarHBondContact O-CB 3.32Å; S2324-G2377 VanDerWaalsContact O-O 3.1Å; S2324-T2378 CarbonylContact O-C 3.57Å; S2324-G2379 VanDerWaalsContact C-CA 3.44Å; S2324-G2379 VanDerWaalsContact O-CA 3.28Å; S2324-G2379 WeakPolarHBondContact O-CA 3.39Å; S2324-G2379 PolarHBondContact O-N 3.13Å; S2324-G2379 VanDerWaalsContact O-N 3.11Å
2325	G	86.6	Confident	86.5	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.066	C	C	.	.	S	Bend	trans	84.8	5	-173.5	0	0	0	0	0	114.1	W2322 S2323 W2367 S2368 H2369 T2384	W2322-G2325 WeakPolarHBondContact O-CA 3.44Å; W2322-G2325 PolarHBondContact O-N 3.11Å; S2323-G2325 PolarHBondContact O-N 3.21Å; G2325-W2367 CarbonylContact O-C 3.54Å; G2325-S2368 PolarHBondContact O-N 3.18Å; G2325-H2369 VanDerWaalsContact CA-C 3.48Å; G2325-H2369 PolarHBondContact O-N 3.19Å; G2325-T2384 PolarHBondContact O-OG1 3.32Å
2326	A	88.5	Confident	85.3	Confident	2.2 Å²	2.2	18.4 Å²	18.4	2%	0.018	10%	0.097	C	C	.	.			trans	-67.2	148	169.2	0	0	0	0	0	111.4	G2321 W2322 S2324 S2366 W2367 T2384	G2321-A2326 WeakPolarHBondContact CA-O 3.35Å; W2322-A2326 HydrophobicContact CB-CB 4.29Å; W2322-A2326 HydrophobicContact CD2-CB 4.48Å; W2322-A2326 HydrophobicContact CE3-CB 4.1Å; W2322-A2326 PolarHBondContact N-O 3.06Å; S2324-A2326 VanDerWaalsContact C-N 3.3Å; S2324-A2326 PolarHBondContact OG-N 3.33Å; A2326-S2366 CarbonylContact C-O 3.55Å; A2326-S2366 WeakPolarHBondContact CA-O 3.36Å; A2326-W2367 HydrophobicContact CB-CD2 4.24Å; A2326-W2367 HydrophobicContact CB-CE3 3.8Å; A2326-W2367 HydrophobicContact CB-CH2 4.33Å; A2326-W2367 HydrophobicContact CB-CZ3 3.85Å; A2326-T2384 PolarHBondContact O-OG1 3.01Å
2327	V	90.2	Very high	83.7	Confident	1.8 Å²	1.8	19.4 Å²	19.4	1%	0.011	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	130.8	174.9	-175.7	0	0	0	0	108.3	I2319 V2320 T2365 S2366 S2368 T2384 Y2406	I2319-V2327 HydrophobicContact CD1-CG1 3.64Å; I2319-V2327 HydrophobicContact CG1-CG1 3.84Å; V2320-V2327 CarbonylContact O-C 3.56Å; V2320-V2327 WeakPolarHBondContact O-CA 3.29Å; V2327-T2365 WeakPolarHBondContact O-CA 3.38Å; V2327-S2366 CarbonylContact C-O 3.59Å; V2327-S2366 PolarHBondContact N-O 3.28Å; V2327-S2366 PolarHBondContact O-N 3.11Å; V2327-S2368 VanDerWaalsContact CG2-OG 3.31Å; V2327-S2368 WeakPolarHBondContact CG2-OG 3.24Å; V2327-T2384 HydrophobicContact CG2-CG2 3.94Å; V2327-Y2406 HydrophobicContact CG1-CE2 3.91Å
2328	R	89.1	Confident	81.6	Confident	29.2 Å²	29.2	25.8 Å²	25.8	11%	0.11	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	144.6	178.5	-59.7	-174.2	-178.6	155.9	2.8	111.4	L2294 I2295 D2297 I2319 V2320 W2322 Y2330 Y2364 T2365	L2294-R2328 PolarHBondContact O-NH1 3.01Å; I2295-R2328 VanDerWaalsContact CD1-NH2 3.29Å; D2297-R2328 IonicContact OD2-CZ 3.05Å; D2297-R2328 IonicContact OD2-NE 3.6Å; D2297-R2328 IonicContact OD2-NH1 4Å; D2297-R2328 PolarHBondContact OD2-NH1 2.98Å; D2297-R2328 IonicContact OD2-NH2 3.18Å; D2297-R2328 PolarHBondContact OD2-NH2 2.95Å; I2319-R2328 WeakPolarHBondContact CA-O 3.41Å; V2320-R2328 PolarHBondContact N-O 3.03Å; V2320-R2328 PolarHBondContact O-N 3.25Å; W2322-R2328 HydrophobicContact CE3-CG 4.39Å; W2322-R2328 HydrophobicContact CH2-CB 3.75Å; W2322-R2328 VanDerWaalsContact CH2-CD 3.48Å; W2322-R2328 HydrophobicContact CH2-CG 3.72Å; W2322-R2328 HydrophobicContact CZ3-CB 3.56Å; W2322-R2328 HydrophobicContact CZ3-CG 3.43Å; W2322-R2328 VanDerWaalsContact CZ3-CG 3.42Å; R2328-Y2330 HydrophobicContact CB-CD2 4.45Å; R2328-Y2330 HydrophobicContact CB-CE2 3.76Å; R2328-Y2330 VanDerWaalsContact CD-OH 3.3Å; R2328-Y2330 WeakPolarHBondContact CD-OH 3.37Å; R2328-Y2364 VanDerWaalsContact CA-O 3.29Å; R2328-Y2364 WeakPolarHBondContact CA-O 3.26Å; R2328-T2365 HydrophobicContact CB-CG2 4.44Å; R2328-T2365 HydrophobicContact CG-CG2 3.88Å; R2328-T2365 WeakPolarHBondContact CG-OG1 3.42Å; R2328-T2365 PolarHBondContact NE-OG1 2.85Å
2329	L	90.3	Very high	79.4	Confident	1.2 Å²	1.2	34 Å²	34	1%	0.006	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	130.3	176.9	-57.3	-179.8	0	0	0	109.3	L2317 V2318 I2319 L2363 Y2364 A2394 Y2406 V2408 V2417	L2317-L2329 HydrophobicContact CD1-CB 4.47Å; V2318-L2329 CarbonylContact O-C 3.56Å; V2318-L2329 WeakPolarHBondContact O-CA 3.42Å; I2319-L2329 HydrophobicContact CB-CD2 3.73Å; I2319-L2329 HydrophobicContact CD1-CD2 3.93Å; I2319-L2329 HydrophobicContact CG1-CD2 3.8Å; L2329-L2363 HydrophobicContact CB-CB 4.19Å; L2329-L2363 HydrophobicContact CB-CD1 4.47Å; L2329-L2363 PolarHBondContact O-N 2.82Å; L2329-Y2364 HydrophobicContact CD1-CD1 4.43Å; L2329-Y2364 PolarHBondContact N-O 3.02Å; L2329-Y2364 PolarHBondContact O-N 3.09Å; L2329-A2394 HydrophobicContact CD1-CB 4.45Å; L2329-A2394 HydrophobicContact CD2-CB 3.51Å; L2329-A2394 VanDerWaalsContact CD2-CB 3.47Å; L2329-Y2406 HydrophobicContact CD1-CG 4.35Å; L2329-V2408 HydrophobicContact CD1-CG2 3.88Å; L2329-V2417 HydrophobicContact CD1-CG1 4.35Å; L2329-V2417 HydrophobicContact CD1-CG2 4.44Å
2330	Y	88.3	Confident	77	Confident	9.4 Å²	9.4	39.5 Å²	39.5	4%	0.037	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	148.1	177.3	-62.5	-86.7	0	0	0	110.7	F2274 V2318 V2320 W2322 R2328 F2332 I2360 V2361 P2362	F2274-Y2330 HydrophobicContact CE1-CE2 4.26Å; F2274-Y2330 HydrophobicContact CZ-CE2 4.4Å; V2318-Y2330 PolarHBondContact N-O 3.03Å; V2318-Y2330 PolarHBondContact O-N 2.99Å; V2320-Y2330 HydrophobicContact CB-CE2 4.32Å; V2320-Y2330 HydrophobicContact CG2-CD2 4.04Å; V2320-Y2330 HydrophobicContact CG2-CE2 3.99Å; W2322-Y2330 HydrophobicContact CH2-CE2 4.17Å; R2328-Y2330 HydrophobicContact CB-CD2 4.45Å; R2328-Y2330 HydrophobicContact CB-CE2 3.76Å; R2328-Y2330 VanDerWaalsContact CD-OH 3.3Å; R2328-Y2330 WeakPolarHBondContact CD-OH 3.37Å; Y2330-F2332 VanDerWaalsContact CB-CE1 3.5Å; Y2330-F2332 HydrophobicContact CD1-CE1 4.29Å; Y2330-F2332 HydrophobicContact CD2-CE2 4.45Å; Y2330-F2332 AromaticContact CG-CE1 3.91Å; Y2330-F2332 HydrophobicContact CG-CE1 4.09Å; Y2330-F2332 AromaticContact CG-CE2 3.98Å; Y2330-F2332 HydrophobicContact CG-CE2 3.98Å; Y2330-F2332 HydrophobicContact CG-CZ 4.33Å; Y2330-I2360 HydrophobicContact CD1-CG2 4.03Å; Y2330-I2360 HydrophobicContact CE1-CG2 4.44Å; Y2330-V2361 WeakPolarHBondContact CA-O 3.32Å; Y2330-P2362 HydrophobicContact CD1-CB 4.11Å; Y2330-P2362 HydrophobicContact CE1-CB 4.03Å
2331	H	86.5	Confident	74.4	Confident	3.2 Å²	3.2	49 Å²	49	2%	0.015	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120.7	165.9	176.5	-111.5	0	0	0	109.1	S2309 Y2311 Y2312 A2315 I2360 V2361 L2363 L2412	S2309-H2331 PolarHBondContact OG-CD2 2.95Å; S2309-H2331 PolarHBondContact OG-CE1 3.03Å; S2309-H2331 PolarHBondContact OG-ND1 2.86Å; S2309-H2331 PolarHBondContact OG-NE2 2.91Å; Y2311-H2331 HydrophobicContact CD2-CB 4.33Å; Y2311-H2331 AromaticContact CD2-CD2 3.54Å; Y2311-H2331 VanDerWaalsContact CD2-CD2 3.49Å; Y2311-H2331 WeakPolarHBondContact CD2-CD2 3.16Å; Y2311-H2331 AromaticContact CD2-CE1 3.79Å; Y2311-H2331 AromaticContact CD2-CG 3.81Å; Y2311-H2331 AromaticContact CD2-ND1 3.6Å; Y2311-H2331 AromaticContact CD2-NE2 3.91Å; Y2311-H2331 HydrophobicContact CE2-CB 4.41Å; Y2312-H2331 AromaticContact CD2-CE1 3.82Å; Y2312-H2331 AromaticContact CD2-NE2 3.85Å; Y2312-H2331 AromaticContact CE2-CE1 3.98Å; A2315-H2331 WeakPolarHBondContact CB-CE1 3.22Å; A2315-H2331 WeakPolarHBondContact CB-NE2 3.29Å; H2331-I2360 WeakPolarHBondContact O-CA 3.33Å; H2331-V2361 HydrophobicContact CB-CB 4.26Å; H2331-V2361 WeakPolarHBondContact CB-O 3.49Å; H2331-V2361 PolarHBondContact N-O 3.08Å; H2331-V2361 PolarHBondContact O-N 3.33Å; H2331-L2363 HydrophobicContact CB-CD1 4.11Å; H2331-L2363 HydrophobicContact CB-CD2 4.04Å; H2331-L2363 HydrophobicContact CB-CG 4.13Å; H2331-L2412 HydrophobicContact CB-CD1 4.29Å; H2331-L2412 VanDerWaalsContact ND1-CD1 3.34Å; H2331-L2412 WeakPolarHBondContact ND1-CD1 3.5Å
2332	F	85.4	Confident	72	Confident	1.4 Å²	1.4	60.1 Å²	60.1	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.3	176.4	-65	-36.4	0	0	0	110.3	I2266 F2274 I2276 A2315 N2316 V2318 Y2330 V2358 I2360	I2266-F2332 HydrophobicContact CD1-CD2 3.94Å; I2266-F2332 HydrophobicContact CD1-CE2 3.75Å; I2266-F2332 HydrophobicContact CG1-CE2 4.28Å; F2274-F2332 HydrophobicContact CE2-CE1 4.26Å; F2274-F2332 HydrophobicContact CE2-CE2 4.35Å; F2274-F2332 AromaticContact CE2-CZ 3.62Å; F2274-F2332 HydrophobicContact CE2-CZ 3.62Å; F2274-F2332 HydrophobicContact CZ-CE1 4.4Å; F2274-F2332 AromaticContact CZ-CZ 3.87Å; F2274-F2332 HydrophobicContact CZ-CZ 3.87Å; I2276-F2332 HydrophobicContact CD1-CD1 3.64Å; I2276-F2332 HydrophobicContact CD1-CD2 4.19Å; I2276-F2332 HydrophobicContact CD1-CE1 3.95Å; I2276-F2332 HydrophobicContact CD1-CE2 4.1Å; I2276-F2332 HydrophobicContact CD1-CG 4.43Å; I2276-F2332 HydrophobicContact CD1-CZ 4.39Å; A2315-F2332 CarbonylContact C-O 3.54Å; A2315-F2332 VanDerWaalsContact CA-O 3.28Å; A2315-F2332 WeakPolarHBondContact CA-O 3.38Å; A2315-F2332 VanDerWaalsContact CB-O 3.28Å; A2315-F2332 WeakPolarHBondContact CB-O 3.25Å; N2316-F2332 HydrophobicContact CB-CB 4.4Å; N2316-F2332 PolarHBondContact N-O 3.05Å; N2316-F2332 PolarHBondContact O-N 2.88Å; V2318-F2332 HydrophobicContact CB-CD2 3.95Å; V2318-F2332 HydrophobicContact CB-CE2 3.69Å; V2318-F2332 VanDerWaalsContact CB-CE2 3.43Å; V2318-F2332 HydrophobicContact CB-CZ 4.26Å; V2318-F2332 HydrophobicContact CG1-CD2 4.45Å; V2318-F2332 HydrophobicContact CG1-CE2 3.9Å; V2318-F2332 HydrophobicContact CG1-CZ 4.34Å; V2318-F2332 HydrophobicContact CG2-CB 4.42Å; V2318-F2332 HydrophobicContact CG2-CD1 4.45Å; V2318-F2332 HydrophobicContact CG2-CD2 3.36Å; V2318-F2332 VanDerWaalsContact CG2-CD2 3.45Å; V2318-F2332 HydrophobicContact CG2-CE2 3.56Å; V2318-F2332 VanDerWaalsContact CG2-CE2 3.42Å; V2318-F2332 HydrophobicContact CG2-CG 4.14Å; V2318-F2332 HydrophobicContact CG2-CZ 4.28Å; Y2330-F2332 VanDerWaalsContact CB-CE1 3.5Å; Y2330-F2332 HydrophobicContact CD1-CE1 4.29Å; Y2330-F2332 HydrophobicContact CD2-CE2 4.45Å; Y2330-F2332 AromaticContact CG-CE1 3.91Å; Y2330-F2332 HydrophobicContact CG-CE1 4.09Å; Y2330-F2332 AromaticContact CG-CE2 3.98Å; Y2330-F2332 HydrophobicContact CG-CE2 3.98Å; Y2330-F2332 HydrophobicContact CG-CZ 4.33Å; F2332-V2358 HydrophobicContact CD1-CG1 4.44Å; F2332-I2360 HydrophobicContact CD1-CB 4.12Å; F2332-I2360 HydrophobicContact CD1-CD1 4.15Å; F2332-I2360 HydrophobicContact CD1-CG1 3.63Å; F2332-I2360 HydrophobicContact CD1-CG2 3.84Å; F2332-I2360 HydrophobicContact CE1-CB 4.16Å; F2332-I2360 HydrophobicContact CE1-CD1 3.84Å; F2332-I2360 HydrophobicContact CE1-CG1 3.77Å; F2332-I2360 HydrophobicContact CE1-CG2 3.51Å; F2332-I2360 VanDerWaalsContact CE1-CG2 3.41Å; F2332-I2360 HydrophobicContact CE2-CG2 4.41Å; F2332-I2360 HydrophobicContact CG-CG1 4.42Å; F2332-I2360 HydrophobicContact CZ-CD1 4.44Å; F2332-I2360 HydrophobicContact CZ-CG2 3.87Å
2333	S	82.1	Confident	69.7	Low	14.6 Å²	14.6	67 Å²	67	10%	0.102	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	140.1	167.3	61.2	0	0	0	0	111.2	S2359	S2333-S2359 PolarHBondContact N-O 3.03Å; S2333-S2359 PolarHBondContact O-N 3.05Å; S2333-S2359 PolarHBondContact O-OG 2.98Å; S2333-S2359 VanDerWaalsContact O-OG 3.08Å; S2333-S2359 PolarHBondContact OG-OG 3.02Å; S2333-S2359 VanDerWaalsContact OG-OG 3.07Å
2334	F	77.5	Confident	67.3	Low	38.8 Å²	38.8	72.4 Å²	72.4	17%	0.17	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	118	179.9	-59.8	-84.2	0	0	0	108.6	D2259 H2264 I2276 I2285 N2316 V2358	D2259-F2334 HydrophobicContact CB-CE2 4.39Å; H2264-F2334 HydrophobicContact CB-CE1 4.49Å; H2264-F2334 HydrophobicContact CB-CZ 4.14Å; H2264-F2334 AromaticContact CD2-CZ 3.86Å; H2264-F2334 AromaticContact CE1-CD1 3.78Å; H2264-F2334 AromaticContact CE1-CD2 3.88Å; H2264-F2334 AromaticContact CE1-CE1 3.81Å; H2264-F2334 AromaticContact CE1-CE2 3.78Å; H2264-F2334 AromaticContact CE1-CG 3.8Å; H2264-F2334 AromaticContact CE1-CZ 3.76Å; H2264-F2334 AromaticContact CG-CE1 3.93Å; H2264-F2334 AromaticContact CG-CZ 3.67Å; H2264-F2334 AromaticContact ND1-CD2 3.87Å; H2264-F2334 AromaticContact ND1-CE1 3.86Å; H2264-F2334 AromaticContact ND1-CE2 3.47Å; H2264-F2334 WeakPolarHBondContact ND1-CE2 3.34Å; H2264-F2334 AromaticContact ND1-CG 3.97Å; H2264-F2334 AromaticContact ND1-CZ 3.48Å; H2264-F2334 VanDerWaalsContact ND1-CZ 3.31Å; H2264-F2334 WeakPolarHBondContact ND1-CZ 3.45Å; H2264-F2334 AromaticContact NE2-CD1 3.96Å; H2264-F2334 AromaticContact NE2-CE1 3.84Å; H2264-F2334 AromaticContact NE2-CZ 3.83Å; I2276-F2334 HydrophobicContact CG2-CE1 4.28Å; I2276-F2334 HydrophobicContact CG2-CZ 4.27Å; I2285-F2334 HydrophobicContact CD1-CE1 4.37Å; N2316-F2334 WeakPolarHBondContact ND2-CE2 3.34Å; F2334-V2358 HydrophobicContact CD1-CG1 4.33Å; F2334-V2358 HydrophobicContact CD1-CG2 3.9Å; F2334-V2358 HydrophobicContact CE1-CG1 4.17Å; F2334-V2358 HydrophobicContact CE1-CG2 3.95Å
2335	K	66.7	Low	65.1	Low	126.8 Å²	126.8	79.8 Å²	79.8	55%	0.551	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	132.4	176.2	-67.7	-174.8	179.8	-178.7	0	109.9	G2337 C2356 D2357	K2335-G2337 PolarHBondContact O-N 3.11Å; K2335-C2356 CarbonylContact O-C 3.41Å; K2335-C2356 VanDerWaalsContact O-CA 3.3Å; K2335-C2356 WeakPolarHBondContact O-CA 3.36Å; K2335-D2357 PolarHBondContact N-O 2.84Å; K2335-D2357 PolarHBondContact O-N 3.19Å
2336	P	55.7	Low	62.8	Low	101.8 Å²	101.8	84.4 Å²	84.4	66%	0.661	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.9	126.7	170.7	18.6	-21.2	0	0	0	109.3	T2338	P2336-T2338 PolarHBondContact O-N 3.11Å; P2336-T2338 VanDerWaalsContact O-N 3.16Å
2337	G	50.5	Low	60.3	Low	26.2 Å²	26.2	91.6 Å²	91.6	27%	0.27	48%	0.484	S	S	.	.			trans	-67.1	102.8	-176.9	0	0	0	0	0	111.9	K2335 K2339 I2355	K2335-G2337 PolarHBondContact O-N 3.11Å; G2337-K2339 PolarHBondContact O-N 3.04Å; G2337-K2339 VanDerWaalsContact O-N 3.17Å; G2337-I2355 WeakPolarHBondContact CA-O 3.35Å; G2337-I2355 PolarHBondContact N-O 3.2Å; G2337-I2355 VanDerWaalsContact N-O 3.16Å
2338	T	45.5	Very low	57.9	Low	133.6 Å²	133.6	96.8 Å²	96.8	82%	0.82	52%	0.516	S	S	*	.			trans	-78.9	92.2	174.7	49.2	0	0	0	0	110.2	P2336 S2340	P2336-T2338 PolarHBondContact O-N 3.11Å; P2336-T2338 VanDerWaalsContact O-N 3.16Å; T2338-S2340 PolarHBondContact O-N 3.14Å; T2338-S2340 VanDerWaalsContact O-N 3.13Å
2339	K	43.2	Very low	55.3	Low	173.2 Å²	173.2	104.2 Å²	104.2	75%	0.753	55%	0.552	S	S	*	*			trans	-61.1	114.3	168.5	-74.9	-175.8	178.7	173.8	0	109.2	G2337 K2341 I2355	G2337-K2339 PolarHBondContact O-N 3.04Å; G2337-K2339 VanDerWaalsContact O-N 3.17Å; K2339-K2341 PolarHBondContact O-N 3.05Å; K2339-I2355 VanDerWaalsContact CE-CD1 3.48Å
2340	S	41.9	Very low	52.8	Low	115.4 Å²	115.4	108.8 Å²	108.8	81%	0.807	58%	0.583	S	S	*	*			trans	-67.8	115.3	177	60.7	0	0	0	0	110.8	T2338 R2342	T2338-S2340 PolarHBondContact O-N 3.14Å; T2338-S2340 VanDerWaalsContact O-N 3.13Å; S2340-R2342 PolarHBondContact O-N 2.97Å
2341	K	37.7	Very low	50.2	Low	200 Å²	200	114.9 Å²	114.9	87%	0.87	62%	0.617	S	S	*	*			trans	-61.1	117.1	174.2	-75.1	-177.8	173.3	-177.3	0	111.5	K2339 D2343	K2339-K2341 PolarHBondContact O-N 3.05Å; K2341-D2343 PolarHBondContact O-N 2.89Å
2342	R	39.6	Very low	47.9	Very low	231.8 Å²	231.8	122.2 Å²	122.2	88%	0.875	66%	0.655	S	S	*	*			trans	-143.6	108.2	141.8	-92.1	176.1	-172.9	-174.7	1.8	108	S2340	S2340-R2342 PolarHBondContact O-N 2.97Å
2343	D	42.3	Very low	45.8	Very low	151.8 Å²	151.8	130.6 Å²	130.6	81%	0.812	69%	0.694	S	S	*	*			trans	161.4	135.4	137.7	-75.8	-13.5	0	0	0	110.3	K2341	K2341-D2343 PolarHBondContact O-N 2.89Å
2344	D	40.1	Very low	44	Very low	147.2 Å²	147.2	133.3 Å²	133.3	79%	0.787	71%	0.713	S	S	*	*			trans	-69.8	146.2	-170.3	-62.1	-45.2	0	0	0	116	S2346	D2344-S2346 PolarHBondContact O-N 3.39Å; D2344-S2346 VanDerWaalsContact O-N 3.13Å
2345	N	39	Very low	42.6	Very low	165.8 Å²	165.8	136.5 Å²	136.5	89%	0.887	73%	0.731	S	S	*	*			trans	60.2	56.2	153.5	-63.7	-20.6	0	0	0	118.8
2346	S	39.5	Very low	42.1	Very low	96.8 Å²	96.8	133.3 Å²	133.3	68%	0.677	72%	0.723	S	S	*	*			trans	-139.6	120.5	147.8	56.7	0	0	0	0	111.3	D2344 V2348	D2344-S2346 PolarHBondContact O-N 3.39Å; D2344-S2346 VanDerWaalsContact O-N 3.13Å; S2346-V2348 PolarHBondContact O-N 2.91Å; S2346-V2348 VanDerWaalsContact O-N 3.16Å; S2346-V2348 WeakPolarHBondContact OG-CG2 3.48Å
2347	T	35.6	Very low	42.4	Very low	153 Å²	153	133.4 Å²	133.4	94%	0.939	72%	0.718	S	S	*	*			trans	-76.8	75.7	172	48	0	0	0	0	109.1	Q2349	T2347-Q2349 PolarHBondContact O-N 3.01Å
2348	V	39	Very low	43.5	Very low	110.8 Å²	110.8	133.8 Å²	133.8	67%	0.672	72%	0.716	S	S	*	*			trans	-99.3	110.1	172.2	-178.4	0	0	0	0	107.4	S2346 S2350	S2346-V2348 PolarHBondContact O-N 2.91Å; S2346-V2348 VanDerWaalsContact O-N 3.16Å; S2346-V2348 WeakPolarHBondContact OG-CG2 3.48Å; V2348-S2350 PolarHBondContact O-N 3.2Å
2349	Q	35.1	Very low	45.1	Very low	186.4 Å²	186.4	129.3 Å²	129.3	87%	0.871	69%	0.69	S	S	*	*			trans	-57.1	112.1	167.5	-90.3	168.6	-48.3	0	0	108.1	T2347 D2351	T2347-Q2349 PolarHBondContact O-N 3.01Å; Q2349-D2351 VanDerWaalsContact C-N 3.34Å; Q2349-D2351 PolarHBondContact O-N 3.03Å
2350	S	36.8	Very low	46.9	Very low	95.8 Å²	95.8	122.5 Å²	122.5	67%	0.67	66%	0.661	S	S	*	*			trans	-76.9	116.7	176.7	43.3	0	0	0	0	109.5	V2348 L2352	V2348-S2350 PolarHBondContact O-N 3.2Å; S2350-L2352 PolarHBondContact O-N 3.17Å
2351	D	35.2	Very low	48.8	Very low	138.4 Å²	138.4	119.7 Å²	119.7	74%	0.74	64%	0.639	S	S	*	*			trans	-51	106.2	172.9	-67.5	-48.1	0	0	0	111.1	Q2349 H2353 S2354	Q2349-D2351 VanDerWaalsContact C-N 3.34Å; Q2349-D2351 PolarHBondContact O-N 3.03Å; D2351-H2353 PolarHBondContact O-N 3.1Å; D2351-S2354 PolarHBondContact O-N 3.11Å; D2351-S2354 VanDerWaalsContact O-N 3.12Å; D2351-S2354 PolarHBondContact O-OG 3.28Å; D2351-S2354 VanDerWaalsContact O-OG 3.06Å
2352	L	37.8	Very low	50.9	Low	157.4 Å²	157.4	113.4 Å²	113.4	82%	0.824	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	18.5	-174.9	-106.4	133.6	0	0	0	113.7	S2350	S2350-L2352 PolarHBondContact O-N 3.17Å
2353	H	41.3	Very low	52.9	Low	176.6 Å²	176.6	103.1 Å²	103.1	82%	0.818	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	19	177.2	-75.4	-59.4	0	0	0	113	D2351 I2355	D2351-H2353 PolarHBondContact O-N 3.1Å; H2353-I2355 PolarHBondContact O-N 3.28Å
2354	S	44	Very low	54.8	Low	71.8 Å²	71.8	99.2 Å²	99.2	50%	0.502	56%	0.556	S	S	.	*	S	Bend	trans	-94	103.6	-172.6	61.9	0	0	0	0	114.2	D2351 C2356	D2351-S2354 PolarHBondContact O-N 3.11Å; D2351-S2354 VanDerWaalsContact O-N 3.12Å; D2351-S2354 PolarHBondContact O-OG 3.28Å; D2351-S2354 VanDerWaalsContact O-OG 3.06Å; S2354-C2356 PolarHBondContact O-N 2.89Å
2355	I	48.8	Very low	56.8	Low	106.2 Å²	106.2	95 Å²	95	55%	0.545	54%	0.535	S	S	.	.			trans	43.7	96.9	163.5	-50.3	168.8	0	0	0	113.2	G2337 K2339 H2353 D2357	G2337-I2355 WeakPolarHBondContact CA-O 3.35Å; G2337-I2355 PolarHBondContact N-O 3.2Å; G2337-I2355 VanDerWaalsContact N-O 3.16Å; K2339-I2355 VanDerWaalsContact CE-CD1 3.48Å; H2353-I2355 PolarHBondContact O-N 3.28Å; I2355-D2357 PolarHBondContact O-N 3.19Å
2356	C	54.9	Low	58.9	Low	58.4 Å²	58.4	88 Å²	88	40%	0.395	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	124.1	164.3	-66.2	0	0	0	0	109.3	K2335 S2354 V2358	K2335-C2356 CarbonylContact O-C 3.41Å; K2335-C2356 VanDerWaalsContact O-CA 3.3Å; K2335-C2356 WeakPolarHBondContact O-CA 3.36Å; S2354-C2356 PolarHBondContact O-N 2.89Å; C2356-V2358 PolarHBondContact O-N 2.89Å
2357	D	62.4	Low	61	Low	104.2 Å²	104.2	84.6 Å²	84.6	56%	0.557	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	116.1	169.2	-80.3	-34.4	0	0	0	108.7	K2335 I2355 S2359	K2335-D2357 PolarHBondContact N-O 2.84Å; K2335-D2357 PolarHBondContact O-N 3.19Å; I2355-D2357 PolarHBondContact O-N 3.19Å; D2357-S2359 PolarHBondContact O-N 2.98Å
2358	V	73.5	Confident	63.3	Low	35.2 Å²	35.2	77.4 Å²	77.4	21%	0.213	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	116.6	177.1	-171.8	0	0	0	0	108.9	I2276 I2285 F2286 F2332 F2334 C2356 I2360	I2276-V2358 HydrophobicContact CD1-CG1 4.38Å; I2285-V2358 HydrophobicContact CB-CG2 4.43Å; I2285-V2358 HydrophobicContact CG2-CG2 3.4Å; I2285-V2358 VanDerWaalsContact CG2-CG2 3.47Å; F2286-V2358 HydrophobicContact CB-CG2 4.47Å; F2332-V2358 HydrophobicContact CD1-CG1 4.44Å; F2334-V2358 HydrophobicContact CD1-CG1 4.33Å; F2334-V2358 HydrophobicContact CD1-CG2 3.9Å; F2334-V2358 HydrophobicContact CE1-CG1 4.17Å; F2334-V2358 HydrophobicContact CE1-CG2 3.95Å; C2356-V2358 PolarHBondContact O-N 2.89Å; V2358-I2360 HydrophobicContact CG1-CD1 4.09Å; V2358-I2360 HydrophobicContact CG1-CG1 3.83Å
2359	S	79.4	Confident	65.7	Low	39.6 Å²	39.6	72.1 Å²	72.1	28%	0.277	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	126.1	170.2	61.9	0	0	0	0	110.5	S2333 D2357	S2333-S2359 PolarHBondContact N-O 3.03Å; S2333-S2359 PolarHBondContact O-N 3.05Å; S2333-S2359 PolarHBondContact O-OG 2.98Å; S2333-S2359 VanDerWaalsContact O-OG 3.08Å; S2333-S2359 PolarHBondContact OG-OG 3.02Å; S2333-S2359 VanDerWaalsContact OG-OG 3.07Å; D2357-S2359 PolarHBondContact O-N 2.98Å
2360	I	80.3	Confident	68	Low	30 Å²	30	63.2 Å²	63.2	15%	0.154	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	121.7	-176.7	-57.8	178.4	0	0	0	108.5	I2276 F2286 L2291 Y2330 H2331 F2332 V2358	I2276-I2360 HydrophobicContact CD1-CD1 4.33Å; F2286-I2360 HydrophobicContact CD1-CD1 3.5Å; F2286-I2360 VanDerWaalsContact CD1-CD1 3.5Å; F2286-I2360 HydrophobicContact CD2-CD1 3.8Å; F2286-I2360 HydrophobicContact CE1-CD1 3.27Å; F2286-I2360 HydrophobicContact CE2-CD1 3.59Å; F2286-I2360 VanDerWaalsContact CE2-CD1 3.46Å; F2286-I2360 HydrophobicContact CG-CD1 3.77Å; F2286-I2360 HydrophobicContact CZ-CD1 3.32Å; L2291-I2360 HydrophobicContact CD1-CD1 4.38Å; L2291-I2360 HydrophobicContact CD1-CG2 4.36Å; L2291-I2360 HydrophobicContact CD2-CG2 4.43Å; Y2330-I2360 HydrophobicContact CD1-CG2 4.03Å; Y2330-I2360 HydrophobicContact CE1-CG2 4.44Å; H2331-I2360 WeakPolarHBondContact O-CA 3.33Å; F2332-I2360 HydrophobicContact CD1-CB 4.12Å; F2332-I2360 HydrophobicContact CD1-CD1 4.15Å; F2332-I2360 HydrophobicContact CD1-CG1 3.63Å; F2332-I2360 HydrophobicContact CD1-CG2 3.84Å; F2332-I2360 HydrophobicContact CE1-CB 4.16Å; F2332-I2360 HydrophobicContact CE1-CD1 3.84Å; F2332-I2360 HydrophobicContact CE1-CG1 3.77Å; F2332-I2360 HydrophobicContact CE1-CG2 3.51Å; F2332-I2360 VanDerWaalsContact CE1-CG2 3.41Å; F2332-I2360 HydrophobicContact CE2-CG2 4.41Å; F2332-I2360 HydrophobicContact CG-CG1 4.42Å; F2332-I2360 HydrophobicContact CZ-CD1 4.44Å; F2332-I2360 HydrophobicContact CZ-CG2 3.87Å; V2358-I2360 HydrophobicContact CG1-CD1 4.09Å; V2358-I2360 HydrophobicContact CG1-CG1 3.83Å
2361	V	81.6	Confident	70	Confident	55.8 Å²	55.8	62.2 Å²	62.2	34%	0.338	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	116.7	176.4	-176	0	0	0	0	108.9	Y2330 H2331 L2363 L2412	Y2330-V2361 WeakPolarHBondContact CA-O 3.32Å; H2331-V2361 HydrophobicContact CB-CB 4.26Å; H2331-V2361 WeakPolarHBondContact CB-O 3.49Å; H2331-V2361 PolarHBondContact N-O 3.08Å; H2331-V2361 PolarHBondContact O-N 3.33Å; V2361-L2363 HydrophobicContact CG1-CD2 4.39Å; V2361-L2363 PolarHBondContact O-N 3.14Å; V2361-L2412 HydrophobicContact CB-CD1 4.36Å; V2361-L2412 HydrophobicContact CG1-CD1 4.34Å
2362	P	81.6	Confident	72	Confident	68.6 Å²	68.6	63.9 Å²	63.9	45%	0.445	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	125.4	170.2	29.1	-31.6	0	0	0	109.3	L2294 Y2330	L2294-P2362 HydrophobicContact CD1-CG 4.31Å; L2294-P2362 HydrophobicContact CD2-CG 4.35Å; Y2330-P2362 HydrophobicContact CD1-CB 4.11Å; Y2330-P2362 HydrophobicContact CE1-CB 4.03Å
2363	L	82.7	Confident	74	Confident	15.8 Å²	15.8	59.8 Å²	59.8	8%	0.083	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-43.9	-177	-59.4	175.5	0	0	0	112	Y2311 L2317 L2329 H2331 V2361 V2408 L2412 P2415	Y2311-L2363 HydrophobicContact CE2-CD1 4.02Å; Y2311-L2363 HydrophobicContact CE2-CD2 3.95Å; L2317-L2363 HydrophobicContact CD1-CD1 3.72Å; L2329-L2363 HydrophobicContact CB-CB 4.19Å; L2329-L2363 HydrophobicContact CB-CD1 4.47Å; L2329-L2363 PolarHBondContact O-N 2.82Å; H2331-L2363 HydrophobicContact CB-CD1 4.11Å; H2331-L2363 HydrophobicContact CB-CD2 4.04Å; H2331-L2363 HydrophobicContact CB-CG 4.13Å; V2361-L2363 HydrophobicContact CG1-CD2 4.39Å; V2361-L2363 PolarHBondContact O-N 3.14Å; L2363-V2408 HydrophobicContact CD1-CG1 4.11Å; L2363-L2412 HydrophobicContact CD2-CD1 3.67Å; L2363-P2415 HydrophobicContact CB-CB 4.41Å; L2363-P2415 HydrophobicContact CB-CG 4.3Å; L2363-P2415 HydrophobicContact CD2-CB 4.19Å; L2363-P2415 HydrophobicContact CD2-CG 4.16Å; L2363-P2415 WeakPolarHBondContact O-CG 3.44Å
2364	Y	82.7	Confident	75.6	Confident	70 Å²	70	53.4 Å²	53.4	28%	0.275	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	148.4	-172	-172.4	-111.7	0	0	0	111.6	R2328 L2329 S2366 Y2406 V2417	R2328-Y2364 VanDerWaalsContact CA-O 3.29Å; R2328-Y2364 WeakPolarHBondContact CA-O 3.26Å; L2329-Y2364 HydrophobicContact CD1-CD1 4.43Å; L2329-Y2364 PolarHBondContact N-O 3.02Å; L2329-Y2364 PolarHBondContact O-N 3.09Å; Y2364-S2366 VanDerWaalsContact CE1-CB 3.41Å; Y2364-Y2406 HydrophobicContact CD1-CD1 4.27Å; Y2364-Y2406 AromaticContact CE1-CD1 3.9Å; Y2364-Y2406 HydrophobicContact CE1-CD1 3.94Å; Y2364-Y2406 HydrophobicContact CE1-CE1 4.06Å; Y2364-V2417 HydrophobicContact CD1-CB 4.31Å; Y2364-V2417 HydrophobicContact CD1-CG1 3.81Å; Y2364-V2417 HydrophobicContact CD2-CB 3.88Å; Y2364-V2417 HydrophobicContact CD2-CG1 4.26Å; Y2364-V2417 HydrophobicContact CD2-CG2 4.27Å; Y2364-V2417 HydrophobicContact CE1-CG1 4.04Å; Y2364-V2417 HydrophobicContact CE2-CB 4.28Å; Y2364-V2417 HydrophobicContact CE2-CG1 4.38Å; Y2364-V2417 HydrophobicContact CG-CB 3.91Å; Y2364-V2417 HydrophobicContact CG-CG1 3.92Å; Y2364-V2417 HydrophobicContact CG-CG2 4.04Å
2365	T	82.3	Confident	76.9	Confident	59 Å²	59	56.9 Å²	56.9	36%	0.362	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	132.1	175.3	-49.1	0	0	0	0	109	I2295 V2327 R2328 W2367	I2295-T2365 HydrophobicContact CD1-CG2 4.48Å; V2327-T2365 WeakPolarHBondContact O-CA 3.38Å; R2328-T2365 HydrophobicContact CB-CG2 4.44Å; R2328-T2365 HydrophobicContact CG-CG2 3.88Å; R2328-T2365 WeakPolarHBondContact CG-OG1 3.42Å; R2328-T2365 PolarHBondContact NE-OG1 2.85Å; T2365-W2367 HydrophobicContact CG2-CH2 4.35Å; T2365-W2367 HydrophobicContact CG2-CZ3 4.39Å
2366	S	82.4	Confident	77.7	Confident	18 Å²	18	56.9 Å²	56.9	13%	0.126	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	151.9	178	-167.1	0	0	0	0	110.6	A2326 V2327 Y2364 S2368	A2326-S2366 CarbonylContact C-O 3.55Å; A2326-S2366 WeakPolarHBondContact CA-O 3.36Å; V2327-S2366 CarbonylContact C-O 3.59Å; V2327-S2366 PolarHBondContact N-O 3.28Å; V2327-S2366 PolarHBondContact O-N 3.11Å; Y2364-S2366 VanDerWaalsContact CE1-CB 3.41Å; S2366-S2368 VanDerWaalsContact C-N 3.33Å; S2366-S2368 WeakPolarHBondContact CB-OG 3.47Å; S2366-S2368 PolarHBondContact O-N 3.4Å; S2366-S2368 PolarHBondContact OG-N 2.94Å; S2366-S2368 PolarHBondContact OG-OG 3.05Å
2367	W	83.6	Confident	78.1	Confident	26.2 Å²	26.2	54.8 Å²	54.8	10%	0.099	30%	0.296	C	S	.	.			trans	-106.6	43.3	178.9	-64.7	93.5	0	0	0	111.2	I2295 D2297 G2325 A2326 T2365 H2369 S2370 H2373 A2374 E2375 N2376	I2295-W2367 HydrophobicContact CD1-CH2 4.23Å; I2295-W2367 HydrophobicContact CD1-CZ2 3.63Å; I2295-W2367 VanDerWaalsContact CD1-CZ2 3.41Å; I2295-W2367 HydrophobicContact CG1-CZ2 4.5Å; I2295-W2367 HydrophobicContact CG2-CH2 4.4Å; I2295-W2367 HydrophobicContact CG2-CZ2 4.12Å; D2297-W2367 HydrophobicContact CB-CH2 4.45Å; D2297-W2367 WeakPolarHBondContact OD1-CH2 3.39Å; D2297-W2367 VanDerWaalsContact OD1-CZ3 3.3Å; D2297-W2367 WeakPolarHBondContact OD1-CZ3 3.49Å; D2297-W2367 VanDerWaalsContact OD2-CH2 3.25Å; D2297-W2367 WeakPolarHBondContact OD2-CH2 3.31Å; D2297-W2367 WeakPolarHBondContact OD2-CZ3 3.17Å; G2325-W2367 CarbonylContact O-C 3.54Å; A2326-W2367 HydrophobicContact CB-CD2 4.24Å; A2326-W2367 HydrophobicContact CB-CE3 3.8Å; A2326-W2367 HydrophobicContact CB-CH2 4.33Å; A2326-W2367 HydrophobicContact CB-CZ3 3.85Å; T2365-W2367 HydrophobicContact CG2-CH2 4.35Å; T2365-W2367 HydrophobicContact CG2-CZ3 4.39Å; W2367-H2369 PolarHBondContact O-N 2.95Å; W2367-H2369 VanDerWaalsContact O-N 3.12Å; W2367-S2370 WeakPolarHBondContact CB-OG 3.29Å; W2367-S2370 WeakPolarHBondContact O-CB 3.38Å; W2367-S2370 PolarHBondContact O-N 2.99Å; W2367-S2370 VanDerWaalsContact O-N 3.17Å; W2367-S2370 PolarHBondContact O-OG 3.23Å; W2367-S2370 VanDerWaalsContact O-OG 3.09Å; W2367-H2373 WeakPolarHBondContact CB-O 3.32Å; W2367-H2373 CarbonylContact O-C 3.58Å; W2367-H2373 WeakPolarHBondContact O-CA 3.39Å; W2367-H2373 PolarHBondContact O-ND1 3.36Å; W2367-A2374 WeakPolarHBondContact CB-O 3.46Å; W2367-E2375 HydrophobicContact CD2-CB 4.28Å; W2367-E2375 HydrophobicContact CD2-CG 4.27Å; W2367-E2375 HydrophobicContact CE3-CB 3.99Å; W2367-E2375 HydrophobicContact CE3-CG 3.6Å; W2367-E2375 HydrophobicContact CG-CB 4.45Å; W2367-E2375 HydrophobicContact CG-CG 4.48Å; W2367-E2375 HydrophobicContact CH2-CB 3.65Å; W2367-E2375 HydrophobicContact CH2-CG 3.65Å; W2367-E2375 WeakPolarHBondContact CH2-O 3.45Å; W2367-E2375 HydrophobicContact CZ2-CB 4.06Å; W2367-E2375 HydrophobicContact CZ2-CG 4.19Å; W2367-E2375 WeakPolarHBondContact CZ2-O 3.41Å; W2367-E2375 HydrophobicContact CZ3-CB 3.76Å; W2367-E2375 HydrophobicContact CZ3-CG 3.28Å; W2367-E2375 VanDerWaalsContact CZ3-CG 3.49Å; W2367-E2375 VanDerWaalsContact CZ3-OE1 3.28Å; W2367-E2375 WeakPolarHBondContact CZ3-OE1 3.38Å; W2367-N2376 VanDerWaalsContact CE2-N 3.28Å; W2367-N2376 VanDerWaalsContact CH2-CA 3.41Å; W2367-N2376 HydrophobicContact CH2-CB 4.36Å; W2367-N2376 VanDerWaalsContact CH2-N 3.3Å; W2367-N2376 WeakPolarHBondContact CH2-OD1 2.89Å; W2367-N2376 VanDerWaalsContact CZ2-N 3.3Å; W2367-N2376 VanDerWaalsContact CZ2-OD1 3.25Å; W2367-N2376 WeakPolarHBondContact CZ2-OD1 3.35Å; W2367-N2376 VanDerWaalsContact CZ3-N 3.35Å
2368	S	84.6	Confident	78.6	Confident	0.2 Å²	0.2	54.6 Å²	54.6	0%	0.001	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.7	-168.8	-51.3	0	0	0	0	115.5	G2325 V2327 S2366 H2373 N2400 W2404 Y2406	G2325-S2368 PolarHBondContact O-N 3.18Å; V2327-S2368 VanDerWaalsContact CG2-OG 3.31Å; V2327-S2368 WeakPolarHBondContact CG2-OG 3.24Å; S2366-S2368 VanDerWaalsContact C-N 3.33Å; S2366-S2368 WeakPolarHBondContact CB-OG 3.47Å; S2366-S2368 PolarHBondContact O-N 3.4Å; S2366-S2368 PolarHBondContact OG-N 2.94Å; S2366-S2368 PolarHBondContact OG-OG 3.05Å; S2368-H2373 PolarHBondContact O-CE1 2.92Å; S2368-H2373 VanDerWaalsContact O-CE1 3.26Å; S2368-H2373 PolarHBondContact O-ND1 2.97Å; S2368-H2373 VanDerWaalsContact O-ND1 3.11Å; S2368-N2400 PolarHBondContact O-ND2 3.31Å; S2368-N2400 VanDerWaalsContact O-ND2 3.14Å; S2368-W2404 VanDerWaalsContact CB-CG 3.5Å; S2368-W2404 PolarHBondContact O-NE1 3.14Å; S2368-W2404 VanDerWaalsContact O-NE1 3.14Å; S2368-W2404 VanDerWaalsContact OG-CD2 3.24Å; S2368-Y2406 VanDerWaalsContact CB-OH 3.25Å; S2368-Y2406 WeakPolarHBondContact CB-OH 3.43Å; S2368-Y2406 PolarHBondContact OG-OH 3.08Å
2369	H	88.7	Confident	78.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	17.3	-179.4	-53.2	-68	0	0	0	113.4	G2325 W2367 G2379 E2380 T2384 S2396 G2398 N2400 E2402 W2404	G2325-H2369 VanDerWaalsContact CA-C 3.48Å; G2325-H2369 PolarHBondContact O-N 3.19Å; W2367-H2369 PolarHBondContact O-N 2.95Å; W2367-H2369 VanDerWaalsContact O-N 3.12Å; H2369-G2379 WeakPolarHBondContact O-CA 3.33Å; H2369-E2380 PolarHBondContact O-N 2.91Å; H2369-E2380 VanDerWaalsContact O-N 3.15Å; H2369-T2384 PolarHBondContact CD2-OG1 3.07Å; H2369-T2384 VanDerWaalsContact CD2-OG1 3.31Å; H2369-S2396 WeakPolarHBondContact NE2-CB 3.37Å; H2369-S2396 PolarHBondContact NE2-OG 3.02Å; H2369-G2398 PolarHBondContact CE1-N 2.81Å; H2369-G2398 VanDerWaalsContact CE1-N 3.28Å; H2369-G2398 WeakPolarHBondContact ND1-CA 3.27Å; H2369-G2398 PolarHBondContact ND1-N 3.4Å; H2369-N2400 PolarHBondContact ND1-OD1 2.95Å; H2369-E2402 PolarHBondContact CE1-O 3.13Å; H2369-E2402 VanDerWaalsContact CE1-O 3.27Å; H2369-W2404 AromaticContact CE1-CD1 3.54Å; H2369-W2404 VanDerWaalsContact CE1-CD1 3.48Å; H2369-W2404 AromaticContact ND1-CD1 3.95Å
2370	S	83.9	Confident	78	Confident	0.4 Å²	0.4	55.9 Å²	55.9	0%	0.003	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-86.2	159.4	169.7	72.9	0	0	0	0	110.9	S2324 W2367 E2372 H2373 A2374 T2378	S2324-S2370 VanDerWaalsContact O-CB 3.31Å; S2324-S2370 WeakPolarHBondContact O-CB 3.32Å; W2367-S2370 WeakPolarHBondContact CB-OG 3.29Å; W2367-S2370 WeakPolarHBondContact O-CB 3.38Å; W2367-S2370 PolarHBondContact O-N 2.99Å; W2367-S2370 VanDerWaalsContact O-N 3.17Å; W2367-S2370 PolarHBondContact O-OG 3.23Å; W2367-S2370 VanDerWaalsContact O-OG 3.09Å; S2370-E2372 PolarHBondContact O-N 3.1Å; S2370-H2373 PolarHBondContact O-N 2.96Å; S2370-H2373 VanDerWaalsContact O-N 3.1Å; S2370-H2373 VanDerWaalsContact OG-C 3.3Å; S2370-H2373 VanDerWaalsContact OG-CA 3.26Å; S2370-H2373 WeakPolarHBondContact OG-CA 3.33Å; S2370-A2374 PolarHBondContact OG-N 3.08Å; S2370-A2374 VanDerWaalsContact OG-N 3.13Å; S2370-A2374 PolarHBondContact OG-O 3.08Å; S2370-A2374 VanDerWaalsContact OG-O 3.1Å; S2370-T2378 WeakPolarHBondContact CA-O 3.35Å
2371	I	78.7	Confident	77.7	Confident	74 Å²	74	57.3 Å²	57.3	38%	0.379	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-55	127.8	172.7	-67.2	172.6	0	0	0	109.5	H2373 A2374 T2378 E2380	I2371-H2373 PolarHBondContact O-N 3.02Å; I2371-A2374 WeakPolarHBondContact O-CB 3.38Å; I2371-A2374 PolarHBondContact O-N 3.08Å; I2371-A2374 VanDerWaalsContact O-N 3.11Å; I2371-T2378 WeakPolarHBondContact CD1-O 3.28Å; I2371-T2378 VanDerWaalsContact CD1-OG1 3.27Å; I2371-T2378 WeakPolarHBondContact CD1-OG1 3.43Å; I2371-T2378 VanDerWaalsContact CG1-O 3.27Å; I2371-T2378 WeakPolarHBondContact CG1-O 3.45Å; I2371-T2378 PolarHBondContact N-O 2.81Å; I2371-E2380 HydrophobicContact CB-CG 4.28Å; I2371-E2380 HydrophobicContact CG1-CB 3.81Å; I2371-E2380 HydrophobicContact CG1-CG 3.92Å; I2371-E2380 VanDerWaalsContact CG1-CG 3.49Å
2372	E	76.7	Confident	77.5	Confident	174 Å²	174	56.2 Å²	56.2	81%	0.813	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	56.1	17.1	-178.3	-61.9	-179.7	171.5	0	0	114.8	S2370 A2374	S2370-E2372 PolarHBondContact O-N 3.1Å; E2372-A2374 PolarHBondContact O-N 3Å; E2372-A2374 VanDerWaalsContact O-N 3.15Å
2373	H	79.7	Confident	77.8	Confident	71 Å²	71	52.9 Å²	52.9	33%	0.329	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	55.2	25.7	-170.6	-45.5	-56.6	0	0	0	113.8	W2367 S2368 S2370 I2371 E2402 W2404	W2367-H2373 WeakPolarHBondContact CB-O 3.32Å; W2367-H2373 CarbonylContact O-C 3.58Å; W2367-H2373 WeakPolarHBondContact O-CA 3.39Å; W2367-H2373 PolarHBondContact O-ND1 3.36Å; S2368-H2373 PolarHBondContact O-CE1 2.92Å; S2368-H2373 VanDerWaalsContact O-CE1 3.26Å; S2368-H2373 PolarHBondContact O-ND1 2.97Å; S2368-H2373 VanDerWaalsContact O-ND1 3.11Å; S2370-H2373 PolarHBondContact O-N 2.96Å; S2370-H2373 VanDerWaalsContact O-N 3.1Å; S2370-H2373 VanDerWaalsContact OG-C 3.3Å; S2370-H2373 VanDerWaalsContact OG-CA 3.26Å; S2370-H2373 WeakPolarHBondContact OG-CA 3.33Å; I2371-H2373 PolarHBondContact O-N 3.02Å; H2373-E2402 IonicContact CE1-OE1 2.96Å; H2373-E2402 IonicContact CE1-OE2 3.26Å; H2373-E2402 PolarHBondContact CE1-OE2 3.07Å; H2373-E2402 IonicContact ND1-OE2 3.35Å; H2373-E2402 IonicContact NE2-OE1 2.89Å; H2373-E2402 IonicContact NE2-OE2 3.58Å; H2373-W2404 AromaticContact CE1-CZ2 3.86Å; H2373-W2404 AromaticContact ND1-CZ2 3.99Å; H2373-W2404 AromaticContact NE2-CZ2 3.92Å
2374	A	74.3	Confident	78.2	Confident	42.6 Å²	42.6	52.2 Å²	52.2	35%	0.352	29%	0.294	S	S	.	.			trans	-73	141.1	-176.3	0	0	0	0	0	112	W2367 S2370 I2371 E2372 N2376 G2377	W2367-A2374 WeakPolarHBondContact CB-O 3.46Å; S2370-A2374 PolarHBondContact OG-N 3.08Å; S2370-A2374 VanDerWaalsContact OG-N 3.13Å; S2370-A2374 PolarHBondContact OG-O 3.08Å; S2370-A2374 VanDerWaalsContact OG-O 3.1Å; I2371-A2374 WeakPolarHBondContact O-CB 3.38Å; I2371-A2374 PolarHBondContact O-N 3.08Å; I2371-A2374 VanDerWaalsContact O-N 3.11Å; E2372-A2374 PolarHBondContact O-N 3Å; E2372-A2374 VanDerWaalsContact O-N 3.15Å; A2374-N2376 PolarHBondContact O-N 3.15Å; A2374-G2377 PolarHBondContact O-N 3.12Å; A2374-G2377 VanDerWaalsContact O-N 3.08Å
2375	E	71.5	Confident	78.7	Confident	145.2 Å²	145.2	51.3 Å²	51.3	68%	0.679	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	115.9	174.1	-68.3	-169.8	161.1	0	0	111.5	W2367 G2377	W2367-E2375 HydrophobicContact CD2-CB 4.28Å; W2367-E2375 HydrophobicContact CD2-CG 4.27Å; W2367-E2375 HydrophobicContact CE3-CB 3.99Å; W2367-E2375 HydrophobicContact CE3-CG 3.6Å; W2367-E2375 HydrophobicContact CG-CB 4.45Å; W2367-E2375 HydrophobicContact CG-CG 4.48Å; W2367-E2375 HydrophobicContact CH2-CB 3.65Å; W2367-E2375 HydrophobicContact CH2-CG 3.65Å; W2367-E2375 WeakPolarHBondContact CH2-O 3.45Å; W2367-E2375 HydrophobicContact CZ2-CB 4.06Å; W2367-E2375 HydrophobicContact CZ2-CG 4.19Å; W2367-E2375 WeakPolarHBondContact CZ2-O 3.41Å; W2367-E2375 HydrophobicContact CZ3-CB 3.76Å; W2367-E2375 HydrophobicContact CZ3-CG 3.28Å; W2367-E2375 VanDerWaalsContact CZ3-CG 3.49Å; W2367-E2375 VanDerWaalsContact CZ3-OE1 3.28Å; W2367-E2375 WeakPolarHBondContact CZ3-OE1 3.38Å; E2375-G2377 PolarHBondContact O-N 3.15Å
2376	N	65.4	Low	79.1	Confident	106 Å²	106	49.1 Å²	49.1	57%	0.567	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	21.8	-175.7	-54.8	-51	0	0	0	113.9	I2295 W2367 A2374	I2295-N2376 WeakPolarHBondContact CG2-OD1 3.34Å; W2367-N2376 VanDerWaalsContact CE2-N 3.28Å; W2367-N2376 VanDerWaalsContact CH2-CA 3.41Å; W2367-N2376 HydrophobicContact CH2-CB 4.36Å; W2367-N2376 VanDerWaalsContact CH2-N 3.3Å; W2367-N2376 WeakPolarHBondContact CH2-OD1 2.89Å; W2367-N2376 VanDerWaalsContact CZ2-N 3.3Å; W2367-N2376 VanDerWaalsContact CZ2-OD1 3.25Å; W2367-N2376 WeakPolarHBondContact CZ2-OD1 3.35Å; W2367-N2376 VanDerWaalsContact CZ3-N 3.35Å; A2374-N2376 PolarHBondContact O-N 3.15Å
2377	G	63.4	Low	79.7	Confident	15.2 Å²	15.2	49.1 Å²	49.1	16%	0.157	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-66.5	156.6	172.3	0	0	0	0	0	112.1	S2324 A2374 E2375	S2324-G2377 VanDerWaalsContact O-O 3.1Å; A2374-G2377 PolarHBondContact O-N 3.12Å; A2374-G2377 VanDerWaalsContact O-N 3.08Å; E2375-G2377 PolarHBondContact O-N 3.15Å
2378	T	72.9	Confident	80.1	Confident	99.8 Å²	99.8	48.3 Å²	48.3	61%	0.612	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-75.2	144.5	168.7	53	0	0	0	0	110	S2324 S2370 I2371 E2380	S2324-T2378 CarbonylContact O-C 3.57Å; S2370-T2378 WeakPolarHBondContact CA-O 3.35Å; I2371-T2378 WeakPolarHBondContact CD1-O 3.28Å; I2371-T2378 VanDerWaalsContact CD1-OG1 3.27Å; I2371-T2378 WeakPolarHBondContact CD1-OG1 3.43Å; I2371-T2378 VanDerWaalsContact CG1-O 3.27Å; I2371-T2378 WeakPolarHBondContact CG1-O 3.45Å; I2371-T2378 PolarHBondContact N-O 2.81Å; T2378-E2380 PolarHBondContact O-N 2.98Å
2379	G	69.9	Low	80.3	Confident	20.2 Å²	20.2	48.9 Å²	48.9	21%	0.208	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-65.2	126.3	-179.6	0	0	0	0	0	111.8	S2323 S2324 H2369 A2381	S2323-G2379 VanDerWaalsContact O-CA 3.32Å; S2323-G2379 WeakPolarHBondContact O-CA 3.41Å; S2324-G2379 VanDerWaalsContact C-CA 3.44Å; S2324-G2379 VanDerWaalsContact O-CA 3.28Å; S2324-G2379 WeakPolarHBondContact O-CA 3.39Å; S2324-G2379 PolarHBondContact O-N 3.13Å; S2324-G2379 VanDerWaalsContact O-N 3.11Å; H2369-G2379 WeakPolarHBondContact O-CA 3.33Å; G2379-A2381 PolarHBondContact O-N 3.08Å
2380	E	70.5	Confident	80.2	Confident	81.4 Å²	81.4	49.6 Å²	49.6	38%	0.38	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-72.9	128.6	179.5	-137.4	-178.8	-179.9	0	0	110.4	H2369 I2371 T2378 G2382 G2383 G2399 N2400	H2369-E2380 PolarHBondContact O-N 2.91Å; H2369-E2380 VanDerWaalsContact O-N 3.15Å; I2371-E2380 HydrophobicContact CB-CG 4.28Å; I2371-E2380 HydrophobicContact CG1-CB 3.81Å; I2371-E2380 HydrophobicContact CG1-CG 3.92Å; I2371-E2380 VanDerWaalsContact CG1-CG 3.49Å; T2378-E2380 PolarHBondContact O-N 2.98Å; E2380-G2382 PolarHBondContact O-N 2.88Å; E2380-G2383 PolarHBondContact O-N 2.97Å; E2380-G2383 VanDerWaalsContact O-N 3.14Å; E2380-G2399 CarbonylContact O-C 3.51Å; E2380-G2399 VanDerWaalsContact O-CA 3.24Å; E2380-G2399 WeakPolarHBondContact O-CA 3.41Å; E2380-N2400 HydrophobicContact CB-CB 3.96Å; E2380-N2400 HydrophobicContact CG-CB 4.24Å; E2380-N2400 PolarHBondContact O-N 3.33Å; E2380-N2400 WeakPolarHBondContact OE2-CB 3.38Å; E2380-N2400 PolarHBondContact OE2-ND2 3.05Å
2381	A	74.1	Confident	79.9	Confident	60.2 Å²	60.2	52.7 Å²	52.7	50%	0.498	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	47.8	28.2	176.1	0	0	0	0	0	115.5	G2379 G2399 Q2428	G2379-A2381 PolarHBondContact O-N 3.08Å; A2381-G2399 VanDerWaalsContact CB-O 3.31Å; A2381-G2399 WeakPolarHBondContact CB-O 3.3Å; A2381-G2399 WeakPolarHBondContact O-CA 3.37Å; A2381-Q2428 PolarHBondContact O-NE2 3.01Å
2382	G	78.2	Confident	80.1	Confident	32.6 Å²	32.6	53.4 Å²	53.4	34%	0.336	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	128.1	-16.4	177.3	0	0	0	0	0	115.4	Q2302 E2380	Q2302-G2382 VanDerWaalsContact CD-O 3.31Å; Q2302-G2382 PolarHBondContact NE2-O 3.04Å; Q2302-G2382 PolarHBondContact OE1-O 2.9Å; Q2302-G2382 VanDerWaalsContact OE1-O 3.06Å; E2380-G2382 PolarHBondContact O-N 2.88Å
2383	G	88.5	Confident	80.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.269	C	S	.	.	S	Bend	trans	83.6	-144.9	-177.4	0	0	0	0	0	113.2	S2323 E2380 L2385 G2398 G2399	S2323-G2383 WeakPolarHBondContact O-CA 3.3Å; E2380-G2383 PolarHBondContact O-N 2.97Å; E2380-G2383 VanDerWaalsContact O-N 3.14Å; G2383-L2385 PolarHBondContact O-N 2.96Å; G2383-G2398 CarbonylContact O-C 3.56Å; G2383-G2398 WeakPolarHBondContact O-CA 3.33Å; G2383-G2399 PolarHBondContact O-N 3.08Å
2384	T	91.3	Very high	81.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	93.8	-176.8	-51	0	0	0	0	111.7	Q2302 A2303 W2322 G2325 A2326 V2327 H2369 C2386	Q2302-T2384 VanDerWaalsContact CB-O 3.24Å; Q2302-T2384 WeakPolarHBondContact CB-O 3.35Å; Q2302-T2384 VanDerWaalsContact OE1-N 3.09Å; Q2302-T2384 PolarHBondContact OE1-O 3Å; Q2302-T2384 VanDerWaalsContact OE1-O 3.08Å; A2303-T2384 HydrophobicContact CB-CG2 4.44Å; W2322-T2384 WeakPolarHBondContact O-CB 3.4Å; W2322-T2384 PolarHBondContact O-N 2.99Å; W2322-T2384 VanDerWaalsContact O-N 3.12Å; W2322-T2384 PolarHBondContact O-OG1 3.14Å; G2325-T2384 PolarHBondContact O-OG1 3.32Å; A2326-T2384 PolarHBondContact O-OG1 3.01Å; V2327-T2384 HydrophobicContact CG2-CG2 3.94Å; H2369-T2384 PolarHBondContact CD2-OG1 3.07Å; H2369-T2384 VanDerWaalsContact CD2-OG1 3.31Å; T2384-C2386 PolarHBondContact O-N 2.92Å
2385	L	91.1	Very high	82.1	Confident	51.2 Å²	51.2	39.7 Å²	39.7	27%	0.268	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	-31.2	-170.9	-61.5	178.7	0	0	0	114.4	G2383 G2397 Q2428 I2429	G2383-L2385 PolarHBondContact O-N 2.96Å; L2385-G2397 PolarHBondContact N-O 2.9Å; L2385-G2397 VanDerWaalsContact N-O 3.12Å; L2385-Q2428 HydrophobicContact CD1-CB 3.93Å; L2385-Q2428 HydrophobicContact CD1-CG 4.44Å; L2385-I2429 WeakPolarHBondContact CB-O 3.28Å; L2385-I2429 WeakPolarHBondContact CD1-O 3.49Å
2386	C	92.2	Very high	83.2	Confident	13.4 Å²	13.4	32.8 Å²	32.8	9%	0.091	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	152.5	-178.9	61.4	0	0	0	0	111.9	T2384 S2396 G2397 V2432	T2384-C2386 PolarHBondContact O-N 2.92Å; C2386-S2396 WeakPolarHBondContact O-CA 3.34Å; C2386-G2397 PolarHBondContact N-O 3.14Å; C2386-G2397 VanDerWaalsContact N-O 3.15Å; C2386-G2397 PolarHBondContact O-N 3.07Å; C2386-V2432 HydrophobicContact CB-CG1 4.1Å; C2386-V2432 VanDerWaalsContact SG-CG2 3.56Å
2387	A	93.7	Very high	84.6	Confident	17.2 Å²	17.2	27.7 Å²	27.7	14%	0.142	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	153	176.4	0	0	0	0	0	111.2	A2303 S2305 I2319 V2395 V2432	A2303-A2387 HydrophobicContact CB-CB 3.83Å; S2305-A2387 VanDerWaalsContact CB-O 3.29Å; S2305-A2387 WeakPolarHBondContact CB-O 3.17Å; I2319-A2387 HydrophobicContact CB-CB 4.49Å; I2319-A2387 HydrophobicContact CD1-CB 4.01Å; I2319-A2387 HydrophobicContact CG1-CB 4.03Å; I2319-A2387 HydrophobicContact CG2-CB 3.76Å; A2387-V2395 CarbonylContact C-O 3.54Å; A2387-V2395 WeakPolarHBondContact CA-O 3.3Å; A2387-V2432 VanDerWaalsContact C-CG1 3.42Å
2388	A	92.7	Very high	85.9	Confident	9.2 Å²	9.2	27 Å²	27	8%	0.076	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	150.9	174	0	0	0	0	0	109.9	A2394 V2395 V2432 V2434	A2388-A2394 CarbonylContact O-C 3.56Å; A2388-A2394 WeakPolarHBondContact O-CA 3.3Å; A2388-V2395 PolarHBondContact N-O 3.06Å; A2388-V2395 PolarHBondContact O-N 3.05Å; A2388-V2432 HydrophobicContact CB-CB 4.46Å; A2388-V2432 HydrophobicContact CB-CG1 3.86Å; A2388-V2432 HydrophobicContact CB-CG2 4.38Å; A2388-V2434 HydrophobicContact CB-CB 4.46Å; A2388-V2434 HydrophobicContact CB-CG2 3.9Å
2389	A	89.7	Confident	86.8	Confident	13.4 Å²	13.4	22.4 Å²	22.4	11%	0.111	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	148.4	176	0	0	0	0	0	110.9	S2305 G2307 I2319 I2393 A2394	S2305-A2389 PolarHBondContact OG-N 2.97Å; G2307-A2389 WeakPolarHBondContact CA-O 3.34Å; I2319-A2389 HydrophobicContact CG2-CB 4.04Å; A2389-I2393 WeakPolarHBondContact CA-O 3.33Å; A2389-A2394 HydrophobicContact CB-CB 4.48Å
2390	S	84.9	Confident	87.7	Confident	13.8 Å²	13.8	22.4 Å²	22.4	10%	0.097	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	168.3	170.9	-177.2	0	0	0	0	108.1	F2392 I2393	S2390-F2392 VanDerWaalsContact C-N 3.34Å; S2390-F2392 PolarHBondContact O-N 2.94Å; S2390-I2393 PolarHBondContact N-O 2.99Å; S2390-I2393 CarbonylContact O-C 3.52Å; S2390-I2393 PolarHBondContact O-N 2.84Å; S2390-I2393 VanDerWaalsContact O-N 3.14Å; S2390-I2393 WeakPolarHBondContact OG-CG2 3.36Å
2391	D	78.8	Confident	88.7	Confident	67 Å²	67	20.1 Å²	20.1	36%	0.358	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-9.7	-66.4	178.9	-46.6	3.6	0	0	0	116.5	I2308 P2310	I2308-D2391 WeakPolarHBondContact CB-OD1 3.41Å; I2308-D2391 WeakPolarHBondContact CD1-OD1 3.33Å; I2308-D2391 CarbonylContact O-C 3.59Å; I2308-D2391 VanDerWaalsContact O-CA 3.3Å; I2308-D2391 WeakPolarHBondContact O-CA 3.44Å; I2308-D2391 VanDerWaalsContact O-O 3.07Å; P2310-D2391 WeakPolarHBondContact CB-O 3.26Å; P2310-D2391 VanDerWaalsContact CD-O 3.28Å; P2310-D2391 WeakPolarHBondContact CD-O 3.34Å
2392	F	81.9	Confident	89.6	Confident	87.2 Å²	87.2	17.6 Å²	17.6	38%	0.382	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.2	8.2	-175.6	-58.2	-83.7	0	0	0	113.6	P2310 S2390 F2407 V2408	P2310-F2392 HydrophobicContact CB-CD1 3.34Å; P2310-F2392 VanDerWaalsContact CB-CD1 3.43Å; P2310-F2392 HydrophobicContact CB-CE1 3.37Å; P2310-F2392 VanDerWaalsContact CB-CE1 3.5Å; P2310-F2392 HydrophobicContact CB-CG 4.3Å; P2310-F2392 HydrophobicContact CB-CZ 4.27Å; P2310-F2392 HydrophobicContact CG-CD1 4.4Å; S2390-F2392 VanDerWaalsContact C-N 3.34Å; S2390-F2392 PolarHBondContact O-N 2.94Å; F2392-F2407 WeakPolarHBondContact O-CA 3.44Å; F2392-V2408 PolarHBondContact O-N 3.06Å
2393	I	88.5	Confident	90.4	Very high	0.2 Å²	0.2	16 Å²	16	0%	0.001	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	135.3	-165.7	-162.2	169.6	0	0	0	112	A2389 S2390 V2395 V2405 Y2406 F2407 V2434 I2439 Y2453	A2389-I2393 WeakPolarHBondContact CA-O 3.33Å; S2390-I2393 PolarHBondContact N-O 2.99Å; S2390-I2393 CarbonylContact O-C 3.52Å; S2390-I2393 PolarHBondContact O-N 2.84Å; S2390-I2393 VanDerWaalsContact O-N 3.14Å; S2390-I2393 WeakPolarHBondContact OG-CG2 3.36Å; I2393-V2395 HydrophobicContact CG1-CG2 4.33Å; I2393-V2405 HydrophobicContact CD1-CG1 3.49Å; I2393-V2405 HydrophobicContact CG1-CG1 3.74Å; I2393-Y2406 CarbonylContact C-O 3.59Å; I2393-Y2406 WeakPolarHBondContact CA-O 3.41Å; I2393-F2407 HydrophobicContact CD1-CD1 4.24Å; I2393-F2407 HydrophobicContact CD1-CE1 3.92Å; I2393-F2407 HydrophobicContact CD1-CE2 4.46Å; I2393-F2407 HydrophobicContact CD1-CZ 4Å; I2393-F2407 HydrophobicContact CG1-CD1 4.44Å; I2393-F2407 HydrophobicContact CG1-CE1 4.45Å; I2393-V2434 HydrophobicContact CG2-CG1 3.77Å; I2393-I2439 HydrophobicContact CD1-CD1 3.96Å; I2393-I2439 HydrophobicContact CD1-CG1 4.45Å; I2393-Y2453 HydrophobicContact CD1-CD1 4.04Å; I2393-Y2453 HydrophobicContact CD1-CD2 3.82Å; I2393-Y2453 HydrophobicContact CD1-CE1 4.18Å; I2393-Y2453 HydrophobicContact CD1-CE2 3.98Å; I2393-Y2453 HydrophobicContact CD1-CG 3.83Å; I2393-Y2453 HydrophobicContact CG2-CE1 4.36Å; I2393-Y2453 HydrophobicContact CG2-CE2 4.21Å; I2393-Y2453 WeakPolarHBondContact CG2-OH 3.49Å
2394	A	91.1	Very high	90.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	147.4	168.9	0	0	0	0	0	109.3	I2319 L2329 A2388 A2389 Y2406	I2319-A2394 HydrophobicContact CB-CB 4.26Å; I2319-A2394 HydrophobicContact CD1-CB 3.86Å; L2329-A2394 HydrophobicContact CD1-CB 4.45Å; L2329-A2394 HydrophobicContact CD2-CB 3.51Å; L2329-A2394 VanDerWaalsContact CD2-CB 3.47Å; A2388-A2394 CarbonylContact O-C 3.56Å; A2388-A2394 WeakPolarHBondContact O-CA 3.3Å; A2389-A2394 HydrophobicContact CB-CB 4.48Å; A2394-Y2406 HydrophobicContact CB-CD2 4.34Å; A2394-Y2406 PolarHBondContact N-O 3.27Å; A2394-Y2406 WeakPolarHBondContact O-CD2 3.34Å; A2394-Y2406 PolarHBondContact O-N 2.91Å
2395	V	93.8	Very high	90.7	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	134.6	-178.6	-173.7	0	0	0	0	109.1	A2387 A2388 I2393 V2403 W2404 V2405 V2432 V2434 I2439	A2387-V2395 CarbonylContact C-O 3.54Å; A2387-V2395 WeakPolarHBondContact CA-O 3.3Å; A2388-V2395 PolarHBondContact N-O 3.06Å; A2388-V2395 PolarHBondContact O-N 3.05Å; I2393-V2395 HydrophobicContact CG1-CG2 4.33Å; V2395-V2403 HydrophobicContact CG1-CG1 3.65Å; V2395-W2404 CarbonylContact C-O 3.55Å; V2395-W2404 VanDerWaalsContact CA-O 3.26Å; V2395-W2404 WeakPolarHBondContact CA-O 3.16Å; V2395-W2404 WeakPolarHBondContact CG1-O 3.14Å; V2395-V2405 HydrophobicContact CG1-CG2 4.11Å; V2395-V2405 HydrophobicContact CG2-CB 4.44Å; V2395-V2405 HydrophobicContact CG2-CG1 4.22Å; V2395-V2405 HydrophobicContact CG2-CG2 4.14Å; V2395-V2432 HydrophobicContact CB-CG1 3.75Å; V2395-V2432 HydrophobicContact CB-CG2 3.93Å; V2395-V2432 HydrophobicContact CG1-CG1 3.51Å; V2395-V2432 VanDerWaalsContact CG1-CG1 3.5Å; V2395-V2432 HydrophobicContact CG1-CG2 4.03Å; V2395-V2434 HydrophobicContact CB-CG2 4.13Å; V2395-V2434 HydrophobicContact CG2-CG2 3.6Å; V2395-I2439 HydrophobicContact CG1-CG2 4.16Å; V2395-I2439 HydrophobicContact CG2-CD1 4.01Å; V2395-I2439 HydrophobicContact CG2-CG1 4.28Å; V2395-I2439 HydrophobicContact CG2-CG2 4.19Å
2396	S	94.7	Very high	90.7	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	147.3	172.1	62.8	0	0	0	0	111.4	H2369 C2386 V2403 W2404 Y2406	H2369-S2396 WeakPolarHBondContact NE2-CB 3.37Å; H2369-S2396 PolarHBondContact NE2-OG 3.02Å; C2386-S2396 WeakPolarHBondContact O-CA 3.34Å; S2396-V2403 WeakPolarHBondContact O-CA 3.35Å; S2396-W2404 PolarHBondContact N-O 3.2Å; S2396-W2404 PolarHBondContact O-N 3.32Å; S2396-Y2406 WeakPolarHBondContact OG-CE2 3.26Å; S2396-Y2406 PolarHBondContact OG-OH 3.28Å
2397	G	93.8	Very high	90.6	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	135.7	173.1	0	0	0	0	0	110.1	L2385 C2386	L2385-G2397 PolarHBondContact N-O 2.9Å; L2385-G2397 VanDerWaalsContact N-O 3.12Å; C2386-G2397 PolarHBondContact N-O 3.14Å; C2386-G2397 VanDerWaalsContact N-O 3.15Å; C2386-G2397 PolarHBondContact O-N 3.07Å
2398	G	92.4	Very high	90.1	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	174.2	-173.1	0	0	0	0	0	115.4	H2369 G2383 N2400 C2401 E2402 I2429	H2369-G2398 PolarHBondContact CE1-N 2.81Å; H2369-G2398 VanDerWaalsContact CE1-N 3.28Å; H2369-G2398 WeakPolarHBondContact ND1-CA 3.27Å; H2369-G2398 PolarHBondContact ND1-N 3.4Å; G2383-G2398 CarbonylContact O-C 3.56Å; G2383-G2398 WeakPolarHBondContact O-CA 3.33Å; G2398-N2400 VanDerWaalsContact C-N 3.27Å; G2398-N2400 PolarHBondContact O-N 3.08Å; G2398-C2401 PolarHBondContact O-N 3.06Å; G2398-E2402 PolarHBondContact N-O 3.08Å; G2398-I2429 PolarHBondContact O-N 2.95Å; G2398-I2429 VanDerWaalsContact O-N 3.12Å
2399	G	90.3	Very high	89.3	Confident	2.6 Å²	2.6	15.3 Å²	15.3	3%	0.027	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-25.8	171.8	0	0	0	0	0	113.3	E2380 A2381 G2383 C2401 Q2428	E2380-G2399 CarbonylContact O-C 3.51Å; E2380-G2399 VanDerWaalsContact O-CA 3.24Å; E2380-G2399 WeakPolarHBondContact O-CA 3.41Å; A2381-G2399 VanDerWaalsContact CB-O 3.31Å; A2381-G2399 WeakPolarHBondContact CB-O 3.3Å; A2381-G2399 WeakPolarHBondContact O-CA 3.37Å; G2383-G2399 PolarHBondContact O-N 3.08Å; G2399-C2401 PolarHBondContact O-N 3.04Å; G2399-C2401 VanDerWaalsContact O-N 3.09Å; G2399-Q2428 WeakPolarHBondContact O-CG 3.42Å
2400	N	89.8	Confident	88.3	Confident	20 Å²	20	18.8 Å²	18.8	11%	0.107	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	10.2	176.9	67.2	-16.2	0	0	0	115.1	S2368 H2369 E2380 G2398 E2402	S2368-N2400 PolarHBondContact O-ND2 3.31Å; S2368-N2400 VanDerWaalsContact O-ND2 3.14Å; H2369-N2400 PolarHBondContact ND1-OD1 2.95Å; E2380-N2400 HydrophobicContact CB-CB 3.96Å; E2380-N2400 HydrophobicContact CG-CB 4.24Å; E2380-N2400 PolarHBondContact O-N 3.33Å; E2380-N2400 WeakPolarHBondContact OE2-CB 3.38Å; E2380-N2400 PolarHBondContact OE2-ND2 3.05Å; G2398-N2400 VanDerWaalsContact C-N 3.27Å; G2398-N2400 PolarHBondContact O-N 3.08Å; N2400-E2402 HydrophobicContact CB-CG 4.36Å; N2400-E2402 VanDerWaalsContact ND2-CD 3.27Å; N2400-E2402 WeakPolarHBondContact ND2-CG 3.44Å; N2400-E2402 PolarHBondContact ND2-OE2 3.05Å; N2400-E2402 PolarHBondContact O-N 2.86Å; N2400-E2402 WeakPolarHBondContact OD1-CB 3.2Å; N2400-E2402 PolarHBondContact OD1-N 3.15Å
2401	C	91.6	Very high	87.5	Confident	34.25 Å²	34.25	22.2 Å²	22.2	23%	0.231	13%	0.13	C	C	.	.	S	Bend	trans	65.3	14.7	-178.8	-45.4	0	0	0	0	114.4	G2398 G2399 S2427 I2429	G2398-C2401 PolarHBondContact O-N 3.06Å; G2399-C2401 PolarHBondContact O-N 3.04Å; G2399-C2401 VanDerWaalsContact O-N 3.09Å; C2401-S2427 WeakPolarHBondContact SG-CA 3.39Å; C2401-I2429 VanDerWaalsContact C-CD1 3.42Å; C2401-I2429 WeakPolarHBondContact O-CD1 3.43Å
2402	E	92.9	Very high	87	Confident	6.5 Å²	6.5	21.6 Å²	21.6	3%	0.03	13%	0.127	C	C	.	.			trans	-102	142.5	179	-54.3	-170.4	146.2	0	0	113.3	H2369 H2373 G2398 N2400 W2404 C2421 F2422 R2423 I2429	H2369-E2402 PolarHBondContact CE1-O 3.13Å; H2369-E2402 VanDerWaalsContact CE1-O 3.27Å; H2373-E2402 IonicContact CE1-OE1 2.96Å; H2373-E2402 IonicContact CE1-OE2 3.26Å; H2373-E2402 PolarHBondContact CE1-OE2 3.07Å; H2373-E2402 IonicContact ND1-OE2 3.35Å; H2373-E2402 IonicContact NE2-OE1 2.89Å; H2373-E2402 IonicContact NE2-OE2 3.58Å; G2398-E2402 PolarHBondContact N-O 3.08Å; N2400-E2402 HydrophobicContact CB-CG 4.36Å; N2400-E2402 VanDerWaalsContact ND2-CD 3.27Å; N2400-E2402 WeakPolarHBondContact ND2-CG 3.44Å; N2400-E2402 PolarHBondContact ND2-OE2 3.05Å; N2400-E2402 PolarHBondContact O-N 2.86Å; N2400-E2402 WeakPolarHBondContact OD1-CB 3.2Å; N2400-E2402 PolarHBondContact OD1-N 3.15Å; E2402-W2404 PolarHBondContact OE2-NE1 3.15Å; E2402-C2421 PolarHBondContact OE1-SG 3Å; E2402-F2422 WeakPolarHBondContact CA-O 3.43Å; E2402-R2423 HydrophobicContact CG-CG 4.11Å; E2402-R2423 IonicContact OE1-CZ 3.64Å; E2402-R2423 IonicContact OE1-NE 2.85Å; E2402-R2423 PolarHBondContact OE1-NE 2.95Å; E2402-R2423 IonicContact OE1-NH2 3.18Å; E2402-R2423 PolarHBondContact OE1-NH2 3.23Å; E2402-I2429 WeakPolarHBondContact O-CD1 3.27Å
2403	V	93.6	Very high	86	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.3	167.4	-174.8	0	0	0	0	108.2	V2395 S2396 V2405 C2421 F2422 I2429 T2441	V2395-V2403 HydrophobicContact CG1-CG1 3.65Å; S2396-V2403 WeakPolarHBondContact O-CA 3.35Å; V2403-V2405 HydrophobicContact CG1-CG2 4.35Å; V2403-C2421 CarbonylContact O-C 3.56Å; V2403-C2421 WeakPolarHBondContact O-CA 3.34Å; V2403-F2422 HydrophobicContact CB-CB 4.31Å; V2403-F2422 PolarHBondContact N-O 3.26Å; V2403-F2422 PolarHBondContact O-N 3.09Å; V2403-I2429 HydrophobicContact CB-CD1 4.44Å; V2403-I2429 HydrophobicContact CG2-CD1 3.47Å; V2403-I2429 VanDerWaalsContact CG2-CD1 3.43Å; V2403-I2429 HydrophobicContact CG2-CG1 4.32Å; V2403-T2441 HydrophobicContact CB-CG2 4.41Å; V2403-T2441 HydrophobicContact CG1-CG2 3.78Å; V2403-T2441 HydrophobicContact CG2-CG2 3.69Å
2404	W	94	Very high	84.8	Confident	34.75 Å²	34.75	32 Å²	32	13%	0.132	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131	172.9	-76.1	76.6	0	0	0	110.8	S2368 H2369 H2373 V2395 S2396 E2402 Y2406 F2420 C2421	S2368-W2404 VanDerWaalsContact CB-CG 3.5Å; S2368-W2404 PolarHBondContact O-NE1 3.14Å; S2368-W2404 VanDerWaalsContact O-NE1 3.14Å; S2368-W2404 VanDerWaalsContact OG-CD2 3.24Å; H2369-W2404 AromaticContact CE1-CD1 3.54Å; H2369-W2404 VanDerWaalsContact CE1-CD1 3.48Å; H2369-W2404 AromaticContact ND1-CD1 3.95Å; H2373-W2404 AromaticContact CE1-CZ2 3.86Å; H2373-W2404 AromaticContact ND1-CZ2 3.99Å; H2373-W2404 AromaticContact NE2-CZ2 3.92Å; V2395-W2404 CarbonylContact C-O 3.55Å; V2395-W2404 VanDerWaalsContact CA-O 3.26Å; V2395-W2404 WeakPolarHBondContact CA-O 3.16Å; V2395-W2404 WeakPolarHBondContact CG1-O 3.14Å; S2396-W2404 PolarHBondContact N-O 3.2Å; S2396-W2404 PolarHBondContact O-N 3.32Å; E2402-W2404 PolarHBondContact OE2-NE1 3.15Å; W2404-Y2406 HydrophobicContact CB-CE1 4.37Å; W2404-Y2406 HydrophobicContact CB-CE2 3.99Å; W2404-Y2406 VanDerWaalsContact CB-OH 3.3Å; W2404-Y2406 WeakPolarHBondContact CB-OH 3.35Å; W2404-Y2406 HydrophobicContact CE3-CE1 4.4Å; W2404-F2420 CarbonylContact C-O 3.54Å; W2404-F2420 VanDerWaalsContact CA-O 3.31Å; W2404-F2420 WeakPolarHBondContact CA-O 3.25Å; W2404-C2421 HydrophobicContact CD2-CB 3.95Å; W2404-C2421 HydrophobicContact CE3-CB 4.21Å; W2404-C2421 HydrophobicContact CG-CB 4.47Å; W2404-C2421 HydrophobicContact CH2-CB 4.09Å; W2404-C2421 HydrophobicContact CZ2-CB 3.81Å; W2404-C2421 HydrophobicContact CZ3-CB 4.27Å
2405	V	93	Very high	83.6	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.4	-179.5	-179.3	0	0	0	0	108.9	I2393 V2395 V2403 F2407 S2419 F2420 F2422 I2439 V2460	I2393-V2405 HydrophobicContact CD1-CG1 3.49Å; I2393-V2405 HydrophobicContact CG1-CG1 3.74Å; V2395-V2405 HydrophobicContact CG1-CG2 4.11Å; V2395-V2405 HydrophobicContact CG2-CB 4.44Å; V2395-V2405 HydrophobicContact CG2-CG1 4.22Å; V2395-V2405 HydrophobicContact CG2-CG2 4.14Å; V2403-V2405 HydrophobicContact CG1-CG2 4.35Å; V2405-F2407 HydrophobicContact CG1-CD2 4.41Å; V2405-F2407 HydrophobicContact CG1-CE2 4.1Å; V2405-F2407 HydrophobicContact CG1-CZ 4.37Å; V2405-S2419 CarbonylContact O-C 3.54Å; V2405-S2419 VanDerWaalsContact O-CA 3.26Å; V2405-S2419 WeakPolarHBondContact O-CA 3.4Å; V2405-F2420 PolarHBondContact N-O 3.1Å; V2405-F2420 PolarHBondContact O-N 3.17Å; V2405-F2422 HydrophobicContact CB-CE2 4.38Å; V2405-F2422 HydrophobicContact CG2-CD2 4.09Å; V2405-F2422 HydrophobicContact CG2-CE2 3.88Å; V2405-I2439 HydrophobicContact CG1-CD1 4.02Å; V2405-I2439 HydrophobicContact CG2-CD1 3.91Å; V2405-V2460 HydrophobicContact CB-CG2 4.49Å; V2405-V2460 HydrophobicContact CG1-CG2 3.99Å
2406	Y	91.8	Very high	82.4	Confident	1 Å²	1	39.9 Å²	39.9	0%	0.004	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	116	-177.8	-46.5	-87	0	0	0	109.8	I2319 V2327 L2329 Y2364 S2368 I2393 A2394 S2396 W2404 V2417 K2418	I2319-Y2406 HydrophobicContact CD1-CD2 4.42Å; I2319-Y2406 HydrophobicContact CD1-CE2 4.29Å; V2327-Y2406 HydrophobicContact CG1-CE2 3.91Å; L2329-Y2406 HydrophobicContact CD1-CG 4.35Å; Y2364-Y2406 HydrophobicContact CD1-CD1 4.27Å; Y2364-Y2406 AromaticContact CE1-CD1 3.9Å; Y2364-Y2406 HydrophobicContact CE1-CD1 3.94Å; Y2364-Y2406 HydrophobicContact CE1-CE1 4.06Å; S2368-Y2406 VanDerWaalsContact CB-OH 3.25Å; S2368-Y2406 WeakPolarHBondContact CB-OH 3.43Å; S2368-Y2406 PolarHBondContact OG-OH 3.08Å; I2393-Y2406 CarbonylContact C-O 3.59Å; I2393-Y2406 WeakPolarHBondContact CA-O 3.41Å; A2394-Y2406 HydrophobicContact CB-CD2 4.34Å; A2394-Y2406 PolarHBondContact N-O 3.27Å; A2394-Y2406 WeakPolarHBondContact O-CD2 3.34Å; A2394-Y2406 PolarHBondContact O-N 2.91Å; S2396-Y2406 WeakPolarHBondContact OG-CE2 3.26Å; S2396-Y2406 PolarHBondContact OG-OH 3.28Å; W2404-Y2406 HydrophobicContact CB-CE1 4.37Å; W2404-Y2406 HydrophobicContact CB-CE2 3.99Å; W2404-Y2406 VanDerWaalsContact CB-OH 3.3Å; W2404-Y2406 WeakPolarHBondContact CB-OH 3.35Å; W2404-Y2406 HydrophobicContact CE3-CE1 4.4Å; Y2406-V2417 HydrophobicContact CD1-CG1 4.35Å; Y2406-K2418 CarbonylContact C-O 3.54Å; Y2406-K2418 WeakPolarHBondContact CA-O 3.38Å
2407	F	88.8	Confident	81.6	Confident	8.25 Å²	8.25	41.1 Å²	41.1	4%	0.036	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	128.5	169.3	-70.3	-91.6	0	0	0	109.6	F2392 I2393 V2405 V2417 K2418 F2420 Y2453 T2458 V2460	F2392-F2407 WeakPolarHBondContact O-CA 3.44Å; I2393-F2407 HydrophobicContact CD1-CD1 4.24Å; I2393-F2407 HydrophobicContact CD1-CE1 3.92Å; I2393-F2407 HydrophobicContact CD1-CE2 4.46Å; I2393-F2407 HydrophobicContact CD1-CZ 4Å; I2393-F2407 HydrophobicContact CG1-CD1 4.44Å; I2393-F2407 HydrophobicContact CG1-CE1 4.45Å; V2405-F2407 HydrophobicContact CG1-CD2 4.41Å; V2405-F2407 HydrophobicContact CG1-CE2 4.1Å; V2405-F2407 HydrophobicContact CG1-CZ 4.37Å; F2407-V2417 VanDerWaalsContact O-CA 3.25Å; F2407-V2417 WeakPolarHBondContact O-CA 3.32Å; F2407-K2418 HydrophobicContact CB-CB 4.43Å; F2407-K2418 PolarHBondContact N-O 3.16Å; F2407-K2418 PolarHBondContact O-N 3.15Å; F2407-K2418 VanDerWaalsContact O-N 3.12Å; F2407-F2420 AromaticContact CD2-CD2 3.86Å; F2407-F2420 HydrophobicContact CD2-CD2 3.86Å; F2407-F2420 AromaticContact CD2-CE2 3.66Å; F2407-F2420 HydrophobicContact CD2-CE2 3.66Å; F2407-F2420 AromaticContact CE2-CD2 3.67Å; F2407-F2420 HydrophobicContact CE2-CD2 3.67Å; F2407-F2420 AromaticContact CE2-CE2 3.56Å; F2407-F2420 HydrophobicContact CE2-CE2 3.56Å; F2407-Y2453 AromaticContact CE1-CD2 3.92Å; F2407-Y2453 HydrophobicContact CE1-CD2 4.02Å; F2407-Y2453 HydrophobicContact CZ-CD2 4.36Å; F2407-T2458 HydrophobicContact CB-CG2 4.42Å; F2407-T2458 HydrophobicContact CD1-CG2 4.2Å; F2407-T2458 HydrophobicContact CG-CG2 4.29Å; F2407-V2460 HydrophobicContact CE2-CG2 3.59Å; F2407-V2460 HydrophobicContact CZ-CG2 3.57Å; F2407-V2460 VanDerWaalsContact CZ-CG2 3.49Å
2408	V	83.8	Confident	81.1	Confident	5.5 Å²	5.5	46.4 Å²	46.4	3%	0.033	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	115.7	179.2	-176.9	0	0	0	0	109.1	P2310 Y2311 L2317 L2329 L2363 F2392 V2417	P2310-V2408 HydrophobicContact CG-CB 4.37Å; P2310-V2408 HydrophobicContact CG-CG1 3.91Å; Y2311-V2408 HydrophobicContact CE2-CG1 4.23Å; Y2311-V2408 VanDerWaalsContact OH-CG1 3.26Å; Y2311-V2408 WeakPolarHBondContact OH-CG1 3.35Å; L2317-V2408 HydrophobicContact CD1-CG2 4.26Å; L2317-V2408 HydrophobicContact CD2-CG2 4.1Å; L2329-V2408 HydrophobicContact CD1-CG2 3.88Å; L2363-V2408 HydrophobicContact CD1-CG1 4.11Å; F2392-V2408 PolarHBondContact O-N 3.06Å; V2408-V2417 HydrophobicContact CG2-CG2 4.44Å
2409	G	75.2	Confident	80.9	Confident	26.25 Å²	26.25	48.6 Å²	48.6	27%	0.271	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-66	153.6	177.5	0	0	0	0	0	113.3	Y2311 V2411 L2416	Y2311-G2409 VanDerWaalsContact CE1-O 3.27Å; Y2311-G2409 WeakPolarHBondContact CE1-O 3.44Å; Y2311-G2409 VanDerWaalsContact CZ-O 3.28Å; Y2311-G2409 PolarHBondContact OH-O 2.99Å; G2409-V2411 VanDerWaalsContact C-N 3.31Å; G2409-V2411 PolarHBondContact O-N 3.24Å; G2409-V2411 VanDerWaalsContact O-N 3.12Å; G2409-L2416 PolarHBondContact N-O 3.04Å; G2409-L2416 VanDerWaalsContact N-O 3.15Å
2410	S	70	Confident	80.8	Confident	85.75 Å²	85.75	51.9 Å²	51.9	60%	0.6	28%	0.283	S	S	*	.	S	Bend	trans	-76.3	-1.7	-173.2	55.5	0	0	0	0	116.1	Y2311	Y2311-S2410 VanDerWaalsContact CD1-O 3.31Å; Y2311-S2410 WeakPolarHBondContact CD1-O 3.4Å; Y2311-S2410 VanDerWaalsContact CE1-C 3.46Å
2411	V	68.5	Low	80.9	Confident	86 Å²	86	53.2 Å²	53.2	52%	0.521	29%	0.293	S	S	.	.			trans	-104.9	113.2	179.5	-177.5	0	0	0	0	110.6	Y2311 G2409 E2413 N2414 P2415	Y2311-V2411 VanDerWaalsContact CE1-C 3.5Å; G2409-V2411 VanDerWaalsContact C-N 3.31Å; G2409-V2411 PolarHBondContact O-N 3.24Å; G2409-V2411 VanDerWaalsContact O-N 3.12Å; V2411-E2413 VanDerWaalsContact C-N 3.28Å; V2411-E2413 HydrophobicContact CG1-CB 4.41Å; V2411-E2413 PolarHBondContact O-N 3Å; V2411-N2414 CarbonylContact O-C 3.51Å; V2411-N2414 PolarHBondContact O-N 3.25Å; V2411-P2415 WeakPolarHBondContact O-CA 3.38Å
2412	L	66.8	Low	80.9	Confident	54.5 Å²	54.5	53.1 Å²	53.1	29%	0.285	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-31.4	-174.9	-174.1	68.6	0	0	0	113.3	Y2311 Y2312 H2331 V2361 L2363 N2414 P2415	Y2311-L2412 HydrophobicContact CD1-CB 3.77Å; Y2311-L2412 HydrophobicContact CD1-CD1 4.18Å; Y2311-L2412 HydrophobicContact CD2-CB 4.4Å; Y2311-L2412 HydrophobicContact CD2-CD1 3.67Å; Y2311-L2412 VanDerWaalsContact CE1-CA 3.42Å; Y2311-L2412 HydrophobicContact CE1-CB 3.94Å; Y2311-L2412 HydrophobicContact CE1-CD1 4.23Å; Y2311-L2412 HydrophobicContact CE2-CB 4.49Å; Y2311-L2412 HydrophobicContact CE2-CD1 3.67Å; Y2311-L2412 HydrophobicContact CG-CB 3.99Å; Y2311-L2412 HydrophobicContact CG-CD1 3.98Å; Y2311-L2412 HydrophobicContact CG-CG 4.48Å; Y2312-L2412 HydrophobicContact CE2-CD2 4.46Å; H2331-L2412 HydrophobicContact CB-CD1 4.29Å; H2331-L2412 VanDerWaalsContact ND1-CD1 3.34Å; H2331-L2412 WeakPolarHBondContact ND1-CD1 3.5Å; V2361-L2412 HydrophobicContact CB-CD1 4.36Å; V2361-L2412 HydrophobicContact CG1-CD1 4.34Å; L2363-L2412 HydrophobicContact CD2-CD1 3.67Å; L2412-N2414 VanDerWaalsContact C-N 3.25Å; L2412-N2414 PolarHBondContact O-N 3.04Å; L2412-P2415 WeakPolarHBondContact O-CD 3.46Å
2413	E	62.3	Low	80.9	Confident	188 Å²	188	61.1 Å²	61.1	88%	0.879	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-23.5	-177.3	-63.2	-174.5	164.3	0	0	113.3	V2411	V2411-E2413 VanDerWaalsContact C-N 3.28Å; V2411-E2413 HydrophobicContact CG1-CB 4.41Å; V2411-E2413 PolarHBondContact O-N 3Å
2414	N	62.4	Low	80.7	Confident	118.5 Å²	118.5	65.1 Å²	65.1	63%	0.634	34%	0.338	S	S	*	.	S	Bend	trans	-149.6	81.4	175.7	-150.9	-6	0	0	0	109.1	V2411 L2412 L2416	V2411-N2414 CarbonylContact O-C 3.51Å; V2411-N2414 PolarHBondContact O-N 3.25Å; L2412-N2414 VanDerWaalsContact C-N 3.25Å; L2412-N2414 PolarHBondContact O-N 3.04Å; N2414-L2416 VanDerWaalsContact C-N 3.27Å; N2414-L2416 PolarHBondContact O-N 3.14Å
2415	P	65.2	Low	80.6	Confident	31.25 Å²	31.25	64.1 Å²	64.1	20%	0.203	33%	0.334	C	S	.	.			trans	-70	92.7	-174.7	29.4	-34.2	0	0	0	109.6	Y2311 L2363 V2411 L2412 V2417	Y2311-P2415 WeakPolarHBondContact OH-CB 3.27Å; L2363-P2415 HydrophobicContact CB-CB 4.41Å; L2363-P2415 HydrophobicContact CB-CG 4.3Å; L2363-P2415 HydrophobicContact CD2-CB 4.19Å; L2363-P2415 HydrophobicContact CD2-CG 4.16Å; L2363-P2415 WeakPolarHBondContact O-CG 3.44Å; V2411-P2415 WeakPolarHBondContact O-CA 3.38Å; L2412-P2415 WeakPolarHBondContact O-CD 3.46Å; P2415-V2417 VanDerWaalsContact C-N 3.28Å; P2415-V2417 PolarHBondContact O-N 3.15Å
2416	L	69.2	Low	80.5	Confident	134 Å²	134	68.8 Å²	68.8	70%	0.702	37%	0.367	S	S	*	.			trans	-67.2	96.8	173.3	-76.8	168.5	0	0	0	109.1	G2409 N2414 K2418	G2409-L2416 PolarHBondContact N-O 3.04Å; G2409-L2416 VanDerWaalsContact N-O 3.15Å; N2414-L2416 VanDerWaalsContact C-N 3.27Å; N2414-L2416 PolarHBondContact O-N 3.14Å; L2416-K2418 PolarHBondContact O-N 3Å
2417	V	77.8	Confident	80.5	Confident	24.5 Å²	24.5	70.5 Å²	70.5	15%	0.148	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	115.2	175.2	179.4	0	0	0	0	110.1	L2329 Y2364 Y2406 F2407 V2408 P2415	L2329-V2417 HydrophobicContact CD1-CG1 4.35Å; L2329-V2417 HydrophobicContact CD1-CG2 4.44Å; Y2364-V2417 HydrophobicContact CD1-CB 4.31Å; Y2364-V2417 HydrophobicContact CD1-CG1 3.81Å; Y2364-V2417 HydrophobicContact CD2-CB 3.88Å; Y2364-V2417 HydrophobicContact CD2-CG1 4.26Å; Y2364-V2417 HydrophobicContact CD2-CG2 4.27Å; Y2364-V2417 HydrophobicContact CE1-CG1 4.04Å; Y2364-V2417 HydrophobicContact CE2-CB 4.28Å; Y2364-V2417 HydrophobicContact CE2-CG1 4.38Å; Y2364-V2417 HydrophobicContact CG-CB 3.91Å; Y2364-V2417 HydrophobicContact CG-CG1 3.92Å; Y2364-V2417 HydrophobicContact CG-CG2 4.04Å; Y2406-V2417 HydrophobicContact CD1-CG1 4.35Å; F2407-V2417 VanDerWaalsContact O-CA 3.25Å; F2407-V2417 WeakPolarHBondContact O-CA 3.32Å; V2408-V2417 HydrophobicContact CG2-CG2 4.44Å; P2415-V2417 VanDerWaalsContact C-N 3.28Å; P2415-V2417 PolarHBondContact O-N 3.15Å
2418	K	83.3	Confident	80.7	Confident	112.25 Å²	112.25	72.3 Å²	72.3	49%	0.488	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	128.8	169.7	-68.2	-176.9	-175	176.5	0	109.2	Y2406 F2407 L2416 F2420 T2458	Y2406-K2418 CarbonylContact C-O 3.54Å; Y2406-K2418 WeakPolarHBondContact CA-O 3.38Å; F2407-K2418 HydrophobicContact CB-CB 4.43Å; F2407-K2418 PolarHBondContact N-O 3.16Å; F2407-K2418 PolarHBondContact O-N 3.15Å; F2407-K2418 VanDerWaalsContact O-N 3.12Å; L2416-K2418 PolarHBondContact O-N 3Å; K2418-F2420 HydrophobicContact CB-CE2 4.36Å; K2418-T2458 HydrophobicContact CD-CG2 4.38Å; K2418-T2458 WeakPolarHBondContact CD-OG1 3.41Å; K2418-T2458 PolarHBondContact NZ-OG1 3.12Å
2419	S	87.8	Confident	81.2	Confident	46 Å²	46	72 Å²	72	32%	0.322	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	141.9	178.1	56.9	0	0	0	0	112.2	V2405	V2405-S2419 CarbonylContact O-C 3.54Å; V2405-S2419 VanDerWaalsContact O-CA 3.26Å; V2405-S2419 WeakPolarHBondContact O-CA 3.4Å
2420	F	89.8	Confident	82.1	Confident	71.5 Å²	71.5	72.3 Å²	72.3	31%	0.314	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	139.6	173.9	-63.6	-88.5	0	0	0	109.9	W2404 V2405 F2407 K2418 F2422 T2458	W2404-F2420 CarbonylContact C-O 3.54Å; W2404-F2420 VanDerWaalsContact CA-O 3.31Å; W2404-F2420 WeakPolarHBondContact CA-O 3.25Å; V2405-F2420 PolarHBondContact N-O 3.1Å; V2405-F2420 PolarHBondContact O-N 3.17Å; F2407-F2420 AromaticContact CD2-CD2 3.86Å; F2407-F2420 HydrophobicContact CD2-CD2 3.86Å; F2407-F2420 AromaticContact CD2-CE2 3.66Å; F2407-F2420 HydrophobicContact CD2-CE2 3.66Å; F2407-F2420 AromaticContact CE2-CD2 3.67Å; F2407-F2420 HydrophobicContact CE2-CD2 3.67Å; F2407-F2420 AromaticContact CE2-CE2 3.56Å; F2407-F2420 HydrophobicContact CE2-CE2 3.56Å; K2418-F2420 HydrophobicContact CB-CE2 4.36Å; F2420-F2422 HydrophobicContact CB-CE2 3.64Å; F2420-F2422 HydrophobicContact CB-CZ 3.85Å; F2420-T2458 VanDerWaalsContact CE2-O 3.29Å; F2420-T2458 WeakPolarHBondContact CE2-O 3.3Å; F2420-T2458 WeakPolarHBondContact CZ-O 3.32Å
2421	C	91.2	Very high	83.2	Confident	47.5 Å²	47.5	68.4 Å²	68.4	32%	0.321	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	133.8	176.9	176.7	0	0	0	0	110.4	E2402 V2403 W2404	E2402-C2421 PolarHBondContact OE1-SG 3Å; V2403-C2421 CarbonylContact O-C 3.56Å; V2403-C2421 WeakPolarHBondContact O-CA 3.34Å; W2404-C2421 HydrophobicContact CD2-CB 3.95Å; W2404-C2421 HydrophobicContact CE3-CB 4.21Å; W2404-C2421 HydrophobicContact CG-CB 4.47Å; W2404-C2421 HydrophobicContact CH2-CB 4.09Å; W2404-C2421 HydrophobicContact CZ2-CB 3.81Å; W2404-C2421 HydrophobicContact CZ3-CB 4.27Å
2422	F	92.3	Very high	84.4	Confident	33 Å²	33	65 Å²	65	15%	0.145	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	138.2	176.3	-57.8	-82.2	0	0	0	110.6	E2402 V2403 V2405 F2420 Y2451 V2460	E2402-F2422 WeakPolarHBondContact CA-O 3.43Å; V2403-F2422 HydrophobicContact CB-CB 4.31Å; V2403-F2422 PolarHBondContact N-O 3.26Å; V2403-F2422 PolarHBondContact O-N 3.09Å; V2405-F2422 HydrophobicContact CB-CE2 4.38Å; V2405-F2422 HydrophobicContact CG2-CD2 4.09Å; V2405-F2422 HydrophobicContact CG2-CE2 3.88Å; F2420-F2422 HydrophobicContact CB-CE2 3.64Å; F2420-F2422 HydrophobicContact CB-CZ 3.85Å; F2422-Y2451 HydrophobicContact CB-CE1 3.98Å; F2422-Y2451 HydrophobicContact CD1-CD1 4.34Å; F2422-Y2451 AromaticContact CD1-CE1 3.92Å; F2422-Y2451 HydrophobicContact CD1-CE1 3.97Å; F2422-Y2451 HydrophobicContact CD2-CE1 4.4Å; F2422-Y2451 HydrophobicContact CG-CD1 4.4Å; F2422-Y2451 AromaticContact CG-CE1 3.83Å; F2422-Y2451 HydrophobicContact CG-CE1 3.87Å; F2422-V2460 HydrophobicContact CE1-CG1 4.46Å; F2422-V2460 HydrophobicContact CE2-CB 4.05Å; F2422-V2460 HydrophobicContact CE2-CG1 3.88Å; F2422-V2460 HydrophobicContact CE2-CG2 4.46Å; F2422-V2460 HydrophobicContact CZ-CB 3.66Å; F2422-V2460 HydrophobicContact CZ-CG1 3.76Å; F2422-V2460 HydrophobicContact CZ-CG2 4.45Å
2423	R	91.6	Very high	85.7	Confident	172.75 Å²	172.75	62.8 Å²	62.8	65%	0.652	32%	0.324	S	S	*	.			trans	-127.1	50.2	-174.6	-65.2	-173.9	177.8	168.7	-1.8	111.7	E2402	E2402-R2423 HydrophobicContact CG-CG 4.11Å; E2402-R2423 IonicContact OE1-CZ 3.64Å; E2402-R2423 IonicContact OE1-NE 2.85Å; E2402-R2423 PolarHBondContact OE1-NE 2.95Å; E2402-R2423 IonicContact OE1-NH2 3.18Å; E2402-R2423 PolarHBondContact OE1-NH2 3.23Å
2424	E	90.1	Very high	87	Confident	86 Å²	86	54.5 Å²	54.5	40%	0.402	29%	0.287	S	S	.	.			trans	-85.8	-19.5	-177.2	-57.7	-59	147.5	0	0	113.6	A2449 Y2451 L2462 I2465	E2424-A2449 HydrophobicContact CB-CB 4.38Å; E2424-Y2451 WeakPolarHBondContact CB-OH 3.33Å; E2424-Y2451 HydrophobicContact CG-CE1 4.05Å; E2424-Y2451 VanDerWaalsContact CG-OH 3.28Å; E2424-Y2451 WeakPolarHBondContact CG-OH 3.42Å; E2424-L2462 HydrophobicContact CG-CD1 4.34Å; E2424-L2462 HydrophobicContact CG-CD2 4.14Å; E2424-I2465 HydrophobicContact CB-CD1 4.37Å
2425	H	92.1	Very high	88.1	Confident	13.5 Å²	13.5	52 Å²	52	6%	0.063	27%	0.271	C	S	.	.			trans	-94.7	145.2	-177.9	-74.6	-71.8	0	0	0	111.9	I2429 T2441 S2443 D2445 N2447	H2425-I2429 HydrophobicContact CB-CG1 4.25Å; H2425-T2441 PolarHBondContact CD2-OG1 2.81Å; H2425-T2441 PolarHBondContact NE2-O 3.2Å; H2425-T2441 PolarHBondContact NE2-OG1 3Å; H2425-S2443 VanDerWaalsContact ND1-CB 3.28Å; H2425-S2443 WeakPolarHBondContact ND1-CB 3.38Å; H2425-D2445 IonicContact CE1-OD1 3.68Å; H2425-D2445 IonicContact CG-OD2 3.49Å; H2425-D2445 IonicContact ND1-OD1 3.21Å; H2425-D2445 PolarHBondContact ND1-OD1 3.09Å; H2425-D2445 IonicContact ND1-OD2 3.31Å; H2425-D2445 PolarHBondContact ND1-OD2 2.98Å; H2425-N2447 PolarHBondContact CE1-O 2.93Å
2426	S	90.5	Very high	88.7	Confident	98.5 Å²	98.5	54.4 Å²	54.4	69%	0.689	28%	0.28	S	S	*	.	S	Bend	trans	-94.3	1.9	178.9	61.2	0	0	0	0	113.8	D2445	S2426-D2445 PolarHBondContact N-OD2 3.14Å; S2426-D2445 VanDerWaalsContact N-OD2 3.08Å; S2426-D2445 VanDerWaalsContact OG-CB 3.28Å; S2426-D2445 WeakPolarHBondContact OG-CB 3.28Å; S2426-D2445 PolarHBondContact OG-OD2 2.98Å
2427	S	92.5	Very high	89.4	Confident	37.25 Å²	37.25	51.5 Å²	51.5	26%	0.26	27%	0.266	S	S	.	.	S	Bend	trans	-152.5	170.7	179.5	-164.1	0	0	0	0	111.4	C2401 I2429 S2443 K2444	C2401-S2427 WeakPolarHBondContact SG-CA 3.39Å; S2427-I2429 PolarHBondContact O-N 3.2Å; S2427-S2443 VanDerWaalsContact C-OG 3.26Å; S2427-S2443 PolarHBondContact O-OG 2.88Å; S2427-K2444 WeakPolarHBondContact OG-CB 3.35Å
2428	Q	92.7	Very high	90	Very high	45.75 Å²	45.75	52 Å²	52	21%	0.214	27%	0.266	C	S	.	.			trans	-44.3	130.6	-179.5	-57.9	179.9	-13.8	0	0	112.7	A2381 L2385 G2399 S2443 K2444	A2381-Q2428 PolarHBondContact O-NE2 3.01Å; L2385-Q2428 HydrophobicContact CD1-CB 3.93Å; L2385-Q2428 HydrophobicContact CD1-CG 4.44Å; G2399-Q2428 WeakPolarHBondContact O-CG 3.42Å; Q2428-S2443 VanDerWaalsContact O-CA 3.31Å; Q2428-S2443 WeakPolarHBondContact O-CA 3.29Å; Q2428-S2443 WeakPolarHBondContact O-CB 3.33Å; Q2428-S2443 PolarHBondContact O-OG 2.86Å; Q2428-S2443 VanDerWaalsContact O-OG 3.05Å; Q2428-K2444 HydrophobicContact CB-CD 4.23Å; Q2428-K2444 HydrophobicContact CB-CG 4.42Å; Q2428-K2444 PolarHBondContact O-N 3.01Å; Q2428-K2444 VanDerWaalsContact O-N 3.08Å; Q2428-K2444 VanDerWaalsContact OE1-CE 3.28Å
2429	I	94.7	Very high	90.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	122	177.1	-63.6	145.9	0	0	0	108.2	L2385 G2398 C2401 E2402 V2403 H2425 S2427 V2432	L2385-I2429 WeakPolarHBondContact CB-O 3.28Å; L2385-I2429 WeakPolarHBondContact CD1-O 3.49Å; G2398-I2429 PolarHBondContact O-N 2.95Å; G2398-I2429 VanDerWaalsContact O-N 3.12Å; C2401-I2429 VanDerWaalsContact C-CD1 3.42Å; C2401-I2429 WeakPolarHBondContact O-CD1 3.43Å; E2402-I2429 WeakPolarHBondContact O-CD1 3.27Å; V2403-I2429 HydrophobicContact CB-CD1 4.44Å; V2403-I2429 HydrophobicContact CG2-CD1 3.47Å; V2403-I2429 VanDerWaalsContact CG2-CD1 3.43Å; V2403-I2429 HydrophobicContact CG2-CG1 4.32Å; H2425-I2429 HydrophobicContact CB-CG1 4.25Å; S2427-I2429 PolarHBondContact O-N 3.2Å; I2429-V2432 HydrophobicContact CG2-CG2 4.06Å
2430	T	93	Very high	90.7	Very high	30.75 Å²	30.75	44.5 Å²	44.5	19%	0.189	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	-18.4	-169.8	38.8	0	0	0	0	112.9	G2442 K2444 I2474	T2430-G2442 PolarHBondContact N-O 3.05Å; T2430-G2442 PolarHBondContact OG1-O 3.22Å; T2430-K2444 HydrophobicContact CG2-CD 4.35Å; T2430-K2444 HydrophobicContact CG2-CG 3.76Å; T2430-I2474 VanDerWaalsContact CB-O 3.31Å; T2430-I2474 WeakPolarHBondContact CB-O 3.27Å; T2430-I2474 PolarHBondContact OG1-O 2.85Å
2431	A	93.2	Very high	91	Very high	5 Å²	5	41.1 Å²	41.1	4%	0.041	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	142.2	178.3	0	0	0	0	0	111.6	T2441 G2442 I2474 L2477	A2431-T2441 CarbonylContact O-C 3.56Å; A2431-T2441 WeakPolarHBondContact O-CA 3.34Å; A2431-G2442 PolarHBondContact N-O 3.06Å; A2431-G2442 VanDerWaalsContact N-O 3.13Å; A2431-G2442 PolarHBondContact O-N 3.02Å; A2431-I2474 HydrophobicContact CB-CG2 4.31Å; A2431-L2477 HydrophobicContact CB-CB 4.12Å; A2431-L2477 HydrophobicContact CB-CD1 4.22Å; A2431-L2477 HydrophobicContact CB-CG 3.79Å
2432	V	94.7	Very high	91.2	Very high	15.25 Å²	15.25	38.8 Å²	38.8	9%	0.092	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140.1	173.5	117.1	0	0	0	0	108.9	C2386 A2387 A2388 V2395 I2429 V2434 I2439 A2440 T2441	C2386-V2432 HydrophobicContact CB-CG1 4.1Å; C2386-V2432 VanDerWaalsContact SG-CG2 3.56Å; A2387-V2432 VanDerWaalsContact C-CG1 3.42Å; A2388-V2432 HydrophobicContact CB-CB 4.46Å; A2388-V2432 HydrophobicContact CB-CG1 3.86Å; A2388-V2432 HydrophobicContact CB-CG2 4.38Å; V2395-V2432 HydrophobicContact CB-CG1 3.75Å; V2395-V2432 HydrophobicContact CB-CG2 3.93Å; V2395-V2432 HydrophobicContact CG1-CG1 3.51Å; V2395-V2432 VanDerWaalsContact CG1-CG1 3.5Å; V2395-V2432 HydrophobicContact CG1-CG2 4.03Å; I2429-V2432 HydrophobicContact CG2-CG2 4.06Å; V2432-V2434 HydrophobicContact CG1-CG2 4.44Å; V2432-I2439 HydrophobicContact CG2-CG2 4.26Å; V2432-A2440 CarbonylContact C-O 3.58Å; V2432-A2440 WeakPolarHBondContact CA-O 3.44Å; V2432-T2441 HydrophobicContact CB-CG2 4.31Å; V2432-T2441 HydrophobicContact CG2-CG2 4Å
2433	A	93.1	Very high	91.3	Very high	6.5 Å²	6.5	37.3 Å²	37.3	5%	0.054	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	135.3	174.5	0	0	0	0	0	110.7	I2439 A2440 L2477 W2479	A2433-I2439 CarbonylContact O-C 3.51Å; A2433-I2439 WeakPolarHBondContact O-CA 3.36Å; A2433-A2440 PolarHBondContact N-O 2.96Å; A2433-A2440 PolarHBondContact O-N 3.32Å; A2433-L2477 HydrophobicContact CB-CB 3.85Å; A2433-W2479 HydrophobicContact CB-CG 4.47Å; A2433-W2479 PolarHBondContact O-NE1 2.92Å; A2433-W2479 VanDerWaalsContact O-NE1 3.08Å
2434	V	90.5	Very high	91.4	Very high	14.75 Å²	14.75	31.6 Å²	31.6	9%	0.089	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.3	178.5	-175.2	0	0	0	0	108.7	A2388 I2393 V2395 V2432 F2438 I2439 Y2453 W2479	A2388-V2434 HydrophobicContact CB-CB 4.46Å; A2388-V2434 HydrophobicContact CB-CG2 3.9Å; I2393-V2434 HydrophobicContact CG2-CG1 3.77Å; V2395-V2434 HydrophobicContact CB-CG2 4.13Å; V2395-V2434 HydrophobicContact CG2-CG2 3.6Å; V2432-V2434 HydrophobicContact CG1-CG2 4.44Å; V2434-F2438 WeakPolarHBondContact CA-O 3.41Å; V2434-I2439 HydrophobicContact CG1-CG1 4.42Å; V2434-I2439 HydrophobicContact CG2-CG1 4.25Å; V2434-I2439 HydrophobicContact CG2-CG2 4.3Å; V2434-Y2453 HydrophobicContact CG1-CE1 4.05Å; V2434-W2479 VanDerWaalsContact C-CD1 3.48Å
2435	Q	84.2	Confident	91.5	Very high	65.25 Å²	65.25	28.6 Å²	28.6	31%	0.305	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	132.9	173.7	-168.7	75.9	40.9	0	0	110.3	D2437 F2438 W2479	Q2435-D2437 PolarHBondContact O-N 2.98Å; Q2435-F2438 PolarHBondContact N-O 2.97Å; Q2435-F2438 VanDerWaalsContact N-O 3.12Å; Q2435-F2438 PolarHBondContact O-N 3.04Å; Q2435-W2479 HydrophobicContact CB-CB 3.45Å; Q2435-W2479 VanDerWaalsContact CB-CB 3.45Å; Q2435-W2479 VanDerWaalsContact CB-CD1 3.46Å; Q2435-W2479 HydrophobicContact CB-CD2 4.46Å; Q2435-W2479 HydrophobicContact CB-CG 3.52Å; Q2435-W2479 VanDerWaalsContact CB-CG 3.49Å; Q2435-W2479 HydrophobicContact CG-CB 3.93Å; Q2435-W2479 HydrophobicContact CG-CG 4.46Å
2436	M	78.4	Confident	91.6	Very high	81.5 Å²	81.5	31.5 Å²	31.5	40%	0.401	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	-121.6	-178.8	-60.1	169.6	137.2	0	0	110.4	F2438 Y2453 Y2481 L2491	M2436-F2438 VanDerWaalsContact C-N 3.29Å; M2436-F2438 PolarHBondContact O-N 2.97Å; M2436-Y2453 WeakPolarHBondContact O-CE1 3.45Å; M2436-Y2453 PolarHBondContact O-OH 2.97Å; M2436-Y2481 HydrophobicContact CE-CG 4.5Å; M2436-L2491 HydrophobicContact SD-CD1 4.04Å
2437	D	84.8	Confident	91.8	Very high	74 Å²	74	27.8 Å²	27.8	40%	0.396	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	8.7	-177.9	-60.5	3	0	0	0	113.8	Q2435 K2452 Y2453	Q2435-D2437 PolarHBondContact O-N 2.98Å; D2437-K2452 HydrophobicContact CB-CD 4.42Å; D2437-K2452 VanDerWaalsContact CB-CE 3.49Å; D2437-K2452 HydrophobicContact CB-CG 4.13Å; D2437-K2452 CarbonylContact O-C 3.52Å; D2437-K2452 WeakPolarHBondContact O-CA 3.39Å; D2437-K2452 WeakPolarHBondContact O-CG 3.46Å; D2437-K2452 WeakPolarHBondContact OD2-CE 3.36Å; D2437-K2452 IonicContact OD2-NZ 3.19Å; D2437-K2452 PolarHBondContact OD2-NZ 3.13Å; D2437-Y2453 VanDerWaalsContact C-CD1 3.42Å; D2437-Y2453 VanDerWaalsContact C-CE1 3.43Å; D2437-Y2453 VanDerWaalsContact O-CD1 3.29Å; D2437-Y2453 WeakPolarHBondContact O-CD1 3.37Å; D2437-Y2453 PolarHBondContact O-N 3.18Å
2438	F	89.4	Confident	91.9	Very high	35.5 Å²	35.5	26 Å²	26	16%	0.156	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	140.9	-168.2	-60	-79.5	0	0	0	113.9	V2434 Q2435 M2436 I2450 Y2451 K2452 Q2463 W2479 L2491	V2434-F2438 WeakPolarHBondContact CA-O 3.41Å; Q2435-F2438 PolarHBondContact N-O 2.97Å; Q2435-F2438 VanDerWaalsContact N-O 3.12Å; Q2435-F2438 PolarHBondContact O-N 3.04Å; M2436-F2438 VanDerWaalsContact C-N 3.29Å; M2436-F2438 PolarHBondContact O-N 2.97Å; F2438-I2450 HydrophobicContact CD1-CG2 4.45Å; F2438-Y2451 WeakPolarHBondContact CA-O 3.24Å; F2438-K2452 HydrophobicContact CD1-CB 4.17Å; F2438-K2452 HydrophobicContact CD1-CG 4.17Å; F2438-K2452 HydrophobicContact CE1-CB 4.03Å; F2438-K2452 HydrophobicContact CE1-CD 4.29Å; F2438-K2452 HydrophobicContact CE1-CG 3.8Å; F2438-K2452 HydrophobicContact CZ-CG 4.25Å; F2438-Q2463 VanDerWaalsContact CE1-OE1 3.29Å; F2438-W2479 HydrophobicContact CB-CH2 3.99Å; F2438-W2479 HydrophobicContact CB-CZ2 3.63Å; F2438-W2479 HydrophobicContact CG-CH2 4.46Å; F2438-W2479 PolarHBondContact O-NE1 3.18Å; F2438-L2491 HydrophobicContact CB-CD2 4.29Å; F2438-L2491 HydrophobicContact CD2-CD2 3.33Å; F2438-L2491 HydrophobicContact CE2-CD2 3.81Å; F2438-L2491 HydrophobicContact CG-CD2 3.93Å
2439	I	92.8	Very high	92	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	130.7	172.5	-54.9	163.8	0	0	0	107	I2393 V2395 V2405 V2432 A2433 V2434 T2441 I2450 Y2451 Y2453 V2460	I2393-I2439 HydrophobicContact CD1-CD1 3.96Å; I2393-I2439 HydrophobicContact CD1-CG1 4.45Å; V2395-I2439 HydrophobicContact CG1-CG2 4.16Å; V2395-I2439 HydrophobicContact CG2-CD1 4.01Å; V2395-I2439 HydrophobicContact CG2-CG1 4.28Å; V2395-I2439 HydrophobicContact CG2-CG2 4.19Å; V2405-I2439 HydrophobicContact CG1-CD1 4.02Å; V2405-I2439 HydrophobicContact CG2-CD1 3.91Å; V2432-I2439 HydrophobicContact CG2-CG2 4.26Å; A2433-I2439 CarbonylContact O-C 3.51Å; A2433-I2439 WeakPolarHBondContact O-CA 3.36Å; V2434-I2439 HydrophobicContact CG1-CG1 4.42Å; V2434-I2439 HydrophobicContact CG2-CG1 4.25Å; V2434-I2439 HydrophobicContact CG2-CG2 4.3Å; I2439-T2441 HydrophobicContact CG2-CG2 4.25Å; I2439-I2450 CarbonylContact O-C 3.57Å; I2439-I2450 WeakPolarHBondContact O-CA 3.3Å; I2439-I2450 WeakPolarHBondContact O-CG2 3.44Å; I2439-Y2451 HydrophobicContact CB-CD2 4.35Å; I2439-Y2451 HydrophobicContact CG2-CD2 4.34Å; I2439-Y2451 PolarHBondContact N-O 3.02Å; I2439-Y2451 PolarHBondContact O-N 3.02Å; I2439-Y2453 HydrophobicContact CD1-CD1 4.03Å; I2439-Y2453 HydrophobicContact CG1-CD1 3.82Å; I2439-Y2453 HydrophobicContact CG1-CE1 4.2Å; I2439-V2460 HydrophobicContact CD1-CG1 4.3Å
2440	A	93.9	Very high	91.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	136.1	170.2	0	0	0	0	0	109.8	V2432 A2433 V2448 A2449 I2450 L2477 W2479 L2493	V2432-A2440 CarbonylContact C-O 3.58Å; V2432-A2440 WeakPolarHBondContact CA-O 3.44Å; A2433-A2440 PolarHBondContact N-O 2.96Å; A2433-A2440 PolarHBondContact O-N 3.32Å; A2440-V2448 HydrophobicContact CB-CG1 4.34Å; A2440-A2449 CarbonylContact C-O 3.59Å; A2440-A2449 WeakPolarHBondContact CA-O 3.4Å; A2440-I2450 HydrophobicContact CB-CD1 4.16Å; A2440-I2450 HydrophobicContact CB-CG1 4.14Å; A2440-L2477 HydrophobicContact CB-CD1 4.08Å; A2440-W2479 HydrophobicContact CB-CH2 4.33Å; A2440-W2479 HydrophobicContact CB-CZ2 3.55Å; A2440-W2479 VanDerWaalsContact CB-CZ2 3.43Å; A2440-L2493 HydrophobicContact CB-CD1 3.72Å; A2440-L2493 HydrophobicContact CB-CD2 3.89Å; A2440-L2493 HydrophobicContact CB-CG 4.47Å
2441	T	96	Very high	91.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	138.1	176.7	59.6	0	0	0	0	110.2	V2403 H2425 A2431 V2432 I2439 V2448 A2449 Y2451 L2477	V2403-T2441 HydrophobicContact CB-CG2 4.41Å; V2403-T2441 HydrophobicContact CG1-CG2 3.78Å; V2403-T2441 HydrophobicContact CG2-CG2 3.69Å; H2425-T2441 PolarHBondContact CD2-OG1 2.81Å; H2425-T2441 PolarHBondContact NE2-O 3.2Å; H2425-T2441 PolarHBondContact NE2-OG1 3Å; A2431-T2441 CarbonylContact O-C 3.56Å; A2431-T2441 WeakPolarHBondContact O-CA 3.34Å; V2432-T2441 HydrophobicContact CB-CG2 4.31Å; V2432-T2441 HydrophobicContact CG2-CG2 4Å; I2439-T2441 HydrophobicContact CG2-CG2 4.25Å; T2441-V2448 CarbonylContact O-C 3.5Å; T2441-V2448 VanDerWaalsContact O-CA 3.24Å; T2441-V2448 WeakPolarHBondContact O-CA 3.43Å; T2441-V2448 WeakPolarHBondContact O-CG1 3.35Å; T2441-A2449 PolarHBondContact N-O 3.26Å; T2441-A2449 PolarHBondContact O-N 3.03Å; T2441-Y2451 HydrophobicContact CG2-CE2 4.11Å; T2441-L2477 VanDerWaalsContact C-CD1 3.48Å
2442	G	94.4	Very high	91.7	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.1	-178.5	0	0	0	0	0	110	T2430 A2431 L2477	T2430-G2442 PolarHBondContact N-O 3.05Å; T2430-G2442 PolarHBondContact OG1-O 3.22Å; A2431-G2442 PolarHBondContact N-O 3.06Å; A2431-G2442 VanDerWaalsContact N-O 3.13Å; A2431-G2442 PolarHBondContact O-N 3.02Å; G2442-L2477 VanDerWaalsContact N-CD1 3.27Å
2443	S	94.8	Very high	91.4	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	165.3	-173.5	166.9	0	0	0	0	111.8	H2425 S2427 Q2428 D2445 K2446 N2447	H2425-S2443 VanDerWaalsContact ND1-CB 3.28Å; H2425-S2443 WeakPolarHBondContact ND1-CB 3.38Å; S2427-S2443 VanDerWaalsContact C-OG 3.26Å; S2427-S2443 PolarHBondContact O-OG 2.88Å; Q2428-S2443 VanDerWaalsContact O-CA 3.31Å; Q2428-S2443 WeakPolarHBondContact O-CA 3.29Å; Q2428-S2443 WeakPolarHBondContact O-CB 3.33Å; Q2428-S2443 PolarHBondContact O-OG 2.86Å; Q2428-S2443 VanDerWaalsContact O-OG 3.05Å; S2443-D2445 VanDerWaalsContact CB-OD1 3.28Å; S2443-D2445 WeakPolarHBondContact CB-OD1 3.31Å; S2443-D2445 PolarHBondContact O-N 3.25Å; S2443-D2445 PolarHBondContact OG-N 2.82Å; S2443-D2445 VanDerWaalsContact OG-N 3.11Å; S2443-D2445 PolarHBondContact OG-OD1 2.97Å; S2443-K2446 PolarHBondContact O-N 3.14Å; S2443-K2446 VanDerWaalsContact O-N 3.12Å; S2443-N2447 PolarHBondContact N-O 3.13Å
2444	K	93	Very high	91	Very high	54 Å²	54	28.5 Å²	28.5	24%	0.235	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-14.2	166.9	-67.5	-172.3	177.1	172.5	0	113.3	S2427 Q2428 T2430 K2446 W2473	S2427-K2444 WeakPolarHBondContact OG-CB 3.35Å; Q2428-K2444 HydrophobicContact CB-CD 4.23Å; Q2428-K2444 HydrophobicContact CB-CG 4.42Å; Q2428-K2444 PolarHBondContact O-N 3.01Å; Q2428-K2444 VanDerWaalsContact O-N 3.08Å; Q2428-K2444 VanDerWaalsContact OE1-CE 3.28Å; T2430-K2444 HydrophobicContact CG2-CD 4.35Å; T2430-K2444 HydrophobicContact CG2-CG 3.76Å; K2444-K2446 PolarHBondContact O-N 2.94Å; K2444-W2473 HydrophobicContact CB-CD2 4.47Å; K2444-W2473 HydrophobicContact CB-CG 4.06Å; K2444-W2473 HydrophobicContact CD-CD2 3.98Å; K2444-W2473 HydrophobicContact CD-CE3 4.3Å; K2444-W2473 HydrophobicContact CD-CG 4.28Å; K2444-W2473 HydrophobicContact CD-CZ2 4.33Å; K2444-W2473 HydrophobicContact CG-CB 4.25Å; K2444-W2473 HydrophobicContact CG-CD2 3.95Å; K2444-W2473 HydrophobicContact CG-CE3 4.46Å; K2444-W2473 HydrophobicContact CG-CG 3.79Å
2445	D	93.2	Very high	90.4	Very high	23.75 Å²	23.75	30.1 Å²	30.1	13%	0.127	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	0.3	170.8	76.3	0.1	0	0	0	114.2	H2425 S2426 S2443 N2447	H2425-D2445 IonicContact CE1-OD1 3.68Å; H2425-D2445 IonicContact CG-OD2 3.49Å; H2425-D2445 IonicContact ND1-OD1 3.21Å; H2425-D2445 PolarHBondContact ND1-OD1 3.09Å; H2425-D2445 IonicContact ND1-OD2 3.31Å; H2425-D2445 PolarHBondContact ND1-OD2 2.98Å; S2426-D2445 PolarHBondContact N-OD2 3.14Å; S2426-D2445 VanDerWaalsContact N-OD2 3.08Å; S2426-D2445 VanDerWaalsContact OG-CB 3.28Å; S2426-D2445 WeakPolarHBondContact OG-CB 3.28Å; S2426-D2445 PolarHBondContact OG-OD2 2.98Å; S2443-D2445 VanDerWaalsContact CB-OD1 3.28Å; S2443-D2445 WeakPolarHBondContact CB-OD1 3.31Å; S2443-D2445 PolarHBondContact O-N 3.25Å; S2443-D2445 PolarHBondContact OG-N 2.82Å; S2443-D2445 VanDerWaalsContact OG-N 3.11Å; S2443-D2445 PolarHBondContact OG-OD1 2.97Å; D2445-N2447 PolarHBondContact O-N 3.12Å; D2445-N2447 PolarHBondContact O-ND2 3.18Å; D2445-N2447 WeakPolarHBondContact OD1-CA 3.47Å; D2445-N2447 VanDerWaalsContact OD1-CB 3.27Å; D2445-N2447 WeakPolarHBondContact OD1-CB 3.19Å; D2445-N2447 PolarHBondContact OD1-N 3.1Å; D2445-N2447 PolarHBondContact OD1-ND2 2.95Å; D2445-N2447 PolarHBondContact OD2-ND2 3.07Å; D2445-N2447 VanDerWaalsContact OD2-ND2 3.1Å
2446	K	93.6	Very high	90.1	Very high	73 Å²	73	34 Å²	34	32%	0.317	17%	0.171	S	C	.	.	S	Bend	trans	71.6	5	177.8	-44.9	174.3	-173.8	-168.2	0	114.4	S2443 K2444 N2468 A2469 S2470 K2471	S2443-K2446 PolarHBondContact O-N 3.14Å; S2443-K2446 VanDerWaalsContact O-N 3.12Å; K2444-K2446 PolarHBondContact O-N 2.94Å; K2446-N2468 CarbonylContact O-C 3.5Å; K2446-A2469 PolarHBondContact O-N 3.05Å; K2446-S2470 PolarHBondContact O-N 3.27Å; K2446-S2470 PolarHBondContact O-OG 2.99Å; K2446-K2471 WeakPolarHBondContact CD-O 3.29Å; K2446-K2471 VanDerWaalsContact CE-O 3.31Å; K2446-K2471 WeakPolarHBondContact CE-O 3.25Å; K2446-K2471 PolarHBondContact NZ-O 2.77Å
2447	N	95.2	Very high	90.2	Very high	21 Å²	21	32.6 Å²	32.6	11%	0.112	17%	0.17	C	C	.	.			trans	-97	154.2	179.8	-53.4	-42.7	0	0	0	110.9	H2425 S2443 D2445 I2465 I2466 Y2467 N2468 I2474	H2425-N2447 PolarHBondContact CE1-O 2.93Å; S2443-N2447 PolarHBondContact N-O 3.13Å; D2445-N2447 PolarHBondContact O-N 3.12Å; D2445-N2447 PolarHBondContact O-ND2 3.18Å; D2445-N2447 WeakPolarHBondContact OD1-CA 3.47Å; D2445-N2447 VanDerWaalsContact OD1-CB 3.27Å; D2445-N2447 WeakPolarHBondContact OD1-CB 3.19Å; D2445-N2447 PolarHBondContact OD1-N 3.1Å; D2445-N2447 PolarHBondContact OD1-ND2 2.95Å; D2445-N2447 PolarHBondContact OD2-ND2 3.07Å; D2445-N2447 VanDerWaalsContact OD2-ND2 3.1Å; N2447-I2465 HydrophobicContact CB-CG2 4.19Å; N2447-I2466 WeakPolarHBondContact CA-O 3.34Å; N2447-Y2467 VanDerWaalsContact OD1-CA 3.28Å; N2447-Y2467 WeakPolarHBondContact OD1-CA 3.37Å; N2447-N2468 PolarHBondContact OD1-N 3.23Å; N2447-I2474 VanDerWaalsContact O-CD1 3.22Å; N2447-I2474 WeakPolarHBondContact O-CD1 3.33Å
2448	V	94.4	Very high	90.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	119.8	167.4	175.5	0	0	0	0	109.2	A2440 T2441 I2450 I2465 I2466 A2469 I2474 L2477 L2493 V2495	A2440-V2448 HydrophobicContact CB-CG1 4.34Å; T2441-V2448 CarbonylContact O-C 3.5Å; T2441-V2448 VanDerWaalsContact O-CA 3.24Å; T2441-V2448 WeakPolarHBondContact O-CA 3.43Å; T2441-V2448 WeakPolarHBondContact O-CG1 3.35Å; V2448-I2450 HydrophobicContact CG1-CD1 4.2Å; V2448-I2450 HydrophobicContact CG1-CG1 3.84Å; V2448-I2465 CarbonylContact O-C 3.55Å; V2448-I2465 WeakPolarHBondContact O-CA 3.3Å; V2448-I2466 HydrophobicContact CB-CB 4.28Å; V2448-I2466 PolarHBondContact N-O 3.18Å; V2448-I2466 PolarHBondContact O-N 2.96Å; V2448-A2469 HydrophobicContact CB-CB 4.32Å; V2448-A2469 HydrophobicContact CG2-CB 3.75Å; V2448-I2474 HydrophobicContact CG2-CD1 3.51Å; V2448-I2474 VanDerWaalsContact CG2-CD1 3.45Å; V2448-L2477 HydrophobicContact CG1-CD1 4.44Å; V2448-L2477 HydrophobicContact CG2-CD2 4.26Å; V2448-L2493 HydrophobicContact CG1-CD2 3.68Å; V2448-V2495 HydrophobicContact CG2-CG1 4.38Å; V2448-V2495 HydrophobicContact CG2-CG2 4.2Å
2449	A	94	Very high	90	Very high	0.5 Å²	0.5	32 Å²	32	0%	0.004	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	137.3	167.6	0	0	0	0	0	109.5	E2424 A2440 T2441 Y2451 L2462 I2465	E2424-A2449 HydrophobicContact CB-CB 4.38Å; A2440-A2449 CarbonylContact C-O 3.59Å; A2440-A2449 WeakPolarHBondContact CA-O 3.4Å; T2441-A2449 PolarHBondContact N-O 3.26Å; T2441-A2449 PolarHBondContact O-N 3.03Å; A2449-Y2451 HydrophobicContact CB-CE2 3.84Å; A2449-L2462 HydrophobicContact CB-CD1 4.12Å; A2449-I2465 HydrophobicContact CB-CG1 4.25Å
2450	I	93.1	Very high	89.7	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	124.1	177	-51.9	-161.4	0	0	0	109.5	F2438 I2439 A2440 V2448 Q2463 Y2464 I2466 W2479 L2493 I2507	F2438-I2450 HydrophobicContact CD1-CG2 4.45Å; I2439-I2450 CarbonylContact O-C 3.57Å; I2439-I2450 WeakPolarHBondContact O-CA 3.3Å; I2439-I2450 WeakPolarHBondContact O-CG2 3.44Å; A2440-I2450 HydrophobicContact CB-CD1 4.16Å; A2440-I2450 HydrophobicContact CB-CG1 4.14Å; V2448-I2450 HydrophobicContact CG1-CD1 4.2Å; V2448-I2450 HydrophobicContact CG1-CG1 3.84Å; I2450-Q2463 WeakPolarHBondContact O-CB 3.33Å; I2450-Q2463 PolarHBondContact O-N 3.2Å; I2450-Y2464 HydrophobicContact CB-CD2 4.2Å; I2450-Y2464 HydrophobicContact CB-CE1 4.37Å; I2450-Y2464 HydrophobicContact CB-CE2 3.58Å; I2450-Y2464 VanDerWaalsContact CB-CE2 3.45Å; I2450-Y2464 HydrophobicContact CD1-CD2 4.31Å; I2450-Y2464 HydrophobicContact CD1-CE2 3.51Å; I2450-Y2464 WeakPolarHBondContact CD1-OH 3.48Å; I2450-Y2464 HydrophobicContact CG1-CD2 4.24Å; I2450-Y2464 HydrophobicContact CG1-CE2 3.58Å; I2450-Y2464 HydrophobicContact CG2-CE1 4.45Å; I2450-Y2464 HydrophobicContact CG2-CE2 4.24Å; I2450-Y2464 WeakPolarHBondContact CG2-OH 3.45Å; I2450-Y2464 PolarHBondContact N-O 3.06Å; I2450-Y2464 PolarHBondContact O-N 3.04Å; I2450-Y2464 VanDerWaalsContact O-N 3.13Å; I2450-I2466 HydrophobicContact CD1-CD1 4.29Å; I2450-W2479 HydrophobicContact CD1-CH2 3.93Å; I2450-W2479 HydrophobicContact CD1-CZ2 4.34Å; I2450-W2479 HydrophobicContact CG2-CH2 3.93Å; I2450-W2479 HydrophobicContact CG2-CZ2 4.11Å; I2450-L2493 HydrophobicContact CD1-CD2 3.8Å; I2450-I2507 HydrophobicContact CD1-CD1 3.79Å; I2450-I2507 HydrophobicContact CD1-CG1 4.38Å; I2450-I2507 HydrophobicContact CG2-CD1 4.35Å
2451	Y	92.2	Very high	89.6	Confident	0.5 Å²	0.5	36.6 Å²	36.6	0%	0.002	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	144.1	179.1	-47.4	-97.2	0	0	0	109.5	F2422 E2424 F2438 I2439 T2441 A2449 V2460 T2461 L2462	F2422-Y2451 HydrophobicContact CB-CE1 3.98Å; F2422-Y2451 HydrophobicContact CD1-CD1 4.34Å; F2422-Y2451 AromaticContact CD1-CE1 3.92Å; F2422-Y2451 HydrophobicContact CD1-CE1 3.97Å; F2422-Y2451 HydrophobicContact CD2-CE1 4.4Å; F2422-Y2451 HydrophobicContact CG-CD1 4.4Å; F2422-Y2451 AromaticContact CG-CE1 3.83Å; F2422-Y2451 HydrophobicContact CG-CE1 3.87Å; E2424-Y2451 WeakPolarHBondContact CB-OH 3.33Å; E2424-Y2451 HydrophobicContact CG-CE1 4.05Å; E2424-Y2451 VanDerWaalsContact CG-OH 3.28Å; E2424-Y2451 WeakPolarHBondContact CG-OH 3.42Å; F2438-Y2451 WeakPolarHBondContact CA-O 3.24Å; I2439-Y2451 HydrophobicContact CB-CD2 4.35Å; I2439-Y2451 HydrophobicContact CG2-CD2 4.34Å; I2439-Y2451 PolarHBondContact N-O 3.02Å; I2439-Y2451 PolarHBondContact O-N 3.02Å; T2441-Y2451 HydrophobicContact CG2-CE2 4.11Å; A2449-Y2451 HydrophobicContact CB-CE2 3.84Å; Y2451-V2460 HydrophobicContact CD1-CG1 4.33Å; Y2451-V2460 HydrophobicContact CG-CG1 4.28Å; Y2451-T2461 CarbonylContact C-O 3.42Å; Y2451-T2461 VanDerWaalsContact CA-O 3.28Å; Y2451-T2461 WeakPolarHBondContact CA-O 3.39Å; Y2451-T2461 WeakPolarHBondContact CB-O 3.47Å; Y2451-L2462 HydrophobicContact CD1-CB 4Å; Y2451-L2462 HydrophobicContact CD1-CD1 3.85Å; Y2451-L2462 HydrophobicContact CD1-CG 4.49Å; Y2451-L2462 HydrophobicContact CE1-CB 4.14Å; Y2451-L2462 HydrophobicContact CE1-CD1 3.62Å; Y2451-L2462 VanDerWaalsContact CE1-CD1 3.45Å; Y2451-L2462 HydrophobicContact CE1-CG 4.37Å; Y2451-L2462 HydrophobicContact CG-CD1 4.43Å
2452	K	89.6	Confident	89.3	Confident	81.25 Å²	81.25	39.8 Å²	39.8	35%	0.353	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131.3	165	-168.1	-169.1	177.7	-168.5	0	108.7	D2437 F2438 V2460 T2461	D2437-K2452 HydrophobicContact CB-CD 4.42Å; D2437-K2452 VanDerWaalsContact CB-CE 3.49Å; D2437-K2452 HydrophobicContact CB-CG 4.13Å; D2437-K2452 CarbonylContact O-C 3.52Å; D2437-K2452 WeakPolarHBondContact O-CA 3.39Å; D2437-K2452 WeakPolarHBondContact O-CG 3.46Å; D2437-K2452 WeakPolarHBondContact OD2-CE 3.36Å; D2437-K2452 IonicContact OD2-NZ 3.19Å; D2437-K2452 PolarHBondContact OD2-NZ 3.13Å; F2438-K2452 HydrophobicContact CD1-CB 4.17Å; F2438-K2452 HydrophobicContact CD1-CG 4.17Å; F2438-K2452 HydrophobicContact CE1-CB 4.03Å; F2438-K2452 HydrophobicContact CE1-CD 4.29Å; F2438-K2452 HydrophobicContact CE1-CG 3.8Å; F2438-K2452 HydrophobicContact CZ-CG 4.25Å; K2452-V2460 CarbonylContact O-C 3.57Å; K2452-V2460 WeakPolarHBondContact O-CA 3.38Å; K2452-T2461 PolarHBondContact N-O 3Å; K2452-T2461 PolarHBondContact O-N 3.13Å; K2452-T2461 PolarHBondContact O-OG1 3.27Å; K2452-T2461 VanDerWaalsContact O-OG1 3.08Å
2453	Y	88.8	Confident	89	Confident	14.5 Å²	14.5	42.4 Å²	42.4	6%	0.057	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	160.2	170	75.6	-88.7	0	0	0	111.9	I2393 F2407 V2434 M2436 D2437 I2439 T2459	I2393-Y2453 HydrophobicContact CD1-CD1 4.04Å; I2393-Y2453 HydrophobicContact CD1-CD2 3.82Å; I2393-Y2453 HydrophobicContact CD1-CE1 4.18Å; I2393-Y2453 HydrophobicContact CD1-CE2 3.98Å; I2393-Y2453 HydrophobicContact CD1-CG 3.83Å; I2393-Y2453 HydrophobicContact CG2-CE1 4.36Å; I2393-Y2453 HydrophobicContact CG2-CE2 4.21Å; I2393-Y2453 WeakPolarHBondContact CG2-OH 3.49Å; F2407-Y2453 AromaticContact CE1-CD2 3.92Å; F2407-Y2453 HydrophobicContact CE1-CD2 4.02Å; F2407-Y2453 HydrophobicContact CZ-CD2 4.36Å; V2434-Y2453 HydrophobicContact CG1-CE1 4.05Å; M2436-Y2453 WeakPolarHBondContact O-CE1 3.45Å; M2436-Y2453 PolarHBondContact O-OH 2.97Å; D2437-Y2453 VanDerWaalsContact C-CD1 3.42Å; D2437-Y2453 VanDerWaalsContact C-CE1 3.43Å; D2437-Y2453 VanDerWaalsContact O-CD1 3.29Å; D2437-Y2453 WeakPolarHBondContact O-CD1 3.37Å; D2437-Y2453 PolarHBondContact O-N 3.18Å; I2439-Y2453 HydrophobicContact CD1-CD1 4.03Å; I2439-Y2453 HydrophobicContact CG1-CD1 3.82Å; I2439-Y2453 HydrophobicContact CG1-CE1 4.2Å; Y2453-T2459 CarbonylContact C-O 3.56Å; Y2453-T2459 VanDerWaalsContact CA-O 3.26Å; Y2453-T2459 WeakPolarHBondContact CA-O 3.42Å; Y2453-T2459 WeakPolarHBondContact CB-O 3.29Å
2454	D	84.9	Confident	88.6	Confident	59.25 Å²	59.25	43.8 Å²	43.8	32%	0.317	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	119.2	168.3	167.6	29.6	0	0	0	108.2	N2456 S2457 T2458 T2459	D2454-N2456 VanDerWaalsContact C-N 3.28Å; D2454-N2456 PolarHBondContact O-N 2.85Å; D2454-N2456 WeakPolarHBondContact OD1-CB 3.33Å; D2454-N2456 PolarHBondContact OD1-N 3.08Å; D2454-N2456 VanDerWaalsContact OD1-N 3.13Å; D2454-N2456 PolarHBondContact OD1-ND2 3.43Å; D2454-S2457 WeakPolarHBondContact CB-OG 3.35Å; D2454-S2457 VanDerWaalsContact CG-OG 3.26Å; D2454-S2457 VanDerWaalsContact OD2-CB 3.26Å; D2454-S2457 WeakPolarHBondContact OD2-CB 3.34Å; D2454-S2457 PolarHBondContact OD2-N 3.13Å; D2454-S2457 PolarHBondContact OD2-OG 3.08Å; D2454-T2458 VanDerWaalsContact O-CA 3.32Å; D2454-T2458 WeakPolarHBondContact O-CA 3.38Å; D2454-T2458 PolarHBondContact O-N 3.14Å; D2454-T2459 PolarHBondContact N-O 3.28Å; D2454-T2459 PolarHBondContact O-N 3.05Å
2455	S	77.9	Confident	88.5	Confident	48 Å²	48	42.5 Å²	42.5	34%	0.336	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-32.8	-179.5	51.4	0	0	0	0	112.3	T2458	S2455-T2458 WeakPolarHBondContact O-CG2 3.35Å; S2455-T2458 PolarHBondContact O-N 3.31Å
2456	N	78.1	Confident	88.4	Confident	146.5 Å²	146.5	41.5 Å²	41.5	78%	0.783	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-45.7	-174.2	-64.4	-32.6	0	0	0	111.8	D2454 T2458	D2454-N2456 VanDerWaalsContact C-N 3.28Å; D2454-N2456 PolarHBondContact O-N 2.85Å; D2454-N2456 WeakPolarHBondContact OD1-CB 3.33Å; D2454-N2456 PolarHBondContact OD1-N 3.08Å; D2454-N2456 VanDerWaalsContact OD1-N 3.13Å; D2454-N2456 PolarHBondContact OD1-ND2 3.43Å; N2456-T2458 VanDerWaalsContact C-N 3.3Å
2457	S	81.1	Confident	88.2	Confident	52.5 Å²	52.5	45.3 Å²	45.3	37%	0.367	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-11.3	174.1	62.1	0	0	0	0	113.2	D2454 T2459	D2454-S2457 WeakPolarHBondContact CB-OG 3.35Å; D2454-S2457 VanDerWaalsContact CG-OG 3.26Å; D2454-S2457 VanDerWaalsContact OD2-CB 3.26Å; D2454-S2457 WeakPolarHBondContact OD2-CB 3.34Å; D2454-S2457 PolarHBondContact OD2-N 3.13Å; D2454-S2457 PolarHBondContact OD2-OG 3.08Å; S2457-T2459 VanDerWaalsContact C-N 3.28Å; S2457-T2459 PolarHBondContact O-N 3.12Å; S2457-T2459 PolarHBondContact OG-OG1 3.22Å
2458	T	82.3	Confident	87.9	Confident	30.75 Å²	30.75	50 Å²	50	19%	0.189	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	42.2	-170.8	58.2	0	0	0	0	112	F2407 K2418 F2420 D2454 S2455 N2456	F2407-T2458 HydrophobicContact CB-CG2 4.42Å; F2407-T2458 HydrophobicContact CD1-CG2 4.2Å; F2407-T2458 HydrophobicContact CG-CG2 4.29Å; K2418-T2458 HydrophobicContact CD-CG2 4.38Å; K2418-T2458 WeakPolarHBondContact CD-OG1 3.41Å; K2418-T2458 PolarHBondContact NZ-OG1 3.12Å; F2420-T2458 VanDerWaalsContact CE2-O 3.29Å; F2420-T2458 WeakPolarHBondContact CE2-O 3.3Å; F2420-T2458 WeakPolarHBondContact CZ-O 3.32Å; D2454-T2458 VanDerWaalsContact O-CA 3.32Å; D2454-T2458 WeakPolarHBondContact O-CA 3.38Å; D2454-T2458 PolarHBondContact O-N 3.14Å; S2455-T2458 WeakPolarHBondContact O-CG2 3.35Å; S2455-T2458 PolarHBondContact O-N 3.31Å; N2456-T2458 VanDerWaalsContact C-N 3.3Å
2459	T	86.3	Confident	87.6	Confident	65.5 Å²	65.5	50 Å²	50	40%	0.402	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	152	179.5	63.8	0	0	0	0	111.5	Y2453 D2454 S2457	Y2453-T2459 CarbonylContact C-O 3.56Å; Y2453-T2459 VanDerWaalsContact CA-O 3.26Å; Y2453-T2459 WeakPolarHBondContact CA-O 3.42Å; Y2453-T2459 WeakPolarHBondContact CB-O 3.29Å; D2454-T2459 PolarHBondContact N-O 3.28Å; D2454-T2459 PolarHBondContact O-N 3.05Å; S2457-T2459 VanDerWaalsContact C-N 3.28Å; S2457-T2459 PolarHBondContact O-N 3.12Å; S2457-T2459 PolarHBondContact OG-OG1 3.22Å
2460	V	88.3	Confident	87.4	Confident	17.5 Å²	17.5	50.2 Å²	50.2	11%	0.106	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	134.4	175.7	-176.1	0	0	0	0	107.7	V2405 F2407 F2422 I2439 Y2451 K2452	V2405-V2460 HydrophobicContact CB-CG2 4.49Å; V2405-V2460 HydrophobicContact CG1-CG2 3.99Å; F2407-V2460 HydrophobicContact CE2-CG2 3.59Å; F2407-V2460 HydrophobicContact CZ-CG2 3.57Å; F2407-V2460 VanDerWaalsContact CZ-CG2 3.49Å; F2422-V2460 HydrophobicContact CE1-CG1 4.46Å; F2422-V2460 HydrophobicContact CE2-CB 4.05Å; F2422-V2460 HydrophobicContact CE2-CG1 3.88Å; F2422-V2460 HydrophobicContact CE2-CG2 4.46Å; F2422-V2460 HydrophobicContact CZ-CB 3.66Å; F2422-V2460 HydrophobicContact CZ-CG1 3.76Å; F2422-V2460 HydrophobicContact CZ-CG2 4.45Å; I2439-V2460 HydrophobicContact CD1-CG1 4.3Å; Y2451-V2460 HydrophobicContact CD1-CG1 4.33Å; Y2451-V2460 HydrophobicContact CG-CG1 4.28Å; K2452-V2460 CarbonylContact O-C 3.57Å; K2452-V2460 WeakPolarHBondContact O-CA 3.38Å
2461	T	90.2	Very high	87.1	Confident	80.75 Å²	80.75	57.9 Å²	57.9	50%	0.495	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	132.4	-177.4	54.4	0	0	0	0	109.7	Y2451 K2452 Q2463	Y2451-T2461 CarbonylContact C-O 3.42Å; Y2451-T2461 VanDerWaalsContact CA-O 3.28Å; Y2451-T2461 WeakPolarHBondContact CA-O 3.39Å; Y2451-T2461 WeakPolarHBondContact CB-O 3.47Å; K2452-T2461 PolarHBondContact N-O 3Å; K2452-T2461 PolarHBondContact O-N 3.13Å; K2452-T2461 PolarHBondContact O-OG1 3.27Å; K2452-T2461 VanDerWaalsContact O-OG1 3.08Å; T2461-Q2463 PolarHBondContact O-N 3.17Å
2462	L	90.7	Very high	87.1	Confident	67.5 Å²	67.5	60.2 Å²	60.2	35%	0.353	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	128	171.4	179.5	70.1	0	0	0	109.1	E2424 A2449 Y2451 I2465	E2424-L2462 HydrophobicContact CG-CD1 4.34Å; E2424-L2462 HydrophobicContact CG-CD2 4.14Å; A2449-L2462 HydrophobicContact CB-CD1 4.12Å; Y2451-L2462 HydrophobicContact CD1-CB 4Å; Y2451-L2462 HydrophobicContact CD1-CD1 3.85Å; Y2451-L2462 HydrophobicContact CD1-CG 4.49Å; Y2451-L2462 HydrophobicContact CE1-CB 4.14Å; Y2451-L2462 HydrophobicContact CE1-CD1 3.62Å; Y2451-L2462 VanDerWaalsContact CE1-CD1 3.45Å; Y2451-L2462 HydrophobicContact CE1-CG 4.37Å; Y2451-L2462 HydrophobicContact CG-CD1 4.43Å; L2462-I2465 HydrophobicContact CD1-CG1 4.17Å; L2462-I2465 HydrophobicContact CD2-CD1 4.13Å; L2462-I2465 HydrophobicContact CD2-CG1 4.19Å
2463	Q	86.9	Confident	87.1	Confident	54.25 Å²	54.25	62.1 Å²	62.1	25%	0.254	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-42.2	-178.1	-158.7	-174.6	6.7	0	0	112.3	F2438 I2450 T2461 S2509	F2438-Q2463 VanDerWaalsContact CE1-OE1 3.29Å; I2450-Q2463 WeakPolarHBondContact O-CB 3.33Å; I2450-Q2463 PolarHBondContact O-N 3.2Å; T2461-Q2463 PolarHBondContact O-N 3.17Å; Q2463-S2509 PolarHBondContact NE2-O 3.08Å
2464	Y	86.7	Confident	87.3	Confident	28.75 Å²	28.75	61.4 Å²	61.4	11%	0.113	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	158.2	174.5	25.6	-86.9	0	0	0	111.3	I2450 I2466 I2507 K2508 S2509 K2510 K2511 Y2512	I2450-Y2464 HydrophobicContact CB-CD2 4.2Å; I2450-Y2464 HydrophobicContact CB-CE1 4.37Å; I2450-Y2464 HydrophobicContact CB-CE2 3.58Å; I2450-Y2464 VanDerWaalsContact CB-CE2 3.45Å; I2450-Y2464 HydrophobicContact CD1-CD2 4.31Å; I2450-Y2464 HydrophobicContact CD1-CE2 3.51Å; I2450-Y2464 WeakPolarHBondContact CD1-OH 3.48Å; I2450-Y2464 HydrophobicContact CG1-CD2 4.24Å; I2450-Y2464 HydrophobicContact CG1-CE2 3.58Å; I2450-Y2464 HydrophobicContact CG2-CE1 4.45Å; I2450-Y2464 HydrophobicContact CG2-CE2 4.24Å; I2450-Y2464 WeakPolarHBondContact CG2-OH 3.45Å; I2450-Y2464 PolarHBondContact N-O 3.06Å; I2450-Y2464 PolarHBondContact O-N 3.04Å; I2450-Y2464 VanDerWaalsContact O-N 3.13Å; Y2464-I2466 HydrophobicContact CD2-CG1 4.03Å; Y2464-I2466 HydrophobicContact CE2-CD1 4.31Å; Y2464-I2466 HydrophobicContact CE2-CG1 4.26Å; Y2464-I2507 HydrophobicContact CE1-CG2 4.31Å; Y2464-I2507 HydrophobicContact CE2-CD1 3.91Å; Y2464-I2507 HydrophobicContact CE2-CG1 4.48Å; Y2464-I2507 HydrophobicContact CE2-CG2 4.19Å; Y2464-I2507 VanDerWaalsContact OH-CD1 3.25Å; Y2464-I2507 WeakPolarHBondContact OH-CD1 3.29Å; Y2464-I2507 VanDerWaalsContact OH-CG1 3.28Å; Y2464-I2507 WeakPolarHBondContact OH-CG1 3.36Å; Y2464-I2507 WeakPolarHBondContact OH-CG2 3.28Å; Y2464-K2508 PolarHBondContact OH-O 2.98Å; Y2464-S2509 PolarHBondContact OH-O 3.13Å; Y2464-K2510 WeakPolarHBondContact OH-CA 3.48Å; Y2464-K2510 PolarHBondContact OH-N 3.42Å; Y2464-K2511 PolarHBondContact OH-N 2.82Å; Y2464-K2511 VanDerWaalsContact OH-N 3.13Å; Y2464-Y2512 HydrophobicContact CD1-CD1 4.14Å; Y2464-Y2512 AromaticContact CD2-CD1 3.62Å; Y2464-Y2512 HydrophobicContact CD2-CD1 3.62Å; Y2464-Y2512 VanDerWaalsContact CD2-CD1 3.47Å; Y2464-Y2512 AromaticContact CD2-CE1 3.88Å; Y2464-Y2512 HydrophobicContact CD2-CE1 4.11Å; Y2464-Y2512 HydrophobicContact CD2-CG 4.47Å; Y2464-Y2512 AromaticContact CE2-CD1 3.92Å; Y2464-Y2512 HydrophobicContact CE2-CD1 4.1Å; Y2464-Y2512 AromaticContact CG-CD1 3.89Å; Y2464-Y2512 HydrophobicContact CG-CD1 4.09Å; Y2464-Y2512 HydrophobicContact CG-CE1 4.34Å
2465	I	90.4	Very high	87.6	Confident	27.25 Å²	27.25	60.6 Å²	60.6	14%	0.14	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	126.7	165.4	-58.7	174.1	0	0	0	107.7	E2424 N2447 V2448 A2449 L2462 Y2467 Y2512	E2424-I2465 HydrophobicContact CB-CD1 4.37Å; N2447-I2465 HydrophobicContact CB-CG2 4.19Å; V2448-I2465 CarbonylContact O-C 3.55Å; V2448-I2465 WeakPolarHBondContact O-CA 3.3Å; A2449-I2465 HydrophobicContact CB-CG1 4.25Å; L2462-I2465 HydrophobicContact CD1-CG1 4.17Å; L2462-I2465 HydrophobicContact CD2-CD1 4.13Å; L2462-I2465 HydrophobicContact CD2-CG1 4.19Å; I2465-Y2467 HydrophobicContact CB-CE1 4.37Å; I2465-Y2467 HydrophobicContact CB-CE2 4.09Å; I2465-Y2467 HydrophobicContact CG2-CD1 3.91Å; I2465-Y2467 HydrophobicContact CG2-CD2 4.34Å; I2465-Y2467 HydrophobicContact CG2-CE1 3.68Å; I2465-Y2467 HydrophobicContact CG2-CE2 4.13Å; I2465-Y2467 HydrophobicContact CG2-CG 4.23Å; I2465-Y2467 PolarHBondContact O-N 2.94Å; I2465-Y2512 PolarHBondContact O-OH 3.46Å
2466	I	91.3	Very high	88.2	Confident	2.75 Å²	2.75	59.1 Å²	59.1	1%	0.014	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	95.2	170.7	-51.3	179.5	0	0	0	106.7	N2447 V2448 I2450 Y2464 A2469 Y2505 Y2512	N2447-I2466 WeakPolarHBondContact CA-O 3.34Å; V2448-I2466 HydrophobicContact CB-CB 4.28Å; V2448-I2466 PolarHBondContact N-O 3.18Å; V2448-I2466 PolarHBondContact O-N 2.96Å; I2450-I2466 HydrophobicContact CD1-CD1 4.29Å; Y2464-I2466 HydrophobicContact CD2-CG1 4.03Å; Y2464-I2466 HydrophobicContact CE2-CD1 4.31Å; Y2464-I2466 HydrophobicContact CE2-CG1 4.26Å; I2466-A2469 HydrophobicContact CB-CB 4.22Å; I2466-A2469 HydrophobicContact CG2-CB 3.76Å; I2466-Y2505 HydrophobicContact CD1-CD1 4Å; I2466-Y2505 HydrophobicContact CD1-CD2 4.47Å; I2466-Y2505 HydrophobicContact CD1-CE1 4.44Å; I2466-Y2505 HydrophobicContact CD1-CG 3.99Å; I2466-Y2505 HydrophobicContact CG2-CD1 4.33Å; I2466-Y2505 HydrophobicContact CG2-CE1 3.9Å; I2466-Y2512 HydrophobicContact CB-CE2 4.41Å; I2466-Y2512 HydrophobicContact CD1-CD1 4.44Å; I2466-Y2512 HydrophobicContact CD1-CD2 4.22Å; I2466-Y2512 HydrophobicContact CD1-CG 4.18Å; I2466-Y2512 HydrophobicContact CG1-CD1 4.04Å; I2466-Y2512 HydrophobicContact CG1-CD2 4.15Å; I2466-Y2512 HydrophobicContact CG1-CE1 4Å; I2466-Y2512 HydrophobicContact CG1-CE2 4.11Å; I2466-Y2512 HydrophobicContact CG1-CG 4.11Å; I2466-Y2512 HydrophobicContact CG2-CD2 4.36Å; I2466-Y2512 HydrophobicContact CG2-CE2 3.92Å
2467	Y	90	Very high	89	Confident	152.5 Å²	152.5	52.5 Å²	52.5	60%	0.598	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	138.8	176.7	-64.3	-75	0	0	0	111.2	N2447 I2465 A2469	N2447-Y2467 VanDerWaalsContact OD1-CA 3.28Å; N2447-Y2467 WeakPolarHBondContact OD1-CA 3.37Å; I2465-Y2467 HydrophobicContact CB-CE1 4.37Å; I2465-Y2467 HydrophobicContact CB-CE2 4.09Å; I2465-Y2467 HydrophobicContact CG2-CD1 3.91Å; I2465-Y2467 HydrophobicContact CG2-CD2 4.34Å; I2465-Y2467 HydrophobicContact CG2-CE1 3.68Å; I2465-Y2467 HydrophobicContact CG2-CE2 4.13Å; I2465-Y2467 HydrophobicContact CG2-CG 4.23Å; I2465-Y2467 PolarHBondContact O-N 2.94Å; Y2467-A2469 VanDerWaalsContact C-N 3.27Å; Y2467-A2469 PolarHBondContact O-N 3.07Å
2468	N	88.9	Confident	89.5	Confident	120 Å²	120	53.3 Å²	53.3	64%	0.642	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	46.2	-177.2	-65.1	-47.1	0	0	0	112.7	K2446 N2447 S2470	K2446-N2468 CarbonylContact O-C 3.5Å; N2447-N2468 PolarHBondContact OD1-N 3.23Å; N2468-S2470 PolarHBondContact O-N 2.84Å; N2468-S2470 VanDerWaalsContact O-N 3.11Å
2469	A	87.8	Confident	89.9	Confident	0.25 Å²	0.25	52.1 Å²	52.1	0%	0.002	25%	0.251	C	S	.	.	S	Bend	trans	-60.6	-17.9	177.2	0	0	0	0	0	112.8	K2446 V2448 I2466 Y2467 I2474 R2503 Y2505	K2446-A2469 PolarHBondContact O-N 3.05Å; V2448-A2469 HydrophobicContact CB-CB 4.32Å; V2448-A2469 HydrophobicContact CG2-CB 3.75Å; I2466-A2469 HydrophobicContact CB-CB 4.22Å; I2466-A2469 HydrophobicContact CG2-CB 3.76Å; Y2467-A2469 VanDerWaalsContact C-N 3.27Å; Y2467-A2469 PolarHBondContact O-N 3.07Å; A2469-I2474 HydrophobicContact CB-CD1 4.35Å; A2469-R2503 WeakPolarHBondContact O-CD 3.2Å; A2469-R2503 PolarHBondContact O-NE 3.21Å; A2469-Y2505 WeakPolarHBondContact CA-OH 3.44Å; A2469-Y2505 HydrophobicContact CB-CE2 4.34Å; A2469-Y2505 PolarHBondContact O-OH 2.97Å
2470	S	89.6	Confident	89.8	Confident	4 Å²	4	49.1 Å²	49.1	3%	0.028	23%	0.232	C	C	.	.	S	Bend	trans	-145.5	163.4	179.5	51.1	0	0	0	0	110.7	K2446 N2468 D2472 I2474 S2497	K2446-S2470 PolarHBondContact O-N 3.27Å; K2446-S2470 PolarHBondContact O-OG 2.99Å; N2468-S2470 PolarHBondContact O-N 2.84Å; N2468-S2470 VanDerWaalsContact O-N 3.11Å; S2470-D2472 VanDerWaalsContact C-N 3.34Å; S2470-D2472 VanDerWaalsContact CB-O 3.3Å; S2470-D2472 WeakPolarHBondContact CB-O 3.4Å; S2470-D2472 PolarHBondContact OG-O 3.11Å; S2470-I2474 VanDerWaalsContact OG-CG1 3.27Å; S2470-I2474 WeakPolarHBondContact OG-CG1 3.33Å; S2470-S2497 VanDerWaalsContact CB-CB 3.46Å; S2470-S2497 WeakPolarHBondContact CB-OG 3.41Å
2471	K	88	Confident	89.2	Confident	161.75 Å²	161.75	51.8 Å²	51.8	70%	0.703	24%	0.241	S	C	*	.	S	Bend	trans	-84.2	-19.3	175.5	-67.3	-176.8	175.2	-178.5	0	113	K2446 D2499	K2446-K2471 WeakPolarHBondContact CD-O 3.29Å; K2446-K2471 VanDerWaalsContact CE-O 3.31Å; K2446-K2471 WeakPolarHBondContact CE-O 3.25Å; K2446-K2471 PolarHBondContact NZ-O 2.77Å; K2471-D2499 HydrophobicContact CB-CB 4.24Å; K2471-D2499 VanDerWaalsContact CB-OD2 3.27Å; K2471-D2499 WeakPolarHBondContact CB-OD2 3.39Å; K2471-D2499 PolarHBondContact N-OD2 3.21Å; K2471-D2499 VanDerWaalsContact N-OD2 3.07Å
2472	D	90.9	Very high	88	Confident	48 Å²	48	48.2 Å²	48.2	26%	0.257	22%	0.219	S	C	.	.	S	Bend	trans	-142.2	179	-178.9	-162.8	10.8	0	0	0	110.3	S2470 I2474 N2498 D2499	S2470-D2472 VanDerWaalsContact C-N 3.34Å; S2470-D2472 VanDerWaalsContact CB-O 3.3Å; S2470-D2472 WeakPolarHBondContact CB-O 3.4Å; S2470-D2472 PolarHBondContact OG-O 3.11Å; D2472-I2474 PolarHBondContact O-N 3.06Å; D2472-N2498 HydrophobicContact CB-CB 4.25Å; D2472-N2498 WeakPolarHBondContact OD2-CB 3.29Å; D2472-N2498 PolarHBondContact OD2-ND2 3Å; D2472-D2499 HydrophobicContact CB-CB 4.03Å
2473	W	90.7	Very high	86.4	Confident	121 Å²	121	48.6 Å²	48.6	46%	0.458	22%	0.221	S	C	.	.			trans	-47.9	136.2	-174	-56.7	-17	0	0	0	113.6	K2444 I2475 S2497 N2498	K2444-W2473 HydrophobicContact CB-CD2 4.47Å; K2444-W2473 HydrophobicContact CB-CG 4.06Å; K2444-W2473 HydrophobicContact CD-CD2 3.98Å; K2444-W2473 HydrophobicContact CD-CE3 4.3Å; K2444-W2473 HydrophobicContact CD-CG 4.28Å; K2444-W2473 HydrophobicContact CD-CZ2 4.33Å; K2444-W2473 HydrophobicContact CG-CB 4.25Å; K2444-W2473 HydrophobicContact CG-CD2 3.95Å; K2444-W2473 HydrophobicContact CG-CE3 4.46Å; K2444-W2473 HydrophobicContact CG-CG 3.79Å; W2473-I2475 HydrophobicContact CB-CD1 4.03Å; W2473-S2497 CarbonylContact O-C 3.5Å; W2473-S2497 VanDerWaalsContact O-CA 3.3Å; W2473-S2497 WeakPolarHBondContact O-CA 3.3Å; W2473-S2497 VanDerWaalsContact O-CB 3.32Å; W2473-S2497 WeakPolarHBondContact O-CB 3.44Å; W2473-N2498 HydrophobicContact CB-CB 4.49Å; W2473-N2498 PolarHBondContact O-N 3.16Å
2474	I	93.3	Very high	84.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	127.4	170.7	-59.9	164.8	0	0	0	107.7	T2430 A2431 N2447 V2448 A2469 S2470 D2472 L2477 V2495	T2430-I2474 VanDerWaalsContact CB-O 3.31Å; T2430-I2474 WeakPolarHBondContact CB-O 3.27Å; T2430-I2474 PolarHBondContact OG1-O 2.85Å; A2431-I2474 HydrophobicContact CB-CG2 4.31Å; N2447-I2474 VanDerWaalsContact O-CD1 3.22Å; N2447-I2474 WeakPolarHBondContact O-CD1 3.33Å; V2448-I2474 HydrophobicContact CG2-CD1 3.51Å; V2448-I2474 VanDerWaalsContact CG2-CD1 3.45Å; A2469-I2474 HydrophobicContact CB-CD1 4.35Å; S2470-I2474 VanDerWaalsContact OG-CG1 3.27Å; S2470-I2474 WeakPolarHBondContact OG-CG1 3.33Å; D2472-I2474 PolarHBondContact O-N 3.06Å; I2474-L2477 HydrophobicContact CG2-CD2 4.01Å; I2474-L2477 HydrophobicContact CG2-CG 4.14Å; I2474-V2495 HydrophobicContact CD1-CG1 4.3Å; I2474-V2495 HydrophobicContact CG1-CG1 4.12Å; I2474-V2495 HydrophobicContact CG2-CG1 4.04Å
2475	I	90.6	Very high	82.7	Confident	42.25 Å²	42.25	59.1 Å²	59.1	22%	0.217	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	-32.8	-177.2	-58.9	-171	0	0	0	111	W2473 G2496 N2498 I2525 K2526	W2473-I2475 HydrophobicContact CB-CD1 4.03Å; I2475-G2496 PolarHBondContact N-O 3.18Å; I2475-N2498 HydrophobicContact CD1-CB 3.87Å; I2475-N2498 HydrophobicContact CG1-CB 4.31Å; I2475-I2525 VanDerWaalsContact CB-O 3.28Å; I2475-I2525 WeakPolarHBondContact CB-O 3.34Å; I2475-I2525 WeakPolarHBondContact CD1-O 3.26Å; I2475-I2525 VanDerWaalsContact CG2-O 3.26Å; I2475-I2525 WeakPolarHBondContact CG2-O 3.36Å; I2475-K2526 HydrophobicContact CG2-CD 4.42Å
2476	S	91.1	Very high	80.3	Confident	17 Å²	17	66.1 Å²	66.1	12%	0.119	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	142.5	-177.9	-179	0	0	0	0	111.8	G2496 L2528	S2476-G2496 PolarHBondContact N-O 2.99Å; S2476-G2496 VanDerWaalsContact N-O 3.16Å; S2476-G2496 PolarHBondContact O-N 3.01Å; S2476-L2528 WeakPolarHBondContact OG-CG 3.4Å; S2476-L2528 PolarHBondContact OG-N 2.96Å; S2476-L2528 VanDerWaalsContact OG-N 3.1Å
2477	L	93.7	Very high	78	Confident	9 Å²	9	71.4 Å²	71.4	5%	0.047	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	139.6	173.3	-71.1	-178.7	0	0	0	108.8	A2431 A2433 A2440 T2441 G2442 V2448 I2474 L2493 L2494 V2495	A2431-L2477 HydrophobicContact CB-CB 4.12Å; A2431-L2477 HydrophobicContact CB-CD1 4.22Å; A2431-L2477 HydrophobicContact CB-CG 3.79Å; A2433-L2477 HydrophobicContact CB-CB 3.85Å; A2440-L2477 HydrophobicContact CB-CD1 4.08Å; T2441-L2477 VanDerWaalsContact C-CD1 3.48Å; G2442-L2477 VanDerWaalsContact N-CD1 3.27Å; V2448-L2477 HydrophobicContact CG1-CD1 4.44Å; V2448-L2477 HydrophobicContact CG2-CD2 4.26Å; I2474-L2477 HydrophobicContact CG2-CD2 4.01Å; I2474-L2477 HydrophobicContact CG2-CG 4.14Å; L2477-L2493 HydrophobicContact CB-CD1 4.49Å; L2477-L2493 HydrophobicContact CD2-CD1 4.41Å; L2477-L2493 HydrophobicContact CD2-CD2 4.21Å; L2477-L2493 HydrophobicContact CD2-CG 4.42Å; L2477-L2494 WeakPolarHBondContact CA-O 3.4Å; L2477-V2495 HydrophobicContact CD2-CB 4.1Å; L2477-V2495 HydrophobicContact CD2-CG1 4.04Å; L2477-V2495 HydrophobicContact CD2-CG2 3.73Å
2478	K	92.1	Very high	76.2	Confident	68.75 Å²	68.75	68.2 Å²	68.2	30%	0.299	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	139.3	170.5	-147.8	69.9	-174.9	-165.7	0	110.3	L2494 L2528 D2529 F2530	K2478-L2494 HydrophobicContact CB-CB 4.44Å; K2478-L2494 HydrophobicContact CB-CD1 4.42Å; K2478-L2494 PolarHBondContact N-O 3.28Å; K2478-L2494 VanDerWaalsContact N-O 3.12Å; K2478-L2494 WeakPolarHBondContact O-CA 3.47Å; K2478-L2494 VanDerWaalsContact O-CB 3.28Å; K2478-L2494 WeakPolarHBondContact O-CB 3.39Å; K2478-L2494 WeakPolarHBondContact O-CG 3.43Å; K2478-L2494 PolarHBondContact O-N 3.16Å; K2478-L2528 HydrophobicContact CB-CB 4.44Å; K2478-L2528 HydrophobicContact CB-CD2 3.73Å; K2478-L2528 HydrophobicContact CG-CD2 3.95Å; K2478-L2528 WeakPolarHBondContact CG-O 3.36Å; K2478-D2529 WeakPolarHBondContact CE-OD1 3.19Å; K2478-D2529 IonicContact NZ-OD1 3.21Å; K2478-D2529 PolarHBondContact NZ-OD1 2.95Å; K2478-F2530 HydrophobicContact CG-CB 4.01Å
2479	W	89.8	Confident	74.8	Confident	6.25 Å²	6.25	70.4 Å²	70.4	2%	0.024	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	143.5	170.5	-70.6	109.6	0	0	0	110.8	A2433 V2434 Q2435 F2438 A2440 I2450 L2491 L2493 I2507	A2433-W2479 HydrophobicContact CB-CG 4.47Å; A2433-W2479 PolarHBondContact O-NE1 2.92Å; A2433-W2479 VanDerWaalsContact O-NE1 3.08Å; V2434-W2479 VanDerWaalsContact C-CD1 3.48Å; Q2435-W2479 HydrophobicContact CB-CB 3.45Å; Q2435-W2479 VanDerWaalsContact CB-CB 3.45Å; Q2435-W2479 VanDerWaalsContact CB-CD1 3.46Å; Q2435-W2479 HydrophobicContact CB-CD2 4.46Å; Q2435-W2479 HydrophobicContact CB-CG 3.52Å; Q2435-W2479 VanDerWaalsContact CB-CG 3.49Å; Q2435-W2479 HydrophobicContact CG-CB 3.93Å; Q2435-W2479 HydrophobicContact CG-CG 4.46Å; F2438-W2479 HydrophobicContact CB-CH2 3.99Å; F2438-W2479 HydrophobicContact CB-CZ2 3.63Å; F2438-W2479 HydrophobicContact CG-CH2 4.46Å; F2438-W2479 PolarHBondContact O-NE1 3.18Å; A2440-W2479 HydrophobicContact CB-CH2 4.33Å; A2440-W2479 HydrophobicContact CB-CZ2 3.55Å; A2440-W2479 VanDerWaalsContact CB-CZ2 3.43Å; I2450-W2479 HydrophobicContact CD1-CH2 3.93Å; I2450-W2479 HydrophobicContact CD1-CZ2 4.34Å; I2450-W2479 HydrophobicContact CG2-CH2 3.93Å; I2450-W2479 HydrophobicContact CG2-CZ2 4.11Å; W2479-L2491 HydrophobicContact CB-CD1 4.34Å; W2479-L2491 HydrophobicContact CD2-CD1 4.31Å; W2479-L2491 HydrophobicContact CD2-CD2 4.3Å; W2479-L2491 HydrophobicContact CD2-CG 4.49Å; W2479-L2491 HydrophobicContact CE3-CD1 3.84Å; W2479-L2491 HydrophobicContact CE3-CD2 3.77Å; W2479-L2491 HydrophobicContact CE3-CG 3.63Å; W2479-L2491 HydrophobicContact CG-CD1 4.5Å; W2479-L2491 HydrophobicContact CH2-CD2 4.08Å; W2479-L2491 HydrophobicContact CZ3-CD1 4.22Å; W2479-L2491 HydrophobicContact CZ3-CD2 3.51Å; W2479-L2491 VanDerWaalsContact CZ3-CD2 3.41Å; W2479-L2491 HydrophobicContact CZ3-CG 3.7Å; W2479-L2493 HydrophobicContact CD2-CD1 3.83Å; W2479-L2493 HydrophobicContact CE3-CB 4Å; W2479-L2493 HydrophobicContact CE3-CD1 3.89Å; W2479-L2493 HydrophobicContact CE3-CG 4.44Å; W2479-L2493 HydrophobicContact CG-CD1 4.42Å; W2479-L2493 HydrophobicContact CH2-CB 4.3Å; W2479-L2493 HydrophobicContact CH2-CD1 4.22Å; W2479-L2493 HydrophobicContact CH2-CD2 4.45Å; W2479-L2493 HydrophobicContact CH2-CG 4.46Å; W2479-L2493 HydrophobicContact CZ2-CD1 4.22Å; W2479-L2493 HydrophobicContact CZ3-CB 3.77Å; W2479-L2493 HydrophobicContact CZ3-CD1 4.13Å; W2479-L2493 HydrophobicContact CZ3-CG 4.41Å; W2479-I2507 HydrophobicContact CH2-CD1 3.54Å; W2479-I2507 HydrophobicContact CH2-CG1 4.16Å; W2479-I2507 HydrophobicContact CZ3-CD1 3.38Å; W2479-I2507 VanDerWaalsContact CZ3-CD1 3.49Å; W2479-I2507 HydrophobicContact CZ3-CG1 3.91Å
2480	S	84.4	Confident	73.9	Confident	0.75 Å²	0.75	72 Å²	72	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	142.9	172.4	63.2	0	0	0	0	110.3	T2492 F2530	S2480-T2492 WeakPolarHBondContact CA-O 3.33Å; S2480-T2492 PolarHBondContact N-O 3.17Å; S2480-T2492 PolarHBondContact O-N 3.07Å; S2480-T2492 VanDerWaalsContact O-O 3.09Å; S2480-T2492 VanDerWaalsContact OG-CB 3.27Å; S2480-T2492 WeakPolarHBondContact OG-CB 3.45Å; S2480-T2492 PolarHBondContact OG-O 3.19Å; S2480-F2530 VanDerWaalsContact CA-CD1 3.49Å; S2480-F2530 VanDerWaalsContact CA-CE1 3.49Å; S2480-F2530 VanDerWaalsContact CB-CD1 3.49Å; S2480-F2530 VanDerWaalsContact CB-CE1 3.43Å; S2480-F2530 VanDerWaalsContact CB-CZ 3.47Å
2481	Y	76.5	Confident	73.6	Confident	75 Å²	75	72.8 Å²	72.8	29%	0.294	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.6	172.9	54.9	-90.3	0	0	0	108.9	M2436 L2483 F2530 F2532	M2436-Y2481 HydrophobicContact CE-CG 4.5Å; Y2481-L2483 HydrophobicContact CD2-CD1 4.12Å; Y2481-L2483 HydrophobicContact CE2-CD1 3.98Å; Y2481-F2530 HydrophobicContact CD1-CE1 4.18Å; Y2481-F2530 HydrophobicContact CE1-CD1 4.45Å; Y2481-F2530 HydrophobicContact CE1-CE1 4.19Å; Y2481-F2530 HydrophobicContact CG-CE1 4.37Å; Y2481-F2530 WeakPolarHBondContact O-CZ 3.46Å; Y2481-F2532 HydrophobicContact CD2-CB 4.39Å; Y2481-F2532 HydrophobicContact CE2-CB 4.02Å; Y2481-F2532 HydrophobicContact CE2-CG 4.38Å; Y2481-F2532 WeakPolarHBondContact O-CD2 3.07Å
2482	I	65.2	Low	73.6	Confident	5.25 Å²	5.25	65.2 Å²	65.2	3%	0.027	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	116	172.7	-60.8	169.5	0	0	0	107	Y2484 K2490 F2532 Y2549 F2555	I2482-Y2484 VanDerWaalsContact C-N 3.31Å; I2482-Y2484 HydrophobicContact CG2-CD2 4.24Å; I2482-Y2484 PolarHBondContact O-N 3.14Å; I2482-K2490 HydrophobicContact CB-CB 4.34Å; I2482-K2490 PolarHBondContact N-O 3.11Å; I2482-K2490 PolarHBondContact O-N 3.13Å; I2482-K2490 VanDerWaalsContact O-N 3.11Å; I2482-F2532 HydrophobicContact CG2-CE2 4.27Å; I2482-Y2549 HydrophobicContact CD1-CD2 4.42Å; I2482-Y2549 HydrophobicContact CD1-CE2 3.78Å; I2482-Y2549 HydrophobicContact CG1-CE2 4.35Å; I2482-Y2549 HydrophobicContact CG2-CD1 4.24Å; I2482-Y2549 HydrophobicContact CG2-CE1 3.85Å; I2482-Y2549 HydrophobicContact CG2-CE2 4.15Å; I2482-Y2549 WeakPolarHBondContact CG2-OH 3.37Å; I2482-F2555 HydrophobicContact CD1-CE2 4.28Å
2483	L	57.2	Low	73.6	Confident	76.25 Å²	76.25	62.9 Å²	62.9	40%	0.399	29%	0.293	S	S	.	.			trans	-67.5	116.1	168.1	-82.2	119.5	0	0	0	109	Y2481 F2532	Y2481-L2483 HydrophobicContact CD2-CD1 4.12Å; Y2481-L2483 HydrophobicContact CE2-CD1 3.98Å; L2483-F2532 HydrophobicContact CB-CZ 4.39Å; L2483-F2532 HydrophobicContact CD1-CD1 4.32Å; L2483-F2532 HydrophobicContact CD1-CE1 4.13Å
2484	Y	49.2	Very low	73.7	Confident	124 Å²	124	57.2 Å²	57.2	49%	0.486	27%	0.272	S	S	.	.			trans	-126.7	103.1	175.1	-153.8	-83.6	0	0	0	109.2	I2482 D2488 K2490	I2482-Y2484 VanDerWaalsContact C-N 3.31Å; I2482-Y2484 HydrophobicContact CG2-CD2 4.24Å; I2482-Y2484 PolarHBondContact O-N 3.14Å; Y2484-D2488 PolarHBondContact N-O 2.95Å; Y2484-K2490 VanDerWaalsContact CB-NZ 3.31Å; Y2484-K2490 VanDerWaalsContact CD1-NZ 3.25Å; Y2484-K2490 HydrophobicContact CG-CD 4.2Å; Y2484-K2490 VanDerWaalsContact CG-NZ 3.27Å
2485	K	45.1	Very low	73.7	Confident	180 Å²	180	57.2 Å²	57.2	78%	0.783	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	89.3	-175.9	-67	-173.8	173.6	-174.7	0	113.1	S2487 D2488	K2485-S2487 WeakPolarHBondContact O-CA 3.4Å; K2485-S2487 PolarHBondContact O-N 3.3Å; K2485-S2487 PolarHBondContact O-OG 2.96Å; K2485-D2488 PolarHBondContact O-N 3.26Å
2486	M	40.7	Very low	73.8	Confident	173.75 Å²	173.75	55.2 Å²	55.2	86%	0.856	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	21.9	-29.4	178.8	-74.1	-66.1	-147.2	0	0	119
2487	S	43.4	Very low	73.8	Confident	114 Å²	114	54.3 Å²	54.3	80%	0.797	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-18.1	-174.4	57.9	0	0	0	0	116.5	K2485	K2485-S2487 WeakPolarHBondContact O-CA 3.4Å; K2485-S2487 PolarHBondContact O-N 3.3Å; K2485-S2487 PolarHBondContact O-OG 2.96Å
2488	D	51.6	Low	73.6	Confident	84.25 Å²	84.25	56.8 Å²	56.8	45%	0.451	27%	0.269	S	S	.	.			trans	-121.4	75.6	-169.2	-162.9	18.2	0	0	0	111.9	Y2484 K2485 K2490	Y2484-D2488 PolarHBondContact N-O 2.95Å; K2485-D2488 PolarHBondContact O-N 3.26Å; D2488-K2490 WeakPolarHBondContact O-CE 3.27Å; D2488-K2490 PolarHBondContact O-N 3.08Å; D2488-K2490 PolarHBondContact O-NZ 3.21Å; D2488-K2490 WeakPolarHBondContact OD1-CE 3.33Å; D2488-K2490 IonicContact OD1-NZ 3.65Å; D2488-K2490 WeakPolarHBondContact OD2-CE 3.24Å; D2488-K2490 IonicContact OD2-NZ 3.53Å; D2488-K2490 PolarHBondContact OD2-NZ 3.26Å; D2488-K2490 VanDerWaalsContact OD2-NZ 3.1Å
2489	R	59.9	Low	73.5	Confident	167.25 Å²	167.25	54.9 Å²	54.9	63%	0.631	26%	0.262	S	S	*	.			trans	-67.2	112.7	176	-71.7	-175	179	-175.2	-0.7	110	L2491	R2489-L2491 PolarHBondContact O-N 3.08Å
2490	K	69.5	Low	73.4	Confident	34.25 Å²	34.25	58.3 Å²	58.3	15%	0.149	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	106.5	-178.1	-74.5	156.1	-171.6	161	0	110.8	I2482 Y2484 D2488 T2492 R2506	I2482-K2490 HydrophobicContact CB-CB 4.34Å; I2482-K2490 PolarHBondContact N-O 3.11Å; I2482-K2490 PolarHBondContact O-N 3.13Å; I2482-K2490 VanDerWaalsContact O-N 3.11Å; Y2484-K2490 VanDerWaalsContact CB-NZ 3.31Å; Y2484-K2490 VanDerWaalsContact CD1-NZ 3.25Å; Y2484-K2490 HydrophobicContact CG-CD 4.2Å; Y2484-K2490 VanDerWaalsContact CG-NZ 3.27Å; D2488-K2490 WeakPolarHBondContact O-CE 3.27Å; D2488-K2490 PolarHBondContact O-N 3.08Å; D2488-K2490 PolarHBondContact O-NZ 3.21Å; D2488-K2490 WeakPolarHBondContact OD1-CE 3.33Å; D2488-K2490 IonicContact OD1-NZ 3.65Å; D2488-K2490 WeakPolarHBondContact OD2-CE 3.24Å; D2488-K2490 IonicContact OD2-NZ 3.53Å; D2488-K2490 PolarHBondContact OD2-NZ 3.26Å; D2488-K2490 VanDerWaalsContact OD2-NZ 3.1Å; K2490-T2492 PolarHBondContact O-N 3.05Å; K2490-T2492 PolarHBondContact O-OG1 3.17Å; K2490-R2506 VanDerWaalsContact CD-CZ 3.49Å; K2490-R2506 VanDerWaalsContact CD-NH2 3.26Å; K2490-R2506 VanDerWaalsContact CE-NH2 3.26Å
2491	L	82.6	Confident	73.7	Confident	21 Å²	21	59.9 Å²	59.9	11%	0.11	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	130.8	175.5	-166	70.7	0	0	0	111	M2436 F2438 W2479 R2489 I2507	M2436-L2491 HydrophobicContact SD-CD1 4.04Å; F2438-L2491 HydrophobicContact CB-CD2 4.29Å; F2438-L2491 HydrophobicContact CD2-CD2 3.33Å; F2438-L2491 HydrophobicContact CE2-CD2 3.81Å; F2438-L2491 HydrophobicContact CG-CD2 3.93Å; W2479-L2491 HydrophobicContact CB-CD1 4.34Å; W2479-L2491 HydrophobicContact CD2-CD1 4.31Å; W2479-L2491 HydrophobicContact CD2-CD2 4.3Å; W2479-L2491 HydrophobicContact CD2-CG 4.49Å; W2479-L2491 HydrophobicContact CE3-CD1 3.84Å; W2479-L2491 HydrophobicContact CE3-CD2 3.77Å; W2479-L2491 HydrophobicContact CE3-CG 3.63Å; W2479-L2491 HydrophobicContact CG-CD1 4.5Å; W2479-L2491 HydrophobicContact CH2-CD2 4.08Å; W2479-L2491 HydrophobicContact CZ3-CD1 4.22Å; W2479-L2491 HydrophobicContact CZ3-CD2 3.51Å; W2479-L2491 VanDerWaalsContact CZ3-CD2 3.41Å; W2479-L2491 HydrophobicContact CZ3-CG 3.7Å; R2489-L2491 PolarHBondContact O-N 3.08Å; L2491-I2507 PolarHBondContact O-N 3.01Å; L2491-I2507 VanDerWaalsContact O-N 3.13Å
2492	T	87.8	Confident	74.4	Confident	1.5 Å²	1.5	56.4 Å²	56.4	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	127.8	179.9	-51.6	0	0	0	0	108.8	S2480 K2490 L2504 Y2505 R2506	S2480-T2492 WeakPolarHBondContact CA-O 3.33Å; S2480-T2492 PolarHBondContact N-O 3.17Å; S2480-T2492 PolarHBondContact O-N 3.07Å; S2480-T2492 VanDerWaalsContact O-O 3.09Å; S2480-T2492 VanDerWaalsContact OG-CB 3.27Å; S2480-T2492 WeakPolarHBondContact OG-CB 3.45Å; S2480-T2492 PolarHBondContact OG-O 3.19Å; K2490-T2492 PolarHBondContact O-N 3.05Å; K2490-T2492 PolarHBondContact O-OG1 3.17Å; T2492-L2504 HydrophobicContact CG2-CB 4.06Å; T2492-L2504 HydrophobicContact CG2-CD2 4.41Å; T2492-Y2505 CarbonylContact C-O 3.57Å; T2492-Y2505 WeakPolarHBondContact CA-O 3.39Å; T2492-Y2505 WeakPolarHBondContact CG2-O 3.43Å; T2492-R2506 HydrophobicContact CG2-CB 4.39Å
2493	L	91.8	Very high	75.7	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	131.6	175.1	-176.4	69.4	0	0	0	110	A2440 V2448 I2450 L2477 W2479 V2495 L2504 Y2505 I2507	A2440-L2493 HydrophobicContact CB-CD1 3.72Å; A2440-L2493 HydrophobicContact CB-CD2 3.89Å; A2440-L2493 HydrophobicContact CB-CG 4.47Å; V2448-L2493 HydrophobicContact CG1-CD2 3.68Å; I2450-L2493 HydrophobicContact CD1-CD2 3.8Å; L2477-L2493 HydrophobicContact CB-CD1 4.49Å; L2477-L2493 HydrophobicContact CD2-CD1 4.41Å; L2477-L2493 HydrophobicContact CD2-CD2 4.21Å; L2477-L2493 HydrophobicContact CD2-CG 4.42Å; W2479-L2493 HydrophobicContact CD2-CD1 3.83Å; W2479-L2493 HydrophobicContact CE3-CB 4Å; W2479-L2493 HydrophobicContact CE3-CD1 3.89Å; W2479-L2493 HydrophobicContact CE3-CG 4.44Å; W2479-L2493 HydrophobicContact CG-CD1 4.42Å; W2479-L2493 HydrophobicContact CH2-CB 4.3Å; W2479-L2493 HydrophobicContact CH2-CD1 4.22Å; W2479-L2493 HydrophobicContact CH2-CD2 4.45Å; W2479-L2493 HydrophobicContact CH2-CG 4.46Å; W2479-L2493 HydrophobicContact CZ2-CD1 4.22Å; W2479-L2493 HydrophobicContact CZ3-CB 3.77Å; W2479-L2493 HydrophobicContact CZ3-CD1 4.13Å; W2479-L2493 HydrophobicContact CZ3-CG 4.41Å; L2493-V2495 HydrophobicContact CD2-CG2 3.94Å; L2493-V2495 HydrophobicContact CG-CG2 4.1Å; L2493-L2504 CarbonylContact O-C 3.52Å; L2493-L2504 WeakPolarHBondContact O-CA 3.45Å; L2493-Y2505 PolarHBondContact N-O 3.02Å; L2493-Y2505 PolarHBondContact O-N 3Å; L2493-I2507 HydrophobicContact CB-CD1 4.1Å
2494	L	92.5	Very high	77.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	124.4	170	-52.4	177.4	0	0	0	108.7	L2477 K2478 I2502 L2504 L2528 F2530 I2535	L2477-L2494 WeakPolarHBondContact CA-O 3.4Å; K2478-L2494 HydrophobicContact CB-CB 4.44Å; K2478-L2494 HydrophobicContact CB-CD1 4.42Å; K2478-L2494 PolarHBondContact N-O 3.28Å; K2478-L2494 VanDerWaalsContact N-O 3.12Å; K2478-L2494 WeakPolarHBondContact O-CA 3.47Å; K2478-L2494 VanDerWaalsContact O-CB 3.28Å; K2478-L2494 WeakPolarHBondContact O-CB 3.39Å; K2478-L2494 WeakPolarHBondContact O-CG 3.43Å; K2478-L2494 PolarHBondContact O-N 3.16Å; L2494-I2502 HydrophobicContact CB-CG2 4.44Å; L2494-I2502 HydrophobicContact CD2-CG2 4.26Å; L2494-L2504 HydrophobicContact CD2-CB 4.46Å; L2494-L2504 HydrophobicContact CD2-CD1 4.04Å; L2494-L2504 HydrophobicContact CD2-CD2 3.86Å; L2494-L2504 HydrophobicContact CD2-CG 3.58Å; L2494-L2504 VanDerWaalsContact CD2-CG 3.49Å; L2494-L2528 HydrophobicContact CB-CD1 4.37Å; L2494-L2528 HydrophobicContact CB-CD2 3.69Å; L2494-L2528 HydrophobicContact CD1-CD2 3.78Å; L2494-L2528 HydrophobicContact CG-CD2 4.4Å; L2494-F2530 HydrophobicContact CD1-CB 3.89Å; L2494-F2530 HydrophobicContact CD1-CD2 4.22Å; L2494-F2530 HydrophobicContact CD1-CG 4.3Å; L2494-I2535 HydrophobicContact CD1-CD1 4.09Å; L2494-I2535 HydrophobicContact CD1-CG1 3.91Å; L2494-I2535 HydrophobicContact CD1-CG2 4.23Å; L2494-I2535 HydrophobicContact CD2-CD1 3.8Å; L2494-I2535 HydrophobicContact CD2-CG1 4.29Å
2495	V	93.4	Very high	79.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	112.5	178.6	-176.1	0	0	0	0	108.8	V2448 I2474 L2477 L2493 I2502 R2503 Y2505	V2448-V2495 HydrophobicContact CG2-CG1 4.38Å; V2448-V2495 HydrophobicContact CG2-CG2 4.2Å; I2474-V2495 HydrophobicContact CD1-CG1 4.3Å; I2474-V2495 HydrophobicContact CG1-CG1 4.12Å; I2474-V2495 HydrophobicContact CG2-CG1 4.04Å; L2477-V2495 HydrophobicContact CD2-CB 4.1Å; L2477-V2495 HydrophobicContact CD2-CG1 4.04Å; L2477-V2495 HydrophobicContact CD2-CG2 3.73Å; L2493-V2495 HydrophobicContact CD2-CG2 3.94Å; L2493-V2495 HydrophobicContact CG-CG2 4.1Å; V2495-I2502 CarbonylContact O-C 3.53Å; V2495-I2502 WeakPolarHBondContact O-CA 3.46Å; V2495-R2503 HydrophobicContact CB-CB 4.39Å; V2495-R2503 PolarHBondContact N-O 3.24Å; V2495-R2503 PolarHBondContact O-N 3.11Å; V2495-Y2505 HydrophobicContact CB-CD2 4.46Å; V2495-Y2505 HydrophobicContact CB-CE2 4.42Å; V2495-Y2505 HydrophobicContact CG2-CD2 3.74Å; V2495-Y2505 HydrophobicContact CG2-CE2 4.02Å
2496	G	92.2	Very high	81.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	122	174.7	0	0	0	0	0	110.6	I2475 S2476 L2528	I2475-G2496 PolarHBondContact N-O 3.18Å; S2476-G2496 PolarHBondContact N-O 2.99Å; S2476-G2496 VanDerWaalsContact N-O 3.16Å; S2476-G2496 PolarHBondContact O-N 3.01Å; G2496-L2528 VanDerWaalsContact CA-CD1 3.45Å; G2496-L2528 VanDerWaalsContact N-CD1 3.27Å
2497	S	91.5	Very high	83.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	164.1	-175.5	36.2	0	0	0	0	112.6	S2470 W2473 D2499 Q2500 L2501 R2503 I2525	S2470-S2497 VanDerWaalsContact CB-CB 3.46Å; S2470-S2497 WeakPolarHBondContact CB-OG 3.41Å; W2473-S2497 CarbonylContact O-C 3.5Å; W2473-S2497 VanDerWaalsContact O-CA 3.3Å; W2473-S2497 WeakPolarHBondContact O-CA 3.3Å; W2473-S2497 VanDerWaalsContact O-CB 3.32Å; W2473-S2497 WeakPolarHBondContact O-CB 3.44Å; S2497-D2499 VanDerWaalsContact CB-OD1 3.27Å; S2497-D2499 WeakPolarHBondContact CB-OD1 3.23Å; S2497-D2499 PolarHBondContact O-N 3.01Å; S2497-D2499 VanDerWaalsContact O-N 3.13Å; S2497-D2499 PolarHBondContact OG-OD1 3.07Å; S2497-Q2500 PolarHBondContact O-N 3.06Å; S2497-L2501 PolarHBondContact N-O 3.01Å; S2497-L2501 PolarHBondContact OG-O 3.09Å; S2497-R2503 PolarHBondContact OG-NH1 3.07Å; S2497-R2503 VanDerWaalsContact OG-NH1 3.13Å; S2497-I2525 PolarHBondContact O-N 3.04Å
2498	N	89.5	Confident	84.9	Confident	60.25 Å²	60.25	36.5 Å²	36.5	32%	0.322	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-15.6	178.1	-163.7	55.4	0	0	0	112.9	D2472 W2473 I2475 Q2500	D2472-N2498 HydrophobicContact CB-CB 4.25Å; D2472-N2498 WeakPolarHBondContact OD2-CB 3.29Å; D2472-N2498 PolarHBondContact OD2-ND2 3Å; W2473-N2498 HydrophobicContact CB-CB 4.49Å; W2473-N2498 PolarHBondContact O-N 3.16Å; I2475-N2498 HydrophobicContact CD1-CB 3.87Å; I2475-N2498 HydrophobicContact CG1-CB 4.31Å; N2498-Q2500 PolarHBondContact O-N 3.09Å; N2498-Q2500 VanDerWaalsContact O-N 3.12Å
2499	D	89	Confident	85.8	Confident	29.25 Å²	29.25	37.2 Å²	37.2	16%	0.156	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	18.8	176.1	73.2	-9.4	0	0	0	114.8	K2471 D2472 S2497 L2501 R2503	K2471-D2499 HydrophobicContact CB-CB 4.24Å; K2471-D2499 VanDerWaalsContact CB-OD2 3.27Å; K2471-D2499 WeakPolarHBondContact CB-OD2 3.39Å; K2471-D2499 PolarHBondContact N-OD2 3.21Å; K2471-D2499 VanDerWaalsContact N-OD2 3.07Å; D2472-D2499 HydrophobicContact CB-CB 4.03Å; S2497-D2499 VanDerWaalsContact CB-OD1 3.27Å; S2497-D2499 WeakPolarHBondContact CB-OD1 3.23Å; S2497-D2499 PolarHBondContact O-N 3.01Å; S2497-D2499 VanDerWaalsContact O-N 3.13Å; S2497-D2499 PolarHBondContact OG-OD1 3.07Å; D2499-L2501 VanDerWaalsContact C-N 3.25Å; D2499-L2501 WeakPolarHBondContact O-CG 3.2Å; D2499-L2501 PolarHBondContact O-N 3.23Å; D2499-L2501 WeakPolarHBondContact OD1-CB 3.32Å; D2499-L2501 PolarHBondContact OD1-N 3.23Å; D2499-R2503 VanDerWaalsContact CG-NH1 3.34Å; D2499-R2503 IonicContact OD1-CZ 3.37Å; D2499-R2503 IonicContact OD1-NH1 2.85Å; D2499-R2503 PolarHBondContact OD1-NH1 3.07Å; D2499-R2503 IonicContact OD1-NH2 3.21Å; D2499-R2503 IonicContact OD2-CZ 3Å; D2499-R2503 VanDerWaalsContact OD2-CZ 3.26Å; D2499-R2503 IonicContact OD2-NH1 2.88Å; D2499-R2503 PolarHBondContact OD2-NH1 2.97Å; D2499-R2503 IonicContact OD2-NH2 3.34Å; D2499-R2503 PolarHBondContact OD2-NH2 2.98Å
2500	Q	87.5	Confident	86.3	Confident	77.75 Å²	77.75	38.5 Å²	38.5	36%	0.363	19%	0.185	S	C	.	.	S	Bend	trans	67.6	15.4	174.6	-47.9	167.4	0.1	0	0	114.8	S2497 N2498 S2520 Q2522	S2497-Q2500 PolarHBondContact O-N 3.06Å; N2498-Q2500 PolarHBondContact O-N 3.09Å; N2498-Q2500 VanDerWaalsContact O-N 3.12Å; Q2500-S2520 WeakPolarHBondContact CB-O 3.4Å; Q2500-S2520 PolarHBondContact O-N 3.06Å; Q2500-S2520 VanDerWaalsContact O-N 3.11Å; Q2500-S2520 PolarHBondContact O-OG 2.98Å; Q2500-S2520 VanDerWaalsContact O-OG 3.1Å; Q2500-Q2522 VanDerWaalsContact CD-C 3.46Å; Q2500-Q2522 VanDerWaalsContact NE2-C 3.31Å; Q2500-Q2522 PolarHBondContact NE2-O 2.99Å
2501	L	91.1	Very high	86.8	Confident	34.75 Å²	34.75	44.8 Å²	44.8	18%	0.182	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.8	-174.5	-61.4	175.2	0	0	0	112.6	S2497 D2499 T2517 L2518 V2519 I2525	S2497-L2501 PolarHBondContact N-O 3.01Å; S2497-L2501 PolarHBondContact OG-O 3.09Å; D2499-L2501 VanDerWaalsContact C-N 3.25Å; D2499-L2501 WeakPolarHBondContact O-CG 3.2Å; D2499-L2501 PolarHBondContact O-N 3.23Å; D2499-L2501 WeakPolarHBondContact OD1-CB 3.32Å; D2499-L2501 PolarHBondContact OD1-N 3.23Å; L2501-T2517 HydrophobicContact CB-CG2 4.13Å; L2501-T2517 HydrophobicContact CD1-CG2 4.22Å; L2501-T2517 HydrophobicContact CD2-CG2 4.05Å; L2501-T2517 HydrophobicContact CG-CG2 4.36Å; L2501-L2518 WeakPolarHBondContact CA-O 3.41Å; L2501-V2519 HydrophobicContact CD2-CB 4.11Å; L2501-V2519 HydrophobicContact CD2-CG1 4.13Å; L2501-V2519 HydrophobicContact CD2-CG2 3.69Å; L2501-I2525 WeakPolarHBondContact O-CD1 3.4Å
2502	I	91.2	Very high	87	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	122	166.4	-49.5	169	0	0	0	108.2	L2494 V2495 L2504 T2517 L2518 I2525 L2528 I2535 W2547	L2494-I2502 HydrophobicContact CB-CG2 4.44Å; L2494-I2502 HydrophobicContact CD2-CG2 4.26Å; V2495-I2502 CarbonylContact O-C 3.53Å; V2495-I2502 WeakPolarHBondContact O-CA 3.46Å; I2502-L2504 HydrophobicContact CG2-CD1 4.23Å; I2502-T2517 CarbonylContact O-C 3.56Å; I2502-T2517 WeakPolarHBondContact O-CA 3.25Å; I2502-L2518 HydrophobicContact CB-CB 4.09Å; I2502-L2518 HydrophobicContact CB-CD1 4.31Å; I2502-L2518 HydrophobicContact CB-CG 4.21Å; I2502-L2518 HydrophobicContact CD1-CB 4.32Å; I2502-L2518 HydrophobicContact CD1-CD1 4.3Å; I2502-L2518 HydrophobicContact CG1-CB 4.42Å; I2502-L2518 HydrophobicContact CG2-CD1 4.44Å; I2502-L2518 PolarHBondContact N-O 2.9Å; I2502-L2518 PolarHBondContact O-N 3.02Å; I2502-I2525 HydrophobicContact CB-CD1 4.43Å; I2502-I2525 HydrophobicContact CD1-CD1 4.4Å; I2502-I2525 HydrophobicContact CG1-CD1 3.51Å; I2502-I2525 VanDerWaalsContact CG1-CD1 3.42Å; I2502-I2525 HydrophobicContact CG1-CG1 4.3Å; I2502-L2528 HydrophobicContact CB-CD1 4.29Å; I2502-L2528 HydrophobicContact CD1-CD1 3.8Å; I2502-L2528 HydrophobicContact CD1-CD2 3.77Å; I2502-L2528 HydrophobicContact CG1-CD1 4.13Å; I2502-L2528 HydrophobicContact CG1-CD2 4.01Å; I2502-L2528 HydrophobicContact CG2-CD1 3.98Å; I2502-L2528 HydrophobicContact CG2-CD2 4.37Å; I2502-I2535 HydrophobicContact CD1-CG2 4.39Å; I2502-W2547 HydrophobicContact CD1-CE3 4.3Å; I2502-W2547 HydrophobicContact CD1-CH2 3.36Å; I2502-W2547 HydrophobicContact CD1-CZ2 4.25Å; I2502-W2547 HydrophobicContact CD1-CZ3 3.49Å; I2502-W2547 VanDerWaalsContact CD1-CZ3 3.43Å
2503	R	92.8	Very high	87	Confident	20.5 Å²	20.5	55.9 Å²	55.9	8%	0.077	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.5	178.4	-69	172.2	-180	88.8	-6.5	111	A2469 V2495 S2497 D2499 Y2505 L2514 T2517	A2469-R2503 WeakPolarHBondContact O-CD 3.2Å; A2469-R2503 PolarHBondContact O-NE 3.21Å; V2495-R2503 HydrophobicContact CB-CB 4.39Å; V2495-R2503 PolarHBondContact N-O 3.24Å; V2495-R2503 PolarHBondContact O-N 3.11Å; S2497-R2503 PolarHBondContact OG-NH1 3.07Å; S2497-R2503 VanDerWaalsContact OG-NH1 3.13Å; D2499-R2503 VanDerWaalsContact CG-NH1 3.34Å; D2499-R2503 IonicContact OD1-CZ 3.37Å; D2499-R2503 IonicContact OD1-NH1 2.85Å; D2499-R2503 PolarHBondContact OD1-NH1 3.07Å; D2499-R2503 IonicContact OD1-NH2 3.21Å; D2499-R2503 IonicContact OD2-CZ 3Å; D2499-R2503 VanDerWaalsContact OD2-CZ 3.26Å; D2499-R2503 IonicContact OD2-NH1 2.88Å; D2499-R2503 PolarHBondContact OD2-NH1 2.97Å; D2499-R2503 IonicContact OD2-NH2 3.34Å; D2499-R2503 PolarHBondContact OD2-NH2 2.98Å; R2503-Y2505 HydrophobicContact CB-CD2 4.21Å; R2503-Y2505 HydrophobicContact CB-CE2 3.66Å; R2503-L2514 HydrophobicContact CB-CD1 3.87Å; R2503-L2514 HydrophobicContact CG-CD1 4.27Å; R2503-T2517 HydrophobicContact CG-CG2 4.11Å
2504	L	91.8	Very high	86.8	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	101.3	-178.9	-73.2	83.3	0	0	0	110.1	T2492 L2493 L2494 I2502 R2506 K2515 Q2516 L2518 I2535 F2555	T2492-L2504 HydrophobicContact CG2-CB 4.06Å; T2492-L2504 HydrophobicContact CG2-CD2 4.41Å; L2493-L2504 CarbonylContact O-C 3.52Å; L2493-L2504 WeakPolarHBondContact O-CA 3.45Å; L2494-L2504 HydrophobicContact CD2-CB 4.46Å; L2494-L2504 HydrophobicContact CD2-CD1 4.04Å; L2494-L2504 HydrophobicContact CD2-CD2 3.86Å; L2494-L2504 HydrophobicContact CD2-CG 3.58Å; L2494-L2504 VanDerWaalsContact CD2-CG 3.49Å; I2502-L2504 HydrophobicContact CG2-CD1 4.23Å; L2504-R2506 PolarHBondContact O-N 3.4Å; L2504-K2515 HydrophobicContact CB-CB 4.47Å; L2504-K2515 WeakPolarHBondContact O-CB 3.35Å; L2504-K2515 PolarHBondContact O-N 3.03Å; L2504-Q2516 HydrophobicContact CB-CB 4.37Å; L2504-Q2516 WeakPolarHBondContact CB-O 3.4Å; L2504-Q2516 HydrophobicContact CD1-CB 4.29Å; L2504-Q2516 WeakPolarHBondContact CD1-O 3.29Å; L2504-Q2516 PolarHBondContact N-O 3.06Å; L2504-L2518 HydrophobicContact CD1-CD1 3.83Å; L2504-L2518 HydrophobicContact CD1-CD2 3.96Å; L2504-L2518 HydrophobicContact CD1-CG 3.8Å; L2504-I2535 HydrophobicContact CD2-CD1 4.14Å; L2504-F2555 HydrophobicContact CD2-CD2 3.4Å; L2504-F2555 VanDerWaalsContact CD2-CD2 3.42Å; L2504-F2555 HydrophobicContact CD2-CE2 3.55Å; L2504-F2555 VanDerWaalsContact CD2-CE2 3.47Å; L2504-F2555 HydrophobicContact CD2-CG 4.47Å
2505	Y	90.2	Very high	86.5	Confident	18.75 Å²	18.75	62.7 Å²	62.7	7%	0.074	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	109.1	176.5	-71.5	-85.3	0	0	0	110.3	I2466 A2469 T2492 L2493 V2495 R2503 I2507 Y2512 L2514	I2466-Y2505 HydrophobicContact CD1-CD1 4Å; I2466-Y2505 HydrophobicContact CD1-CD2 4.47Å; I2466-Y2505 HydrophobicContact CD1-CE1 4.44Å; I2466-Y2505 HydrophobicContact CD1-CG 3.99Å; I2466-Y2505 HydrophobicContact CG2-CD1 4.33Å; I2466-Y2505 HydrophobicContact CG2-CE1 3.9Å; A2469-Y2505 WeakPolarHBondContact CA-OH 3.44Å; A2469-Y2505 HydrophobicContact CB-CE2 4.34Å; A2469-Y2505 PolarHBondContact O-OH 2.97Å; T2492-Y2505 CarbonylContact C-O 3.57Å; T2492-Y2505 WeakPolarHBondContact CA-O 3.39Å; T2492-Y2505 WeakPolarHBondContact CG2-O 3.43Å; L2493-Y2505 PolarHBondContact N-O 3.02Å; L2493-Y2505 PolarHBondContact O-N 3Å; V2495-Y2505 HydrophobicContact CB-CD2 4.46Å; V2495-Y2505 HydrophobicContact CB-CE2 4.42Å; V2495-Y2505 HydrophobicContact CG2-CD2 3.74Å; V2495-Y2505 HydrophobicContact CG2-CE2 4.02Å; R2503-Y2505 HydrophobicContact CB-CD2 4.21Å; R2503-Y2505 HydrophobicContact CB-CE2 3.66Å; Y2505-I2507 PolarHBondContact O-N 2.97Å; Y2505-Y2512 HydrophobicContact CD1-CD2 4.26Å; Y2505-Y2512 HydrophobicContact CE1-CD2 4.47Å; Y2505-L2514 HydrophobicContact CD1-CB 4.23Å; Y2505-L2514 HydrophobicContact CD1-CD1 4.34Å; Y2505-L2514 HydrophobicContact CD2-CD1 4.45Å; Y2505-L2514 HydrophobicContact CE1-CB 3.97Å; Y2505-L2514 HydrophobicContact CE1-CD1 4.12Å; Y2505-L2514 HydrophobicContact CE2-CD1 4.22Å
2506	R	86.3	Confident	86.2	Confident	77.75 Å²	77.75	64.3 Å²	64.3	29%	0.293	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	129.5	171.7	-178.9	174.6	174.8	-174.4	-4.4	109.2	K2490 T2492 L2504 Y2512 K2513 K2515	K2490-R2506 VanDerWaalsContact CD-CZ 3.49Å; K2490-R2506 VanDerWaalsContact CD-NH2 3.26Å; K2490-R2506 VanDerWaalsContact CE-NH2 3.26Å; T2492-R2506 HydrophobicContact CG2-CB 4.39Å; L2504-R2506 PolarHBondContact O-N 3.4Å; R2506-Y2512 CarbonylContact O-C 3.52Å; R2506-Y2512 VanDerWaalsContact O-CA 3.29Å; R2506-Y2512 WeakPolarHBondContact O-CA 3.43Å; R2506-K2513 PolarHBondContact N-O 3.03Å; R2506-K2513 PolarHBondContact O-N 3.09Å; R2506-K2515 HydrophobicContact CB-CB 4.4Å
2507	I	83.7	Confident	86.1	Confident	13 Å²	13	67.2 Å²	67.2	7%	0.067	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	137	-178.9	-61.1	-108.6	0	0	0	110	I2450 Y2464 W2479 L2491 L2493 Y2505	I2450-I2507 HydrophobicContact CD1-CD1 3.79Å; I2450-I2507 HydrophobicContact CD1-CG1 4.38Å; I2450-I2507 HydrophobicContact CG2-CD1 4.35Å; Y2464-I2507 HydrophobicContact CE1-CG2 4.31Å; Y2464-I2507 HydrophobicContact CE2-CD1 3.91Å; Y2464-I2507 HydrophobicContact CE2-CG1 4.48Å; Y2464-I2507 HydrophobicContact CE2-CG2 4.19Å; Y2464-I2507 VanDerWaalsContact OH-CD1 3.25Å; Y2464-I2507 WeakPolarHBondContact OH-CD1 3.29Å; Y2464-I2507 VanDerWaalsContact OH-CG1 3.28Å; Y2464-I2507 WeakPolarHBondContact OH-CG1 3.36Å; Y2464-I2507 WeakPolarHBondContact OH-CG2 3.28Å; W2479-I2507 HydrophobicContact CH2-CD1 3.54Å; W2479-I2507 HydrophobicContact CH2-CG1 4.16Å; W2479-I2507 HydrophobicContact CZ3-CD1 3.38Å; W2479-I2507 VanDerWaalsContact CZ3-CD1 3.49Å; W2479-I2507 HydrophobicContact CZ3-CG1 3.91Å; L2491-I2507 PolarHBondContact O-N 3.01Å; L2491-I2507 VanDerWaalsContact O-N 3.13Å; L2493-I2507 HydrophobicContact CB-CD1 4.1Å; Y2505-I2507 PolarHBondContact O-N 2.97Å
2508	K	76.8	Confident	85.9	Confident	125.75 Å²	125.75	67.6 Å²	67.6	55%	0.547	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	157.2	166	-64.3	-174.5	175.8	-173.3	0	108	Y2464 K2510 K2511	Y2464-K2508 PolarHBondContact OH-O 2.98Å; K2508-K2510 PolarHBondContact O-N 3.08Å; K2508-K2511 WeakPolarHBondContact CA-O 3.33Å; K2508-K2511 WeakPolarHBondContact CB-O 3.34Å; K2508-K2511 PolarHBondContact N-O 2.86Å; K2508-K2511 PolarHBondContact O-N 3.16Å; K2508-K2511 VanDerWaalsContact O-N 3.1Å; K2508-K2511 VanDerWaalsContact O-O 3.09Å
2509	S	69.8	Low	85.6	Confident	99.5 Å²	99.5	69.2 Å²	69.2	70%	0.696	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-20.2	-170.1	-52.9	0	0	0	0	116.9	Q2463 Y2464	Q2463-S2509 PolarHBondContact NE2-O 3.08Å; Y2464-S2509 PolarHBondContact OH-O 3.13Å
2510	K	71.1	Confident	84.9	Confident	194.5 Å²	194.5	68.2 Å²	68.2	85%	0.846	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.2	2.8	175.7	-65	-170	177.2	-174.9	0	115.3	Y2464 K2508	Y2464-K2510 WeakPolarHBondContact OH-CA 3.48Å; Y2464-K2510 PolarHBondContact OH-N 3.42Å; K2508-K2510 PolarHBondContact O-N 3.08Å
2511	K	80.6	Confident	83.9	Confident	165.5 Å²	165.5	67.8 Å²	67.8	72%	0.72	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.7	141.1	-176.8	-66.7	-168.9	178.6	-173.4	0	111.1	Y2464 K2508	Y2464-K2511 PolarHBondContact OH-N 2.82Å; Y2464-K2511 VanDerWaalsContact OH-N 3.13Å; K2508-K2511 WeakPolarHBondContact CA-O 3.33Å; K2508-K2511 WeakPolarHBondContact CB-O 3.34Å; K2508-K2511 PolarHBondContact N-O 2.86Å; K2508-K2511 PolarHBondContact O-N 3.16Å; K2508-K2511 VanDerWaalsContact O-N 3.1Å; K2508-K2511 VanDerWaalsContact O-O 3.09Å
2512	Y	85.9	Confident	82.9	Confident	96 Å²	96	73.1 Å²	73.1	38%	0.376	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	156	165.6	60.2	-94.1	0	0	0	110.8	Y2464 I2465 I2466 Y2505 R2506	Y2464-Y2512 HydrophobicContact CD1-CD1 4.14Å; Y2464-Y2512 AromaticContact CD2-CD1 3.62Å; Y2464-Y2512 HydrophobicContact CD2-CD1 3.62Å; Y2464-Y2512 VanDerWaalsContact CD2-CD1 3.47Å; Y2464-Y2512 AromaticContact CD2-CE1 3.88Å; Y2464-Y2512 HydrophobicContact CD2-CE1 4.11Å; Y2464-Y2512 HydrophobicContact CD2-CG 4.47Å; Y2464-Y2512 AromaticContact CE2-CD1 3.92Å; Y2464-Y2512 HydrophobicContact CE2-CD1 4.1Å; Y2464-Y2512 AromaticContact CG-CD1 3.89Å; Y2464-Y2512 HydrophobicContact CG-CD1 4.09Å; Y2464-Y2512 HydrophobicContact CG-CE1 4.34Å; I2465-Y2512 PolarHBondContact O-OH 3.46Å; I2466-Y2512 HydrophobicContact CB-CE2 4.41Å; I2466-Y2512 HydrophobicContact CD1-CD1 4.44Å; I2466-Y2512 HydrophobicContact CD1-CD2 4.22Å; I2466-Y2512 HydrophobicContact CD1-CG 4.18Å; I2466-Y2512 HydrophobicContact CG1-CD1 4.04Å; I2466-Y2512 HydrophobicContact CG1-CD2 4.15Å; I2466-Y2512 HydrophobicContact CG1-CE1 4Å; I2466-Y2512 HydrophobicContact CG1-CE2 4.11Å; I2466-Y2512 HydrophobicContact CG1-CG 4.11Å; I2466-Y2512 HydrophobicContact CG2-CD2 4.36Å; I2466-Y2512 HydrophobicContact CG2-CE2 3.92Å; Y2505-Y2512 HydrophobicContact CD1-CD2 4.26Å; Y2505-Y2512 HydrophobicContact CE1-CD2 4.47Å; R2506-Y2512 CarbonylContact O-C 3.52Å; R2506-Y2512 VanDerWaalsContact O-CA 3.29Å; R2506-Y2512 WeakPolarHBondContact O-CA 3.43Å
2513	K	87.6	Confident	82.3	Confident	160.5 Å²	160.5	73.8 Å²	73.8	70%	0.698	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.6	130.9	170.5	-178.7	171.9	179.7	175	0	110.2	R2506 K2515	R2506-K2513 PolarHBondContact N-O 3.03Å; R2506-K2513 PolarHBondContact O-N 3.09Å; K2513-K2515 PolarHBondContact O-N 3.14Å
2514	L	88.1	Confident	81.7	Confident	72.25 Å²	72.25	73.2 Å²	73.2	38%	0.378	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	118.7	167.6	-178.3	64.3	0	0	0	108.8	R2503 Y2505 Q2516	R2503-L2514 HydrophobicContact CB-CD1 3.87Å; R2503-L2514 HydrophobicContact CG-CD1 4.27Å; Y2505-L2514 HydrophobicContact CD1-CB 4.23Å; Y2505-L2514 HydrophobicContact CD1-CD1 4.34Å; Y2505-L2514 HydrophobicContact CD2-CD1 4.45Å; Y2505-L2514 HydrophobicContact CE1-CB 3.97Å; Y2505-L2514 HydrophobicContact CE1-CD1 4.12Å; Y2505-L2514 HydrophobicContact CE2-CD1 4.22Å; L2514-Q2516 WeakPolarHBondContact CD1-O 3.38Å
2515	K	85.6	Confident	81.5	Confident	70 Å²	70	73.2 Å²	73.2	30%	0.304	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-46.5	-177.7	-176.1	-169.9	173.3	-169.5	0	111.5	L2504 R2506 K2513 Y2549 G2553	L2504-K2515 HydrophobicContact CB-CB 4.47Å; L2504-K2515 WeakPolarHBondContact O-CB 3.35Å; L2504-K2515 PolarHBondContact O-N 3.03Å; R2506-K2515 HydrophobicContact CB-CB 4.4Å; K2513-K2515 PolarHBondContact O-N 3.14Å; K2515-Y2549 PolarHBondContact NZ-OH 3Å; K2515-G2553 VanDerWaalsContact CE-O 3.23Å; K2515-G2553 WeakPolarHBondContact CE-O 3.32Å; K2515-G2553 PolarHBondContact NZ-O 2.92Å
2516	Q	87.4	Confident	81.3	Confident	35.25 Å²	35.25	77.7 Å²	77.7	17%	0.165	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	149.2	-173	-169.9	174.8	2.8	0	0	109.2	L2504 L2514 L2518 F2555	L2504-Q2516 HydrophobicContact CB-CB 4.37Å; L2504-Q2516 WeakPolarHBondContact CB-O 3.4Å; L2504-Q2516 HydrophobicContact CD1-CB 4.29Å; L2504-Q2516 WeakPolarHBondContact CD1-O 3.29Å; L2504-Q2516 PolarHBondContact N-O 3.06Å; L2514-Q2516 WeakPolarHBondContact CD1-O 3.38Å; Q2516-L2518 HydrophobicContact CG-CD2 3.92Å; Q2516-L2518 VanDerWaalsContact NE2-CD2 3.3Å; Q2516-F2555 PolarHBondContact NE2-O 3.03Å
2517	T	89.6	Confident	81.3	Confident	60.5 Å²	60.5	74.5 Å²	74.5	37%	0.371	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.2	167.2	-56.2	0	0	0	0	107.5	L2501 I2502 R2503	L2501-T2517 HydrophobicContact CB-CG2 4.13Å; L2501-T2517 HydrophobicContact CD1-CG2 4.22Å; L2501-T2517 HydrophobicContact CD2-CG2 4.05Å; L2501-T2517 HydrophobicContact CG-CG2 4.36Å; I2502-T2517 CarbonylContact O-C 3.56Å; I2502-T2517 WeakPolarHBondContact O-CA 3.25Å; R2503-T2517 HydrophobicContact CG-CG2 4.11Å
2518	L	87.8	Confident	81.7	Confident	7 Å²	7	74.2 Å²	74.2	4%	0.037	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	140.5	174.8	-45.9	173	0	0	0	107.8	L2501 I2502 L2504 Q2516 I2535 W2547 F2555	L2501-L2518 WeakPolarHBondContact CA-O 3.41Å; I2502-L2518 HydrophobicContact CB-CB 4.09Å; I2502-L2518 HydrophobicContact CB-CD1 4.31Å; I2502-L2518 HydrophobicContact CB-CG 4.21Å; I2502-L2518 HydrophobicContact CD1-CB 4.32Å; I2502-L2518 HydrophobicContact CD1-CD1 4.3Å; I2502-L2518 HydrophobicContact CG1-CB 4.42Å; I2502-L2518 HydrophobicContact CG2-CD1 4.44Å; I2502-L2518 PolarHBondContact N-O 2.9Å; I2502-L2518 PolarHBondContact O-N 3.02Å; L2504-L2518 HydrophobicContact CD1-CD1 3.83Å; L2504-L2518 HydrophobicContact CD1-CD2 3.96Å; L2504-L2518 HydrophobicContact CD1-CG 3.8Å; Q2516-L2518 HydrophobicContact CG-CD2 3.92Å; Q2516-L2518 VanDerWaalsContact NE2-CD2 3.3Å; L2518-I2535 HydrophobicContact CD1-CD1 4.2Å; L2518-W2547 HydrophobicContact CB-CD2 4.44Å; L2518-W2547 HydrophobicContact CB-CE3 4.22Å; L2518-W2547 HydrophobicContact CB-CH2 3.68Å; L2518-W2547 HydrophobicContact CB-CZ2 4.06Å; L2518-W2547 HydrophobicContact CB-CZ3 3.82Å; L2518-W2547 HydrophobicContact CD1-CB 4.46Å; L2518-W2547 HydrophobicContact CD1-CD2 3.89Å; L2518-W2547 HydrophobicContact CD1-CE3 4.06Å; L2518-W2547 HydrophobicContact CD1-CG 4.08Å; L2518-W2547 HydrophobicContact CD1-CZ3 4.36Å; L2518-W2547 HydrophobicContact CD2-CE3 3.85Å; L2518-W2547 HydrophobicContact CD2-CH2 4.43Å; L2518-W2547 HydrophobicContact CD2-CZ3 3.8Å; L2518-W2547 HydrophobicContact CG-CE3 4.21Å; L2518-W2547 HydrophobicContact CG-CH2 4.43Å; L2518-W2547 HydrophobicContact CG-CZ3 4.19Å; L2518-F2555 HydrophobicContact CD1-CB 4.31Å; L2518-F2555 HydrophobicContact CD2-CB 4.24Å
2519	V	83.4	Confident	82.3	Confident	94.75 Å²	94.75	68.5 Å²	68.5	57%	0.574	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	125.5	177.3	-172.2	0	0	0	0	107.3	L2501 W2547	L2501-V2519 HydrophobicContact CD2-CB 4.11Å; L2501-V2519 HydrophobicContact CD2-CG1 4.13Å; L2501-V2519 HydrophobicContact CD2-CG2 3.69Å; V2519-W2547 WeakPolarHBondContact O-CH2 3.34Å; V2519-W2547 VanDerWaalsContact O-CZ2 3.3Å; V2519-W2547 WeakPolarHBondContact O-CZ2 3.2Å
2520	S	73.7	Confident	83.1	Confident	8.5 Å²	8.5	64.5 Å²	64.5	6%	0.059	31%	0.308	C	S	.	.			trans	-91.8	170.3	167.8	81.1	0	0	0	0	109.7	Q2500 Q2522 S2537 T2539	Q2500-S2520 WeakPolarHBondContact CB-O 3.4Å; Q2500-S2520 PolarHBondContact O-N 3.06Å; Q2500-S2520 VanDerWaalsContact O-N 3.11Å; Q2500-S2520 PolarHBondContact O-OG 2.98Å; Q2500-S2520 VanDerWaalsContact O-OG 3.1Å; S2520-Q2522 VanDerWaalsContact C-N 3.33Å; S2520-Q2522 PolarHBondContact O-N 2.94Å; S2520-S2537 PolarHBondContact OG-OG 2.88Å; S2520-T2539 WeakPolarHBondContact OG-CG2 3.25Å
2521	D	68.3	Low	83.6	Confident	68 Å²	68	56.3 Å²	56.3	36%	0.364	27%	0.273	S	S	.	.	S	Bend	trans	-64.2	162.1	176.3	-154.3	18.4	0	0	0	113.1	S2523 N2541 H2543	D2521-S2523 PolarHBondContact O-N 2.99Å; D2521-N2541 PolarHBondContact OD2-ND2 2.77Å; D2521-H2543 HydrophobicContact CB-CB 4.27Å; D2521-H2543 IonicContact OD2-CD2 3.04Å; D2521-H2543 IonicContact OD2-CG 3.47Å
2522	Q	69	Low	83.5	Confident	148 Å²	148	51 Å²	51	69%	0.692	25%	0.25	S	S	*	.	S	Bend	trans	-82.1	11.3	-166.7	-57.8	-171.3	1.6	0	0	116.2	Q2500 S2520	Q2500-Q2522 VanDerWaalsContact CD-C 3.46Å; Q2500-Q2522 VanDerWaalsContact NE2-C 3.31Å; Q2500-Q2522 PolarHBondContact NE2-O 2.99Å; S2520-Q2522 VanDerWaalsContact C-N 3.33Å; S2520-Q2522 PolarHBondContact O-N 2.94Å
2523	S	78.3	Confident	83	Confident	13.25 Å²	13.25	47.6 Å²	47.6	9%	0.093	24%	0.24	C	C	.	.	S	Bend	trans	-144.7	158.7	-179	70.5	0	0	0	0	112.1	D2521 T2539 S2540 N2541	D2521-S2523 PolarHBondContact O-N 2.99Å; S2523-T2539 WeakPolarHBondContact O-CG2 3.5Å; S2523-T2539 VanDerWaalsContact OG-CB 3.25Å; S2523-T2539 WeakPolarHBondContact OG-CB 3.29Å; S2523-T2539 PolarHBondContact OG-OG1 2.78Å; S2523-S2540 WeakPolarHBondContact CB-OG 3.43Å; S2523-S2540 PolarHBondContact OG-N 2.89Å; S2523-S2540 PolarHBondContact OG-OG 2.83Å; S2523-N2541 WeakPolarHBondContact CB-OD1 3.27Å; S2523-N2541 VanDerWaalsContact OG-CG 3.26Å; S2523-N2541 PolarHBondContact OG-N 2.76Å; S2523-N2541 PolarHBondContact OG-ND2 2.82Å; S2523-N2541 PolarHBondContact OG-OD1 2.94Å; S2523-N2541 VanDerWaalsContact OG-OD1 3.04Å
2524	G	81	Confident	82.8	Confident	8.5 Å²	8.5	40.7 Å²	40.7	9%	0.088	21%	0.21	C	C	.	.			trans	-62.6	139.1	-173.8	0	0	0	0	0	112.7	K2526 T2539 S2540	G2524-K2526 PolarHBondContact O-N 3.12Å; G2524-T2539 CarbonylContact O-C 3.46Å; G2524-T2539 WeakPolarHBondContact O-CA 3.36Å; G2524-S2540 PolarHBondContact O-N 2.92Å; G2524-S2540 VanDerWaalsContact O-N 3.09Å
2525	I	86.7	Confident	82.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	120.3	-178	-61.3	163.6	0	0	0	109.5	I2475 S2497 L2501 I2502 L2528 A2538 T2539	I2475-I2525 VanDerWaalsContact CB-O 3.28Å; I2475-I2525 WeakPolarHBondContact CB-O 3.34Å; I2475-I2525 WeakPolarHBondContact CD1-O 3.26Å; I2475-I2525 VanDerWaalsContact CG2-O 3.26Å; I2475-I2525 WeakPolarHBondContact CG2-O 3.36Å; S2497-I2525 PolarHBondContact O-N 3.04Å; L2501-I2525 WeakPolarHBondContact O-CD1 3.4Å; I2502-I2525 HydrophobicContact CB-CD1 4.43Å; I2502-I2525 HydrophobicContact CD1-CD1 4.4Å; I2502-I2525 HydrophobicContact CG1-CD1 3.51Å; I2502-I2525 VanDerWaalsContact CG1-CD1 3.42Å; I2502-I2525 HydrophobicContact CG1-CG1 4.3Å; I2525-L2528 HydrophobicContact CG2-CD1 4.42Å; I2525-L2528 HydrophobicContact CG2-CD2 3.85Å; I2525-L2528 HydrophobicContact CG2-CG 3.83Å; I2525-A2538 CarbonylContact C-O 3.56Å; I2525-T2539 HydrophobicContact CG1-CG2 4.35Å
2526	K	85.7	Confident	82.9	Confident	113 Å²	113	33.9 Å²	33.9	49%	0.491	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-33.8	-179	-90.7	-47.9	-177.8	176.4	0	113.4	I2475 G2524 A2538	I2475-K2526 HydrophobicContact CG2-CD 4.42Å; G2524-K2526 PolarHBondContact O-N 3.12Å; K2526-A2538 PolarHBondContact N-O 2.99Å
2527	S	87.9	Confident	83	Confident	10 Å²	10	32.3 Å²	32.3	7%	0.07	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	138.4	-178.5	-174.8	0	0	0	0	110.1	S2537 A2538 I2585	S2527-S2537 CarbonylContact O-C 3.57Å; S2527-S2537 VanDerWaalsContact O-CA 3.25Å; S2527-S2537 WeakPolarHBondContact O-CA 3.41Å; S2527-A2538 PolarHBondContact N-O 3.18Å; S2527-A2538 PolarHBondContact O-N 3.23Å; S2527-I2585 PolarHBondContact OG-N 2.87Å; S2527-I2585 VanDerWaalsContact OG-N 3.1Å; S2527-I2585 PolarHBondContact OG-O 3.38Å
2528	L	90.5	Very high	82.9	Confident	7.25 Å²	7.25	29.4 Å²	29.4	4%	0.038	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	140.8	171.5	-92.9	172.5	0	0	0	109.9	S2476 K2478 L2494 G2496 I2502 I2525 F2536 S2537	S2476-L2528 WeakPolarHBondContact OG-CG 3.4Å; S2476-L2528 PolarHBondContact OG-N 2.96Å; S2476-L2528 VanDerWaalsContact OG-N 3.1Å; K2478-L2528 HydrophobicContact CB-CB 4.44Å; K2478-L2528 HydrophobicContact CB-CD2 3.73Å; K2478-L2528 HydrophobicContact CG-CD2 3.95Å; K2478-L2528 WeakPolarHBondContact CG-O 3.36Å; L2494-L2528 HydrophobicContact CB-CD1 4.37Å; L2494-L2528 HydrophobicContact CB-CD2 3.69Å; L2494-L2528 HydrophobicContact CD1-CD2 3.78Å; L2494-L2528 HydrophobicContact CG-CD2 4.4Å; G2496-L2528 VanDerWaalsContact CA-CD1 3.45Å; G2496-L2528 VanDerWaalsContact N-CD1 3.27Å; I2502-L2528 HydrophobicContact CB-CD1 4.29Å; I2502-L2528 HydrophobicContact CD1-CD1 3.8Å; I2502-L2528 HydrophobicContact CD1-CD2 3.77Å; I2502-L2528 HydrophobicContact CG1-CD1 4.13Å; I2502-L2528 HydrophobicContact CG1-CD2 4.01Å; I2502-L2528 HydrophobicContact CG2-CD1 3.98Å; I2502-L2528 HydrophobicContact CG2-CD2 4.37Å; I2525-L2528 HydrophobicContact CG2-CD1 4.42Å; I2525-L2528 HydrophobicContact CG2-CD2 3.85Å; I2525-L2528 HydrophobicContact CG2-CG 3.83Å; L2528-F2536 WeakPolarHBondContact CA-O 3.2Å; L2528-S2537 VanDerWaalsContact CD2-CB 3.43Å
2529	D	90	Very high	82.8	Confident	7 Å²	7	29.1 Å²	29.1	4%	0.037	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	161.1	171.6	-160	31.2	0	0	0	112.3	K2478 F2536 I2585 S2587	K2478-D2529 WeakPolarHBondContact CE-OD1 3.19Å; K2478-D2529 IonicContact NZ-OD1 3.21Å; K2478-D2529 PolarHBondContact NZ-OD1 2.95Å; D2529-F2536 HydrophobicContact CB-CB 4.49Å; D2529-F2536 PolarHBondContact N-O 3.12Å; D2529-F2536 PolarHBondContact O-N 2.96Å; D2529-I2585 HydrophobicContact CB-CG2 4.43Å; D2529-S2587 WeakPolarHBondContact OD2-CA 3.44Å; D2529-S2587 WeakPolarHBondContact OD2-CB 3.37Å; D2529-S2587 PolarHBondContact OD2-N 2.84Å; D2529-S2587 PolarHBondContact OD2-OG 2.83Å
2530	F	86.8	Confident	82.5	Confident	15.5 Å²	15.5	27.2 Å²	27.2	7%	0.068	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	124.4	-176.5	174.4	-98.5	0	0	0	110.7	K2478 S2480 Y2481 L2494 F2532 Y2534 I2535 F2555	K2478-F2530 HydrophobicContact CG-CB 4.01Å; S2480-F2530 VanDerWaalsContact CA-CD1 3.49Å; S2480-F2530 VanDerWaalsContact CA-CE1 3.49Å; S2480-F2530 VanDerWaalsContact CB-CD1 3.49Å; S2480-F2530 VanDerWaalsContact CB-CE1 3.43Å; S2480-F2530 VanDerWaalsContact CB-CZ 3.47Å; Y2481-F2530 HydrophobicContact CD1-CE1 4.18Å; Y2481-F2530 HydrophobicContact CE1-CD1 4.45Å; Y2481-F2530 HydrophobicContact CE1-CE1 4.19Å; Y2481-F2530 HydrophobicContact CG-CE1 4.37Å; Y2481-F2530 WeakPolarHBondContact O-CZ 3.46Å; L2494-F2530 HydrophobicContact CD1-CB 3.89Å; L2494-F2530 HydrophobicContact CD1-CD2 4.22Å; L2494-F2530 HydrophobicContact CD1-CG 4.3Å; F2530-F2532 HydrophobicContact CE1-CB 4.05Å; F2530-F2532 HydrophobicContact CE2-CB 4.48Å; F2530-F2532 HydrophobicContact CZ-CB 3.69Å; F2530-F2532 HydrophobicContact CZ-CD2 4.1Å; F2530-F2532 HydrophobicContact CZ-CG 4.41Å; F2530-Y2534 WeakPolarHBondContact CD2-O 3.42Å; F2530-I2535 HydrophobicContact CD2-CG1 3.79Å; F2530-I2535 HydrophobicContact CE2-CG1 4.36Å; F2530-F2555 HydrophobicContact CE2-CE1 4.36Å; F2530-F2555 AromaticContact CE2-CZ 3.95Å; F2530-F2555 HydrophobicContact CE2-CZ 4.06Å
2531	N	82.4	Confident	82.4	Confident	20.5 Å²	20.5	31.2 Å²	31.2	11%	0.11	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	115.2	162.8	-176.1	5.9	0	0	0	108.2	Y2534 F2536 S2587 E2589 V2723	N2531-Y2534 CarbonylContact C-O 3.57Å; N2531-Y2534 PolarHBondContact N-O 3.07Å; N2531-Y2534 VanDerWaalsContact N-O 3.09Å; N2531-Y2534 CarbonylContact O-C 3.53Å; N2531-Y2534 WeakPolarHBondContact O-CA 3.26Å; N2531-Y2534 WeakPolarHBondContact O-CB 3.47Å; N2531-Y2534 PolarHBondContact O-N 2.84Å; N2531-Y2534 VanDerWaalsContact O-O 3.1Å; N2531-F2536 HydrophobicContact CB-CE2 4.41Å; N2531-S2587 WeakPolarHBondContact CB-OG 3.4Å; N2531-E2589 WeakPolarHBondContact ND2-CG 3.36Å; N2531-E2589 PolarHBondContact ND2-OE1 2.93Å; N2531-V2723 HydrophobicContact CB-CG1 4.37Å; N2531-V2723 WeakPolarHBondContact ND2-CG2 3.27Å
2532	F	77.2	Confident	82.7	Confident	55.5 Å²	55.5	28.1 Å²	28.1	24%	0.243	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	129	-172.2	-179.9	-93.4	0	0	0	111.1	Y2481 I2482 L2483 F2530 Y2549	Y2481-F2532 HydrophobicContact CD2-CB 4.39Å; Y2481-F2532 HydrophobicContact CE2-CB 4.02Å; Y2481-F2532 HydrophobicContact CE2-CG 4.38Å; Y2481-F2532 WeakPolarHBondContact O-CD2 3.07Å; I2482-F2532 HydrophobicContact CG2-CE2 4.27Å; L2483-F2532 HydrophobicContact CB-CZ 4.39Å; L2483-F2532 HydrophobicContact CD1-CD1 4.32Å; L2483-F2532 HydrophobicContact CD1-CE1 4.13Å; F2530-F2532 HydrophobicContact CE1-CB 4.05Å; F2530-F2532 HydrophobicContact CE2-CB 4.48Å; F2530-F2532 HydrophobicContact CZ-CB 3.69Å; F2530-F2532 HydrophobicContact CZ-CD2 4.1Å; F2530-F2532 HydrophobicContact CZ-CG 4.41Å; F2532-Y2549 HydrophobicContact CE2-CD1 4.21Å; F2532-Y2549 HydrophobicContact CE2-CG 4.44Å
2533	P	76.1	Confident	83.2	Confident	25.25 Å²	25.25	21.8 Å²	21.8	16%	0.164	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	cis	-95	16.3	14.4	37.7	-38.2	0	0	0	116	R2548 Y2549	P2533-R2548 HydrophobicContact CB-CG 4.35Å; P2533-R2548 HydrophobicContact CG-CG 4.24Å; P2533-R2548 CarbonylContact O-C 3.52Å; P2533-R2548 WeakPolarHBondContact O-CA 3.41Å; P2533-Y2549 PolarHBondContact O-N 2.99Å
2534	Y	83.7	Confident	83.4	Confident	15 Å²	15	21.2 Å²	21.2	6%	0.059	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	146.5	-169.7	-54.2	-71.8	0	0	0	114.9	F2530 N2531 F2536 V2546 W2547 R2548 I2558 V2723	F2530-Y2534 WeakPolarHBondContact CD2-O 3.42Å; N2531-Y2534 CarbonylContact C-O 3.57Å; N2531-Y2534 PolarHBondContact N-O 3.07Å; N2531-Y2534 VanDerWaalsContact N-O 3.09Å; N2531-Y2534 CarbonylContact O-C 3.53Å; N2531-Y2534 WeakPolarHBondContact O-CA 3.26Å; N2531-Y2534 WeakPolarHBondContact O-CB 3.47Å; N2531-Y2534 PolarHBondContact O-N 2.84Å; N2531-Y2534 VanDerWaalsContact O-O 3.1Å; Y2534-F2536 VanDerWaalsContact CB-CZ 3.5Å; Y2534-F2536 HydrophobicContact CD2-CZ 4.37Å; Y2534-F2536 HydrophobicContact CG-CZ 4.14Å; Y2534-V2546 HydrophobicContact CD1-CG1 4.26Å; Y2534-W2547 CarbonylContact C-O 3.56Å; Y2534-W2547 VanDerWaalsContact CA-O 3.24Å; Y2534-W2547 WeakPolarHBondContact CA-O 3.4Å; Y2534-R2548 HydrophobicContact CD1-CB 4.03Å; Y2534-R2548 HydrophobicContact CD1-CG 4.11Å; Y2534-R2548 HydrophobicContact CE1-CB 4.03Å; Y2534-R2548 HydrophobicContact CE1-CG 3.79Å; Y2534-I2558 HydrophobicContact CD1-CD1 3.98Å; Y2534-I2558 HydrophobicContact CE1-CD1 3.74Å; Y2534-V2723 HydrophobicContact CD2-CG1 4.43Å; Y2534-V2723 HydrophobicContact CD2-CG2 4.26Å; Y2534-V2723 HydrophobicContact CE2-CG2 4.31Å
2535	I	87.9	Confident	83.6	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	137.5	162.3	-63.9	167.6	0	0	0	107.9	L2494 I2502 L2504 L2518 F2530 V2546 W2547 F2555	L2494-I2535 HydrophobicContact CD1-CD1 4.09Å; L2494-I2535 HydrophobicContact CD1-CG1 3.91Å; L2494-I2535 HydrophobicContact CD1-CG2 4.23Å; L2494-I2535 HydrophobicContact CD2-CD1 3.8Å; L2494-I2535 HydrophobicContact CD2-CG1 4.29Å; I2502-I2535 HydrophobicContact CD1-CG2 4.39Å; L2504-I2535 HydrophobicContact CD2-CD1 4.14Å; L2518-I2535 HydrophobicContact CD1-CD1 4.2Å; F2530-I2535 HydrophobicContact CD2-CG1 3.79Å; F2530-I2535 HydrophobicContact CE2-CG1 4.36Å; I2535-V2546 WeakPolarHBondContact O-CA 3.45Å; I2535-W2547 HydrophobicContact CB-CB 4.3Å; I2535-W2547 HydrophobicContact CB-CE3 4.2Å; I2535-W2547 HydrophobicContact CG2-CE3 3.89Å; I2535-W2547 HydrophobicContact CG2-CZ3 4.28Å; I2535-W2547 PolarHBondContact N-O 2.99Å; I2535-W2547 PolarHBondContact O-N 3.27Å; I2535-F2555 HydrophobicContact CD1-CB 4.43Å; I2535-F2555 HydrophobicContact CD1-CD1 3.55Å; I2535-F2555 VanDerWaalsContact CD1-CD1 3.42Å; I2535-F2555 HydrophobicContact CD1-CD2 3.76Å; I2535-F2555 HydrophobicContact CD1-CE1 3.58Å; I2535-F2555 VanDerWaalsContact CD1-CE1 3.46Å; I2535-F2555 HydrophobicContact CD1-CE2 3.77Å; I2535-F2555 HydrophobicContact CD1-CG 3.64Å; I2535-F2555 HydrophobicContact CD1-CZ 3.68Å; I2535-F2555 HydrophobicContact CG1-CD1 3.91Å; I2535-F2555 HydrophobicContact CG1-CE1 3.66Å; I2535-F2555 HydrophobicContact CG1-CG 4.46Å; I2535-F2555 HydrophobicContact CG1-CZ 4.03Å
2536	F	88.3	Confident	83.4	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	138.6	175.2	-53.8	-77.9	0	0	0	110.2	L2528 D2529 N2531 Y2534 V2546 I2585 S2587 V2723 L2725 P2747	L2528-F2536 WeakPolarHBondContact CA-O 3.2Å; D2529-F2536 HydrophobicContact CB-CB 4.49Å; D2529-F2536 PolarHBondContact N-O 3.12Å; D2529-F2536 PolarHBondContact O-N 2.96Å; N2531-F2536 HydrophobicContact CB-CE2 4.41Å; Y2534-F2536 VanDerWaalsContact CB-CZ 3.5Å; Y2534-F2536 HydrophobicContact CD2-CZ 4.37Å; Y2534-F2536 HydrophobicContact CG-CZ 4.14Å; F2536-V2546 HydrophobicContact CD1-CB 4.39Å; F2536-V2546 HydrophobicContact CD1-CG1 3.89Å; F2536-V2546 HydrophobicContact CD1-CG2 3.97Å; F2536-V2546 HydrophobicContact CE1-CB 4.41Å; F2536-V2546 HydrophobicContact CE1-CG1 3.6Å; F2536-V2546 HydrophobicContact CE1-CG2 4.2Å; F2536-V2546 HydrophobicContact CZ-CG1 4.44Å; F2536-I2585 HydrophobicContact CB-CD1 4.27Å; F2536-I2585 HydrophobicContact CB-CG2 3.93Å; F2536-S2587 VanDerWaalsContact CE2-CB 3.49Å; F2536-V2723 HydrophobicContact CE2-CG1 4.19Å; F2536-V2723 HydrophobicContact CZ-CG1 3.94Å; F2536-L2725 HydrophobicContact CB-CD1 4.16Å; F2536-L2725 HydrophobicContact CD1-CD1 3.44Å; F2536-L2725 HydrophobicContact CD1-CD2 3.98Å; F2536-L2725 HydrophobicContact CD1-CG 4.25Å; F2536-L2725 HydrophobicContact CD2-CD1 4.03Å; F2536-L2725 HydrophobicContact CE1-CD1 3.74Å; F2536-L2725 HydrophobicContact CE1-CD2 3.99Å; F2536-L2725 HydrophobicContact CE1-CG 4.4Å; F2536-L2725 HydrophobicContact CE2-CD1 4.12Å; F2536-L2725 HydrophobicContact CG-CD1 3.6Å; F2536-L2725 HydrophobicContact CG-CD2 4.41Å; F2536-L2725 HydrophobicContact CZ-CD1 4.16Å; F2536-P2747 HydrophobicContact CE1-CB 4.11Å; F2536-P2747 HydrophobicContact CE1-CG 3.76Å; F2536-P2747 HydrophobicContact CZ-CG 4.1Å
2537	S	89.5	Confident	83.3	Confident	0.5 Å²	0.5	16.2 Å²	16.2	0%	0.003	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	135.3	174.2	63.8	0	0	0	0	111.8	S2520 S2527 L2528 I2544 S2545 W2547 I2585	S2520-S2537 PolarHBondContact OG-OG 2.88Å; S2527-S2537 CarbonylContact O-C 3.57Å; S2527-S2537 VanDerWaalsContact O-CA 3.25Å; S2527-S2537 WeakPolarHBondContact O-CA 3.41Å; L2528-S2537 VanDerWaalsContact CD2-CB 3.43Å; S2537-I2544 CarbonylContact O-C 3.58Å; S2537-I2544 VanDerWaalsContact O-CA 3.27Å; S2537-I2544 WeakPolarHBondContact O-CA 3.36Å; S2537-S2545 PolarHBondContact N-O 3.09Å; S2537-S2545 VanDerWaalsContact N-O 3.12Å; S2537-S2545 PolarHBondContact O-N 3.2Å; S2537-S2545 WeakPolarHBondContact OG-CB 3.35Å; S2537-S2545 PolarHBondContact OG-O 3.13Å; S2537-W2547 VanDerWaalsContact OG-CH2 3.26Å; S2537-W2547 WeakPolarHBondContact OG-CH2 3.27Å; S2537-W2547 VanDerWaalsContact OG-CZ3 3.27Å; S2537-W2547 WeakPolarHBondContact OG-CZ3 3.42Å; S2537-W2547 PolarHBondContact OG-NE1 3.1Å; S2537-I2585 VanDerWaalsContact C-CD1 3.43Å
2538	A	87.6	Confident	83	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	138.1	169	0	0	0	0	0	110.2	I2525 K2526 S2527 H2543 I2544 V2583 I2585	I2525-A2538 CarbonylContact C-O 3.56Å; K2526-A2538 PolarHBondContact N-O 2.99Å; S2527-A2538 PolarHBondContact N-O 3.18Å; S2527-A2538 PolarHBondContact O-N 3.23Å; A2538-H2543 WeakPolarHBondContact CA-O 3.43Å; A2538-I2544 HydrophobicContact CB-CD1 4.42Å; A2538-I2544 HydrophobicContact CB-CG1 4.31Å; A2538-V2583 HydrophobicContact CB-CB 4.45Å; A2538-V2583 HydrophobicContact CB-CG1 3.67Å; A2538-I2585 HydrophobicContact CB-CD1 3.5Å; A2538-I2585 HydrophobicContact CB-CG1 3.71Å; A2538-I2585 VanDerWaalsContact N-CD1 3.31Å
2539	T	84.6	Confident	82.5	Confident	0.75 Å²	0.75	20.8 Å²	20.8	1%	0.005	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	170.6	171.8	62.5	0	0	0	0	111.3	S2520 S2523 G2524 I2525 N2541 G2542 H2543	S2520-T2539 WeakPolarHBondContact OG-CG2 3.25Å; S2523-T2539 WeakPolarHBondContact O-CG2 3.5Å; S2523-T2539 VanDerWaalsContact OG-CB 3.25Å; S2523-T2539 WeakPolarHBondContact OG-CB 3.29Å; S2523-T2539 PolarHBondContact OG-OG1 2.78Å; G2524-T2539 CarbonylContact O-C 3.46Å; G2524-T2539 WeakPolarHBondContact O-CA 3.36Å; I2525-T2539 HydrophobicContact CG1-CG2 4.35Å; T2539-N2541 PolarHBondContact O-N 2.93Å; T2539-N2541 PolarHBondContact OG1-N 3.45Å; T2539-N2541 PolarHBondContact OG1-OD1 3.15Å; T2539-G2542 PolarHBondContact O-N 2.86Å; T2539-H2543 HydrophobicContact CG2-CB 4.48Å; T2539-H2543 PolarHBondContact N-O 2.98Å; T2539-H2543 WeakPolarHBondContact OG1-CB 3.42Å; T2539-H2543 PolarHBondContact OG1-N 3.03Å; T2539-H2543 PolarHBondContact OG1-O 2.9Å; T2539-H2543 VanDerWaalsContact OG1-O 3.06Å
2540	S	76.6	Confident	81.5	Confident	53.75 Å²	53.75	21.2 Å²	21.2	38%	0.376	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.4	178.8	56.2	0	0	0	0	114.8	S2523 G2524 G2542	S2523-S2540 WeakPolarHBondContact CB-OG 3.43Å; S2523-S2540 PolarHBondContact OG-N 2.89Å; S2523-S2540 PolarHBondContact OG-OG 2.83Å; G2524-S2540 PolarHBondContact O-N 2.92Å; G2524-S2540 VanDerWaalsContact O-N 3.09Å; S2540-G2542 VanDerWaalsContact C-N 3.33Å; S2540-G2542 PolarHBondContact O-N 2.61Å
2541	N	72.4	Confident	80.5	Confident	92.75 Å²	92.75	29.9 Å²	29.9	50%	0.496	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	8.8	-177.1	3.7	3.6	0	0	0	113.1	D2521 S2523 T2539 H2543	D2521-N2541 PolarHBondContact OD2-ND2 2.77Å; S2523-N2541 WeakPolarHBondContact CB-OD1 3.27Å; S2523-N2541 VanDerWaalsContact OG-CG 3.26Å; S2523-N2541 PolarHBondContact OG-N 2.76Å; S2523-N2541 PolarHBondContact OG-ND2 2.82Å; S2523-N2541 PolarHBondContact OG-OD1 2.94Å; S2523-N2541 VanDerWaalsContact OG-OD1 3.04Å; T2539-N2541 PolarHBondContact O-N 2.93Å; T2539-N2541 PolarHBondContact OG1-N 3.45Å; T2539-N2541 PolarHBondContact OG1-OD1 3.15Å; N2541-H2543 VanDerWaalsContact C-N 3.32Å; N2541-H2543 PolarHBondContact O-N 3.06Å; N2541-H2543 VanDerWaalsContact OD1-CB 3.29Å; N2541-H2543 WeakPolarHBondContact OD1-CB 3.33Å; N2541-H2543 PolarHBondContact OD1-N 2.86Å
2542	G	74.6	Confident	79.8	Confident	4.25 Å²	4.25	35.1 Å²	35.1	4%	0.044	18%	0.175	C	C	.	.	S	Bend	trans	78.7	6.7	-177.2	0	0	0	0	0	114.7	T2539 S2540 I2563	T2539-G2542 PolarHBondContact O-N 2.86Å; S2540-G2542 VanDerWaalsContact C-N 3.33Å; S2540-G2542 PolarHBondContact O-N 2.61Å; G2542-I2563 PolarHBondContact O-N 3.11Å; G2542-I2563 VanDerWaalsContact O-N 3.08Å
2543	H	79.4	Confident	79.5	Confident	15 Å²	15	33.2 Å²	33.2	7%	0.069	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	130.8	171.3	-170.8	-81.1	0	0	0	110.5	D2521 A2538 T2539 N2541 S2545 E2560	D2521-H2543 HydrophobicContact CB-CB 4.27Å; D2521-H2543 IonicContact OD2-CD2 3.04Å; D2521-H2543 IonicContact OD2-CG 3.47Å; A2538-H2543 WeakPolarHBondContact CA-O 3.43Å; T2539-H2543 HydrophobicContact CG2-CB 4.48Å; T2539-H2543 PolarHBondContact N-O 2.98Å; T2539-H2543 WeakPolarHBondContact OG1-CB 3.42Å; T2539-H2543 PolarHBondContact OG1-N 3.03Å; T2539-H2543 PolarHBondContact OG1-O 2.9Å; T2539-H2543 VanDerWaalsContact OG1-O 3.06Å; N2541-H2543 VanDerWaalsContact C-N 3.32Å; N2541-H2543 PolarHBondContact O-N 3.06Å; N2541-H2543 VanDerWaalsContact OD1-CB 3.29Å; N2541-H2543 WeakPolarHBondContact OD1-CB 3.33Å; N2541-H2543 PolarHBondContact OD1-N 2.86Å; H2543-S2545 PolarHBondContact CE1-OG 2.96Å; H2543-S2545 VanDerWaalsContact CE1-OG 3.31Å; H2543-S2545 PolarHBondContact ND1-OG 2.95Å; H2543-E2560 VanDerWaalsContact CE1-CG 3.5Å; H2543-E2560 WeakPolarHBondContact CE1-CG 3.37Å; H2543-E2560 IonicContact CE1-OE1 3.08Å; H2543-E2560 PolarHBondContact CE1-OE1 3.01Å; H2543-E2560 IonicContact CE1-OE2 3.1Å; H2543-E2560 IonicContact NE2-OE1 2.82Å; H2543-E2560 IonicContact NE2-OE2 2.67Å; H2543-E2560 PolarHBondContact NE2-OE2 2.91Å
2544	I	83.5	Confident	79.7	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.7	179.4	-63.6	-174.1	0	0	0	109.6	S2537 A2538 V2546 E2560 M2561 I2563 I2585 L2725 I2727	S2537-I2544 CarbonylContact O-C 3.58Å; S2537-I2544 VanDerWaalsContact O-CA 3.27Å; S2537-I2544 WeakPolarHBondContact O-CA 3.36Å; A2538-I2544 HydrophobicContact CB-CD1 4.42Å; A2538-I2544 HydrophobicContact CB-CG1 4.31Å; I2544-V2546 HydrophobicContact CG2-CG2 4.48Å; I2544-E2560 CarbonylContact O-C 3.56Å; I2544-E2560 VanDerWaalsContact O-CA 3.29Å; I2544-E2560 WeakPolarHBondContact O-CA 3.29Å; I2544-M2561 HydrophobicContact CB-CB 4.29Å; I2544-M2561 PolarHBondContact N-O 2.87Å; I2544-M2561 PolarHBondContact O-N 3.09Å; I2544-I2563 HydrophobicContact CD1-CD1 3.54Å; I2544-I2563 HydrophobicContact CD1-CG1 4.2Å; I2544-I2563 HydrophobicContact CG1-CD1 4.25Å; I2544-I2585 HydrophobicContact CB-CD1 4.34Å; I2544-I2585 HydrophobicContact CD1-CD1 3.71Å; I2544-I2585 HydrophobicContact CD1-CG1 4Å; I2544-I2585 HydrophobicContact CG1-CD1 3.87Å; I2544-I2585 HydrophobicContact CG2-CD1 3.69Å; I2544-L2725 HydrophobicContact CG2-CD2 4.19Å; I2544-I2727 HydrophobicContact CD1-CD1 3.46Å; I2544-I2727 HydrophobicContact CD1-CG1 3.65Å; I2544-I2727 HydrophobicContact CD1-CG2 4.39Å
2545	S	83.4	Confident	79.6	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.007	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136.7	177.3	-53.9	0	0	0	0	110.5	S2537 H2543 W2547	S2537-S2545 PolarHBondContact N-O 3.09Å; S2537-S2545 VanDerWaalsContact N-O 3.12Å; S2537-S2545 PolarHBondContact O-N 3.2Å; S2537-S2545 WeakPolarHBondContact OG-CB 3.35Å; S2537-S2545 PolarHBondContact OG-O 3.13Å; H2543-S2545 PolarHBondContact CE1-OG 2.96Å; H2543-S2545 VanDerWaalsContact CE1-OG 3.31Å; H2543-S2545 PolarHBondContact ND1-OG 2.95Å; S2545-W2547 VanDerWaalsContact O-CZ3 3.27Å; S2545-W2547 WeakPolarHBondContact O-CZ3 3.45Å
2546	V	83.9	Confident	79.1	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.018	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	123.1	-179.3	-172	0	0	0	0	109.8	Y2534 I2535 F2536 I2544 I2558 S2559 M2561 P2747	Y2534-V2546 HydrophobicContact CD1-CG1 4.26Å; I2535-V2546 WeakPolarHBondContact O-CA 3.45Å; F2536-V2546 HydrophobicContact CD1-CB 4.39Å; F2536-V2546 HydrophobicContact CD1-CG1 3.89Å; F2536-V2546 HydrophobicContact CD1-CG2 3.97Å; F2536-V2546 HydrophobicContact CE1-CB 4.41Å; F2536-V2546 HydrophobicContact CE1-CG1 3.6Å; F2536-V2546 HydrophobicContact CE1-CG2 4.2Å; F2536-V2546 HydrophobicContact CZ-CG1 4.44Å; I2544-V2546 HydrophobicContact CG2-CG2 4.48Å; V2546-I2558 HydrophobicContact CB-CG1 4.25Å; V2546-I2558 HydrophobicContact CG1-CD1 4.02Å; V2546-I2558 HydrophobicContact CG1-CG1 3.98Å; V2546-I2558 VanDerWaalsContact O-CG1 3.28Å; V2546-I2558 WeakPolarHBondContact O-CG1 3.29Å; V2546-I2558 PolarHBondContact O-N 3.1Å; V2546-S2559 PolarHBondContact N-O 3.19Å; V2546-S2559 PolarHBondContact O-N 3.12Å; V2546-M2561 HydrophobicContact CG2-CE 3.86Å; V2546-P2747 HydrophobicContact CG1-CB 4.4Å; V2546-P2747 HydrophobicContact CG2-CB 4.29Å
2547	W	84.1	Confident	78.7	Confident	13.25 Å²	13.25	40.4 Å²	40.4	5%	0.05	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	139.1	179.5	-53.5	-16.2	0	0	0	111	I2502 L2518 V2519 Y2534 I2535 S2537 S2545 F2555 E2556 L2557	I2502-W2547 HydrophobicContact CD1-CE3 4.3Å; I2502-W2547 HydrophobicContact CD1-CH2 3.36Å; I2502-W2547 HydrophobicContact CD1-CZ2 4.25Å; I2502-W2547 HydrophobicContact CD1-CZ3 3.49Å; I2502-W2547 VanDerWaalsContact CD1-CZ3 3.43Å; L2518-W2547 HydrophobicContact CB-CD2 4.44Å; L2518-W2547 HydrophobicContact CB-CE3 4.22Å; L2518-W2547 HydrophobicContact CB-CH2 3.68Å; L2518-W2547 HydrophobicContact CB-CZ2 4.06Å; L2518-W2547 HydrophobicContact CB-CZ3 3.82Å; L2518-W2547 HydrophobicContact CD1-CB 4.46Å; L2518-W2547 HydrophobicContact CD1-CD2 3.89Å; L2518-W2547 HydrophobicContact CD1-CE3 4.06Å; L2518-W2547 HydrophobicContact CD1-CG 4.08Å; L2518-W2547 HydrophobicContact CD1-CZ3 4.36Å; L2518-W2547 HydrophobicContact CD2-CE3 3.85Å; L2518-W2547 HydrophobicContact CD2-CH2 4.43Å; L2518-W2547 HydrophobicContact CD2-CZ3 3.8Å; L2518-W2547 HydrophobicContact CG-CE3 4.21Å; L2518-W2547 HydrophobicContact CG-CH2 4.43Å; L2518-W2547 HydrophobicContact CG-CZ3 4.19Å; V2519-W2547 WeakPolarHBondContact O-CH2 3.34Å; V2519-W2547 VanDerWaalsContact O-CZ2 3.3Å; V2519-W2547 WeakPolarHBondContact O-CZ2 3.2Å; Y2534-W2547 CarbonylContact C-O 3.56Å; Y2534-W2547 VanDerWaalsContact CA-O 3.24Å; Y2534-W2547 WeakPolarHBondContact CA-O 3.4Å; I2535-W2547 HydrophobicContact CB-CB 4.3Å; I2535-W2547 HydrophobicContact CB-CE3 4.2Å; I2535-W2547 HydrophobicContact CG2-CE3 3.89Å; I2535-W2547 HydrophobicContact CG2-CZ3 4.28Å; I2535-W2547 PolarHBondContact N-O 2.99Å; I2535-W2547 PolarHBondContact O-N 3.27Å; S2537-W2547 VanDerWaalsContact OG-CH2 3.26Å; S2537-W2547 WeakPolarHBondContact OG-CH2 3.27Å; S2537-W2547 VanDerWaalsContact OG-CZ3 3.27Å; S2537-W2547 WeakPolarHBondContact OG-CZ3 3.42Å; S2537-W2547 PolarHBondContact OG-NE1 3.1Å; S2545-W2547 VanDerWaalsContact O-CZ3 3.27Å; S2545-W2547 WeakPolarHBondContact O-CZ3 3.45Å; W2547-F2555 HydrophobicContact CB-CB 4.24Å; W2547-F2555 HydrophobicContact CB-CD1 4.45Å; W2547-E2556 CarbonylContact C-O 3.52Å; W2547-E2556 VanDerWaalsContact CA-O 3.27Å; W2547-E2556 WeakPolarHBondContact CA-O 3.32Å; W2547-L2557 VanDerWaalsContact CD1-CA 3.47Å; W2547-L2557 HydrophobicContact CD2-CB 4.34Å; W2547-L2557 HydrophobicContact CD2-CD1 4.13Å; W2547-L2557 HydrophobicContact CE3-CB 3.91Å; W2547-L2557 HydrophobicContact CE3-CD1 4.23Å; W2547-L2557 HydrophobicContact CG-CD1 4.34Å; W2547-L2557 HydrophobicContact CH2-CB 4.23Å; W2547-L2557 HydrophobicContact CH2-CD1 4.09Å; W2547-L2557 HydrophobicContact CH2-CG 4.45Å; W2547-L2557 HydrophobicContact CZ2-CD1 4.14Å; W2547-L2557 HydrophobicContact CZ3-CB 3.85Å; W2547-L2557 HydrophobicContact CZ3-CD1 4.26Å; W2547-L2557 HydrophobicContact CZ3-CG 4.4Å
2548	R	80.3	Confident	77.8	Confident	73.25 Å²	73.25	42 Å²	42	28%	0.276	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	145.3	174.6	-164.2	174.4	178.9	169.5	1	111.2	Y2168 P2533 Y2534 G2550 F2555 E2556 I2558	Y2168-R2548 PolarHBondContact O-NH1 3.19Å; P2533-R2548 HydrophobicContact CB-CG 4.35Å; P2533-R2548 HydrophobicContact CG-CG 4.24Å; P2533-R2548 CarbonylContact O-C 3.52Å; P2533-R2548 WeakPolarHBondContact O-CA 3.41Å; Y2534-R2548 HydrophobicContact CD1-CB 4.03Å; Y2534-R2548 HydrophobicContact CD1-CG 4.11Å; Y2534-R2548 HydrophobicContact CE1-CB 4.03Å; Y2534-R2548 HydrophobicContact CE1-CG 3.79Å; R2548-G2550 PolarHBondContact O-N 3Å; R2548-F2555 CarbonylContact O-C 3.57Å; R2548-F2555 VanDerWaalsContact O-CA 3.28Å; R2548-F2555 WeakPolarHBondContact O-CA 3.34Å; R2548-E2556 PolarHBondContact N-O 2.88Å; R2548-E2556 PolarHBondContact O-N 3.27Å; R2548-I2558 HydrophobicContact CB-CD1 3.46Å; R2548-I2558 HydrophobicContact CB-CG1 3.84Å; R2548-I2558 HydrophobicContact CB-CG2 3.66Å; R2548-I2558 HydrophobicContact CG-CD1 4.02Å
2549	Y	79.8	Confident	76.9	Confident	40.75 Å²	40.75	42.6 Å²	42.6	16%	0.16	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	110.5	167.2	-162.6	-109.6	0	0	0	110.9	I2482 K2515 F2532 P2533 G2553 F2555	I2482-Y2549 HydrophobicContact CD1-CD2 4.42Å; I2482-Y2549 HydrophobicContact CD1-CE2 3.78Å; I2482-Y2549 HydrophobicContact CG1-CE2 4.35Å; I2482-Y2549 HydrophobicContact CG2-CD1 4.24Å; I2482-Y2549 HydrophobicContact CG2-CE1 3.85Å; I2482-Y2549 HydrophobicContact CG2-CE2 4.15Å; I2482-Y2549 WeakPolarHBondContact CG2-OH 3.37Å; K2515-Y2549 PolarHBondContact NZ-OH 3Å; F2532-Y2549 HydrophobicContact CE2-CD1 4.21Å; F2532-Y2549 HydrophobicContact CE2-CG 4.44Å; P2533-Y2549 PolarHBondContact O-N 2.99Å; Y2549-G2553 VanDerWaalsContact CE2-C 3.49Å; Y2549-G2553 VanDerWaalsContact CE2-O 3.24Å; Y2549-G2553 WeakPolarHBondContact CE2-O 3.29Å; Y2549-G2553 VanDerWaalsContact CZ-CA 3.49Å; Y2549-G2553 VanDerWaalsContact OH-CA 3.28Å; Y2549-G2553 WeakPolarHBondContact OH-CA 3.31Å; Y2549-G2553 PolarHBondContact OH-O 3.08Å; Y2549-F2555 HydrophobicContact CD2-CD1 4.27Å; Y2549-F2555 AromaticContact CD2-CD2 3.92Å; Y2549-F2555 HydrophobicContact CD2-CD2 3.92Å; Y2549-F2555 AromaticContact CD2-CE1 3.95Å; Y2549-F2555 HydrophobicContact CD2-CE1 3.97Å; Y2549-F2555 AromaticContact CD2-CE2 3.6Å; Y2549-F2555 HydrophobicContact CD2-CE2 3.6Å; Y2549-F2555 HydrophobicContact CD2-CG 4.26Å; Y2549-F2555 AromaticContact CD2-CZ 3.63Å; Y2549-F2555 HydrophobicContact CD2-CZ 3.63Å; Y2549-F2555 HydrophobicContact CE2-CD2 4.46Å; Y2549-F2555 HydrophobicContact CE2-CE2 4.12Å; Y2549-F2555 HydrophobicContact CE2-CZ 4.42Å; Y2549-F2555 HydrophobicContact CG-CE1 4.36Å; Y2549-F2555 HydrophobicContact CG-CZ 4.3Å
2550	G	69.9	Low	76.4	Confident	14.25 Å²	14.25	45.9 Å²	45.9	15%	0.147	24%	0.235	C	C	.	.			trans	-85	165.4	-179.4	0	0	0	0	0	113.7	R2548 N2552 G2553 N2554	R2548-G2550 PolarHBondContact O-N 3Å; G2550-N2552 PolarHBondContact O-N 2.86Å; G2550-N2552 VanDerWaalsContact O-N 3.09Å; G2550-G2553 PolarHBondContact O-N 3.11Å; G2550-N2554 PolarHBondContact N-O 3.25Å
2551	K	65.1	Low	76.1	Confident	198.25 Å²	198.25	44.2 Å²	44.2	86%	0.862	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-25.5	178	-68.4	-170.3	178.9	-173.3	0	113.3	G2553 R2710	K2551-G2553 PolarHBondContact O-N 2.98Å; K2551-R2710 PolarHBondContact NZ-O 3.48Å; K2551-R2710 VanDerWaalsContact NZ-O 3.15Å
2552	N	67.1	Low	76	Confident	130.75 Å²	130.75	45.8 Å²	45.8	70%	0.699	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-3.2	176.1	-60.9	-24.5	0	0	0	113.2	G2550 N2554 E2556	G2550-N2552 PolarHBondContact O-N 2.86Å; G2550-N2552 VanDerWaalsContact O-N 3.09Å; N2552-N2554 VanDerWaalsContact C-N 3.33Å; N2552-E2556 PolarHBondContact ND2-OE1 3.27Å; N2552-E2556 VanDerWaalsContact ND2-OE1 3.16Å
2553	G	71.2	Confident	75.7	Confident	15.75 Å²	15.75	46.4 Å²	46.4	16%	0.162	23%	0.23	C	C	.	.	S	Bend	trans	80	12.3	-179.8	0	0	0	0	0	114.5	K2515 Y2549 G2550 K2551	K2515-G2553 VanDerWaalsContact CE-O 3.23Å; K2515-G2553 WeakPolarHBondContact CE-O 3.32Å; K2515-G2553 PolarHBondContact NZ-O 2.92Å; Y2549-G2553 VanDerWaalsContact CE2-C 3.49Å; Y2549-G2553 VanDerWaalsContact CE2-O 3.24Å; Y2549-G2553 WeakPolarHBondContact CE2-O 3.29Å; Y2549-G2553 VanDerWaalsContact CZ-CA 3.49Å; Y2549-G2553 VanDerWaalsContact OH-CA 3.28Å; Y2549-G2553 WeakPolarHBondContact OH-CA 3.31Å; Y2549-G2553 PolarHBondContact OH-O 3.08Å; G2550-G2553 PolarHBondContact O-N 3.11Å; K2551-G2553 PolarHBondContact O-N 2.98Å
2554	N	80.7	Confident	74.5	Confident	71.25 Å²	71.25	49.3 Å²	49.3	38%	0.381	25%	0.253	S	S	.	.	S	Bend	trans	-117	158.1	177.2	-69.8	-18.9	0	0	0	110.3	G2550 N2552	G2550-N2554 PolarHBondContact N-O 3.25Å; N2552-N2554 VanDerWaalsContact C-N 3.33Å
2555	F	82.3	Confident	72.8	Confident	4.75 Å²	4.75	50.5 Å²	50.5	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	132.7	170.8	-73.6	-87.3	0	0	0	110.4	I2482 L2504 Q2516 L2518 F2530 I2535 W2547 R2548 Y2549	I2482-F2555 HydrophobicContact CD1-CE2 4.28Å; L2504-F2555 HydrophobicContact CD2-CD2 3.4Å; L2504-F2555 VanDerWaalsContact CD2-CD2 3.42Å; L2504-F2555 HydrophobicContact CD2-CE2 3.55Å; L2504-F2555 VanDerWaalsContact CD2-CE2 3.47Å; L2504-F2555 HydrophobicContact CD2-CG 4.47Å; Q2516-F2555 PolarHBondContact NE2-O 3.03Å; L2518-F2555 HydrophobicContact CD1-CB 4.31Å; L2518-F2555 HydrophobicContact CD2-CB 4.24Å; F2530-F2555 HydrophobicContact CE2-CE1 4.36Å; F2530-F2555 AromaticContact CE2-CZ 3.95Å; F2530-F2555 HydrophobicContact CE2-CZ 4.06Å; I2535-F2555 HydrophobicContact CD1-CB 4.43Å; I2535-F2555 HydrophobicContact CD1-CD1 3.55Å; I2535-F2555 VanDerWaalsContact CD1-CD1 3.42Å; I2535-F2555 HydrophobicContact CD1-CD2 3.76Å; I2535-F2555 HydrophobicContact CD1-CE1 3.58Å; I2535-F2555 VanDerWaalsContact CD1-CE1 3.46Å; I2535-F2555 HydrophobicContact CD1-CE2 3.77Å; I2535-F2555 HydrophobicContact CD1-CG 3.64Å; I2535-F2555 HydrophobicContact CD1-CZ 3.68Å; I2535-F2555 HydrophobicContact CG1-CD1 3.91Å; I2535-F2555 HydrophobicContact CG1-CE1 3.66Å; I2535-F2555 HydrophobicContact CG1-CG 4.46Å; I2535-F2555 HydrophobicContact CG1-CZ 4.03Å; W2547-F2555 HydrophobicContact CB-CB 4.24Å; W2547-F2555 HydrophobicContact CB-CD1 4.45Å; R2548-F2555 CarbonylContact O-C 3.57Å; R2548-F2555 VanDerWaalsContact O-CA 3.28Å; R2548-F2555 WeakPolarHBondContact O-CA 3.34Å; Y2549-F2555 HydrophobicContact CD2-CD1 4.27Å; Y2549-F2555 AromaticContact CD2-CD2 3.92Å; Y2549-F2555 HydrophobicContact CD2-CD2 3.92Å; Y2549-F2555 AromaticContact CD2-CE1 3.95Å; Y2549-F2555 HydrophobicContact CD2-CE1 3.97Å; Y2549-F2555 AromaticContact CD2-CE2 3.6Å; Y2549-F2555 HydrophobicContact CD2-CE2 3.6Å; Y2549-F2555 HydrophobicContact CD2-CG 4.26Å; Y2549-F2555 AromaticContact CD2-CZ 3.63Å; Y2549-F2555 HydrophobicContact CD2-CZ 3.63Å; Y2549-F2555 HydrophobicContact CE2-CD2 4.46Å; Y2549-F2555 HydrophobicContact CE2-CE2 4.12Å; Y2549-F2555 HydrophobicContact CE2-CZ 4.42Å; Y2549-F2555 HydrophobicContact CG-CE1 4.36Å; Y2549-F2555 HydrophobicContact CG-CZ 4.3Å
2556	E	77.8	Confident	70.9	Confident	52.5 Å²	52.5	53.8 Å²	53.8	25%	0.245	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136	-179.4	-66.7	173.3	-168.9	0	0	108.9	W2547 R2548 N2552 I2558	W2547-E2556 CarbonylContact C-O 3.52Å; W2547-E2556 VanDerWaalsContact CA-O 3.27Å; W2547-E2556 WeakPolarHBondContact CA-O 3.32Å; R2548-E2556 PolarHBondContact N-O 2.88Å; R2548-E2556 PolarHBondContact O-N 3.27Å; N2552-E2556 PolarHBondContact ND2-OE1 3.27Å; N2552-E2556 VanDerWaalsContact ND2-OE1 3.16Å; E2556-I2558 PolarHBondContact O-N 3.15Å
2557	L	78.3	Confident	68.7	Low	63.5 Å²	63.5	57.7 Å²	57.7	33%	0.332	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	124.8	178.4	-178	68.8	0	0	0	109.4	W2547 E2560	W2547-L2557 VanDerWaalsContact CD1-CA 3.47Å; W2547-L2557 HydrophobicContact CD2-CB 4.34Å; W2547-L2557 HydrophobicContact CD2-CD1 4.13Å; W2547-L2557 HydrophobicContact CE3-CB 3.91Å; W2547-L2557 HydrophobicContact CE3-CD1 4.23Å; W2547-L2557 HydrophobicContact CG-CD1 4.34Å; W2547-L2557 HydrophobicContact CH2-CB 4.23Å; W2547-L2557 HydrophobicContact CH2-CD1 4.09Å; W2547-L2557 HydrophobicContact CH2-CG 4.45Å; W2547-L2557 HydrophobicContact CZ2-CD1 4.14Å; W2547-L2557 HydrophobicContact CZ3-CB 3.85Å; W2547-L2557 HydrophobicContact CZ3-CD1 4.26Å; W2547-L2557 HydrophobicContact CZ3-CG 4.4Å; L2557-E2560 HydrophobicContact CD1-CG 4.15Å; L2557-E2560 HydrophobicContact CD2-CG 4.14Å; L2557-E2560 HydrophobicContact CG-CG 4.36Å
2558	I	71.7	Confident	66.6	Low	33.5 Å²	33.5	62.6 Å²	62.6	17%	0.172	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	-44.9	-179.2	-30.7	166.8	0	0	0	111.9	L2169 L2230 Y2534 V2546 R2548 E2556	L2169-I2558 HydrophobicContact CD1-CG2 4.48Å; L2169-I2558 HydrophobicContact CD2-CG1 4.44Å; L2169-I2558 HydrophobicContact CD2-CG2 3.37Å; L2230-I2558 HydrophobicContact CD1-CD1 4.48Å; L2230-I2558 HydrophobicContact CD1-CG2 4.32Å; Y2534-I2558 HydrophobicContact CD1-CD1 3.98Å; Y2534-I2558 HydrophobicContact CE1-CD1 3.74Å; V2546-I2558 HydrophobicContact CB-CG1 4.25Å; V2546-I2558 HydrophobicContact CG1-CD1 4.02Å; V2546-I2558 HydrophobicContact CG1-CG1 3.98Å; V2546-I2558 VanDerWaalsContact O-CG1 3.28Å; V2546-I2558 WeakPolarHBondContact O-CG1 3.29Å; V2546-I2558 PolarHBondContact O-N 3.1Å; R2548-I2558 HydrophobicContact CB-CD1 3.46Å; R2548-I2558 HydrophobicContact CB-CG1 3.84Å; R2548-I2558 HydrophobicContact CB-CG2 3.66Å; R2548-I2558 HydrophobicContact CG-CD1 4.02Å; E2556-I2558 PolarHBondContact O-N 3.15Å
2559	S	69.1	Low	64.6	Low	13 Å²	13	66.2 Å²	66.2	9%	0.091	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	150.6	-169.9	-165.5	0	0	0	0	110.6	L2230 V2546	L2230-S2559 PolarHBondContact O-OG 2.87Å; V2546-S2559 PolarHBondContact N-O 3.19Å; V2546-S2559 PolarHBondContact O-N 3.12Å
2560	E	72.7	Confident	62.4	Low	68.75 Å²	68.75	70.3 Å²	70.3	32%	0.321	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	132.1	175	-66.5	-177.7	134.6	0	0	107.5	R2147 H2543 I2544 L2557	R2147-E2560 IonicContact NH1-OE2 3.15Å; R2147-E2560 PolarHBondContact NH1-OE2 3.18Å; H2543-E2560 VanDerWaalsContact CE1-CG 3.5Å; H2543-E2560 WeakPolarHBondContact CE1-CG 3.37Å; H2543-E2560 IonicContact CE1-OE1 3.08Å; H2543-E2560 PolarHBondContact CE1-OE1 3.01Å; H2543-E2560 IonicContact CE1-OE2 3.1Å; H2543-E2560 IonicContact NE2-OE1 2.82Å; H2543-E2560 IonicContact NE2-OE2 2.67Å; H2543-E2560 PolarHBondContact NE2-OE2 2.91Å; I2544-E2560 CarbonylContact O-C 3.56Å; I2544-E2560 VanDerWaalsContact O-CA 3.29Å; I2544-E2560 WeakPolarHBondContact O-CA 3.29Å; L2557-E2560 HydrophobicContact CD1-CG 4.15Å; L2557-E2560 HydrophobicContact CD2-CG 4.14Å; L2557-E2560 HydrophobicContact CG-CG 4.36Å
2561	M	70.9	Confident	60.7	Low	19 Å²	19	75.6 Å²	75.6	9%	0.094	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	126.6	-178.4	-59	174.1	78	0	0	108.5	L2230 G2231 I2544 V2546 Y2745	L2230-M2561 WeakPolarHBondContact O-CE 3.1Å; L2230-M2561 WeakPolarHBondContact O-CG 3.44Å; G2231-M2561 VanDerWaalsContact CA-CE 3.46Å; G2231-M2561 WeakPolarHBondContact O-CE 3.5Å; I2544-M2561 HydrophobicContact CB-CB 4.29Å; I2544-M2561 PolarHBondContact N-O 2.87Å; I2544-M2561 PolarHBondContact O-N 3.09Å; V2546-M2561 HydrophobicContact CG2-CE 3.86Å; M2561-Y2745 HydrophobicContact CE-CD1 3.39Å; M2561-Y2745 VanDerWaalsContact CE-CD1 3.46Å; M2561-Y2745 HydrophobicContact CE-CE1 3.87Å; M2561-Y2745 HydrophobicContact CE-CG 3.93Å; M2561-Y2745 HydrophobicContact SD-CD1 4.43Å
2562	I	69.9	Low	59.1	Low	125.5 Å²	125.5	72.6 Å²	72.6	64%	0.644	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	116.8	171.5	-61.5	171.2	0	0	0	107.3	S2564	I2562-S2564 VanDerWaalsContact C-N 3.31Å; I2562-S2564 PolarHBondContact O-N 3.2Å
2563	I	67.8	Low	57.5	Low	16.75 Å²	16.75	71.2 Å²	71.2	9%	0.086	41%	0.408	C	S	.	.			trans	-79.6	97.2	168.8	-56.1	170.1	0	0	0	107	W2237 G2542 I2544 S2565 V2583 I2727	W2237-I2563 HydrophobicContact CH2-CG2 4Å; W2237-I2563 HydrophobicContact CZ2-CG2 3.83Å; G2542-I2563 PolarHBondContact O-N 3.11Å; G2542-I2563 VanDerWaalsContact O-N 3.08Å; I2544-I2563 HydrophobicContact CD1-CD1 3.54Å; I2544-I2563 HydrophobicContact CD1-CG1 4.2Å; I2544-I2563 HydrophobicContact CG1-CD1 4.25Å; I2563-S2565 PolarHBondContact O-N 3.19Å; I2563-V2583 HydrophobicContact CD1-CG1 4.08Å; I2563-I2727 HydrophobicContact CD1-CB 4.19Å; I2563-I2727 HydrophobicContact CD1-CD1 4Å; I2563-I2727 HydrophobicContact CD1-CG1 4.12Å; I2563-I2727 HydrophobicContact CD1-CG2 3.46Å; I2563-I2727 VanDerWaalsContact CD1-CG2 3.45Å; I2563-I2727 HydrophobicContact CG1-CG2 4.32Å
2564	S	54.1	Low	55.9	Low	76.5 Å²	76.5	75.6 Å²	75.6	54%	0.535	43%	0.432	S	S	.	.			trans	-62.8	135.5	172.6	36.2	0	0	0	0	109.9	I2562	I2562-S2564 VanDerWaalsContact C-N 3.31Å; I2562-S2564 PolarHBondContact O-N 3.2Å
2565	S	48.9	Very low	53.7	Low	24.5 Å²	24.5	78.8 Å²	78.8	17%	0.171	45%	0.454	C	S	.	.			trans	-65.1	141.4	166.2	92.7	0	0	0	0	108	I2563 L2567 D2568	I2563-S2565 PolarHBondContact O-N 3.19Å; S2565-L2567 PolarHBondContact O-N 2.95Å; S2565-L2567 PolarHBondContact OG-N 3.17Å; S2565-L2567 VanDerWaalsContact OG-N 3.17Å; S2565-D2568 WeakPolarHBondContact CB-OD1 3.2Å; S2565-D2568 VanDerWaalsContact CB-OD2 3.26Å; S2565-D2568 WeakPolarHBondContact CB-OD2 3.3Å; S2565-D2568 PolarHBondContact N-OD2 3.11Å; S2565-D2568 VanDerWaalsContact O-CG 3.32Å; S2565-D2568 PolarHBondContact O-N 3.07Å; S2565-D2568 VanDerWaalsContact O-N 3.14Å; S2565-D2568 VanDerWaalsContact OG-CG 3.27Å; S2565-D2568 PolarHBondContact OG-N 3.23Å; S2565-D2568 PolarHBondContact OG-OD1 3.28Å; S2565-D2568 PolarHBondContact OG-OD2 2.94Å
2566	P	42.4	Very low	51.5	Low	70.25 Å²	70.25	85 Å²	85	46%	0.456	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-3.5	178.9	2.5	-0.8	0	0	0	114	I2731	P2566-I2731 VanDerWaalsContact CD-CD1 3.45Å; P2566-I2731 HydrophobicContact CG-CD1 3.86Å; P2566-I2731 VanDerWaalsContact CG-CD1 3.48Å
2567	L	39.5	Very low	49.7	Very low	85.75 Å²	85.75	90.7 Å²	90.7	45%	0.449	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-13.5	-178.8	-91.3	88.2	0	0	0	115	S2565 N2569 L2570	S2565-L2567 PolarHBondContact O-N 2.95Å; S2565-L2567 PolarHBondContact OG-N 3.17Å; S2565-L2567 VanDerWaalsContact OG-N 3.17Å; L2567-N2569 PolarHBondContact O-N 3.05Å; L2567-N2569 VanDerWaalsContact O-N 3.1Å; L2567-L2570 CarbonylContact O-C 3.59Å; L2567-L2570 PolarHBondContact O-N 3.04Å; L2567-L2570 VanDerWaalsContact O-N 3.12Å
2568	D	39.7	Very low	48.1	Very low	116.25 Å²	116.25	92 Å²	92	62%	0.622	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.7	-173.9	-65.5	-41.3	0	0	0	114	S2565 L2570	S2565-D2568 WeakPolarHBondContact CB-OD1 3.2Å; S2565-D2568 VanDerWaalsContact CB-OD2 3.26Å; S2565-D2568 WeakPolarHBondContact CB-OD2 3.3Å; S2565-D2568 PolarHBondContact N-OD2 3.11Å; S2565-D2568 VanDerWaalsContact O-CG 3.32Å; S2565-D2568 PolarHBondContact O-N 3.07Å; S2565-D2568 VanDerWaalsContact O-N 3.14Å; S2565-D2568 VanDerWaalsContact OG-CG 3.27Å; S2565-D2568 PolarHBondContact OG-N 3.23Å; S2565-D2568 PolarHBondContact OG-OD1 3.28Å; S2565-D2568 PolarHBondContact OG-OD2 2.94Å; D2568-L2570 VanDerWaalsContact C-N 3.34Å; D2568-L2570 PolarHBondContact O-N 2.89Å
2569	N	36.9	Very low	47	Very low	148 Å²	148	93.7 Å²	93.7	79%	0.791	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-1.5	176	-76	-17	0	0	0	114.6	L2567	L2567-N2569 PolarHBondContact O-N 3.05Å; L2567-N2569 VanDerWaalsContact O-N 3.1Å
2570	L	35.2	Very low	46.2	Very low	126.5 Å²	126.5	96 Å²	96	66%	0.662	55%	0.547	S	S	*	.	S	Bend	trans	-123.9	81.3	-177.3	-84.2	141.7	0	0	0	113.3	L2567 D2568	L2567-L2570 CarbonylContact O-C 3.59Å; L2567-L2570 PolarHBondContact O-N 3.04Å; L2567-L2570 VanDerWaalsContact O-N 3.12Å; D2568-L2570 VanDerWaalsContact C-N 3.34Å; D2568-L2570 PolarHBondContact O-N 2.89Å
2571	N	32.8	Very low	45.5	Very low	126.5 Å²	126.5	96.4 Å²	96.4	68%	0.676	55%	0.551	S	S	*	*			trans	94.8	95.3	165.8	-61.2	-31.6	0	0	0	116.1	S2573	N2571-S2573 PolarHBondContact O-N 3.39Å; N2571-S2573 VanDerWaalsContact O-N 3.1Å
2572	S	31.2	Very low	45.2	Very low	135 Å²	135	96.6 Å²	96.6	94%	0.944	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	51.7	169.2	51.7	0	0	0	0	113.9
2573	S	33.5	Very low	45.2	Very low	101 Å²	101	91.3 Å²	91.3	71%	0.706	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.2	-1	179.4	60.4	0	0	0	0	117	N2571	N2571-S2573 PolarHBondContact O-N 3.39Å; N2571-S2573 VanDerWaalsContact O-N 3.1Å
2574	T	37.6	Very low	45.6	Very low	108.75 Å²	108.75	92.7 Å²	92.7	67%	0.667	53%	0.531	S	S	*	.			trans	-115	111.7	177.1	49.9	0	0	0	0	111.6	D2576	T2574-D2576 VanDerWaalsContact C-N 3.28Å; T2574-D2576 PolarHBondContact O-N 2.88Å; T2574-D2576 VanDerWaalsContact O-N 3.13Å
2575	T	34.7	Very low	47	Very low	138.25 Å²	138.25	89.2 Å²	89.2	85%	0.848	51%	0.506	S	S	*	.			trans	-72.7	72.5	177.7	52.8	0	0	0	0	112.8	E2577	T2575-E2577 PolarHBondContact O-N 3.43Å
2576	D	37	Very low	48.4	Very low	134.25 Å²	134.25	89.7 Å²	89.7	72%	0.718	51%	0.506	S	S	*	.			trans	-91.3	99.2	161.7	-73.1	-31	0	0	0	110.4	T2574 N2578	T2574-D2576 VanDerWaalsContact C-N 3.28Å; T2574-D2576 PolarHBondContact O-N 2.88Å; T2574-D2576 VanDerWaalsContact O-N 3.13Å; D2576-N2578 PolarHBondContact O-N 3.2Å; D2576-N2578 VanDerWaalsContact O-N 3.12Å
2577	E	39.1	Very low	50.2	Low	172.75 Å²	172.75	87.4 Å²	87.4	81%	0.807	49%	0.492	S	S	*	.			trans	-71.4	109.6	172.8	-67.9	-174.5	160.6	0	0	109.9	T2575 V2579	T2575-E2577 PolarHBondContact O-N 3.43Å; E2577-V2579 VanDerWaalsContact C-N 3.31Å; E2577-V2579 HydrophobicContact CB-CG2 4.15Å; E2577-V2579 WeakPolarHBondContact O-CG2 3.3Å; E2577-V2579 PolarHBondContact O-N 3.23Å
2578	N	44.6	Very low	51.9	Low	90.25 Å²	90.25	84.2 Å²	84.2	48%	0.483	47%	0.474	S	S	.	.			trans	-65.8	84.1	172.3	-73.4	-37.1	0	0	0	109.8	D2576 V2580 S2732	D2576-N2578 PolarHBondContact O-N 3.2Å; D2576-N2578 VanDerWaalsContact O-N 3.12Å; N2578-V2580 VanDerWaalsContact C-N 3.31Å; N2578-V2580 PolarHBondContact O-N 2.97Å; N2578-S2732 PolarHBondContact OD1-O 3.09Å
2579	V	48.9	Very low	53.1	Low	69.75 Å²	69.75	82.9 Å²	82.9	42%	0.423	46%	0.464	S	S	.	.			trans	-69.1	111	178.7	-171.5	0	0	0	0	109.3	E2577 N2581 S2732	E2577-V2579 VanDerWaalsContact C-N 3.31Å; E2577-V2579 HydrophobicContact CB-CG2 4.15Å; E2577-V2579 WeakPolarHBondContact O-CG2 3.3Å; E2577-V2579 PolarHBondContact O-N 3.23Å; V2579-N2581 VanDerWaalsContact C-N 3.29Å; V2579-N2581 VanDerWaalsContact CG1-OD1 3.26Å; V2579-N2581 WeakPolarHBondContact CG1-OD1 3.45Å; V2579-N2581 PolarHBondContact O-N 3.07Å; V2579-N2581 VanDerWaalsContact O-N 3.11Å; V2579-N2581 PolarHBondContact O-ND2 3.25Å; V2579-S2732 PolarHBondContact N-OG 2.87Å; V2579-S2732 VanDerWaalsContact N-OG 3.12Å; V2579-S2732 PolarHBondContact O-OG 2.87Å
2580	V	52.7	Low	53.8	Low	62.5 Å²	62.5	79.2 Å²	79.2	38%	0.379	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	98	167.9	-175.5	0	0	0	0	107.4	N2578 L2582 V2583 Q2729	N2578-V2580 VanDerWaalsContact C-N 3.31Å; N2578-V2580 PolarHBondContact O-N 2.97Å; V2580-L2582 VanDerWaalsContact C-N 3.28Å; V2580-L2582 PolarHBondContact O-N 3.38Å; V2580-V2583 HydrophobicContact CB-CG2 4.44Å; V2580-V2583 HydrophobicContact CG1-CG2 3.49Å; V2580-Q2729 HydrophobicContact CG1-CB 4.16Å
2581	N	58.5	Low	54.2	Low	76.25 Å²	76.25	77.8 Å²	77.8	41%	0.408	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	-5.5	-173.3	-72.5	-43.3	0	0	0	112.4	V2579 V2583 T2730 Q2738	V2579-N2581 VanDerWaalsContact C-N 3.29Å; V2579-N2581 VanDerWaalsContact CG1-OD1 3.26Å; V2579-N2581 WeakPolarHBondContact CG1-OD1 3.45Å; V2579-N2581 PolarHBondContact O-N 3.07Å; V2579-N2581 VanDerWaalsContact O-N 3.11Å; V2579-N2581 PolarHBondContact O-ND2 3.25Å; N2581-V2583 VanDerWaalsContact C-N 3.27Å; N2581-V2583 HydrophobicContact CB-CG2 3.91Å; N2581-V2583 PolarHBondContact O-N 3Å; N2581-T2730 WeakPolarHBondContact CB-OG1 3.38Å; N2581-T2730 PolarHBondContact N-O 3.18Å; N2581-Q2738 PolarHBondContact ND2-OE1 3.32Å
2582	L	63.6	Low	54.2	Low	24.25 Å²	24.25	75.1 Å²	75.1	13%	0.127	43%	0.426	C	S	.	.			trans	-121.3	114.7	176.5	-172.9	92.1	0	0	0	109.7	A2253 T2254 Y2256 V2580 Q2729 T2730 F2740	A2253-L2582 HydrophobicContact CB-CD2 4.47Å; T2254-L2582 VanDerWaalsContact C-CD1 3.47Å; T2254-L2582 WeakPolarHBondContact O-CD1 3.36Å; Y2256-L2582 HydrophobicContact CD1-CD2 3.82Å; Y2256-L2582 HydrophobicContact CE1-CD2 4.01Å; Y2256-L2582 VanDerWaalsContact CE1-CD2 3.49Å; V2580-L2582 VanDerWaalsContact C-N 3.28Å; V2580-L2582 PolarHBondContact O-N 3.38Å; L2582-Q2729 VanDerWaalsContact O-CA 3.28Å; L2582-Q2729 WeakPolarHBondContact O-CA 3.3Å; L2582-T2730 HydrophobicContact CB-CG2 4.35Å; L2582-T2730 WeakPolarHBondContact CB-OG1 3.36Å; L2582-T2730 PolarHBondContact N-OG1 2.93Å; L2582-T2730 VanDerWaalsContact N-OG1 3.16Å; L2582-F2740 HydrophobicContact CD2-CD2 4.42Å; L2582-F2740 HydrophobicContact CD2-CE2 4Å
2583	V	70.1	Confident	54.1	Low	13.75 Å²	13.75	73.2 Å²	73.2	8%	0.083	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	111.4	165.1	-172.1	0	0	0	0	107.6	A2538 I2563 V2580 N2581 I2727	A2538-V2583 HydrophobicContact CB-CB 4.45Å; A2538-V2583 HydrophobicContact CB-CG1 3.67Å; I2563-V2583 HydrophobicContact CD1-CG1 4.08Å; V2580-V2583 HydrophobicContact CB-CG2 4.44Å; V2580-V2583 HydrophobicContact CG1-CG2 3.49Å; N2581-V2583 VanDerWaalsContact C-N 3.27Å; N2581-V2583 HydrophobicContact CB-CG2 3.91Å; N2581-V2583 PolarHBondContact O-N 3Å; V2583-I2727 HydrophobicContact CG1-CG2 4.37Å
2584	K	77.4	Confident	53.8	Low	46.5 Å²	46.5	77.3 Å²	77.3	20%	0.202	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	150.5	172.3	-172.1	174.2	-174	175.3	0	108.2	T2255 Y2256	T2255-K2584 PolarHBondContact OG1-NZ 2.95Å; Y2256-K2584 HydrophobicContact CD1-CB 4.42Å; Y2256-K2584 HydrophobicContact CD1-CD 4.45Å; Y2256-K2584 HydrophobicContact CD2-CD 4.47Å; Y2256-K2584 HydrophobicContact CE1-CB 3.72Å; Y2256-K2584 HydrophobicContact CE1-CD 4.4Å; Y2256-K2584 HydrophobicContact CE1-CG 4.4Å; Y2256-K2584 HydrophobicContact CE2-CB 4.37Å; Y2256-K2584 HydrophobicContact CE2-CD 4.39Å; Y2256-K2584 HydrophobicContact CE2-CG 4.39Å; Y2256-K2584 WeakPolarHBondContact O-CD 3.37Å; Y2256-K2584 WeakPolarHBondContact O-CE 3.31Å; Y2256-K2584 PolarHBondContact O-NZ 3.21Å; Y2256-K2584 PolarHBondContact OH-O 3.23Å
2585	I	81.6	Confident	53.2	Low	2.25 Å²	2.25	78.1 Å²	78.1	1%	0.012	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.8	173.8	-64.1	177.7	0	0	0	107.6	S2527 D2529 F2536 S2537 A2538 I2544 L2725 I2727	S2527-I2585 PolarHBondContact OG-N 2.87Å; S2527-I2585 VanDerWaalsContact OG-N 3.1Å; S2527-I2585 PolarHBondContact OG-O 3.38Å; D2529-I2585 HydrophobicContact CB-CG2 4.43Å; F2536-I2585 HydrophobicContact CB-CD1 4.27Å; F2536-I2585 HydrophobicContact CB-CG2 3.93Å; S2537-I2585 VanDerWaalsContact C-CD1 3.43Å; A2538-I2585 HydrophobicContact CB-CD1 3.5Å; A2538-I2585 HydrophobicContact CB-CG1 3.71Å; A2538-I2585 VanDerWaalsContact N-CD1 3.31Å; I2544-I2585 HydrophobicContact CB-CD1 4.34Å; I2544-I2585 HydrophobicContact CD1-CD1 3.71Å; I2544-I2585 HydrophobicContact CD1-CG1 4Å; I2544-I2585 HydrophobicContact CG1-CD1 3.87Å; I2544-I2585 HydrophobicContact CG2-CD1 3.69Å; I2585-L2725 HydrophobicContact CG1-CD2 4.29Å; I2585-L2725 HydrophobicContact CG2-CD1 3.46Å; I2585-L2725 HydrophobicContact CG2-CD2 4.11Å; I2585-L2725 HydrophobicContact CG2-CG 3.76Å; I2585-I2727 HydrophobicContact CG1-CG1 4.35Å
2586	Q	80	Confident	52.9	Low	35.5 Å²	35.5	77 Å²	77	17%	0.166	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	129.2	163.9	-71.1	-174.3	-51.8	0	0	109.7	Y2256 A2257 I2258 L2726	Y2256-Q2586 HydrophobicContact CE2-CG 4.43Å; A2257-Q2586 VanDerWaalsContact CA-OE1 3.24Å; I2258-Q2586 HydrophobicContact CD1-CB 3.61Å; I2258-Q2586 HydrophobicContact CG1-CB 4.32Å; I2258-Q2586 VanDerWaalsContact CG1-OE1 3.25Å; Q2586-L2726 PolarHBondContact N-O 3.35Å; Q2586-L2726 VanDerWaalsContact N-O 3.13Å; Q2586-L2726 PolarHBondContact O-N 3.44Å
2587	S	80.2	Confident	52.7	Low	21.5 Å²	21.5	74.8 Å²	74.8	15%	0.15	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	141.8	172.6	61.1	0	0	0	0	110.1	D2529 N2531 F2536 K2724	D2529-S2587 WeakPolarHBondContact OD2-CA 3.44Å; D2529-S2587 WeakPolarHBondContact OD2-CB 3.37Å; D2529-S2587 PolarHBondContact OD2-N 2.84Å; D2529-S2587 PolarHBondContact OD2-OG 2.83Å; N2531-S2587 WeakPolarHBondContact CB-OG 3.4Å; F2536-S2587 VanDerWaalsContact CE2-CB 3.49Å; S2587-K2724 CarbonylContact C-O 3.58Å; S2587-K2724 VanDerWaalsContact CA-O 3.25Å; S2587-K2724 WeakPolarHBondContact CA-O 3.31Å
2588	F	74.6	Confident	52.2	Low	18.75 Å²	18.75	71.7 Å²	71.7	8%	0.082	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	153.3	178.3	63.7	-77.4	0	0	0	109.7	I2258 G2262 I2279 Y2590 K2724 L2726 V2744	I2258-F2588 HydrophobicContact CD1-CB 4.47Å; I2258-F2588 HydrophobicContact CD1-CD1 3.93Å; I2258-F2588 HydrophobicContact CD1-CE1 4.26Å; I2258-F2588 HydrophobicContact CD1-CG 4.26Å; G2262-F2588 VanDerWaalsContact O-CE2 3.31Å; G2262-F2588 WeakPolarHBondContact O-CE2 3.44Å; I2279-F2588 HydrophobicContact CD1-CZ 4.48Å; I2279-F2588 HydrophobicContact CG2-CZ 4.4Å; F2588-Y2590 HydrophobicContact CE2-CD2 4.27Å; F2588-K2724 HydrophobicContact CD1-CB 4.07Å; F2588-K2724 WeakPolarHBondContact CD1-O 3.39Å; F2588-K2724 HydrophobicContact CD2-CB 4.32Å; F2588-K2724 HydrophobicContact CE1-CB 3.57Å; F2588-K2724 HydrophobicContact CE2-CB 3.89Å; F2588-K2724 HydrophobicContact CE2-CD 4.07Å; F2588-K2724 HydrophobicContact CE2-CG 4.48Å; F2588-K2724 HydrophobicContact CG-CB 4.41Å; F2588-K2724 HydrophobicContact CZ-CB 3.49Å; F2588-K2724 VanDerWaalsContact CZ-CB 3.48Å; F2588-K2724 HydrophobicContact CZ-CD 4.05Å; F2588-K2724 HydrophobicContact CZ-CG 4.39Å; F2588-K2724 PolarHBondContact N-O 3.32Å; F2588-K2724 PolarHBondContact O-N 2.85Å; F2588-L2726 HydrophobicContact CD1-CB 4.48Å; F2588-L2726 HydrophobicContact CE1-CB 4.02Å; F2588-V2744 HydrophobicContact CE1-CG1 4.17Å; F2588-V2744 HydrophobicContact CE1-CG2 4.46Å; F2588-V2744 HydrophobicContact CZ-CG1 3.95Å; F2588-V2744 HydrophobicContact CZ-CG2 4.25Å
2589	E	65.2	Low	51.5	Low	89 Å²	89	74 Å²	74	42%	0.416	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	119	170.1	-70.2	-177	-174.1	0	0	108.2	N2531 T2591 N2719 N2722 V2723	N2531-E2589 WeakPolarHBondContact ND2-CG 3.36Å; N2531-E2589 PolarHBondContact ND2-OE1 2.93Å; E2589-T2591 PolarHBondContact O-N 3.04Å; E2589-N2719 PolarHBondContact OE2-ND2 3.04Å; E2589-N2722 WeakPolarHBondContact CA-O 3.25Å; E2589-V2723 HydrophobicContact CG-CG2 4.37Å
2590	Y	52.2	Low	50.6	Low	70 Å²	70	79.4 Å²	79.4	28%	0.275	43%	0.43	S	S	.	.			trans	-91	106.8	173.6	-174.4	-99.4	0	0	0	108.9	K2263 F2588 P2592 N2722 K2724	K2263-Y2590 HydrophobicContact CG-CE2 4.41Å; F2588-Y2590 HydrophobicContact CE2-CD2 4.27Å; Y2590-P2592 HydrophobicContact CD1-CB 4.36Å; Y2590-P2592 HydrophobicContact CE1-CB 3.98Å; Y2590-P2592 VanDerWaalsContact O-CD 3.25Å; Y2590-P2592 WeakPolarHBondContact O-CD 3.37Å; Y2590-N2722 PolarHBondContact N-O 2.83Å; Y2590-K2724 HydrophobicContact CG-CD 4.44Å
2591	T	41.7	Very low	49.5	Very low	96 Å²	96	81.3 Å²	81.3	59%	0.589	45%	0.446	S	S	*	.			trans	-80.5	107.7	164.9	45.9	0	0	0	0	108.4	E2589 C2593	E2589-T2591 PolarHBondContact O-N 3.04Å; T2591-C2593 PolarHBondContact O-N 3.08Å
2592	P	33	Very low	48.2	Very low	70.5 Å²	70.5	83.4 Å²	83.4	46%	0.458	46%	0.461	S	S	.	.			trans	-62.8	128.6	172.7	27.3	-33.3	0	0	0	108.6	Y2590 Y2594	Y2590-P2592 HydrophobicContact CD1-CB 4.36Å; Y2590-P2592 HydrophobicContact CE1-CB 3.98Å; Y2590-P2592 VanDerWaalsContact O-CD 3.25Å; Y2590-P2592 WeakPolarHBondContact O-CD 3.37Å; P2592-Y2594 HydrophobicContact CB-CD2 3.92Å; P2592-Y2594 HydrophobicContact CB-CE2 3.94Å; P2592-Y2594 HydrophobicContact CG-CD2 3.94Å; P2592-Y2594 HydrophobicContact CG-CE2 4.3Å; P2592-Y2594 PolarHBondContact O-N 3.06Å
2593	C	29.7	Very low	46.6	Very low	96.25 Å²	96.25	89.4 Å²	89.4	65%	0.65	49%	0.491	S	S	*	.			trans	-74.5	49.2	178.5	-60.8	0	0	0	0	112.1	K2263 T2591 N2595	K2263-C2593 PolarHBondContact NZ-SG 3.17Å; T2591-C2593 PolarHBondContact O-N 3.08Å; C2593-N2595 PolarHBondContact O-N 2.95Å
2594	Y	26.4	Very low	44.5	Very low	185.75 Å²	185.75	96.2 Å²	96.2	73%	0.728	53%	0.527	S	S	*	.			trans	-85.3	103.5	165.7	-82.2	-82.1	0	0	0	108.2	P2592 P2596	P2592-Y2594 HydrophobicContact CB-CD2 3.92Å; P2592-Y2594 HydrophobicContact CB-CE2 3.94Å; P2592-Y2594 HydrophobicContact CG-CD2 3.94Å; P2592-Y2594 HydrophobicContact CG-CE2 4.3Å; P2592-Y2594 PolarHBondContact O-N 3.06Å; Y2594-P2596 WeakPolarHBondContact O-CD 3.38Å
2595	N	26	Very low	42.2	Very low	125.25 Å²	125.25	99.9 Å²	99.9	67%	0.67	55%	0.554	S	S	*	*			trans	-69	115.6	162.7	-91.2	-13.5	0	0	0	108.1	C2593 S2597	C2593-N2595 PolarHBondContact O-N 2.95Å; N2595-S2597 PolarHBondContact O-N 3.11Å
2596	P	29.3	Very low	39.6	Very low	116 Å²	116	106 Å²	106	75%	0.753	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-9	176.6	-11.3	28.6	0	0	0	112.4	Y2594 T2598 N2599	Y2594-P2596 WeakPolarHBondContact O-CD 3.38Å; P2596-T2598 VanDerWaalsContact C-N 3.27Å; P2596-T2598 PolarHBondContact O-N 3.2Å; P2596-T2598 VanDerWaalsContact O-N 3.13Å; P2596-N2599 PolarHBondContact O-N 3.03Å
2597	S	30.9	Very low	37.2	Very low	87.25 Å²	87.25	112 Å²	112	61%	0.61	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	16.7	-167.4	60	0	0	0	0	115.5	N2595 N2599	N2595-S2597 PolarHBondContact O-N 3.11Å; S2597-N2599 PolarHBondContact O-N 3.23Å
2598	T	30.1	Very low	34.9	Very low	108.5 Å²	108.5	119.8 Å²	119.8	67%	0.666	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.4	19.2	175	55.1	0	0	0	0	113.6	P2596	P2596-T2598 VanDerWaalsContact C-N 3.27Å; P2596-T2598 PolarHBondContact O-N 3.2Å; P2596-T2598 VanDerWaalsContact O-N 3.13Å
2599	N	29.1	Very low	32.8	Very low	138.25 Å²	138.25	126.7 Å²	126.7	74%	0.739	70%	0.7	S	S	*	*	S	Bend	trans	-120.1	20.2	176.7	-85.9	2.3	0	0	0	113.7	P2596 S2597 S2601 V2602	P2596-N2599 PolarHBondContact O-N 3.03Å; S2597-N2599 PolarHBondContact O-N 3.23Å; N2599-S2601 VanDerWaalsContact C-N 3.28Å; N2599-S2601 PolarHBondContact O-N 3.04Å; N2599-V2602 PolarHBondContact O-N 2.99Å
2600	E	30.8	Very low	31.1	Very low	184.25 Å²	184.25	130.7 Å²	130.7	86%	0.861	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	23.6	175.2	-70.6	-169.7	149.7	0	0	113.4
2601	S	29.8	Very low	30	Very low	102.333 Å²	102.333	132.7 Å²	132.7	72%	0.716	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	14.1	-173.3	65.4	0	0	0	0	116.4	N2599	N2599-S2601 VanDerWaalsContact C-N 3.28Å; N2599-S2601 PolarHBondContact O-N 3.04Å
2602	V	30.3	Very low	29.5	Very low	120 Å²	120	136.8 Å²	136.8	73%	0.727	75%	0.752	S	S	*	*	S	Bend	trans	-134.4	52.4	178.2	-163.1	0	0	0	0	111.9	N2599	N2599-V2602 PolarHBondContact O-N 2.99Å
2603	I	29.8	Very low	29.4	Very low	149.333 Å²	149.333	141.9 Å²	141.9	77%	0.766	77%	0.77	S	S	*	*			trans	-143.2	42.9	177.7	-51.8	172.8	0	0	0	111.8	T2605	I2603-T2605 VanDerWaalsContact C-N 3.33Å; I2603-T2605 PolarHBondContact O-N 3.32Å; I2603-T2605 VanDerWaalsContact O-N 3.15Å
2604	N	27.4	Very low	29.5	Very low	157.333 Å²	157.333	144.2 Å²	144.2	84%	0.841	78%	0.775	S	S	*	*			trans	-118.9	67.6	162.6	-83.7	-12.6	0	0	0	111
2605	T	27.8	Very low	29.7	Very low	124 Å²	124	143.8 Å²	143.8	76%	0.761	78%	0.78	S	S	*	*			trans	-160.4	73.6	166.2	50.9	0	0	0	0	111.1	I2603	I2603-T2605 VanDerWaalsContact C-N 3.33Å; I2603-T2605 PolarHBondContact O-N 3.32Å; I2603-T2605 VanDerWaalsContact O-N 3.15Å
2606	C	28.5	Very low	30.1	Very low	129.333 Å²	129.333	145 Å²	145	87%	0.874	79%	0.787	S	S	*	*			trans	-157.8	44.3	157.2	-86.5	0	0	0	0	110.7	E2608	C2606-E2608 VanDerWaalsContact C-N 3.32Å; C2606-E2608 PolarHBondContact O-N 3.01Å
2607	D	29.1	Very low	30.2	Very low	162.667 Å²	162.667	144.5 Å²	144.5	87%	0.87	79%	0.786	S	S	*	*			trans	-79.4	99	162	-75.8	-43.9	0	0	0	109.4
2608	E	30.6	Very low	30.3	Very low	184 Å²	184	146.5 Å²	146.5	86%	0.86	79%	0.794	S	S	*	*			trans	-177.8	102.9	165.5	-84.6	-179.6	-176.2	0	0	112.3	C2606	C2606-E2608 VanDerWaalsContact C-N 3.32Å; C2606-E2608 PolarHBondContact O-N 3.01Å
2609	L	30.2	Very low	30.3	Very low	165.333 Å²	165.333	146.9 Å²	146.9	87%	0.866	80%	0.796	S	S	*	*			trans	169.8	94.8	151.7	-77	175.7	0	0	0	112.8
2610	E	30.7	Very low	30.4	Very low	172 Å²	172	146.8 Å²	146.8	80%	0.804	80%	0.796	S	S	*	*			trans	-57.1	137.4	160.8	-65.3	-168.2	145.9	0	0	114.8	H2612	E2610-H2612 PolarHBondContact O-N 2.89Å; E2610-H2612 IonicContact OE2-CE1 3.86Å; E2610-H2612 IonicContact OE2-ND1 3.97Å
2611	P	28.5	Very low	30.4	Very low	113 Å²	113	143.2 Å²	143.2	73%	0.734	79%	0.786	S	S	*	*			trans	-87.8	125.6	175.7	34.4	-31.5	0	0	0	111.5	Q2613	P2611-Q2613 PolarHBondContact O-N 3.12Å; P2611-Q2613 VanDerWaalsContact O-N 3.13Å
2612	H	32.1	Very low	30.5	Very low	181.667 Å²	181.667	144.8 Å²	144.8	84%	0.841	79%	0.786	S	S	*	*			trans	-87.2	106.2	163.8	-84.5	-55.2	0	0	0	110.8	E2610	E2610-H2612 PolarHBondContact O-N 2.89Å; E2610-H2612 IonicContact OE2-CE1 3.86Å; E2610-H2612 IonicContact OE2-ND1 3.97Å
2613	Q	30.3	Very low	30.5	Very low	177.667 Å²	177.667	146.5 Å²	146.5	83%	0.83	79%	0.786	S	S	*	*			trans	-82.8	130.1	163.1	-68.1	-178.4	-11	0	0	109.2	P2611	P2611-Q2613 PolarHBondContact O-N 3.12Å; P2611-Q2613 VanDerWaalsContact O-N 3.13Å
2614	N	31.7	Very low	30.5	Very low	143.667 Å²	143.667	147.6 Å²	147.6	77%	0.768	79%	0.786	S	S	*	*			trans	-119.6	116.2	147	-87.4	3.8	0	0	0	109.2
2615	E	31.5	Very low	30.6	Very low	178 Å²	178	144.8 Å²	144.8	83%	0.832	78%	0.779	S	S	*	*			trans	6.7	122.5	139.2	-63	-177.8	150.9	0	0	114.4
2616	D	33.5	Very low	30.6	Very low	151 Å²	151	145.3 Å²	145.3	81%	0.807	78%	0.776	S	S	*	*				-139.6	131.3	107.7	-117.9	-27.7	0	0	0	113.5
2617	S	31.7	Very low	30.7	Very low	104 Å²	104	150.2 Å²	150.2	73%	0.727	78%	0.776	S	S	*	*			trans	57.5	141.6	149.6	78.1	0	0	0	0	120.4
2618	V	33.7	Very low	30.7	Very low	130.667 Å²	130.667	147.4 Å²	147.4	79%	0.792	77%	0.77	S	S	*	*			cis	-165.3	134.1	12	129.2	0	0	0	0	109.3
2619	V	30.1	Very low	30.7	Very low	116 Å²	116	143.8 Å²	143.8	70%	0.703	77%	0.765	S	S	*	*			trans	37.1	129.6	151.2	-179.7	0	0	0	0	116.6
2620	D	30.7	Very low	30.7	Very low	137 Å²	137	141.2 Å²	141.2	73%	0.733	76%	0.761	S	S	*	*				175.1	131.8	101	-104.6	-25.4	0	0	0	115.6
2621	T	29.9	Very low	31	Very low	108.333 Å²	108.333	138.5 Å²	138.5	67%	0.665	76%	0.758	S	S	*	*				49.9	144.8	123.2	55.6	0	0	0	0	116.5
2622	L	32.6	Very low	31	Very low	135.667 Å²	135.667	140.9 Å²	140.9	71%	0.71	76%	0.764	S	S	*	*				162.5	119.4	106.1	-74.9	160.9	0	0	0	115.5
2623	E	30.6	Very low	30.8	Very low	155 Å²	155	137.4 Å²	137.4	72%	0.724	76%	0.76	S	S	*	*				56.7	145.3	117.3	-73.1	-175.1	163.3	0	0	124.2
2624	F	28.6	Very low	30.9	Very low	173.667 Å²	173.667	133.5 Å²	133.5	76%	0.762	75%	0.752	S	S	*	*			trans	88.3	144.7	154	-93.1	-80.8	0	0	0	116.3
2625	S	30	Very low	30.9	Very low	98.3333 Å²	98.3333	134.7 Å²	134.7	69%	0.688	75%	0.753	S	S	*	*				149.9	145.8	117.1	57.9	0	0	0	0	112.9
2626	N	28	Very low	31	Very low	133.667 Å²	133.667	132.9 Å²	132.9	72%	0.715	75%	0.749	S	S	*	*				61	137.1	124.4	-70.9	-30.3	0	0	0	115.2
2627	R	31.6	Very low	30.9	Very low	232 Å²	232	132.7 Å²	132.7	88%	0.875	75%	0.748	S	S	*	*				-160.9	107.8	104.5	-98.1	174	-175.3	-162.9	1.5	111.3
2628	S	27.3	Very low	30.9	Very low	104.667 Å²	104.667	132.1 Å²	132.1	73%	0.732	74%	0.744	S	S	*	*				19.5	137.7	124.6	63.2	0	0	0	0	117.2
2629	S	31.1	Very low	30.8	Very low	108 Å²	108	130.5 Å²	130.5	76%	0.755	74%	0.739	S	S	*	*			trans	122.9	115.6	143.9	64.4	0	0	0	0	118.4
2630	S	29.8	Very low	30.9	Very low	111 Å²	111	132.9 Å²	132.9	78%	0.776	74%	0.742	S	S	*	*			trans	51.9	159	151.1	59.6	0	0	0	0	119.1
2631	P	37	Very low	30.9	Very low	116.333 Å²	116.333	133.1 Å²	133.1	76%	0.755	74%	0.738	S	S	*	*			trans	-104.1	167.8	-157.2	34.1	-24.6	0	0	0	114.3
2632	L	29.8	Very low	30.9	Very low	163.333 Å²	163.333	136.3 Å²	136.3	86%	0.855	75%	0.745	S	S	*	*			trans	161.8	144.3	157.2	-96.4	151.8	0	0	0	114.4
2633	S	28	Very low	30.7	Very low	106.667 Å²	106.667	133 Å²	133	75%	0.746	74%	0.744	S	S	*	*			trans	73.1	148.9	169.9	56	0	0	0	0	116.5
2634	S	31.1	Very low	30.7	Very low	97.3333 Å²	97.3333	133.3 Å²	133.3	68%	0.681	75%	0.749	S	S	*	*			cis	179.1	155.2	-27.7	42.6	0	0	0	0	107.2
2635	E	32.4	Very low	30.8	Very low	168.333 Å²	168.333	130.1 Å²	130.1	79%	0.787	74%	0.744	S	S	*	*			trans	103.6	141.5	144.4	-85.1	171.1	177.5	0	0	116.1
2636	D	32.7	Very low	30.9	Very low	139.333 Å²	139.333	132 Å²	132	75%	0.745	75%	0.746	S	S	*	*			trans	71.5	130.6	148.4	-61.1	-8.1	0	0	0	122.1
2637	D	32.9	Very low	31.3	Very low	147.333 Å²	147.333	133.1 Å²	133.1	79%	0.788	75%	0.747	S	S	*	*				88.8	158.2	94	-108.6	-8.4	0	0	0	118.7
2638	S	31.5	Very low	31.4	Very low	91 Å²	91	127.6 Å²	127.6	64%	0.636	74%	0.735	S	S	*	*			trans	-179.7	141.1	-158.4	65	0	0	0	0	116
2639	S	31.1	Very low	31.8	Very low	97 Å²	97	128.8 Å²	128.8	68%	0.678	73%	0.733	S	S	*	*			trans	68.9	147.8	138.5	79.8	0	0	0	0	121.3
2640	Q	31.7	Very low	32.1	Very low	166.333 Å²	166.333	132.4 Å²	132.4	78%	0.777	74%	0.735	S	S	*	*			trans	101.2	149.3	152.2	-75.5	-175.1	17.2	0	0	115.4
2641	H	30.7	Very low	32.4	Very low	141.333 Å²	141.333	130.3 Å²	130.3	65%	0.654	73%	0.732	S	S	*	*			cis	171.3	150.2	-0.8	-102.5	-64	0	0	0	113.9
2642	H	30.1	Very low	32.4	Very low	175 Å²	175	130.7 Å²	130.7	81%	0.81	73%	0.727	S	S	*	*			trans	39.6	136.1	152.4	-65.5	-59.5	0	0	0	122
2643	G	28.1	Very low	32.8	Very low	66.6667 Å²	66.6667	130.3 Å²	130.3	69%	0.687	72%	0.719	S	S	*	*				163.4	177.2	117.3	0	0	0	0	0	112.3
2644	I	31.7	Very low	33.2	Very low	161.333 Å²	161.333	131.9 Å²	131.9	83%	0.827	72%	0.719	S	S	*	*			trans	168.7	143.7	148	-99.2	163.8	0	0	0	110.1
2645	T	30.2	Very low	33.4	Very low	107.333 Å²	107.333	131.9 Å²	131.9	66%	0.658	72%	0.719	S	S	*	*			trans	-96.8	162.6	166.8	47.9	0	0	0	0	114.7
2646	D	33.2	Very low	33.5	Very low	137.667 Å²	137.667	131 Å²	131	74%	0.736	72%	0.717	S	S	*	*				92.3	163.1	106.7	-76.8	-22.6	0	0	0	116.5
2647	E	34.8	Very low	33.5	Very low	156.667 Å²	156.667	133.3 Å²	133.3	73%	0.732	72%	0.72	S	S	*	*			cis	162.8	154.4	38.1	-110.8	-167.5	175.2	0	0	113.2
2648	N	34.4	Very low	33.5	Very low	117 Å²	117	129.5 Å²	129.5	63%	0.626	72%	0.716	S	S	*	*			trans	88.2	152.4	130.1	-93.7	-21.6	0	0	0	119.2
2649	L	36.1	Very low	33.7	Very low	129 Å²	129	131.8 Å²	131.8	68%	0.675	73%	0.726	S	S	*	*				154.4	141.4	73	-93.8	151.7	0	0	0	114.7
2650	F	35.9	Very low	33.8	Very low	184 Å²	184	131.7 Å²	131.7	81%	0.807	73%	0.725	S	S	*	*				46.8	163.4	115.9	-81.4	-72.4	0	0	0	118.5
2651	G	36.2	Very low	34	Very low	68.3333 Å²	68.3333	129.9 Å²	129.9	70%	0.704	72%	0.721	S	S	*	*			cis	147.3	136.9	34.9	0	0	0	0	0	115.8
2652	D	37.3	Very low	34.2	Very low	123 Å²	123	132.2 Å²	132.2	66%	0.658	73%	0.725	S	S	*	*			cis	162.5	150.9	25.9	-139.5	20.1	0	0	0	114.7
2653	K	38.2	Very low	34.4	Very low	156 Å²	156	130.4 Å²	130.4	68%	0.678	72%	0.722	S	S	*	*			trans	123.5	133.9	148	-80.1	178.9	-173.4	101.6	0	116.8
2654	N	36.1	Very low	34.6	Very low	139 Å²	139	134.8 Å²	134.8	74%	0.743	73%	0.725	S	S	*	*				106.4	145.5	98.2	-80.8	-10.6	0	0	0	118.2
2655	S	35.3	Very low	34.7	Very low	99 Å²	99	134.4 Å²	134.4	69%	0.692	72%	0.723	S	S	*	*			cis	159.7	160.9	16.3	61.5	0	0	0	0	114
2656	M	34.6	Very low	34.8	Very low	148.667 Å²	148.667	136.7 Å²	136.7	73%	0.732	73%	0.728	S	S	*	*			cis	161.9	141.8	30.6	-117	-163.3	-163.6	0	0	114.8
2657	K	33.6	Very low	34.8	Very low	187.333 Å²	187.333	136.7 Å²	136.7	81%	0.814	73%	0.728	S	S	*	*			trans	64.4	133.6	146.2	-68.6	172	179.4	171.2	0	121.1
2658	G	33	Very low	34.7	Very low	68.3333 Å²	68.3333	137.9 Å²	137.9	70%	0.704	73%	0.734	S	S	*	*			cis	162	141.4	10.9	0	0	0	0	0	115.6
2659	T	34.8	Very low	34.5	Very low	138.667 Å²	138.667	135.4 Å²	135.4	85%	0.851	74%	0.736	S	S	*	*			trans	29.1	145.6	163.8	51.8	0	0	0	0	118.4
2660	S	34.2	Very low	34.3	Very low	95 Å²	95	134.6 Å²	134.6	66%	0.664	74%	0.742	S	S	*	*			cis	153.2	153.6	35	36.7	0	0	0	0	112
2661	D	34.7	Very low	34.1	Very low	128.333 Å²	128.333	133.3 Å²	133.3	69%	0.686	74%	0.743	S	S	*	*			cis	172.4	150.2	33.6	-93.7	-10.1	0	0	0	115.8
2662	Y	36	Very low	34	Very low	189 Å²	189	138.7 Å²	138.7	74%	0.741	75%	0.75	S	S	*	*			trans	27.9	145.9	155.5	-57.9	-73.3	0	0	0	124.1
2663	D	33.2	Very low	33.7	Very low	137.667 Å²	137.667	139.2 Å²	139.2	74%	0.736	76%	0.757	S	S	*	*				114.6	148.9	128.6	-78.1	-17.3	0	0	0	118.6
2664	E	33.2	Very low	33.5	Very low	160.333 Å²	160.333	137.6 Å²	137.6	75%	0.749	76%	0.763	S	S	*	*			trans	63.7	144.8	171.8	-96	-176	-179	0	0	115.8
2665	L	33.8	Very low	33.3	Very low	152 Å²	152	136.8 Å²	136.8	80%	0.796	77%	0.768	S	S	*	*				105	146.6	124.4	-62.6	167.8	0	0	0	116.9
2666	M	31.6	Very low	33	Very low	155.667 Å²	155.667	141 Å²	141	77%	0.767	78%	0.777	S	S	*	*			trans	-164.8	159.3	-178.5	-78.3	-78.4	-78.3	0	0	113.8
2667	D	33.2	Very low	32.7	Very low	138 Å²	138	140 Å²	140	74%	0.738	78%	0.783	S	S	*	*			trans	102.7	132.8	153	-81	-11.3	0	0	0	116.6
2668	E	32.8	Very low	32.4	Very low	181 Å²	181	136.2 Å²	136.2	85%	0.846	78%	0.78	S	S	*	*				94.8	139.3	102.9	-77	-161.2	168.6	0	0	113.8
2669	G	30.5	Very low	32.3	Very low	66 Å²	66	140.7 Å²	140.7	68%	0.68	78%	0.783	S	S	*	*				116	124.9	118.6	0	0	0	0	0	115.8
2670	S	32.7	Very low	32	Very low	112 Å²	112	142.4 Å²	142.4	78%	0.783	78%	0.778	S	S	*	*			trans	71.7	135	156.9	52.2	0	0	0	0	114.5
2671	D	30.9	Very low	32	Very low	156.333 Å²	156.333	144.9 Å²	144.9	84%	0.836	78%	0.784	S	S	*	*			cis	120.4	160.3	41.6	-99.1	-35.4	0	0	0	114.4
2672	E	34	Very low	31.8	Very low	180.333 Å²	180.333	146.6 Å²	146.6	84%	0.843	79%	0.793	S	S	*	*			trans	86	104	167.1	-54.8	-156.1	159.6	0	0	120
2673	T	32.2	Very low	31.3	Very low	134 Å²	134	145.7 Å²	145.7	82%	0.822	80%	0.797	S	S	*	*			trans	-99.3	165.5	155.4	56.4	0	0	0	0	115.1
2674	P	33.8	Very low	31.3	Very low	123.667 Å²	123.667	145.4 Å²	145.4	80%	0.803	80%	0.8	S	S	*	*			trans	-108.4	162.2	-136	36.6	-29.4	0	0	0	113.9
2675	S	31.5	Very low	31.2	Very low	121 Å²	121	143.7 Å²	143.7	85%	0.846	80%	0.801	S	S	*	*			trans	-121.8	143.9	165.3	56.7	0	0	0	0	113.1
2676	Q	28.4	Very low	31.1	Very low	188.333 Å²	188.333	142.7 Å²	142.7	88%	0.88	80%	0.796	S	S	*	*			trans	-83.4	147.7	175.5	-65.3	170	-24.7	0	0	111.6
2677	C	27.7	Very low	30.9	Very low	128 Å²	128	143.4 Å²	143.4	87%	0.865	80%	0.795	S	S	*	*			trans	-160.3	137.6	148	-92.1	0	0	0	0	110.2
2678	S	28.6	Very low	30.7	Very low	106 Å²	106	142.3 Å²	142.3	74%	0.741	80%	0.797	S	S	*	*			trans	-170.7	147.6	157.7	57.4	0	0	0	0	113.6	K2680	S2678-K2680 PolarHBondContact O-N 3.43Å
2679	E	31	Very low	30.6	Very low	164.333 Å²	164.333	140.7 Å²	140.7	77%	0.768	79%	0.794	S	S	*	*			trans	35.7	119.5	157.6	-75.8	-169.7	144.3	0	0	115.4
2680	K	28.9	Very low	30.4	Very low	173.667 Å²	173.667	145 Å²	145	76%	0.755	80%	0.802	S	S	*	*				145	158.9	99.5	-87.4	166.7	-169.5	165.1	0	112.7	S2678	S2678-K2680 PolarHBondContact O-N 3.43Å
2681	D	32.3	Very low	30.3	Very low	148 Å²	148	146.5 Å²	146.5	79%	0.791	81%	0.805	S	S	*	*			trans	84.6	128.9	172.4	-58.3	-14.5	0	0	0	117.4
2682	L	31.2	Very low	30.1	Very low	164 Å²	164	143.1 Å²	143.1	86%	0.859	80%	0.799	S	S	*	*			cis	-175.1	138.9	-0.6	-94.6	138	0	0	0	113.6
2683	M	26.8	Very low	29.8	Very low	170.333 Å²	170.333	143.4 Å²	143.4	84%	0.839	80%	0.798	S	S	*	*			trans	-96.6	142.2	165.7	-71.7	-126.5	-63.3	0	0	112.2
2684	T	32.8	Very low	29.6	Very low	130.667 Å²	130.667	144.7 Å²	144.7	80%	0.802	80%	0.8	S	S	*	*			trans	-164.4	127.3	135.6	28.9	0	0	0	0	109.9
2685	V	29.9	Very low	29.4	Very low	124.333 Å²	124.333	142.2 Å²	142.2	75%	0.754	80%	0.796	S	S	*	*				79.5	107.9	109.7	-178.7	0	0	0	0	114.5
2686	D	31.5	Very low	29.1	Very low	130 Å²	130	144 Å²	144	70%	0.695	80%	0.797	S	S	*	*				-172.2	158.5	85	-110	-3.7	0	0	0	113.6
2687	K	28.2	Very low	29.2	Very low	170.667 Å²	170.667	142.7 Å²	142.7	74%	0.742	80%	0.795	S	S	*	*			cis	-179.5	131.1	-0.3	-125.8	-175.6	179.2	169.9	0	110.8
2688	C	29.2	Very low	29.1	Very low	116 Å²	116	141.6 Å²	141.6	78%	0.784	79%	0.788	S	S	*	*			trans	177.3	111.7	159.9	-89.6	0	0	0	0	112
2689	N	31	Very low	29	Very low	146 Å²	146	143 Å²	143	78%	0.781	79%	0.793	S	S	*	*				114.8	133.9	55.7	-91.3	-8.5	0	0	0	115.1
2690	N	26.3	Very low	28.8	Very low	158.333 Å²	158.333	138.1 Å²	138.1	85%	0.847	79%	0.786	S	S	*	*			trans	-65.4	144.4	178	-58.8	-29.9	0	0	0	114.7
2691	V	30.7	Very low	28.7	Very low	142 Å²	142	138.9 Å²	138.9	86%	0.861	79%	0.79	S	S	*	*			trans	-137.1	137	141.9	-175.3	0	0	0	0	107.8	F2693	V2691-F2693 HydrophobicContact CG1-CD2 3.67Å; V2691-F2693 HydrophobicContact CG1-CE2 3.86Å
2692	A	26.9	Very low	28.4	Very low	85.6667 Å²	85.6667	140.3 Å²	140.3	71%	0.708	79%	0.792	S	S	*	*			trans	-110.8	153.1	-176	0	0	0	0	0	112.3
2693	F	28.1	Very low	28.1	Very low	187 Å²	187	139 Å²	139	82%	0.82	78%	0.783	S	S	*	*			trans	-110.8	140	170.5	-83.4	-85.2	0	0	0	111.8	V2691	V2691-F2693 HydrophobicContact CG1-CD2 3.67Å; V2691-F2693 HydrophobicContact CG1-CE2 3.86Å
2694	N	27.4	Very low	28.3	Very low	161 Å²	161	137.3 Å²	137.3	86%	0.861	77%	0.771	S	S	*	*			trans	-136.9	152.5	138.6	-93.9	-18	0	0	0	110.1
2695	G	28.8	Very low	28.1	Very low	70 Å²	70	138.3 Å²	138.3	72%	0.722	77%	0.772	S	S	*	*			trans	134.1	102.3	166.4	0	0	0	0	0	114.3	L2697	G2695-L2697 PolarHBondContact O-N 2.95Å
2696	D	26.6	Very low	28	Very low	160.333 Å²	160.333	140.2 Å²	140.2	86%	0.857	77%	0.77	S	S	*	*			trans	-37.9	118.1	159.8	-63.7	-45.8	0	0	0	114.6
2697	L	28.6	Very low	27.8	Very low	160.667 Å²	160.667	142.6 Å²	142.6	84%	0.841	77%	0.77	S	S	*	*			trans	-160.8	120.8	143.9	-115.3	121.7	0	0	0	111.5	G2695 T2699	G2695-L2697 PolarHBondContact O-N 2.95Å; L2697-T2699 VanDerWaalsContact C-N 3.28Å; L2697-T2699 HydrophobicContact CD2-CG2 4.36Å; L2697-T2699 PolarHBondContact O-N 2.86Å
2698	S	26.4	Very low	27.8	Very low	104 Å²	104	140.5 Å²	140.5	73%	0.727	77%	0.766	S	S	*	*			trans	-41.7	102.7	171.7	55	0	0	0	0	115.5
2699	T	27.2	Very low	27.7	Very low	136.333 Å²	136.333	140.5 Å²	140.5	84%	0.836	76%	0.758	S	S	*	*			trans	92.6	97.8	158.7	59.1	0	0	0	0	116.3	L2697	L2697-T2699 VanDerWaalsContact C-N 3.28Å; L2697-T2699 HydrophobicContact CD2-CG2 4.36Å; L2697-T2699 PolarHBondContact O-N 2.86Å
2700	G	25.2	Very low	27.4	Very low	60.6667 Å²	60.6667	143.8 Å²	143.8	63%	0.625	76%	0.76	S	S	*	*			trans	-149.8	154.9	173.7	0	0	0	0	0	115.4	Q2702	G2700-Q2702 PolarHBondContact O-N 3.26Å
2701	F	27.1	Very low	27.3	Very low	191.667 Å²	191.667	142.1 Å²	142.1	84%	0.841	76%	0.757	S	S	*	*			trans	66.3	52.6	167.1	-57.9	-81	0	0	0	118.2	M2703	F2701-M2703 HydrophobicContact CB-CB 4.31Å; F2701-M2703 HydrophobicContact CD1-CB 4.42Å; F2701-M2703 HydrophobicContact CD1-CG 4.26Å; F2701-M2703 PolarHBondContact O-N 2.89Å
2702	Q	26.4	Very low	27.1	Very low	177.333 Å²	177.333	137.2 Å²	137.2	83%	0.829	74%	0.736	S	S	*	*			trans	-116.8	79.1	154.1	-72.7	-166.7	-4.4	0	0	111.1	G2700	G2700-Q2702 PolarHBondContact O-N 3.26Å
2703	M	25.8	Very low	27.2	Very low	135 Å²	135	136.3 Å²	136.3	67%	0.665	72%	0.724	S	S	*	*			trans	-141.5	51.2	179.9	-104.8	-87.5	-66	0	0	112.3	F2701 Y2707	F2701-M2703 HydrophobicContact CB-CB 4.31Å; F2701-M2703 HydrophobicContact CD1-CB 4.42Å; F2701-M2703 HydrophobicContact CD1-CG 4.26Å; F2701-M2703 PolarHBondContact O-N 2.89Å; M2703-Y2707 HydrophobicContact CE-CD2 4.38Å; M2703-Y2707 HydrophobicContact CE-CE2 4.24Å; M2703-Y2707 HydrophobicContact SD-CD2 3.82Å; M2703-Y2707 HydrophobicContact SD-CE2 3.44Å; M2703-Y2707 WeakPolarHBondContact SD-CE2 3.21Å
2704	F	29.7	Very low	27.2	Very low	135 Å²	135	132 Å²	132	59%	0.592	72%	0.717	S	S	*	*	S	Bend	trans	-152.5	-16.6	164.5	-101.8	-77	0	0	0	114.5	L2129 A2130 K2706 Y2707 I2708	L2129-F2704 HydrophobicContact CB-CE2 4.1Å; L2129-F2704 HydrophobicContact CD2-CE2 4.45Å; A2130-F2704 HydrophobicContact CB-CB 3.75Å; A2130-F2704 HydrophobicContact CB-CD2 3.55Å; A2130-F2704 HydrophobicContact CB-CE2 4.39Å; A2130-F2704 HydrophobicContact CB-CG 3.8Å; A2130-F2704 WeakPolarHBondContact O-CD1 3.46Å; A2130-F2704 WeakPolarHBondContact O-CD2 3.12Å; A2130-F2704 WeakPolarHBondContact O-CE1 3.26Å; A2130-F2704 VanDerWaalsContact O-CE2 3.3Å; A2130-F2704 WeakPolarHBondContact O-CE2 3.36Å; A2130-F2704 WeakPolarHBondContact O-CG 3.27Å; A2130-F2704 VanDerWaalsContact O-CZ 3.31Å; A2130-F2704 WeakPolarHBondContact O-CZ 3.43Å; F2704-K2706 VanDerWaalsContact C-N 3.26Å; F2704-K2706 PolarHBondContact O-N 2.97Å; F2704-K2706 VanDerWaalsContact O-N 3.14Å; F2704-Y2707 PolarHBondContact O-N 3Å; F2704-I2708 HydrophobicContact CE1-CD1 4.47Å
2705	D	29	Very low	27.3	Very low	152.667 Å²	152.667	127.6 Å²	127.6	82%	0.816	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	2.1	-173.3	-130.2	8.1	0	0	0	116.1
2706	K	27.8	Very low	27.6	Very low	163.333 Å²	163.333	130.1 Å²	130.1	71%	0.71	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.4	-8.4	-179.9	-81.1	-177.9	177.2	169.6	0	116.1	F2704 N2709	F2704-K2706 VanDerWaalsContact C-N 3.26Å; F2704-K2706 PolarHBondContact O-N 2.97Å; F2704-K2706 VanDerWaalsContact O-N 3.14Å; K2706-N2709 WeakPolarHBondContact O-CB 3.42Å; K2706-N2709 PolarHBondContact O-ND2 2.93Å
2707	Y	28.2	Very low	27.8	Very low	180 Å²	180	127.9 Å²	127.9	71%	0.706	68%	0.68	S	S	*	*	S	Bend	trans	-124.7	27.4	-174	-77.1	-79.7	0	0	0	115.1	M2703 F2704 N2709	M2703-Y2707 HydrophobicContact CE-CD2 4.38Å; M2703-Y2707 HydrophobicContact CE-CE2 4.24Å; M2703-Y2707 HydrophobicContact SD-CD2 3.82Å; M2703-Y2707 HydrophobicContact SD-CE2 3.44Å; M2703-Y2707 WeakPolarHBondContact SD-CE2 3.21Å; F2704-Y2707 PolarHBondContact O-N 3Å; Y2707-N2709 PolarHBondContact O-N 3.44Å
2708	I	27.9	Very low	28	Very low	127.333 Å²	127.333	125.6 Å²	125.6	65%	0.653	67%	0.668	S	S	*	*	S	Bend	trans	-116.4	56	171.4	-56.2	174.2	0	0	0	112.5	F2704 L2717	F2704-I2708 HydrophobicContact CE1-CD1 4.47Å; I2708-L2717 HydrophobicContact CG2-CD1 4.1Å
2709	N	25.9	Very low	28.6	Very low	115.667 Å²	115.667	124.6 Å²	124.6	62%	0.619	65%	0.654	S	S	*	*			trans	-120.5	69.6	178.4	-85	-32.5	0	0	0	117.1	K2706 Y2707 P2711	K2706-N2709 WeakPolarHBondContact O-CB 3.42Å; K2706-N2709 PolarHBondContact O-ND2 2.93Å; Y2707-N2709 PolarHBondContact O-N 3.44Å; N2709-P2711 WeakPolarHBondContact O-CD 3.43Å
2710	R	25.2	Very low	29.5	Very low	216 Å²	216	118.8 Å²	118.8	82%	0.815	62%	0.622	S	S	*	*			trans	-113	132.8	155.2	-75.5	-176.7	-179.3	-172.5	-2.4	114	K2551 G2712	K2551-R2710 PolarHBondContact NZ-O 3.48Å; K2551-R2710 VanDerWaalsContact NZ-O 3.15Å; R2710-G2712 PolarHBondContact O-N 3.36Å
2711	P	23.9	Very low	30.8	Very low	122.333 Å²	122.333	119.3 Å²	119.3	79%	0.794	61%	0.612	S	S	*	*			trans	-86.6	95.4	147.9	32.9	-27.6	0	0	0	109.9	N2709	N2709-P2711 WeakPolarHBondContact O-CD 3.43Å
2712	G	27	Very low	32.4	Very low	40 Å²	40	113 Å²	113	41%	0.412	59%	0.588	S	S	.	*			trans	153.1	16.6	-178.9	0	0	0	0	0	117.1	R2710 E2716	R2710-G2712 PolarHBondContact O-N 3.36Å; G2712-E2716 WeakPolarHBondContact CA-OE2 3.44Å; G2712-E2716 WeakPolarHBondContact O-CG 3.25Å
2713	S	28.4	Very low	34.5	Very low	66 Å²	66	104.6 Å²	104.6	46%	0.462	55%	0.548	S	S	.	.			trans	-103.8	135.2	175.9	70.5	0	0	0	0	113	S2715 E2716 L2717	S2713-S2715 WeakPolarHBondContact CB-OG 3.48Å; S2713-S2715 PolarHBondContact O-N 2.88Å; S2713-S2715 PolarHBondContact OG-N 2.89Å; S2713-S2715 PolarHBondContact OG-OG 3.41Å; S2713-E2716 PolarHBondContact O-N 3.22Å; S2713-E2716 PolarHBondContact OG-N 2.79Å; S2713-L2717 PolarHBondContact O-N 3.09Å
2714	S	28.3	Very low	36.9	Very low	95.6667 Å²	95.6667	99.5 Å²	99.5	67%	0.669	52%	0.523	S	S	*	.	H	α-helix	trans	-67.1	-19.8	175.9	43.1	0	0	0	0	113.6	E2716 L2717 L2718	S2714-E2716 PolarHBondContact O-N 2.97Å; S2714-L2717 PolarHBondContact O-N 2.9Å; S2714-L2718 WeakPolarHBondContact O-CD1 3.44Å; S2714-L2718 WeakPolarHBondContact O-CG 3.46Å; S2714-L2718 PolarHBondContact O-N 2.85Å
2715	S	31.1	Very low	39.4	Very low	69.6667 Å²	69.6667	93.1 Å²	93.1	49%	0.487	49%	0.494	S	S	.	.	H	α-helix	trans	-73.7	-28.6	179.5	61.1	0	0	0	0	114.3	S2713 L2717 L2718 N2719	S2713-S2715 WeakPolarHBondContact CB-OG 3.48Å; S2713-S2715 PolarHBondContact O-N 2.88Å; S2713-S2715 PolarHBondContact OG-N 2.89Å; S2713-S2715 PolarHBondContact OG-OG 3.41Å; S2715-L2717 VanDerWaalsContact C-N 3.28Å; S2715-L2717 PolarHBondContact O-N 2.99Å; S2715-L2718 PolarHBondContact O-N 3.48Å; S2715-N2719 PolarHBondContact O-N 2.99Å; S2715-N2719 PolarHBondContact O-OD1 3.03Å; S2715-N2719 VanDerWaalsContact O-OD1 3.07Å
2716	E	33.6	Very low	42.1	Very low	123 Å²	123	85.8 Å²	85.8	58%	0.575	46%	0.456	S	S	*	.	H	α-helix	trans	-74.8	-19.5	179.8	-71.4	-172.6	168.5	0	0	113.6	G2712 S2713 S2714	G2712-E2716 WeakPolarHBondContact CA-OE2 3.44Å; G2712-E2716 WeakPolarHBondContact O-CG 3.25Å; S2713-E2716 PolarHBondContact O-N 3.22Å; S2713-E2716 PolarHBondContact OG-N 2.79Å; S2714-E2716 PolarHBondContact O-N 2.97Å
2717	L	31.7	Very low	44.8	Very low	113.667 Å²	113.667	78.1 Å²	78.1	60%	0.595	42%	0.422	S	S	*	.	H	α-helix	trans	-87.3	-33.1	174.4	-93.4	141.8	0	0	0	113	Y2168 I2708 S2713 S2714 S2715 N2719 G2720	Y2168-L2717 HydrophobicContact CE1-CD2 4.23Å; I2708-L2717 HydrophobicContact CG2-CD1 4.1Å; S2713-L2717 PolarHBondContact O-N 3.09Å; S2714-L2717 PolarHBondContact O-N 2.9Å; S2715-L2717 VanDerWaalsContact C-N 3.28Å; S2715-L2717 PolarHBondContact O-N 2.99Å; L2717-N2719 VanDerWaalsContact C-N 3.32Å; L2717-N2719 PolarHBondContact O-N 3.37Å; L2717-G2720 PolarHBondContact O-N 2.79Å
2718	L	33.4	Very low	47.4	Very low	113 Å²	113	69.5 Å²	69.5	59%	0.592	39%	0.388	S	S	*	.	H	α-helix	trans	-72.7	-32.4	176.9	-83.7	157.9	0	0	0	112.9	S2714 S2715 G2720 T2721 N2722	S2714-L2718 WeakPolarHBondContact O-CD1 3.44Å; S2714-L2718 WeakPolarHBondContact O-CG 3.46Å; S2714-L2718 PolarHBondContact O-N 2.85Å; S2715-L2718 PolarHBondContact O-N 3.48Å; L2718-G2720 VanDerWaalsContact C-N 3.25Å; L2718-G2720 PolarHBondContact O-N 2.99Å; L2718-T2721 PolarHBondContact O-OG1 3.08Å; L2718-T2721 VanDerWaalsContact O-OG1 3.06Å; L2718-N2722 PolarHBondContact O-ND2 2.93Å; L2718-N2722 PolarHBondContact O-OD1 3.46Å
2719	N	37.8	Very low	49.9	Very low	81.6667 Å²	81.6667	63.7 Å²	63.7	44%	0.437	36%	0.358	S	S	.	.	H	α-helix	trans	-73.2	-19	176.5	-72.8	38.4	0	0	0	112.8	E2589 S2715 L2717 T2721	E2589-N2719 PolarHBondContact OE2-ND2 3.04Å; S2715-N2719 PolarHBondContact O-N 2.99Å; S2715-N2719 PolarHBondContact O-OD1 3.03Å; S2715-N2719 VanDerWaalsContact O-OD1 3.07Å; L2717-N2719 VanDerWaalsContact C-N 3.32Å; L2717-N2719 PolarHBondContact O-N 3.37Å; N2719-T2721 VanDerWaalsContact C-N 3.33Å; N2719-T2721 PolarHBondContact O-N 3.09Å
2720	G	45.4	Very low	52.2	Low	15.6667 Å²	15.6667	58.2 Å²	58.2	16%	0.162	33%	0.329	C	S	.	.	H	α-helix	trans	-72.7	-17.6	-179.6	0	0	0	0	0	115.2	L2717 L2718 S2748	L2717-G2720 PolarHBondContact O-N 2.79Å; L2718-G2720 VanDerWaalsContact C-N 3.25Å; L2718-G2720 PolarHBondContact O-N 2.99Å; G2720-S2748 PolarHBondContact O-OG 3.18Å
2721	T	52.6	Low	54.1	Low	70 Å²	70	49.3 Å²	49.3	43%	0.429	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-98	-13.8	-176.9	50.2	0	0	0	0	114.1	L2718 N2719	L2718-T2721 PolarHBondContact O-OG1 3.08Å; L2718-T2721 VanDerWaalsContact O-OG1 3.06Å; N2719-T2721 VanDerWaalsContact C-N 3.33Å; N2719-T2721 PolarHBondContact O-N 3.09Å
2722	N	62.1	Low	55.8	Low	59.6667 Å²	59.6667	44.7 Å²	44.7	32%	0.319	27%	0.268	S	S	.	.			trans	-98.9	-4.7	-168.8	-63	-1.4	0	0	0	114	E2589 Y2590 L2718 K2724	E2589-N2722 WeakPolarHBondContact CA-O 3.25Å; Y2590-N2722 PolarHBondContact N-O 2.83Å; L2718-N2722 PolarHBondContact O-ND2 2.93Å; L2718-N2722 PolarHBondContact O-OD1 3.46Å; N2722-K2724 PolarHBondContact O-N 2.96Å
2723	V	69.8	Low	57	Low	1 Å²	1	44.1 Å²	44.1	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	108.6	-178.7	-174.5	0	0	0	0	109.8	N2531 Y2534 F2536 E2589 P2747	N2531-V2723 HydrophobicContact CB-CG1 4.37Å; N2531-V2723 WeakPolarHBondContact ND2-CG2 3.27Å; Y2534-V2723 HydrophobicContact CD2-CG1 4.43Å; Y2534-V2723 HydrophobicContact CD2-CG2 4.26Å; Y2534-V2723 HydrophobicContact CE2-CG2 4.31Å; F2536-V2723 HydrophobicContact CE2-CG1 4.19Å; F2536-V2723 HydrophobicContact CZ-CG1 3.94Å; E2589-V2723 HydrophobicContact CG-CG2 4.37Å; V2723-P2747 WeakPolarHBondContact O-CD 3.31Å
2724	K	77.2	Confident	58	Low	28.6667 Å²	28.6667	46.3 Å²	46.3	13%	0.125	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	148.9	175.2	-65.9	-171.6	174.3	-162.8	0	110.5	E2234 S2587 F2588 Y2590 N2722 V2744 E2746	E2234-K2724 VanDerWaalsContact OE1-CE 3.29Å; E2234-K2724 WeakPolarHBondContact OE1-CE 3.15Å; E2234-K2724 IonicContact OE1-NZ 3.15Å; E2234-K2724 PolarHBondContact OE1-NZ 3.45Å; E2234-K2724 VanDerWaalsContact OE2-CD 3.32Å; E2234-K2724 WeakPolarHBondContact OE2-CD 3.24Å; E2234-K2724 WeakPolarHBondContact OE2-CE 3.31Å; E2234-K2724 IonicContact OE2-NZ 3.79Å; E2234-K2724 PolarHBondContact OE2-NZ 3.16Å; S2587-K2724 CarbonylContact C-O 3.58Å; S2587-K2724 VanDerWaalsContact CA-O 3.25Å; S2587-K2724 WeakPolarHBondContact CA-O 3.31Å; F2588-K2724 HydrophobicContact CD1-CB 4.07Å; F2588-K2724 WeakPolarHBondContact CD1-O 3.39Å; F2588-K2724 HydrophobicContact CD2-CB 4.32Å; F2588-K2724 HydrophobicContact CE1-CB 3.57Å; F2588-K2724 HydrophobicContact CE2-CB 3.89Å; F2588-K2724 HydrophobicContact CE2-CD 4.07Å; F2588-K2724 HydrophobicContact CE2-CG 4.48Å; F2588-K2724 HydrophobicContact CG-CB 4.41Å; F2588-K2724 HydrophobicContact CZ-CB 3.49Å; F2588-K2724 VanDerWaalsContact CZ-CB 3.48Å; F2588-K2724 HydrophobicContact CZ-CD 4.05Å; F2588-K2724 HydrophobicContact CZ-CG 4.39Å; F2588-K2724 PolarHBondContact N-O 3.32Å; F2588-K2724 PolarHBondContact O-N 2.85Å; Y2590-K2724 HydrophobicContact CG-CD 4.44Å; N2722-K2724 PolarHBondContact O-N 2.96Å; K2724-V2744 HydrophobicContact CB-CG1 3.84Å; K2724-V2744 HydrophobicContact CD-CG1 4.09Å; K2724-V2744 HydrophobicContact CG-CG1 4.33Å; K2724-E2746 VanDerWaalsContact CE-OE1 3.25Å; K2724-E2746 WeakPolarHBondContact CE-OE1 3.24Å; K2724-E2746 HydrophobicContact CG-CG 4.34Å; K2724-E2746 IonicContact NZ-OE1 3.3Å
2725	L	82.3	Confident	59.1	Low	0.333333 Å²	0.333333	52 Å²	52	0%	0.002	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	109.3	-174.5	-164.6	98.1	0	0	0	110	F2536 I2544 I2585 I2727 V2744 Y2745 P2747	F2536-L2725 HydrophobicContact CB-CD1 4.16Å; F2536-L2725 HydrophobicContact CD1-CD1 3.44Å; F2536-L2725 HydrophobicContact CD1-CD2 3.98Å; F2536-L2725 HydrophobicContact CD1-CG 4.25Å; F2536-L2725 HydrophobicContact CD2-CD1 4.03Å; F2536-L2725 HydrophobicContact CE1-CD1 3.74Å; F2536-L2725 HydrophobicContact CE1-CD2 3.99Å; F2536-L2725 HydrophobicContact CE1-CG 4.4Å; F2536-L2725 HydrophobicContact CE2-CD1 4.12Å; F2536-L2725 HydrophobicContact CG-CD1 3.6Å; F2536-L2725 HydrophobicContact CG-CD2 4.41Å; F2536-L2725 HydrophobicContact CZ-CD1 4.16Å; I2544-L2725 HydrophobicContact CG2-CD2 4.19Å; I2585-L2725 HydrophobicContact CG1-CD2 4.29Å; I2585-L2725 HydrophobicContact CG2-CD1 3.46Å; I2585-L2725 HydrophobicContact CG2-CD2 4.11Å; I2585-L2725 HydrophobicContact CG2-CG 3.76Å; L2725-I2727 HydrophobicContact CD2-CD1 3.76Å; L2725-I2727 HydrophobicContact CD2-CG1 4.01Å; L2725-I2727 HydrophobicContact CG-CD1 4.4Å; L2725-I2727 HydrophobicContact CG-CG1 4.48Å; L2725-V2744 CarbonylContact O-C 3.56Å; L2725-V2744 WeakPolarHBondContact O-CA 3.48Å; L2725-Y2745 WeakPolarHBondContact CB-O 3.12Å; L2725-Y2745 PolarHBondContact N-O 3.08Å; L2725-Y2745 PolarHBondContact O-N 3.03Å; L2725-P2747 HydrophobicContact CB-CG 3.94Å; L2725-P2747 HydrophobicContact CD2-CG 4.34Å
2726	L	85.6	Confident	60.1	Low	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	124.6	177.2	-168.4	148.5	0	0	0	110.4	Y2256 I2258 I2265 I2279 Q2586 F2588 F2742 V2744	Y2256-L2726 HydrophobicContact CD2-CD2 4.39Å; Y2256-L2726 HydrophobicContact CE2-CD2 3.62Å; Y2256-L2726 PolarHBondContact OH-O 3.41Å; Y2256-L2726 VanDerWaalsContact OH-O 3.13Å; I2258-L2726 HydrophobicContact CD1-CB 3.63Å; I2258-L2726 HydrophobicContact CD1-CD1 3.9Å; I2258-L2726 HydrophobicContact CD1-CD2 4.25Å; I2258-L2726 HydrophobicContact CD1-CG 4.18Å; I2258-L2726 HydrophobicContact CG1-CD1 4.31Å; I2265-L2726 HydrophobicContact CD1-CD1 4.05Å; I2265-L2726 HydrophobicContact CD1-CD2 3.86Å; I2265-L2726 HydrophobicContact CG1-CD1 3.98Å; I2279-L2726 HydrophobicContact CD1-CD1 3.89Å; I2279-L2726 HydrophobicContact CG1-CD1 4Å; I2279-L2726 HydrophobicContact CG2-CD1 4.15Å; Q2586-L2726 PolarHBondContact N-O 3.35Å; Q2586-L2726 VanDerWaalsContact N-O 3.13Å; Q2586-L2726 PolarHBondContact O-N 3.44Å; F2588-L2726 HydrophobicContact CD1-CB 4.48Å; F2588-L2726 HydrophobicContact CE1-CB 4.02Å; L2726-F2742 HydrophobicContact CD1-CD2 3.94Å; L2726-F2742 HydrophobicContact CD1-CE2 4.36Å; L2726-F2742 HydrophobicContact CD2-CB 4.17Å; L2726-F2742 HydrophobicContact CD2-CD2 4.34Å; L2726-F2742 HydrophobicContact CD2-CG 4.45Å; L2726-F2742 HydrophobicContact CG-CD2 4.25Å; L2726-V2744 HydrophobicContact CB-CG2 4.46Å; L2726-V2744 HydrophobicContact CD1-CG2 4.25Å; L2726-V2744 HydrophobicContact CG-CG2 4.39Å
2727	I	84	Confident	61	Low	0.333333 Å²	0.333333	53.8 Å²	53.8	0%	0.002	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	118.5	174.2	-66.3	140.7	0	0	0	108.3	W2237 I2544 I2563 V2583 I2585 L2725 F2742 R2743 Y2745	W2237-I2727 HydrophobicContact CH2-CG2 4.1Å; W2237-I2727 HydrophobicContact CZ3-CG2 4.45Å; I2544-I2727 HydrophobicContact CD1-CD1 3.46Å; I2544-I2727 HydrophobicContact CD1-CG1 3.65Å; I2544-I2727 HydrophobicContact CD1-CG2 4.39Å; I2563-I2727 HydrophobicContact CD1-CB 4.19Å; I2563-I2727 HydrophobicContact CD1-CD1 4Å; I2563-I2727 HydrophobicContact CD1-CG1 4.12Å; I2563-I2727 HydrophobicContact CD1-CG2 3.46Å; I2563-I2727 VanDerWaalsContact CD1-CG2 3.45Å; I2563-I2727 HydrophobicContact CG1-CG2 4.32Å; V2583-I2727 HydrophobicContact CG1-CG2 4.37Å; I2585-I2727 HydrophobicContact CG1-CG1 4.35Å; L2725-I2727 HydrophobicContact CD2-CD1 3.76Å; L2725-I2727 HydrophobicContact CD2-CG1 4.01Å; L2725-I2727 HydrophobicContact CG-CD1 4.4Å; L2725-I2727 HydrophobicContact CG-CG1 4.48Å; I2727-F2742 CarbonylContact O-C 3.48Å; I2727-F2742 VanDerWaalsContact O-CA 3.27Å; I2727-F2742 WeakPolarHBondContact O-CA 3.32Å; I2727-R2743 PolarHBondContact N-O 3.09Å; I2727-R2743 PolarHBondContact O-N 3.05Å; I2727-Y2745 HydrophobicContact CB-CD2 4.22Å; I2727-Y2745 HydrophobicContact CB-CE2 4.04Å; I2727-Y2745 HydrophobicContact CD1-CD2 3.42Å; I2727-Y2745 HydrophobicContact CD1-CE2 3.63Å; I2727-Y2745 HydrophobicContact CD1-CG 4.13Å; I2727-Y2745 HydrophobicContact CG1-CD2 4.26Å; I2727-Y2745 HydrophobicContact CG1-CE2 4.41Å; I2727-Y2745 HydrophobicContact CG2-CE2 4.43Å
2728	G	82.4	Confident	62.3	Low	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	137.4	168.8	0	0	0	0	0	110.8	Y2256 Q2741	Y2256-G2728 PolarHBondContact OH-N 3Å; G2728-Q2741 WeakPolarHBondContact CA-O 3.42Å
2729	Q	79.9	Confident	63.9	Low	4.33333 Å²	4.33333	48.5 Å²	48.5	2%	0.02	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	150.2	174.8	67	177.2	-2.5	0	0	112.8	W2237 V2580 L2582 I2731 Q2741	W2237-Q2729 HydrophobicContact CH2-CG 3.92Å; W2237-Q2729 HydrophobicContact CZ3-CG 3.87Å; V2580-Q2729 HydrophobicContact CG1-CB 4.16Å; L2582-Q2729 VanDerWaalsContact O-CA 3.28Å; L2582-Q2729 WeakPolarHBondContact O-CA 3.3Å; Q2729-I2731 HydrophobicContact CG-CG1 4.44Å; Q2729-Q2741 HydrophobicContact CG-CG 3.82Å; Q2729-Q2741 PolarHBondContact N-O 3.01Å; Q2729-Q2741 PolarHBondContact O-N 2.98Å; Q2729-Q2741 VanDerWaalsContact O-O 3.13Å
2730	T	74.4	Confident	65.9	Low	1.66667 Å²	1.66667	44.8 Å²	44.8	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	120.3	169.2	43.7	0	0	0	0	109.7	A2253 N2581 L2582 F2740	A2253-T2730 HydrophobicContact CB-CG2 3.88Å; A2253-T2730 WeakPolarHBondContact O-CG2 3.42Å; N2581-T2730 WeakPolarHBondContact CB-OG1 3.38Å; N2581-T2730 PolarHBondContact N-O 3.18Å; L2582-T2730 HydrophobicContact CB-CG2 4.35Å; L2582-T2730 WeakPolarHBondContact CB-OG1 3.36Å; L2582-T2730 PolarHBondContact N-OG1 2.93Å; L2582-T2730 VanDerWaalsContact N-OG1 3.16Å; T2730-F2740 HydrophobicContact CG2-CB 4.19Å; T2730-F2740 HydrophobicContact CG2-CD2 3.87Å
2731	I	66.1	Low	67.7	Low	29.6667 Å²	29.6667	44.8 Å²	44.8	15%	0.152	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126.7	176	-61.4	172.9	0	0	0	108.7	P2566 Q2729 Q2738 E2739 Q2741	P2566-I2731 VanDerWaalsContact CD-CD1 3.45Å; P2566-I2731 HydrophobicContact CG-CD1 3.86Å; P2566-I2731 VanDerWaalsContact CG-CD1 3.48Å; Q2729-I2731 HydrophobicContact CG-CG1 4.44Å; I2731-Q2738 VanDerWaalsContact O-CA 3.28Å; I2731-Q2738 WeakPolarHBondContact O-CA 3.37Å; I2731-Q2738 WeakPolarHBondContact O-CB 3.41Å; I2731-E2739 PolarHBondContact N-O 3.13Å; I2731-E2739 PolarHBondContact O-N 3.25Å; I2731-Q2741 VanDerWaalsContact CD1-CD 3.47Å; I2731-Q2741 HydrophobicContact CD1-CG 4.24Å
2732	S	58.7	Low	69.3	Low	25.3333 Å²	25.3333	41.5 Å²	41.5	18%	0.177	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	109.8	167.6	83.6	0	0	0	0	110.3	N2578 V2579 Q2738	N2578-S2732 PolarHBondContact OD1-O 3.09Å; V2579-S2732 PolarHBondContact N-OG 2.87Å; V2579-S2732 VanDerWaalsContact N-OG 3.12Å; V2579-S2732 PolarHBondContact O-OG 2.87Å; S2732-Q2738 PolarHBondContact OG-NE2 2.83Å
2733	G	53.3	Low	70.2	Confident	26.6667 Å²	26.6667	40.9 Å²	40.9	28%	0.275	21%	0.209	S	C	.	.			trans	-96.4	158.1	170.3	0	0	0	0	0	112.2	R2735 N2736	G2733-R2735 PolarHBondContact O-N 3.15Å; G2733-N2736 PolarHBondContact O-N 3.06Å; G2733-N2736 VanDerWaalsContact O-N 3.14Å
2734	S	47.9	Very low	70.7	Confident	113.333 Å²	113.333	41.5 Å²	41.5	79%	0.793	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-1.2	-177.3	63.5	0	0	0	0	116.4
2735	R	52	Low	70.5	Confident	215 Å²	215	41.2 Å²	41.2	81%	0.811	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104	17.4	-179.7	-67.6	-173.6	174.2	-178.3	-0.8	114.3	G2733 I2737	G2733-R2735 PolarHBondContact O-N 3.15Å; R2735-I2737 PolarHBondContact O-N 2.86Å
2736	N	51	Low	69.9	Low	127.333 Å²	127.333	42.6 Å²	42.6	68%	0.681	22%	0.217	S	C	*	.	S	Bend	trans	58.5	1.2	-176.4	-72.7	-12.9	0	0	0	115.9	T2250 G2733 Q2738	T2250-N2736 HydrophobicContact CG2-CB 4.13Å; T2250-N2736 WeakPolarHBondContact CG2-O 3.36Å; G2733-N2736 PolarHBondContact O-N 3.06Å; G2733-N2736 VanDerWaalsContact O-N 3.14Å; N2736-Q2738 PolarHBondContact O-N 3.1Å
2737	I	52.7	Low	68.8	Low	102.333 Å²	102.333	42.9 Å²	42.9	53%	0.525	22%	0.219	S	C	.	.			trans	-85.4	108.1	170.4	-57.7	173.6	0	0	0	106.5	R2735 E2739	R2735-I2737 PolarHBondContact O-N 2.86Å; I2737-E2739 HydrophobicContact CG2-CG 4.01Å
2738	Q	58.9	Low	67.7	Low	44 Å²	44	44.1 Å²	44.1	21%	0.206	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	120.8	169.9	-69	176.5	-11.5	0	0	108.1	L2252 N2581 I2731 S2732 N2736	L2252-Q2738 VanDerWaalsContact CD1-OE1 3.25Å; L2252-Q2738 HydrophobicContact CD2-CB 3.77Å; L2252-Q2738 HydrophobicContact CD2-CG 3.87Å; L2252-Q2738 VanDerWaalsContact CD2-CG 3.5Å; L2252-Q2738 VanDerWaalsContact CD2-OE1 3.31Å; L2252-Q2738 VanDerWaalsContact CG-OE1 3.22Å; N2581-Q2738 PolarHBondContact ND2-OE1 3.32Å; I2731-Q2738 VanDerWaalsContact O-CA 3.28Å; I2731-Q2738 WeakPolarHBondContact O-CA 3.37Å; I2731-Q2738 WeakPolarHBondContact O-CB 3.41Å; S2732-Q2738 PolarHBondContact OG-NE2 2.83Å; N2736-Q2738 PolarHBondContact O-N 3.1Å
2739	E	67.3	Low	66.6	Low	72.3333 Å²	72.3333	47.2 Å²	47.2	34%	0.338	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.6	176.9	-65.8	-174	-169.7	0	0	109.3	N2239 I2731 I2737	N2239-E2739 PolarHBondContact ND2-OE2 3.35Å; I2731-E2739 PolarHBondContact N-O 3.13Å; I2731-E2739 PolarHBondContact O-N 3.25Å; I2737-E2739 HydrophobicContact CG2-CG 4.01Å
2740	F	81	Confident	65.6	Low	3.33333 Å²	3.33333	47.3 Å²	47.3	2%	0.015	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	124.4	164	177.2	-104	0	0	0	108.2	V2240 A2253 Y2256 I2265 I2267 W2269 L2582 T2730 F2742	V2240-F2740 HydrophobicContact CB-CD1 4.18Å; V2240-F2740 HydrophobicContact CG2-CD1 4.09Å; V2240-F2740 HydrophobicContact CG2-CE1 4.42Å; V2240-F2740 PolarHBondContact N-O 2.96Å; A2253-F2740 HydrophobicContact CB-CB 3.75Å; A2253-F2740 HydrophobicContact CB-CD2 3.63Å; A2253-F2740 HydrophobicContact CB-CE2 4.39Å; A2253-F2740 HydrophobicContact CB-CG 3.74Å; Y2256-F2740 AromaticContact CD1-CE2 3.94Å; Y2256-F2740 HydrophobicContact CD1-CE2 3.94Å; Y2256-F2740 AromaticContact CD1-CZ 3.78Å; Y2256-F2740 HydrophobicContact CD1-CZ 3.78Å; Y2256-F2740 HydrophobicContact CE1-CE2 4.21Å; Y2256-F2740 HydrophobicContact CE1-CZ 4.13Å; Y2256-F2740 HydrophobicContact CG-CZ 4.41Å; I2265-F2740 HydrophobicContact CD1-CE1 4.42Å; I2265-F2740 HydrophobicContact CD1-CZ 4.32Å; I2267-F2740 HydrophobicContact CD1-CD1 3.7Å; I2267-F2740 HydrophobicContact CD1-CE1 3.5Å; I2267-F2740 VanDerWaalsContact CD1-CE1 3.49Å; I2267-F2740 HydrophobicContact CD1-CZ 4.49Å; I2267-F2740 HydrophobicContact CG1-CD1 4.42Å; I2267-F2740 HydrophobicContact CG1-CE1 3.94Å; I2267-F2740 HydrophobicContact CG1-CZ 4.47Å; I2267-F2740 HydrophobicContact CG2-CD1 4.48Å; W2269-F2740 HydrophobicContact CH2-CB 4.27Å; W2269-F2740 HydrophobicContact CZ3-CB 4.38Å; L2582-F2740 HydrophobicContact CD2-CD2 4.42Å; L2582-F2740 HydrophobicContact CD2-CE2 4Å; T2730-F2740 HydrophobicContact CG2-CB 4.19Å; T2730-F2740 HydrophobicContact CG2-CD2 3.87Å; F2740-F2742 HydrophobicContact CE1-CB 4.17Å; F2740-F2742 AromaticContact CE1-CD1 3.94Å; F2740-F2742 HydrophobicContact CE1-CD1 3.94Å; F2740-F2742 HydrophobicContact CE1-CG 4.47Å; F2740-F2742 HydrophobicContact CZ-CB 4.19Å
2741	Q	83.5	Confident	64.8	Low	15.6667 Å²	15.6667	48 Å²	48	7%	0.073	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	142.7	173.4	62	174.8	18	0	0	110.1	W2237 I2238 N2239 G2728 Q2729 I2731	W2237-Q2741 HydrophobicContact CB-CB 4.41Å; W2237-Q2741 VanDerWaalsContact CB-OE1 3.31Å; W2237-Q2741 HydrophobicContact CD2-CG 4.2Å; W2237-Q2741 HydrophobicContact CE3-CB 4.1Å; W2237-Q2741 HydrophobicContact CE3-CG 3.69Å; W2237-Q2741 VanDerWaalsContact CG-NE2 3.35Å; W2237-Q2741 HydrophobicContact CZ3-CG 4.2Å; I2238-Q2741 CarbonylContact O-C 3.58Å; I2238-Q2741 VanDerWaalsContact O-CA 3.25Å; I2238-Q2741 WeakPolarHBondContact O-CA 3.31Å; N2239-Q2741 VanDerWaalsContact OD1-CB 3.24Å; N2239-Q2741 WeakPolarHBondContact OD1-CB 3.25Å; N2239-Q2741 PolarHBondContact OD1-OE1 2.77Å; G2728-Q2741 WeakPolarHBondContact CA-O 3.42Å; Q2729-Q2741 HydrophobicContact CG-CG 3.82Å; Q2729-Q2741 PolarHBondContact N-O 3.01Å; Q2729-Q2741 PolarHBondContact O-N 2.98Å; Q2729-Q2741 VanDerWaalsContact O-O 3.13Å; I2731-Q2741 VanDerWaalsContact CD1-CD 3.47Å; I2731-Q2741 HydrophobicContact CD1-CG 4.24Å
2742	F	85.3	Confident	64.7	Low	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	161.1	174.2	71.3	-88.5	0	0	0	111.5	I2238 V2240 I2265 V2277 I2279 L2726 I2727 F2740	I2238-F2742 HydrophobicContact CB-CD1 4.3Å; I2238-F2742 HydrophobicContact CB-CD2 4.49Å; I2238-F2742 HydrophobicContact CB-CE1 3.96Å; I2238-F2742 HydrophobicContact CB-CE2 4.17Å; I2238-F2742 HydrophobicContact CB-CZ 3.89Å; I2238-F2742 HydrophobicContact CD1-CE2 3.83Å; I2238-F2742 HydrophobicContact CD1-CZ 3.98Å; I2238-F2742 HydrophobicContact CG1-CE2 4.48Å; I2238-F2742 HydrophobicContact CG1-CZ 4.49Å; I2238-F2742 HydrophobicContact CG2-CD1 4.37Å; I2238-F2742 HydrophobicContact CG2-CE1 3.62Å; I2238-F2742 HydrophobicContact CG2-CE2 4.37Å; I2238-F2742 HydrophobicContact CG2-CZ 3.62Å; I2238-F2742 PolarHBondContact N-O 3.27Å; I2238-F2742 PolarHBondContact O-N 3.08Å; V2240-F2742 HydrophobicContact CG2-CD1 3.89Å; V2240-F2742 HydrophobicContact CG2-CE1 3.62Å; I2265-F2742 HydrophobicContact CD1-CB 4.41Å; I2265-F2742 HydrophobicContact CD1-CD1 3.63Å; I2265-F2742 HydrophobicContact CD1-CD2 3.61Å; I2265-F2742 HydrophobicContact CD1-CE1 3.64Å; I2265-F2742 HydrophobicContact CD1-CE2 3.64Å; I2265-F2742 HydrophobicContact CD1-CG 4.03Å; I2265-F2742 HydrophobicContact CD1-CZ 3.64Å; I2265-F2742 HydrophobicContact CG2-CE1 4.27Å; I2265-F2742 HydrophobicContact CG2-CZ 4.29Å; V2277-F2742 HydrophobicContact CG1-CE1 4.27Å; V2277-F2742 HydrophobicContact CG1-CZ 4.49Å; I2279-F2742 HydrophobicContact CB-CE2 4.49Å; I2279-F2742 HydrophobicContact CG2-CE2 4.36Å; I2279-F2742 WeakPolarHBondContact O-CE2 3.33Å; L2726-F2742 HydrophobicContact CD1-CD2 3.94Å; L2726-F2742 HydrophobicContact CD1-CE2 4.36Å; L2726-F2742 HydrophobicContact CD2-CB 4.17Å; L2726-F2742 HydrophobicContact CD2-CD2 4.34Å; L2726-F2742 HydrophobicContact CD2-CG 4.45Å; L2726-F2742 HydrophobicContact CG-CD2 4.25Å; I2727-F2742 CarbonylContact O-C 3.48Å; I2727-F2742 VanDerWaalsContact O-CA 3.27Å; I2727-F2742 WeakPolarHBondContact O-CA 3.32Å; F2740-F2742 HydrophobicContact CE1-CB 4.17Å; F2740-F2742 AromaticContact CE1-CD1 3.94Å; F2740-F2742 HydrophobicContact CE1-CD1 3.94Å; F2740-F2742 HydrophobicContact CE1-CG 4.47Å; F2740-F2742 HydrophobicContact CZ-CB 4.19Å
2743	R	81	Confident	65	Low	48 Å²	48	53.3 Å²	53.3	18%	0.181	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	145	177.6	178.7	-179.7	-90.3	-166.7	-2.5	109.7	P2233 G2235 P2236 W2237 I2727 Y2745	P2233-R2743 HydrophobicContact CB-CG 4.26Å; G2235-R2743 VanDerWaalsContact O-CZ 3.28Å; G2235-R2743 PolarHBondContact O-NE 3.01Å; G2235-R2743 VanDerWaalsContact O-NE 3.16Å; G2235-R2743 PolarHBondContact O-NH2 3.48Å; P2236-R2743 VanDerWaalsContact C-NE 3.32Å; P2236-R2743 PolarHBondContact O-NE 2.93Å; W2237-R2743 VanDerWaalsContact CD1-CZ 3.4Å; W2237-R2743 HydrophobicContact CD2-CB 3.96Å; W2237-R2743 HydrophobicContact CE3-CB 3.58Å; W2237-R2743 HydrophobicContact CG-CB 4.5Å; W2237-R2743 HydrophobicContact CH2-CB 4.35Å; W2237-R2743 HydrophobicContact CZ3-CB 3.8Å; I2727-R2743 PolarHBondContact N-O 3.09Å; I2727-R2743 PolarHBondContact O-N 3.05Å; R2743-Y2745 HydrophobicContact CB-CD2 4.43Å; R2743-Y2745 HydrophobicContact CB-CE2 3.85Å; R2743-Y2745 VanDerWaalsContact CD-CE2 3.48Å; R2743-Y2745 VanDerWaalsContact CD-CZ 3.43Å; R2743-Y2745 VanDerWaalsContact CD-OH 3.25Å; R2743-Y2745 WeakPolarHBondContact CD-OH 3.22Å; R2743-Y2745 HydrophobicContact CG-CD2 4.07Å; R2743-Y2745 HydrophobicContact CG-CE2 3.65Å
2744	V	79.3	Confident	65.6	Low	12.3333 Å²	12.3333	52.2 Å²	52.2	8%	0.075	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	137.5	174.2	-175.8	0	0	0	0	109.5	P2233 E2234 I2279 F2588 K2724 L2725 L2726	P2233-V2744 WeakPolarHBondContact CA-O 3.46Å; E2234-V2744 HydrophobicContact CB-CB 4.35Å; E2234-V2744 HydrophobicContact CG-CG1 4.45Å; E2234-V2744 PolarHBondContact N-O 3.26Å; E2234-V2744 VanDerWaalsContact OE2-CG1 3.26Å; E2234-V2744 WeakPolarHBondContact OE2-CG1 3.29Å; I2279-V2744 HydrophobicContact CG2-CG2 3.7Å; F2588-V2744 HydrophobicContact CE1-CG1 4.17Å; F2588-V2744 HydrophobicContact CE1-CG2 4.46Å; F2588-V2744 HydrophobicContact CZ-CG1 3.95Å; F2588-V2744 HydrophobicContact CZ-CG2 4.25Å; K2724-V2744 HydrophobicContact CB-CG1 3.84Å; K2724-V2744 HydrophobicContact CD-CG1 4.09Å; K2724-V2744 HydrophobicContact CG-CG1 4.33Å; L2725-V2744 CarbonylContact O-C 3.56Å; L2725-V2744 WeakPolarHBondContact O-CA 3.48Å; L2726-V2744 HydrophobicContact CB-CG2 4.46Å; L2726-V2744 HydrophobicContact CD1-CG2 4.25Å; L2726-V2744 HydrophobicContact CG-CG2 4.39Å
2745	Y	73	Confident	66.6	Low	22.3333 Å²	22.3333	47.6 Å²	47.6	9%	0.088	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	144.4	178.3	-68.1	-102.3	0	0	0	110.2	G2231 A2232 P2233 W2237 M2561 L2725 I2727 R2743 P2747	G2231-Y2745 VanDerWaalsContact O-CD1 3.3Å; G2231-Y2745 WeakPolarHBondContact O-CD1 3.35Å; A2232-Y2745 CarbonylContact O-C 3.56Å; A2232-Y2745 VanDerWaalsContact O-CA 3.25Å; A2232-Y2745 WeakPolarHBondContact O-CA 3.37Å; P2233-Y2745 HydrophobicContact CB-CD1 4.01Å; P2233-Y2745 HydrophobicContact CB-CE1 3.93Å; W2237-Y2745 WeakPolarHBondContact CZ2-OH 3.38Å; M2561-Y2745 HydrophobicContact CE-CD1 3.39Å; M2561-Y2745 VanDerWaalsContact CE-CD1 3.46Å; M2561-Y2745 HydrophobicContact CE-CE1 3.87Å; M2561-Y2745 HydrophobicContact CE-CG 3.93Å; M2561-Y2745 HydrophobicContact SD-CD1 4.43Å; L2725-Y2745 WeakPolarHBondContact CB-O 3.12Å; L2725-Y2745 PolarHBondContact N-O 3.08Å; L2725-Y2745 PolarHBondContact O-N 3.03Å; I2727-Y2745 HydrophobicContact CB-CD2 4.22Å; I2727-Y2745 HydrophobicContact CB-CE2 4.04Å; I2727-Y2745 HydrophobicContact CD1-CD2 3.42Å; I2727-Y2745 HydrophobicContact CD1-CE2 3.63Å; I2727-Y2745 HydrophobicContact CD1-CG 4.13Å; I2727-Y2745 HydrophobicContact CG1-CD2 4.26Å; I2727-Y2745 HydrophobicContact CG1-CE2 4.41Å; I2727-Y2745 HydrophobicContact CG2-CE2 4.43Å; R2743-Y2745 HydrophobicContact CB-CD2 4.43Å; R2743-Y2745 HydrophobicContact CB-CE2 3.85Å; R2743-Y2745 VanDerWaalsContact CD-CE2 3.48Å; R2743-Y2745 VanDerWaalsContact CD-CZ 3.43Å; R2743-Y2745 VanDerWaalsContact CD-OH 3.25Å; R2743-Y2745 WeakPolarHBondContact CD-OH 3.22Å; R2743-Y2745 HydrophobicContact CG-CD2 4.07Å; R2743-Y2745 HydrophobicContact CG-CE2 3.65Å; Y2745-P2747 WeakPolarHBondContact O-CD 3.48Å
2746	E	70.3	Confident	67.5	Low	31 Å²	31	37.5 Å²	37.5	15%	0.145	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	105.1	173.7	-93.3	-164.9	146.5	0	0	109.7	G2231 A2232 E2234 K2724 S2748 L2749	G2231-E2746 WeakPolarHBondContact CA-O 3.43Å; G2231-E2746 PolarHBondContact N-O 3.24Å; A2232-E2746 PolarHBondContact N-O 3.35Å; A2232-E2746 PolarHBondContact O-N 3.18Å; E2234-E2746 HydrophobicContact CG-CG 4.01Å; K2724-E2746 VanDerWaalsContact CE-OE1 3.25Å; K2724-E2746 WeakPolarHBondContact CE-OE1 3.24Å; K2724-E2746 HydrophobicContact CG-CG 4.34Å; K2724-E2746 IonicContact NZ-OE1 3.3Å; E2746-S2748 VanDerWaalsContact C-N 3.25Å; E2746-S2748 PolarHBondContact O-N 3.33Å; E2746-S2748 WeakPolarHBondContact OE1-CB 3.48Å; E2746-S2748 PolarHBondContact OE1-OG 3.34Å; E2746-L2749 HydrophobicContact CB-CB 3.97Å; E2746-L2749 HydrophobicContact CG-CB 4.36Å; E2746-L2749 PolarHBondContact O-N 3.14Å; E2746-L2749 WeakPolarHBondContact OE2-CB 3.22Å; E2746-L2749 WeakPolarHBondContact OE2-CD2 3.34Å
2747	P	63.5	Low	68.2	Low	6 Å²	6	34.3 Å²	34.3	4%	0.039	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	-17.4	-173.4	13	-13.5	0	0	0	114	F2536 V2546 V2723 L2725 Y2745	F2536-P2747 HydrophobicContact CE1-CB 4.11Å; F2536-P2747 HydrophobicContact CE1-CG 3.76Å; F2536-P2747 HydrophobicContact CZ-CG 4.1Å; V2546-P2747 HydrophobicContact CG1-CB 4.4Å; V2546-P2747 HydrophobicContact CG2-CB 4.29Å; V2723-P2747 WeakPolarHBondContact O-CD 3.31Å; L2725-P2747 HydrophobicContact CB-CG 3.94Å; L2725-P2747 HydrophobicContact CD2-CG 4.34Å; Y2745-P2747 WeakPolarHBondContact O-CD 3.48Å
2748	S	60	Low	68.4	Low	24.6667 Å²	24.6667	30.1 Å²	30.1	17%	0.172	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	-16.2	179.3	41.6	0	0	0	0	114	G2720 E2746	G2720-S2748 PolarHBondContact O-OG 3.18Å; E2746-S2748 VanDerWaalsContact C-N 3.25Å; E2746-S2748 PolarHBondContact O-N 3.33Å; E2746-S2748 WeakPolarHBondContact OE1-CB 3.48Å; E2746-S2748 PolarHBondContact OE1-OG 3.34Å
2749	L	59.4	Low	68.7	Low	66.3333 Å²	66.3333	28 Å²	28	35%	0.347	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	140.5	-177.1	-141.7	88.3	0	0	0	111.7	G2231 A2232 E2746	G2231-L2749 PolarHBondContact N-O 2.91Å; A2232-L2749 HydrophobicContact CB-CB 3.78Å; A2232-L2749 HydrophobicContact CB-CD2 4.08Å; A2232-L2749 HydrophobicContact CB-CG 4.38Å; A2232-L2749 PolarHBondContact N-O 3.2Å; E2746-L2749 HydrophobicContact CB-CB 3.97Å; E2746-L2749 HydrophobicContact CG-CB 4.36Å; E2746-L2749 PolarHBondContact O-N 3.14Å; E2746-L2749 WeakPolarHBondContact OE2-CB 3.22Å; E2746-L2749 WeakPolarHBondContact OE2-CD2 3.34Å
2750	T	58.3	Low	68.1	Low	6.66667 Å²	6.66667	27.6 Å²	27.6	4%	0.041	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	127	161.2	51.3	0	0	0	0	109	I2160 L2172 N2227 L2230 Y2752	I2160-T2750 HydrophobicContact CD1-CG2 3.56Å; L2172-T2750 WeakPolarHBondContact CD1-OG1 3.14Å; L2172-T2750 HydrophobicContact CD2-CG2 4.15Å; L2172-T2750 WeakPolarHBondContact CD2-OG1 3.48Å; N2227-T2750 WeakPolarHBondContact O-CB 3.42Å; N2227-T2750 VanDerWaalsContact O-CG2 3.28Å; N2227-T2750 WeakPolarHBondContact O-CG2 3.2Å; L2230-T2750 HydrophobicContact CD2-CG2 4.07Å; T2750-Y2752 PolarHBondContact O-N 3.12Å
2751	G	59.1	Low	66.8	Low	15 Å²	15	29.5 Å²	29.5	16%	0.155	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	125	179	0	0	0	0	0	111.1	W2226 N2227 A2232 H2753	W2226-G2751 CarbonylContact C-O 3.51Å; N2227-G2751 WeakPolarHBondContact CB-O 3.21Å; N2227-G2751 PolarHBondContact N-O 3.23Å; A2232-G2751 VanDerWaalsContact CB-CA 3.49Å; A2232-G2751 VanDerWaalsContact CB-N 3.34Å; G2751-H2753 PolarHBondContact O-N 3.28Å
2752	Y	63.8	Low	65.7	Low	101.667 Å²	101.667	29.7 Å²	29.7	40%	0.399	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	128.5	164.4	-178	-93.1	0	0	0	109.1	P1888 N2224 W2226 T2750 A2754 T2755	P1888-Y2752 HydrophobicContact CB-CE1 4.07Å; N2224-Y2752 HydrophobicContact CB-CE2 3.95Å; N2224-Y2752 WeakPolarHBondContact OD1-CE2 3.5Å; N2224-Y2752 PolarHBondContact OD1-OH 2.73Å; W2226-Y2752 HydrophobicContact CD2-CD2 4.18Å; W2226-Y2752 AromaticContact CE3-CD2 3.86Å; W2226-Y2752 HydrophobicContact CE3-CD2 4.04Å; W2226-Y2752 AromaticContact CH2-CD2 3.87Å; W2226-Y2752 HydrophobicContact CH2-CD2 4.07Å; W2226-Y2752 HydrophobicContact CH2-CE2 4.42Å; W2226-Y2752 HydrophobicContact CZ2-CD2 4.18Å; W2226-Y2752 HydrophobicContact CZ2-CE2 4.4Å; W2226-Y2752 AromaticContact CZ3-CD2 3.7Å; W2226-Y2752 HydrophobicContact CZ3-CD2 3.87Å; W2226-Y2752 HydrophobicContact CZ3-CG 4.47Å; T2750-Y2752 PolarHBondContact O-N 3.12Å; Y2752-A2754 PolarHBondContact OH-O 3.13Å; Y2752-T2755 WeakPolarHBondContact OH-CA 3.38Å; Y2752-T2755 VanDerWaalsContact OH-CB 3.26Å; Y2752-T2755 WeakPolarHBondContact OH-CB 3.29Å; Y2752-T2755 PolarHBondContact OH-N 3.34Å; Y2752-T2755 PolarHBondContact OH-OG1 2.99Å
2753	H	65.3	Low	64.7	Low	64.6667 Å²	64.6667	32.3 Å²	32.3	30%	0.299	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-48.3	-174.1	-172.3	46.4	0	0	0	112.7	Y2210 V2225 G2751	Y2210-H2753 HydrophobicContact CD1-CB 4.45Å; Y2210-H2753 AromaticContact CD1-CD2 3.73Å; Y2210-H2753 HydrophobicContact CE1-CB 4.28Å; Y2210-H2753 AromaticContact CE1-CD2 3.16Å; Y2210-H2753 WeakPolarHBondContact CE1-CD2 3.44Å; Y2210-H2753 AromaticContact CE1-CG 3.69Å; Y2210-H2753 AromaticContact CE1-NE2 3.52Å; Y2210-H2753 WeakPolarHBondContact CE1-NE2 3.39Å; Y2210-H2753 AromaticContact CZ-CD2 3.73Å; Y2210-H2753 AromaticContact CZ-NE2 3.62Å; Y2210-H2753 PolarHBondContact OH-NE2 3.1Å; V2225-H2753 HydrophobicContact CB-CB 4.44Å; V2225-H2753 HydrophobicContact CG1-CB 4.22Å; V2225-H2753 WeakPolarHBondContact O-CA 3.41Å; V2225-H2753 VanDerWaalsContact O-CB 3.3Å; V2225-H2753 WeakPolarHBondContact O-CB 3.3Å; V2225-H2753 PolarHBondContact O-N 3.13Å; G2751-H2753 PolarHBondContact O-N 3.28Å
2754	A	65.4	Low	63.7	Low	4 Å²	4	30.3 Å²	30.3	3%	0.033	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	155	-179.9	0	0	0	0	0	112.1	I1891 V2225 Y2752 L2806	I1891-A2754 HydrophobicContact CD1-CB 3.99Å; I1891-A2754 HydrophobicContact CG1-CB 4.36Å; V2225-A2754 WeakPolarHBondContact CA-O 3.2Å; V2225-A2754 HydrophobicContact CB-CB 4.44Å; V2225-A2754 WeakPolarHBondContact CB-O 3.31Å; V2225-A2754 PolarHBondContact N-O 3.13Å; V2225-A2754 PolarHBondContact O-N 2.98Å; Y2752-A2754 PolarHBondContact OH-O 3.13Å; A2754-L2806 HydrophobicContact CB-CD1 3.78Å
2755	T	69.2	Low	63	Low	16.6667 Å²	16.6667	31.4 Å²	31.4	10%	0.102	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.2	160.8	-45.5	0	0	0	0	108.5	P1888 R2222 I2223 N2224 Y2752 S2757	P1888-T2755 WeakPolarHBondContact CB-OG1 3.49Å; P1888-T2755 VanDerWaalsContact CG-OG1 3.3Å; P1888-T2755 WeakPolarHBondContact CG-OG1 3.4Å; R2222-T2755 HydrophobicContact CB-CG2 4.01Å; R2222-T2755 HydrophobicContact CG-CG2 4.04Å; I2223-T2755 CarbonylContact O-C 3.55Å; I2223-T2755 WeakPolarHBondContact O-CA 3.34Å; N2224-T2755 PolarHBondContact OD1-OG1 2.78Å; Y2752-T2755 WeakPolarHBondContact OH-CA 3.38Å; Y2752-T2755 VanDerWaalsContact OH-CB 3.26Å; Y2752-T2755 WeakPolarHBondContact OH-CB 3.29Å; Y2752-T2755 PolarHBondContact OH-N 3.34Å; Y2752-T2755 PolarHBondContact OH-OG1 2.99Å; T2755-S2757 PolarHBondContact O-N 2.87Å
2756	L	69.9	Low	63.1	Low	2.66667 Å²	2.66667	30.8 Å²	30.8	1%	0.014	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	100.6	168.1	-42.4	173.6	0	0	0	107.5	I1891 I2223 V2225 G2758 L2782 W2802 L2806	I1891-L2756 HydrophobicContact CB-CD2 3.81Å; I1891-L2756 HydrophobicContact CD1-CD2 3.57Å; I1891-L2756 HydrophobicContact CG1-CD2 3.85Å; I1891-L2756 HydrophobicContact CG2-CD2 4.45Å; I2223-L2756 HydrophobicContact CB-CB 4.05Å; I2223-L2756 HydrophobicContact CB-CD1 4.08Å; I2223-L2756 HydrophobicContact CB-CG 4.16Å; I2223-L2756 HydrophobicContact CD1-CB 4.38Å; I2223-L2756 HydrophobicContact CD1-CD1 4.24Å; I2223-L2756 HydrophobicContact CG1-CB 4.36Å; I2223-L2756 HydrophobicContact CG2-CD1 4.05Å; I2223-L2756 HydrophobicContact CG2-CG 4.5Å; I2223-L2756 PolarHBondContact N-O 2.81Å; I2223-L2756 VanDerWaalsContact N-O 3.14Å; I2223-L2756 PolarHBondContact O-N 3.17Å; V2225-L2756 HydrophobicContact CG2-CD1 4.05Å; V2225-L2756 HydrophobicContact CG2-CD2 4.06Å; V2225-L2756 HydrophobicContact CG2-CG 4.06Å; L2756-G2758 VanDerWaalsContact C-N 3.27Å; L2756-G2758 PolarHBondContact O-N 3.43Å; L2756-G2758 VanDerWaalsContact O-N 3.11Å; L2756-L2782 HydrophobicContact CD1-CD2 3.46Å; L2756-L2782 VanDerWaalsContact CD1-CD2 3.4Å; L2756-W2802 HydrophobicContact CB-CD2 4.22Å; L2756-W2802 HydrophobicContact CB-CE3 3.96Å; L2756-W2802 HydrophobicContact CB-CH2 3.95Å; L2756-W2802 HydrophobicContact CB-CZ2 4.21Å; L2756-W2802 HydrophobicContact CB-CZ3 3.83Å; L2756-W2802 HydrophobicContact CD1-CB 4.19Å; L2756-W2802 HydrophobicContact CD1-CD2 3.85Å; L2756-W2802 HydrophobicContact CD1-CE3 4.16Å; L2756-W2802 HydrophobicContact CD1-CG 3.87Å; L2756-W2802 HydrophobicContact CD2-CD2 4.47Å; L2756-W2802 HydrophobicContact CD2-CE3 3.96Å; L2756-W2802 HydrophobicContact CD2-CZ3 4.4Å; L2756-W2802 HydrophobicContact CG-CD2 4.41Å; L2756-W2802 HydrophobicContact CG-CE3 4.25Å; L2756-L2806 HydrophobicContact CD2-CD1 4.18Å; L2756-L2806 HydrophobicContact CD2-CD2 4.24Å
2757	S	66	Low	63.6	Low	60.3333 Å²	60.3333	30.1 Å²	30.1	42%	0.422	19%	0.19	S	C	.	.			trans	-91.4	107.7	174.1	55.6	0	0	0	0	109.8	I1890 T2755 W2802	I1890-S2757 VanDerWaalsContact CG2-OG 3.27Å; I1890-S2757 WeakPolarHBondContact CG2-OG 3.33Å; T2755-S2757 PolarHBondContact O-N 2.87Å; S2757-W2802 WeakPolarHBondContact O-CH2 3.38Å
2758	G	57.2	Low	64.4	Low	14 Å²	14	31 Å²	31	14%	0.144	20%	0.196	C	C	.	.			trans	-149.9	-49.6	177.4	0	0	0	0	0	113.4	L2756 A2760 R2800	L2756-G2758 VanDerWaalsContact C-N 3.27Å; L2756-G2758 PolarHBondContact O-N 3.43Å; L2756-G2758 VanDerWaalsContact O-N 3.11Å; G2758-A2760 PolarHBondContact O-N 2.95Å; G2758-R2800 VanDerWaalsContact C-CZ 3.42Å; G2758-R2800 VanDerWaalsContact CA-NH1 3.29Å; G2758-R2800 PolarHBondContact O-NH1 3.21Å; G2758-R2800 PolarHBondContact O-NH2 3.13Å
2759	H	63.8	Low	65.3	Low	1 Å²	1	30 Å²	30	1%	0.005	19%	0.189	C	C	.	.			trans	-77.5	35.7	-177.3	-65.7	-66.2	0	0	0	113	G2221 G2761 L2762 S2784 A2786 D2798 R2800	G2221-H2759 VanDerWaalsContact CA-O 3.23Å; G2221-H2759 WeakPolarHBondContact CA-O 3.21Å; H2759-G2761 PolarHBondContact O-N 3.17Å; H2759-L2762 HydrophobicContact CB-CB 4.36Å; H2759-L2762 CarbonylContact O-C 3.51Å; H2759-L2762 PolarHBondContact O-N 2.9Å; H2759-L2762 VanDerWaalsContact O-N 3.13Å; H2759-L2762 VanDerWaalsContact O-O 3.1Å; H2759-S2784 PolarHBondContact CD2-OG 3.21Å; H2759-S2784 VanDerWaalsContact CD2-OG 3.3Å; H2759-S2784 PolarHBondContact CE1-O 2.93Å; H2759-S2784 PolarHBondContact NE2-O 2.93Å; H2759-S2784 VanDerWaalsContact NE2-O 3.08Å; H2759-S2784 PolarHBondContact NE2-OG 3.16Å; H2759-A2786 HydrophobicContact CB-CB 3.66Å; H2759-A2786 VanDerWaalsContact CG-CB 3.41Å; H2759-A2786 VanDerWaalsContact ND1-CB 3.27Å; H2759-A2786 WeakPolarHBondContact ND1-CB 3.32Å; H2759-D2798 VanDerWaalsContact CE1-CG 3.48Å; H2759-D2798 PolarHBondContact CE1-O 3Å; H2759-D2798 IonicContact CE1-OD1 3.06Å; H2759-D2798 PolarHBondContact CE1-OD1 3.33Å; H2759-D2798 IonicContact CE1-OD2 3.05Å; H2759-D2798 IonicContact CG-OD1 2.88Å; H2759-D2798 VanDerWaalsContact ND1-CG 3.35Å; H2759-D2798 IonicContact ND1-OD1 3.65Å; H2759-D2798 PolarHBondContact ND1-OD1 2.97Å; H2759-D2798 IonicContact ND1-OD2 2.99Å; H2759-D2798 PolarHBondContact ND1-OD2 3.19Å; H2759-R2800 VanDerWaalsContact CE1-CD 3.46Å; H2759-R2800 WeakPolarHBondContact CE1-CD 3.3Å; H2759-R2800 PolarHBondContact CE1-NE 2.66Å; H2759-R2800 PolarHBondContact ND1-NE 2.58Å
2760	A	56.5	Low	66	Low	63 Å²	63	28 Å²	28	52%	0.521	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	130.7	-178.2	0	0	0	0	0	110.7	G2758 L2762 G3202	G2758-A2760 PolarHBondContact O-N 2.95Å; A2760-L2762 VanDerWaalsContact C-N 3.31Å; A2760-L2762 PolarHBondContact O-N 3.07Å; A2760-G3202 WeakPolarHBondContact CB-O 3.3Å
2761	G	53.6	Low	66.5	Low	43 Å²	43	30.9 Å²	30.9	44%	0.443	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	-9.8	-171.3	0	0	0	0	0	115.2	H2759 Q2788 C2790	H2759-G2761 PolarHBondContact O-N 3.17Å; G2761-Q2788 PolarHBondContact O-OE1 3Å; G2761-C2790 PolarHBondContact O-SG 3.14Å
2762	L	60.6	Low	66.8	Low	21 Å²	21	31.9 Å²	31.9	11%	0.11	20%	0.195	C	C	.	.	S	Bend	trans	-113.1	151.9	175.8	-61.9	177.4	0	0	0	111.7	G2221 H2759 A2760 P2764 A2786 Q2788 G2796 D2798	G2221-L2762 WeakPolarHBondContact CA-O 3.17Å; H2759-L2762 HydrophobicContact CB-CB 4.36Å; H2759-L2762 CarbonylContact O-C 3.51Å; H2759-L2762 PolarHBondContact O-N 2.9Å; H2759-L2762 VanDerWaalsContact O-N 3.13Å; H2759-L2762 VanDerWaalsContact O-O 3.1Å; A2760-L2762 VanDerWaalsContact C-N 3.31Å; A2760-L2762 PolarHBondContact O-N 3.07Å; L2762-P2764 VanDerWaalsContact O-CD 3.29Å; L2762-P2764 WeakPolarHBondContact O-CD 3.4Å; L2762-A2786 HydrophobicContact CB-CB 3.64Å; L2762-A2786 HydrophobicContact CD1-CB 4.4Å; L2762-Q2788 HydrophobicContact CD2-CB 4.05Å; L2762-G2796 WeakPolarHBondContact CD2-O 3.28Å; L2762-D2798 HydrophobicContact CD1-CB 3.61Å; L2762-D2798 VanDerWaalsContact CD1-OD1 3.26Å; L2762-D2798 WeakPolarHBondContact CD1-OD1 3.31Å
2763	I	62.5	Low	66.4	Low	54 Å²	54	32.9 Å²	32.9	28%	0.277	21%	0.207	S	C	.	.			trans	-87.6	114.9	176.9	-60.3	168.5	0	0	0	108.9	S2196 V2220 C2765 A2786 G2787 Q2788	S2196-I2763 VanDerWaalsContact CB-CG2 3.4Å; V2220-I2763 HydrophobicContact CG1-CG1 4.26Å; I2763-C2765 PolarHBondContact O-N 3.18Å; I2763-A2786 CarbonylContact O-C 3.42Å; I2763-A2786 VanDerWaalsContact O-CA 3.26Å; I2763-A2786 WeakPolarHBondContact O-CA 3.16Å; I2763-A2786 WeakPolarHBondContact O-CB 3.14Å; I2763-G2787 WeakPolarHBondContact CB-O 3.1Å; I2763-G2787 PolarHBondContact N-O 2.75Å; I2763-G2787 PolarHBondContact O-N 3.12Å; I2763-Q2788 HydrophobicContact CB-CB 4.47Å; I2763-Q2788 HydrophobicContact CD1-CB 4.03Å; I2763-Q2788 VanDerWaalsContact CD1-CD 3.47Å; I2763-Q2788 HydrophobicContact CD1-CG 3.69Å; I2763-Q2788 HydrophobicContact CG1-CB 4.3Å; I2763-Q2788 HydrophobicContact CG1-CG 4.33Å
2764	P	60.1	Low	65.8	Low	5.66667 Å²	5.66667	37 Å²	37	4%	0.037	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	119.7	175	27.6	-33.1	0	0	0	110	T2214 L2762 V2785 A2786	T2214-P2764 HydrophobicContact CG2-CB 3.62Å; T2214-P2764 HydrophobicContact CG2-CG 3.99Å; L2762-P2764 VanDerWaalsContact O-CD 3.29Å; L2762-P2764 WeakPolarHBondContact O-CD 3.4Å; P2764-V2785 CarbonylContact C-O 3.58Å; P2764-V2785 VanDerWaalsContact CA-O 3.28Å; P2764-V2785 WeakPolarHBondContact CA-O 3.32Å; P2764-A2786 HydrophobicContact CB-CB 4.35Å
2765	C	66.2	Low	65.3	Low	35.6667 Å²	35.6667	37.6 Å²	37.6	24%	0.241	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-13.3	-169.7	57.5	0	0	0	0	113.7	P1910 I2763 V2785	P1910-C2765 PolarHBondContact O-SG 2.75Å; I2763-C2765 PolarHBondContact O-N 3.18Å; C2765-V2785 PolarHBondContact N-O 2.91Å; C2765-V2785 WeakPolarHBondContact SG-CG1 3.2Å; C2765-V2785 PolarHBondContact SG-O 2.6Å
2766	G	74	Confident	64.3	Low	10.3333 Å²	10.3333	44.5 Å²	44.5	11%	0.107	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	146.2	-179.9	0	0	0	0	0	113.6	S2784 V2785	G2766-S2784 WeakPolarHBondContact O-CA 3.39Å; G2766-V2785 PolarHBondContact N-O 3.43Å; G2766-V2785 VanDerWaalsContact N-O 3.11Å; G2766-V2785 PolarHBondContact O-N 2.86Å
2767	L	81.2	Confident	63.5	Low	16.3333 Å²	16.3333	49.3 Å²	49.3	9%	0.086	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	138.4	173.7	-70.7	174.3	0	0	0	109.8	V2200 C2202 I2212 T2214 I2223 L2782 I2783	V2200-L2767 HydrophobicContact CB-CD1 4.33Å; V2200-L2767 HydrophobicContact CB-CG 4.49Å; V2200-L2767 HydrophobicContact CG1-CB 4.19Å; V2200-L2767 HydrophobicContact CG1-CD1 4.46Å; C2202-L2767 HydrophobicContact CB-CB 3.77Å; C2202-L2767 HydrophobicContact CB-CD1 4.18Å; I2212-L2767 HydrophobicContact CG2-CD1 4Å; I2212-L2767 HydrophobicContact CG2-CD2 4.26Å; T2214-L2767 HydrophobicContact CG2-CD1 3.69Å; T2214-L2767 HydrophobicContact CG2-CD2 3.63Å; T2214-L2767 HydrophobicContact CG2-CG 3.64Å; T2214-L2767 VanDerWaalsContact OG1-CD1 3.3Å; T2214-L2767 WeakPolarHBondContact OG1-CD1 3.35Å; I2223-L2767 HydrophobicContact CD1-CD2 4.3Å; I2223-L2767 HydrophobicContact CG2-CD2 4.21Å; L2767-L2782 HydrophobicContact CD2-CD1 4.03Å; L2767-I2783 WeakPolarHBondContact CA-O 3.31Å
2768	S	80.7	Confident	63.1	Low	23.6667 Å²	23.6667	49.4 Å²	49.4	17%	0.166	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	145.3	165.4	-169.8	0	0	0	0	110.9	E1914 L1915 I2783	E1914-S2768 WeakPolarHBondContact OE2-CB 3.37Å; E1914-S2768 PolarHBondContact OE2-OG 3.15Å; L1915-S2768 PolarHBondContact N-OG 3.14Å; S2768-I2783 PolarHBondContact N-O 3.04Å; S2768-I2783 PolarHBondContact O-N 2.86Å
2769	C	78.7	Confident	63.4	Low	4 Å²	4	50.9 Å²	50.9	3%	0.027	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	136.6	-172.4	-142.7	0	0	0	0	112	K2205 I2212 T2780 L2781 L2782	K2205-C2769 VanDerWaalsContact CD-O 3.29Å; K2205-C2769 WeakPolarHBondContact CD-O 3.49Å; I2212-C2769 HydrophobicContact CD1-CB 4.49Å; I2212-C2769 WeakPolarHBondContact CD1-SG 3.31Å; C2769-T2780 HydrophobicContact CB-CG2 3.76Å; C2769-T2780 WeakPolarHBondContact SG-CG2 3.39Å; C2769-L2781 WeakPolarHBondContact CA-O 3.41Å; C2769-L2782 HydrophobicContact CB-CD1 4.06Å
2770	T	72.9	Confident	63.6	Low	25.3333 Å²	25.3333	50.9 Å²	50.9	16%	0.155	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	167.1	178.6	160.8	0	0	0	0	111.5	L1915 D1916 T2780 L2781	L1915-T2770 HydrophobicContact CB-CG2 3.58Å; L1915-T2770 HydrophobicContact CD1-CG2 4.08Å; L1915-T2770 HydrophobicContact CG-CG2 4.43Å; D1916-T2770 WeakPolarHBondContact O-CG2 3.22Å; T2770-T2780 CarbonylContact O-C 3.51Å; T2770-T2780 WeakPolarHBondContact O-CA 3.36Å; T2770-T2780 WeakPolarHBondContact O-CB 3.24Å; T2770-L2781 HydrophobicContact CG2-CB 4.03Å; T2770-L2781 HydrophobicContact CG2-CD2 4.16Å; T2770-L2781 PolarHBondContact N-O 3.15Å; T2770-L2781 PolarHBondContact O-N 3.29Å
2771	K	70.4	Confident	64.5	Low	67 Å²	67	48.9 Å²	48.9	29%	0.291	28%	0.279	S	S	.	.			trans	-88.2	130.2	169.7	-173.6	171	-175.2	178.9	0	109.5	K2205 P2206 S2775 N2776 N2777 D2779	K2205-K2771 PolarHBondContact O-N 3.14Å; P2206-K2771 HydrophobicContact CG-CD 4.46Å; K2771-S2775 WeakPolarHBondContact CE-O 3.32Å; K2771-S2775 WeakPolarHBondContact CE-OG 3.36Å; K2771-S2775 PolarHBondContact NZ-O 3.25Å; K2771-S2775 VanDerWaalsContact NZ-O 3.17Å; K2771-N2776 PolarHBondContact NZ-O 2.58Å; K2771-N2777 WeakPolarHBondContact CE-O 3.33Å; K2771-N2777 PolarHBondContact NZ-O 3.05Å; K2771-D2779 WeakPolarHBondContact CG-O 3.43Å
2772	P	63.7	Low	65.8	Low	35 Å²	35	46.9 Å²	46.9	23%	0.227	26%	0.257	C	S	.	.			trans	-64.1	142.8	172.4	10.3	-10.4	0	0	0	111	N2774 S2775 D2779 L2781	P2772-N2774 PolarHBondContact O-N 3.11Å; P2772-S2775 WeakPolarHBondContact CD-OG 3.36Å; P2772-S2775 PolarHBondContact O-N 2.93Å; P2772-S2775 PolarHBondContact O-OG 2.94Å; P2772-D2779 WeakPolarHBondContact CD-O 3.38Å; P2772-D2779 HydrophobicContact CG-CB 4.31Å; P2772-L2781 HydrophobicContact CB-CB 4.44Å; P2772-L2781 HydrophobicContact CG-CB 4.34Å
2773	L	56.3	Low	66.7	Low	123.333 Å²	123.333	46.8 Å²	46.8	65%	0.646	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-24.1	-174.3	-103.9	133.4	0	0	0	115.1	T1918 I1920	T1918-L2773 HydrophobicContact CG2-CD1 4.37Å; T1918-L2773 WeakPolarHBondContact O-CD1 3.46Å; I1920-L2773 HydrophobicContact CD1-CD2 4.4Å
2774	N	53.6	Low	67.4	Low	150.333 Å²	150.333	44.2 Å²	44.2	80%	0.804	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110	5.3	-171.3	-67	-8.8	0	0	0	114.3	P2772	P2772-N2774 PolarHBondContact O-N 3.11Å
2775	S	54.3	Low	68.1	Low	17.6667 Å²	17.6667	44.6 Å²	44.6	12%	0.124	25%	0.246	C	C	.	.			trans	-91.1	122	178.1	62.7	0	0	0	0	112.4	K2771 P2772 N2777 D2779	K2771-S2775 WeakPolarHBondContact CE-O 3.32Å; K2771-S2775 WeakPolarHBondContact CE-OG 3.36Å; K2771-S2775 PolarHBondContact NZ-O 3.25Å; K2771-S2775 VanDerWaalsContact NZ-O 3.17Å; P2772-S2775 WeakPolarHBondContact CD-OG 3.36Å; P2772-S2775 PolarHBondContact O-N 2.93Å; P2772-S2775 PolarHBondContact O-OG 2.94Å; S2775-N2777 VanDerWaalsContact C-N 3.34Å; S2775-N2777 PolarHBondContact O-N 2.72Å; S2775-D2779 WeakPolarHBondContact CB-OD2 3.43Å; S2775-D2779 PolarHBondContact OG-O 3.17Å
2776	N	48.9	Very low	68.3	Low	162 Å²	162	42.9 Å²	42.9	87%	0.866	24%	0.235	S	C	*	.	S	Bend	trans	-76.6	-25	168	-76.8	-17	0	0	0	111.8	K2771	K2771-N2776 PolarHBondContact NZ-O 2.58Å
2777	N	53.2	Low	67.8	Low	102.333 Å²	102.333	43 Å²	43	55%	0.547	24%	0.235	S	C	.	.	S	Bend	trans	-80.1	-179.4	-178.1	-63.9	-16.9	0	0	0	112.8	K2771 S2775 D2779	K2771-N2777 WeakPolarHBondContact CE-O 3.33Å; K2771-N2777 PolarHBondContact NZ-O 3.05Å; S2775-N2777 VanDerWaalsContact C-N 3.34Å; S2775-N2777 PolarHBondContact O-N 2.72Å; N2777-D2779 WeakPolarHBondContact CB-OD1 3.32Å; N2777-D2779 WeakPolarHBondContact CB-OD2 3.12Å; N2777-D2779 PolarHBondContact ND2-OD2 2.89Å; N2777-D2779 PolarHBondContact O-N 3.23Å; N2777-D2779 VanDerWaalsContact O-N 3.11Å
2778	D	56.5	Low	66.9	Low	63 Å²	63	45.4 Å²	45.4	34%	0.337	25%	0.246	S	C	.	.	S	Bend	trans	-66.3	6.8	174.2	-105.3	5.8	0	0	0	114.4	T2207 R2209 T2780	T2207-D2778 WeakPolarHBondContact CG2-OD1 3.39Å; R2209-D2778 WeakPolarHBondContact CD-OD2 3.38Å; R2209-D2778 IonicContact CZ-OD2 3.6Å; R2209-D2778 IonicContact NE-OD2 3.07Å; R2209-D2778 IonicContact NH1-OD2 3.27Å; R2209-D2778 PolarHBondContact NH1-OD2 3.05Å; D2778-T2780 WeakPolarHBondContact O-CG2 3.37Å; D2778-T2780 PolarHBondContact O-N 2.97Å; D2778-T2780 PolarHBondContact O-OG1 2.93Å
2779	D	63.5	Low	65.4	Low	44.6667 Å²	44.6667	49.4 Å²	49.4	24%	0.239	27%	0.266	C	S	.	.			trans	-60.3	131.7	-172	-46.1	-25.2	0	0	0	111.4	K2771 P2772 S2775 N2777 L2804	K2771-D2779 WeakPolarHBondContact CG-O 3.43Å; P2772-D2779 WeakPolarHBondContact CD-O 3.38Å; P2772-D2779 HydrophobicContact CG-CB 4.31Å; S2775-D2779 WeakPolarHBondContact CB-OD2 3.43Å; S2775-D2779 PolarHBondContact OG-O 3.17Å; N2777-D2779 WeakPolarHBondContact CB-OD1 3.32Å; N2777-D2779 WeakPolarHBondContact CB-OD2 3.12Å; N2777-D2779 PolarHBondContact ND2-OD2 2.89Å; N2777-D2779 PolarHBondContact O-N 3.23Å; N2777-D2779 VanDerWaalsContact O-N 3.11Å; D2779-L2804 CarbonylContact C-O 3.55Å; D2779-L2804 VanDerWaalsContact CA-O 3.24Å; D2779-L2804 WeakPolarHBondContact CA-O 3.45Å
2780	T	68.4	Low	63.7	Low	1.33333 Å²	1.33333	51.5 Å²	51.5	1%	0.008	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	122.8	-177.3	-28.3	0	0	0	0	109.1	K2205 C2769 T2770 D2778 L2804	K2205-T2780 VanDerWaalsContact O-CG2 3.23Å; K2205-T2780 WeakPolarHBondContact O-CG2 3.4Å; C2769-T2780 HydrophobicContact CB-CG2 3.76Å; C2769-T2780 WeakPolarHBondContact SG-CG2 3.39Å; T2770-T2780 CarbonylContact O-C 3.51Å; T2770-T2780 WeakPolarHBondContact O-CA 3.36Å; T2770-T2780 WeakPolarHBondContact O-CB 3.24Å; D2778-T2780 WeakPolarHBondContact O-CG2 3.37Å; D2778-T2780 PolarHBondContact O-N 2.97Å; D2778-T2780 PolarHBondContact O-OG1 2.93Å; T2780-L2804 PolarHBondContact N-O 3.11Å; T2780-L2804 PolarHBondContact O-N 2.81Å
2781	L	75.1	Confident	62.2	Low	21.6667 Å²	21.6667	58.1 Å²	58.1	11%	0.113	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	117.5	172.2	-173.5	71.4	0	0	0	109	V1936 C2769 T2770 P2772 L2801 D2803	V1936-L2781 HydrophobicContact CG1-CD2 3.95Å; C2769-L2781 WeakPolarHBondContact CA-O 3.41Å; T2770-L2781 HydrophobicContact CG2-CB 4.03Å; T2770-L2781 HydrophobicContact CG2-CD2 4.16Å; T2770-L2781 PolarHBondContact N-O 3.15Å; T2770-L2781 PolarHBondContact O-N 3.29Å; P2772-L2781 HydrophobicContact CB-CB 4.44Å; P2772-L2781 HydrophobicContact CG-CB 4.34Å; L2781-L2801 HydrophobicContact CD1-CB 4.33Å; L2781-L2801 HydrophobicContact CD1-CD2 4.41Å; L2781-L2801 HydrophobicContact CD2-CD2 4.43Å; L2781-D2803 WeakPolarHBondContact CD1-OD1 3.12Å
2782	L	80.1	Confident	60.8	Low	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	135.2	172	170	68.2	0	0	0	109.4	I2212 I2223 L2756 L2767 C2769 L2801 W2802 L2804	I2212-L2782 HydrophobicContact CD1-CD1 4.11Å; I2212-L2782 HydrophobicContact CD1-CD2 4.24Å; I2212-L2782 HydrophobicContact CD1-CG 4.45Å; I2212-L2782 HydrophobicContact CG1-CD2 4.32Å; I2212-L2782 HydrophobicContact CG2-CD1 4.2Å; I2212-L2782 HydrophobicContact CG2-CD2 3.88Å; I2223-L2782 HydrophobicContact CG2-CD2 4.47Å; L2756-L2782 HydrophobicContact CD1-CD2 3.46Å; L2756-L2782 VanDerWaalsContact CD1-CD2 3.4Å; L2767-L2782 HydrophobicContact CD2-CD1 4.03Å; C2769-L2782 HydrophobicContact CB-CD1 4.06Å; L2782-L2801 CarbonylContact O-C 3.55Å; L2782-L2801 WeakPolarHBondContact O-CA 3.46Å; L2782-W2802 HydrophobicContact CB-CB 4.22Å; L2782-W2802 HydrophobicContact CD2-CB 4.41Å; L2782-W2802 HydrophobicContact CD2-CG 4.43Å; L2782-W2802 HydrophobicContact CG-CB 4.49Å; L2782-W2802 PolarHBondContact N-O 2.98Å; L2782-W2802 PolarHBondContact O-N 3.04Å; L2782-L2804 HydrophobicContact CB-CD1 4.37Å; L2782-L2804 HydrophobicContact CD2-CD1 4.12Å
2783	I	79.7	Confident	59.7	Low	19.3333 Å²	19.3333	67.4 Å²	67.4	10%	0.099	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	131.9	167.5	-54.4	-175.2	0	0	0	108.7	I1913 L1915 L1922 V1936 L2767 S2768 I2799 R2800 L2801	I1913-I2783 HydrophobicContact CD1-CG2 3.73Å; L1915-I2783 HydrophobicContact CD1-CB 4.25Å; L1915-I2783 HydrophobicContact CD1-CD1 4.02Å; L1915-I2783 HydrophobicContact CD1-CG1 4.03Å; L1915-I2783 HydrophobicContact CD2-CD1 3.85Å; L1915-I2783 HydrophobicContact CG-CD1 4.16Å; L1922-I2783 HydrophobicContact CD1-CD1 3.76Å; L1922-I2783 HydrophobicContact CD1-CG2 4.35Å; L1922-I2783 HydrophobicContact CD2-CD1 3.86Å; L1922-I2783 HydrophobicContact CD2-CG2 4.45Å; L1922-I2783 HydrophobicContact CG-CD1 4.32Å; V1936-I2783 HydrophobicContact CG1-CD1 4.35Å; V1936-I2783 HydrophobicContact CG2-CD1 4.32Å; L2767-I2783 WeakPolarHBondContact CA-O 3.31Å; S2768-I2783 PolarHBondContact N-O 3.04Å; S2768-I2783 PolarHBondContact O-N 2.86Å; I2783-I2799 HydrophobicContact CG2-CG2 3.71Å; I2783-I2799 VanDerWaalsContact CG2-CG2 3.48Å; I2783-R2800 CarbonylContact C-O 3.41Å; I2783-R2800 VanDerWaalsContact CA-O 3.31Å; I2783-R2800 WeakPolarHBondContact CA-O 3.32Å; I2783-R2800 WeakPolarHBondContact CG2-O 3.45Å; I2783-L2801 HydrophobicContact CB-CD2 4.18Å; I2783-L2801 HydrophobicContact CD1-CD2 4.26Å; I2783-L2801 HydrophobicContact CD1-CG 4.05Å; I2783-L2801 HydrophobicContact CG1-CD2 3.69Å; I2783-L2801 HydrophobicContact CG1-CG 4.03Å; I2783-L2801 HydrophobicContact CG2-CD2 4Å
2784	S	79	Confident	59	Low	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	146	173	63.5	0	0	0	0	111.6	I2223 H2759 G2766 I2799 R2800 W2802	I2223-S2784 VanDerWaalsContact CD1-OG 3.28Å; I2223-S2784 WeakPolarHBondContact CD1-OG 3.37Å; H2759-S2784 PolarHBondContact CD2-OG 3.21Å; H2759-S2784 VanDerWaalsContact CD2-OG 3.3Å; H2759-S2784 PolarHBondContact CE1-O 2.93Å; H2759-S2784 PolarHBondContact NE2-O 2.93Å; H2759-S2784 VanDerWaalsContact NE2-O 3.08Å; H2759-S2784 PolarHBondContact NE2-OG 3.16Å; G2766-S2784 WeakPolarHBondContact O-CA 3.39Å; S2784-I2799 CarbonylContact O-C 3.55Å; S2784-I2799 WeakPolarHBondContact O-CA 3.39Å; S2784-R2800 PolarHBondContact N-O 3.06Å; S2784-R2800 PolarHBondContact O-N 3.25Å; S2784-W2802 PolarHBondContact OG-NE1 3.29Å
2785	V	74.7	Confident	58.9	Low	14 Å²	14	63.3 Å²	63.3	9%	0.085	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.4	177.7	-174.5	0	0	0	0	108.5	P1910 I1913 P2764 C2765 G2766 D2798 I2799	P1910-V2785 HydrophobicContact CB-CG1 3.76Å; P1910-V2785 HydrophobicContact CG-CG1 3.31Å; I1913-V2785 HydrophobicContact CB-CG2 3.79Å; I1913-V2785 HydrophobicContact CD1-CG2 3.18Å; I1913-V2785 HydrophobicContact CG1-CG2 4.08Å; I1913-V2785 HydrophobicContact CG2-CG2 3.77Å; P2764-V2785 CarbonylContact C-O 3.58Å; P2764-V2785 VanDerWaalsContact CA-O 3.28Å; P2764-V2785 WeakPolarHBondContact CA-O 3.32Å; C2765-V2785 PolarHBondContact N-O 2.91Å; C2765-V2785 WeakPolarHBondContact SG-CG1 3.2Å; C2765-V2785 PolarHBondContact SG-O 2.6Å; G2766-V2785 PolarHBondContact N-O 3.43Å; G2766-V2785 VanDerWaalsContact N-O 3.11Å; G2766-V2785 PolarHBondContact O-N 2.86Å; V2785-D2798 CarbonylContact C-O 3.56Å; V2785-D2798 WeakPolarHBondContact CA-O 3.41Å; V2785-I2799 HydrophobicContact CG1-CG1 4.21Å; V2785-I2799 HydrophobicContact CG2-CD1 4.42Å; V2785-I2799 HydrophobicContact CG2-CG1 4.11Å; V2785-I2799 HydrophobicContact CG2-CG2 4.33Å
2786	A	68.8	Low	59	Low	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	153.1	166.3	0	0	0	0	0	112	H2759 L2762 I2763 P2764 C2797 D2798	H2759-A2786 HydrophobicContact CB-CB 3.66Å; H2759-A2786 VanDerWaalsContact CG-CB 3.41Å; H2759-A2786 VanDerWaalsContact ND1-CB 3.27Å; H2759-A2786 WeakPolarHBondContact ND1-CB 3.32Å; L2762-A2786 HydrophobicContact CB-CB 3.64Å; L2762-A2786 HydrophobicContact CD1-CB 4.4Å; I2763-A2786 CarbonylContact O-C 3.42Å; I2763-A2786 VanDerWaalsContact O-CA 3.26Å; I2763-A2786 WeakPolarHBondContact O-CA 3.16Å; I2763-A2786 WeakPolarHBondContact O-CB 3.14Å; P2764-A2786 HydrophobicContact CB-CB 4.35Å; A2786-C2797 WeakPolarHBondContact O-CA 3.3Å; A2786-D2798 PolarHBondContact N-O 2.87Å; A2786-D2798 PolarHBondContact O-N 3.24Å; A2786-D2798 VanDerWaalsContact O-N 3.08Å
2787	G	63.5	Low	59.8	Low	12 Å²	12	57.4 Å²	57.4	12%	0.124	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	149.6	174.6	0	0	0	0	0	111.5	I2763 G2796	I2763-G2787 WeakPolarHBondContact CB-O 3.1Å; I2763-G2787 PolarHBondContact N-O 2.75Å; I2763-G2787 PolarHBondContact O-N 3.12Å; G2787-G2796 VanDerWaalsContact CA-O 3.28Å; G2787-G2796 WeakPolarHBondContact CA-O 3.35Å
2788	Q	62.6	Low	60.6	Low	66 Å²	66	53.3 Å²	53.3	31%	0.308	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	131.6	176.9	-168.3	176.1	7.7	0	0	109.8	G2761 L2762 I2763 C2790 G2796	G2761-Q2788 PolarHBondContact O-OE1 3Å; L2762-Q2788 HydrophobicContact CD2-CB 4.05Å; I2763-Q2788 HydrophobicContact CB-CB 4.47Å; I2763-Q2788 HydrophobicContact CD1-CB 4.03Å; I2763-Q2788 VanDerWaalsContact CD1-CD 3.47Å; I2763-Q2788 HydrophobicContact CD1-CG 3.69Å; I2763-Q2788 HydrophobicContact CG1-CB 4.3Å; I2763-Q2788 HydrophobicContact CG1-CG 4.33Å; Q2788-C2790 VanDerWaalsContact C-N 3.27Å; Q2788-C2790 WeakPolarHBondContact CG-SG 3.5Å; Q2788-C2790 PolarHBondContact NE2-SG 3.07Å; Q2788-C2790 PolarHBondContact O-N 2.94Å; Q2788-C2790 VanDerWaalsContact O-N 3.12Å; Q2788-G2796 PolarHBondContact N-O 3.03Å; Q2788-G2796 PolarHBondContact O-N 3.46Å; Q2788-G2796 VanDerWaalsContact O-N 3.17Å
2789	N	49	Very low	61.6	Low	109 Å²	109	52 Å²	52	58%	0.583	29%	0.29	S	S	*	.			trans	-89.4	92	165.6	-133.9	7.8	0	0	0	107.5	D2791	N2789-D2791 PolarHBondContact O-N 2.85Å; N2789-D2791 PolarHBondContact OD1-O 3.39Å
2790	C	43.3	Very low	62.3	Low	47.3333 Å²	47.3333	52.4 Å²	52.4	32%	0.32	29%	0.288	S	S	.	.			trans	-96.1	125.1	167.1	-72.8	0	0	0	0	108.1	G2761 Q2788 S2792 T2794	G2761-C2790 PolarHBondContact O-SG 3.14Å; Q2788-C2790 VanDerWaalsContact C-N 3.27Å; Q2788-C2790 WeakPolarHBondContact CG-SG 3.5Å; Q2788-C2790 PolarHBondContact NE2-SG 3.07Å; Q2788-C2790 PolarHBondContact O-N 2.94Å; Q2788-C2790 VanDerWaalsContact O-N 3.12Å; C2790-S2792 PolarHBondContact O-N 3.14Å; C2790-T2794 PolarHBondContact N-O 3.39Å; C2790-T2794 WeakPolarHBondContact O-CB 3.34Å; C2790-T2794 PolarHBondContact O-OG1 3.4Å
2791	D	42.2	Very low	62.8	Low	164.667 Å²	164.667	55.2 Å²	55.2	88%	0.881	30%	0.302	S	S	*	.	S	Bend	trans	-38.2	53.9	-174.8	-65	-45.2	0	0	0	114.7	N2789 K2793 T2794	N2789-D2791 PolarHBondContact O-N 2.85Å; N2789-D2791 PolarHBondContact OD1-O 3.39Å; D2791-K2793 PolarHBondContact O-N 3.34Å; D2791-T2794 PolarHBondContact O-N 3.07Å; D2791-T2794 VanDerWaalsContact O-N 3.11Å
2792	S	39.6	Very low	62.9	Low	88.3333 Å²	88.3333	55.3 Å²	55.3	62%	0.618	30%	0.301	S	S	*	.	S	Bend	trans	-114.9	48.7	-171.2	54.8	0	0	0	0	114.5	C2790 T2794	C2790-S2792 PolarHBondContact O-N 3.14Å; S2792-T2794 PolarHBondContact O-N 2.98Å; S2792-T2794 PolarHBondContact O-OG1 3.43Å
2793	K	40.8	Very low	62.6	Low	208.667 Å²	208.667	59.6 Å²	59.6	91%	0.907	32%	0.324	S	S	*	.	S	Bend	trans	69.2	-6.1	168.5	-65.4	179.2	179.7	173	0	117.6	D2791	D2791-K2793 PolarHBondContact O-N 3.34Å
2794	T	42.4	Very low	62	Low	96 Å²	96	58.7 Å²	58.7	59%	0.589	32%	0.32	S	S	*	.			trans	-121.4	84.8	-176	37.6	0	0	0	0	110.7	C2790 D2791 S2792 G2796	C2790-T2794 PolarHBondContact N-O 3.39Å; C2790-T2794 WeakPolarHBondContact O-CB 3.34Å; C2790-T2794 PolarHBondContact O-OG1 3.4Å; D2791-T2794 PolarHBondContact O-N 3.07Å; D2791-T2794 VanDerWaalsContact O-N 3.11Å; S2792-T2794 PolarHBondContact O-N 2.98Å; S2792-T2794 PolarHBondContact O-OG1 3.43Å; T2794-G2796 PolarHBondContact O-N 3.01Å
2795	I	50.8	Low	61.1	Low	91.3333 Å²	91.3333	60.5 Å²	60.5	47%	0.468	33%	0.331	S	S	.	.			trans	-78.7	110.7	170	-57.8	172.8	0	0	0	107.6	Q1907 I1909	Q1907-I2795 HydrophobicContact CB-CG2 4.35Å; Q1907-I2795 PolarHBondContact OE1-O 3.1Å; I1909-I2795 HydrophobicContact CD1-CG2 4.27Å; I1909-I2795 HydrophobicContact CG1-CG2 3.86Å
2796	G	56.3	Low	60.2	Low	24.6667 Å²	24.6667	62.8 Å²	62.8	25%	0.254	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.6	168.8	0	0	0	0	0	110.4	L2762 G2787 Q2788 T2794	L2762-G2796 WeakPolarHBondContact CD2-O 3.28Å; G2787-G2796 VanDerWaalsContact CA-O 3.28Å; G2787-G2796 WeakPolarHBondContact CA-O 3.35Å; Q2788-G2796 PolarHBondContact N-O 3.03Å; Q2788-G2796 PolarHBondContact O-N 3.46Å; Q2788-G2796 VanDerWaalsContact O-N 3.17Å; T2794-G2796 PolarHBondContact O-N 3.01Å
2797	C	66.2	Low	59	Low	31.3333 Å²	31.3333	67 Å²	67	21%	0.212	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	135.9	171.6	89.8	0	0	0	0	110.6	K1898 D1908 P1910 A2786	K1898-C2797 VanDerWaalsContact CD-O 3.24Å; K1898-C2797 WeakPolarHBondContact CD-O 3.37Å; K1898-C2797 VanDerWaalsContact CG-O 3.3Å; K1898-C2797 WeakPolarHBondContact CG-O 3.46Å; D1908-C2797 PolarHBondContact O-SG 2.97Å; P1910-C2797 HydrophobicContact CG-CB 4.27Å; A2786-C2797 WeakPolarHBondContact O-CA 3.3Å
2798	D	70.5	Confident	57.8	Low	15 Å²	15	73.2 Å²	73.2	8%	0.08	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	141.8	176.1	91.6	-10.6	0	0	0	111.6	I1896 K1898 H2759 L2762 V2785 A2786 R2800	I1896-D2798 HydrophobicContact CG2-CB 3.97Å; K1898-D2798 HydrophobicContact CG-CB 4.26Å; H2759-D2798 VanDerWaalsContact CE1-CG 3.48Å; H2759-D2798 PolarHBondContact CE1-O 3Å; H2759-D2798 IonicContact CE1-OD1 3.06Å; H2759-D2798 PolarHBondContact CE1-OD1 3.33Å; H2759-D2798 IonicContact CE1-OD2 3.05Å; H2759-D2798 IonicContact CG-OD1 2.88Å; H2759-D2798 VanDerWaalsContact ND1-CG 3.35Å; H2759-D2798 IonicContact ND1-OD1 3.65Å; H2759-D2798 PolarHBondContact ND1-OD1 2.97Å; H2759-D2798 IonicContact ND1-OD2 2.99Å; H2759-D2798 PolarHBondContact ND1-OD2 3.19Å; L2762-D2798 HydrophobicContact CD1-CB 3.61Å; L2762-D2798 VanDerWaalsContact CD1-OD1 3.26Å; L2762-D2798 WeakPolarHBondContact CD1-OD1 3.31Å; V2785-D2798 CarbonylContact C-O 3.56Å; V2785-D2798 WeakPolarHBondContact CA-O 3.41Å; A2786-D2798 PolarHBondContact N-O 2.87Å; A2786-D2798 PolarHBondContact O-N 3.24Å; A2786-D2798 VanDerWaalsContact O-N 3.08Å; D2798-R2800 WeakPolarHBondContact OD1-CG 3.3Å; D2798-R2800 IonicContact OD1-NE 3.55Å; D2798-R2800 PolarHBondContact OD1-NE 2.93Å; D2798-R2800 IonicContact OD2-CZ 3.49Å; D2798-R2800 IonicContact OD2-NE 3.23Å; D2798-R2800 PolarHBondContact OD2-NE 3.09Å; D2798-R2800 IonicContact OD2-NH2 3.14Å; D2798-R2800 PolarHBondContact OD2-NH2 3.06Å
2799	I	77.4	Confident	56.2	Low	37.3333 Å²	37.3333	76.6 Å²	76.6	19%	0.191	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.8	173.9	-54.9	-177	0	0	0	107.4	I1896 H1897 I1913 L1922 Y1924 I2783 S2784 V2785	I1896-I2799 CarbonylContact C-O 3.57Å; I1896-I2799 WeakPolarHBondContact CA-O 3.5Å; H1897-I2799 HydrophobicContact CB-CB 4.35Å; H1897-I2799 PolarHBondContact N-O 2.92Å; H1897-I2799 PolarHBondContact O-N 2.99Å; I1913-I2799 HydrophobicContact CD1-CD1 4.29Å; I1913-I2799 HydrophobicContact CD1-CG2 3.95Å; L1922-I2799 HydrophobicContact CD2-CG2 4.13Å; Y1924-I2799 HydrophobicContact CD1-CD1 3.65Å; Y1924-I2799 HydrophobicContact CE1-CD1 4.11Å; Y1924-I2799 HydrophobicContact CG-CD1 3.96Å; I2783-I2799 HydrophobicContact CG2-CG2 3.71Å; I2783-I2799 VanDerWaalsContact CG2-CG2 3.48Å; S2784-I2799 CarbonylContact O-C 3.55Å; S2784-I2799 WeakPolarHBondContact O-CA 3.39Å; V2785-I2799 HydrophobicContact CG1-CG1 4.21Å; V2785-I2799 HydrophobicContact CG2-CD1 4.42Å; V2785-I2799 HydrophobicContact CG2-CG1 4.11Å; V2785-I2799 HydrophobicContact CG2-CG2 4.33Å
2800	R	77.2	Confident	55.1	Low	52.3333 Å²	52.3333	75.8 Å²	75.8	20%	0.197	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	141.6	-176.3	-64.6	-175.1	-173.7	-144.4	6.2	112.1	P1893 I1896 G2758 H2759 I2783 S2784 D2798 W2802	P1893-R2800 HydrophobicContact CB-CB 4.03Å; P1893-R2800 HydrophobicContact CB-CG 4.26Å; I1896-R2800 HydrophobicContact CG1-CG 4.26Å; I1896-R2800 HydrophobicContact CG2-CG 4.28Å; G2758-R2800 VanDerWaalsContact C-CZ 3.42Å; G2758-R2800 VanDerWaalsContact CA-NH1 3.29Å; G2758-R2800 PolarHBondContact O-NH1 3.21Å; G2758-R2800 PolarHBondContact O-NH2 3.13Å; H2759-R2800 VanDerWaalsContact CE1-CD 3.46Å; H2759-R2800 WeakPolarHBondContact CE1-CD 3.3Å; H2759-R2800 PolarHBondContact CE1-NE 2.66Å; H2759-R2800 PolarHBondContact ND1-NE 2.58Å; I2783-R2800 CarbonylContact C-O 3.41Å; I2783-R2800 VanDerWaalsContact CA-O 3.31Å; I2783-R2800 WeakPolarHBondContact CA-O 3.32Å; I2783-R2800 WeakPolarHBondContact CG2-O 3.45Å; S2784-R2800 PolarHBondContact N-O 3.06Å; S2784-R2800 PolarHBondContact O-N 3.25Å; D2798-R2800 WeakPolarHBondContact OD1-CG 3.3Å; D2798-R2800 IonicContact OD1-NE 3.55Å; D2798-R2800 PolarHBondContact OD1-NE 2.93Å; D2798-R2800 IonicContact OD2-CZ 3.49Å; D2798-R2800 IonicContact OD2-NE 3.23Å; D2798-R2800 PolarHBondContact OD2-NE 3.09Å; D2798-R2800 IonicContact OD2-NH2 3.14Å; D2798-R2800 PolarHBondContact OD2-NH2 3.06Å; R2800-W2802 HydrophobicContact CB-CZ2 3.89Å; R2800-W2802 HydrophobicContact CG-CZ2 4.33Å; R2800-W2802 PolarHBondContact O-NE1 3.23Å
2801	L	79.9	Confident	54.3	Low	60.5 Å²	60.5	78.5 Å²	78.5	32%	0.317	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	138.9	176.6	-66.1	129.4	0	0	0	109.4	L2781 L2782 I2783	L2781-L2801 HydrophobicContact CD1-CB 4.33Å; L2781-L2801 HydrophobicContact CD1-CD2 4.41Å; L2781-L2801 HydrophobicContact CD2-CD2 4.43Å; L2782-L2801 CarbonylContact O-C 3.55Å; L2782-L2801 WeakPolarHBondContact O-CA 3.46Å; I2783-L2801 HydrophobicContact CB-CD2 4.18Å; I2783-L2801 HydrophobicContact CD1-CD2 4.26Å; I2783-L2801 HydrophobicContact CD1-CG 4.05Å; I2783-L2801 HydrophobicContact CG1-CD2 3.69Å; I2783-L2801 HydrophobicContact CG1-CG 4.03Å; I2783-L2801 HydrophobicContact CG2-CD2 4Å
2802	W	76.5	Confident	53.5	Low	23 Å²	23	77.8 Å²	77.8	9%	0.087	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	137.7	-177	-42.2	81.6	0	0	0	110.2	I2223 L2756 S2757 L2782 S2784 R2800	I2223-W2802 HydrophobicContact CD1-CZ2 4.38Å; L2756-W2802 HydrophobicContact CB-CD2 4.22Å; L2756-W2802 HydrophobicContact CB-CE3 3.96Å; L2756-W2802 HydrophobicContact CB-CH2 3.95Å; L2756-W2802 HydrophobicContact CB-CZ2 4.21Å; L2756-W2802 HydrophobicContact CB-CZ3 3.83Å; L2756-W2802 HydrophobicContact CD1-CB 4.19Å; L2756-W2802 HydrophobicContact CD1-CD2 3.85Å; L2756-W2802 HydrophobicContact CD1-CE3 4.16Å; L2756-W2802 HydrophobicContact CD1-CG 3.87Å; L2756-W2802 HydrophobicContact CD2-CD2 4.47Å; L2756-W2802 HydrophobicContact CD2-CE3 3.96Å; L2756-W2802 HydrophobicContact CD2-CZ3 4.4Å; L2756-W2802 HydrophobicContact CG-CD2 4.41Å; L2756-W2802 HydrophobicContact CG-CE3 4.25Å; S2757-W2802 WeakPolarHBondContact O-CH2 3.38Å; L2782-W2802 HydrophobicContact CB-CB 4.22Å; L2782-W2802 HydrophobicContact CD2-CB 4.41Å; L2782-W2802 HydrophobicContact CD2-CG 4.43Å; L2782-W2802 HydrophobicContact CG-CB 4.49Å; L2782-W2802 PolarHBondContact N-O 2.98Å; L2782-W2802 PolarHBondContact O-N 3.04Å; S2784-W2802 PolarHBondContact OG-NE1 3.29Å; R2800-W2802 HydrophobicContact CB-CZ2 3.89Å; R2800-W2802 HydrophobicContact CG-CZ2 4.33Å; R2800-W2802 PolarHBondContact O-NE1 3.23Å
2803	D	73.8	Confident	52.9	Low	90.5 Å²	90.5	79.2 Å²	79.2	48%	0.484	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	134.7	172.8	-74.7	-34.6	0	0	0	110.8	L2781	L2781-D2803 WeakPolarHBondContact CD1-OD1 3.12Å
2804	L	67.9	Low	52.3	Low	1 Å²	1	77.9 Å²	77.9	1%	0.005	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	139.2	176.4	-64.5	172.7	0	0	0	109.5	Y2210 I2212 V2225 D2779 T2780 L2782 L2806	Y2210-L2804 HydrophobicContact CD2-CB 4.35Å; Y2210-L2804 HydrophobicContact CE2-CB 4.3Å; I2212-L2804 HydrophobicContact CD1-CD1 4.07Å; I2212-L2804 HydrophobicContact CG1-CD1 4.34Å; V2225-L2804 HydrophobicContact CG1-CD1 4.04Å; V2225-L2804 HydrophobicContact CG1-CD2 4.38Å; V2225-L2804 HydrophobicContact CG2-CD1 4.29Å; V2225-L2804 HydrophobicContact CG2-CD2 4.38Å; D2779-L2804 CarbonylContact C-O 3.55Å; D2779-L2804 VanDerWaalsContact CA-O 3.24Å; D2779-L2804 WeakPolarHBondContact CA-O 3.45Å; T2780-L2804 PolarHBondContact N-O 3.11Å; T2780-L2804 PolarHBondContact O-N 2.81Å; L2782-L2804 HydrophobicContact CB-CD1 4.37Å; L2782-L2804 HydrophobicContact CD2-CD1 4.12Å; L2804-L2806 HydrophobicContact CD2-CG 4.31Å
2805	P	59.2	Low	52	Low	37 Å²	37	78.1 Å²	78.1	24%	0.24	45%	0.446	C	S	.	.	S	Bend	cis	-66.1	148	-5.9	10.7	-6.5	0	0	0	111.1	Y2210 S2807	Y2210-P2805 HydrophobicContact CE2-CB 4.49Å; Y2210-P2805 HydrophobicContact CE2-CG 4.11Å; Y2210-P2805 WeakPolarHBondContact OH-CB 3.32Å; Y2210-P2805 VanDerWaalsContact OH-CG 3.32Å; Y2210-P2805 WeakPolarHBondContact OH-CG 3.45Å; P2805-S2807 VanDerWaalsContact C-N 3.33Å; P2805-S2807 PolarHBondContact O-N 3.12Å
2806	L	56.2	Low	52	Low	63.5 Å²	63.5	77.9 Å²	77.9	33%	0.332	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-57.2	115.3	159.9	-67.9	165.4	0	0	0	107.1	A2754 L2756 L2804 N2808	A2754-L2806 HydrophobicContact CB-CD1 3.78Å; L2756-L2806 HydrophobicContact CD2-CD1 4.18Å; L2756-L2806 HydrophobicContact CD2-CD2 4.24Å; L2804-L2806 HydrophobicContact CD2-CG 4.31Å; L2806-N2808 PolarHBondContact O-N 2.76Å
2807	S	44.1	Very low	52.3	Low	87 Å²	87	77.7 Å²	77.7	61%	0.608	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-58.9	118.4	-174.5	57.7	0	0	0	0	110.2	P2805 N2809 S2810	P2805-S2807 VanDerWaalsContact C-N 3.33Å; P2805-S2807 PolarHBondContact O-N 3.12Å; S2807-N2809 PolarHBondContact O-N 2.85Å; S2807-N2809 VanDerWaalsContact O-N 3.13Å; S2807-S2810 PolarHBondContact O-N 2.75Å
2808	N	37.7	Very low	52.3	Low	142 Å²	142	80.2 Å²	80.2	76%	0.759	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	0.2	175	-88.5	-1.7	0	0	0	113.7	L2806 S2810	L2806-N2808 PolarHBondContact O-N 2.76Å; N2808-S2810 PolarHBondContact O-N 3.12Å
2809	N	29.6	Very low	52.3	Low	137.5 Å²	137.5	80.2 Å²	80.2	74%	0.735	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	41.1	170.8	-71.2	-10.1	0	0	0	111.3	S2807 S2811	S2807-N2809 PolarHBondContact O-N 2.85Å; S2807-N2809 VanDerWaalsContact O-N 3.13Å; N2809-S2811 PolarHBondContact O-N 2.75Å
2810	S	26.2	Very low	51.9	Low	93 Å²	93	83.4 Å²	83.4	65%	0.65	47%	0.472	S	S	*	.			trans	-55.3	94	150.7	58.1	0	0	0	0	111.2	S2807 N2808 L2812	S2807-S2810 PolarHBondContact O-N 2.75Å; N2808-S2810 PolarHBondContact O-N 3.12Å; S2810-L2812 CarbonylContact C-O 3.54Å; S2810-L2812 VanDerWaalsContact C-O 3.23Å; S2810-L2812 WeakPolarHBondContact CA-O 3.29Å; S2810-L2812 WeakPolarHBondContact CB-O 3.48Å
2811	S	25.2	Very low	51.4	Low	104 Å²	104	81.6 Å²	81.6	73%	0.727	47%	0.469	S	S	*	.			trans	12.4	55.1	165.2	69.6	0	0	0	0	114.7	N2809	N2809-S2811 PolarHBondContact O-N 2.75Å
2812	L	26.6	Very low	51	Low	150.5 Å²	150.5	80.8 Å²	80.8	79%	0.788	47%	0.467	S	S	*	.	S	Bend	trans	-6.9	113.1	163.5	-66.3	98.4	0	0	0	114.1	S2810	S2810-L2812 CarbonylContact C-O 3.54Å; S2810-L2812 VanDerWaalsContact C-O 3.23Å; S2810-L2812 WeakPolarHBondContact CA-O 3.29Å; S2810-L2812 WeakPolarHBondContact CB-O 3.48Å
2813	C	25.7	Very low	51.2	Low	117 Å²	117	79.9 Å²	79.9	79%	0.791	46%	0.464	S	S	*	.			trans	126.4	61.5	146.2	-103.5	0	0	0	0	112.6
2814	K	29.7	Very low	51.6	Low	182 Å²	182	78.2 Å²	78.2	79%	0.791	46%	0.455	S	S	*	.			trans	-65.6	137.6	146.7	-76.4	-177.2	175.6	-178.1	0	107.2	T2816	K2814-T2816 PolarHBondContact O-N 3.18Å
2815	P	34.6	Very low	52.3	Low	100 Å²	100	78.7 Å²	78.7	65%	0.649	46%	0.458	S	S	*	.			trans	-53.8	120.1	172.6	23	-30.7	0	0	0	108.6	L2817	P2815-L2817 VanDerWaalsContact C-N 3.29Å; P2815-L2817 PolarHBondContact O-N 3.14Å
2816	T	51.4	Low	53.6	Low	87.5 Å²	87.5	77.5 Å²	77.5	54%	0.537	45%	0.451	S	S	.	.			trans	-60.3	109.4	-178.7	40	0	0	0	0	109.9	K2814 Q2818 W2850 P2888	K2814-T2816 PolarHBondContact O-N 3.18Å; T2816-Q2818 PolarHBondContact O-N 3.12Å; T2816-Q2818 VanDerWaalsContact O-N 3.16Å; T2816-W2850 WeakPolarHBondContact O-CH2 3.32Å; T2816-W2850 WeakPolarHBondContact O-CZ3 3.42Å; T2816-P2888 HydrophobicContact CG2-CG 4.39Å
2817	L	61.8	Low	55	Low	19 Å²	19	76.4 Å²	76.4	10%	0.099	45%	0.445	C	S	.	.	S	Bend	trans	17.2	83.6	174.3	-131.9	67.7	0	0	0	113.1	P2815 I2848 W2850 P2888 R2891 L2964 N2965	P2815-L2817 VanDerWaalsContact C-N 3.29Å; P2815-L2817 PolarHBondContact O-N 3.14Å; L2817-I2848 HydrophobicContact CB-CD1 4.31Å; L2817-I2848 HydrophobicContact CB-CG2 4.34Å; L2817-I2848 HydrophobicContact CD2-CG1 4.48Å; L2817-I2848 HydrophobicContact CD2-CG2 3.98Å; L2817-I2848 HydrophobicContact CG-CD1 4.32Å; L2817-I2848 HydrophobicContact CG-CG2 4.33Å; L2817-I2848 WeakPolarHBondContact O-CD1 3.48Å; L2817-W2850 VanDerWaalsContact O-CH2 3.23Å; L2817-W2850 WeakPolarHBondContact O-CH2 3.37Å; L2817-P2888 HydrophobicContact CB-CB 3.68Å; L2817-P2888 HydrophobicContact CB-CG 3.98Å; L2817-P2888 HydrophobicContact CD2-CB 3.93Å; L2817-P2888 HydrophobicContact CG-CB 4.44Å; L2817-R2891 HydrophobicContact CD1-CB 3.92Å; L2817-R2891 HydrophobicContact CD2-CB 3.61Å; L2817-R2891 VanDerWaalsContact CD2-CB 3.41Å; L2817-R2891 HydrophobicContact CG-CB 3.95Å; L2817-L2964 HydrophobicContact CD1-CB 3.81Å; L2817-L2964 VanDerWaalsContact CD1-CB 3.46Å; L2817-L2964 HydrophobicContact CD1-CD1 3.86Å; L2817-L2964 HydrophobicContact CD1-CD2 4.36Å; L2817-L2964 HydrophobicContact CD1-CG 4.1Å; L2817-L2964 HydrophobicContact CD2-CB 4.37Å; L2817-L2964 HydrophobicContact CD2-CD2 4.48Å; L2817-N2965 WeakPolarHBondContact CD1-OD1 3.36Å
2818	Q	66.3	Low	56.9	Low	85 Å²	85	74.3 Å²	74.3	40%	0.397	43%	0.425	S	S	.	.			trans	-100.7	149.4	176.3	133.4	-178.3	-8	0	0	110.6	T2816 R2891 S3224 G3225	T2816-Q2818 PolarHBondContact O-N 3.12Å; T2816-Q2818 VanDerWaalsContact O-N 3.16Å; Q2818-R2891 PolarHBondContact O-NH1 2.84Å; Q2818-S3224 PolarHBondContact NE2-O 2.91Å; Q2818-G3225 VanDerWaalsContact CG-O 3.25Å; Q2818-G3225 WeakPolarHBondContact CG-O 3.42Å
2819	H	71.1	Confident	59.1	Low	14.5 Å²	14.5	67.9 Å²	67.9	7%	0.067	39%	0.391	C	S	.	.			trans	-66.4	149.8	166	-70.7	-74.2	0	0	0	110	G2821 I2823 T2840 S2842 D2844 D2846 I2848 G3225	H2819-G2821 WeakPolarHBondContact CB-O 3.29Å; H2819-I2823 HydrophobicContact CB-CG1 4.31Å; H2819-I2823 VanDerWaalsContact CD2-CG1 3.47Å; H2819-I2823 WeakPolarHBondContact CD2-CG1 3.34Å; H2819-T2840 PolarHBondContact CD2-OG1 3.25Å; H2819-T2840 PolarHBondContact CE1-O 2.98Å; H2819-T2840 VanDerWaalsContact CE1-O 3.23Å; H2819-T2840 PolarHBondContact NE2-O 3.33Å; H2819-T2840 VanDerWaalsContact NE2-O 3.14Å; H2819-T2840 PolarHBondContact NE2-OG1 3.21Å; H2819-S2842 WeakPolarHBondContact ND1-CB 3.22Å; H2819-D2844 IonicContact ND1-OD1 2.7Å; H2819-D2846 PolarHBondContact CE1-O 3.06Å; H2819-D2846 VanDerWaalsContact CE1-O 3.24Å; H2819-D2846 PolarHBondContact ND1-O 3.38Å; H2819-I2848 VanDerWaalsContact CE1-CG1 3.46Å; H2819-I2848 WeakPolarHBondContact CE1-CG1 3.47Å; H2819-G3225 PolarHBondContact N-O 2.72Å
2820	T	70.1	Confident	61.5	Low	105.5 Å²	105.5	65 Å²	65	65%	0.647	38%	0.375	S	S	*	.	S	Bend	trans	-98.6	-6.7	178.5	43.4	0	0	0	0	113.1	D2844	T2820-D2844 WeakPolarHBondContact CA-OD2 3.32Å; T2820-D2844 PolarHBondContact N-OD2 3.17Å; T2820-D2844 VanDerWaalsContact OG1-CB 3.27Å; T2820-D2844 WeakPolarHBondContact OG1-CB 3.36Å; T2820-D2844 VanDerWaalsContact OG1-CG 3.27Å; T2820-D2844 PolarHBondContact OG1-OD2 3.22Å
2821	G	65.7	Low	64	Low	13 Å²	13	60.8 Å²	60.8	13%	0.134	35%	0.345	C	S	.	.	S	Bend	trans	-137.2	179.7	172.5	0	0	0	0	0	112	H2819 I2823 S2842 D2844 G3225	H2819-G2821 WeakPolarHBondContact CB-O 3.29Å; G2821-I2823 PolarHBondContact O-N 3.45Å; G2821-S2842 WeakPolarHBondContact CA-OG 3.46Å; G2821-S2842 PolarHBondContact O-OG 3.22Å; G2821-D2844 PolarHBondContact N-OD2 3.2Å; G2821-D2844 VanDerWaalsContact N-OD2 3.07Å; G2821-G3225 WeakPolarHBondContact O-CA 3.21Å; G2821-G3225 PolarHBondContact O-N 3.3Å
2822	P	72.5	Confident	66.4	Low	44 Å²	44	56.8 Å²	56.8	29%	0.286	32%	0.316	S	S	.	.			trans	-62.4	134.5	-178.5	1.7	0.1	0	0	0	111.8	I2824 S2842 V2843 K3206 Q3223	P2822-I2824 PolarHBondContact O-N 2.93Å; P2822-S2842 WeakPolarHBondContact O-CA 3.2Å; P2822-S2842 PolarHBondContact O-OG 3.08Å; P2822-S2842 VanDerWaalsContact O-OG 3.12Å; P2822-V2843 HydrophobicContact CB-CG2 4.37Å; P2822-V2843 HydrophobicContact CG-CB 4.31Å; P2822-V2843 HydrophobicContact CG-CG2 3.83Å; P2822-V2843 PolarHBondContact O-N 3.33Å; P2822-V2843 VanDerWaalsContact O-N 3.12Å; P2822-K3206 HydrophobicContact CB-CG 4.4Å; P2822-Q3223 VanDerWaalsContact CA-O 3.29Å; P2822-Q3223 WeakPolarHBondContact CA-O 3.46Å; P2822-Q3223 HydrophobicContact CB-CG 4.33Å; P2822-Q3223 HydrophobicContact CG-CG 4Å; P2822-Q3223 WeakPolarHBondContact CG-O 3.41Å
2823	I	80.5	Confident	68.5	Low	4 Å²	4	57.8 Å²	57.8	2%	0.021	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	119.2	171.4	-61.4	162.3	0	0	0	108.1	H2819 G2821 C2825 A2826 T2840 G2841 K3206 C3221 G3225 I3227	H2819-I2823 HydrophobicContact CB-CG1 4.31Å; H2819-I2823 VanDerWaalsContact CD2-CG1 3.47Å; H2819-I2823 WeakPolarHBondContact CD2-CG1 3.34Å; G2821-I2823 PolarHBondContact O-N 3.45Å; I2823-C2825 WeakPolarHBondContact CG2-O 3.25Å; I2823-A2826 HydrophobicContact CG2-CB 4.49Å; I2823-T2840 HydrophobicContact CG2-CG2 4.39Å; I2823-G2841 WeakPolarHBondContact CA-O 3.33Å; I2823-K3206 VanDerWaalsContact O-CB 3.27Å; I2823-K3206 WeakPolarHBondContact O-CB 3.12Å; I2823-C3221 HydrophobicContact CB-CB 3.84Å; I2823-C3221 HydrophobicContact CD1-CB 4.21Å; I2823-C3221 HydrophobicContact CG2-CB 3.6Å; I2823-G3225 WeakPolarHBondContact CD1-O 3.17Å; I2823-I3227 HydrophobicContact CD1-CD1 4.31Å; I2823-I3227 HydrophobicContact CD1-CG1 3.53Å
2824	I	81.6	Confident	70.9	Confident	55.5 Å²	55.5	53.9 Å²	53.9	29%	0.285	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-24.3	-175.9	48.7	168.1	0	0	0	112.9	P2822 G2841 V2843 I2903	P2822-I2824 PolarHBondContact O-N 2.93Å; I2824-G2841 WeakPolarHBondContact CG1-O 3.42Å; I2824-G2841 PolarHBondContact N-O 3.16Å; I2824-V2843 HydrophobicContact CB-CG2 4.43Å; I2824-V2843 HydrophobicContact CD1-CG2 4.09Å; I2824-V2843 HydrophobicContact CG1-CG2 4.3Å; I2824-V2843 HydrophobicContact CG2-CG2 3.55Å; I2824-V2843 VanDerWaalsContact CG2-CG2 3.4Å; I2824-I2903 VanDerWaalsContact CD1-O 3.3Å; I2824-I2903 WeakPolarHBondContact CD1-O 3.19Å; I2824-I2903 VanDerWaalsContact CG1-O 3.31Å; I2824-I2903 WeakPolarHBondContact CG1-O 3.34Å
2825	C	82.8	Confident	73.3	Confident	10.5 Å²	10.5	45.2 Å²	45.2	7%	0.071	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	149.7	173.1	64.7	0	0	0	0	111.3	I2823 G2841 I2903 N2904 I2906	I2823-C2825 WeakPolarHBondContact CG2-O 3.25Å; C2825-G2841 PolarHBondContact N-O 3.11Å; C2825-G2841 PolarHBondContact O-N 3.1Å; C2825-I2903 PolarHBondContact SG-O 2.99Å; C2825-N2904 WeakPolarHBondContact CB-O 3.32Å; C2825-I2906 VanDerWaalsContact SG-CD1 3.56Å
2826	A	86.7	Confident	75.5	Confident	11.5 Å²	11.5	41.6 Å²	41.6	10%	0.095	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	146.8	176.9	0	0	0	0	0	109.9	I2823 I2839 T2840 K3207 V3209 M3219	I2823-A2826 HydrophobicContact CG2-CB 4.49Å; A2826-I2839 CarbonylContact C-O 3.55Å; A2826-I2839 VanDerWaalsContact CA-O 3.23Å; A2826-I2839 WeakPolarHBondContact CA-O 3.22Å; A2826-T2840 HydrophobicContact CB-CG2 3.95Å; A2826-K3207 HydrophobicContact CB-CG 4.34Å; A2826-V3209 HydrophobicContact CB-CG2 3.89Å; A2826-V3209 WeakPolarHBondContact O-CG2 3.3Å; A2826-M3219 HydrophobicContact CB-CE 3.77Å
2827	N	85.6	Confident	77.2	Confident	40.5 Å²	40.5	37.5 Å²	37.5	22%	0.217	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	171.2	175.8	-149.2	-31.4	0	0	0	110.5	I2839 I2906 V2907 T2908	N2827-I2839 PolarHBondContact N-O 3.07Å; N2827-I2839 PolarHBondContact O-N 2.8Å; N2827-I2906 HydrophobicContact CB-CB 4.42Å; N2827-I2906 HydrophobicContact CB-CG2 4.01Å; N2827-I2906 WeakPolarHBondContact CB-O 3.19Å; N2827-I2906 PolarHBondContact ND2-O 3.08Å; N2827-V2907 WeakPolarHBondContact ND2-CA 3.46Å; N2827-T2908 HydrophobicContact CB-CG2 4.39Å; N2827-T2908 PolarHBondContact OD1-OG1 2.91Å
2828	Y	84.4	Confident	78.4	Confident	43 Å²	43	36.6 Å²	36.6	17%	0.169	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	150.5	178.9	-1.6	-86.6	0	0	0	112.2	N2830 Q2836 L2837 C2838 V2852 Y2886 T2908 V3209 T3210 F3211	Y2828-N2830 WeakPolarHBondContact CE2-OD1 3.11Å; Y2828-Q2836 HydrophobicContact CD1-CB 4.5Å; Y2828-L2837 CarbonylContact C-O 3.53Å; Y2828-L2837 VanDerWaalsContact CA-O 3.27Å; Y2828-L2837 WeakPolarHBondContact CA-O 3.15Å; Y2828-C2838 HydrophobicContact CD1-CB 3.82Å; Y2828-C2838 HydrophobicContact CE1-CB 3.36Å; Y2828-C2838 HydrophobicContact CE2-CB 4.45Å; Y2828-C2838 PolarHBondContact OH-SG 2.71Å; Y2828-V2852 HydrophobicContact CE1-CG2 4.21Å; Y2828-Y2886 HydrophobicContact CE1-CE1 4.42Å; Y2828-Y2886 PolarHBondContact OH-OH 3.27Å; Y2828-T2908 WeakPolarHBondContact O-CB 3.33Å; Y2828-T2908 PolarHBondContact O-OG1 2.76Å; Y2828-V3209 HydrophobicContact CD1-CG1 3.76Å; Y2828-V3209 HydrophobicContact CE1-CG1 4.23Å; Y2828-T3210 WeakPolarHBondContact CE1-O 3.08Å; Y2828-F3211 HydrophobicContact CD1-CB 3.64Å; Y2828-F3211 HydrophobicContact CD2-CB 3.71Å; Y2828-F3211 HydrophobicContact CE1-CB 3.82Å; Y2828-F3211 HydrophobicContact CE2-CB 3.88Å; Y2828-F3211 HydrophobicContact CG-CB 3.59Å
2829	L	83.5	Confident	79.5	Confident	9 Å²	9	32.6 Å²	32.6	5%	0.047	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	118.6	173.8	-173.5	72.1	0	0	0	109.7	V2831 L2837 T2908 Y2922	L2829-V2831 HydrophobicContact CD2-CG2 4.49Å; L2829-V2831 PolarHBondContact O-N 3.05Å; L2829-L2837 HydrophobicContact CB-CB 4.35Å; L2829-L2837 HydrophobicContact CD2-CD1 4.38Å; L2829-L2837 PolarHBondContact N-O 3.28Å; L2829-L2837 PolarHBondContact O-N 3.16Å; L2829-T2908 HydrophobicContact CB-CG2 4.24Å; L2829-T2908 HydrophobicContact CD1-CG2 4.5Å; L2829-Y2922 HydrophobicContact CD1-CD1 3.97Å; L2829-Y2922 HydrophobicContact CD2-CD1 3.69Å; L2829-Y2922 HydrophobicContact CD2-CE1 4.44Å; L2829-Y2922 HydrophobicContact CD2-CG 4.22Å; L2829-Y2922 HydrophobicContact CG-CD1 4Å
2830	N	79.1	Confident	80.3	Confident	76.5 Å²	76.5	31.9 Å²	31.9	41%	0.409	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	109	174.4	-76.8	-20.5	0	0	0	110.1	Y2828 Q2836 R2910	Y2828-N2830 WeakPolarHBondContact CE2-OD1 3.11Å; N2830-Q2836 WeakPolarHBondContact OD1-CG 3.14Å; N2830-Q2836 PolarHBondContact OD1-NE2 3.05Å; N2830-R2910 PolarHBondContact O-NH1 2.97Å
2831	V	78.3	Confident	81.1	Confident	4 Å²	4	26.9 Å²	26.9	2%	0.024	14%	0.14	C	C	.	.			trans	-89.1	-66.9	178.5	174.5	0	0	0	0	109.4	L2829 L2835 L2837 R2910 L2950 I2954	L2829-V2831 HydrophobicContact CD2-CG2 4.49Å; L2829-V2831 PolarHBondContact O-N 3.05Å; V2831-L2835 HydrophobicContact CB-CD2 4.44Å; V2831-L2835 HydrophobicContact CB-CG 4.49Å; V2831-L2835 WeakPolarHBondContact CB-O 3.33Å; V2831-L2835 HydrophobicContact CG1-CD2 4.29Å; V2831-L2835 PolarHBondContact N-O 2.91Å; V2831-L2837 HydrophobicContact CG2-CD1 4.24Å; V2831-L2837 HydrophobicContact CG2-CG 4.09Å; V2831-R2910 PolarHBondContact O-NH1 2.94Å; V2831-L2950 HydrophobicContact CG1-CD2 3.52Å; V2831-L2950 HydrophobicContact CG1-CG 4.43Å; V2831-I2954 HydrophobicContact CB-CD1 4.38Å; V2831-I2954 HydrophobicContact CG1-CD1 3.47Å; V2831-I2954 HydrophobicContact CG2-CD1 3.99Å; V2831-I2954 HydrophobicContact CG2-CG2 4.32Å
2832	T	76.5	Confident	82	Confident	20 Å²	20	26.2 Å²	26.2	12%	0.123	13%	0.133	C	C	.	.	S	Bend	trans	-122.3	-173.4	173.1	62	0	0	0	0	110	N2834 L2835 E2947 L2950 E2951	T2832-N2834 VanDerWaalsContact C-N 3.35Å; T2832-N2834 PolarHBondContact O-N 2.9Å; T2832-N2834 PolarHBondContact OG1-N 2.81Å; T2832-N2834 VanDerWaalsContact OG1-N 3.09Å; T2832-L2835 PolarHBondContact N-O 3.04Å; T2832-L2835 PolarHBondContact OG1-N 3.29Å; T2832-E2947 HydrophobicContact CG2-CB 4.17Å; T2832-E2947 HydrophobicContact CG2-CG 4.38Å; T2832-L2950 HydrophobicContact CG2-CD2 3.82Å; T2832-E2951 WeakPolarHBondContact CB-OE1 3.16Å; T2832-E2951 HydrophobicContact CG2-CG 3.73Å; T2832-E2951 PolarHBondContact OG1-OE1 3.04Å
2833	K	71.3	Confident	82.5	Confident	172.5 Å²	172.5	27.6 Å²	27.6	75%	0.75	14%	0.141	S	C	*	.	S	Bend	trans	-71.1	-21.9	169.2	-69.5	177.9	-179.4	171.5	0	113.3
2834	N	75.7	Confident	82.3	Confident	34.5 Å²	34.5	28.6 Å²	28.6	18%	0.184	15%	0.146	C	C	.	.	S	Bend	trans	-101.6	-33.1	-176.4	-45.3	-50.5	0	0	0	112.4	T2832 Y2853 D2854 T2857 E2951	T2832-N2834 VanDerWaalsContact C-N 3.35Å; T2832-N2834 PolarHBondContact O-N 2.9Å; T2832-N2834 PolarHBondContact OG1-N 2.81Å; T2832-N2834 VanDerWaalsContact OG1-N 3.09Å; N2834-Y2853 VanDerWaalsContact O-CA 3.31Å; N2834-Y2853 WeakPolarHBondContact O-CA 3.15Å; N2834-D2854 PolarHBondContact O-N 2.89Å; N2834-D2854 VanDerWaalsContact O-N 3.07Å; N2834-T2857 PolarHBondContact OD1-OG1 2.81Å; N2834-T2857 VanDerWaalsContact OD1-OG1 3.07Å; N2834-E2951 WeakPolarHBondContact CB-OE1 3.27Å; N2834-E2951 PolarHBondContact ND2-OE1 2.82Å
2835	L	79.1	Confident	82.3	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	122.9	-178.1	179.5	65.4	0	0	0	111.3	V2831 T2832 L2837 A2851 Y2853 E2951 L2955	V2831-L2835 HydrophobicContact CB-CD2 4.44Å; V2831-L2835 HydrophobicContact CB-CG 4.49Å; V2831-L2835 WeakPolarHBondContact CB-O 3.33Å; V2831-L2835 HydrophobicContact CG1-CD2 4.29Å; V2831-L2835 PolarHBondContact N-O 2.91Å; T2832-L2835 PolarHBondContact N-O 3.04Å; T2832-L2835 PolarHBondContact OG1-N 3.29Å; L2835-L2837 HydrophobicContact CD1-CD2 4.49Å; L2835-A2851 HydrophobicContact CD1-CB 3.86Å; L2835-Y2853 HydrophobicContact CD1-CD1 4.28Å; L2835-Y2853 HydrophobicContact CD1-CE1 3.89Å; L2835-E2951 HydrophobicContact CB-CG 3.8Å; L2835-E2951 HydrophobicContact CD2-CB 3.94Å; L2835-E2951 HydrophobicContact CD2-CG 3.91Å; L2835-L2955 HydrophobicContact CD1-CD2 4.31Å; L2835-L2955 HydrophobicContact CD2-CD1 4.4Å; L2835-L2955 HydrophobicContact CD2-CD2 4.35Å; L2835-L2955 HydrophobicContact CD2-CG 4.13Å
2836	Q	82.2	Confident	82.4	Confident	24 Å²	24	25.6 Å²	25.6	11%	0.112	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	141.1	167.5	-56.8	180	-51.7	0	0	109.1	Y2828 N2830 V2852 F3211	Y2828-Q2836 HydrophobicContact CD1-CB 4.5Å; N2830-Q2836 WeakPolarHBondContact OD1-CG 3.14Å; N2830-Q2836 PolarHBondContact OD1-NE2 3.05Å; Q2836-V2852 HydrophobicContact CB-CB 4.36Å; Q2836-V2852 PolarHBondContact N-O 2.87Å; Q2836-V2852 PolarHBondContact O-N 3.13Å; Q2836-F3211 PolarHBondContact NE2-O 2.75Å; Q2836-F3211 VanDerWaalsContact OE1-CD2 3.23Å
2837	L	86.2	Confident	82.5	Confident	1.5 Å²	1.5	25 Å²	25	1%	0.008	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.2	170.6	-62.5	-179.3	0	0	0	109.3	Y2828 L2829 V2831 L2835 I2849 W2850 A2851 L2889 I2954 F2958	Y2828-L2837 CarbonylContact C-O 3.53Å; Y2828-L2837 VanDerWaalsContact CA-O 3.27Å; Y2828-L2837 WeakPolarHBondContact CA-O 3.15Å; L2829-L2837 HydrophobicContact CB-CB 4.35Å; L2829-L2837 HydrophobicContact CD2-CD1 4.38Å; L2829-L2837 PolarHBondContact N-O 3.28Å; L2829-L2837 PolarHBondContact O-N 3.16Å; V2831-L2837 HydrophobicContact CG2-CD1 4.24Å; V2831-L2837 HydrophobicContact CG2-CG 4.09Å; L2835-L2837 HydrophobicContact CD1-CD2 4.49Å; L2837-I2849 HydrophobicContact CB-CG2 4.44Å; L2837-I2849 HydrophobicContact CD1-CG2 4.47Å; L2837-I2849 HydrophobicContact CD2-CG2 4.37Å; L2837-W2850 CarbonylContact C-O 3.52Å; L2837-W2850 VanDerWaalsContact CA-O 3.32Å; L2837-W2850 WeakPolarHBondContact CA-O 3.33Å; L2837-A2851 HydrophobicContact CD2-CB 4.46Å; L2837-L2889 HydrophobicContact CD2-CD1 3.67Å; L2837-I2954 HydrophobicContact CD1-CG2 3.75Å; L2837-I2954 HydrophobicContact CG-CG2 4.45Å; L2837-F2958 HydrophobicContact CD1-CD2 4.08Å; L2837-F2958 HydrophobicContact CD1-CE2 3.66Å
2838	C	86.8	Confident	82.5	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	138.4	167.3	-121.7	0	0	0	0	109.2	Y2828 I2849 W2850 V2852 Y2886 M3219 F3229	Y2828-C2838 HydrophobicContact CD1-CB 3.82Å; Y2828-C2838 HydrophobicContact CE1-CB 3.36Å; Y2828-C2838 HydrophobicContact CE2-CB 4.45Å; Y2828-C2838 PolarHBondContact OH-SG 2.71Å; C2838-I2849 CarbonylContact O-C 3.58Å; C2838-I2849 WeakPolarHBondContact O-CA 3.42Å; C2838-W2850 HydrophobicContact CB-CB 4.23Å; C2838-W2850 PolarHBondContact N-O 3Å; C2838-W2850 VanDerWaalsContact O-CD1 3.32Å; C2838-W2850 PolarHBondContact O-N 2.95Å; C2838-V2852 HydrophobicContact CB-CG2 4.12Å; C2838-Y2886 HydrophobicContact CB-CD1 4.36Å; C2838-Y2886 HydrophobicContact CB-CE1 3.89Å; C2838-M3219 HydrophobicContact CB-CE 4.25Å; C2838-M3219 HydrophobicContact CB-SD 3.82Å; C2838-F3229 HydrophobicContact CB-CZ 4.46Å
2839	I	89.7	Confident	82.7	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	129.1	-178.1	-47.7	-178.7	0	0	0	107.8	A2826 N2827 C2847 I2848 I2849 I2906 T2908 I2924	A2826-I2839 CarbonylContact C-O 3.55Å; A2826-I2839 VanDerWaalsContact CA-O 3.23Å; A2826-I2839 WeakPolarHBondContact CA-O 3.22Å; N2827-I2839 PolarHBondContact N-O 3.07Å; N2827-I2839 PolarHBondContact O-N 2.8Å; I2839-C2847 WeakPolarHBondContact CG2-SG 3.35Å; I2839-I2848 WeakPolarHBondContact CA-O 3.37Å; I2839-I2849 HydrophobicContact CG1-CG1 4.33Å; I2839-I2849 HydrophobicContact CG1-CG2 4.41Å; I2839-I2849 HydrophobicContact CG2-CG1 4.11Å; I2839-I2906 HydrophobicContact CB-CG2 4.15Å; I2839-I2906 HydrophobicContact CG2-CD1 3.93Å; I2839-I2906 HydrophobicContact CG2-CG2 3.93Å; I2839-T2908 HydrophobicContact CD1-CG2 3.86Å; I2839-I2924 HydrophobicContact CD1-CB 4.41Å; I2839-I2924 HydrophobicContact CD1-CD1 3.75Å; I2839-I2924 HydrophobicContact CD1-CG1 3.93Å; I2839-I2924 HydrophobicContact CD1-CG2 3.59Å
2840	T	88.8	Confident	82.8	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.7	-174.6	55	0	0	0	0	111.7	H2819 I2823 A2826 C2847 I2848 W2850 M3219 I3227	H2819-T2840 PolarHBondContact CD2-OG1 3.25Å; H2819-T2840 PolarHBondContact CE1-O 2.98Å; H2819-T2840 VanDerWaalsContact CE1-O 3.23Å; H2819-T2840 PolarHBondContact NE2-O 3.33Å; H2819-T2840 VanDerWaalsContact NE2-O 3.14Å; H2819-T2840 PolarHBondContact NE2-OG1 3.21Å; I2823-T2840 HydrophobicContact CG2-CG2 4.39Å; A2826-T2840 HydrophobicContact CB-CG2 3.95Å; T2840-C2847 CarbonylContact O-C 3.57Å; T2840-C2847 WeakPolarHBondContact O-CA 3.47Å; T2840-I2848 PolarHBondContact N-O 3.15Å; T2840-I2848 PolarHBondContact O-N 3.19Å; T2840-I2848 PolarHBondContact OG1-O 2.88Å; T2840-I2848 VanDerWaalsContact OG1-O 3.1Å; T2840-W2850 PolarHBondContact OG1-NE1 3.14Å; T2840-M3219 HydrophobicContact CG2-SD 4.19Å; T2840-I3227 HydrophobicContact CG2-CD1 3.57Å; T2840-I3227 HydrophobicContact CG2-CG1 4.27Å
2841	G	86.6	Confident	83	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135.7	179.2	0	0	0	0	0	111.9	I2823 I2824 C2825 I2906	I2823-G2841 WeakPolarHBondContact CA-O 3.33Å; I2824-G2841 WeakPolarHBondContact CG1-O 3.42Å; I2824-G2841 PolarHBondContact N-O 3.16Å; C2825-G2841 PolarHBondContact N-O 3.11Å; C2825-G2841 PolarHBondContact O-N 3.1Å; G2841-I2906 VanDerWaalsContact N-CD1 3.33Å
2842	S	84.8	Confident	83	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	161.8	-175.5	171.3	0	0	0	0	112.8	H2819 G2821 P2822 D2844 G2845 D2846 I2903	H2819-S2842 WeakPolarHBondContact ND1-CB 3.22Å; G2821-S2842 WeakPolarHBondContact CA-OG 3.46Å; G2821-S2842 PolarHBondContact O-OG 3.22Å; P2822-S2842 WeakPolarHBondContact O-CA 3.2Å; P2822-S2842 PolarHBondContact O-OG 3.08Å; P2822-S2842 VanDerWaalsContact O-OG 3.12Å; S2842-D2844 WeakPolarHBondContact CB-OD1 3.37Å; S2842-D2844 PolarHBondContact O-N 2.95Å; S2842-D2844 PolarHBondContact OG-N 3.41Å; S2842-D2844 VanDerWaalsContact OG-N 3.16Å; S2842-D2844 PolarHBondContact OG-OD1 3.09Å; S2842-D2844 PolarHBondContact OG-OD2 3.27Å; S2842-G2845 PolarHBondContact O-N 2.75Å; S2842-G2845 VanDerWaalsContact O-N 3.08Å; S2842-D2846 PolarHBondContact N-O 3.18Å; S2842-D2846 VanDerWaalsContact N-O 3.14Å; S2842-I2903 PolarHBondContact O-N 3.38Å
2843	V	81.9	Confident	82.7	Confident	72.5 Å²	72.5	19.3 Å²	19.3	44%	0.439	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.8	169.4	-177.1	0	0	0	0	111.8	P2822 I2824 G2845	P2822-V2843 HydrophobicContact CB-CG2 4.37Å; P2822-V2843 HydrophobicContact CG-CB 4.31Å; P2822-V2843 HydrophobicContact CG-CG2 3.83Å; P2822-V2843 PolarHBondContact O-N 3.33Å; P2822-V2843 VanDerWaalsContact O-N 3.12Å; I2824-V2843 HydrophobicContact CB-CG2 4.43Å; I2824-V2843 HydrophobicContact CD1-CG2 4.09Å; I2824-V2843 HydrophobicContact CG1-CG2 4.3Å; I2824-V2843 HydrophobicContact CG2-CG2 3.55Å; I2824-V2843 VanDerWaalsContact CG2-CG2 3.4Å; V2843-G2845 PolarHBondContact O-N 3.04Å; V2843-G2845 VanDerWaalsContact O-N 3.17Å
2844	D	77.3	Confident	82.2	Confident	24.5 Å²	24.5	13.7 Å²	13.7	13%	0.131	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-4.4	174.9	67.6	20.8	0	0	0	114.5	H2819 T2820 G2821 S2842 D2846 R2891 R2900	H2819-D2844 IonicContact ND1-OD1 2.7Å; T2820-D2844 WeakPolarHBondContact CA-OD2 3.32Å; T2820-D2844 PolarHBondContact N-OD2 3.17Å; T2820-D2844 VanDerWaalsContact OG1-CB 3.27Å; T2820-D2844 WeakPolarHBondContact OG1-CB 3.36Å; T2820-D2844 VanDerWaalsContact OG1-CG 3.27Å; T2820-D2844 PolarHBondContact OG1-OD2 3.22Å; G2821-D2844 PolarHBondContact N-OD2 3.2Å; G2821-D2844 VanDerWaalsContact N-OD2 3.07Å; S2842-D2844 WeakPolarHBondContact CB-OD1 3.37Å; S2842-D2844 PolarHBondContact O-N 2.95Å; S2842-D2844 PolarHBondContact OG-N 3.41Å; S2842-D2844 VanDerWaalsContact OG-N 3.16Å; S2842-D2844 PolarHBondContact OG-OD1 3.09Å; S2842-D2844 PolarHBondContact OG-OD2 3.27Å; D2844-D2846 VanDerWaalsContact C-N 3.33Å; D2844-D2846 WeakPolarHBondContact OD1-CB 3.37Å; D2844-D2846 PolarHBondContact OD1-N 3.06Å; D2844-R2891 IonicContact OD2-NH2 3.76Å; D2844-R2900 VanDerWaalsContact O-CB 3.27Å; D2844-R2900 WeakPolarHBondContact O-CB 3.37Å; D2844-R2900 WeakPolarHBondContact O-CD 3.33Å; D2844-R2900 PolarHBondContact O-NH1 3.33Å
2845	G	80.3	Confident	80.9	Confident	2.5 Å²	2.5	13.9 Å²	13.9	3%	0.026	8%	0.075	C	C	.	.	S	Bend	trans	77.2	15.9	177.8	0	0	0	0	0	115.3	S2842 V2843 Y2901	S2842-G2845 PolarHBondContact O-N 2.75Å; S2842-G2845 VanDerWaalsContact O-N 3.08Å; V2843-G2845 PolarHBondContact O-N 3.04Å; V2843-G2845 VanDerWaalsContact O-N 3.17Å; G2845-Y2901 WeakPolarHBondContact CA-O 3.33Å
2846	D	85.2	Confident	79.4	Confident	0.5 Å²	0.5	18.6 Å²	18.6	0%	0.003	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	141.9	172	-60.1	-27.2	0	0	0	112.1	H2819 S2842 D2844 R2891 L2892 T2893 R2900 I2903	H2819-D2846 PolarHBondContact CE1-O 3.06Å; H2819-D2846 VanDerWaalsContact CE1-O 3.24Å; H2819-D2846 PolarHBondContact ND1-O 3.38Å; S2842-D2846 PolarHBondContact N-O 3.18Å; S2842-D2846 VanDerWaalsContact N-O 3.14Å; D2844-D2846 VanDerWaalsContact C-N 3.33Å; D2844-D2846 WeakPolarHBondContact OD1-CB 3.37Å; D2844-D2846 PolarHBondContact OD1-N 3.06Å; D2846-R2891 HydrophobicContact CB-CG 4.03Å; D2846-R2891 IonicContact OD2-CZ 3.45Å; D2846-R2891 IonicContact OD2-NE 3.81Å; D2846-R2891 PolarHBondContact OD2-NE 3.15Å; D2846-R2891 IonicContact OD2-NH2 3.86Å; D2846-R2891 PolarHBondContact OD2-NH2 2.66Å; D2846-L2892 WeakPolarHBondContact CA-O 3.35Å; D2846-T2893 WeakPolarHBondContact OD1-CB 3.48Å; D2846-T2893 WeakPolarHBondContact OD1-CG2 3.34Å; D2846-R2900 IonicContact OD1-CZ 3.89Å; D2846-R2900 IonicContact OD1-NE 3.85Å; D2846-R2900 PolarHBondContact OD1-NE 3.34Å; D2846-R2900 IonicContact OD1-NH1 3.04Å; D2846-R2900 PolarHBondContact OD1-NH1 3.18Å; D2846-R2900 IonicContact OD1-NH2 3.1Å; D2846-R2900 PolarHBondContact OD1-NH2 2.82Å; D2846-R2900 VanDerWaalsContact OD1-NH2 3.14Å; D2846-R2900 IonicContact OD2-CZ 3.25Å; D2846-R2900 IonicContact OD2-NH1 2.99Å; D2846-R2900 PolarHBondContact OD2-NH1 3.07Å; D2846-R2900 IonicContact OD2-NH2 3.32Å; D2846-I2903 WeakPolarHBondContact O-CD1 3.29Å
2847	C	88	Confident	77.3	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.6	174.5	-179.9	0	0	0	0	108.4	I2839 T2840 R2891 L2892 I2903	I2839-C2847 WeakPolarHBondContact CG2-SG 3.35Å; T2840-C2847 CarbonylContact O-C 3.57Å; T2840-C2847 WeakPolarHBondContact O-CA 3.47Å; C2847-R2891 CarbonylContact O-C 3.54Å; C2847-R2891 WeakPolarHBondContact O-CA 3.42Å; C2847-L2892 HydrophobicContact CB-CB 4.27Å; C2847-L2892 PolarHBondContact N-O 3.18Å; C2847-L2892 PolarHBondContact O-N 3.45Å; C2847-I2903 HydrophobicContact CB-CD1 3.64Å; C2847-I2903 VanDerWaalsContact N-CD1 3.31Å
2848	I	87.5	Confident	74.7	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.4	177.9	-56	176.5	0	0	0	109.7	L2817 H2819 I2839 T2840 W2850 P2888 I2890 R2891	L2817-I2848 HydrophobicContact CB-CD1 4.31Å; L2817-I2848 HydrophobicContact CB-CG2 4.34Å; L2817-I2848 HydrophobicContact CD2-CG1 4.48Å; L2817-I2848 HydrophobicContact CD2-CG2 3.98Å; L2817-I2848 HydrophobicContact CG-CD1 4.32Å; L2817-I2848 HydrophobicContact CG-CG2 4.33Å; L2817-I2848 WeakPolarHBondContact O-CD1 3.48Å; H2819-I2848 VanDerWaalsContact CE1-CG1 3.46Å; H2819-I2848 WeakPolarHBondContact CE1-CG1 3.47Å; I2839-I2848 WeakPolarHBondContact CA-O 3.37Å; T2840-I2848 PolarHBondContact N-O 3.15Å; T2840-I2848 PolarHBondContact O-N 3.19Å; T2840-I2848 PolarHBondContact OG1-O 2.88Å; T2840-I2848 VanDerWaalsContact OG1-O 3.1Å; I2848-W2850 HydrophobicContact CB-CZ2 4.07Å; I2848-W2850 HydrophobicContact CD1-CZ2 4.26Å; I2848-W2850 HydrophobicContact CG2-CD2 4Å; I2848-W2850 VanDerWaalsContact CG2-CE2 3.43Å; I2848-W2850 HydrophobicContact CG2-CG 4.34Å; I2848-W2850 HydrophobicContact CG2-CH2 4.25Å; I2848-W2850 HydrophobicContact CG2-CZ2 3.54Å; I2848-W2850 PolarHBondContact O-NE1 3.15Å; I2848-P2888 HydrophobicContact CG2-CB 4.26Å; I2848-I2890 WeakPolarHBondContact CA-O 3.35Å; I2848-R2891 HydrophobicContact CD1-CG 4.36Å; I2848-R2891 HydrophobicContact CG1-CB 4.2Å; I2848-R2891 HydrophobicContact CG1-CG 4.11Å
2849	I	88	Confident	72.2	Confident	0.5 Å²	0.5	35 Å²	35	0%	0.003	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	129.3	176	-56.6	175	0	0	0	108.8	L2837 C2838 I2839 L2889 I2890 L2892 F2958	L2837-I2849 HydrophobicContact CB-CG2 4.44Å; L2837-I2849 HydrophobicContact CD1-CG2 4.47Å; L2837-I2849 HydrophobicContact CD2-CG2 4.37Å; C2838-I2849 CarbonylContact O-C 3.58Å; C2838-I2849 WeakPolarHBondContact O-CA 3.42Å; I2839-I2849 HydrophobicContact CG1-CG1 4.33Å; I2839-I2849 HydrophobicContact CG1-CG2 4.41Å; I2839-I2849 HydrophobicContact CG2-CG1 4.11Å; I2849-L2889 HydrophobicContact CG2-CD1 4.27Å; I2849-L2889 PolarHBondContact O-N 2.97Å; I2849-I2890 HydrophobicContact CB-CG2 3.92Å; I2849-I2890 HydrophobicContact CD1-CG2 3.9Å; I2849-I2890 HydrophobicContact CG1-CG2 4.13Å; I2849-I2890 PolarHBondContact N-O 2.91Å; I2849-L2892 HydrophobicContact CD1-CD1 4.09Å; I2849-F2958 HydrophobicContact CD1-CD1 3.65Å; I2849-F2958 HydrophobicContact CD1-CE1 3.39Å; I2849-F2958 VanDerWaalsContact CD1-CE1 3.48Å; I2849-F2958 HydrophobicContact CD1-CG 4.35Å; I2849-F2958 HydrophobicContact CD1-CZ 4.03Å
2850	W	85.1	Confident	69.3	Low	23.5 Å²	23.5	40.3 Å²	40.3	9%	0.089	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.1	-175.4	-46	80.9	0	0	0	110	T2816 L2817 L2837 C2838 T2840 I2848 Y2886 Q2887 P2888 I3227	T2816-W2850 WeakPolarHBondContact O-CH2 3.32Å; T2816-W2850 WeakPolarHBondContact O-CZ3 3.42Å; L2817-W2850 VanDerWaalsContact O-CH2 3.23Å; L2817-W2850 WeakPolarHBondContact O-CH2 3.37Å; L2837-W2850 CarbonylContact C-O 3.52Å; L2837-W2850 VanDerWaalsContact CA-O 3.32Å; L2837-W2850 WeakPolarHBondContact CA-O 3.33Å; C2838-W2850 HydrophobicContact CB-CB 4.23Å; C2838-W2850 PolarHBondContact N-O 3Å; C2838-W2850 VanDerWaalsContact O-CD1 3.32Å; C2838-W2850 PolarHBondContact O-N 2.95Å; T2840-W2850 PolarHBondContact OG1-NE1 3.14Å; I2848-W2850 HydrophobicContact CB-CZ2 4.07Å; I2848-W2850 HydrophobicContact CD1-CZ2 4.26Å; I2848-W2850 HydrophobicContact CG2-CD2 4Å; I2848-W2850 VanDerWaalsContact CG2-CE2 3.43Å; I2848-W2850 HydrophobicContact CG2-CG 4.34Å; I2848-W2850 HydrophobicContact CG2-CH2 4.25Å; I2848-W2850 HydrophobicContact CG2-CZ2 3.54Å; I2848-W2850 PolarHBondContact O-NE1 3.15Å; W2850-Y2886 HydrophobicContact CB-CD1 4.1Å; W2850-Q2887 CarbonylContact C-O 3.54Å; W2850-Q2887 WeakPolarHBondContact CA-O 3.43Å; W2850-P2888 HydrophobicContact CD2-CB 4.42Å; W2850-P2888 HydrophobicContact CE3-CB 3.72Å; W2850-P2888 HydrophobicContact CE3-CG 4.27Å; W2850-P2888 HydrophobicContact CH2-CB 4.49Å; W2850-P2888 HydrophobicContact CZ3-CB 3.77Å; W2850-P2888 HydrophobicContact CZ3-CG 4.06Å; W2850-I3227 HydrophobicContact CD2-CD1 4.22Å; W2850-I3227 HydrophobicContact CH2-CD1 4.39Å; W2850-I3227 HydrophobicContact CZ2-CD1 3.49Å; W2850-I3227 VanDerWaalsContact CZ2-CD1 3.49Å; W2850-I3227 VanDerWaalsContact NE1-CD1 3.28Å
2851	A	82.7	Confident	66.8	Low	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	130.8	165.5	0	0	0	0	0	110.1	L2835 L2837 Y2853 Y2886 Q2887 L2889 L2955	L2835-A2851 HydrophobicContact CD1-CB 3.86Å; L2837-A2851 HydrophobicContact CD2-CB 4.46Å; A2851-Y2853 HydrophobicContact CB-CE2 3.94Å; A2851-Y2886 CarbonylContact O-C 3.51Å; A2851-Y2886 VanDerWaalsContact O-CA 3.3Å; A2851-Y2886 WeakPolarHBondContact O-CA 3.43Å; A2851-Q2887 HydrophobicContact CB-CB 4.47Å; A2851-Q2887 PolarHBondContact N-O 3.09Å; A2851-Q2887 PolarHBondContact O-N 3.29Å; A2851-L2889 HydrophobicContact CB-CD1 4.11Å; A2851-L2889 HydrophobicContact CB-CD2 3.95Å; A2851-L2889 HydrophobicContact CB-CG 4.08Å; A2851-L2955 HydrophobicContact CB-CD2 3.82Å
2852	V	78.6	Confident	64.1	Low	3.5 Å²	3.5	54.5 Å²	54.5	2%	0.021	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.9	175.1	-172.7	0	0	0	0	108.2	Y2828 Q2836 C2838 Y2886 F3229	Y2828-V2852 HydrophobicContact CE1-CG2 4.21Å; Q2836-V2852 HydrophobicContact CB-CB 4.36Å; Q2836-V2852 PolarHBondContact N-O 2.87Å; Q2836-V2852 PolarHBondContact O-N 3.13Å; C2838-V2852 HydrophobicContact CB-CG2 4.12Å; V2852-Y2886 HydrophobicContact CB-CD1 4.44Å; V2852-Y2886 HydrophobicContact CB-CE1 4.38Å; V2852-Y2886 HydrophobicContact CG1-CD1 4.15Å; V2852-Y2886 HydrophobicContact CG1-CD2 4.22Å; V2852-Y2886 HydrophobicContact CG1-CE1 3.99Å; V2852-Y2886 HydrophobicContact CG1-CE2 3.76Å; V2852-Y2886 HydrophobicContact CG2-CD1 3.66Å; V2852-Y2886 VanDerWaalsContact CG2-CD1 3.45Å; V2852-Y2886 HydrophobicContact CG2-CD2 4.3Å; V2852-Y2886 HydrophobicContact CG2-CE1 3.58Å; V2852-Y2886 HydrophobicContact CG2-CE2 4.11Å; V2852-Y2886 HydrophobicContact CG2-CG 3.99Å; V2852-F3229 HydrophobicContact CG2-CE1 4.41Å; V2852-F3229 HydrophobicContact CG2-CZ 4.27Å
2853	Y	71.9	Confident	61.5	Low	46 Å²	46	60.1 Å²	60.1	18%	0.18	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	129.7	178.6	-63.8	-87.5	0	0	0	112	N2834 L2835 A2851 S2855 I2861 T2885 L2955	N2834-Y2853 VanDerWaalsContact O-CA 3.31Å; N2834-Y2853 WeakPolarHBondContact O-CA 3.15Å; L2835-Y2853 HydrophobicContact CD1-CD1 4.28Å; L2835-Y2853 HydrophobicContact CD1-CE1 3.89Å; A2851-Y2853 HydrophobicContact CB-CE2 3.94Å; Y2853-S2855 PolarHBondContact O-N 3.48Å; Y2853-I2861 HydrophobicContact CE1-CD1 4.46Å; Y2853-T2885 PolarHBondContact N-O 2.83Å; Y2853-L2955 WeakPolarHBondContact OH-CD1 3.36Å; Y2853-L2955 WeakPolarHBondContact OH-CD2 3.42Å
2854	D	60.2	Low	58.9	Low	53.5 Å²	53.5	66 Å²	66	29%	0.286	37%	0.367	S	S	.	.			trans	-80.3	117.1	170.9	-103.4	2.2	0	0	0	110.9	N2834 S2856 K3217	N2834-D2854 PolarHBondContact O-N 2.89Å; N2834-D2854 VanDerWaalsContact O-N 3.07Å; D2854-S2856 PolarHBondContact O-N 3.08Å; D2854-K3217 IonicContact OD1-NZ 3.45Å; D2854-K3217 PolarHBondContact OD1-NZ 3.42Å; D2854-K3217 IonicContact OD2-NZ 3.71Å; D2854-K3217 PolarHBondContact OD2-NZ 3.16Å
2855	S	48.9	Very low	56.6	Low	39 Å²	39	68.7 Å²	68.7	27%	0.273	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-66.1	4.1	-166.1	62.8	0	0	0	0	116.9	Y2853 T2857 S2858 T2882 T2883	Y2853-S2855 PolarHBondContact O-N 3.48Å; S2855-T2857 VanDerWaalsContact C-N 3.26Å; S2855-T2857 PolarHBondContact O-N 2.97Å; S2855-S2858 PolarHBondContact O-OG 2.93Å; S2855-S2858 VanDerWaalsContact O-OG 3.14Å; S2855-T2882 WeakPolarHBondContact OG-CB 3.5Å; S2855-T2883 WeakPolarHBondContact CB-O 3.29Å
2856	S	46.7	Very low	54.2	Low	98.5 Å²	98.5	74.9 Å²	74.9	69%	0.689	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-16	-173.6	54.3	0	0	0	0	115.3	D2854	D2854-S2856 PolarHBondContact O-N 3.08Å
2857	T	37.8	Very low	51.4	Low	86 Å²	86	80.6 Å²	80.6	53%	0.528	47%	0.465	S	S	.	.			trans	-136.9	21.5	-170.6	42.4	0	0	0	0	114.8	N2834 S2855 Q2859	N2834-T2857 PolarHBondContact OD1-OG1 2.81Å; N2834-T2857 VanDerWaalsContact OD1-OG1 3.07Å; S2855-T2857 VanDerWaalsContact C-N 3.26Å; S2855-T2857 PolarHBondContact O-N 2.97Å; T2857-Q2859 PolarHBondContact O-N 2.86Å
2858	S	32.5	Very low	48.7	Very low	111.5 Å²	111.5	87 Å²	87	78%	0.78	51%	0.505	S	S	*	.			trans	-73.4	59.2	-176	57.1	0	0	0	0	115.3	S2855	S2855-S2858 PolarHBondContact O-OG 2.93Å; S2855-S2858 VanDerWaalsContact O-OG 3.14Å
2859	Q	33.1	Very low	46	Very low	174 Å²	174	93 Å²	93	81%	0.813	54%	0.541	S	S	*	.	S	Bend	trans	-98.3	120.3	158	-73.9	-169.3	-3.9	0	0	110.1	T2857	T2857-Q2859 PolarHBondContact O-N 2.86Å
2860	S	30.1	Very low	43.4	Very low	110 Å²	110	99.5 Å²	99.5	77%	0.769	58%	0.581	S	S	*	*			trans	59.2	71	163.3	62	0	0	0	0	118.6
2861	I	36.7	Very low	40.9	Very low	109.5 Å²	109.5	104.8 Å²	104.8	56%	0.562	62%	0.616	S	S	*	*			trans	-108.5	99.1	141.8	-57.6	179.6	0	0	0	107.2	Y2853 I2948	Y2853-I2861 HydrophobicContact CE1-CD1 4.46Å; I2861-I2948 HydrophobicContact CD1-CG2 4.43Å
2862	K	28.5	Very low	38.6	Very low	190 Å²	190	111.8 Å²	111.8	83%	0.826	66%	0.659	S	S	*	*			trans	-86.2	123.2	168.6	-82.2	-179.4	176.1	174.8	0	108.1	M2864	K2862-M2864 PolarHBondContact O-N 2.97Å
2863	P	30.1	Very low	36.5	Very low	117.5 Å²	117.5	117.8 Å²	117.8	76%	0.763	70%	0.696	S	S	*	*			trans	-63.6	129.1	160.4	9.6	-4.3	0	0	0	108	A2865	P2863-A2865 PolarHBondContact O-N 3.46Å
2864	M	27.2	Very low	34.6	Very low	194.5 Å²	194.5	122.4 Å²	122.4	96%	0.958	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-65	102.9	-176.9	-136.6	164.1	76.6	0	0	112	K2862	K2862-M2864 PolarHBondContact O-N 2.97Å
2865	A	28.8	Very low	33.2	Very low	82 Å²	82	126.2 Å²	126.2	68%	0.678	76%	0.755	S	S	*	*			trans	-78.4	142.6	178.7	0	0	0	0	0	112.2	P2863 T2867	P2863-A2865 PolarHBondContact O-N 3.46Å; A2865-T2867 PolarHBondContact O-N 2.84Å
2866	T	29.9	Very low	32.3	Very low	133.5 Å²	133.5	130.8 Å²	130.8	82%	0.819	78%	0.781	S	S	*	*			trans	-106.2	93.4	154.5	45.4	0	0	0	0	109.3
2867	T	28.5	Very low	31.4	Very low	120 Å²	120	132.6 Å²	132.6	74%	0.736	79%	0.788	S	S	*	*				44.7	107.3	126.6	54.1	0	0	0	0	115	A2865	A2865-T2867 PolarHBondContact O-N 2.84Å
2868	T	30.8	Very low	31	Very low	135 Å²	135	134.5 Å²	134.5	83%	0.828	80%	0.8	S	S	*	*				-158.8	123.4	96.3	20.4	0	0	0	0	109.4
2869	T	30.4	Very low	30.9	Very low	125.5 Å²	125.5	135.4 Å²	135.4	77%	0.77	80%	0.801	S	S	*	*			trans	-19.9	132.4	150.4	47.8	0	0	0	0	114.1
2870	T	33.3	Very low	30.7	Very low	137.5 Å²	137.5	134 Å²	134	84%	0.844	80%	0.804	S	S	*	*				-166.6	119.1	86.6	9.6	0	0	0	0	109.5
2871	T	33.2	Very low	30.8	Very low	133 Å²	133	134.1 Å²	134.1	82%	0.816	80%	0.8	S	S	*	*			trans	-115.4	130.1	169.9	40.6	0	0	0	0	110.2
2872	T	34.7	Very low	30.8	Very low	148 Å²	148	134.8 Å²	134.8	91%	0.908	81%	0.81	S	S	*	*			trans	-103.1	130.5	168.2	35.7	0	0	0	0	109.7
2873	T	32.9	Very low	31.3	Very low	128.5 Å²	128.5	129.8 Å²	129.8	79%	0.788	80%	0.795	S	S	*	*			trans	-103.5	130.1	-178.4	42.8	0	0	0	0	111.1
2874	T	32.8	Very low	32.2	Very low	142.5 Å²	142.5	125.7 Å²	125.7	87%	0.874	77%	0.769	S	S	*	*			trans	-124	118.6	161	43.6	0	0	0	0	109.1
2875	T	30.4	Very low	33.6	Very low	135 Å²	135	120.2 Å²	120.2	83%	0.828	75%	0.746	S	S	*	*			trans	-82.3	126.8	-175.1	42.4	0	0	0	0	112.5
2876	T	30.8	Very low	35.4	Very low	134.5 Å²	134.5	119.3 Å²	119.3	83%	0.825	73%	0.725	S	S	*	*			trans	-129.3	123.6	157.3	45	0	0	0	0	109.5	T2878	T2876-T2878 PolarHBondContact O-N 3.4Å
2877	T	28.1	Very low	37.4	Very low	137.5 Å²	137.5	117.8 Å²	117.8	84%	0.844	71%	0.709	S	S	*	*			trans	-74.5	123.6	-178.5	45.9	0	0	0	0	112.3
2878	T	28.8	Very low	39.6	Very low	126 Å²	126	112.9 Å²	112.9	77%	0.773	68%	0.679	S	S	*	*			trans	-141.5	138.8	150.6	42	0	0	0	0	111.9	T2876 T2880	T2876-T2878 PolarHBondContact O-N 3.4Å; T2878-T2880 PolarHBondContact O-N 2.84Å
2879	T	30.4	Very low	42	Very low	130 Å²	130	106.7 Å²	106.7	80%	0.798	64%	0.641	S	S	*	*			trans	1.1	112.5	169.6	50.8	0	0	0	0	115.5	T2881	T2879-T2881 PolarHBondContact O-N 2.91Å; T2879-T2881 VanDerWaalsContact O-N 3.15Å
2880	T	29.1	Very low	44.6	Very low	144.5 Å²	144.5	100.7 Å²	100.7	89%	0.887	60%	0.604	S	S	*	*			trans	-71.6	100.2	174.2	47.2	0	0	0	0	111.6	T2878	T2878-T2880 PolarHBondContact O-N 2.84Å
2881	T	31.5	Very low	47	Very low	111.5 Å²	111.5	95.7 Å²	95.7	68%	0.684	57%	0.57	S	S	*	*			trans	-83.2	132	158.9	45.3	0	0	0	0	108.8	T2879 T2883	T2879-T2881 PolarHBondContact O-N 2.91Å; T2879-T2881 VanDerWaalsContact O-N 3.15Å; T2881-T2883 PolarHBondContact O-N 3.04Å
2882	T	36.8	Very low	49.5	Very low	123.5 Å²	123.5	89.4 Å²	89.4	76%	0.758	53%	0.531	S	S	*	.			trans	-66.7	97.6	178.5	45.4	0	0	0	0	110.6	S2855	S2855-T2882 WeakPolarHBondContact OG-CB 3.5Å
2883	T	39.7	Very low	51.7	Low	85 Å²	85	82.7 Å²	82.7	52%	0.521	49%	0.49	S	S	.	.			trans	-93.7	108.5	178	52.3	0	0	0	0	110.4	S2855 T2881 T2885	S2855-T2883 WeakPolarHBondContact CB-O 3.29Å; T2881-T2883 PolarHBondContact O-N 3.04Å; T2883-T2885 PolarHBondContact O-N 2.53Å
2884	T	49.2	Very low	53.6	Low	33 Å²	33	78.6 Å²	78.6	20%	0.202	46%	0.462	C	S	.	.			trans	-62.9	129	159.8	36.7	0	0	0	0	109	Y2886	T2884-Y2886 WeakPolarHBondContact CB-OH 3.36Å; T2884-Y2886 WeakPolarHBondContact O-CE2 3.22Å; T2884-Y2886 VanDerWaalsContact OG1-CE2 3.23Å; T2884-Y2886 WeakPolarHBondContact OG1-CE2 3.43Å; T2884-Y2886 PolarHBondContact OG1-OH 3.41Å
2885	T	54.7	Low	55.1	Low	77.5 Å²	77.5	73.5 Å²	73.5	48%	0.475	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122.5	179.7	50.4	0	0	0	0	109.8	Y2853 T2883	Y2853-T2885 PolarHBondContact N-O 2.83Å; T2883-T2885 PolarHBondContact O-N 2.53Å
2886	Y	66.4	Low	56.3	Low	63.5 Å²	63.5	74.2 Å²	74.2	25%	0.249	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	126.9	174.6	-67.1	-100.6	0	0	0	108.8	Y2828 C2838 W2850 A2851 V2852 T2884 F3229	Y2828-Y2886 HydrophobicContact CE1-CE1 4.42Å; Y2828-Y2886 PolarHBondContact OH-OH 3.27Å; C2838-Y2886 HydrophobicContact CB-CD1 4.36Å; C2838-Y2886 HydrophobicContact CB-CE1 3.89Å; W2850-Y2886 HydrophobicContact CB-CD1 4.1Å; A2851-Y2886 CarbonylContact O-C 3.51Å; A2851-Y2886 VanDerWaalsContact O-CA 3.3Å; A2851-Y2886 WeakPolarHBondContact O-CA 3.43Å; V2852-Y2886 HydrophobicContact CB-CD1 4.44Å; V2852-Y2886 HydrophobicContact CB-CE1 4.38Å; V2852-Y2886 HydrophobicContact CG1-CD1 4.15Å; V2852-Y2886 HydrophobicContact CG1-CD2 4.22Å; V2852-Y2886 HydrophobicContact CG1-CE1 3.99Å; V2852-Y2886 HydrophobicContact CG1-CE2 3.76Å; V2852-Y2886 HydrophobicContact CG2-CD1 3.66Å; V2852-Y2886 VanDerWaalsContact CG2-CD1 3.45Å; V2852-Y2886 HydrophobicContact CG2-CD2 4.3Å; V2852-Y2886 HydrophobicContact CG2-CE1 3.58Å; V2852-Y2886 HydrophobicContact CG2-CE2 4.11Å; V2852-Y2886 HydrophobicContact CG2-CG 3.99Å; T2884-Y2886 WeakPolarHBondContact CB-OH 3.36Å; T2884-Y2886 WeakPolarHBondContact O-CE2 3.22Å; T2884-Y2886 VanDerWaalsContact OG1-CE2 3.23Å; T2884-Y2886 WeakPolarHBondContact OG1-CE2 3.43Å; T2884-Y2886 PolarHBondContact OG1-OH 3.41Å; Y2886-F3229 AromaticContact CD1-CD2 3.76Å; Y2886-F3229 HydrophobicContact CD1-CD2 3.76Å; Y2886-F3229 AromaticContact CD1-CE2 3.55Å; Y2886-F3229 HydrophobicContact CD1-CE2 3.55Å; Y2886-F3229 HydrophobicContact CD1-CG 4.34Å; Y2886-F3229 AromaticContact CD1-CZ 3.98Å; Y2886-F3229 HydrophobicContact CD1-CZ 3.98Å; Y2886-F3229 HydrophobicContact CE1-CB 4.13Å; Y2886-F3229 AromaticContact CE1-CD1 3.7Å; Y2886-F3229 HydrophobicContact CE1-CD1 3.7Å; Y2886-F3229 AromaticContact CE1-CD2 3.29Å; Y2886-F3229 HydrophobicContact CE1-CD2 3.29Å; Y2886-F3229 AromaticContact CE1-CE1 3.83Å; Y2886-F3229 HydrophobicContact CE1-CE1 3.83Å; Y2886-F3229 AromaticContact CE1-CE2 3.43Å; Y2886-F3229 HydrophobicContact CE1-CE2 3.43Å; Y2886-F3229 VanDerWaalsContact CE1-CE2 3.43Å; Y2886-F3229 AromaticContact CE1-CG 3.42Å; Y2886-F3229 HydrophobicContact CE1-CG 3.42Å; Y2886-F3229 VanDerWaalsContact CE1-CG 3.42Å; Y2886-F3229 AromaticContact CE1-CZ 3.7Å; Y2886-F3229 HydrophobicContact CE1-CZ 3.7Å; Y2886-F3229 HydrophobicContact CE2-CD2 4.42Å; Y2886-F3229 HydrophobicContact CG-CE2 4.49Å; Y2886-F3229 AromaticContact CZ-CD2 3.69Å; Y2886-F3229 AromaticContact CZ-CG 3.59Å; Y2886-F3229 VanDerWaalsContact OH-CB 3.26Å; Y2886-F3229 WeakPolarHBondContact OH-CB 3.48Å; Y2886-F3229 WeakPolarHBondContact OH-CG 3.15Å
2887	Q	72.9	Confident	57.1	Low	103 Å²	103	74.1 Å²	74.1	48%	0.481	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	117.1	176.1	-179.1	179.5	-33.8	0	0	109.6	W2850 A2851 L2889	W2850-Q2887 CarbonylContact C-O 3.54Å; W2850-Q2887 WeakPolarHBondContact CA-O 3.43Å; A2851-Q2887 HydrophobicContact CB-CB 4.47Å; A2851-Q2887 PolarHBondContact N-O 3.09Å; A2851-Q2887 PolarHBondContact O-N 3.29Å; Q2887-L2889 HydrophobicContact CG-CD2 4.49Å; Q2887-L2889 PolarHBondContact O-N 3.33Å
2888	P	75	Confident	58.2	Low	17 Å²	17	74.9 Å²	74.9	11%	0.11	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	129.4	171.3	25.7	-31.1	0	0	0	109.8	T2816 L2817 I2848 W2850	T2816-P2888 HydrophobicContact CG2-CG 4.39Å; L2817-P2888 HydrophobicContact CB-CB 3.68Å; L2817-P2888 HydrophobicContact CB-CG 3.98Å; L2817-P2888 HydrophobicContact CD2-CB 3.93Å; L2817-P2888 HydrophobicContact CG-CB 4.44Å; I2848-P2888 HydrophobicContact CG2-CB 4.26Å; W2850-P2888 HydrophobicContact CD2-CB 4.42Å; W2850-P2888 HydrophobicContact CE3-CB 3.72Å; W2850-P2888 HydrophobicContact CE3-CG 4.27Å; W2850-P2888 HydrophobicContact CH2-CB 4.49Å; W2850-P2888 HydrophobicContact CZ3-CB 3.77Å; W2850-P2888 HydrophobicContact CZ3-CG 4.06Å
2889	L	80.1	Confident	59.1	Low	4 Å²	4	73 Å²	73	2%	0.021	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-46.6	177.4	-59	-179.7	0	0	0	111	L2837 I2849 A2851 Q2887 L2955 F2958 L2964	L2837-L2889 HydrophobicContact CD2-CD1 3.67Å; I2849-L2889 HydrophobicContact CG2-CD1 4.27Å; I2849-L2889 PolarHBondContact O-N 2.97Å; A2851-L2889 HydrophobicContact CB-CD1 4.11Å; A2851-L2889 HydrophobicContact CB-CD2 3.95Å; A2851-L2889 HydrophobicContact CB-CG 4.08Å; Q2887-L2889 HydrophobicContact CG-CD2 4.49Å; Q2887-L2889 PolarHBondContact O-N 3.33Å; L2889-L2955 HydrophobicContact CD1-CD2 4.09Å; L2889-L2955 HydrophobicContact CD2-CD2 3.76Å; L2889-L2955 HydrophobicContact CG-CD2 4.46Å; L2889-F2958 HydrophobicContact CB-CB 3.87Å; L2889-F2958 HydrophobicContact CD1-CB 3.86Å; L2889-F2958 HydrophobicContact CD1-CD2 4.39Å; L2889-F2958 HydrophobicContact CD1-CG 4.45Å; L2889-F2958 HydrophobicContact CG-CB 4.49Å; L2889-L2964 WeakPolarHBondContact O-CD2 3.27Å
2890	I	84.8	Confident	60.6	Low	0 Å²	0	70.6 Å²	70.6	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	146.8	-172.3	-171.2	163.1	0	0	0	112.3	I2848 I2849 L2892 F2958 L2964 I2966 L2971	I2848-I2890 WeakPolarHBondContact CA-O 3.35Å; I2849-I2890 HydrophobicContact CB-CG2 3.92Å; I2849-I2890 HydrophobicContact CD1-CG2 3.9Å; I2849-I2890 HydrophobicContact CG1-CG2 4.13Å; I2849-I2890 PolarHBondContact N-O 2.91Å; I2890-L2892 HydrophobicContact CD1-CD2 3.56Å; I2890-L2892 VanDerWaalsContact CD1-CD2 3.5Å; I2890-L2892 HydrophobicContact CD1-CG 4.42Å; I2890-L2892 HydrophobicContact CG1-CD2 3.79Å; I2890-L2892 HydrophobicContact CG1-CG 4.24Å; I2890-L2892 HydrophobicContact CG2-CG 4.4Å; I2890-F2958 WeakPolarHBondContact CB-O 3.32Å; I2890-F2958 HydrophobicContact CG2-CB 4.23Å; I2890-F2958 HydrophobicContact CG2-CD1 4.04Å; I2890-L2964 CarbonylContact C-O 3.59Å; I2890-I2966 HydrophobicContact CD1-CB 4.1Å; I2890-I2966 HydrophobicContact CD1-CD1 3.58Å; I2890-I2966 VanDerWaalsContact CD1-CD1 3.43Å; I2890-I2966 HydrophobicContact CD1-CG1 3.96Å; I2890-I2966 HydrophobicContact CG1-CB 4.46Å; I2890-I2966 HydrophobicContact CG1-CD1 4.34Å; I2890-I2966 HydrophobicContact CG1-CG1 4.38Å; I2890-L2971 HydrophobicContact CD1-CD1 4.01Å
2891	R	85	Confident	62.8	Low	33 Å²	33	69 Å²	69	13%	0.125	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	113.2	168	180	-177.9	-168.8	143.4	3.1	107.5	L2817 Q2818 D2844 D2846 C2847 I2848 T2893 L2964 N2965 I2966	L2817-R2891 HydrophobicContact CD1-CB 3.92Å; L2817-R2891 HydrophobicContact CD2-CB 3.61Å; L2817-R2891 VanDerWaalsContact CD2-CB 3.41Å; L2817-R2891 HydrophobicContact CG-CB 3.95Å; Q2818-R2891 PolarHBondContact O-NH1 2.84Å; D2844-R2891 IonicContact OD2-NH2 3.76Å; D2846-R2891 HydrophobicContact CB-CG 4.03Å; D2846-R2891 IonicContact OD2-CZ 3.45Å; D2846-R2891 IonicContact OD2-NE 3.81Å; D2846-R2891 PolarHBondContact OD2-NE 3.15Å; D2846-R2891 IonicContact OD2-NH2 3.86Å; D2846-R2891 PolarHBondContact OD2-NH2 2.66Å; C2847-R2891 CarbonylContact O-C 3.54Å; C2847-R2891 WeakPolarHBondContact O-CA 3.42Å; I2848-R2891 HydrophobicContact CD1-CG 4.36Å; I2848-R2891 HydrophobicContact CG1-CB 4.2Å; I2848-R2891 HydrophobicContact CG1-CG 4.11Å; R2891-T2893 HydrophobicContact CG-CG2 4.35Å; R2891-L2964 WeakPolarHBondContact CB-O 3.4Å; R2891-L2964 PolarHBondContact N-O 2.76Å; R2891-N2965 WeakPolarHBondContact CB-OD1 3.26Å; R2891-N2965 WeakPolarHBondContact CD-OD1 3.37Å; R2891-I2966 PolarHBondContact O-N 3.13Å; R2891-I2966 VanDerWaalsContact O-O 3.1Å
2892	L	84.8	Confident	65.1	Low	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	126.3	177.3	-61.5	175.9	0	0	0	109.6	D2846 C2847 I2849 I2890 L2935 I2966 F2968 L2971	D2846-L2892 WeakPolarHBondContact CA-O 3.35Å; C2847-L2892 HydrophobicContact CB-CB 4.27Å; C2847-L2892 PolarHBondContact N-O 3.18Å; C2847-L2892 PolarHBondContact O-N 3.45Å; I2849-L2892 HydrophobicContact CD1-CD1 4.09Å; I2890-L2892 HydrophobicContact CD1-CD2 3.56Å; I2890-L2892 VanDerWaalsContact CD1-CD2 3.5Å; I2890-L2892 HydrophobicContact CD1-CG 4.42Å; I2890-L2892 HydrophobicContact CG1-CD2 3.79Å; I2890-L2892 HydrophobicContact CG1-CG 4.24Å; I2890-L2892 HydrophobicContact CG2-CG 4.4Å; L2892-L2935 HydrophobicContact CD1-CD2 4.3Å; L2892-I2966 VanDerWaalsContact CA-O 3.29Å; L2892-I2966 WeakPolarHBondContact CA-O 3.37Å; L2892-I2966 HydrophobicContact CD2-CB 4.44Å; L2892-F2968 HydrophobicContact CB-CD1 4.49Å; L2892-F2968 HydrophobicContact CB-CE1 4.07Å; L2892-F2968 HydrophobicContact CB-CE2 4.18Å; L2892-F2968 HydrophobicContact CB-CZ 3.84Å; L2892-F2968 HydrophobicContact CD1-CD1 4.34Å; L2892-F2968 HydrophobicContact CD1-CE1 3.74Å; L2892-F2968 HydrophobicContact CD1-CZ 4.18Å; L2892-F2968 HydrophobicContact CG-CE1 4.37Å; L2892-L2971 HydrophobicContact CD1-CD2 4.03Å; L2892-L2971 HydrophobicContact CD2-CB 4.37Å; L2892-L2971 HydrophobicContact CD2-CD1 4.36Å; L2892-L2971 HydrophobicContact CD2-CD2 3.78Å; L2892-L2971 HydrophobicContact CD2-CG 4.4Å
2893	T	82.1	Confident	67.4	Low	7.5 Å²	7.5	59.5 Å²	59.5	5%	0.046	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	145	179	71.6	0	0	0	0	110	D2846 R2891 I2966 N2967 F2968	D2846-T2893 WeakPolarHBondContact OD1-CB 3.48Å; D2846-T2893 WeakPolarHBondContact OD1-CG2 3.34Å; R2891-T2893 HydrophobicContact CG-CG2 4.35Å; T2893-I2966 PolarHBondContact N-O 3.2Å; T2893-I2966 PolarHBondContact OG1-O 3.12Å; T2893-N2967 CarbonylContact O-C 3.49Å; T2893-N2967 WeakPolarHBondContact O-CA 3.33Å; T2893-N2967 WeakPolarHBondContact O-CB 3.4Å; T2893-N2967 WeakPolarHBondContact OG1-CB 3.48Å; T2893-F2968 WeakPolarHBondContact O-CD2 3.07Å; T2893-F2968 PolarHBondContact O-N 2.84Å
2894	H	72.4	Confident	69.6	Low	43 Å²	43	57.1 Å²	57.1	20%	0.199	28%	0.276	C	S	.	.	S	Bend	trans	-66	-47.8	175.5	-178.7	74.3	0	0	0	112.3	F2928 E2931	H2894-F2928 HydrophobicContact CB-CD2 4.43Å; H2894-F2928 AromaticContact CE1-CD2 3.87Å; H2894-F2928 AromaticContact CE1-CE2 3.32Å; H2894-F2928 VanDerWaalsContact CE1-CE2 3.5Å; H2894-F2928 WeakPolarHBondContact CE1-CE2 3.36Å; H2894-F2928 AromaticContact CE1-CZ 3.83Å; H2894-F2928 AromaticContact CG-CD2 3.94Å; H2894-F2928 AromaticContact CG-CE2 3.92Å; H2894-F2928 AromaticContact ND1-CD2 3.45Å; H2894-F2928 WeakPolarHBondContact ND1-CD2 3.3Å; H2894-F2928 AromaticContact ND1-CE2 2.95Å; H2894-F2928 WeakPolarHBondContact ND1-CE2 3.44Å; H2894-F2928 AromaticContact ND1-CZ 3.58Å; H2894-F2928 WeakPolarHBondContact ND1-CZ 3.46Å; H2894-E2931 IonicContact CE1-OE2 3.61Å; H2894-E2931 PolarHBondContact CE1-OE2 3.46Å
2895	S	64.5	Low	71.4	Confident	34 Å²	34	56 Å²	56	24%	0.238	27%	0.269	C	S	.	.			trans	-149.8	161.8	179.2	75.8	0	0	0	0	111.4	M2897	S2895-M2897 VanDerWaalsContact C-N 3.26Å; S2895-M2897 PolarHBondContact OG-N 3.16Å; S2895-M2897 PolarHBondContact OG-O 3.35Å; S2895-M2897 VanDerWaalsContact OG-O 3.07Å
2896	Y	56.1	Low	73.1	Confident	150.5 Å²	150.5	52.6 Å²	52.6	59%	0.59	25%	0.248	S	C	*	.	S	Bend	trans	-75.9	-11.7	170.9	-64.1	-68.8	0	0	0	113.6	N2967 E2970	Y2896-N2967 HydrophobicContact CE2-CB 4.42Å; Y2896-N2967 WeakPolarHBondContact CE2-ND2 3.33Å; Y2896-N2967 VanDerWaalsContact CZ-ND2 3.25Å; Y2896-N2967 PolarHBondContact OH-ND2 3.35Å; Y2896-E2970 WeakPolarHBondContact CE2-OE1 3.47Å; Y2896-E2970 PolarHBondContact OH-OE1 2.87Å; Y2896-E2970 PolarHBondContact OH-OE2 3.47Å
2897	M	46.1	Very low	74.1	Confident	131.5 Å²	131.5	49.9 Å²	49.9	65%	0.648	24%	0.238	S	C	*	.	S	Bend	trans	-108.4	138.7	-178.6	-69	-142.5	158.3	0	0	110.9	S2895	S2895-M2897 VanDerWaalsContact C-N 3.26Å; S2895-M2897 PolarHBondContact OG-N 3.16Å; S2895-M2897 PolarHBondContact OG-O 3.35Å; S2895-M2897 VanDerWaalsContact OG-O 3.07Å
2898	K	51.7	Low	74.8	Confident	154.5 Å²	154.5	46 Å²	46	67%	0.672	22%	0.221	S	C	*	.	S	Bend	trans	-76.2	155.5	171.6	-73	-176.2	179.1	-177	0	110.3
2899	P	47.3	Very low	75.3	Confident	85.5 Å²	85.5	45.3 Å²	45.3	56%	0.555	22%	0.217	S	C	*	.	P	Polyproline II helix	cis	-77.3	145.4	0.6	31.8	-33.6	0	0	0	111.8
2900	R	63.1	Low	75.4	Confident	80 Å²	80	49.4 Å²	49.4	30%	0.302	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-92.4	130.3	169.5	-65.4	176.2	171.4	-177	-15.1	107.8	D2844 D2846	D2844-R2900 VanDerWaalsContact O-CB 3.27Å; D2844-R2900 WeakPolarHBondContact O-CB 3.37Å; D2844-R2900 WeakPolarHBondContact O-CD 3.33Å; D2844-R2900 PolarHBondContact O-NH1 3.33Å; D2846-R2900 IonicContact OD1-CZ 3.89Å; D2846-R2900 IonicContact OD1-NE 3.85Å; D2846-R2900 PolarHBondContact OD1-NE 3.34Å; D2846-R2900 IonicContact OD1-NH1 3.04Å; D2846-R2900 PolarHBondContact OD1-NH1 3.18Å; D2846-R2900 IonicContact OD1-NH2 3.1Å; D2846-R2900 PolarHBondContact OD1-NH2 2.82Å; D2846-R2900 VanDerWaalsContact OD1-NH2 3.14Å; D2846-R2900 IonicContact OD2-CZ 3.25Å; D2846-R2900 IonicContact OD2-NH1 2.99Å; D2846-R2900 PolarHBondContact OD2-NH1 3.07Å; D2846-R2900 IonicContact OD2-NH2 3.32Å
2901	Y	73.6	Confident	74.8	Confident	110.5 Å²	110.5	49.5 Å²	49.5	43%	0.433	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-71.4	139.6	168.5	-68	-75.6	0	0	0	109.2	G2845 Y2930	G2845-Y2901 WeakPolarHBondContact CA-O 3.33Å; Y2901-Y2930 HydrophobicContact CE1-CD2 4.34Å; Y2901-Y2930 HydrophobicContact CE1-CE2 4.19Å
2902	S	80.5	Confident	74.1	Confident	36.5 Å²	36.5	52.2 Å²	52.2	26%	0.255	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-59.1	146.1	170.4	51.5	0	0	0	0	110.8	N2904 F2928	S2902-N2904 WeakPolarHBondContact CB-OD1 3.16Å; S2902-N2904 PolarHBondContact O-N 2.76Å; S2902-N2904 PolarHBondContact O-OD1 3.01Å; S2902-N2904 PolarHBondContact OG-OD1 2.87Å; S2902-F2928 WeakPolarHBondContact O-CA 3.23Å
2903	I	85.8	Confident	73.2	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	103	172.6	-68.5	148.1	0	0	0	108.1	I2824 C2825 S2842 D2846 C2847 I2906 I2926 A2927 F2928	I2824-I2903 VanDerWaalsContact CD1-O 3.3Å; I2824-I2903 WeakPolarHBondContact CD1-O 3.19Å; I2824-I2903 VanDerWaalsContact CG1-O 3.31Å; I2824-I2903 WeakPolarHBondContact CG1-O 3.34Å; C2825-I2903 PolarHBondContact SG-O 2.99Å; S2842-I2903 PolarHBondContact O-N 3.38Å; D2846-I2903 WeakPolarHBondContact O-CD1 3.29Å; C2847-I2903 HydrophobicContact CB-CD1 3.64Å; C2847-I2903 VanDerWaalsContact N-CD1 3.31Å; I2903-I2906 HydrophobicContact CG2-CD1 3.97Å; I2903-I2906 HydrophobicContact CG2-CG1 3.83Å; I2903-I2926 HydrophobicContact CG1-CG2 4.36Å; I2903-I2926 HydrophobicContact CG2-CG2 3.65Å; I2903-A2927 CarbonylContact C-O 3.48Å; I2903-A2927 VanDerWaalsContact CA-O 3.3Å; I2903-A2927 WeakPolarHBondContact CA-O 3.4Å; I2903-F2928 HydrophobicContact CG1-CB 4.15Å
2904	N	84.9	Confident	72	Confident	34 Å²	34	58.7 Å²	58.7	18%	0.182	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	-36.6	-166.4	-62.9	-18.1	0	0	0	112.3	C2825 S2902 A2927 I2994 V2995	C2825-N2904 WeakPolarHBondContact CB-O 3.32Å; S2902-N2904 WeakPolarHBondContact CB-OD1 3.16Å; S2902-N2904 PolarHBondContact O-N 2.76Å; S2902-N2904 PolarHBondContact O-OD1 3.01Å; S2902-N2904 PolarHBondContact OG-OD1 2.87Å; N2904-A2927 PolarHBondContact N-O 3.01Å; N2904-I2994 WeakPolarHBondContact ND2-CG2 3.36Å; N2904-V2995 WeakPolarHBondContact CB-O 3.42Å; N2904-V2995 PolarHBondContact ND2-O 3.04Å
2905	S	87.4	Confident	71.2	Confident	10 Å²	10	64.5 Å²	64.5	7%	0.07	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	146.7	179.8	-172.7	0	0	0	0	112.1	A2927 M2998	S2905-A2927 PolarHBondContact O-N 3.19Å; S2905-M2998 VanDerWaalsContact O-CE 3.3Å; S2905-M2998 WeakPolarHBondContact O-CE 2.93Å; S2905-M2998 PolarHBondContact OG-N 2.8Å
2906	I	89.4	Confident	70.8	Confident	6 Å²	6	67.5 Å²	67.5	3%	0.031	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	126.1	175.5	-63	167.6	0	0	0	108.2	C2825 N2827 I2839 G2841 I2903 I2924 Y2925 I2926	C2825-I2906 VanDerWaalsContact SG-CD1 3.56Å; N2827-I2906 HydrophobicContact CB-CB 4.42Å; N2827-I2906 HydrophobicContact CB-CG2 4.01Å; N2827-I2906 WeakPolarHBondContact CB-O 3.19Å; N2827-I2906 PolarHBondContact ND2-O 3.08Å; I2839-I2906 HydrophobicContact CB-CG2 4.15Å; I2839-I2906 HydrophobicContact CG2-CD1 3.93Å; I2839-I2906 HydrophobicContact CG2-CG2 3.93Å; G2841-I2906 VanDerWaalsContact N-CD1 3.33Å; I2903-I2906 HydrophobicContact CG2-CD1 3.97Å; I2903-I2906 HydrophobicContact CG2-CG1 3.83Å; I2906-I2924 HydrophobicContact CG2-CG2 4.43Å; I2906-Y2925 CarbonylContact C-O 3.58Å; I2906-Y2925 VanDerWaalsContact CA-O 3.32Å; I2906-Y2925 WeakPolarHBondContact CA-O 3.4Å; I2906-I2926 HydrophobicContact CG1-CG1 4.47Å; I2906-I2926 HydrophobicContact CG1-CG2 4.34Å
2907	V	87.8	Confident	70.9	Confident	6.5 Å²	6.5	68.7 Å²	68.7	4%	0.039	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	135.8	179.6	176.5	0	0	0	0	109.2	N2827 I2924 Y2925 M2998 T3000 V3013	N2827-V2907 WeakPolarHBondContact ND2-CA 3.46Å; V2907-I2924 CarbonylContact O-C 3.52Å; V2907-I2924 WeakPolarHBondContact O-CA 2.95Å; V2907-Y2925 HydrophobicContact CB-CD2 4.41Å; V2907-Y2925 HydrophobicContact CG1-CD2 4.33Å; V2907-Y2925 PolarHBondContact N-O 3.33Å; V2907-Y2925 PolarHBondContact O-N 2.86Å; V2907-M2998 VanDerWaalsContact CG2-C 3.41Å; V2907-M2998 HydrophobicContact CG2-CB 3.56Å; V2907-M2998 HydrophobicContact CG2-CE 4.34Å; V2907-M2998 VanDerWaalsContact CG2-O 3.3Å; V2907-M2998 WeakPolarHBondContact CG2-O 3.27Å; V2907-T3000 HydrophobicContact CG1-CG2 3.3Å; V2907-T3000 VanDerWaalsContact CG1-N 3.34Å; V2907-V3013 HydrophobicContact CB-CG1 4.25Å; V2907-V3013 HydrophobicContact CG1-CG1 4.03Å
2908	T	88	Confident	71.7	Confident	20 Å²	20	64.5 Å²	64.5	12%	0.123	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	143	175.3	60.3	0	0	0	0	110.2	N2827 Y2828 L2829 I2839 F2923 I2924 T3000	N2827-T2908 HydrophobicContact CB-CG2 4.39Å; N2827-T2908 PolarHBondContact OD1-OG1 2.91Å; Y2828-T2908 WeakPolarHBondContact O-CB 3.33Å; Y2828-T2908 PolarHBondContact O-OG1 2.76Å; L2829-T2908 HydrophobicContact CB-CG2 4.24Å; L2829-T2908 HydrophobicContact CD1-CG2 4.5Å; I2839-T2908 HydrophobicContact CD1-CG2 3.86Å; T2908-F2923 CarbonylContact C-O 3.52Å; T2908-F2923 VanDerWaalsContact CA-O 3.25Å; T2908-F2923 WeakPolarHBondContact CA-O 3.21Å; T2908-I2924 HydrophobicContact CG2-CG1 4.27Å; T2908-I2924 HydrophobicContact CG2-CG2 4.42Å; T2908-T3000 VanDerWaalsContact O-CG2 3.31Å; T2908-T3000 WeakPolarHBondContact O-CG2 3.39Å
2909	Q	84.8	Confident	72.6	Confident	3.5 Å²	3.5	60 Å²	60	2%	0.016	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	142.3	179.3	-159.8	-179.5	19.2	0	0	108.9	F2923 Y2925 T3000 H3002 P3005 Q3010 G3012	Q2909-F2923 HydrophobicContact CB-CB 4.17Å; Q2909-F2923 HydrophobicContact CB-CD2 4.38Å; Q2909-F2923 PolarHBondContact N-O 3.23Å; Q2909-F2923 PolarHBondContact O-N 3.46Å; Q2909-Y2925 HydrophobicContact CB-CE2 4.26Å; Q2909-Y2925 PolarHBondContact OE1-OH 3.14Å; Q2909-T3000 HydrophobicContact CB-CG2 3.76Å; Q2909-T3000 HydrophobicContact CG-CG2 3.83Å; Q2909-H3002 PolarHBondContact NE2-O 3.16Å; Q2909-P3005 HydrophobicContact CG-CG 4.03Å; Q2909-Q3010 PolarHBondContact NE2-O 3.17Å; Q2909-G3012 VanDerWaalsContact OE1-N 3.12Å
2910	R	82.1	Confident	74	Confident	90 Å²	90	56.6 Å²	56.6	34%	0.34	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	118.2	173.4	177.8	-179.8	173	161.9	-1.2	108.6	N2830 V2831 I2920 D2921 Y2922	N2830-R2910 PolarHBondContact O-NH1 2.97Å; V2831-R2910 PolarHBondContact O-NH1 2.94Å; R2910-I2920 HydrophobicContact CG-CG2 3.91Å; R2910-D2921 CarbonylContact C-O 3.56Å; R2910-D2921 WeakPolarHBondContact CA-O 3.47Å; R2910-Y2922 HydrophobicContact CG-CD1 4.29Å; R2910-Y2922 HydrophobicContact CG-CE1 4.13Å
2911	G	72.5	Confident	75	Confident	1.5 Å²	1.5	52.9 Å²	52.9	2%	0.015	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	138.1	174.6	0	0	0	0	0	112	D2921	G2911-D2921 PolarHBondContact N-O 3.27Å; G2911-D2921 PolarHBondContact O-N 3.14Å; G2911-D2921 VanDerWaalsContact O-N 3.1Å
2912	I	70.8	Confident	75.6	Confident	90.5 Å²	90.5	47.7 Å²	47.7	46%	0.464	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	107.2	165.6	-57.9	176.8	0	0	0	106.1	D2914	I2912-D2914 PolarHBondContact O-N 2.87Å
2913	M	66.1	Low	76	Confident	32 Å²	32	46 Å²	46	16%	0.158	23%	0.227	C	C	.	.			trans	-81.4	118.9	-171.9	-64.9	-90.1	88.7	0	0	111.1	N2915 E2916 D2921 N3007 M3008	M2913-N2915 PolarHBondContact O-N 3.32Å; M2913-E2916 CarbonylContact O-C 3.54Å; M2913-E2916 VanDerWaalsContact O-C 3.32Å; M2913-E2916 PolarHBondContact O-N 3.02Å; M2913-E2916 VanDerWaalsContact O-N 3.14Å; M2913-D2921 WeakPolarHBondContact CG-OD2 3.35Å; M2913-N3007 VanDerWaalsContact SD-C 3.56Å; M2913-N3007 VanDerWaalsContact SD-CA 3.52Å; M2913-M3008 HydrophobicContact CE-SD 4.38Å; M2913-M3008 HydrophobicContact CG-SD 4.3Å; M2913-M3008 HydrophobicContact SD-CG 3.69Å; M2913-M3008 PolarHBondContact SD-N 2.63Å; M2913-M3008 VanDerWaalsContact SD-N 3.41Å; M2913-M3008 HydrophobicContact SD-SD 3.78Å
2914	D	56.2	Low	76.2	Confident	112.5 Å²	112.5	46.1 Å²	46.1	60%	0.602	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-17.8	-168.7	-126.2	0.2	0	0	0	115.1	I2912 V3006	I2912-D2914 PolarHBondContact O-N 2.87Å; D2914-V3006 HydrophobicContact CB-CG1 4.1Å
2915	N	56.2	Low	76.4	Confident	164 Å²	164	44.7 Å²	44.7	88%	0.877	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-22	178.8	-73.4	-26.5	0	0	0	114.4	M2913	M2913-N2915 PolarHBondContact O-N 3.32Å
2916	E	56.4	Low	76.6	Confident	97 Å²	97	44.2 Å²	44.2	45%	0.453	22%	0.216	S	C	.	.			trans	-143.5	88.5	179.4	-69.3	-175	178.6	0	0	108.4	M2913 T2918 K2919	M2913-E2916 CarbonylContact O-C 3.54Å; M2913-E2916 VanDerWaalsContact O-C 3.32Å; M2913-E2916 PolarHBondContact O-N 3.02Å; M2913-E2916 VanDerWaalsContact O-N 3.14Å; E2916-T2918 PolarHBondContact O-N 2.79Å; E2916-K2919 HydrophobicContact CB-CG 4.46Å; E2916-K2919 PolarHBondContact O-N 3.1Å; E2916-K2919 VanDerWaalsContact O-N 3.11Å; E2916-K2919 IonicContact OE1-NZ 2.73Å; E2916-K2919 WeakPolarHBondContact OE2-CD 3.31Å; E2916-K2919 WeakPolarHBondContact OE2-CE 3.41Å; E2916-K2919 IonicContact OE2-NZ 2.9Å; E2916-K2919 PolarHBondContact OE2-NZ 3.1Å
2917	K	56.9	Low	76.6	Confident	176.5 Å²	176.5	43.9 Å²	43.9	77%	0.767	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	0.4	-178	-72	-169.9	173.7	-172.8	0	115.4
2918	T	62.9	Low	76.5	Confident	42 Å²	42	43.8 Å²	43.8	26%	0.258	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-0.6	-173.4	59.9	0	0	0	0	112.3	E2916 N2940 H2941 D2942	E2916-T2918 PolarHBondContact O-N 2.79Å; T2918-N2940 PolarHBondContact O-OD1 3.1Å; T2918-H2941 WeakPolarHBondContact O-CA 3.22Å; T2918-H2941 VanDerWaalsContact O-CB 3.3Å; T2918-H2941 WeakPolarHBondContact O-CB 3.39Å; T2918-H2941 PolarHBondContact O-N 3.11Å; T2918-D2942 VanDerWaalsContact CB-CG 3.4Å; T2918-D2942 WeakPolarHBondContact CB-OD1 3.41Å; T2918-D2942 WeakPolarHBondContact CB-OD2 3.41Å; T2918-D2942 VanDerWaalsContact CG2-CG 3.42Å; T2918-D2942 VanDerWaalsContact CG2-OD1 3.24Å; T2918-D2942 WeakPolarHBondContact CG2-OD1 3.37Å; T2918-D2942 VanDerWaalsContact CG2-OD2 3.31Å; T2918-D2942 WeakPolarHBondContact CG2-OD2 3.18Å; T2918-D2942 PolarHBondContact OG1-OD2 2.81Å
2919	K	70.7	Confident	76.2	Confident	60.5 Å²	60.5	43 Å²	43	26%	0.263	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136.3	168	-71.3	-178.6	-177.7	156.7	0	111.4	E2916 L2939	E2916-K2919 HydrophobicContact CB-CG 4.46Å; E2916-K2919 PolarHBondContact O-N 3.1Å; E2916-K2919 VanDerWaalsContact O-N 3.11Å; E2916-K2919 IonicContact OE1-NZ 2.73Å; E2916-K2919 WeakPolarHBondContact OE2-CD 3.31Å; E2916-K2919 WeakPolarHBondContact OE2-CE 3.41Å; E2916-K2919 IonicContact OE2-NZ 2.9Å; E2916-K2919 PolarHBondContact OE2-NZ 3.1Å; K2919-L2939 WeakPolarHBondContact CA-O 3.13Å
2920	I	77.1	Confident	76.3	Confident	13.5 Å²	13.5	47.2 Å²	47.2	7%	0.069	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	126.4	173.3	-56.5	-171.4	0	0	0	108.1	R2910 Y2922 L2939 H2941	R2910-I2920 HydrophobicContact CG-CG2 3.91Å; I2920-Y2922 HydrophobicContact CB-CE2 4.24Å; I2920-Y2922 HydrophobicContact CG2-CD2 4.22Å; I2920-Y2922 HydrophobicContact CG2-CE1 4.15Å; I2920-Y2922 HydrophobicContact CG2-CE2 3.67Å; I2920-L2939 PolarHBondContact N-O 3Å; I2920-L2939 VanDerWaalsContact N-O 3.11Å; I2920-L2939 PolarHBondContact O-N 3.25Å; I2920-L2939 VanDerWaalsContact O-N 3.13Å; I2920-H2941 VanDerWaalsContact CD1-CD2 3.48Å; I2920-H2941 WeakPolarHBondContact CD1-CD2 3.2Å; I2920-H2941 VanDerWaalsContact CD1-NE2 3.26Å; I2920-H2941 WeakPolarHBondContact CD1-NE2 3.21Å
2921	D	84	Confident	76.4	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.011	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.3	-179.9	-57.9	-58.8	0	0	0	109	R2910 G2911 M2913 F2923 H2936 Q2938	R2910-D2921 CarbonylContact C-O 3.56Å; R2910-D2921 WeakPolarHBondContact CA-O 3.47Å; G2911-D2921 PolarHBondContact N-O 3.27Å; G2911-D2921 PolarHBondContact O-N 3.14Å; G2911-D2921 VanDerWaalsContact O-N 3.1Å; M2913-D2921 WeakPolarHBondContact CG-OD2 3.35Å; D2921-F2923 HydrophobicContact CB-CE2 3.62Å; D2921-F2923 HydrophobicContact CB-CZ 3.84Å; D2921-H2936 IonicContact OD1-NE2 3.38Å; D2921-Q2938 VanDerWaalsContact OD1-CB 3.26Å; D2921-Q2938 WeakPolarHBondContact OD1-CB 3.17Å; D2921-Q2938 VanDerWaalsContact OD1-CG 3.25Å; D2921-Q2938 WeakPolarHBondContact OD1-CG 3.32Å; D2921-Q2938 PolarHBondContact OD1-NE2 2.94Å
2922	Y	86.7	Confident	77.1	Confident	3 Å²	3	44.9 Å²	44.9	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.8	177.8	-62.5	-84.1	0	0	0	109.5	L2829 R2910 I2920 H2936 I2937 L2939 I2954	L2829-Y2922 HydrophobicContact CD1-CD1 3.97Å; L2829-Y2922 HydrophobicContact CD2-CD1 3.69Å; L2829-Y2922 HydrophobicContact CD2-CE1 4.44Å; L2829-Y2922 HydrophobicContact CD2-CG 4.22Å; L2829-Y2922 HydrophobicContact CG-CD1 4Å; R2910-Y2922 HydrophobicContact CG-CD1 4.29Å; R2910-Y2922 HydrophobicContact CG-CE1 4.13Å; I2920-Y2922 HydrophobicContact CB-CE2 4.24Å; I2920-Y2922 HydrophobicContact CG2-CD2 4.22Å; I2920-Y2922 HydrophobicContact CG2-CE1 4.15Å; I2920-Y2922 HydrophobicContact CG2-CE2 3.67Å; Y2922-H2936 WeakPolarHBondContact O-CA 3.46Å; Y2922-I2937 PolarHBondContact N-O 2.84Å; Y2922-I2937 PolarHBondContact O-N 3.08Å; Y2922-L2939 HydrophobicContact CD2-CD1 4.36Å; Y2922-L2939 HydrophobicContact CE2-CD1 4.15Å; Y2922-I2954 HydrophobicContact CE2-CD1 4.23Å
2923	F	88.3	Confident	77.9	Confident	1 Å²	1	40.5 Å²	40.5	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.5	178.2	-54.4	-91.3	0	0	0	110.6	T2908 Q2909 D2921 Y2925 L2935 H2936 M3008 C3011 F3027	T2908-F2923 CarbonylContact C-O 3.52Å; T2908-F2923 VanDerWaalsContact CA-O 3.25Å; T2908-F2923 WeakPolarHBondContact CA-O 3.21Å; Q2909-F2923 HydrophobicContact CB-CB 4.17Å; Q2909-F2923 HydrophobicContact CB-CD2 4.38Å; Q2909-F2923 PolarHBondContact N-O 3.23Å; Q2909-F2923 PolarHBondContact O-N 3.46Å; D2921-F2923 HydrophobicContact CB-CE2 3.62Å; D2921-F2923 HydrophobicContact CB-CZ 3.84Å; F2923-Y2925 HydrophobicContact CB-CD2 4.31Å; F2923-Y2925 HydrophobicContact CB-CE2 3.51Å; F2923-Y2925 VanDerWaalsContact CB-CE2 3.5Å; F2923-Y2925 HydrophobicContact CG-CE2 4.39Å; F2923-L2935 CarbonylContact C-O 3.59Å; F2923-L2935 WeakPolarHBondContact CA-O 3.42Å; F2923-H2936 HydrophobicContact CD1-CB 4.01Å; F2923-H2936 AromaticContact CD1-CD2 3.67Å; F2923-H2936 AromaticContact CD1-CG 3.97Å; F2923-H2936 HydrophobicContact CE1-CB 4.12Å; F2923-H2936 AromaticContact CE1-CD2 3.18Å; F2923-H2936 WeakPolarHBondContact CE1-CD2 3.39Å; F2923-H2936 AromaticContact CE1-CG 3.65Å; F2923-H2936 AromaticContact CE1-NE2 3.68Å; F2923-H2936 AromaticContact CZ-CD2 3.6Å; F2923-H2936 AromaticContact CZ-NE2 3.73Å; F2923-M3008 HydrophobicContact CZ-CE 4.09Å; F2923-M3008 HydrophobicContact CZ-SD 4.33Å; F2923-C3011 HydrophobicContact CE2-CB 4.15Å; F2923-C3011 HydrophobicContact CZ-CB 4.06Å; F2923-F3027 HydrophobicContact CD1-CD2 4.18Å; F2923-F3027 HydrophobicContact CD1-CE2 4.31Å; F2923-F3027 HydrophobicContact CD1-CG 4.45Å; F2923-F3027 AromaticContact CE1-CD1 3.8Å; F2923-F3027 HydrophobicContact CE1-CD1 3.8Å; F2923-F3027 AromaticContact CE1-CD2 3.88Å; F2923-F3027 HydrophobicContact CE1-CD2 3.88Å; F2923-F3027 AromaticContact CE1-CE1 3.86Å; F2923-F3027 HydrophobicContact CE1-CE1 3.86Å; F2923-F3027 AromaticContact CE1-CE2 3.91Å; F2923-F3027 HydrophobicContact CE1-CE2 3.91Å; F2923-F3027 AromaticContact CE1-CG 3.83Å; F2923-F3027 HydrophobicContact CE1-CG 3.83Å; F2923-F3027 AromaticContact CE1-CZ 3.92Å; F2923-F3027 HydrophobicContact CE1-CZ 3.92Å; F2923-F3027 HydrophobicContact CZ-CD1 4.31Å; F2923-F3027 HydrophobicContact CZ-CE1 4.45Å
2924	I	90	Very high	79	Confident	2.5 Å²	2.5	39.1 Å²	39.1	1%	0.013	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	115	172.4	-54	163	0	0	0	107.6	I2839 I2906 V2907 T2908 I2926 T2934 L2935 F2958	I2839-I2924 HydrophobicContact CD1-CB 4.41Å; I2839-I2924 HydrophobicContact CD1-CD1 3.75Å; I2839-I2924 HydrophobicContact CD1-CG1 3.93Å; I2839-I2924 HydrophobicContact CD1-CG2 3.59Å; I2906-I2924 HydrophobicContact CG2-CG2 4.43Å; V2907-I2924 CarbonylContact O-C 3.52Å; V2907-I2924 WeakPolarHBondContact O-CA 2.95Å; T2908-I2924 HydrophobicContact CG2-CG1 4.27Å; T2908-I2924 HydrophobicContact CG2-CG2 4.42Å; I2924-I2926 HydrophobicContact CG2-CD1 4.18Å; I2924-I2926 HydrophobicContact CG2-CG1 3.97Å; I2924-T2934 CarbonylContact O-C 3.5Å; I2924-T2934 WeakPolarHBondContact O-CA 3.49Å; I2924-L2935 HydrophobicContact CB-CB 4.2Å; I2924-L2935 PolarHBondContact N-O 3.08Å; I2924-L2935 WeakPolarHBondContact O-CD1 3.34Å; I2924-L2935 PolarHBondContact O-N 2.84Å; I2924-F2958 HydrophobicContact CD1-CZ 4.02Å
2925	Y	90.6	Very high	80.5	Confident	3.5 Å²	3.5	33.8 Å²	33.8	1%	0.014	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	125.9	178.1	-54.7	-93	0	0	0	109.3	I2906 V2907 Q2909 F2923 A2933 T2934 G3012 V3013	I2906-Y2925 CarbonylContact C-O 3.58Å; I2906-Y2925 VanDerWaalsContact CA-O 3.32Å; I2906-Y2925 WeakPolarHBondContact CA-O 3.4Å; V2907-Y2925 HydrophobicContact CB-CD2 4.41Å; V2907-Y2925 HydrophobicContact CG1-CD2 4.33Å; V2907-Y2925 PolarHBondContact N-O 3.33Å; V2907-Y2925 PolarHBondContact O-N 2.86Å; Q2909-Y2925 HydrophobicContact CB-CE2 4.26Å; Q2909-Y2925 PolarHBondContact OE1-OH 3.14Å; F2923-Y2925 HydrophobicContact CB-CD2 4.31Å; F2923-Y2925 HydrophobicContact CB-CE2 3.51Å; F2923-Y2925 VanDerWaalsContact CB-CE2 3.5Å; F2923-Y2925 HydrophobicContact CG-CE2 4.39Å; Y2925-A2933 CarbonylContact C-O 3.58Å; Y2925-A2933 WeakPolarHBondContact CA-O 3.39Å; Y2925-T2934 HydrophobicContact CD1-CG2 3.55Å; Y2925-T2934 VanDerWaalsContact CD1-OG1 3.29Å; Y2925-T2934 WeakPolarHBondContact CD1-OG1 3.33Å; Y2925-T2934 HydrophobicContact CE1-CG2 3.56Å; Y2925-T2934 VanDerWaalsContact CE1-CG2 3.43Å; Y2925-T2934 HydrophobicContact CG-CG2 4.4Å; Y2925-G3012 WeakPolarHBondContact OH-CA 3.03Å; Y2925-G3012 PolarHBondContact OH-N 2.98Å; Y2925-G3012 VanDerWaalsContact OH-N 3.16Å; Y2925-V3013 HydrophobicContact CD1-CG1 3.8Å; Y2925-V3013 HydrophobicContact CD1-CG2 4.19Å; Y2925-V3013 HydrophobicContact CD2-CG1 3.47Å; Y2925-V3013 VanDerWaalsContact CD2-CG1 3.47Å; Y2925-V3013 HydrophobicContact CE1-CG1 4.18Å; Y2925-V3013 HydrophobicContact CE2-CG1 3.88Å; Y2925-V3013 HydrophobicContact CG-CG1 3.43Å; Y2925-V3013 VanDerWaalsContact CG-CG1 3.43Å
2926	I	90.7	Very high	81.9	Confident	0.5 Å²	0.5	26.4 Å²	26.4	0%	0.003	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	115.1	-176	-54	175.1	0	0	0	108.7	I2903 I2906 I2924 F2928 I2932 A2933 L2935 F2968	I2903-I2926 HydrophobicContact CG1-CG2 4.36Å; I2903-I2926 HydrophobicContact CG2-CG2 3.65Å; I2906-I2926 HydrophobicContact CG1-CG1 4.47Å; I2906-I2926 HydrophobicContact CG1-CG2 4.34Å; I2924-I2926 HydrophobicContact CG2-CD1 4.18Å; I2924-I2926 HydrophobicContact CG2-CG1 3.97Å; I2926-F2928 HydrophobicContact CG2-CD1 4.19Å; I2926-I2932 CarbonylContact O-C 3.59Å; I2926-I2932 WeakPolarHBondContact O-CA 3.36Å; I2926-A2933 PolarHBondContact N-O 2.97Å; I2926-A2933 PolarHBondContact O-N 3.06Å; I2926-L2935 HydrophobicContact CD1-CD1 3.9Å; I2926-L2935 HydrophobicContact CG1-CD1 4.18Å; I2926-F2968 HydrophobicContact CD1-CE1 3.88Å; I2926-F2968 HydrophobicContact CD1-CZ 3.73Å; I2926-F2968 HydrophobicContact CG2-CZ 4.34Å
2927	A	88.7	Confident	83.3	Confident	0 Å²	0	22 Å²	22	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	125.1	176.6	0	0	0	0	0	111.3	I2903 N2904 S2905 E2931 I2932 V2995 M2998	I2903-A2927 CarbonylContact C-O 3.48Å; I2903-A2927 VanDerWaalsContact CA-O 3.3Å; I2903-A2927 WeakPolarHBondContact CA-O 3.4Å; N2904-A2927 PolarHBondContact N-O 3.01Å; S2905-A2927 PolarHBondContact O-N 3.19Å; A2927-E2931 WeakPolarHBondContact CA-O 3.48Å; A2927-I2932 HydrophobicContact CB-CG1 4.21Å; A2927-V2995 HydrophobicContact CB-CB 3.88Å; A2927-V2995 HydrophobicContact CB-CG1 3.61Å; A2927-M2998 HydrophobicContact CB-CE 3.59Å; A2927-M2998 HydrophobicContact CB-CG 4.42Å; A2927-M2998 HydrophobicContact CB-SD 3.85Å
2928	F	86.3	Confident	84.5	Confident	4.5 Å²	4.5	16.6 Å²	16.6	2%	0.02	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	106.8	173.1	47	-89.8	0	0	0	109.8	H2894 S2902 I2903 I2926 Y2930 E2931 A2933 F2968	H2894-F2928 HydrophobicContact CB-CD2 4.43Å; H2894-F2928 AromaticContact CE1-CD2 3.87Å; H2894-F2928 AromaticContact CE1-CE2 3.32Å; H2894-F2928 VanDerWaalsContact CE1-CE2 3.5Å; H2894-F2928 WeakPolarHBondContact CE1-CE2 3.36Å; H2894-F2928 AromaticContact CE1-CZ 3.83Å; H2894-F2928 AromaticContact CG-CD2 3.94Å; H2894-F2928 AromaticContact CG-CE2 3.92Å; H2894-F2928 AromaticContact ND1-CD2 3.45Å; H2894-F2928 WeakPolarHBondContact ND1-CD2 3.3Å; H2894-F2928 AromaticContact ND1-CE2 2.95Å; H2894-F2928 WeakPolarHBondContact ND1-CE2 3.44Å; H2894-F2928 AromaticContact ND1-CZ 3.58Å; H2894-F2928 WeakPolarHBondContact ND1-CZ 3.46Å; S2902-F2928 WeakPolarHBondContact O-CA 3.23Å; I2903-F2928 HydrophobicContact CG1-CB 4.15Å; I2926-F2928 HydrophobicContact CG2-CD1 4.19Å; F2928-Y2930 PolarHBondContact O-N 2.87Å; F2928-Y2930 VanDerWaalsContact O-N 3.09Å; F2928-E2931 HydrophobicContact CD2-CB 3.92Å; F2928-E2931 HydrophobicContact CE2-CB 3.29Å; F2928-E2931 HydrophobicContact CE2-CG 4.27Å; F2928-E2931 WeakPolarHBondContact CE2-OE2 3.31Å; F2928-E2931 HydrophobicContact CZ-CB 3.77Å; F2928-E2931 PolarHBondContact N-O 2.97Å; F2928-E2931 PolarHBondContact O-N 2.87Å; F2928-E2931 VanDerWaalsContact O-N 3.16Å; F2928-A2933 HydrophobicContact CE1-CB 3.64Å; F2928-A2933 HydrophobicContact CZ-CB 4.07Å; F2928-F2968 HydrophobicContact CD1-CE2 4.48Å; F2928-F2968 HydrophobicContact CE1-CD2 4.47Å; F2928-F2968 HydrophobicContact CE1-CE2 4.22Å
2929	G	82.9	Confident	85.2	Confident	1.5 Å²	1.5	14.7 Å²	14.7	2%	0.015	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	-116.2	-174.8	0	0	0	0	0	112.2	I2994 V2995	G2929-I2994 CarbonylContact O-C 3.53Å; G2929-I2994 VanDerWaalsContact O-CA 3.3Å; G2929-I2994 WeakPolarHBondContact O-CA 3.44Å; G2929-V2995 PolarHBondContact O-N 3.13Å
2930	Y	85.7	Confident	85.2	Confident	93.5 Å²	93.5	14.5 Å²	14.5	37%	0.367	7%	0.067	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	3.3	-177	-56.5	-95.8	0	0	0	113.6	Y2901 F2928 K2990 T2991 I2994	Y2901-Y2930 HydrophobicContact CE1-CD2 4.34Å; Y2901-Y2930 HydrophobicContact CE1-CE2 4.19Å; F2928-Y2930 PolarHBondContact O-N 2.87Å; F2928-Y2930 VanDerWaalsContact O-N 3.09Å; Y2930-K2990 CarbonylContact O-C 3.48Å; Y2930-K2990 WeakPolarHBondContact O-CA 3.35Å; Y2930-K2990 WeakPolarHBondContact O-CG 3.48Å; Y2930-T2991 PolarHBondContact O-N 2.72Å; Y2930-T2991 PolarHBondContact O-OG1 3.39Å; Y2930-I2994 HydrophobicContact CD1-CG1 4.11Å; Y2930-I2994 HydrophobicContact CD2-CG1 4.03Å; Y2930-I2994 HydrophobicContact CE1-CD1 4.5Å; Y2930-I2994 HydrophobicContact CE1-CG1 3.73Å; Y2930-I2994 HydrophobicContact CE2-CD1 4.04Å; Y2930-I2994 HydrophobicContact CE2-CG1 3.63Å; Y2930-I2994 HydrophobicContact CG-CG1 4.24Å
2931	E	85.2	Confident	84.7	Confident	41 Å²	41	16.8 Å²	16.8	19%	0.192	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	142.9	-177.8	-82	-175.6	-159.7	0	0	111.1	H2894 A2927 F2928 R2988 F2989 K2990	H2894-E2931 IonicContact CE1-OE2 3.61Å; H2894-E2931 PolarHBondContact CE1-OE2 3.46Å; A2927-E2931 WeakPolarHBondContact CA-O 3.48Å; F2928-E2931 HydrophobicContact CD2-CB 3.92Å; F2928-E2931 HydrophobicContact CE2-CB 3.29Å; F2928-E2931 HydrophobicContact CE2-CG 4.27Å; F2928-E2931 WeakPolarHBondContact CE2-OE2 3.31Å; F2928-E2931 HydrophobicContact CZ-CB 3.77Å; F2928-E2931 PolarHBondContact N-O 2.97Å; F2928-E2931 PolarHBondContact O-N 2.87Å; F2928-E2931 VanDerWaalsContact O-N 3.16Å; E2931-R2988 IonicContact OE2-NH1 2.76Å; E2931-F2989 CarbonylContact C-O 3.59Å; E2931-F2989 VanDerWaalsContact CA-O 3.28Å; E2931-F2989 WeakPolarHBondContact CA-O 3.34Å; E2931-K2990 HydrophobicContact CG-CB 4.35Å; E2931-K2990 HydrophobicContact CG-CD 4.45Å; E2931-K2990 HydrophobicContact CG-CG 3.99Å; E2931-K2990 WeakPolarHBondContact OE1-CE 3.5Å; E2931-K2990 IonicContact OE1-NZ 3.08Å; E2931-K2990 PolarHBondContact OE1-NZ 3.19Å
2932	I	87.2	Confident	83.6	Confident	0.5 Å²	0.5	22 Å²	22	0%	0.003	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	116.3	169.4	-61.1	167.2	0	0	0	107.3	I2926 A2927 T2934 R2988 F2989 T2991 V2995 M2998 A3015 I3025	I2926-I2932 CarbonylContact O-C 3.59Å; I2926-I2932 WeakPolarHBondContact O-CA 3.36Å; A2927-I2932 HydrophobicContact CB-CG1 4.21Å; I2932-T2934 HydrophobicContact CG2-CG2 4.11Å; I2932-R2988 CarbonylContact O-C 3.57Å; I2932-R2988 WeakPolarHBondContact O-CA 3.29Å; I2932-F2989 HydrophobicContact CB-CB 4.49Å; I2932-F2989 PolarHBondContact N-O 2.86Å; I2932-F2989 PolarHBondContact O-N 2.82Å; I2932-T2991 HydrophobicContact CD1-CG2 4.26Å; I2932-V2995 HydrophobicContact CD1-CG1 4.33Å; I2932-V2995 HydrophobicContact CD1-CG2 3.87Å; I2932-V2995 HydrophobicContact CG1-CG2 3.96Å; I2932-M2998 HydrophobicContact CD1-SD 3.71Å; I2932-M2998 HydrophobicContact CG1-SD 3.94Å; I2932-M2998 HydrophobicContact CG2-CE 4.42Å; I2932-M2998 HydrophobicContact CG2-SD 4.05Å; I2932-A3015 HydrophobicContact CD1-CB 4.26Å; I2932-I3025 HydrophobicContact CD1-CD1 3.44Å; I2932-I3025 VanDerWaalsContact CD1-CD1 3.44Å
2933	A	87.8	Confident	82.2	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	129.1	166.7	0	0	0	0	0	109.6	Y2925 I2926 F2928 L2935 F2968 I2986 Q2987	Y2925-A2933 CarbonylContact C-O 3.58Å; Y2925-A2933 WeakPolarHBondContact CA-O 3.39Å; I2926-A2933 PolarHBondContact N-O 2.97Å; I2926-A2933 PolarHBondContact O-N 3.06Å; F2928-A2933 HydrophobicContact CE1-CB 3.64Å; F2928-A2933 HydrophobicContact CZ-CB 4.07Å; A2933-L2935 HydrophobicContact CB-CD1 4.23Å; A2933-F2968 HydrophobicContact CB-CD1 4.4Å; A2933-F2968 HydrophobicContact CB-CE1 4.36Å; A2933-I2986 HydrophobicContact CB-CG2 4.46Å; A2933-Q2987 WeakPolarHBondContact CA-O 3.43Å
2934	T	87.7	Confident	80.8	Confident	2.5 Å²	2.5	25 Å²	25	2%	0.015	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	115.5	174.7	3.2	0	0	0	0	107.8	I2924 Y2925 I2932 I2986 Q2987 F2989 F3027	I2924-T2934 CarbonylContact O-C 3.5Å; I2924-T2934 WeakPolarHBondContact O-CA 3.49Å; Y2925-T2934 HydrophobicContact CD1-CG2 3.55Å; Y2925-T2934 VanDerWaalsContact CD1-OG1 3.29Å; Y2925-T2934 WeakPolarHBondContact CD1-OG1 3.33Å; Y2925-T2934 HydrophobicContact CE1-CG2 3.56Å; Y2925-T2934 VanDerWaalsContact CE1-CG2 3.43Å; Y2925-T2934 HydrophobicContact CG-CG2 4.4Å; I2932-T2934 HydrophobicContact CG2-CG2 4.11Å; T2934-I2986 CarbonylContact O-C 3.54Å; T2934-I2986 VanDerWaalsContact O-CA 3.24Å; T2934-I2986 WeakPolarHBondContact O-CA 3.43Å; T2934-Q2987 PolarHBondContact N-O 3.04Å; T2934-Q2987 PolarHBondContact O-N 3.27Å; T2934-Q2987 VanDerWaalsContact OG1-CB 3.31Å; T2934-Q2987 WeakPolarHBondContact OG1-CB 3.49Å; T2934-Q2987 PolarHBondContact OG1-O 2.72Å; T2934-F2989 HydrophobicContact CG2-CD2 3.73Å; T2934-F2989 HydrophobicContact CG2-CE2 3.72Å; T2934-F3027 HydrophobicContact CG2-CD2 4.13Å; T2934-F3027 HydrophobicContact CG2-CE2 4.27Å
2935	L	88.2	Confident	79.2	Confident	0.5 Å²	0.5	32.7 Å²	32.7	0%	0.003	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	117.1	175.7	-67.8	76.4	0	0	0	106.6	L2892 F2923 I2924 I2926 A2933 F2968 L2971 W2975 E2985 I2986	L2892-L2935 HydrophobicContact CD1-CD2 4.3Å; F2923-L2935 CarbonylContact C-O 3.59Å; F2923-L2935 WeakPolarHBondContact CA-O 3.42Å; I2924-L2935 HydrophobicContact CB-CB 4.2Å; I2924-L2935 PolarHBondContact N-O 3.08Å; I2924-L2935 WeakPolarHBondContact O-CD1 3.34Å; I2924-L2935 PolarHBondContact O-N 2.84Å; I2926-L2935 HydrophobicContact CD1-CD1 3.9Å; I2926-L2935 HydrophobicContact CG1-CD1 4.18Å; A2933-L2935 HydrophobicContact CB-CD1 4.23Å; L2935-F2968 HydrophobicContact CD1-CD1 4.47Å; L2935-F2968 HydrophobicContact CD1-CE1 4.08Å; L2935-L2971 HydrophobicContact CD2-CD2 3.9Å; L2935-W2975 HydrophobicContact CB-CH2 3.83Å; L2935-W2975 HydrophobicContact CB-CZ3 3.72Å; L2935-W2975 HydrophobicContact CD2-CH2 3.66Å; L2935-W2975 VanDerWaalsContact CD2-CH2 3.48Å; L2935-W2975 HydrophobicContact CD2-CZ2 4.26Å; L2935-W2975 HydrophobicContact CD2-CZ3 4.07Å; L2935-W2975 HydrophobicContact CG-CH2 4.06Å; L2935-W2975 HydrophobicContact CG-CZ3 3.99Å; L2935-E2985 WeakPolarHBondContact CA-O 3.38Å; L2935-I2986 HydrophobicContact CD1-CG2 4.27Å; L2935-I2986 HydrophobicContact CG-CG1 4.33Å; L2935-I2986 HydrophobicContact CG-CG2 4.46Å
2936	H	86.6	Confident	78.2	Confident	8.5 Å²	8.5	37.3 Å²	37.3	4%	0.039	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.9	-178.9	168.6	-138.1	0	0	0	108.9	D2921 Y2922 F2923 A2984 E2985 F3027	D2921-H2936 IonicContact OD1-NE2 3.38Å; Y2922-H2936 WeakPolarHBondContact O-CA 3.46Å; F2923-H2936 HydrophobicContact CD1-CB 4.01Å; F2923-H2936 AromaticContact CD1-CD2 3.67Å; F2923-H2936 AromaticContact CD1-CG 3.97Å; F2923-H2936 HydrophobicContact CE1-CB 4.12Å; F2923-H2936 AromaticContact CE1-CD2 3.18Å; F2923-H2936 WeakPolarHBondContact CE1-CD2 3.39Å; F2923-H2936 AromaticContact CE1-CG 3.65Å; F2923-H2936 AromaticContact CE1-NE2 3.68Å; F2923-H2936 AromaticContact CZ-CD2 3.6Å; F2923-H2936 AromaticContact CZ-NE2 3.73Å; H2936-A2984 CarbonylContact O-C 3.53Å; H2936-A2984 VanDerWaalsContact O-CA 3.25Å; H2936-A2984 WeakPolarHBondContact O-CA 3.1Å; H2936-E2985 HydrophobicContact CB-CG 3.8Å; H2936-E2985 IonicContact CE1-OE1 3.77Å; H2936-E2985 IonicContact CG-OE1 3.24Å; H2936-E2985 PolarHBondContact N-O 3.14Å; H2936-E2985 IonicContact ND1-OE1 3.21Å; H2936-E2985 PolarHBondContact ND1-OE1 3.15Å; H2936-E2985 PolarHBondContact O-N 2.94Å; H2936-F3027 HydrophobicContact CB-CE2 4.09Å; H2936-F3027 HydrophobicContact CB-CZ 4.2Å; H2936-F3027 AromaticContact CE1-CZ 3.91Å; H2936-F3027 AromaticContact CG-CZ 3.81Å; H2936-F3027 AromaticContact ND1-CZ 3.44Å; H2936-F3027 WeakPolarHBondContact ND1-CZ 3.45Å
2937	I	85.6	Confident	77.3	Confident	5.5 Å²	5.5	42 Å²	42	3%	0.028	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	114.5	178.9	-54.1	173.1	0	0	0	108.3	Y2922 L2939 L2957 F2958 W2975 Y2983 A2984	Y2922-I2937 PolarHBondContact N-O 2.84Å; Y2922-I2937 PolarHBondContact O-N 3.08Å; I2937-L2939 HydrophobicContact CG2-CD1 4.46Å; I2937-L2939 HydrophobicContact CG2-CD2 4.32Å; I2937-L2939 HydrophobicContact CG2-CG 4.15Å; I2937-L2957 HydrophobicContact CG2-CD1 4.05Å; I2937-F2958 HydrophobicContact CD1-CE2 4.02Å; I2937-F2958 HydrophobicContact CD1-CZ 3.75Å; I2937-W2975 HydrophobicContact CD1-CH2 3.91Å; I2937-W2975 HydrophobicContact CD1-CZ2 4.24Å; I2937-W2975 HydrophobicContact CG1-CH2 3.91Å; I2937-W2975 HydrophobicContact CG1-CZ3 4.27Å; I2937-Y2983 WeakPolarHBondContact CA-O 3.41Å; I2937-A2984 HydrophobicContact CG1-CB 4.26Å
2938	Q	82.2	Confident	76.7	Confident	62 Å²	62	46.5 Å²	46.5	29%	0.29	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	120.6	176.5	174.4	163.5	78.1	0	0	109.8	D2921 G2982 Y2983	D2921-Q2938 VanDerWaalsContact OD1-CB 3.26Å; D2921-Q2938 WeakPolarHBondContact OD1-CB 3.17Å; D2921-Q2938 VanDerWaalsContact OD1-CG 3.25Å; D2921-Q2938 WeakPolarHBondContact OD1-CG 3.32Å; D2921-Q2938 PolarHBondContact OD1-NE2 2.94Å; Q2938-G2982 WeakPolarHBondContact O-CA 3.29Å; Q2938-Y2983 PolarHBondContact N-O 2.94Å; Q2938-Y2983 PolarHBondContact O-N 3.23Å
2939	L	77.2	Confident	76.1	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.2	177.4	-64	178.1	0	0	0	111.1	K2919 I2920 Y2922 I2937 L2950 I2953 I2954	K2919-L2939 WeakPolarHBondContact CA-O 3.13Å; I2920-L2939 PolarHBondContact N-O 3Å; I2920-L2939 VanDerWaalsContact N-O 3.11Å; I2920-L2939 PolarHBondContact O-N 3.25Å; I2920-L2939 VanDerWaalsContact O-N 3.13Å; Y2922-L2939 HydrophobicContact CD2-CD1 4.36Å; Y2922-L2939 HydrophobicContact CE2-CD1 4.15Å; I2937-L2939 HydrophobicContact CG2-CD1 4.46Å; I2937-L2939 HydrophobicContact CG2-CD2 4.32Å; I2937-L2939 HydrophobicContact CG2-CG 4.15Å; L2939-L2950 HydrophobicContact CB-CD1 4.48Å; L2939-L2950 HydrophobicContact CD1-CD1 3.99Å; L2939-L2950 HydrophobicContact CD1-CG 3.99Å; L2939-I2953 HydrophobicContact CD2-CG2 3.95Å; L2939-I2954 HydrophobicContact CD1-CD1 3.78Å; L2939-I2954 HydrophobicContact CD1-CG1 3.84Å
2940	N	70.4	Confident	75.8	Confident	55.5 Å²	55.5	49.2 Å²	49.2	30%	0.297	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	109.9	175.2	-169	4	0	0	0	110.3	T2918 D2942 S2943 L2944	T2918-N2940 PolarHBondContact O-OD1 3.1Å; N2940-D2942 VanDerWaalsContact C-N 3.32Å; N2940-D2942 PolarHBondContact O-N 3.06Å; N2940-D2942 PolarHBondContact OD1-N 3.03Å; N2940-D2942 VanDerWaalsContact OD1-N 3.08Å; N2940-S2943 PolarHBondContact O-N 3.21Å; N2940-S2943 PolarHBondContact O-OG 3.31Å; N2940-L2944 WeakPolarHBondContact O-CD1 3.3Å; N2940-L2944 WeakPolarHBondContact O-CG 3.28Å
2941	H	65.8	Low	75.5	Confident	63.5 Å²	63.5	45.2 Å²	45.2	29%	0.294	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-67.4	-21.2	178.6	-101.9	-79.3	0	0	0	113.5	T2918 I2920 S2943 L2944 L2950	T2918-H2941 WeakPolarHBondContact O-CA 3.22Å; T2918-H2941 VanDerWaalsContact O-CB 3.3Å; T2918-H2941 WeakPolarHBondContact O-CB 3.39Å; T2918-H2941 PolarHBondContact O-N 3.11Å; I2920-H2941 VanDerWaalsContact CD1-CD2 3.48Å; I2920-H2941 WeakPolarHBondContact CD1-CD2 3.2Å; I2920-H2941 VanDerWaalsContact CD1-NE2 3.26Å; I2920-H2941 WeakPolarHBondContact CD1-NE2 3.21Å; H2941-S2943 VanDerWaalsContact C-N 3.29Å; H2941-S2943 PolarHBondContact O-N 3.14Å; H2941-L2944 PolarHBondContact O-N 2.93Å; H2941-L2944 VanDerWaalsContact O-N 3.13Å; H2941-L2950 WeakPolarHBondContact NE2-CD1 3.34Å
2942	D	60.9	Low	75.2	Confident	109.5 Å²	109.5	46.6 Å²	46.6	59%	0.586	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-68.1	-24.3	-179.3	-81.8	-31.5	0	0	0	113.8	T2918 N2940	T2918-D2942 VanDerWaalsContact CB-CG 3.4Å; T2918-D2942 WeakPolarHBondContact CB-OD1 3.41Å; T2918-D2942 WeakPolarHBondContact CB-OD2 3.41Å; T2918-D2942 VanDerWaalsContact CG2-CG 3.42Å; T2918-D2942 VanDerWaalsContact CG2-OD1 3.24Å; T2918-D2942 WeakPolarHBondContact CG2-OD1 3.37Å; T2918-D2942 VanDerWaalsContact CG2-OD2 3.31Å; T2918-D2942 WeakPolarHBondContact CG2-OD2 3.18Å; T2918-D2942 PolarHBondContact OG1-OD2 2.81Å; N2940-D2942 VanDerWaalsContact C-N 3.32Å; N2940-D2942 PolarHBondContact O-N 3.06Å; N2940-D2942 PolarHBondContact OD1-N 3.03Å; N2940-D2942 VanDerWaalsContact OD1-N 3.08Å
2943	S	57.7	Low	74.8	Confident	53 Å²	53	48.4 Å²	48.4	37%	0.371	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-89.2	-15.9	171.8	61.5	0	0	0	0	113.1	N2940 H2941 M2945 D2981	N2940-S2943 PolarHBondContact O-N 3.21Å; N2940-S2943 PolarHBondContact O-OG 3.31Å; H2941-S2943 VanDerWaalsContact C-N 3.29Å; H2941-S2943 PolarHBondContact O-N 3.14Å; S2943-M2945 PolarHBondContact O-N 2.95Å; S2943-D2981 VanDerWaalsContact CB-OD1 3.27Å; S2943-D2981 WeakPolarHBondContact CB-OD1 3.37Å; S2943-D2981 PolarHBondContact OG-OD1 2.91Å
2944	L	59.1	Low	74.4	Confident	15.5 Å²	15.5	48.5 Å²	48.5	8%	0.081	25%	0.251	C	S	.	.			trans	-96.9	86.8	-174.2	-72.9	165.9	0	0	0	111	N2940 H2941 N2946 D2949 L2950 I2953	N2940-L2944 WeakPolarHBondContact O-CD1 3.3Å; N2940-L2944 WeakPolarHBondContact O-CG 3.28Å; H2941-L2944 PolarHBondContact O-N 2.93Å; H2941-L2944 VanDerWaalsContact O-N 3.13Å; L2944-N2946 PolarHBondContact O-N 3.37Å; L2944-N2946 VanDerWaalsContact O-N 3.11Å; L2944-D2949 HydrophobicContact CD2-CB 3.82Å; L2944-D2949 VanDerWaalsContact CD2-CB 3.42Å; L2944-L2950 HydrophobicContact CD1-CB 4.09Å; L2944-L2950 HydrophobicContact CD1-CD1 3.94Å; L2944-L2950 HydrophobicContact CD1-CG 4.31Å; L2944-L2950 HydrophobicContact CD2-CB 4.41Å; L2944-I2953 HydrophobicContact CD1-CD1 4.23Å; L2944-I2953 HydrophobicContact CD2-CD1 3.51Å; L2944-I2953 VanDerWaalsContact CD2-CD1 3.47Å; L2944-I2953 HydrophobicContact CD2-CG1 4.3Å; L2944-I2953 HydrophobicContact CG-CD1 4.15Å
2945	M	57.3	Low	74	Confident	164 Å²	164	49.5 Å²	49.5	81%	0.808	26%	0.256	S	S	*	.			trans	-66.4	-12	-172.8	-70.6	-73.7	-117.9	0	0	115.1	S2943	S2943-M2945 PolarHBondContact O-N 2.95Å
2946	N	69.1	Low	73.5	Confident	100 Å²	100	56.4 Å²	56.4	54%	0.535	29%	0.288	S	S	.	.	S	Bend	trans	-144.9	153.5	175.4	-65.3	-64.7	0	0	0	112.7	L2944 I2948 D2949 L2950	L2944-N2946 PolarHBondContact O-N 3.37Å; L2944-N2946 VanDerWaalsContact O-N 3.11Å; N2946-I2948 PolarHBondContact O-N 3.27Å; N2946-D2949 WeakPolarHBondContact CB-OD2 3.09Å; N2946-D2949 PolarHBondContact N-OD2 3.18Å; N2946-D2949 PolarHBondContact ND2-OD2 3.01Å; N2946-D2949 WeakPolarHBondContact O-CB 3.28Å; N2946-D2949 PolarHBondContact O-N 2.97Å; N2946-D2949 VanDerWaalsContact O-N 3.14Å; N2946-L2950 PolarHBondContact O-N 2.94Å
2947	E	72.3	Confident	73.1	Confident	98.5 Å²	98.5	57.3 Å²	57.3	46%	0.46	29%	0.293	S	S	.	.	H	α-helix	trans	-54.3	-35	171.8	-70.8	-173.9	157.3	0	0	112.3	T2832 D2949 L2950 E2951	T2832-E2947 HydrophobicContact CG2-CB 4.17Å; T2832-E2947 HydrophobicContact CG2-CG 4.38Å; E2947-D2949 VanDerWaalsContact C-N 3.31Å; E2947-D2949 PolarHBondContact O-N 2.82Å; E2947-L2950 WeakPolarHBondContact O-CB 3.08Å; E2947-L2950 PolarHBondContact O-N 2.88Å; E2947-E2951 WeakPolarHBondContact O-CG 3.2Å; E2947-E2951 PolarHBondContact O-N 2.85Å
2948	I	74.4	Confident	72.7	Confident	94 Å²	94	57.1 Å²	57.1	48%	0.482	29%	0.292	S	S	.	.	H	α-helix	trans	-63	-36.1	178.9	-61.7	169.7	0	0	0	111.8	I2861 N2946 L2950 E2951 N2952	I2861-I2948 HydrophobicContact CD1-CG2 4.43Å; N2946-I2948 PolarHBondContact O-N 3.27Å; I2948-L2950 VanDerWaalsContact C-N 3.33Å; I2948-E2951 PolarHBondContact O-N 3.32Å; I2948-N2952 WeakPolarHBondContact O-CB 3.33Å; I2948-N2952 VanDerWaalsContact O-CG 3.27Å; I2948-N2952 PolarHBondContact O-N 3.32Å; I2948-N2952 PolarHBondContact O-ND2 3.15Å; I2948-N2952 VanDerWaalsContact O-ND2 3.15Å
2949	D	74.4	Confident	72.1	Confident	62.5 Å²	62.5	56.1 Å²	56.1	33%	0.334	29%	0.292	S	S	.	.	H	α-helix	trans	-70.2	-37.3	-179.3	-59.7	-39.9	0	0	0	110.3	L2944 N2946 E2947 N2952 I2953	L2944-D2949 HydrophobicContact CD2-CB 3.82Å; L2944-D2949 VanDerWaalsContact CD2-CB 3.42Å; N2946-D2949 WeakPolarHBondContact CB-OD2 3.09Å; N2946-D2949 PolarHBondContact N-OD2 3.18Å; N2946-D2949 PolarHBondContact ND2-OD2 3.01Å; N2946-D2949 WeakPolarHBondContact O-CB 3.28Å; N2946-D2949 PolarHBondContact O-N 2.97Å; N2946-D2949 VanDerWaalsContact O-N 3.14Å; E2947-D2949 VanDerWaalsContact C-N 3.31Å; E2947-D2949 PolarHBondContact O-N 2.82Å; D2949-N2952 PolarHBondContact O-N 3.34Å; D2949-I2953 WeakPolarHBondContact O-CG1 3.19Å; D2949-I2953 PolarHBondContact O-N 3.31Å; D2949-I2953 VanDerWaalsContact O-N 3.14Å
2950	L	75.9	Confident	71.4	Confident	1.5 Å²	1.5	57.1 Å²	57.1	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-66.3	-42.8	174.1	-174.9	121.4	0	0	0	111.7	V2831 T2832 L2939 H2941 L2944 N2946 E2947 I2948 N2952 I2953 I2954	V2831-L2950 HydrophobicContact CG1-CD2 3.52Å; V2831-L2950 HydrophobicContact CG1-CG 4.43Å; T2832-L2950 HydrophobicContact CG2-CD2 3.82Å; L2939-L2950 HydrophobicContact CB-CD1 4.48Å; L2939-L2950 HydrophobicContact CD1-CD1 3.99Å; L2939-L2950 HydrophobicContact CD1-CG 3.99Å; H2941-L2950 WeakPolarHBondContact NE2-CD1 3.34Å; L2944-L2950 HydrophobicContact CD1-CB 4.09Å; L2944-L2950 HydrophobicContact CD1-CD1 3.94Å; L2944-L2950 HydrophobicContact CD1-CG 4.31Å; L2944-L2950 HydrophobicContact CD2-CB 4.41Å; N2946-L2950 PolarHBondContact O-N 2.94Å; E2947-L2950 WeakPolarHBondContact O-CB 3.08Å; E2947-L2950 PolarHBondContact O-N 2.88Å; I2948-L2950 VanDerWaalsContact C-N 3.33Å; L2950-N2952 VanDerWaalsContact C-N 3.32Å; L2950-N2952 PolarHBondContact O-N 2.95Å; L2950-I2953 PolarHBondContact O-N 2.75Å; L2950-I2954 HydrophobicContact CD2-CD1 3.91Å; L2950-I2954 HydrophobicContact CG-CD1 4.48Å; L2950-I2954 PolarHBondContact O-N 3.28Å; L2950-I2954 VanDerWaalsContact O-N 3.08Å
2951	E	79.9	Confident	70.9	Confident	8.5 Å²	8.5	65.8 Å²	65.8	4%	0.04	33%	0.326	C	S	.	.	H	α-helix	trans	-58.2	-47.2	173.9	-70.5	177.8	-164.6	0	0	110.9	T2832 N2834 L2835 E2947 I2948 I2953 I2954 L2955	T2832-E2951 WeakPolarHBondContact CB-OE1 3.16Å; T2832-E2951 HydrophobicContact CG2-CG 3.73Å; T2832-E2951 PolarHBondContact OG1-OE1 3.04Å; N2834-E2951 WeakPolarHBondContact CB-OE1 3.27Å; N2834-E2951 PolarHBondContact ND2-OE1 2.82Å; L2835-E2951 HydrophobicContact CB-CG 3.8Å; L2835-E2951 HydrophobicContact CD2-CB 3.94Å; L2835-E2951 HydrophobicContact CD2-CG 3.91Å; E2947-E2951 WeakPolarHBondContact O-CG 3.2Å; E2947-E2951 PolarHBondContact O-N 2.85Å; I2948-E2951 PolarHBondContact O-N 3.32Å; E2951-I2953 PolarHBondContact O-N 3.07Å; E2951-I2954 PolarHBondContact O-N 3.1Å; E2951-L2955 WeakPolarHBondContact O-CB 3.31Å; E2951-L2955 VanDerWaalsContact O-CD1 3.26Å; E2951-L2955 WeakPolarHBondContact O-CD1 3.19Å; E2951-L2955 WeakPolarHBondContact O-CG 3.24Å; E2951-L2955 PolarHBondContact O-N 3.21Å
2952	N	79.1	Confident	70.6	Confident	71 Å²	71	72 Å²	72	38%	0.38	35%	0.352	S	S	.	.	H	α-helix	trans	-61.2	-43.9	179.1	-73.9	-37.1	0	0	0	112.8	I2948 D2949 L2950 I2954 L2955 E2956	I2948-N2952 WeakPolarHBondContact O-CB 3.33Å; I2948-N2952 VanDerWaalsContact O-CG 3.27Å; I2948-N2952 PolarHBondContact O-N 3.32Å; I2948-N2952 PolarHBondContact O-ND2 3.15Å; I2948-N2952 VanDerWaalsContact O-ND2 3.15Å; D2949-N2952 PolarHBondContact O-N 3.34Å; L2950-N2952 VanDerWaalsContact C-N 3.32Å; L2950-N2952 PolarHBondContact O-N 2.95Å; N2952-I2954 PolarHBondContact O-N 3.1Å; N2952-L2955 PolarHBondContact O-N 3.1Å; N2952-E2956 VanDerWaalsContact O-CB 3.29Å; N2952-E2956 WeakPolarHBondContact O-CB 3.35Å; N2952-E2956 PolarHBondContact O-N 3.22Å
2953	I	78.6	Confident	70.7	Confident	37.5 Å²	37.5	72.4 Å²	72.4	19%	0.192	35%	0.351	C	S	.	.	H	α-helix	trans	-61.7	-46	178.9	-72	178.7	0	0	0	111.1	L2939 L2944 D2949 L2950 E2951 L2955 E2956 L2957 D2981	L2939-I2953 HydrophobicContact CD2-CG2 3.95Å; L2944-I2953 HydrophobicContact CD1-CD1 4.23Å; L2944-I2953 HydrophobicContact CD2-CD1 3.51Å; L2944-I2953 VanDerWaalsContact CD2-CD1 3.47Å; L2944-I2953 HydrophobicContact CD2-CG1 4.3Å; L2944-I2953 HydrophobicContact CG-CD1 4.15Å; D2949-I2953 WeakPolarHBondContact O-CG1 3.19Å; D2949-I2953 PolarHBondContact O-N 3.31Å; D2949-I2953 VanDerWaalsContact O-N 3.14Å; L2950-I2953 PolarHBondContact O-N 2.75Å; E2951-I2953 PolarHBondContact O-N 3.07Å; I2953-L2955 VanDerWaalsContact C-N 3.32Å; I2953-L2955 PolarHBondContact O-N 2.86Å; I2953-E2956 PolarHBondContact O-N 3.11Å; I2953-L2957 HydrophobicContact CG2-CD1 4.09Å; I2953-L2957 HydrophobicContact CG2-CG 4.44Å; I2953-L2957 WeakPolarHBondContact O-CB 3.22Å; I2953-L2957 WeakPolarHBondContact O-CG 3.26Å; I2953-L2957 PolarHBondContact O-N 2.94Å; I2953-D2981 HydrophobicContact CD1-CB 4.39Å
2954	I	78.9	Confident	71.4	Confident	3.5 Å²	3.5	73.3 Å²	73.3	2%	0.018	35%	0.351	C	S	.	.	H	α-helix	trans	-66.5	-38.5	-179.9	-73.5	-178.8	0	0	0	111.4	V2831 L2837 Y2922 L2939 L2950 E2951 N2952 E2956 L2957 F2958	V2831-I2954 HydrophobicContact CB-CD1 4.38Å; V2831-I2954 HydrophobicContact CG1-CD1 3.47Å; V2831-I2954 HydrophobicContact CG2-CD1 3.99Å; V2831-I2954 HydrophobicContact CG2-CG2 4.32Å; L2837-I2954 HydrophobicContact CD1-CG2 3.75Å; L2837-I2954 HydrophobicContact CG-CG2 4.45Å; Y2922-I2954 HydrophobicContact CE2-CD1 4.23Å; L2939-I2954 HydrophobicContact CD1-CD1 3.78Å; L2939-I2954 HydrophobicContact CD1-CG1 3.84Å; L2950-I2954 HydrophobicContact CD2-CD1 3.91Å; L2950-I2954 HydrophobicContact CG-CD1 4.48Å; L2950-I2954 PolarHBondContact O-N 3.28Å; L2950-I2954 VanDerWaalsContact O-N 3.08Å; E2951-I2954 PolarHBondContact O-N 3.1Å; N2952-I2954 PolarHBondContact O-N 3.1Å; I2954-E2956 VanDerWaalsContact C-N 3.33Å; I2954-E2956 PolarHBondContact O-N 2.48Å; I2954-L2957 PolarHBondContact O-N 2.92Å; I2954-F2958 HydrophobicContact CG2-CD2 4.18Å; I2954-F2958 HydrophobicContact CG2-CE2 4.22Å; I2954-F2958 VanDerWaalsContact O-CD2 3.31Å; I2954-F2958 WeakPolarHBondContact O-CD2 3.34Å; I2954-F2958 PolarHBondContact O-N 2.69Å
2955	L	79.9	Confident	72.2	Confident	22 Å²	22	76.8 Å²	76.8	12%	0.115	37%	0.37	C	S	.	.	H	α-helix	trans	-66.1	-38.1	174.4	-67.4	163.3	0	0	0	111.9	L2835 A2851 Y2853 L2889 E2951 N2952 I2953 S2959	L2835-L2955 HydrophobicContact CD1-CD2 4.31Å; L2835-L2955 HydrophobicContact CD2-CD1 4.4Å; L2835-L2955 HydrophobicContact CD2-CD2 4.35Å; L2835-L2955 HydrophobicContact CD2-CG 4.13Å; A2851-L2955 HydrophobicContact CB-CD2 3.82Å; Y2853-L2955 WeakPolarHBondContact OH-CD1 3.36Å; Y2853-L2955 WeakPolarHBondContact OH-CD2 3.42Å; L2889-L2955 HydrophobicContact CD1-CD2 4.09Å; L2889-L2955 HydrophobicContact CD2-CD2 3.76Å; L2889-L2955 HydrophobicContact CG-CD2 4.46Å; E2951-L2955 WeakPolarHBondContact O-CB 3.31Å; E2951-L2955 VanDerWaalsContact O-CD1 3.26Å; E2951-L2955 WeakPolarHBondContact O-CD1 3.19Å; E2951-L2955 WeakPolarHBondContact O-CG 3.24Å; E2951-L2955 PolarHBondContact O-N 3.21Å; N2952-L2955 PolarHBondContact O-N 3.1Å; I2953-L2955 VanDerWaalsContact C-N 3.32Å; I2953-L2955 PolarHBondContact O-N 2.86Å; L2955-S2959 WeakPolarHBondContact O-CB 3.26Å; L2955-S2959 PolarHBondContact O-N 2.91Å; L2955-S2959 PolarHBondContact O-OG 2.92Å
2956	E	78.5	Confident	73.2	Confident	147 Å²	147	69.1 Å²	69.1	69%	0.687	33%	0.332	S	S	*	.	H	α-helix	trans	-68.5	-43	177.4	-169.3	165.4	-163.7	0	0	111.8	N2952 I2953 I2954 F2958 S2959 N2960	N2952-E2956 VanDerWaalsContact O-CB 3.29Å; N2952-E2956 WeakPolarHBondContact O-CB 3.35Å; N2952-E2956 PolarHBondContact O-N 3.22Å; I2953-E2956 PolarHBondContact O-N 3.11Å; I2954-E2956 VanDerWaalsContact C-N 3.33Å; I2954-E2956 PolarHBondContact O-N 2.48Å; E2956-F2958 VanDerWaalsContact C-N 3.3Å; E2956-F2958 PolarHBondContact O-N 3.43Å; E2956-S2959 PolarHBondContact O-N 2.98Å; E2956-S2959 PolarHBondContact O-OG 3.19Å; E2956-N2960 PolarHBondContact O-N 3.44Å
2957	L	78.3	Confident	73.8	Confident	27 Å²	27	64.8 Å²	64.8	14%	0.141	31%	0.309	C	S	.	.	H	α-helix	trans	-55.2	-37.4	176.4	-96.6	161.5	0	0	0	113.2	I2937 I2953 I2954 W2975 T2979 A2984	I2937-L2957 HydrophobicContact CG2-CD1 4.05Å; I2953-L2957 HydrophobicContact CG2-CD1 4.09Å; I2953-L2957 HydrophobicContact CG2-CG 4.44Å; I2953-L2957 WeakPolarHBondContact O-CB 3.22Å; I2953-L2957 WeakPolarHBondContact O-CG 3.26Å; I2953-L2957 PolarHBondContact O-N 2.94Å; I2954-L2957 PolarHBondContact O-N 2.92Å; L2957-W2975 HydrophobicContact CD2-CZ2 4.24Å; L2957-W2975 PolarHBondContact O-NE1 3.07Å; L2957-T2979 HydrophobicContact CD2-CG2 4.07Å; L2957-A2984 HydrophobicContact CD2-CB 4.28Å
2958	F	77.6	Confident	74.1	Confident	0.5 Å²	0.5	60.2 Å²	60.2	0%	0.002	29%	0.287	C	S	.	.	H	α-helix	trans	-95.4	-25.7	179.2	-70.5	-63.9	0	0	0	114.4	L2837 I2849 L2889 I2890 I2924 I2937 I2954 E2956 N2960 W2975	L2837-F2958 HydrophobicContact CD1-CD2 4.08Å; L2837-F2958 HydrophobicContact CD1-CE2 3.66Å; I2849-F2958 HydrophobicContact CD1-CD1 3.65Å; I2849-F2958 HydrophobicContact CD1-CE1 3.39Å; I2849-F2958 VanDerWaalsContact CD1-CE1 3.48Å; I2849-F2958 HydrophobicContact CD1-CG 4.35Å; I2849-F2958 HydrophobicContact CD1-CZ 4.03Å; L2889-F2958 HydrophobicContact CB-CB 3.87Å; L2889-F2958 HydrophobicContact CD1-CB 3.86Å; L2889-F2958 HydrophobicContact CD1-CD2 4.39Å; L2889-F2958 HydrophobicContact CD1-CG 4.45Å; L2889-F2958 HydrophobicContact CG-CB 4.49Å; I2890-F2958 WeakPolarHBondContact CB-O 3.32Å; I2890-F2958 HydrophobicContact CG2-CB 4.23Å; I2890-F2958 HydrophobicContact CG2-CD1 4.04Å; I2924-F2958 HydrophobicContact CD1-CZ 4.02Å; I2937-F2958 HydrophobicContact CD1-CE2 4.02Å; I2937-F2958 HydrophobicContact CD1-CZ 3.75Å; I2954-F2958 HydrophobicContact CG2-CD2 4.18Å; I2954-F2958 HydrophobicContact CG2-CE2 4.22Å; I2954-F2958 VanDerWaalsContact O-CD2 3.31Å; I2954-F2958 WeakPolarHBondContact O-CD2 3.34Å; I2954-F2958 PolarHBondContact O-N 2.69Å; E2956-F2958 VanDerWaalsContact C-N 3.3Å; E2956-F2958 PolarHBondContact O-N 3.43Å; F2958-N2960 VanDerWaalsContact C-N 3.32Å; F2958-N2960 PolarHBondContact O-N 3.22Å; F2958-W2975 HydrophobicContact CD1-CZ2 4.29Å; F2958-W2975 HydrophobicContact CE1-CH2 4.26Å; F2958-W2975 AromaticContact CE1-CZ2 3.82Å; F2958-W2975 HydrophobicContact CE1-CZ2 3.82Å; F2958-W2975 HydrophobicContact CZ-CH2 4.35Å; F2958-W2975 HydrophobicContact CZ-CZ2 4.3Å
2959	S	68.9	Low	74.3	Confident	42.5 Å²	42.5	60.4 Å²	60.4	30%	0.297	29%	0.288	S	S	.	.	H	α-helix	trans	-77.9	-6.5	-177	67.4	0	0	0	0	115.1	L2955 E2956 R2961 K2962	L2955-S2959 WeakPolarHBondContact O-CB 3.26Å; L2955-S2959 PolarHBondContact O-N 2.91Å; L2955-S2959 PolarHBondContact O-OG 2.92Å; E2956-S2959 PolarHBondContact O-N 2.98Å; E2956-S2959 PolarHBondContact O-OG 3.19Å; S2959-R2961 PolarHBondContact O-N 2.88Å; S2959-K2962 WeakPolarHBondContact O-CA 3.43Å; S2959-K2962 PolarHBondContact O-N 2.88Å
2960	N	61.3	Low	74.6	Confident	23 Å²	23	60.5 Å²	60.5	12%	0.123	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	19.8	71.6	178.4	-176.4	42	0	0	0	115.4	E2956 F2958 K2962 Q2963 I2966 L2974	E2956-N2960 PolarHBondContact O-N 3.44Å; F2958-N2960 VanDerWaalsContact C-N 3.32Å; F2958-N2960 PolarHBondContact O-N 3.22Å; N2960-K2962 PolarHBondContact O-N 3.18Å; N2960-Q2963 PolarHBondContact ND2-OE1 2.76Å; N2960-Q2963 PolarHBondContact O-N 3.08Å; N2960-I2966 HydrophobicContact CB-CD1 3.67Å; N2960-I2966 VanDerWaalsContact CB-CD1 3.5Å; N2960-I2966 VanDerWaalsContact CG-CD1 3.46Å; N2960-I2966 WeakPolarHBondContact ND2-CD1 3.4Å; N2960-L2974 HydrophobicContact CB-CD1 4.45Å; N2960-L2974 WeakPolarHBondContact ND2-CD1 3.36Å
2961	R	60.3	Low	74.8	Confident	237.5 Å²	237.5	60.4 Å²	60.4	90%	0.896	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	51	27.7	175.3	-56.8	-176.2	177.3	-174.9	1	114.5	S2959	S2959-R2961 PolarHBondContact O-N 2.88Å
2962	K	59.2	Low	74.7	Confident	193.5 Å²	193.5	63.1 Å²	63.1	84%	0.841	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	74.5	13.3	-176.6	-46.8	175.5	-178.7	178.4	0	115.9	S2959 N2960 L2964	S2959-K2962 WeakPolarHBondContact O-CA 3.43Å; S2959-K2962 PolarHBondContact O-N 2.88Å; N2960-K2962 PolarHBondContact O-N 3.18Å; K2962-L2964 PolarHBondContact O-N 3.03Å
2963	Q	64.7	Low	74.6	Confident	118 Å²	118	63.8 Å²	63.8	55%	0.551	31%	0.308	S	S	*	.			trans	-79.8	102.4	165.3	-80	-173.2	-39.1	0	0	109.7	N2960 I2966	N2960-Q2963 PolarHBondContact ND2-OE1 2.76Å; N2960-Q2963 PolarHBondContact O-N 3.08Å; Q2963-I2966 HydrophobicContact CB-CD1 4.34Å; Q2963-I2966 HydrophobicContact CB-CG1 4.41Å
2964	L	71	Confident	74.4	Confident	72 Å²	72	65 Å²	65	38%	0.377	31%	0.314	S	S	.	.			trans	-79.6	-20.6	-177.6	-65.7	170.1	0	0	0	114.2	L2817 L2889 I2890 R2891 K2962	L2817-L2964 HydrophobicContact CD1-CB 3.81Å; L2817-L2964 VanDerWaalsContact CD1-CB 3.46Å; L2817-L2964 HydrophobicContact CD1-CD1 3.86Å; L2817-L2964 HydrophobicContact CD1-CD2 4.36Å; L2817-L2964 HydrophobicContact CD1-CG 4.1Å; L2817-L2964 HydrophobicContact CD2-CB 4.37Å; L2817-L2964 HydrophobicContact CD2-CD2 4.48Å; L2889-L2964 WeakPolarHBondContact O-CD2 3.27Å; I2890-L2964 CarbonylContact C-O 3.59Å; R2891-L2964 WeakPolarHBondContact CB-O 3.4Å; R2891-L2964 PolarHBondContact N-O 2.76Å; K2962-L2964 PolarHBondContact O-N 3.03Å
2965	N	76.8	Confident	74.3	Confident	88.5 Å²	88.5	65.5 Å²	65.5	47%	0.473	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	118.9	-179.9	-67.5	-12.4	0	0	0	109	L2817 R2891	L2817-N2965 WeakPolarHBondContact CD1-OD1 3.36Å; R2891-N2965 WeakPolarHBondContact CB-OD1 3.26Å; R2891-N2965 WeakPolarHBondContact CD-OD1 3.37Å
2966	I	78.6	Confident	73.6	Confident	2.5 Å²	2.5	68.6 Å²	68.6	1%	0.013	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	147.8	-176.6	-53.6	-171.1	0	0	0	108.5	I2890 R2891 L2892 T2893 N2960 Q2963 E2970 L2971 L2974	I2890-I2966 HydrophobicContact CD1-CB 4.1Å; I2890-I2966 HydrophobicContact CD1-CD1 3.58Å; I2890-I2966 VanDerWaalsContact CD1-CD1 3.43Å; I2890-I2966 HydrophobicContact CD1-CG1 3.96Å; I2890-I2966 HydrophobicContact CG1-CB 4.46Å; I2890-I2966 HydrophobicContact CG1-CD1 4.34Å; I2890-I2966 HydrophobicContact CG1-CG1 4.38Å; R2891-I2966 PolarHBondContact O-N 3.13Å; R2891-I2966 VanDerWaalsContact O-O 3.1Å; L2892-I2966 VanDerWaalsContact CA-O 3.29Å; L2892-I2966 WeakPolarHBondContact CA-O 3.37Å; L2892-I2966 HydrophobicContact CD2-CB 4.44Å; T2893-I2966 PolarHBondContact N-O 3.2Å; T2893-I2966 PolarHBondContact OG1-O 3.12Å; N2960-I2966 HydrophobicContact CB-CD1 3.67Å; N2960-I2966 VanDerWaalsContact CB-CD1 3.5Å; N2960-I2966 VanDerWaalsContact CG-CD1 3.46Å; N2960-I2966 WeakPolarHBondContact ND2-CD1 3.4Å; Q2963-I2966 HydrophobicContact CB-CD1 4.34Å; Q2963-I2966 HydrophobicContact CB-CG1 4.41Å; I2966-E2970 HydrophobicContact CG2-CB 3.49Å; I2966-E2970 VanDerWaalsContact CG2-CB 3.47Å; I2966-L2971 HydrophobicContact CG2-CB 4.3Å; I2966-L2974 HydrophobicContact CD1-CD1 4.15Å; I2966-L2974 HydrophobicContact CG2-CD1 4.34Å
2967	N	81.6	Confident	72.8	Confident	10.5 Å²	10.5	67.4 Å²	67.4	6%	0.056	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	160.1	170.2	76.2	46.4	0	0	0	113	T2893 Y2896 I2969 E2970 L2971	T2893-N2967 CarbonylContact O-C 3.49Å; T2893-N2967 WeakPolarHBondContact O-CA 3.33Å; T2893-N2967 WeakPolarHBondContact O-CB 3.4Å; T2893-N2967 WeakPolarHBondContact OG1-CB 3.48Å; Y2896-N2967 HydrophobicContact CE2-CB 4.42Å; Y2896-N2967 WeakPolarHBondContact CE2-ND2 3.33Å; Y2896-N2967 VanDerWaalsContact CZ-ND2 3.25Å; Y2896-N2967 PolarHBondContact OH-ND2 3.35Å; N2967-I2969 PolarHBondContact O-N 2.74Å; N2967-I2969 VanDerWaalsContact O-N 3.09Å; N2967-I2969 VanDerWaalsContact OD1-CA 3.27Å; N2967-I2969 WeakPolarHBondContact OD1-CA 3.25Å; N2967-I2969 VanDerWaalsContact OD1-CB 3.24Å; N2967-I2969 WeakPolarHBondContact OD1-CB 3.3Å; N2967-I2969 PolarHBondContact OD1-N 2.82Å; N2967-E2970 PolarHBondContact N-OE2 3.3Å; N2967-E2970 PolarHBondContact ND2-OE1 2.99Å; N2967-E2970 PolarHBondContact ND2-OE2 3.17Å; N2967-E2970 VanDerWaalsContact ND2-OE2 3.15Å; N2967-E2970 PolarHBondContact O-N 2.87Å; N2967-E2970 VanDerWaalsContact O-N 3.11Å; N2967-E2970 WeakPolarHBondContact OD1-CB 3.22Å; N2967-E2970 WeakPolarHBondContact OD1-CG 3.24Å; N2967-E2970 PolarHBondContact OD1-N 2.92Å; N2967-L2971 PolarHBondContact O-N 2.94Å
2968	F	79	Confident	71.7	Confident	1 Å²	1	74.3 Å²	74.3	0%	0.004	37%	0.368	C	S	.	.	H	α-helix	trans	-62.2	-15.5	179.8	-76.4	-73.3	0	0	0	114.6	L2892 T2893 I2926 F2928 A2933 L2935 N2972 R2988	L2892-F2968 HydrophobicContact CB-CD1 4.49Å; L2892-F2968 HydrophobicContact CB-CE1 4.07Å; L2892-F2968 HydrophobicContact CB-CE2 4.18Å; L2892-F2968 HydrophobicContact CB-CZ 3.84Å; L2892-F2968 HydrophobicContact CD1-CD1 4.34Å; L2892-F2968 HydrophobicContact CD1-CE1 3.74Å; L2892-F2968 HydrophobicContact CD1-CZ 4.18Å; L2892-F2968 HydrophobicContact CG-CE1 4.37Å; T2893-F2968 WeakPolarHBondContact O-CD2 3.07Å; T2893-F2968 PolarHBondContact O-N 2.84Å; I2926-F2968 HydrophobicContact CD1-CE1 3.88Å; I2926-F2968 HydrophobicContact CD1-CZ 3.73Å; I2926-F2968 HydrophobicContact CG2-CZ 4.34Å; F2928-F2968 HydrophobicContact CD1-CE2 4.48Å; F2928-F2968 HydrophobicContact CE1-CD2 4.47Å; F2928-F2968 HydrophobicContact CE1-CE2 4.22Å; A2933-F2968 HydrophobicContact CB-CD1 4.4Å; A2933-F2968 HydrophobicContact CB-CE1 4.36Å; L2935-F2968 HydrophobicContact CD1-CD1 4.47Å; L2935-F2968 HydrophobicContact CD1-CE1 4.08Å; F2968-N2972 PolarHBondContact O-N 2.91Å; F2968-R2988 PolarHBondContact O-NH2 2.83Å
2969	I	78.2	Confident	70.6	Confident	98 Å²	98	77.7 Å²	77.7	50%	0.503	39%	0.389	S	S	.	.	H	α-helix	trans	-81	-45.4	175.2	-54.4	173.8	0	0	0	109.6	N2967 N2972 T2973 R2988	N2967-I2969 PolarHBondContact O-N 2.74Å; N2967-I2969 VanDerWaalsContact O-N 3.09Å; N2967-I2969 VanDerWaalsContact OD1-CA 3.27Å; N2967-I2969 WeakPolarHBondContact OD1-CA 3.25Å; N2967-I2969 VanDerWaalsContact OD1-CB 3.24Å; N2967-I2969 WeakPolarHBondContact OD1-CB 3.3Å; N2967-I2969 PolarHBondContact OD1-N 2.82Å; I2969-N2972 WeakPolarHBondContact O-CB 3.26Å; I2969-N2972 PolarHBondContact O-N 3.15Å; I2969-T2973 PolarHBondContact O-N 3.09Å; I2969-T2973 VanDerWaalsContact O-N 3.07Å; I2969-R2988 VanDerWaalsContact CG1-NH2 3.3Å
2970	E	80.6	Confident	70	Confident	64 Å²	64	84.5 Å²	84.5	30%	0.299	42%	0.419	S	S	.	.	H	α-helix	trans	-63.7	-39.2	174.9	-70.9	171.1	148.5	0	0	111.5	Y2896 I2966 N2967 N2972 T2973 L2974	Y2896-E2970 WeakPolarHBondContact CE2-OE1 3.47Å; Y2896-E2970 PolarHBondContact OH-OE1 2.87Å; Y2896-E2970 PolarHBondContact OH-OE2 3.47Å; I2966-E2970 HydrophobicContact CG2-CB 3.49Å; I2966-E2970 VanDerWaalsContact CG2-CB 3.47Å; N2967-E2970 PolarHBondContact N-OE2 3.3Å; N2967-E2970 PolarHBondContact ND2-OE1 2.99Å; N2967-E2970 PolarHBondContact ND2-OE2 3.17Å; N2967-E2970 VanDerWaalsContact ND2-OE2 3.15Å; N2967-E2970 PolarHBondContact O-N 2.87Å; N2967-E2970 VanDerWaalsContact O-N 3.11Å; N2967-E2970 WeakPolarHBondContact OD1-CB 3.22Å; N2967-E2970 WeakPolarHBondContact OD1-CG 3.24Å; N2967-E2970 PolarHBondContact OD1-N 2.92Å; E2970-N2972 VanDerWaalsContact C-N 3.31Å; E2970-N2972 PolarHBondContact O-N 3.06Å; E2970-T2973 WeakPolarHBondContact CA-OG1 3.46Å; E2970-T2973 PolarHBondContact O-N 2.86Å; E2970-T2973 PolarHBondContact O-OG1 3.03Å; E2970-L2974 WeakPolarHBondContact O-CB 3.42Å; E2970-L2974 WeakPolarHBondContact O-CD1 3.34Å; E2970-L2974 VanDerWaalsContact O-CG 3.24Å; E2970-L2974 WeakPolarHBondContact O-CG 3.42Å; E2970-L2974 PolarHBondContact O-N 3.03Å; E2970-L2974 VanDerWaalsContact O-N 3.1Å
2971	L	79.6	Confident	69.9	Low	1 Å²	1	87 Å²	87	1%	0.005	43%	0.431	C	S	.	.	H	α-helix	trans	-63.4	-40	174.5	-166.6	72.9	0	0	0	111.2	I2890 L2892 L2935 I2966 N2967 L2974 W2975 I2986	I2890-L2971 HydrophobicContact CD1-CD1 4.01Å; L2892-L2971 HydrophobicContact CD1-CD2 4.03Å; L2892-L2971 HydrophobicContact CD2-CB 4.37Å; L2892-L2971 HydrophobicContact CD2-CD1 4.36Å; L2892-L2971 HydrophobicContact CD2-CD2 3.78Å; L2892-L2971 HydrophobicContact CD2-CG 4.4Å; L2935-L2971 HydrophobicContact CD2-CD2 3.9Å; I2966-L2971 HydrophobicContact CG2-CB 4.3Å; N2967-L2971 PolarHBondContact O-N 2.94Å; L2971-L2974 PolarHBondContact O-N 2.92Å; L2971-W2975 HydrophobicContact CD1-CZ2 4.49Å; L2971-W2975 HydrophobicContact CD2-CD2 4.48Å; L2971-W2975 HydrophobicContact CD2-CH2 4.37Å; L2971-W2975 HydrophobicContact CD2-CZ2 3.98Å; L2971-W2975 HydrophobicContact CG-CD2 4.23Å; L2971-W2975 HydrophobicContact CG-CG 4.48Å; L2971-W2975 HydrophobicContact CG-CZ2 4.37Å; L2971-W2975 WeakPolarHBondContact O-CB 3.41Å; L2971-W2975 PolarHBondContact O-N 2.87Å; L2971-I2986 HydrophobicContact CB-CD1 3.78Å; L2971-I2986 HydrophobicContact CD2-CD1 3.65Å; L2971-I2986 HydrophobicContact CG-CD1 3.79Å
2972	N	78.2	Confident	70.1	Confident	64.5 Å²	64.5	76.5 Å²	76.5	35%	0.345	40%	0.398	S	S	.	.	H	α-helix	trans	-66.2	-40.4	178.4	-163.3	24.9	0	0	0	111.9	F2968 I2969 E2970 L2974 W2975 S2976 I2986	F2968-N2972 PolarHBondContact O-N 2.91Å; I2969-N2972 WeakPolarHBondContact O-CB 3.26Å; I2969-N2972 PolarHBondContact O-N 3.15Å; E2970-N2972 VanDerWaalsContact C-N 3.31Å; E2970-N2972 PolarHBondContact O-N 3.06Å; N2972-L2974 VanDerWaalsContact C-N 3.32Å; N2972-L2974 PolarHBondContact O-N 3.15Å; N2972-W2975 PolarHBondContact O-N 3.19Å; N2972-S2976 WeakPolarHBondContact O-CB 3.47Å; N2972-S2976 PolarHBondContact O-N 3.04Å; N2972-I2986 HydrophobicContact CB-CB 4.2Å; N2972-I2986 HydrophobicContact CB-CD1 3.98Å; N2972-I2986 HydrophobicContact CB-CG1 4.28Å
2973	T	77.2	Confident	70.8	Confident	86 Å²	86	72.1 Å²	72.1	53%	0.528	38%	0.377	S	S	.	.	H	α-helix	trans	-67.3	-34.2	176.2	56.8	0	0	0	0	111.9	I2969 E2970 S2976	I2969-T2973 PolarHBondContact O-N 3.09Å; I2969-T2973 VanDerWaalsContact O-N 3.07Å; E2970-T2973 WeakPolarHBondContact CA-OG1 3.46Å; E2970-T2973 PolarHBondContact O-N 2.86Å; E2970-T2973 PolarHBondContact O-OG1 3.03Å; T2973-S2976 PolarHBondContact O-OG 2.95Å
2974	L	74.3	Confident	71.4	Confident	62 Å²	62	66.9 Å²	66.9	33%	0.325	35%	0.354	S	S	.	.	H	α-helix	trans	-67.7	-45.1	173.9	-70.8	163.8	0	0	0	112.3	N2960 I2966 E2970 L2971 N2972 S2976 I2977	N2960-L2974 HydrophobicContact CB-CD1 4.45Å; N2960-L2974 WeakPolarHBondContact ND2-CD1 3.36Å; I2966-L2974 HydrophobicContact CD1-CD1 4.15Å; I2966-L2974 HydrophobicContact CG2-CD1 4.34Å; E2970-L2974 WeakPolarHBondContact O-CB 3.42Å; E2970-L2974 WeakPolarHBondContact O-CD1 3.34Å; E2970-L2974 VanDerWaalsContact O-CG 3.24Å; E2970-L2974 WeakPolarHBondContact O-CG 3.42Å; E2970-L2974 PolarHBondContact O-N 3.03Å; E2970-L2974 VanDerWaalsContact O-N 3.1Å; L2971-L2974 PolarHBondContact O-N 2.92Å; N2972-L2974 VanDerWaalsContact C-N 3.32Å; N2972-L2974 PolarHBondContact O-N 3.15Å; L2974-S2976 VanDerWaalsContact C-N 3.29Å; L2974-S2976 PolarHBondContact O-N 2.68Å; L2974-I2977 PolarHBondContact O-N 2.96Å
2975	W	76.9	Confident	72	Confident	14.5 Å²	14.5	65.2 Å²	65.2	6%	0.055	34%	0.344	C	S	.	.	H	α-helix	trans	-71.3	-24	-179.3	-75.1	8	0	0	0	113.8	L2935 I2937 L2957 F2958 L2971 N2972 I2977 A2984 E2985 I2986	L2935-W2975 HydrophobicContact CB-CH2 3.83Å; L2935-W2975 HydrophobicContact CB-CZ3 3.72Å; L2935-W2975 HydrophobicContact CD2-CH2 3.66Å; L2935-W2975 VanDerWaalsContact CD2-CH2 3.48Å; L2935-W2975 HydrophobicContact CD2-CZ2 4.26Å; L2935-W2975 HydrophobicContact CD2-CZ3 4.07Å; L2935-W2975 HydrophobicContact CG-CH2 4.06Å; L2935-W2975 HydrophobicContact CG-CZ3 3.99Å; I2937-W2975 HydrophobicContact CD1-CH2 3.91Å; I2937-W2975 HydrophobicContact CD1-CZ2 4.24Å; I2937-W2975 HydrophobicContact CG1-CH2 3.91Å; I2937-W2975 HydrophobicContact CG1-CZ3 4.27Å; L2957-W2975 HydrophobicContact CD2-CZ2 4.24Å; L2957-W2975 PolarHBondContact O-NE1 3.07Å; F2958-W2975 HydrophobicContact CD1-CZ2 4.29Å; F2958-W2975 HydrophobicContact CE1-CH2 4.26Å; F2958-W2975 AromaticContact CE1-CZ2 3.82Å; F2958-W2975 HydrophobicContact CE1-CZ2 3.82Å; F2958-W2975 HydrophobicContact CZ-CH2 4.35Å; F2958-W2975 HydrophobicContact CZ-CZ2 4.3Å; L2971-W2975 HydrophobicContact CD1-CZ2 4.49Å; L2971-W2975 HydrophobicContact CD2-CD2 4.48Å; L2971-W2975 HydrophobicContact CD2-CH2 4.37Å; L2971-W2975 HydrophobicContact CD2-CZ2 3.98Å; L2971-W2975 HydrophobicContact CG-CD2 4.23Å; L2971-W2975 HydrophobicContact CG-CG 4.48Å; L2971-W2975 HydrophobicContact CG-CZ2 4.37Å; L2971-W2975 WeakPolarHBondContact O-CB 3.41Å; L2971-W2975 PolarHBondContact O-N 2.87Å; N2972-W2975 PolarHBondContact O-N 3.19Å; W2975-I2977 PolarHBondContact O-N 2.83Å; W2975-A2984 HydrophobicContact CB-CB 4.16Å; W2975-A2984 HydrophobicContact CD2-CB 3.66Å; W2975-A2984 HydrophobicContact CE3-CB 3.64Å; W2975-A2984 HydrophobicContact CG-CB 3.92Å; W2975-A2984 HydrophobicContact CZ3-CB 4.14Å; W2975-E2985 WeakPolarHBondContact CZ3-O 3.23Å; W2975-I2986 HydrophobicContact CD2-CG1 4.36Å; W2975-I2986 HydrophobicContact CE3-CD1 4.11Å; W2975-I2986 HydrophobicContact CE3-CG1 3.53Å; W2975-I2986 HydrophobicContact CZ3-CD1 4.4Å; W2975-I2986 HydrophobicContact CZ3-CG1 3.87Å
2976	S	65.6	Low	72.3	Confident	87.5 Å²	87.5	61.6 Å²	61.6	61%	0.612	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-7.5	175.7	70.3	0	0	0	0	114.9	N2972 T2973 L2974	N2972-S2976 WeakPolarHBondContact O-CB 3.47Å; N2972-S2976 PolarHBondContact O-N 3.04Å; T2973-S2976 PolarHBondContact O-OG 2.95Å; L2974-S2976 VanDerWaalsContact C-N 3.29Å; L2974-S2976 PolarHBondContact O-N 2.68Å
2977	I	59.9	Low	72.5	Confident	121.5 Å²	121.5	63.9 Å²	63.9	62%	0.623	34%	0.335	S	S	*	.	S	Bend	trans	-90.9	110.1	173	-54.7	173.6	0	0	0	108.4	L2974 W2975 T2979	L2974-I2977 PolarHBondContact O-N 2.96Å; W2975-I2977 PolarHBondContact O-N 2.83Å; I2977-T2979 PolarHBondContact O-N 3.05Å; I2977-T2979 VanDerWaalsContact O-N 3.11Å
2978	Q	55	Low	72.5	Confident	171 Å²	171	67.7 Å²	67.7	80%	0.799	35%	0.349	S	S	*	.			trans	-51.2	121.6	177.5	-80	-178.1	-39.8	0	0	111.7
2979	T	55.7	Low	72.6	Confident	72 Å²	72	70 Å²	70	44%	0.442	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-79.8	150.4	162.4	52.5	0	0	0	0	108.7	L2957 I2977 D2981 G2982	L2957-T2979 HydrophobicContact CD2-CG2 4.07Å; I2977-T2979 PolarHBondContact O-N 3.05Å; I2977-T2979 VanDerWaalsContact O-N 3.11Å; T2979-D2981 PolarHBondContact O-N 2.95Å; T2979-G2982 PolarHBondContact OG1-O 2.91Å; T2979-G2982 VanDerWaalsContact OG1-O 3.05Å
2980	M	55.2	Low	72.8	Confident	187 Å²	187	72.7 Å²	72.7	92%	0.921	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-21.7	-170.7	-75.1	-74.9	-119.7	0	0	114.3
2981	D	60.5	Low	72.8	Confident	73.5 Å²	73.5	69.9 Å²	69.9	39%	0.393	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.6	13.6	-168.3	-66.9	-74	0	0	0	114	S2943 I2953 T2979	S2943-D2981 VanDerWaalsContact CB-OD1 3.27Å; S2943-D2981 WeakPolarHBondContact CB-OD1 3.37Å; S2943-D2981 PolarHBondContact OG-OD1 2.91Å; I2953-D2981 HydrophobicContact CD1-CB 4.39Å; T2979-D2981 PolarHBondContact O-N 2.95Å
2982	G	64.1	Low	72.9	Confident	19 Å²	19	75.5 Å²	75.5	20%	0.196	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.8	173.2	-179.4	0	0	0	0	0	114.7	Q2938 T2979	Q2938-G2982 WeakPolarHBondContact O-CA 3.29Å; T2979-G2982 PolarHBondContact OG1-O 2.91Å; T2979-G2982 VanDerWaalsContact OG1-O 3.05Å
2983	Y	74	Confident	73.2	Confident	101 Å²	101	75.9 Å²	75.9	40%	0.396	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.4	176.4	176.5	-110.7	0	0	0	109.9	I2937 Q2938 E2985	I2937-Y2983 WeakPolarHBondContact CA-O 3.41Å; Q2938-Y2983 PolarHBondContact N-O 2.94Å; Q2938-Y2983 PolarHBondContact O-N 3.23Å; Y2983-E2985 HydrophobicContact CE1-CB 3.77Å; Y2983-E2985 HydrophobicContact CE1-CG 3.84Å; Y2983-E2985 WeakPolarHBondContact OH-CB 3.43Å
2984	A	78	Confident	73.5	Confident	7.5 Å²	7.5	74.2 Å²	74.2	6%	0.062	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	135.8	174.9	0	0	0	0	0	109.9	H2936 I2937 L2957 W2975	H2936-A2984 CarbonylContact O-C 3.53Å; H2936-A2984 VanDerWaalsContact O-CA 3.25Å; H2936-A2984 WeakPolarHBondContact O-CA 3.1Å; I2937-A2984 HydrophobicContact CG1-CB 4.26Å; L2957-A2984 HydrophobicContact CD2-CB 4.28Å; W2975-A2984 HydrophobicContact CB-CB 4.16Å; W2975-A2984 HydrophobicContact CD2-CB 3.66Å; W2975-A2984 HydrophobicContact CE3-CB 3.64Å; W2975-A2984 HydrophobicContact CG-CB 3.92Å; W2975-A2984 HydrophobicContact CZ3-CB 4.14Å
2985	E	82.7	Confident	73.9	Confident	36.5 Å²	36.5	71.3 Å²	71.3	17%	0.171	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	156	179.6	66.6	176.1	144.2	0	0	112.3	L2935 H2936 W2975 Y2983 Q2987	L2935-E2985 WeakPolarHBondContact CA-O 3.38Å; H2936-E2985 HydrophobicContact CB-CG 3.8Å; H2936-E2985 IonicContact CE1-OE1 3.77Å; H2936-E2985 IonicContact CG-OE1 3.24Å; H2936-E2985 PolarHBondContact N-O 3.14Å; H2936-E2985 IonicContact ND1-OE1 3.21Å; H2936-E2985 PolarHBondContact ND1-OE1 3.15Å; H2936-E2985 PolarHBondContact O-N 2.94Å; W2975-E2985 WeakPolarHBondContact CZ3-O 3.23Å; Y2983-E2985 HydrophobicContact CE1-CB 3.77Å; Y2983-E2985 HydrophobicContact CE1-CG 3.84Å; Y2983-E2985 WeakPolarHBondContact OH-CB 3.43Å; E2985-Q2987 VanDerWaalsContact CD-NE2 3.34Å; E2985-Q2987 PolarHBondContact OE1-NE2 2.72Å; E2985-Q2987 WeakPolarHBondContact OE2-CG 3.39Å; E2985-Q2987 PolarHBondContact OE2-NE2 2.86Å
2986	I	82.3	Confident	74.3	Confident	12.5 Å²	12.5	73.8 Å²	73.8	6%	0.064	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	111.5	172.1	-48.8	-175.4	0	0	0	109.3	A2933 T2934 L2935 L2971 N2972 W2975	A2933-I2986 HydrophobicContact CB-CG2 4.46Å; T2934-I2986 CarbonylContact O-C 3.54Å; T2934-I2986 VanDerWaalsContact O-CA 3.24Å; T2934-I2986 WeakPolarHBondContact O-CA 3.43Å; L2935-I2986 HydrophobicContact CD1-CG2 4.27Å; L2935-I2986 HydrophobicContact CG-CG1 4.33Å; L2935-I2986 HydrophobicContact CG-CG2 4.46Å; L2971-I2986 HydrophobicContact CB-CD1 3.78Å; L2971-I2986 HydrophobicContact CD2-CD1 3.65Å; L2971-I2986 HydrophobicContact CG-CD1 3.79Å; N2972-I2986 HydrophobicContact CB-CB 4.2Å; N2972-I2986 HydrophobicContact CB-CD1 3.98Å; N2972-I2986 HydrophobicContact CB-CG1 4.28Å; W2975-I2986 HydrophobicContact CD2-CG1 4.36Å; W2975-I2986 HydrophobicContact CE3-CD1 4.11Å; W2975-I2986 HydrophobicContact CE3-CG1 3.53Å; W2975-I2986 HydrophobicContact CZ3-CD1 4.4Å; W2975-I2986 HydrophobicContact CZ3-CG1 3.87Å
2987	Q	82.8	Confident	75.2	Confident	51 Å²	51	71 Å²	71	24%	0.238	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	148.8	170	-52.8	176.3	0.3	0	0	109.6	A2933 T2934 E2985 F2989	A2933-Q2987 WeakPolarHBondContact CA-O 3.43Å; T2934-Q2987 PolarHBondContact N-O 3.04Å; T2934-Q2987 PolarHBondContact O-N 3.27Å; T2934-Q2987 VanDerWaalsContact OG1-CB 3.31Å; T2934-Q2987 WeakPolarHBondContact OG1-CB 3.49Å; T2934-Q2987 PolarHBondContact OG1-O 2.72Å; E2985-Q2987 VanDerWaalsContact CD-NE2 3.34Å; E2985-Q2987 PolarHBondContact OE1-NE2 2.72Å; E2985-Q2987 WeakPolarHBondContact OE2-CG 3.39Å; E2985-Q2987 PolarHBondContact OE2-NE2 2.86Å; Q2987-F2989 HydrophobicContact CB-CE2 3.98Å; Q2987-F2989 HydrophobicContact CB-CZ 4.44Å
2988	R	81.8	Confident	76.7	Confident	91.5 Å²	91.5	65.7 Å²	65.7	35%	0.345	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.7	176.3	-62.8	-172.5	-170.1	-175.7	3.8	110.3	E2931 I2932 F2968 I2969	E2931-R2988 IonicContact OE2-NH1 2.76Å; I2932-R2988 CarbonylContact O-C 3.57Å; I2932-R2988 WeakPolarHBondContact O-CA 3.29Å; F2968-R2988 PolarHBondContact O-NH2 2.83Å; I2969-R2988 VanDerWaalsContact CG1-NH2 3.3Å
2989	F	82.2	Confident	78.2	Confident	47.5 Å²	47.5	58.2 Å²	58.2	21%	0.208	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	143.4	174.7	-61.7	-87.9	0	0	0	109.1	E2931 I2932 T2934 Q2987 I3025	E2931-F2989 CarbonylContact C-O 3.59Å; E2931-F2989 VanDerWaalsContact CA-O 3.28Å; E2931-F2989 WeakPolarHBondContact CA-O 3.34Å; I2932-F2989 HydrophobicContact CB-CB 4.49Å; I2932-F2989 PolarHBondContact N-O 2.86Å; I2932-F2989 PolarHBondContact O-N 2.82Å; T2934-F2989 HydrophobicContact CG2-CD2 3.73Å; T2934-F2989 HydrophobicContact CG2-CE2 3.72Å; Q2987-F2989 HydrophobicContact CB-CE2 3.98Å; Q2987-F2989 HydrophobicContact CB-CZ 4.44Å; F2989-I3025 HydrophobicContact CB-CG2 4.43Å; F2989-I3025 HydrophobicContact CD1-CG2 4.04Å; F2989-I3025 HydrophobicContact CD2-CG2 4.23Å; F2989-I3025 HydrophobicContact CE1-CG2 4.4Å; F2989-I3025 HydrophobicContact CG-CG2 3.95Å
2990	K	82.5	Confident	79.6	Confident	155.5 Å²	155.5	55.1 Å²	55.1	68%	0.676	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.6	139.3	176	-126.4	178.4	178.7	-179.4	0	110	Y2930 E2931	Y2930-K2990 CarbonylContact O-C 3.48Å; Y2930-K2990 WeakPolarHBondContact O-CA 3.35Å; Y2930-K2990 WeakPolarHBondContact O-CG 3.48Å; E2931-K2990 HydrophobicContact CG-CB 4.35Å; E2931-K2990 HydrophobicContact CG-CD 4.45Å; E2931-K2990 HydrophobicContact CG-CG 3.99Å; E2931-K2990 WeakPolarHBondContact OE1-CE 3.5Å; E2931-K2990 IonicContact OE1-NZ 3.08Å; E2931-K2990 PolarHBondContact OE1-NZ 3.19Å
2991	T	81.2	Confident	81	Confident	6 Å²	6	46.9 Å²	46.9	4%	0.037	23%	0.23	C	C	.	.			trans	-113	156.2	176.6	53.7	0	0	0	0	110.5	Y2930 I2932 H2993 V2995 L3017 L3034	Y2930-T2991 PolarHBondContact O-N 2.72Å; Y2930-T2991 PolarHBondContact O-OG1 3.39Å; I2932-T2991 HydrophobicContact CD1-CG2 4.26Å; T2991-H2993 VanDerWaalsContact C-N 3.27Å; T2991-H2993 WeakPolarHBondContact CB-O 3.44Å; T2991-H2993 PolarHBondContact O-N 2.96Å; T2991-H2993 PolarHBondContact OG1-O 2.99Å; T2991-V2995 HydrophobicContact CG2-CG2 3.9Å; T2991-V2995 WeakPolarHBondContact OG1-CG2 3.31Å; T2991-L3017 HydrophobicContact CG2-CD2 3.98Å; T2991-L3034 HydrophobicContact CG2-CD1 4.14Å
2992	D	81.1	Confident	81.9	Confident	118 Å²	118	45.1 Å²	45.1	63%	0.631	22%	0.219	S	C	*	.	S	Bend	trans	-71.2	-24	179.4	-63.3	-40.2	0	0	0	112.8
2993	H	83.6	Confident	82.3	Confident	73.5 Å²	73.5	49.4 Å²	49.4	34%	0.34	23%	0.234	S	C	.	.	S	Bend	trans	-130.7	163.4	-179.4	-68.4	-77.8	0	0	0	110.9	T2991 V2995 L3017 N3019	T2991-H2993 VanDerWaalsContact C-N 3.27Å; T2991-H2993 WeakPolarHBondContact CB-O 3.44Å; T2991-H2993 PolarHBondContact O-N 2.96Å; T2991-H2993 PolarHBondContact OG1-O 2.99Å; H2993-V2995 PolarHBondContact O-N 3.41Å; H2993-L3017 HydrophobicContact CB-CB 4.12Å; H2993-L3017 HydrophobicContact CB-CD1 4.45Å; H2993-N3019 HydrophobicContact CB-CB 4.47Å; H2993-N3019 PolarHBondContact CD2-ND2 3.14Å; H2993-N3019 PolarHBondContact NE2-ND2 2.89Å
2994	I	83.2	Confident	82.4	Confident	50.5 Å²	50.5	52.5 Å²	52.5	26%	0.259	25%	0.252	S	S	.	.			trans	-65	132.3	-178.9	-66.8	175.3	0	0	0	109.1	N2904 G2929 Y2930 V2996 L3017 S3018	N2904-I2994 WeakPolarHBondContact ND2-CG2 3.36Å; G2929-I2994 CarbonylContact O-C 3.53Å; G2929-I2994 VanDerWaalsContact O-CA 3.3Å; G2929-I2994 WeakPolarHBondContact O-CA 3.44Å; Y2930-I2994 HydrophobicContact CD1-CG1 4.11Å; Y2930-I2994 HydrophobicContact CD2-CG1 4.03Å; Y2930-I2994 HydrophobicContact CE1-CD1 4.5Å; Y2930-I2994 HydrophobicContact CE1-CG1 3.73Å; Y2930-I2994 HydrophobicContact CE2-CD1 4.04Å; Y2930-I2994 HydrophobicContact CE2-CG1 3.63Å; Y2930-I2994 HydrophobicContact CG-CG1 4.24Å; I2994-V2996 PolarHBondContact O-N 3.41Å; I2994-L3017 CarbonylContact O-C 3.52Å; I2994-L3017 WeakPolarHBondContact O-CA 3.15Å; I2994-S3018 PolarHBondContact N-OG 2.95Å; I2994-S3018 WeakPolarHBondContact O-CB 3.31Å; I2994-S3018 PolarHBondContact O-N 2.99Å; I2994-S3018 PolarHBondContact O-OG 2.92Å
2995	V	84.6	Confident	82.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	122.2	174.7	178.7	0	0	0	0	108.7	N2904 A2927 G2929 I2932 T2991 H2993 M2998 A3015 L3017	N2904-V2995 WeakPolarHBondContact CB-O 3.42Å; N2904-V2995 PolarHBondContact ND2-O 3.04Å; A2927-V2995 HydrophobicContact CB-CB 3.88Å; A2927-V2995 HydrophobicContact CB-CG1 3.61Å; G2929-V2995 PolarHBondContact O-N 3.13Å; I2932-V2995 HydrophobicContact CD1-CG1 4.33Å; I2932-V2995 HydrophobicContact CD1-CG2 3.87Å; I2932-V2995 HydrophobicContact CG1-CG2 3.96Å; T2991-V2995 HydrophobicContact CG2-CG2 3.9Å; T2991-V2995 WeakPolarHBondContact OG1-CG2 3.31Å; H2993-V2995 PolarHBondContact O-N 3.41Å; V2995-M2998 HydrophobicContact CG1-CG 3.55Å; V2995-M2998 VanDerWaalsContact CG1-CG 3.43Å; V2995-M2998 HydrophobicContact CG1-SD 4.09Å; V2995-A3015 HydrophobicContact CG1-CB 4.11Å; V2995-L3017 HydrophobicContact CG2-CD2 3.77Å
2996	V	83.7	Confident	81.9	Confident	67.5 Å²	67.5	54.2 Å²	54.2	41%	0.409	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-56.1	-176.3	-179.7	0	0	0	0	110.6	I2994 L3016	I2994-V2996 PolarHBondContact O-N 3.41Å; V2996-L3016 HydrophobicContact CB-CG 4.46Å; V2996-L3016 PolarHBondContact N-O 3.45Å
2997	E	86.1	Confident	81.5	Confident	29 Å²	29	56.8 Å²	56.8	14%	0.136	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	155	177.9	-169.8	171.1	-143.1	0	0	109.6	L3016 S3052 I3053 R3097	E2997-L3016 PolarHBondContact O-N 2.83Å; E2997-S3052 WeakPolarHBondContact OE2-CA 3.47Å; E2997-S3052 WeakPolarHBondContact OE2-CB 3.3Å; E2997-S3052 PolarHBondContact OE2-OG 3.46Å; E2997-I3053 HydrophobicContact CB-CG2 4.02Å; E2997-I3053 HydrophobicContact CG-CG2 4.02Å; E2997-I3053 PolarHBondContact OE2-N 3.43Å; E2997-R3097 IonicContact OE1-NE 2.75Å; E2997-R3097 IonicContact OE1-NH2 3.68Å
2998	M	89.8	Confident	81.2	Confident	9 Å²	9	55.8 Å²	55.8	4%	0.044	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	151.5	176	-62.4	-172.3	-61.4	0	0	110	S2905 V2907 A2927 I2932 V2995 V3013 V3014 A3015	S2905-M2998 VanDerWaalsContact O-CE 3.3Å; S2905-M2998 WeakPolarHBondContact O-CE 2.93Å; S2905-M2998 PolarHBondContact OG-N 2.8Å; V2907-M2998 VanDerWaalsContact CG2-C 3.41Å; V2907-M2998 HydrophobicContact CG2-CB 3.56Å; V2907-M2998 HydrophobicContact CG2-CE 4.34Å; V2907-M2998 VanDerWaalsContact CG2-O 3.3Å; V2907-M2998 WeakPolarHBondContact CG2-O 3.27Å; A2927-M2998 HydrophobicContact CB-CE 3.59Å; A2927-M2998 HydrophobicContact CB-CG 4.42Å; A2927-M2998 HydrophobicContact CB-SD 3.85Å; I2932-M2998 HydrophobicContact CD1-SD 3.71Å; I2932-M2998 HydrophobicContact CG1-SD 3.94Å; I2932-M2998 HydrophobicContact CG2-CE 4.42Å; I2932-M2998 HydrophobicContact CG2-SD 4.05Å; V2995-M2998 HydrophobicContact CG1-CG 3.55Å; V2995-M2998 VanDerWaalsContact CG1-CG 3.43Å; V2995-M2998 HydrophobicContact CG1-SD 4.09Å; M2998-V3013 HydrophobicContact SD-CG2 4.19Å; M2998-V3014 CarbonylContact C-O 3.57Å; M2998-V3014 VanDerWaalsContact CA-O 3.3Å; M2998-V3014 WeakPolarHBondContact CA-O 3.37Å; M2998-A3015 HydrophobicContact CG-CB 3.97Å
2999	S	87.1	Confident	80.9	Confident	13.5 Å²	13.5	56.8 Å²	56.8	9%	0.094	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	153	168.1	-176	0	0	0	0	110.1	V3013 V3014 T3055	S2999-V3013 CarbonylContact O-C 3.55Å; S2999-V3013 VanDerWaalsContact O-CA 3.28Å; S2999-V3013 WeakPolarHBondContact O-CA 3.46Å; S2999-V3013 WeakPolarHBondContact O-CB 3.27Å; S2999-V3014 PolarHBondContact N-O 2.58Å; S2999-V3014 PolarHBondContact O-N 3.09Å; S2999-T3055 PolarHBondContact OG-N 2.8Å; S2999-T3055 PolarHBondContact OG-OG1 2.9Å
3000	T	86.1	Confident	80.7	Confident	7.5 Å²	7.5	56.9 Å²	56.9	5%	0.046	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	143.1	171	45.5	0	0	0	0	110.1	V2907 T2908 Q2909 H3002 H3003 T3055	V2907-T3000 HydrophobicContact CG1-CG2 3.3Å; V2907-T3000 VanDerWaalsContact CG1-N 3.34Å; T2908-T3000 VanDerWaalsContact O-CG2 3.31Å; T2908-T3000 WeakPolarHBondContact O-CG2 3.39Å; Q2909-T3000 HydrophobicContact CB-CG2 3.76Å; Q2909-T3000 HydrophobicContact CG-CG2 3.83Å; T3000-H3002 VanDerWaalsContact C-N 3.33Å; T3000-H3002 PolarHBondContact O-N 3.22Å; T3000-H3003 PolarHBondContact OG1-ND1 3.09Å; T3000-T3055 WeakPolarHBondContact O-CB 3.39Å; T3000-T3055 WeakPolarHBondContact O-CG2 3.34Å; T3000-T3055 PolarHBondContact O-OG1 3.1Å
3001	L	83.6	Confident	80.6	Confident	15 Å²	15	49.5 Å²	49.5	8%	0.079	26%	0.255	C	S	.	.	S	Bend	trans	-58.1	-46.7	176.8	-176.9	60.5	0	0	0	111.3	G3012 V3014 I3024 F3073	L3001-G3012 PolarHBondContact N-O 2.9Å; L3001-V3014 HydrophobicContact CD1-CG2 3.77Å; L3001-I3024 HydrophobicContact CD1-CD1 4.47Å; L3001-I3024 HydrophobicContact CD1-CG2 3.83Å; L3001-I3024 HydrophobicContact CD2-CG2 4.12Å; L3001-F3073 HydrophobicContact CD1-CD1 4.49Å; L3001-F3073 HydrophobicContact CD1-CE1 3.96Å; L3001-F3073 WeakPolarHBondContact O-CZ 3.44Å
3002	H	79.4	Confident	80.8	Confident	36 Å²	36	49.2 Å²	49.2	17%	0.167	25%	0.253	C	S	.	.			trans	-132.3	138.6	166	-60.6	-89.1	0	0	0	110.1	Q2909 T3000 E3004 Q3010 F3073	Q2909-H3002 PolarHBondContact NE2-O 3.16Å; T3000-H3002 VanDerWaalsContact C-N 3.33Å; T3000-H3002 PolarHBondContact O-N 3.22Å; H3002-E3004 VanDerWaalsContact C-N 3.32Å; H3002-E3004 PolarHBondContact O-N 3.49Å; H3002-Q3010 HydrophobicContact CB-CB 4.38Å; H3002-Q3010 VanDerWaalsContact CD2-CB 3.41Å; H3002-Q3010 WeakPolarHBondContact CD2-CB 2.97Å; H3002-F3073 AromaticContact CE1-CD2 3.45Å; H3002-F3073 VanDerWaalsContact CE1-CD2 3.45Å; H3002-F3073 WeakPolarHBondContact CE1-CD2 3.5Å; H3002-F3073 AromaticContact CE1-CE2 3.58Å; H3002-F3073 AromaticContact CE1-CG 3.72Å; H3002-F3073 AromaticContact CE1-CZ 3.98Å; H3002-F3073 AromaticContact ND1-CD2 3.91Å; H3002-F3073 AromaticContact ND1-CE2 3.62Å
3003	H	73.6	Confident	81.1	Confident	109 Å²	109	43.6 Å²	43.6	51%	0.505	22%	0.223	S	C	.	.	S	Bend	trans	-65.7	-34.7	178.9	-67.1	-78.9	0	0	0	112.8	T3000 T3055	T3000-H3003 PolarHBondContact OG1-ND1 3.09Å; H3003-T3055 PolarHBondContact NE2-O 3.04Å; H3003-T3055 PolarHBondContact NE2-OG1 2.94Å
3004	E	74.7	Confident	81.4	Confident	166 Å²	166	40.1 Å²	40.1	78%	0.776	21%	0.207	S	C	*	.	S	Bend	trans	-126.1	86.6	177.6	-64.7	-177.2	158.9	0	0	109.1	H3002	H3002-E3004 VanDerWaalsContact C-N 3.32Å; H3002-E3004 PolarHBondContact O-N 3.49Å
3005	P	76.4	Confident	81.6	Confident	5 Å²	5	37.7 Å²	37.7	3%	0.032	19%	0.194	C	C	.	.			trans	-78.1	124.3	-179.2	31.8	-34.8	0	0	0	111.4	Q2909 Q3010	Q2909-P3005 HydrophobicContact CG-CG 4.03Å; P3005-Q3010 HydrophobicContact CB-CB 3.68Å
3006	V	73.6	Confident	81.7	Confident	75 Å²	75	37.8 Å²	37.8	46%	0.455	20%	0.195	S	C	.	.	S	Bend	trans	-86.7	-22.2	179.6	-171.7	0	0	0	0	111.5	D2914	D2914-V3006 HydrophobicContact CB-CG1 4.1Å
3007	N	75	Confident	81.8	Confident	66 Å²	66	34.7 Å²	34.7	35%	0.353	18%	0.176	S	C	.	.	S	Bend	trans	-142.6	162	177.8	67.3	71	0	0	0	112.1	M2913 N3009 Q3010	M2913-N3007 VanDerWaalsContact SD-C 3.56Å; M2913-N3007 VanDerWaalsContact SD-CA 3.52Å; N3007-N3009 PolarHBondContact O-N 3.38Å; N3007-N3009 VanDerWaalsContact O-N 3.16Å; N3007-N3009 WeakPolarHBondContact OD1-CA 3.44Å; N3007-N3009 VanDerWaalsContact OD1-CB 3.29Å; N3007-N3009 WeakPolarHBondContact OD1-CB 3.5Å; N3007-N3009 PolarHBondContact OD1-N 3.42Å; N3007-Q3010 PolarHBondContact ND2-OE1 3.26Å; N3007-Q3010 WeakPolarHBondContact O-CB 3.46Å; N3007-Q3010 PolarHBondContact O-N 3.31Å; N3007-Q3010 PolarHBondContact OD1-N 3.15Å
3008	M	76.2	Confident	81.6	Confident	30 Å²	30	36.1 Å²	36.1	15%	0.148	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-62.8	-21.9	-176.3	-66.9	-62.7	-82.4	0	0	114.7	M2913 F2923 Q3010 C3011 F3027 Q3028	M2913-M3008 HydrophobicContact CE-SD 4.38Å; M2913-M3008 HydrophobicContact CG-SD 4.3Å; M2913-M3008 HydrophobicContact SD-CG 3.69Å; M2913-M3008 PolarHBondContact SD-N 2.63Å; M2913-M3008 VanDerWaalsContact SD-N 3.41Å; M2913-M3008 HydrophobicContact SD-SD 3.78Å; F2923-M3008 HydrophobicContact CZ-CE 4.09Å; F2923-M3008 HydrophobicContact CZ-SD 4.33Å; M3008-Q3010 PolarHBondContact O-N 3.46Å; M3008-C3011 WeakPolarHBondContact O-CB 3.41Å; M3008-C3011 PolarHBondContact O-N 2.96Å; M3008-F3027 HydrophobicContact CE-CD1 3.65Å; M3008-F3027 HydrophobicContact CE-CE1 3.49Å; M3008-F3027 VanDerWaalsContact CE-CE1 3.49Å; M3008-Q3028 HydrophobicContact CB-CG 4.46Å
3009	N	75.5	Confident	81	Confident	114 Å²	114	38.5 Å²	38.5	61%	0.61	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-74.6	-15.5	176.5	-55.6	-17.1	0	0	0	112	N3007	N3007-N3009 PolarHBondContact O-N 3.38Å; N3007-N3009 VanDerWaalsContact O-N 3.16Å; N3007-N3009 WeakPolarHBondContact OD1-CA 3.44Å; N3007-N3009 VanDerWaalsContact OD1-CB 3.29Å; N3007-N3009 WeakPolarHBondContact OD1-CB 3.5Å; N3007-N3009 PolarHBondContact OD1-N 3.42Å
3010	Q	77.1	Confident	80.4	Confident	49 Å²	49	38.8 Å²	38.8	23%	0.229	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-91.5	-5.7	173.6	-66.4	176.7	-38.2	0	0	112.7	Q2909 H3002 P3005 N3007 M3008	Q2909-Q3010 PolarHBondContact NE2-O 3.17Å; H3002-Q3010 HydrophobicContact CB-CB 4.38Å; H3002-Q3010 VanDerWaalsContact CD2-CB 3.41Å; H3002-Q3010 WeakPolarHBondContact CD2-CB 2.97Å; P3005-Q3010 HydrophobicContact CB-CB 3.68Å; N3007-Q3010 PolarHBondContact ND2-OE1 3.26Å; N3007-Q3010 WeakPolarHBondContact O-CB 3.46Å; N3007-Q3010 PolarHBondContact O-N 3.31Å; N3007-Q3010 PolarHBondContact OD1-N 3.15Å; M3008-Q3010 PolarHBondContact O-N 3.46Å
3011	C	81.2	Confident	80.2	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.223	C	C	.	.			trans	-83.1	134.5	174	-60.3	0	0	0	0	110.4	F2923 M3008 F3027	F2923-C3011 HydrophobicContact CE2-CB 4.15Å; F2923-C3011 HydrophobicContact CZ-CB 4.06Å; M3008-C3011 WeakPolarHBondContact O-CB 3.41Å; M3008-C3011 PolarHBondContact O-N 2.96Å; C3011-F3027 HydrophobicContact CB-CB 4.01Å; C3011-F3027 WeakPolarHBondContact O-CB 3.26Å; C3011-F3027 PolarHBondContact O-N 3.02Å
3012	G	84.8	Confident	80.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144.1	-178.4	-173.9	0	0	0	0	0	113.1	Q2909 Y2925 L3001 I3025	Q2909-G3012 VanDerWaalsContact OE1-N 3.12Å; Y2925-G3012 WeakPolarHBondContact OH-CA 3.03Å; Y2925-G3012 PolarHBondContact OH-N 2.98Å; Y2925-G3012 VanDerWaalsContact OH-N 3.16Å; L3001-G3012 PolarHBondContact N-O 2.9Å; G3012-I3025 VanDerWaalsContact CA-O 3.25Å; G3012-I3025 WeakPolarHBondContact CA-O 3.38Å
3013	V	88.8	Confident	80.5	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	152.3	179.7	-68.7	0	0	0	0	112.3	V2907 Y2925 M2998 S2999 I3025	V2907-V3013 HydrophobicContact CB-CG1 4.25Å; V2907-V3013 HydrophobicContact CG1-CG1 4.03Å; Y2925-V3013 HydrophobicContact CD1-CG1 3.8Å; Y2925-V3013 HydrophobicContact CD1-CG2 4.19Å; Y2925-V3013 HydrophobicContact CD2-CG1 3.47Å; Y2925-V3013 VanDerWaalsContact CD2-CG1 3.47Å; Y2925-V3013 HydrophobicContact CE1-CG1 4.18Å; Y2925-V3013 HydrophobicContact CE2-CG1 3.88Å; Y2925-V3013 HydrophobicContact CG-CG1 3.43Å; Y2925-V3013 VanDerWaalsContact CG-CG1 3.43Å; M2998-V3013 HydrophobicContact SD-CG2 4.19Å; S2999-V3013 CarbonylContact O-C 3.55Å; S2999-V3013 VanDerWaalsContact O-CA 3.28Å; S2999-V3013 WeakPolarHBondContact O-CA 3.46Å; S2999-V3013 WeakPolarHBondContact O-CB 3.27Å; V3013-I3025 HydrophobicContact CG2-CB 4.06Å; V3013-I3025 HydrophobicContact CG2-CD1 4.47Å; V3013-I3025 PolarHBondContact N-O 2.84Å; V3013-I3025 PolarHBondContact O-N 3.42Å
3014	V	89.1	Confident	81.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	125.8	161.1	-162	0	0	0	0	107.3	M2998 S2999 L3001 V3022 V3023 I3024 I3053 T3055 I3060	M2998-V3014 CarbonylContact C-O 3.57Å; M2998-V3014 VanDerWaalsContact CA-O 3.3Å; M2998-V3014 WeakPolarHBondContact CA-O 3.37Å; S2999-V3014 PolarHBondContact N-O 2.58Å; S2999-V3014 PolarHBondContact O-N 3.09Å; L3001-V3014 HydrophobicContact CD1-CG2 3.77Å; V3014-V3022 HydrophobicContact CG1-CG1 3.49Å; V3014-V3022 VanDerWaalsContact CG1-CG1 3.49Å; V3014-V3023 WeakPolarHBondContact CA-O 3.4Å; V3014-I3024 HydrophobicContact CG1-CG1 4.1Å; V3014-I3024 HydrophobicContact CG2-CG1 4.26Å; V3014-I3053 HydrophobicContact CB-CD1 4.09Å; V3014-I3053 HydrophobicContact CG1-CD1 3.53Å; V3014-T3055 HydrophobicContact CG2-CG2 4.01Å; V3014-I3060 HydrophobicContact CG1-CD1 4.18Å; V3014-I3060 HydrophobicContact CG1-CG2 4.37Å; V3014-I3060 HydrophobicContact CG2-CD1 3.97Å; V3014-I3060 HydrophobicContact CG2-CG1 4.27Å
3015	A	87.8	Confident	81.5	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	135.9	-176.6	0	0	0	0	0	110.9	I2932 V2995 M2998 V3022 V3023 I3025	I2932-A3015 HydrophobicContact CD1-CB 4.26Å; V2995-A3015 HydrophobicContact CG1-CB 4.11Å; M2998-A3015 HydrophobicContact CG-CB 3.97Å; A3015-V3022 WeakPolarHBondContact O-CA 3.44Å; A3015-V3023 HydrophobicContact CB-CG2 4.01Å; A3015-V3023 PolarHBondContact N-O 3.24Å; A3015-V3023 PolarHBondContact O-N 2.88Å; A3015-I3025 HydrophobicContact CB-CD1 4.47Å
3016	L	87.1	Confident	81.7	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.2	170.5	168.6	59.2	0	0	0	109.1	V2996 E2997 V3022 C3050 I3053	V2996-L3016 HydrophobicContact CB-CG 4.46Å; V2996-L3016 PolarHBondContact N-O 3.45Å; E2997-L3016 PolarHBondContact O-N 2.83Å; L3016-V3022 HydrophobicContact CD1-CG2 4.15Å; L3016-C3050 HydrophobicContact CD1-CB 3.56Å; L3016-C3050 HydrophobicContact CD2-CB 4.21Å; L3016-I3053 HydrophobicContact CB-CB 4.3Å; L3016-I3053 HydrophobicContact CB-CG2 3.79Å
3017	L	85.6	Confident	81.8	Confident	2 Å²	2	26.6 Å²	26.6	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	154.9	-179	-59.2	-173.7	0	0	0	112	T2991 H2993 I2994 V2995 N3019 G3020 E3021 V3023	T2991-L3017 HydrophobicContact CG2-CD2 3.98Å; H2993-L3017 HydrophobicContact CB-CB 4.12Å; H2993-L3017 HydrophobicContact CB-CD1 4.45Å; I2994-L3017 CarbonylContact O-C 3.52Å; I2994-L3017 WeakPolarHBondContact O-CA 3.15Å; V2995-L3017 HydrophobicContact CG2-CD2 3.77Å; L3017-N3019 VanDerWaalsContact CB-OD1 3.22Å; L3017-N3019 WeakPolarHBondContact CB-OD1 3.49Å; L3017-N3019 PolarHBondContact O-N 3.36Å; L3017-G3020 PolarHBondContact O-N 3.44Å; L3017-E3021 WeakPolarHBondContact CB-O 3.4Å; L3017-E3021 HydrophobicContact CD1-CB 4.44Å; L3017-E3021 PolarHBondContact N-O 3.02Å; L3017-V3023 HydrophobicContact CD1-CG1 3.92Å; L3017-V3023 HydrophobicContact CD1-CG2 4.21Å; L3017-V3023 HydrophobicContact CD2-CG2 4.27Å; L3017-V3023 HydrophobicContact CG-CG2 4.2Å
3018	S	80.5	Confident	81.5	Confident	60 Å²	60	28.4 Å²	28.4	42%	0.42	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-2.9	-176.3	68.4	0	0	0	0	115.1	I2994	I2994-S3018 PolarHBondContact N-OG 2.95Å; I2994-S3018 WeakPolarHBondContact O-CB 3.31Å; I2994-S3018 PolarHBondContact O-N 2.99Å; I2994-S3018 PolarHBondContact O-OG 2.92Å
3019	N	78.2	Confident	80.8	Confident	58 Å²	58	33.9 Å²	33.9	31%	0.31	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-3.8	168.5	64.9	-10.2	0	0	0	112.7	H2993 L3017 E3021	H2993-N3019 HydrophobicContact CB-CB 4.47Å; H2993-N3019 PolarHBondContact CD2-ND2 3.14Å; H2993-N3019 PolarHBondContact NE2-ND2 2.89Å; L3017-N3019 VanDerWaalsContact CB-OD1 3.22Å; L3017-N3019 WeakPolarHBondContact CB-OD1 3.49Å; L3017-N3019 PolarHBondContact O-N 3.36Å; N3019-E3021 VanDerWaalsContact ND2-CD 3.25Å; N3019-E3021 WeakPolarHBondContact ND2-CG 3.49Å; N3019-E3021 PolarHBondContact ND2-OE2 3.49Å; N3019-E3021 WeakPolarHBondContact OD1-CB 3.36Å; N3019-E3021 PolarHBondContact OD1-N 3.31Å
3020	G	74.3	Confident	79.7	Confident	20 Å²	20	34.6 Å²	34.6	21%	0.206	18%	0.181	C	C	.	.	S	Bend	trans	93.3	-7.1	-174.9	0	0	0	0	0	114.8	L3017 C3050	L3017-G3020 PolarHBondContact O-N 3.44Å; G3020-C3050 PolarHBondContact O-SG 3.48Å
3021	E	81	Confident	78.6	Confident	78 Å²	78	37.2 Å²	37.2	36%	0.364	20%	0.197	S	C	.	.			trans	-72.5	151.3	177.7	-67.8	-175.7	137.6	0	0	112.3	L3017 N3019 H3036	L3017-E3021 WeakPolarHBondContact CB-O 3.4Å; L3017-E3021 HydrophobicContact CD1-CB 4.44Å; L3017-E3021 PolarHBondContact N-O 3.02Å; N3019-E3021 VanDerWaalsContact ND2-CD 3.25Å; N3019-E3021 WeakPolarHBondContact ND2-CG 3.49Å; N3019-E3021 PolarHBondContact ND2-OE2 3.49Å; N3019-E3021 WeakPolarHBondContact OD1-CB 3.36Å; N3019-E3021 PolarHBondContact OD1-N 3.31Å; E3021-H3036 IonicContact OE1-ND1 3.87Å; E3021-H3036 IonicContact OE2-CE1 3.64Å; E3021-H3036 IonicContact OE2-ND1 2.73Å; E3021-H3036 PolarHBondContact OE2-ND1 3.44Å
3022	V	84.5	Confident	77.3	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.03	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	123.9	176.7	177	0	0	0	0	109	V3014 A3015 L3016 L3037 I3053 V3062 F3080	V3014-V3022 HydrophobicContact CG1-CG1 3.49Å; V3014-V3022 VanDerWaalsContact CG1-CG1 3.49Å; A3015-V3022 WeakPolarHBondContact O-CA 3.44Å; L3016-V3022 HydrophobicContact CD1-CG2 4.15Å; V3022-L3037 HydrophobicContact CB-CB 4.48Å; V3022-L3037 HydrophobicContact CG1-CD1 4.06Å; V3022-L3037 PolarHBondContact O-N 2.93Å; V3022-I3053 HydrophobicContact CB-CD1 4.47Å; V3022-I3053 HydrophobicContact CG1-CD1 3.43Å; V3022-I3053 VanDerWaalsContact CG1-CD1 3.43Å; V3022-I3053 HydrophobicContact CG2-CD1 4.21Å; V3022-V3062 HydrophobicContact CG2-CG2 4.06Å; V3022-F3080 HydrophobicContact CB-CE2 4.14Å; V3022-F3080 HydrophobicContact CB-CZ 4.48Å; V3022-F3080 HydrophobicContact CG1-CE2 4.36Å; V3022-F3080 HydrophobicContact CG1-CZ 4.28Å; V3022-F3080 HydrophobicContact CG2-CE2 4.37Å
3023	V	86.5	Confident	76.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	137.2	-177.7	-62.5	0	0	0	0	111.6	V3014 A3015 L3017 I3025 L3034 V3035 H3036	V3014-V3023 WeakPolarHBondContact CA-O 3.4Å; A3015-V3023 HydrophobicContact CB-CG2 4.01Å; A3015-V3023 PolarHBondContact N-O 3.24Å; A3015-V3023 PolarHBondContact O-N 2.88Å; L3017-V3023 HydrophobicContact CD1-CG1 3.92Å; L3017-V3023 HydrophobicContact CD1-CG2 4.21Å; L3017-V3023 HydrophobicContact CD2-CG2 4.27Å; L3017-V3023 HydrophobicContact CG-CG2 4.2Å; V3023-I3025 HydrophobicContact CG2-CD1 4.44Å; V3023-I3025 HydrophobicContact CG2-CG1 4.36Å; V3023-L3034 HydrophobicContact CB-CB 4.32Å; V3023-L3034 HydrophobicContact CG1-CB 4.35Å; V3023-V3035 CarbonylContact C-O 3.32Å; V3023-V3035 WeakPolarHBondContact CA-O 3.31Å; V3023-H3036 HydrophobicContact CG1-CB 4.48Å
3024	I	86.2	Confident	75.4	Confident	24 Å²	24	53.9 Å²	53.9	12%	0.123	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	131.3	169.5	-53.2	170.8	0	0	0	109.2	L3001 V3014 P3026 V3035 L3037 I3060	L3001-I3024 HydrophobicContact CD1-CD1 4.47Å; L3001-I3024 HydrophobicContact CD1-CG2 3.83Å; L3001-I3024 HydrophobicContact CD2-CG2 4.12Å; V3014-I3024 HydrophobicContact CG1-CG1 4.1Å; V3014-I3024 HydrophobicContact CG2-CG1 4.26Å; I3024-P3026 WeakPolarHBondContact O-CD 3.39Å; I3024-V3035 HydrophobicContact CB-CB 4.19Å; I3024-V3035 PolarHBondContact N-O 2.82Å; I3024-V3035 PolarHBondContact O-N 2.92Å; I3024-L3037 HydrophobicContact CD1-CD1 4.15Å; I3024-L3037 HydrophobicContact CD1-CD2 4.03Å; I3024-L3037 HydrophobicContact CD1-CG 4.29Å; I3024-L3037 HydrophobicContact CG1-CD1 4.24Å; I3024-L3037 HydrophobicContact CG1-CG 4.36Å; I3024-I3060 HydrophobicContact CD1-CD1 4.01Å; I3024-I3060 HydrophobicContact CG1-CD1 4.34Å
3025	I	82.3	Confident	74.9	Confident	7 Å²	7	54.9 Å²	54.9	4%	0.036	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	89.2	179	-48.4	-174.3	0	0	0	107.9	I2932 F2989 G3012 V3013 A3015 V3023 L3034	I2932-I3025 HydrophobicContact CD1-CD1 3.44Å; I2932-I3025 VanDerWaalsContact CD1-CD1 3.44Å; F2989-I3025 HydrophobicContact CB-CG2 4.43Å; F2989-I3025 HydrophobicContact CD1-CG2 4.04Å; F2989-I3025 HydrophobicContact CD2-CG2 4.23Å; F2989-I3025 HydrophobicContact CE1-CG2 4.4Å; F2989-I3025 HydrophobicContact CG-CG2 3.95Å; G3012-I3025 VanDerWaalsContact CA-O 3.25Å; G3012-I3025 WeakPolarHBondContact CA-O 3.38Å; V3013-I3025 HydrophobicContact CG2-CB 4.06Å; V3013-I3025 HydrophobicContact CG2-CD1 4.47Å; V3013-I3025 PolarHBondContact N-O 2.84Å; V3013-I3025 PolarHBondContact O-N 3.42Å; A3015-I3025 HydrophobicContact CB-CD1 4.47Å; V3023-I3025 HydrophobicContact CG2-CD1 4.44Å; V3023-I3025 HydrophobicContact CG2-CG1 4.36Å; I3025-L3034 HydrophobicContact CD1-CD2 3.92Å; I3025-L3034 HydrophobicContact CG1-CD2 3.76Å
3026	P	79.8	Confident	74.5	Confident	26 Å²	26	57.8 Å²	57.8	17%	0.169	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	145.8	176.3	31.4	-34.3	0	0	0	110.5	I3024 R3029	I3024-P3026 WeakPolarHBondContact O-CD 3.39Å; P3026-R3029 HydrophobicContact CG-CB 4.3Å; P3026-R3029 HydrophobicContact CG-CG 3.83Å
3027	F	76.9	Confident	74.1	Confident	17 Å²	17	58.1 Å²	58.1	8%	0.075	30%	0.302	C	S	.	.	S	Bend	trans	-69.7	-38.2	179.9	178	-105.9	0	0	0	113	F2923 T2934 H2936 M3008 C3011	F2923-F3027 HydrophobicContact CD1-CD2 4.18Å; F2923-F3027 HydrophobicContact CD1-CE2 4.31Å; F2923-F3027 HydrophobicContact CD1-CG 4.45Å; F2923-F3027 AromaticContact CE1-CD1 3.8Å; F2923-F3027 HydrophobicContact CE1-CD1 3.8Å; F2923-F3027 AromaticContact CE1-CD2 3.88Å; F2923-F3027 HydrophobicContact CE1-CD2 3.88Å; F2923-F3027 AromaticContact CE1-CE1 3.86Å; F2923-F3027 HydrophobicContact CE1-CE1 3.86Å; F2923-F3027 AromaticContact CE1-CE2 3.91Å; F2923-F3027 HydrophobicContact CE1-CE2 3.91Å; F2923-F3027 AromaticContact CE1-CG 3.83Å; F2923-F3027 HydrophobicContact CE1-CG 3.83Å; F2923-F3027 AromaticContact CE1-CZ 3.92Å; F2923-F3027 HydrophobicContact CE1-CZ 3.92Å; F2923-F3027 HydrophobicContact CZ-CD1 4.31Å; F2923-F3027 HydrophobicContact CZ-CE1 4.45Å; T2934-F3027 HydrophobicContact CG2-CD2 4.13Å; T2934-F3027 HydrophobicContact CG2-CE2 4.27Å; H2936-F3027 HydrophobicContact CB-CE2 4.09Å; H2936-F3027 HydrophobicContact CB-CZ 4.2Å; H2936-F3027 AromaticContact CE1-CZ 3.91Å; H2936-F3027 AromaticContact CG-CZ 3.81Å; H2936-F3027 AromaticContact ND1-CZ 3.44Å; H2936-F3027 WeakPolarHBondContact ND1-CZ 3.45Å; M3008-F3027 HydrophobicContact CE-CD1 3.65Å; M3008-F3027 HydrophobicContact CE-CE1 3.49Å; M3008-F3027 VanDerWaalsContact CE-CE1 3.49Å; C3011-F3027 HydrophobicContact CB-CB 4.01Å; C3011-F3027 WeakPolarHBondContact O-CB 3.26Å; C3011-F3027 PolarHBondContact O-N 3.02Å
3028	Q	67.6	Low	73.4	Confident	105 Å²	105	66.7 Å²	66.7	49%	0.491	33%	0.334	S	S	.	.	S	Bend	trans	-104.7	89.4	176	-75.7	-173.7	-13.3	0	0	112.2	M3008	M3008-Q3028 HydrophobicContact CB-CG 4.46Å
3029	R	61.3	Low	72.7	Confident	144 Å²	144	66.2 Å²	66.2	54%	0.543	33%	0.329	S	S	.	.			trans	-135.4	144.5	157.4	-92.8	-167.9	172.8	-172.5	-2.9	111	P3026 D3031 V3035	P3026-R3029 HydrophobicContact CG-CB 4.3Å; P3026-R3029 HydrophobicContact CG-CG 3.83Å; R3029-D3031 VanDerWaalsContact C-N 3.35Å; R3029-V3035 VanDerWaalsContact NH1-CG2 3.3Å
3030	T	53.1	Low	72	Confident	129 Å²	129	69.3 Å²	69.3	79%	0.791	34%	0.336	S	S	*	.	S	Bend	trans	-81.4	-18.3	173.7	46.7	0	0	0	0	113.3
3031	D	53.8	Low	70.9	Confident	105 Å²	105	76 Å²	76	56%	0.561	37%	0.368	S	S	*	.	S	Bend	trans	-112.8	124.3	-167	-49.4	-11.2	0	0	0	107.4	R3029 E3033	R3029-D3031 VanDerWaalsContact C-N 3.35Å; D3031-E3033 PolarHBondContact O-N 3.41Å
3032	N	54.9	Low	69.2	Low	160 Å²	160	79.7 Å²	79.7	86%	0.856	39%	0.39	S	S	*	.			trans	-70.6	19	-172.8	-71.3	-15.2	0	0	0	114.5
3033	E	61.2	Low	67.5	Low	156 Å²	156	81.5 Å²	81.5	73%	0.729	40%	0.402	S	S	*	.			trans	-92.1	117.6	-177.1	-65.7	-170	168.6	0	0	111.7	D3031	D3031-E3033 PolarHBondContact O-N 3.41Å
3034	L	71.8	Confident	65.6	Low	33 Å²	33	89.7 Å²	89.7	17%	0.173	45%	0.446	C	S	.	.			trans	-62.9	142.8	171.8	-59.8	170.1	0	0	0	110.2	T2991 V3023 I3025 H3036	T2991-L3034 HydrophobicContact CG2-CD1 4.14Å; V3023-L3034 HydrophobicContact CB-CB 4.32Å; V3023-L3034 HydrophobicContact CG1-CB 4.35Å; I3025-L3034 HydrophobicContact CD1-CD2 3.92Å; I3025-L3034 HydrophobicContact CG1-CD2 3.76Å; L3034-H3036 PolarHBondContact O-CD2 3.45Å; L3034-H3036 PolarHBondContact O-N 3.35Å
3035	V	78	Confident	63.8	Low	21 Å²	21	91.1 Å²	91.1	13%	0.127	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	97.8	173.7	179	0	0	0	0	109.1	V3023 I3024 R3029 L3037	V3023-V3035 CarbonylContact C-O 3.32Å; V3023-V3035 WeakPolarHBondContact CA-O 3.31Å; I3024-V3035 HydrophobicContact CB-CB 4.19Å; I3024-V3035 PolarHBondContact N-O 2.82Å; I3024-V3035 PolarHBondContact O-N 2.92Å; R3029-V3035 VanDerWaalsContact NH1-CG2 3.3Å; V3035-L3037 PolarHBondContact O-N 3.2Å
3036	H	79.4	Confident	61.8	Low	61 Å²	61	94.1 Å²	94.1	28%	0.282	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	119.3	176.3	-62.5	-116.1	0	0	0	110.6	E3021 V3023 L3034	E3021-H3036 IonicContact OE1-ND1 3.87Å; E3021-H3036 IonicContact OE2-CE1 3.64Å; E3021-H3036 IonicContact OE2-ND1 2.73Å; E3021-H3036 PolarHBondContact OE2-ND1 3.44Å; V3023-H3036 HydrophobicContact CG1-CB 4.48Å; L3034-H3036 PolarHBondContact O-CD2 3.45Å; L3034-H3036 PolarHBondContact O-N 3.35Å
3037	L	78.9	Confident	60.1	Low	10 Å²	10	97.9 Å²	97.9	5%	0.052	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	142.8	168.7	-58.1	-178.5	0	0	0	109.8	V3022 I3024 V3035 I3060 H3078 F3080	V3022-L3037 HydrophobicContact CB-CB 4.48Å; V3022-L3037 HydrophobicContact CG1-CD1 4.06Å; V3022-L3037 PolarHBondContact O-N 2.93Å; I3024-L3037 HydrophobicContact CD1-CD1 4.15Å; I3024-L3037 HydrophobicContact CD1-CD2 4.03Å; I3024-L3037 HydrophobicContact CD1-CG 4.29Å; I3024-L3037 HydrophobicContact CG1-CD1 4.24Å; I3024-L3037 HydrophobicContact CG1-CG 4.36Å; V3035-L3037 PolarHBondContact O-N 3.2Å; L3037-I3060 HydrophobicContact CD1-CD1 3.6Å; L3037-H3078 HydrophobicContact CD2-CB 3.89Å; L3037-F3080 HydrophobicContact CB-CD2 4.13Å; L3037-F3080 HydrophobicContact CB-CE2 3.58Å; L3037-F3080 HydrophobicContact CB-CZ 4.43Å; L3037-F3080 HydrophobicContact CD1-CE2 3.78Å; L3037-F3080 HydrophobicContact CD1-CZ 3.78Å; L3037-F3080 HydrophobicContact CG-CE2 4.36Å
3038	R	70.4	Confident	58.9	Low	181 Å²	181	101.5 Å²	101.5	68%	0.683	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.4	150.1	-176.3	-62.1	-174.6	-178.9	-171.9	-0.3	112	H3078 V3079 F3080	R3038-H3078 PolarHBondContact N-O 3.39Å; R3038-V3079 CarbonylContact O-C 3.59Å; R3038-V3079 WeakPolarHBondContact O-CA 3.46Å; R3038-F3080 PolarHBondContact O-N 2.66Å
3039	V	66.4	Low	58.6	Low	50 Å²	50	106.2 Å²	106.2	30%	0.303	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	145.6	164.4	-175.6	0	0	0	0	108.3	D3041 L3045 L3069	V3039-D3041 PolarHBondContact O-N 3.23Å; V3039-L3045 HydrophobicContact CG1-CD1 4.37Å; V3039-L3069 HydrophobicContact CG1-CD1 4.31Å; V3039-L3069 HydrophobicContact CG2-CD1 3.96Å
3040	R	63.6	Low	59	Low	123 Å²	123	100.2 Å²	100.2	46%	0.464	51%	0.512	S	S	.	.			trans	-71.2	123.8	-176	-168.6	171.5	-73.2	178.5	-1.6	111.4	N3042 C3043 V3079	R3040-N3042 PolarHBondContact O-N 2.79Å; R3040-C3043 PolarHBondContact O-N 3.31Å; R3040-V3079 HydrophobicContact CB-CG1 3.58Å; R3040-V3079 HydrophobicContact CG-CG1 4.05Å
3041	D	50.5	Low	59.9	Low	162 Å²	162	95.7 Å²	95.7	87%	0.866	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-10.7	-173.4	-57.5	-51	0	0	0	116.9	V3039	V3039-D3041 PolarHBondContact O-N 3.23Å
3042	N	46.3	Very low	61.1	Low	155 Å²	155	90.8 Å²	90.8	83%	0.829	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	9.9	179.9	-75.3	-22.3	0	0	0	113.8	R3040	R3040-N3042 PolarHBondContact O-N 2.79Å
3043	C	49.6	Very low	62.5	Low	43 Å²	43	83.4 Å²	83.4	29%	0.291	42%	0.42	S	S	.	.	S	Bend	trans	-87.2	133	171.1	-63.9	0	0	0	0	110.1	R3040 L3045	R3040-C3043 PolarHBondContact O-N 3.31Å; C3043-L3045 HydrophobicContact CB-CB 4.43Å; C3043-L3045 HydrophobicContact CB-CD1 4.03Å; C3043-L3045 HydrophobicContact CB-CG 4.16Å; C3043-L3045 PolarHBondContact O-N 2.7Å
3044	N	45	Very low	63.5	Low	172 Å²	172	76.6 Å²	76.6	92%	0.92	39%	0.39	S	S	*	.			trans	-74	33.4	175.3	-75.4	-13	0	0	0	113.2	S3046	N3044-S3046 PolarHBondContact O-N 3.34Å
3045	L	49.2	Very low	63.9	Low	54 Å²	54	75.1 Å²	75.1	28%	0.283	38%	0.382	S	S	.	.			trans	-88.1	102	-179.6	-70.8	170.6	0	0	0	109.2	V3039 C3043 S3047 L3069	V3039-L3045 HydrophobicContact CG1-CD1 4.37Å; C3043-L3045 HydrophobicContact CB-CB 4.43Å; C3043-L3045 HydrophobicContact CB-CD1 4.03Å; C3043-L3045 HydrophobicContact CB-CG 4.16Å; C3043-L3045 PolarHBondContact O-N 2.7Å; L3045-S3047 PolarHBondContact O-N 2.88Å; L3045-L3069 HydrophobicContact CD1-CD2 4.43Å
3046	S	39.7	Very low	63.7	Low	69 Å²	69	74.7 Å²	74.7	48%	0.483	38%	0.378	S	S	.	.			trans	-87	101	-171.5	52.3	0	0	0	0	113.3	N3044 H3048	N3044-S3046 PolarHBondContact O-N 3.34Å; S3046-H3048 PolarHBondContact O-CD2 3.25Å; S3046-H3048 PolarHBondContact O-CE1 3.33Å; S3046-H3048 PolarHBondContact O-N 2.73Å; S3046-H3048 PolarHBondContact O-ND1 2.99Å; S3046-H3048 PolarHBondContact O-NE2 3.1Å
3047	S	45.1	Very low	63.3	Low	106 Å²	106	76.4 Å²	76.4	74%	0.741	39%	0.386	S	S	*	.	S	Bend	trans	53.7	27.2	155.2	61.6	0	0	0	0	117.6	L3045	L3045-S3047 PolarHBondContact O-N 2.88Å
3048	H	50.7	Low	63	Low	92 Å²	92	80.8 Å²	80.8	43%	0.426	41%	0.41	S	S	.	.			trans	-119.2	161.7	-172.7	-67	-19.3	0	0	0	112.1	S3046 H3064 D3065	S3046-H3048 PolarHBondContact O-CD2 3.25Å; S3046-H3048 PolarHBondContact O-CE1 3.33Å; S3046-H3048 PolarHBondContact O-N 2.73Å; S3046-H3048 PolarHBondContact O-ND1 2.99Å; S3046-H3048 PolarHBondContact O-NE2 3.1Å; H3048-H3064 PolarHBondContact O-NE2 3.3Å; H3048-D3065 HydrophobicContact CB-CB 4.05Å; H3048-D3065 IonicContact CD2-OD2 2.79Å; H3048-D3065 PolarHBondContact CD2-OD2 3.07Å; H3048-D3065 IonicContact CG-OD2 3.81Å
3049	W	62	Low	63.5	Low	205 Å²	205	72.2 Å²	72.2	78%	0.777	38%	0.377	S	S	*	.			trans	-87.3	136.5	-155.7	-54	-22.4	0	0	0	112.6	S3051	W3049-S3051 PolarHBondContact O-N 2.93Å
3050	C	69.4	Low	64.3	Low	17 Å²	17	69.9 Å²	69.9	12%	0.115	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	128.2	162.9	-62.4	0	0	0	0	109	L3016 G3020 V3062 A3063	L3016-C3050 HydrophobicContact CD1-CB 3.56Å; L3016-C3050 HydrophobicContact CD2-CB 4.21Å; G3020-C3050 PolarHBondContact O-SG 3.48Å; C3050-V3062 HydrophobicContact CB-CG1 3.83Å; C3050-A3063 CarbonylContact C-O 3.57Å; C3050-A3063 VanDerWaalsContact CA-O 3.24Å; C3050-A3063 WeakPolarHBondContact CA-O 3.15Å
3051	S	72	Confident	65.2	Low	35 Å²	35	64 Å²	64	25%	0.245	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-28.7	-171.9	57.6	0	0	0	0	114.2	W3049 A3063 I3095	W3049-S3051 PolarHBondContact O-N 2.93Å; S3051-A3063 PolarHBondContact N-O 2.93Å; S3051-A3063 WeakPolarHBondContact OG-CB 3.21Å; S3051-I3095 VanDerWaalsContact CB-O 3.27Å; S3051-I3095 WeakPolarHBondContact CB-O 3.24Å; S3051-I3095 PolarHBondContact OG-O 3.4Å
3052	S	78.4	Confident	66.6	Low	2 Å²	2	56.3 Å²	56.3	1%	0.014	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	154.9	178	-179.6	0	0	0	0	111.9	E2997 V3062 A3063 R3097	E2997-S3052 WeakPolarHBondContact OE2-CA 3.47Å; E2997-S3052 WeakPolarHBondContact OE2-CB 3.3Å; E2997-S3052 PolarHBondContact OE2-OG 3.46Å; S3052-V3062 WeakPolarHBondContact O-CA 3.4Å; S3052-A3063 PolarHBondContact O-N 2.88Å; S3052-R3097 WeakPolarHBondContact OG-CG 3.5Å
3053	I	85.7	Confident	68.1	Low	4 Å²	4	49 Å²	49	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	139.1	177.9	-172.8	166	0	0	0	111.5	E2997 V3014 L3016 V3022 I3060 V3062	E2997-I3053 HydrophobicContact CB-CG2 4.02Å; E2997-I3053 HydrophobicContact CG-CG2 4.02Å; E2997-I3053 PolarHBondContact OE2-N 3.43Å; V3014-I3053 HydrophobicContact CB-CD1 4.09Å; V3014-I3053 HydrophobicContact CG1-CD1 3.53Å; L3016-I3053 HydrophobicContact CB-CB 4.3Å; L3016-I3053 HydrophobicContact CB-CG2 3.79Å; V3022-I3053 HydrophobicContact CB-CD1 4.47Å; V3022-I3053 HydrophobicContact CG1-CD1 3.43Å; V3022-I3053 VanDerWaalsContact CG1-CD1 3.43Å; V3022-I3053 HydrophobicContact CG2-CD1 4.21Å; I3053-I3060 HydrophobicContact CD1-CG2 4.08Å; I3053-I3060 HydrophobicContact CG1-CG2 4.14Å; I3053-V3062 HydrophobicContact CD1-CG2 4.15Å; I3053-V3062 HydrophobicContact CG1-CG2 4.04Å
3054	C	82.3	Confident	69.2	Low	13 Å²	13	47.6 Å²	47.6	9%	0.088	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	162.9	171.1	63.1	0	0	0	0	111.6	L3061 I3098	C3054-L3061 PolarHBondContact N-O 3.46Å; C3054-L3061 PolarHBondContact O-N 2.92Å; C3054-L3061 VanDerWaalsContact O-O 3.11Å; C3054-I3098 PolarHBondContact SG-O 3.49Å
3055	T	79.3	Confident	70.3	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	142	175.1	43.6	0	0	0	0	110.8	S2999 T3000 H3003 V3014 I3060 F3073	S2999-T3055 PolarHBondContact OG-N 2.8Å; S2999-T3055 PolarHBondContact OG-OG1 2.9Å; T3000-T3055 WeakPolarHBondContact O-CB 3.39Å; T3000-T3055 WeakPolarHBondContact O-CG2 3.34Å; T3000-T3055 PolarHBondContact O-OG1 3.1Å; H3003-T3055 PolarHBondContact NE2-O 3.04Å; H3003-T3055 PolarHBondContact NE2-OG1 2.94Å; V3014-T3055 HydrophobicContact CG2-CG2 4.01Å; T3055-I3060 HydrophobicContact CG2-CG1 4.08Å; T3055-I3060 HydrophobicContact CG2-CG2 4.46Å; T3055-F3073 HydrophobicContact CG2-CZ 4.36Å
3056	Y	75	Confident	71.1	Confident	12 Å²	12	40.9 Å²	40.9	5%	0.047	22%	0.217	C	C	.	.			trans	-116	-179.9	174.6	175.3	-112.4	0	0	0	109.1	D3058 G3059 F3073 P3100 L3111	Y3056-D3058 HydrophobicContact CD1-CB 4.09Å; Y3056-D3058 HydrophobicContact CE1-CB 4.04Å; Y3056-D3058 VanDerWaalsContact CE1-OD2 3.32Å; Y3056-D3058 WeakPolarHBondContact CE1-OD2 3.24Å; Y3056-D3058 PolarHBondContact O-N 2.8Å; Y3056-G3059 PolarHBondContact N-O 2.96Å; Y3056-F3073 VanDerWaalsContact O-CE2 3.3Å; Y3056-F3073 WeakPolarHBondContact O-CE2 3.36Å; Y3056-P3100 HydrophobicContact CD2-CB 3.96Å; Y3056-P3100 HydrophobicContact CD2-CG 4.39Å; Y3056-P3100 HydrophobicContact CG-CB 4.47Å; Y3056-L3111 HydrophobicContact CD1-CD1 3.84Å; Y3056-L3111 HydrophobicContact CD2-CD1 3.91Å; Y3056-L3111 HydrophobicContact CE1-CD1 3.73Å; Y3056-L3111 HydrophobicContact CE2-CD1 3.8Å; Y3056-L3111 HydrophobicContact CG-CD1 3.94Å
3057	Q	70.4	Confident	72.5	Confident	98 Å²	98	38.1 Å²	38.1	46%	0.458	20%	0.198	S	C	.	.	S	Bend	trans	-63.8	-39.1	179.7	-69.4	-175.4	-48.6	0	0	112.7	F3073	Q3057-F3073 WeakPolarHBondContact O-CD2 3.32Å; Q3057-F3073 WeakPolarHBondContact O-CE2 3.31Å
3058	D	73.1	Confident	74	Confident	102 Å²	102	33.1 Å²	33.1	55%	0.545	16%	0.163	S	C	.	.	S	Bend	trans	-96.3	-8	-173.4	-57.1	-35.5	0	0	0	114.2	Y3056 F3070 P3072 F3073	Y3056-D3058 HydrophobicContact CD1-CB 4.09Å; Y3056-D3058 HydrophobicContact CE1-CB 4.04Å; Y3056-D3058 VanDerWaalsContact CE1-OD2 3.32Å; Y3056-D3058 WeakPolarHBondContact CE1-OD2 3.24Å; Y3056-D3058 PolarHBondContact O-N 2.8Å; D3058-F3070 HydrophobicContact CB-CZ 4.43Å; D3058-P3072 WeakPolarHBondContact O-CA 3.36Å; D3058-F3073 VanDerWaalsContact C-CD2 3.49Å; D3058-F3073 PolarHBondContact O-N 2.81Å
3059	G	80.9	Confident	75.3	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.2	-168.7	-178.4	0	0	0	0	0	116.4	Y3056 H3071 F3073	Y3056-G3059 PolarHBondContact N-O 2.96Å; G3059-H3071 CarbonylContact C-O 3.58Å; G3059-H3071 WeakPolarHBondContact CA-O 3.46Å; G3059-F3073 VanDerWaalsContact N-CE2 3.3Å
3060	I	83	Confident	76.2	Confident	1 Å²	1	21 Å²	21	1%	0.005	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	135.3	-176.6	-52.4	165	0	0	0	109.3	V3014 I3024 L3037 I3053 T3055 V3062 F3070 H3071 F3073 F3080	V3014-I3060 HydrophobicContact CG1-CD1 4.18Å; V3014-I3060 HydrophobicContact CG1-CG2 4.37Å; V3014-I3060 HydrophobicContact CG2-CD1 3.97Å; V3014-I3060 HydrophobicContact CG2-CG1 4.27Å; I3024-I3060 HydrophobicContact CD1-CD1 4.01Å; I3024-I3060 HydrophobicContact CG1-CD1 4.34Å; L3037-I3060 HydrophobicContact CD1-CD1 3.6Å; I3053-I3060 HydrophobicContact CD1-CG2 4.08Å; I3053-I3060 HydrophobicContact CG1-CG2 4.14Å; T3055-I3060 HydrophobicContact CG2-CG1 4.08Å; T3055-I3060 HydrophobicContact CG2-CG2 4.46Å; I3060-V3062 HydrophobicContact CG2-CG2 4.42Å; I3060-F3070 WeakPolarHBondContact O-CA 3.33Å; I3060-F3070 VanDerWaalsContact O-CD2 3.31Å; I3060-F3070 WeakPolarHBondContact O-CD2 3.22Å; I3060-H3071 HydrophobicContact CB-CB 4.43Å; I3060-H3071 PolarHBondContact N-O 2.9Å; I3060-H3071 PolarHBondContact O-N 2.99Å; I3060-F3073 HydrophobicContact CD1-CE1 4.25Å; I3060-F3073 HydrophobicContact CG1-CD1 4.35Å; I3060-F3073 HydrophobicContact CG1-CE1 3.66Å; I3060-F3073 HydrophobicContact CG1-CZ 4.34Å; I3060-F3080 HydrophobicContact CB-CE1 4.5Å; I3060-F3080 HydrophobicContact CG2-CE1 4.32Å; I3060-F3080 HydrophobicContact CG2-CZ 4.19Å
3061	L	81.4	Confident	76.8	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	142.1	170.6	-88.4	99.2	0	0	0	111.8	C3054 L3069 F3070 L3083 I3098 Y3113	C3054-L3061 PolarHBondContact N-O 3.46Å; C3054-L3061 PolarHBondContact O-N 2.92Å; C3054-L3061 VanDerWaalsContact O-O 3.11Å; L3061-L3069 WeakPolarHBondContact CA-O 3.42Å; L3061-F3070 HydrophobicContact CD1-CD2 3.63Å; L3061-F3070 HydrophobicContact CD1-CE2 4.01Å; L3061-F3070 HydrophobicContact CG-CD2 3.97Å; L3061-L3083 HydrophobicContact CD2-CD1 3.76Å; L3061-I3098 HydrophobicContact CD2-CD1 3.81Å; L3061-Y3113 HydrophobicContact CD1-CE1 3.88Å; L3061-Y3113 HydrophobicContact CD2-CD1 4.01Å; L3061-Y3113 HydrophobicContact CD2-CE1 3.34Å; L3061-Y3113 HydrophobicContact CD2-CE2 4.17Å; L3061-Y3113 VanDerWaalsContact CD2-CZ 3.44Å; L3061-Y3113 HydrophobicContact CG-CE1 4.26Å
3062	V	79.9	Confident	77.2	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.006	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	135.4	177.2	178.7	0	0	0	0	109.6	V3022 C3050 S3052 I3053 I3060 L3069 F3080	V3022-V3062 HydrophobicContact CG2-CG2 4.06Å; C3050-V3062 HydrophobicContact CB-CG1 3.83Å; S3052-V3062 WeakPolarHBondContact O-CA 3.4Å; I3053-V3062 HydrophobicContact CD1-CG2 4.15Å; I3053-V3062 HydrophobicContact CG1-CG2 4.04Å; I3060-V3062 HydrophobicContact CG2-CG2 4.42Å; V3062-L3069 PolarHBondContact N-O 3.37Å; V3062-L3069 PolarHBondContact O-N 2.95Å; V3062-F3080 HydrophobicContact CB-CE1 4.24Å; V3062-F3080 HydrophobicContact CB-CZ 4.41Å; V3062-F3080 HydrophobicContact CG2-CE1 3.59Å; V3062-F3080 HydrophobicContact CG2-CE2 4.26Å; V3062-F3080 HydrophobicContact CG2-CZ 3.43Å; V3062-F3080 VanDerWaalsContact CG2-CZ 3.43Å
3063	A	78.1	Confident	77.2	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	129.4	168.1	0	0	0	0	0	110	C3050 S3051 S3052 I3095 I3098	C3050-A3063 CarbonylContact C-O 3.57Å; C3050-A3063 VanDerWaalsContact CA-O 3.24Å; C3050-A3063 WeakPolarHBondContact CA-O 3.15Å; S3051-A3063 PolarHBondContact N-O 2.93Å; S3051-A3063 WeakPolarHBondContact OG-CB 3.21Å; S3052-A3063 PolarHBondContact O-N 2.88Å; A3063-I3095 HydrophobicContact CB-CB 4.16Å; A3063-I3095 HydrophobicContact CB-CG2 3.54Å; A3063-I3098 HydrophobicContact CB-CG2 4.03Å
3064	H	72.5	Confident	76.6	Confident	14 Å²	14	30.7 Å²	30.7	7%	0.065	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	112.2	-174.7	177.9	-50.1	0	0	0	110.4	H3048 G3066 S3067 L3069	H3048-H3064 PolarHBondContact O-NE2 3.3Å; H3064-G3066 PolarHBondContact O-N 3.33Å; H3064-S3067 PolarHBondContact N-O 2.98Å; H3064-S3067 WeakPolarHBondContact O-CA 3.48Å; H3064-S3067 WeakPolarHBondContact O-CB 3.37Å; H3064-S3067 PolarHBondContact O-N 2.82Å; H3064-S3067 PolarHBondContact O-OG 3.2Å; H3064-L3069 HydrophobicContact CB-CD1 4.04Å; H3064-L3069 HydrophobicContact CB-CG 4.32Å
3065	D	67.4	Low	76.2	Confident	72 Å²	72	32.1 Å²	32.1	39%	0.385	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.3	56.1	169.9	-160.1	26.1	0	0	0	114.1	H3048 S3067	H3048-D3065 HydrophobicContact CB-CB 4.05Å; H3048-D3065 IonicContact CD2-OD2 2.79Å; H3048-D3065 PolarHBondContact CD2-OD2 3.07Å; H3048-D3065 IonicContact CG-OD2 3.81Å; D3065-S3067 PolarHBondContact O-N 3.14Å; D3065-S3067 VanDerWaalsContact O-N 3.07Å
3066	G	65.8	Low	76	Confident	13 Å²	13	37.2 Å²	37.2	13%	0.134	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	-14.6	-177.3	0	0	0	0	0	116	H3064 I3093 I3095	H3064-G3066 PolarHBondContact O-N 3.33Å; G3066-I3093 WeakPolarHBondContact CA-O 3.42Å; G3066-I3095 VanDerWaalsContact O-CD1 3.31Å; G3066-I3095 WeakPolarHBondContact O-CD1 3.22Å
3067	S	70.2	Confident	75.7	Confident	12 Å²	12	40.4 Å²	40.4	8%	0.084	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	164.4	175	78	0	0	0	0	112.9	H3064 D3065 N3088	H3064-S3067 PolarHBondContact N-O 2.98Å; H3064-S3067 WeakPolarHBondContact O-CA 3.48Å; H3064-S3067 WeakPolarHBondContact O-CB 3.37Å; H3064-S3067 PolarHBondContact O-N 2.82Å; H3064-S3067 PolarHBondContact O-OG 3.2Å; D3065-S3067 PolarHBondContact O-N 3.14Å; D3065-S3067 VanDerWaalsContact O-N 3.07Å; S3067-N3088 WeakPolarHBondContact CA-OD1 3.3Å; S3067-N3088 WeakPolarHBondContact CB-OD1 3.45Å
3068	A	75.6	Confident	76	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.7	170	0	0	0	0	0	111.5	L3083 I3087 N3088 I3098	A3068-L3083 HydrophobicContact CB-CD1 3.67Å; A3068-L3083 WeakPolarHBondContact O-CB 3.29Å; A3068-L3083 PolarHBondContact O-N 2.63Å; A3068-I3087 HydrophobicContact CB-CD1 3.76Å; A3068-I3087 HydrophobicContact CB-CG1 4.42Å; A3068-I3087 HydrophobicContact CB-CG2 4.36Å; A3068-N3088 PolarHBondContact N-OD1 3.26Å; A3068-I3098 HydrophobicContact CB-CD1 4.08Å
3069	L	78.2	Confident	76.2	Confident	1 Å²	1	36 Å²	36	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	143.6	-176.8	-55.1	-178.1	0	0	0	110.7	V3039 L3045 L3061 V3062 H3064 F3080 T3081 P3082	V3039-L3069 HydrophobicContact CG1-CD1 4.31Å; V3039-L3069 HydrophobicContact CG2-CD1 3.96Å; L3045-L3069 HydrophobicContact CD1-CD2 4.43Å; L3061-L3069 WeakPolarHBondContact CA-O 3.42Å; V3062-L3069 PolarHBondContact N-O 3.37Å; V3062-L3069 PolarHBondContact O-N 2.95Å; H3064-L3069 HydrophobicContact CB-CD1 4.04Å; H3064-L3069 HydrophobicContact CB-CG 4.32Å; L3069-F3080 HydrophobicContact CB-CB 4.17Å; L3069-F3080 HydrophobicContact CB-CD1 3.85Å; L3069-F3080 HydrophobicContact CB-CG 4.25Å; L3069-F3080 HydrophobicContact CD1-CB 4.16Å; L3069-F3080 HydrophobicContact CD1-CG 4.46Å; L3069-T3081 CarbonylContact C-O 3.58Å; L3069-T3081 WeakPolarHBondContact CA-O 3.43Å; L3069-P3082 HydrophobicContact CD2-CB 3.98Å
3070	F	80.7	Confident	76.1	Confident	41 Å²	41	36.3 Å²	36.3	18%	0.18	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	143.7	177.1	-179.6	-112.8	0	0	0	112	D3058 I3060 L3061 P3072 T3081 L3083	D3058-F3070 HydrophobicContact CB-CZ 4.43Å; I3060-F3070 WeakPolarHBondContact O-CA 3.33Å; I3060-F3070 VanDerWaalsContact O-CD2 3.31Å; I3060-F3070 WeakPolarHBondContact O-CD2 3.22Å; L3061-F3070 HydrophobicContact CD1-CD2 3.63Å; L3061-F3070 HydrophobicContact CD1-CE2 4.01Å; L3061-F3070 HydrophobicContact CG-CD2 3.97Å; F3070-P3072 HydrophobicContact CD1-CG 4.31Å; F3070-P3072 HydrophobicContact CE1-CB 4.25Å; F3070-P3072 HydrophobicContact CE1-CG 3.82Å; F3070-T3081 PolarHBondContact N-O 2.92Å; F3070-T3081 PolarHBondContact O-N 2.59Å; F3070-T3081 PolarHBondContact O-OG1 3.31Å; F3070-L3083 HydrophobicContact CB-CD1 4.36Å; F3070-L3083 HydrophobicContact CB-CD2 3.99Å; F3070-L3083 HydrophobicContact CB-CG 4.02Å
3071	H	82.2	Confident	75.6	Confident	5 Å²	5	38.1 Å²	38.1	2%	0.023	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	112.2	174.5	-174.7	-58.6	0	0	0	109.8	G3059 I3060 D3075 H3078 V3079 F3080	G3059-H3071 CarbonylContact C-O 3.58Å; G3059-H3071 WeakPolarHBondContact CA-O 3.46Å; I3060-H3071 HydrophobicContact CB-CB 4.43Å; I3060-H3071 PolarHBondContact N-O 2.9Å; I3060-H3071 PolarHBondContact O-N 2.99Å; H3071-D3075 PolarHBondContact CE1-O 2.82Å; H3071-D3075 VanDerWaalsContact CE1-O 3.3Å; H3071-H3078 WeakPolarHBondContact NE2-CA 3.3Å; H3071-V3079 PolarHBondContact NE2-N 2.92Å; H3071-F3080 HydrophobicContact CB-CD1 3.68Å; H3071-F3080 HydrophobicContact CB-CE1 3.6Å; H3071-F3080 HydrophobicContact CB-CG 4.34Å; H3071-F3080 HydrophobicContact CB-CZ 4.22Å
3072	P	81.2	Confident	75.1	Confident	41 Å²	41	41.3 Å²	41.3	27%	0.266	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	147.6	176	-15.2	27	0	0	0	111.8	D3058 F3070 D3074 D3075	D3058-P3072 WeakPolarHBondContact O-CA 3.36Å; F3070-P3072 HydrophobicContact CD1-CG 4.31Å; F3070-P3072 HydrophobicContact CE1-CB 4.25Å; F3070-P3072 HydrophobicContact CE1-CG 3.82Å; P3072-D3074 VanDerWaalsContact C-N 3.28Å; P3072-D3074 PolarHBondContact O-N 3.25Å; P3072-D3075 HydrophobicContact CB-CB 4.2Å; P3072-D3075 HydrophobicContact CG-CB 4.16Å; P3072-D3075 PolarHBondContact O-N 2.87Å
3073	F	78.5	Confident	74.7	Confident	53 Å²	53	42.1 Å²	42.1	23%	0.232	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-29.9	175.5	-68.4	-54.9	0	0	0	113.5	L3001 H3002 T3055 Y3056 Q3057 D3058 G3059 I3060 D3075	L3001-F3073 HydrophobicContact CD1-CD1 4.49Å; L3001-F3073 HydrophobicContact CD1-CE1 3.96Å; L3001-F3073 WeakPolarHBondContact O-CZ 3.44Å; H3002-F3073 AromaticContact CE1-CD2 3.45Å; H3002-F3073 VanDerWaalsContact CE1-CD2 3.45Å; H3002-F3073 WeakPolarHBondContact CE1-CD2 3.5Å; H3002-F3073 AromaticContact CE1-CE2 3.58Å; H3002-F3073 AromaticContact CE1-CG 3.72Å; H3002-F3073 AromaticContact CE1-CZ 3.98Å; H3002-F3073 AromaticContact ND1-CD2 3.91Å; H3002-F3073 AromaticContact ND1-CE2 3.62Å; T3055-F3073 HydrophobicContact CG2-CZ 4.36Å; Y3056-F3073 VanDerWaalsContact O-CE2 3.3Å; Y3056-F3073 WeakPolarHBondContact O-CE2 3.36Å; Q3057-F3073 WeakPolarHBondContact O-CD2 3.32Å; Q3057-F3073 WeakPolarHBondContact O-CE2 3.31Å; D3058-F3073 VanDerWaalsContact C-CD2 3.49Å; D3058-F3073 PolarHBondContact O-N 2.81Å; G3059-F3073 VanDerWaalsContact N-CE2 3.3Å; I3060-F3073 HydrophobicContact CD1-CE1 4.25Å; I3060-F3073 HydrophobicContact CG1-CD1 4.35Å; I3060-F3073 HydrophobicContact CG1-CE1 3.66Å; I3060-F3073 HydrophobicContact CG1-CZ 4.34Å; F3073-D3075 VanDerWaalsContact C-N 3.27Å; F3073-D3075 PolarHBondContact O-N 3.09Å
3074	D	73.4	Confident	73.7	Confident	164 Å²	164	48 Å²	48	88%	0.877	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-5.3	178.1	-68.4	-24.6	0	0	0	113.7	P3072 S3076	P3072-D3074 VanDerWaalsContact C-N 3.28Å; P3072-D3074 PolarHBondContact O-N 3.25Å; D3074-S3076 PolarHBondContact O-N 2.89Å
3075	D	74.2	Confident	73.2	Confident	43 Å²	43	48.1 Å²	48.1	23%	0.23	29%	0.285	C	S	.	.			trans	-82.4	101.4	-178	-165.1	-28.6	0	0	0	111.7	H3071 P3072 F3073 T3077	H3071-D3075 PolarHBondContact CE1-O 2.82Å; H3071-D3075 VanDerWaalsContact CE1-O 3.3Å; P3072-D3075 HydrophobicContact CB-CB 4.2Å; P3072-D3075 HydrophobicContact CG-CB 4.16Å; P3072-D3075 PolarHBondContact O-N 2.87Å; F3073-D3075 VanDerWaalsContact C-N 3.27Å; F3073-D3075 PolarHBondContact O-N 3.09Å; D3075-T3077 PolarHBondContact O-N 3.29Å; D3075-T3077 VanDerWaalsContact OD1-CB 3.23Å; D3075-T3077 WeakPolarHBondContact OD1-CB 3.34Å; D3075-T3077 WeakPolarHBondContact OD1-CG2 3.49Å; D3075-T3077 PolarHBondContact OD1-N 2.98Å; D3075-T3077 PolarHBondContact OD1-OG1 3.07Å
3076	S	73.5	Confident	72.7	Confident	108 Å²	108	46.4 Å²	46.4	76%	0.755	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	2.7	178	71.8	0	0	0	0	114.7	D3074	D3074-S3076 PolarHBondContact O-N 2.89Å
3077	T	69.2	Low	72.6	Confident	80 Å²	80	46.3 Å²	46.3	49%	0.491	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-17.2	179	66.8	0	0	0	0	113.5	D3075 V3079	D3075-T3077 PolarHBondContact O-N 3.29Å; D3075-T3077 VanDerWaalsContact OD1-CB 3.23Å; D3075-T3077 WeakPolarHBondContact OD1-CB 3.34Å; D3075-T3077 WeakPolarHBondContact OD1-CG2 3.49Å; D3075-T3077 PolarHBondContact OD1-N 2.98Å; D3075-T3077 PolarHBondContact OD1-OG1 3.07Å; T3077-V3079 PolarHBondContact O-N 2.9Å
3078	H	77.2	Confident	72.1	Confident	79 Å²	79	48.2 Å²	48.2	37%	0.366	28%	0.284	S	S	.	.			trans	59.2	30.9	-174.2	-61.5	-49.8	0	0	0	113.9	L3037 R3038 H3071	L3037-H3078 HydrophobicContact CD2-CB 3.89Å; R3038-H3078 PolarHBondContact N-O 3.39Å; H3071-H3078 WeakPolarHBondContact NE2-CA 3.3Å
3079	V	78	Confident	71.1	Confident	29 Å²	29	54.3 Å²	54.3	18%	0.176	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	121.9	-174.8	174	0	0	0	0	112.2	R3038 R3040 H3071 T3077	R3038-V3079 CarbonylContact O-C 3.59Å; R3038-V3079 WeakPolarHBondContact O-CA 3.46Å; R3040-V3079 HydrophobicContact CB-CG1 3.58Å; R3040-V3079 HydrophobicContact CG-CG1 4.05Å; H3071-V3079 PolarHBondContact NE2-N 2.92Å; T3077-V3079 PolarHBondContact O-N 2.9Å
3080	F	77.6	Confident	70.2	Confident	6 Å²	6	57.9 Å²	57.9	3%	0.026	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	145.3	172.4	-82.3	-77.2	0	0	0	112.8	V3022 L3037 R3038 I3060 V3062 L3069 H3071	V3022-F3080 HydrophobicContact CB-CE2 4.14Å; V3022-F3080 HydrophobicContact CB-CZ 4.48Å; V3022-F3080 HydrophobicContact CG1-CE2 4.36Å; V3022-F3080 HydrophobicContact CG1-CZ 4.28Å; V3022-F3080 HydrophobicContact CG2-CE2 4.37Å; L3037-F3080 HydrophobicContact CB-CD2 4.13Å; L3037-F3080 HydrophobicContact CB-CE2 3.58Å; L3037-F3080 HydrophobicContact CB-CZ 4.43Å; L3037-F3080 HydrophobicContact CD1-CE2 3.78Å; L3037-F3080 HydrophobicContact CD1-CZ 3.78Å; L3037-F3080 HydrophobicContact CG-CE2 4.36Å; R3038-F3080 PolarHBondContact O-N 2.66Å; I3060-F3080 HydrophobicContact CB-CE1 4.5Å; I3060-F3080 HydrophobicContact CG2-CE1 4.32Å; I3060-F3080 HydrophobicContact CG2-CZ 4.19Å; V3062-F3080 HydrophobicContact CB-CE1 4.24Å; V3062-F3080 HydrophobicContact CB-CZ 4.41Å; V3062-F3080 HydrophobicContact CG2-CE1 3.59Å; V3062-F3080 HydrophobicContact CG2-CE2 4.26Å; V3062-F3080 HydrophobicContact CG2-CZ 3.43Å; V3062-F3080 VanDerWaalsContact CG2-CZ 3.43Å; L3069-F3080 HydrophobicContact CB-CB 4.17Å; L3069-F3080 HydrophobicContact CB-CD1 3.85Å; L3069-F3080 HydrophobicContact CB-CG 4.25Å; L3069-F3080 HydrophobicContact CD1-CB 4.16Å; L3069-F3080 HydrophobicContact CD1-CG 4.46Å; H3071-F3080 HydrophobicContact CB-CD1 3.68Å; H3071-F3080 HydrophobicContact CB-CE1 3.6Å; H3071-F3080 HydrophobicContact CB-CG 4.34Å; H3071-F3080 HydrophobicContact CB-CZ 4.22Å
3081	T	73.2	Confident	69.1	Low	39 Å²	39	64 Å²	64	24%	0.239	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	138.2	174.8	58.3	0	0	0	0	110.8	L3069 F3070	L3069-T3081 CarbonylContact C-O 3.58Å; L3069-T3081 WeakPolarHBondContact CA-O 3.43Å; F3070-T3081 PolarHBondContact N-O 2.92Å; F3070-T3081 PolarHBondContact O-N 2.59Å; F3070-T3081 PolarHBondContact O-OG1 3.31Å
3082	P	71.4	Confident	68	Low	66 Å²	66	69.9 Å²	69.9	43%	0.429	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	143.5	177.2	30	-34.5	0	0	0	111.6	L3069	L3069-P3082 HydrophobicContact CD2-CB 3.98Å
3083	L	70	Confident	67.2	Low	19 Å²	19	68.9 Å²	68.9	10%	0.099	39%	0.388	C	S	.	.			trans	-73.6	131.1	-176	-84.9	160.7	0	0	0	113.8	L3061 A3068 F3070 G3085 N3088 E3132	L3061-L3083 HydrophobicContact CD2-CD1 3.76Å; A3068-L3083 HydrophobicContact CB-CD1 3.67Å; A3068-L3083 WeakPolarHBondContact O-CB 3.29Å; A3068-L3083 PolarHBondContact O-N 2.63Å; F3070-L3083 HydrophobicContact CB-CD1 4.36Å; F3070-L3083 HydrophobicContact CB-CD2 3.99Å; F3070-L3083 HydrophobicContact CB-CG 4.02Å; L3083-G3085 PolarHBondContact O-N 3.45Å; L3083-N3088 PolarHBondContact N-ND2 2.86Å; L3083-N3088 PolarHBondContact O-ND2 2.9Å; L3083-E3132 WeakPolarHBondContact CB-OE1 3.37Å
3084	P	58.2	Low	66.7	Low	122 Å²	122	70.8 Å²	70.8	79%	0.792	40%	0.397	S	S	*	.	S	Bend	trans	22	-80.4	160.4	41.1	-34.7	0	0	0	121.6	E3132	P3084-E3132 WeakPolarHBondContact CA-OE1 3.36Å; P3084-E3132 WeakPolarHBondContact CD-OE1 3.44Å
3085	G	60.8	Low	66.7	Low	18 Å²	18	63.1 Å²	63.1	19%	0.186	36%	0.356	C	S	.	.	S	Bend	trans	-144.9	-126.3	-137.9	0	0	0	0	0	115.9	L3083 I3087 N3088 N3089 E3132	L3083-G3085 PolarHBondContact O-N 3.45Å; G3085-I3087 VanDerWaalsContact C-N 3.33Å; G3085-I3087 PolarHBondContact O-N 2.89Å; G3085-N3088 PolarHBondContact O-N 3.07Å; G3085-N3089 PolarHBondContact O-ND2 3.49Å; G3085-E3132 PolarHBondContact N-OE2 3.38Å
3086	S	58.2	Low	66.4	Low	36 Å²	36	63.5 Å²	63.5	25%	0.252	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-71	-24.6	-160.6	72.3	0	0	0	0	114.7	N3088 N3089 L3090 E3132	S3086-N3088 PolarHBondContact O-N 2.79Å; S3086-N3089 PolarHBondContact O-N 3.5Å; S3086-N3089 VanDerWaalsContact O-N 3.09Å; S3086-L3090 WeakPolarHBondContact O-CD1 3.13Å; S3086-L3090 WeakPolarHBondContact O-CG 3.42Å; S3086-E3132 WeakPolarHBondContact CB-O 3.35Å; S3086-E3132 PolarHBondContact N-O 3.41Å; S3086-E3132 PolarHBondContact OG-O 3.25Å
3087	I	64.1	Low	66.5	Low	11 Å²	11	61 Å²	61	6%	0.056	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-58.9	-33.4	176.4	-164.4	166.4	0	0	0	112.2	A3068 G3085 I3095 I3098 V3115 F3128 E3132	A3068-I3087 HydrophobicContact CB-CD1 3.76Å; A3068-I3087 HydrophobicContact CB-CG1 4.42Å; A3068-I3087 HydrophobicContact CB-CG2 4.36Å; G3085-I3087 VanDerWaalsContact C-N 3.33Å; G3085-I3087 PolarHBondContact O-N 2.89Å; I3087-I3095 HydrophobicContact CD1-CD1 4Å; I3087-I3095 HydrophobicContact CG1-CD1 3.98Å; I3087-I3098 HydrophobicContact CD1-CD1 4.45Å; I3087-V3115 HydrophobicContact CD1-CG2 3.77Å; I3087-F3128 HydrophobicContact CB-CE1 4.35Å; I3087-F3128 HydrophobicContact CB-CZ 4.28Å; I3087-F3128 HydrophobicContact CD1-CD2 4.5Å; I3087-F3128 HydrophobicContact CD1-CE2 4.24Å; I3087-F3128 HydrophobicContact CG1-CE2 4.39Å; I3087-F3128 HydrophobicContact CG1-CZ 4.3Å; I3087-E3132 WeakPolarHBondContact CG2-OE2 3.17Å
3088	N	58.2	Low	66.8	Low	51 Å²	51	57.3 Å²	57.3	27%	0.273	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-91.2	3.6	-179.6	-69	-18.6	0	0	0	113.8	S3067 A3068 L3083 G3085 S3086	S3067-N3088 WeakPolarHBondContact CA-OD1 3.3Å; S3067-N3088 WeakPolarHBondContact CB-OD1 3.45Å; A3068-N3088 PolarHBondContact N-OD1 3.26Å; L3083-N3088 PolarHBondContact N-ND2 2.86Å; L3083-N3088 PolarHBondContact O-ND2 2.9Å; G3085-N3088 PolarHBondContact O-N 3.07Å; S3086-N3088 PolarHBondContact O-N 2.79Å
3089	N	56.3	Low	66.7	Low	129 Å²	129	55.8 Å²	55.8	69%	0.69	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-116	11.6	-177.4	-73.9	-68.2	0	0	0	113.5	G3085 S3086	G3085-N3089 PolarHBondContact O-ND2 3.49Å; S3086-N3089 PolarHBondContact O-N 3.5Å; S3086-N3089 VanDerWaalsContact O-N 3.09Å
3090	L	59	Low	66.5	Low	75 Å²	75	55.8 Å²	55.8	39%	0.393	30%	0.303	S	S	.	.			trans	-106.9	92	-176	-70.1	162.7	0	0	0	110.7	S3086 I3093	S3086-L3090 WeakPolarHBondContact O-CD1 3.13Å; S3086-L3090 WeakPolarHBondContact O-CG 3.42Å; L3090-I3093 HydrophobicContact CB-CD1 3.5Å; L3090-I3093 HydrophobicContact CB-CG1 3.93Å; L3090-I3093 HydrophobicContact CD1-CD1 3.7Å; L3090-I3093 HydrophobicContact CD2-CD1 4.5Å; L3090-I3093 HydrophobicContact CG-CD1 4.08Å; L3090-I3093 PolarHBondContact O-N 3.22Å
3091	E	56.2	Low	66.2	Low	170 Å²	170	55.9 Å²	55.9	79%	0.794	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	141.8	175.3	-62.8	-177.1	164.5	0	0	111.4	I3093	E3091-I3093 PolarHBondContact O-N 2.69Å
3092	N	59.8	Low	65.5	Low	128 Å²	128	57.4 Å²	57.4	68%	0.684	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	11.8	178.8	-51.2	-39.8	0	0	0	117.7	L3119	N3092-L3119 HydrophobicContact CB-CD1 4.14Å
3093	I	64.7	Low	64.8	Low	21 Å²	21	54.7 Å²	54.7	11%	0.108	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	119.5	170.5	-64.4	-166.7	0	0	0	111	G3066 L3090 E3091 I3095 L3119	G3066-I3093 WeakPolarHBondContact CA-O 3.42Å; L3090-I3093 HydrophobicContact CB-CD1 3.5Å; L3090-I3093 HydrophobicContact CB-CG1 3.93Å; L3090-I3093 HydrophobicContact CD1-CD1 3.7Å; L3090-I3093 HydrophobicContact CD2-CD1 4.5Å; L3090-I3093 HydrophobicContact CG-CD1 4.08Å; L3090-I3093 PolarHBondContact O-N 3.22Å; E3091-I3093 PolarHBondContact O-N 2.69Å; I3093-I3095 HydrophobicContact CG2-CG1 4.23Å; I3093-L3119 HydrophobicContact CG1-CB 4.35Å; I3093-L3119 HydrophobicContact CG1-CD1 3.77Å
3094	H	68.1	Low	63.7	Low	93 Å²	93	59.5 Å²	59.5	43%	0.431	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	113.5	163.3	-175.2	-84.9	0	0	0	109.8	D3096 S3117 K3118	H3094-D3096 IonicContact CE1-OD1 3.61Å; H3094-D3096 PolarHBondContact CE1-OD1 3.4Å; H3094-D3096 IonicContact ND1-OD1 3.54Å; H3094-D3096 PolarHBondContact ND1-OD1 2.91Å; H3094-D3096 PolarHBondContact O-N 3.23Å; H3094-S3117 CarbonylContact O-C 3.53Å; H3094-S3117 WeakPolarHBondContact O-CA 3.39Å; H3094-S3117 WeakPolarHBondContact O-CB 3.43Å; H3094-K3118 PolarHBondContact N-O 2.96Å; H3094-K3118 PolarHBondContact O-N 2.89Å
3095	I	72.6	Confident	63	Low	2 Å²	2	58.1 Å²	58.1	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	118.1	173.1	-62.7	174.7	0	0	0	108.9	S3051 A3063 G3066 I3087 I3093 V3115	S3051-I3095 VanDerWaalsContact CB-O 3.27Å; S3051-I3095 WeakPolarHBondContact CB-O 3.24Å; S3051-I3095 PolarHBondContact OG-O 3.4Å; A3063-I3095 HydrophobicContact CB-CB 4.16Å; A3063-I3095 HydrophobicContact CB-CG2 3.54Å; G3066-I3095 VanDerWaalsContact O-CD1 3.31Å; G3066-I3095 WeakPolarHBondContact O-CD1 3.22Å; I3087-I3095 HydrophobicContact CD1-CD1 4Å; I3087-I3095 HydrophobicContact CG1-CD1 3.98Å; I3093-I3095 HydrophobicContact CG2-CG1 4.23Å; I3095-V3115 HydrophobicContact CB-CG1 4.43Å; I3095-V3115 HydrophobicContact CD1-CG1 4.2Å; I3095-V3115 HydrophobicContact CG1-CG1 3.88Å; I3095-V3115 HydrophobicContact CG2-CG1 3.9Å
3096	D	69	Low	62.2	Low	51 Å²	51	60 Å²	60	27%	0.273	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-33.7	175.3	-69.4	-15.7	0	0	0	112.2	H3094 T3116 K3118	H3094-D3096 IonicContact CE1-OD1 3.61Å; H3094-D3096 PolarHBondContact CE1-OD1 3.4Å; H3094-D3096 IonicContact ND1-OD1 3.54Å; H3094-D3096 PolarHBondContact ND1-OD1 2.91Å; H3094-D3096 PolarHBondContact O-N 3.23Å; D3096-T3116 PolarHBondContact N-O 3.29Å; D3096-K3118 IonicContact OD1-NZ 2.64Å; D3096-K3118 PolarHBondContact OD1-NZ 2.88Å; D3096-K3118 IonicContact OD2-NZ 3.94Å; D3096-K3118 PolarHBondContact OD2-NZ 2.88Å
3097	R	73.8	Confident	61.2	Low	57 Å²	57	66.8 Å²	66.8	22%	0.215	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	149.1	-177.5	-151	161.7	177.2	-100.4	-16.9	112.3	E2997 S3052 E3099 V3115 T3116 Y3150	E2997-R3097 IonicContact OE1-NE 2.75Å; E2997-R3097 IonicContact OE1-NH2 3.68Å; S3052-R3097 WeakPolarHBondContact OG-CG 3.5Å; R3097-E3099 IonicContact CZ-OE1 3.68Å; R3097-E3099 IonicContact NH1-OE1 3.87Å; R3097-E3099 PolarHBondContact NH1-OE1 2.95Å; R3097-E3099 IonicContact NH1-OE2 3.9Å; R3097-E3099 IonicContact NH2-OE1 3.4Å; R3097-E3099 PolarHBondContact NH2-OE1 3.46Å; R3097-V3115 WeakPolarHBondContact O-CA 3.47Å; R3097-T3116 VanDerWaalsContact CB-OG1 3.28Å; R3097-T3116 WeakPolarHBondContact CB-OG1 3.45Å; R3097-T3116 PolarHBondContact N-O 3.48Å; R3097-T3116 PolarHBondContact N-OG1 3.43Å; R3097-T3116 PolarHBondContact O-N 2.79Å; R3097-Y3150 HydrophobicContact CB-CE1 4.43Å
3098	I	77	Confident	60.2	Low	1 Å²	1	70.3 Å²	70.3	1%	0.005	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	130.9	175.8	-172.4	165.3	0	0	0	110.8	C3054 L3061 A3063 A3068 I3087 Y3113 I3114 V3115	C3054-I3098 PolarHBondContact SG-O 3.49Å; L3061-I3098 HydrophobicContact CD2-CD1 3.81Å; A3063-I3098 HydrophobicContact CB-CG2 4.03Å; A3068-I3098 HydrophobicContact CB-CD1 4.08Å; I3087-I3098 HydrophobicContact CD1-CD1 4.45Å; I3098-Y3113 HydrophobicContact CD1-CD1 4.46Å; I3098-Y3113 HydrophobicContact CD1-CG 4.36Å; I3098-Y3113 HydrophobicContact CG1-CD1 4.43Å; I3098-I3114 WeakPolarHBondContact CA-O 3.46Å; I3098-V3115 HydrophobicContact CD1-CG2 4.22Å; I3098-V3115 HydrophobicContact CG1-CG2 4.18Å
3099	E	75.4	Confident	59.8	Low	47 Å²	47	72.7 Å²	72.7	22%	0.22	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134.6	176.9	-71.9	-170.2	147.8	0	0	111.9	R3097 Y3113 I3114 Y3150	R3097-E3099 IonicContact CZ-OE1 3.68Å; R3097-E3099 IonicContact NH1-OE1 3.87Å; R3097-E3099 PolarHBondContact NH1-OE1 2.95Å; R3097-E3099 IonicContact NH1-OE2 3.9Å; R3097-E3099 IonicContact NH2-OE1 3.4Å; R3097-E3099 PolarHBondContact NH2-OE1 3.46Å; E3099-Y3113 WeakPolarHBondContact O-CA 3.37Å; E3099-I3114 PolarHBondContact N-O 3.16Å; E3099-I3114 PolarHBondContact O-N 3.07Å; E3099-Y3150 VanDerWaalsContact OE2-CE2 3.32Å; E3099-Y3150 WeakPolarHBondContact OE2-CE2 3.41Å
3100	P	73.6	Confident	59.7	Low	29 Å²	29	70.9 Å²	70.9	19%	0.188	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	135.6	175.7	32.4	-33.9	0	0	0	111.8	Y3056 C3102 Y3113	Y3056-P3100 HydrophobicContact CD2-CB 3.96Å; Y3056-P3100 HydrophobicContact CD2-CG 4.39Å; Y3056-P3100 HydrophobicContact CG-CB 4.47Å; P3100-C3102 PolarHBondContact O-N 2.85Å; P3100-Y3113 HydrophobicContact CB-CD1 4.2Å; P3100-Y3113 HydrophobicContact CB-CE1 4.15Å
3101	L	70.4	Confident	59.7	Low	8 Å²	8	68 Å²	68	4%	0.042	37%	0.372	C	S	.	.			trans	-99.7	81.9	179.1	-164.7	83.2	0	0	0	110.8	L3103 L3112 I3114 I3152 T3155 L3162	L3101-L3103 HydrophobicContact CD2-CD1 4.17Å; L3101-L3103 HydrophobicContact CD2-CG 4.39Å; L3101-L3103 PolarHBondContact O-N 3.22Å; L3101-L3112 HydrophobicContact CB-CB 4.1Å; L3101-L3112 WeakPolarHBondContact CB-O 3.44Å; L3101-L3112 HydrophobicContact CD2-CB 4.28Å; L3101-L3112 PolarHBondContact N-O 3.38Å; L3101-I3114 HydrophobicContact CD1-CD1 4.48Å; L3101-I3152 HydrophobicContact CD1-CD1 3.67Å; L3101-I3152 HydrophobicContact CD1-CG2 4.2Å; L3101-T3155 HydrophobicContact CD1-CG2 3.88Å; L3101-T3155 HydrophobicContact CD2-CG2 4.26Å; L3101-T3155 HydrophobicContact CG-CG2 4.4Å; L3101-L3162 HydrophobicContact CD2-CD2 3.71Å
3102	C	58.8	Low	60.2	Low	71 Å²	71	59.9 Å²	59.9	48%	0.48	34%	0.335	S	S	.	.			trans	-64.1	120.9	177	-58.2	0	0	0	0	111.2	P3100	P3100-C3102 PolarHBondContact O-N 2.85Å
3103	L	56.5	Low	60.7	Low	10 Å²	10	54.6 Å²	54.6	5%	0.052	31%	0.305	C	S	.	.			trans	-121.1	122.4	178.2	-68.9	168.1	0	0	0	110.6	L3101 N3105 L3112 F3157 L3162	L3101-L3103 HydrophobicContact CD2-CD1 4.17Å; L3101-L3103 HydrophobicContact CD2-CG 4.39Å; L3101-L3103 PolarHBondContact O-N 3.22Å; L3103-N3105 PolarHBondContact O-N 3.38Å; L3103-N3105 VanDerWaalsContact O-N 3.16Å; L3103-L3112 HydrophobicContact CD1-CD1 3.78Å; L3103-F3157 HydrophobicContact CB-CE2 4.05Å; L3103-F3157 HydrophobicContact CD1-CE2 3.82Å; L3103-F3157 HydrophobicContact CD1-CZ 3.89Å; L3103-F3157 HydrophobicContact CG-CE2 4.36Å; L3103-L3162 HydrophobicContact CD1-CD1 3.76Å; L3103-L3162 HydrophobicContact CD1-CD2 3.9Å; L3103-L3162 HydrophobicContact CD1-CG 4.41Å; L3103-L3162 HydrophobicContact CD2-CD1 3.76Å; L3103-L3162 HydrophobicContact CG-CD1 4.44Å
3104	P	47.7	Very low	61.1	Low	120 Å²	120	53.6 Å²	53.6	78%	0.779	30%	0.3	S	S	*	.			trans	-76.7	102.7	178.3	30.2	-32.9	0	0	0	110.4
3105	N	42.9	Very low	61.1	Low	93 Å²	93	49.3 Å²	49.3	50%	0.497	28%	0.28	S	S	.	.			trans	-146.5	63.5	178.9	-152.8	-7	0	0	0	113.3	L3103 F3157	L3103-N3105 PolarHBondContact O-N 3.38Å; L3103-N3105 VanDerWaalsContact O-N 3.16Å; N3105-F3157 HydrophobicContact CB-CE2 4.23Å; N3105-F3157 WeakPolarHBondContact ND2-CE2 3.46Å
3106	G	43.5	Very low	61	Low	56 Å²	56	49.9 Å²	49.9	58%	0.577	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	-163.9	176.2	0	0	0	0	0	114.6	S3108	G3106-S3108 PolarHBondContact O-N 3.14Å
3107	N	38	Very low	61	Low	179 Å²	179	47.5 Å²	47.5	96%	0.957	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	19	-174.9	-66.4	16.8	0	0	0	114.7
3108	S	43.5	Very low	60.4	Low	85 Å²	85	49.2 Å²	49.2	59%	0.594	28%	0.28	S	S	*	.			trans	-141.5	90.1	-178.4	58.1	0	0	0	0	110.4	G3106 K3110	G3106-S3108 PolarHBondContact O-N 3.14Å; S3108-K3110 PolarHBondContact O-N 3.27Å
3109	F	48.7	Very low	59.6	Low	101 Å²	101	50.6 Å²	50.6	44%	0.443	29%	0.288	S	S	.	.			trans	-66.6	100.2	173.7	-63.4	-76.1	0	0	0	110.1	L3111 N3130	F3109-L3111 VanDerWaalsContact C-N 3.33Å; F3109-L3111 PolarHBondContact O-N 3.35Å; F3109-N3130 PolarHBondContact O-ND2 3.11Å; F3109-N3130 VanDerWaalsContact O-ND2 3.16Å
3110	K	55.1	Low	58.7	Low	91 Å²	91	55.8 Å²	55.8	40%	0.396	31%	0.312	S	S	.	.			trans	-73.9	95.5	155	-79.5	-159	176.9	-159	0	106.7	S3108 V3184	S3108-K3110 PolarHBondContact O-N 3.27Å; K3110-V3184 HydrophobicContact CD-CG1 3.53Å; K3110-V3184 PolarHBondContact NZ-O 3.16Å
3111	L	58.4	Low	57.9	Low	14 Å²	14	59.7 Å²	59.7	7%	0.073	34%	0.34	C	S	.	.			trans	-71.6	147.7	168.3	157.5	159.2	0	0	0	108.7	Y3056 F3109 Y3113 N3130	Y3056-L3111 HydrophobicContact CD1-CD1 3.84Å; Y3056-L3111 HydrophobicContact CD2-CD1 3.91Å; Y3056-L3111 HydrophobicContact CE1-CD1 3.73Å; Y3056-L3111 HydrophobicContact CE2-CD1 3.8Å; Y3056-L3111 HydrophobicContact CG-CD1 3.94Å; F3109-L3111 VanDerWaalsContact C-N 3.33Å; F3109-L3111 PolarHBondContact O-N 3.35Å; L3111-Y3113 HydrophobicContact CD1-CE1 3.73Å; L3111-Y3113 HydrophobicContact CD2-CD1 4.19Å; L3111-Y3113 HydrophobicContact CD2-CD2 3.89Å; L3111-Y3113 HydrophobicContact CD2-CE1 3.71Å; L3111-Y3113 HydrophobicContact CD2-CE2 3.39Å; L3111-Y3113 HydrophobicContact CD2-CG 4.26Å; L3111-Y3113 HydrophobicContact CG-CE1 4.03Å; L3111-N3130 VanDerWaalsContact CA-OD1 3.31Å; L3111-N3130 WeakPolarHBondContact CA-OD1 3.43Å; L3111-N3130 VanDerWaalsContact CB-OD1 3.24Å; L3111-N3130 WeakPolarHBondContact CB-OD1 3.43Å; L3111-N3130 PolarHBondContact N-OD1 3.26Å; L3111-N3130 PolarHBondContact O-N 2.91Å; L3111-N3130 PolarHBondContact O-OD1 2.99Å
3112	L	66.8	Low	57.4	Low	0 Å²	0	62.4 Å²	62.4	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	153.8	166.9	-70.3	91	0	0	0	107.9	L3101 L3103 F3128 L3135 L3162	L3101-L3112 HydrophobicContact CB-CB 4.1Å; L3101-L3112 WeakPolarHBondContact CB-O 3.44Å; L3101-L3112 HydrophobicContact CD2-CB 4.28Å; L3101-L3112 PolarHBondContact N-O 3.38Å; L3103-L3112 HydrophobicContact CD1-CD1 3.78Å; L3112-F3128 WeakPolarHBondContact CA-O 3.39Å; L3112-F3128 WeakPolarHBondContact CB-O 3.34Å; L3112-L3135 HydrophobicContact CD2-CD1 3.6Å; L3112-L3162 HydrophobicContact CD1-CD2 4.25Å; L3112-L3162 HydrophobicContact CD2-CD2 3.82Å
3113	Y	69.8	Low	57.7	Low	17 Å²	17	60.5 Å²	60.5	7%	0.067	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	138.9	171.1	-60.2	-62.9	0	0	0	110.1	L3061 I3098 E3099 P3100 L3111 F3127 F3128	L3061-Y3113 HydrophobicContact CD1-CE1 3.88Å; L3061-Y3113 HydrophobicContact CD2-CD1 4.01Å; L3061-Y3113 HydrophobicContact CD2-CE1 3.34Å; L3061-Y3113 HydrophobicContact CD2-CE2 4.17Å; L3061-Y3113 VanDerWaalsContact CD2-CZ 3.44Å; L3061-Y3113 HydrophobicContact CG-CE1 4.26Å; I3098-Y3113 HydrophobicContact CD1-CD1 4.46Å; I3098-Y3113 HydrophobicContact CD1-CG 4.36Å; I3098-Y3113 HydrophobicContact CG1-CD1 4.43Å; E3099-Y3113 WeakPolarHBondContact O-CA 3.37Å; P3100-Y3113 HydrophobicContact CB-CD1 4.2Å; P3100-Y3113 HydrophobicContact CB-CE1 4.15Å; L3111-Y3113 HydrophobicContact CD1-CE1 3.73Å; L3111-Y3113 HydrophobicContact CD2-CD1 4.19Å; L3111-Y3113 HydrophobicContact CD2-CD2 3.89Å; L3111-Y3113 HydrophobicContact CD2-CE1 3.71Å; L3111-Y3113 HydrophobicContact CD2-CE2 3.39Å; L3111-Y3113 HydrophobicContact CD2-CG 4.26Å; L3111-Y3113 HydrophobicContact CG-CE1 4.03Å; Y3113-F3127 WeakPolarHBondContact O-CA 3.31Å; Y3113-F3128 PolarHBondContact N-O 2.98Å; Y3113-F3128 VanDerWaalsContact N-O 3.1Å; Y3113-F3128 PolarHBondContact O-N 2.82Å
3114	I	73	Confident	58.4	Low	1 Å²	1	62.5 Å²	62.5	1%	0.005	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.6	159.1	-56.7	-169.1	0	0	0	107.7	I3098 E3099 L3101 I3125 I3126 F3127 I3152	I3098-I3114 WeakPolarHBondContact CA-O 3.46Å; E3099-I3114 PolarHBondContact N-O 3.16Å; E3099-I3114 PolarHBondContact O-N 3.07Å; L3101-I3114 HydrophobicContact CD1-CD1 4.48Å; I3114-I3125 HydrophobicContact CG2-CG2 3.65Å; I3114-I3126 WeakPolarHBondContact CA-O 3.48Å; I3114-F3127 HydrophobicContact CD1-CD1 4.14Å; I3114-F3127 HydrophobicContact CD1-CE1 3.38Å; I3114-F3127 HydrophobicContact CD1-CE2 4.48Å; I3114-F3127 HydrophobicContact CD1-CZ 3.59Å; I3114-F3127 HydrophobicContact CG1-CD1 3.82Å; I3114-F3127 HydrophobicContact CG1-CE1 3.6Å; I3114-F3127 HydrophobicContact CG1-CG 4.5Å; I3114-F3127 HydrophobicContact CG1-CZ 4.09Å; I3114-I3152 HydrophobicContact CD1-CD1 3.5Å; I3114-I3152 HydrophobicContact CD1-CG1 3.85Å; I3114-I3152 HydrophobicContact CG1-CD1 4.37Å
3115	V	69	Low	59.8	Low	2 Å²	2	57 Å²	57	1%	0.012	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	121.8	175.5	177.3	0	0	0	0	107.8	I3087 I3095 R3097 I3098 I3126 F3128	I3087-V3115 HydrophobicContact CD1-CG2 3.77Å; I3095-V3115 HydrophobicContact CB-CG1 4.43Å; I3095-V3115 HydrophobicContact CD1-CG1 4.2Å; I3095-V3115 HydrophobicContact CG1-CG1 3.88Å; I3095-V3115 HydrophobicContact CG2-CG1 3.9Å; R3097-V3115 WeakPolarHBondContact O-CA 3.47Å; I3098-V3115 HydrophobicContact CD1-CG2 4.22Å; I3098-V3115 HydrophobicContact CG1-CG2 4.18Å; V3115-I3126 PolarHBondContact N-O 3.23Å; V3115-I3126 PolarHBondContact O-N 3.38Å; V3115-F3128 HydrophobicContact CB-CD2 4.31Å; V3115-F3128 HydrophobicContact CB-CE2 3.95Å; V3115-F3128 HydrophobicContact CG2-CD2 3.74Å; V3115-F3128 HydrophobicContact CG2-CE2 3.71Å
3116	T	70.4	Confident	61.4	Low	14 Å²	14	52.9 Å²	52.9	9%	0.086	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.1	166.4	55.8	0	0	0	0	109	D3096 R3097 R3124 I3125 Y3150	D3096-T3116 PolarHBondContact N-O 3.29Å; R3097-T3116 VanDerWaalsContact CB-OG1 3.28Å; R3097-T3116 WeakPolarHBondContact CB-OG1 3.45Å; R3097-T3116 PolarHBondContact N-O 3.48Å; R3097-T3116 PolarHBondContact N-OG1 3.43Å; R3097-T3116 PolarHBondContact O-N 2.79Å; T3116-R3124 WeakPolarHBondContact CA-O 3.24Å; T3116-I3125 HydrophobicContact CG2-CD1 4.35Å; T3116-I3125 HydrophobicContact CG2-CG1 4.06Å; T3116-I3125 HydrophobicContact CG2-CG2 4.26Å; T3116-Y3150 HydrophobicContact CG2-CD1 3.71Å; T3116-Y3150 HydrophobicContact CG2-CE1 3.29Å; T3116-Y3150 HydrophobicContact CG2-CG 4.49Å
3117	S	67.8	Low	63	Low	2 Å²	2	50.3 Å²	50.3	1%	0.014	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	162	-173.8	62.7	0	0	0	0	113.3	H3094 P3123 R3124	H3094-S3117 CarbonylContact O-C 3.53Å; H3094-S3117 WeakPolarHBondContact O-CA 3.39Å; H3094-S3117 WeakPolarHBondContact O-CB 3.43Å; S3117-P3123 WeakPolarHBondContact O-CA 3.27Å; S3117-R3124 PolarHBondContact N-O 3.43Å; S3117-R3124 PolarHBondContact O-N 3.06Å
3118	K	62.6	Low	64.7	Low	92 Å²	92	42 Å²	42	40%	0.4	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	120.8	165	-58.9	-174.7	-169.8	70.3	0	109.1	H3094 D3096 E3122	H3094-K3118 PolarHBondContact N-O 2.96Å; H3094-K3118 PolarHBondContact O-N 2.89Å; D3096-K3118 IonicContact OD1-NZ 2.64Å; D3096-K3118 PolarHBondContact OD1-NZ 2.88Å; D3096-K3118 IonicContact OD2-NZ 3.94Å; D3096-K3118 PolarHBondContact OD2-NZ 2.88Å; K3118-E3122 WeakPolarHBondContact CA-O 3.43Å
3119	L	59.1	Low	66	Low	31 Å²	31	38.5 Å²	38.5	16%	0.162	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.7	164.8	177.8	74.9	0	0	0	106.9	N3092 I3093 S3121 E3122 R3124	N3092-L3119 HydrophobicContact CB-CD1 4.14Å; I3093-L3119 HydrophobicContact CG1-CB 4.35Å; I3093-L3119 HydrophobicContact CG1-CD1 3.77Å; L3119-S3121 PolarHBondContact O-N 2.99Å; L3119-E3122 PolarHBondContact N-O 3.38Å; L3119-E3122 VanDerWaalsContact N-O 3.17Å; L3119-E3122 WeakPolarHBondContact O-CB 3.42Å; L3119-E3122 PolarHBondContact O-N 2.92Å; L3119-R3124 VanDerWaalsContact CD2-NH1 3.34Å
3120	E	57.2	Low	66.8	Low	156 Å²	156	37.5 Å²	37.5	73%	0.729	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	34.9	177.2	-62.3	-175.8	162.7	0	0	114.3	E3122	E3120-E3122 VanDerWaalsContact C-N 3.3Å; E3120-E3122 PolarHBondContact O-N 3.05Å
3121	S	56.8	Low	67.1	Low	111 Å²	111	37.8 Å²	37.8	78%	0.776	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.5	-8.9	-173.5	-24.7	0	0	0	0	116.5	L3119	L3119-S3121 PolarHBondContact O-N 2.99Å
3122	E	60.5	Low	67.3	Low	64 Å²	64	37.8 Å²	37.8	30%	0.299	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	126.3	176.6	-62.8	-166.4	145.4	0	0	111.9	K3118 L3119 E3120 R3124	K3118-E3122 WeakPolarHBondContact CA-O 3.43Å; L3119-E3122 PolarHBondContact N-O 3.38Å; L3119-E3122 VanDerWaalsContact N-O 3.17Å; L3119-E3122 WeakPolarHBondContact O-CB 3.42Å; L3119-E3122 PolarHBondContact O-N 2.92Å; E3120-E3122 VanDerWaalsContact C-N 3.3Å; E3120-E3122 PolarHBondContact O-N 3.05Å; E3122-R3124 HydrophobicContact CB-CG 4.47Å; E3122-R3124 PolarHBondContact O-N 3.39Å; E3122-R3124 IonicContact OE2-CZ 2.98Å; E3122-R3124 VanDerWaalsContact OE2-CZ 3.29Å; E3122-R3124 IonicContact OE2-NE 3.94Å; E3122-R3124 PolarHBondContact OE2-NE 2.78Å; E3122-R3124 VanDerWaalsContact OE2-NE 3.08Å; E3122-R3124 IonicContact OE2-NH2 3.98Å; E3122-R3124 PolarHBondContact OE2-NH2 3.45Å
3123	P	64.1	Low	67.3	Low	31 Å²	31	42.9 Å²	42.9	20%	0.201	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	125.2	169.4	29.9	-31.3	0	0	0	110.2	S3117 L3145 V3147	S3117-P3123 WeakPolarHBondContact O-CA 3.27Å; P3123-L3145 WeakPolarHBondContact CG-O 3.21Å; P3123-V3147 HydrophobicContact CB-CG2 4.32Å
3124	R	71.7	Confident	67.4	Low	52 Å²	52	46.5 Å²	46.5	20%	0.196	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	150.8	-179.4	-65	-178.2	176.2	-162.5	-1.4	111	T3116 S3117 L3119 E3122 I3126 I3138	T3116-R3124 WeakPolarHBondContact CA-O 3.24Å; S3117-R3124 PolarHBondContact N-O 3.43Å; S3117-R3124 PolarHBondContact O-N 3.06Å; L3119-R3124 VanDerWaalsContact CD2-NH1 3.34Å; E3122-R3124 HydrophobicContact CB-CG 4.47Å; E3122-R3124 PolarHBondContact O-N 3.39Å; E3122-R3124 IonicContact OE2-CZ 2.98Å; E3122-R3124 VanDerWaalsContact OE2-CZ 3.29Å; E3122-R3124 IonicContact OE2-NE 3.94Å; E3122-R3124 PolarHBondContact OE2-NE 2.78Å; E3122-R3124 VanDerWaalsContact OE2-NE 3.08Å; E3122-R3124 IonicContact OE2-NH2 3.98Å; E3122-R3124 PolarHBondContact OE2-NH2 3.45Å; R3124-I3126 HydrophobicContact CB-CG1 4.46Å; R3124-I3138 WeakPolarHBondContact CA-O 3.39Å
3125	I	76.3	Confident	67.3	Low	6 Å²	6	47.4 Å²	47.4	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	118.3	175.7	-49.1	-172.7	0	0	0	108.4	I3114 T3116 F3127 I3138 L3166 L3168	I3114-I3125 HydrophobicContact CG2-CG2 3.65Å; T3116-I3125 HydrophobicContact CG2-CD1 4.35Å; T3116-I3125 HydrophobicContact CG2-CG1 4.06Å; T3116-I3125 HydrophobicContact CG2-CG2 4.26Å; I3125-F3127 HydrophobicContact CG2-CE2 4.43Å; I3125-I3138 HydrophobicContact CB-CB 4.26Å; I3125-I3138 HydrophobicContact CB-CD1 4.48Å; I3125-I3138 PolarHBondContact N-O 2.97Å; I3125-I3138 PolarHBondContact O-N 2.84Å; I3125-L3166 HydrophobicContact CD1-CD2 4.1Å; I3125-L3166 HydrophobicContact CG2-CD2 4.19Å; I3125-L3168 HydrophobicContact CD1-CD1 3.64Å; I3125-L3168 HydrophobicContact CD1-CD2 3.35Å; I3125-L3168 HydrophobicContact CD1-CG 4.16Å
3126	I	76.3	Confident	67.6	Low	6 Å²	6	48 Å²	48	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.5	-168.1	-48	178.8	0	0	0	109.4	I3114 V3115 R3124 F3128 M3134 L3136	I3114-I3126 WeakPolarHBondContact CA-O 3.48Å; V3115-I3126 PolarHBondContact N-O 3.23Å; V3115-I3126 PolarHBondContact O-N 3.38Å; R3124-I3126 HydrophobicContact CB-CG1 4.46Å; I3126-F3128 HydrophobicContact CB-CE2 3.85Å; I3126-F3128 HydrophobicContact CB-CZ 4.36Å; I3126-F3128 HydrophobicContact CG2-CD2 4.04Å; I3126-F3128 HydrophobicContact CG2-CE1 4.3Å; I3126-F3128 HydrophobicContact CG2-CE2 3.44Å; I3126-F3128 VanDerWaalsContact CG2-CE2 3.44Å; I3126-F3128 HydrophobicContact CG2-CZ 3.6Å; I3126-M3134 HydrophobicContact CG2-CB 4.46Å; I3126-M3134 HydrophobicContact CG2-CG 3.64Å; I3126-M3134 HydrophobicContact CG2-SD 3.88Å; I3126-L3136 WeakPolarHBondContact CA-O 3.28Å
3127	F	77.2	Confident	68	Low	1 Å²	1	49.7 Å²	49.7	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	126.8	174.3	-69.4	-107.3	0	0	0	109.7	Y3113 I3114 I3125 L3135 L3136 I3138 A3164 C3180 I3182	Y3113-F3127 WeakPolarHBondContact O-CA 3.31Å; I3114-F3127 HydrophobicContact CD1-CD1 4.14Å; I3114-F3127 HydrophobicContact CD1-CE1 3.38Å; I3114-F3127 HydrophobicContact CD1-CE2 4.48Å; I3114-F3127 HydrophobicContact CD1-CZ 3.59Å; I3114-F3127 HydrophobicContact CG1-CD1 3.82Å; I3114-F3127 HydrophobicContact CG1-CE1 3.6Å; I3114-F3127 HydrophobicContact CG1-CG 4.5Å; I3114-F3127 HydrophobicContact CG1-CZ 4.09Å; I3125-F3127 HydrophobicContact CG2-CE2 4.43Å; F3127-L3135 PolarHBondContact O-N 3.22Å; F3127-L3136 HydrophobicContact CB-CB 4.18Å; F3127-L3136 HydrophobicContact CD2-CB 4.08Å; F3127-L3136 HydrophobicContact CD2-CD2 4.01Å; F3127-L3136 HydrophobicContact CD2-CG 4.4Å; F3127-L3136 HydrophobicContact CE2-CD2 4.14Å; F3127-L3136 HydrophobicContact CG-CB 4.43Å; F3127-L3136 PolarHBondContact N-O 3.1Å; F3127-I3138 HydrophobicContact CE2-CD1 4.12Å; F3127-A3164 HydrophobicContact CE1-CB 4.49Å; F3127-C3180 HydrophobicContact CZ-CB 4.44Å; F3127-I3182 HydrophobicContact CB-CD1 4.23Å; F3127-I3182 HydrophobicContact CD1-CD1 3.35Å; F3127-I3182 HydrophobicContact CD2-CD1 4.21Å; F3127-I3182 HydrophobicContact CE1-CD1 3.59Å; F3127-I3182 HydrophobicContact CE2-CD1 4.42Å; F3127-I3182 HydrophobicContact CG-CD1 3.68Å; F3127-I3182 HydrophobicContact CZ-CD1 4.13Å
3128	F	74	Confident	68.4	Low	4 Å²	4	49.7 Å²	49.7	2%	0.018	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	152.3	175.8	-65.7	-88.3	0	0	0	111.5	I3087 L3112 Y3113 V3115 I3126 H3133 M3134	I3087-F3128 HydrophobicContact CB-CE1 4.35Å; I3087-F3128 HydrophobicContact CB-CZ 4.28Å; I3087-F3128 HydrophobicContact CD1-CD2 4.5Å; I3087-F3128 HydrophobicContact CD1-CE2 4.24Å; I3087-F3128 HydrophobicContact CG1-CE2 4.39Å; I3087-F3128 HydrophobicContact CG1-CZ 4.3Å; L3112-F3128 WeakPolarHBondContact CA-O 3.39Å; L3112-F3128 WeakPolarHBondContact CB-O 3.34Å; Y3113-F3128 PolarHBondContact N-O 2.98Å; Y3113-F3128 VanDerWaalsContact N-O 3.1Å; Y3113-F3128 PolarHBondContact O-N 2.82Å; V3115-F3128 HydrophobicContact CB-CD2 4.31Å; V3115-F3128 HydrophobicContact CB-CE2 3.95Å; V3115-F3128 HydrophobicContact CG2-CD2 3.74Å; V3115-F3128 HydrophobicContact CG2-CE2 3.71Å; I3126-F3128 HydrophobicContact CB-CE2 3.85Å; I3126-F3128 HydrophobicContact CB-CZ 4.36Å; I3126-F3128 HydrophobicContact CG2-CD2 4.04Å; I3126-F3128 HydrophobicContact CG2-CE1 4.3Å; I3126-F3128 HydrophobicContact CG2-CE2 3.44Å; I3126-F3128 VanDerWaalsContact CG2-CE2 3.44Å; I3126-F3128 HydrophobicContact CG2-CZ 3.6Å; F3128-H3133 WeakPolarHBondContact CA-O 3.48Å; F3128-M3134 HydrophobicContact CD1-CB 4.32Å; F3128-M3134 HydrophobicContact CE1-CB 4.07Å
3129	N	71.3	Confident	68.8	Low	12 Å²	12	46.1 Å²	46.1	6%	0.064	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	174.5	173.4	75	1.4	0	0	0	113.3	N3131 E3132 H3133 L3135 D3186	N3129-N3131 PolarHBondContact O-N 3.4Å; N3129-N3131 WeakPolarHBondContact OD1-CA 3.29Å; N3129-N3131 WeakPolarHBondContact OD1-CB 3.43Å; N3129-N3131 PolarHBondContact OD1-N 2.63Å; N3129-E3132 WeakPolarHBondContact O-CA 3.43Å; N3129-E3132 PolarHBondContact O-N 2.76Å; N3129-E3132 PolarHBondContact OD1-N 2.82Å; N3129-E3132 VanDerWaalsContact OD1-N 3.1Å; N3129-H3133 PolarHBondContact N-O 2.88Å; N3129-H3133 VanDerWaalsContact N-O 3.14Å; N3129-H3133 PolarHBondContact OD1-N 2.86Å; N3129-L3135 HydrophobicContact CB-CD1 3.94Å; N3129-L3135 HydrophobicContact CB-CD2 4.09Å; N3129-L3135 HydrophobicContact CB-CG 4.03Å; N3129-D3186 PolarHBondContact ND2-OD1 3.49Å
3130	N	64.9	Low	69.2	Low	80 Å²	80	46.2 Å²	46.2	43%	0.428	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-26.7	171.4	-92.3	12.5	0	0	0	115.4	F3109 L3111 E3132	F3109-N3130 PolarHBondContact O-ND2 3.11Å; F3109-N3130 VanDerWaalsContact O-ND2 3.16Å; L3111-N3130 VanDerWaalsContact CA-OD1 3.31Å; L3111-N3130 WeakPolarHBondContact CA-OD1 3.43Å; L3111-N3130 VanDerWaalsContact CB-OD1 3.24Å; L3111-N3130 WeakPolarHBondContact CB-OD1 3.43Å; L3111-N3130 PolarHBondContact N-OD1 3.26Å; L3111-N3130 PolarHBondContact O-N 2.91Å; L3111-N3130 PolarHBondContact O-OD1 2.99Å; N3130-E3132 VanDerWaalsContact C-N 3.29Å
3131	N	62.5	Low	69.2	Low	98 Å²	98	45.2 Å²	45.2	52%	0.524	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	6.9	179.5	-58.1	-19.6	0	0	0	111.5	N3129 H3133 D3186	N3129-N3131 PolarHBondContact O-N 3.4Å; N3129-N3131 WeakPolarHBondContact OD1-CA 3.29Å; N3129-N3131 WeakPolarHBondContact OD1-CB 3.43Å; N3129-N3131 PolarHBondContact OD1-N 2.63Å; N3131-H3133 PolarHBondContact O-N 2.93Å; N3131-D3186 PolarHBondContact ND2-OD1 2.81Å
3132	E	62.5	Low	69.3	Low	13 Å²	13	44 Å²	44	6%	0.061	24%	0.242	C	C	.	.			trans	52.6	34.9	-175.7	-65.5	178.7	-136.9	0	0	114	L3083 P3084 G3085 S3086 I3087 N3129 N3130	L3083-E3132 WeakPolarHBondContact CB-OE1 3.37Å; P3084-E3132 WeakPolarHBondContact CA-OE1 3.36Å; P3084-E3132 WeakPolarHBondContact CD-OE1 3.44Å; G3085-E3132 PolarHBondContact N-OE2 3.38Å; S3086-E3132 WeakPolarHBondContact CB-O 3.35Å; S3086-E3132 PolarHBondContact N-O 3.41Å; S3086-E3132 PolarHBondContact OG-O 3.25Å; I3087-E3132 WeakPolarHBondContact CG2-OE2 3.17Å; N3129-E3132 WeakPolarHBondContact O-CA 3.43Å; N3129-E3132 PolarHBondContact O-N 2.76Å; N3129-E3132 PolarHBondContact OD1-N 2.82Å; N3129-E3132 VanDerWaalsContact OD1-N 3.1Å; N3130-E3132 VanDerWaalsContact C-N 3.29Å
3133	H	66	Low	69.3	Low	107 Å²	107	45.8 Å²	45.8	50%	0.495	25%	0.251	S	S	.	.			trans	-86.5	134.7	163	-63.5	-44.5	0	0	0	110.2	F3128 N3129 N3131 L3135	F3128-H3133 WeakPolarHBondContact CA-O 3.48Å; N3129-H3133 PolarHBondContact N-O 2.88Å; N3129-H3133 VanDerWaalsContact N-O 3.14Å; N3129-H3133 PolarHBondContact OD1-N 2.86Å; N3131-H3133 PolarHBondContact O-N 2.93Å; H3133-L3135 PolarHBondContact O-N 2.95Å
3134	M	72	Confident	69.4	Low	94 Å²	94	53.9 Å²	53.9	46%	0.463	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	115.4	170.4	176.4	176.9	72.1	0	0	109.7	I3126 F3128 N3137	I3126-M3134 HydrophobicContact CG2-CB 4.46Å; I3126-M3134 HydrophobicContact CG2-CG 3.64Å; I3126-M3134 HydrophobicContact CG2-SD 3.88Å; F3128-M3134 HydrophobicContact CD1-CB 4.32Å; F3128-M3134 HydrophobicContact CE1-CB 4.07Å; M3134-N3137 HydrophobicContact SD-CB 3.87Å
3135	L	71.9	Confident	69.3	Low	20 Å²	20	52.7 Å²	52.7	11%	0.105	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-30.2	179.2	-59.2	-173.1	0	0	0	113.4	L3112 F3127 N3129 H3133 I3182 S3191	L3112-L3135 HydrophobicContact CD2-CD1 3.6Å; F3127-L3135 PolarHBondContact O-N 3.22Å; N3129-L3135 HydrophobicContact CB-CD1 3.94Å; N3129-L3135 HydrophobicContact CB-CD2 4.09Å; N3129-L3135 HydrophobicContact CB-CG 4.03Å; H3133-L3135 PolarHBondContact O-N 2.95Å; L3135-I3182 HydrophobicContact CB-CG2 3.79Å; L3135-I3182 HydrophobicContact CD1-CG2 3.46Å; L3135-I3182 VanDerWaalsContact CD1-CG2 3.46Å; L3135-I3182 HydrophobicContact CG-CG2 4.31Å; L3135-S3191 WeakPolarHBondContact O-CB 3.1Å; L3135-S3191 PolarHBondContact O-OG 2.89Å
3136	L	75.5	Confident	69.1	Low	13 Å²	13	58.7 Å²	58.7	7%	0.068	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	137	-177.4	-173.1	67.5	0	0	0	109.4	I3126 F3127 I3138 C3180 I3182 W3193	I3126-L3136 WeakPolarHBondContact CA-O 3.28Å; F3127-L3136 HydrophobicContact CB-CB 4.18Å; F3127-L3136 HydrophobicContact CD2-CB 4.08Å; F3127-L3136 HydrophobicContact CD2-CD2 4.01Å; F3127-L3136 HydrophobicContact CD2-CG 4.4Å; F3127-L3136 HydrophobicContact CE2-CD2 4.14Å; F3127-L3136 HydrophobicContact CG-CB 4.43Å; F3127-L3136 PolarHBondContact N-O 3.1Å; L3136-I3138 HydrophobicContact CD2-CD1 4.34Å; L3136-I3138 HydrophobicContact CD2-CG1 4.26Å; L3136-I3138 HydrophobicContact CG-CG1 4.3Å; L3136-C3180 HydrophobicContact CD2-CB 3.66Å; L3136-I3182 HydrophobicContact CB-CG1 4.36Å; L3136-I3182 HydrophobicContact CD2-CD1 4.25Å; L3136-I3182 HydrophobicContact CD2-CG1 3.93Å; L3136-W3193 HydrophobicContact CD2-CB 4.49Å
3137	N	77.2	Confident	69.1	Low	50 Å²	50	60.3 Å²	60.3	27%	0.267	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	128.6	170.4	176.4	21.9	0	0	0	108.4	M3134	M3134-N3137 HydrophobicContact SD-CB 3.87Å
3138	I	76.5	Confident	69	Low	2 Å²	2	61.8 Å²	61.8	1%	0.01	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	102.7	177.4	-49.3	178.5	0	0	0	107.5	R3124 I3125 F3127 L3136 L3166 W3193	R3124-I3138 WeakPolarHBondContact CA-O 3.39Å; I3125-I3138 HydrophobicContact CB-CB 4.26Å; I3125-I3138 HydrophobicContact CB-CD1 4.48Å; I3125-I3138 PolarHBondContact N-O 2.97Å; I3125-I3138 PolarHBondContact O-N 2.84Å; F3127-I3138 HydrophobicContact CE2-CD1 4.12Å; L3136-I3138 HydrophobicContact CD2-CD1 4.34Å; L3136-I3138 HydrophobicContact CD2-CG1 4.26Å; L3136-I3138 HydrophobicContact CG-CG1 4.3Å; I3138-L3166 HydrophobicContact CD1-CD2 4.06Å; I3138-W3193 HydrophobicContact CG1-CG 4.2Å; I3138-W3193 HydrophobicContact CG2-CD2 4.23Å; I3138-W3193 HydrophobicContact CG2-CG 4.48Å; I3138-W3193 HydrophobicContact CG2-CZ2 4.23Å
3139	S	72.3	Confident	69.3	Low	18 Å²	18	62.2 Å²	62.2	13%	0.126	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	138.6	167.5	50.3	0	0	0	0	110.3	E3141	S3139-E3141 WeakPolarHBondContact CB-OE1 3.45Å; S3139-E3141 PolarHBondContact O-N 3.06Å; S3139-E3141 PolarHBondContact OG-OE1 2.86Å
3140	L	66.7	Low	69.9	Low	32 Å²	32	62.6 Å²	62.6	17%	0.168	34%	0.336	C	S	.	.			trans	-93.3	46.4	172.6	-65.6	174.5	0	0	0	110.8	G3142 M3143 V3147 F3178	L3140-G3142 PolarHBondContact O-N 2.97Å; L3140-M3143 PolarHBondContact O-N 2.92Å; L3140-V3147 HydrophobicContact CD1-CG2 3.69Å; L3140-F3178 HydrophobicContact CD2-CZ 4.19Å
3141	E	56.9	Low	70.5	Confident	135 Å²	135	59.1 Å²	59.1	63%	0.631	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	128.1	-172.9	-89.2	163.3	-123.3	0	0	112.8	S3139	S3139-E3141 WeakPolarHBondContact CB-OE1 3.45Å; S3139-E3141 PolarHBondContact O-N 3.06Å; S3139-E3141 PolarHBondContact OG-OE1 2.86Å
3142	G	59.2	Low	71.3	Confident	86 Å²	86	56 Å²	56	89%	0.887	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	13.3	173.6	0	0	0	0	0	116.6	L3140	L3140-G3142 PolarHBondContact O-N 2.97Å
3143	M	61.1	Low	72	Confident	102 Å²	102	55.5 Å²	55.5	50%	0.502	30%	0.298	S	S	.	.	S	Bend	trans	-107.8	-14.9	177.5	-73.1	-153.6	161.9	0	0	116.5	L3140 L3145	L3140-M3143 PolarHBondContact O-N 2.92Å; M3143-L3145 HydrophobicContact CB-CB 4.48Å; M3143-L3145 HydrophobicContact CB-CD1 4.2Å; M3143-L3145 HydrophobicContact CB-CG 4.07Å; M3143-L3145 PolarHBondContact O-N 2.86Å; M3143-L3145 HydrophobicContact SD-CD1 4.12Å
3144	E	64.6	Low	72.4	Confident	201 Å²	201	51.7 Å²	51.7	94%	0.939	28%	0.284	S	S	*	.			trans	53.7	17	-175	-62.3	-173.6	169.5	0	0	115.1
3145	L	69.7	Low	72.5	Confident	27 Å²	27	49.3 Å²	49.3	14%	0.141	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-87.8	124.8	-179	-65.7	178.4	0	0	0	111.9	P3123 M3143 T3170 D3172	P3123-L3145 WeakPolarHBondContact CG-O 3.21Å; M3143-L3145 HydrophobicContact CB-CB 4.48Å; M3143-L3145 HydrophobicContact CB-CD1 4.2Å; M3143-L3145 HydrophobicContact CB-CG 4.07Å; M3143-L3145 PolarHBondContact O-N 2.86Å; M3143-L3145 HydrophobicContact SD-CD1 4.12Å; L3145-T3170 HydrophobicContact CB-CG2 4.37Å; L3145-D3172 WeakPolarHBondContact CD1-OD2 3.27Å; L3145-D3172 HydrophobicContact CD2-CB 3.67Å
3146	Q	72.7	Confident	72.7	Confident	132 Å²	132	52.4 Å²	52.4	62%	0.617	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-75.4	135.6	164.3	-62.3	-178.7	-4.2	0	0	110.6	T3170 S3171	Q3146-T3170 WeakPolarHBondContact O-CA 3.49Å; Q3146-S3171 PolarHBondContact N-OG 2.77Å; Q3146-S3171 PolarHBondContact O-N 3.47Å; Q3146-S3171 PolarHBondContact O-OG 3.08Å
3147	V	75.6	Confident	72.6	Confident	40 Å²	40	54.9 Å²	54.9	24%	0.242	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	129.8	166.2	179.3	0	0	0	0	108.3	P3123 L3140 L3168 A3169 T3170	P3123-V3147 HydrophobicContact CB-CG2 4.32Å; L3140-V3147 HydrophobicContact CD1-CG2 3.69Å; V3147-L3168 HydrophobicContact CG2-CD1 4.47Å; V3147-A3169 WeakPolarHBondContact CA-O 3.44Å; V3147-T3170 HydrophobicContact CG2-CG2 4.33Å
3148	T	76.9	Confident	72.4	Confident	31 Å²	31	56.1 Å²	56.1	19%	0.19	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	-24.6	-170.1	68.1	0	0	0	0	112.8	A3169 Q3204 I3205	T3148-A3169 PolarHBondContact N-O 3.33Å; T3148-A3169 WeakPolarHBondContact OG1-CB 3.48Å; T3148-A3169 PolarHBondContact OG1-O 3.15Å; T3148-Q3204 HydrophobicContact CG2-CG 3.91Å; T3148-I3205 VanDerWaalsContact CB-O 3.28Å; T3148-I3205 WeakPolarHBondContact CB-O 3.32Å; T3148-I3205 PolarHBondContact OG1-O 3.11Å
3149	A	79.2	Confident	72.2	Confident	13 Å²	13	63.4 Å²	63.4	11%	0.107	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	158.6	165.2	0	0	0	0	0	108.8	A3169 I3205 L3208	A3149-A3169 HydrophobicContact CB-CB 4.15Å; A3149-A3169 PolarHBondContact O-N 2.86Å; A3149-I3205 HydrophobicContact CB-CG2 4.07Å; A3149-L3208 HydrophobicContact CB-CB 4.3Å; A3149-L3208 HydrophobicContact CB-CD1 4.09Å; A3149-L3208 HydrophobicContact CB-CG 3.88Å
3150	Y	83.5	Confident	72.1	Confident	20 Å²	20	69 Å²	69	8%	0.078	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	161	167.3	69.7	-90.6	0	0	0	110.8	R3097 E3099 T3116 L3166 L3167	R3097-Y3150 HydrophobicContact CB-CE1 4.43Å; E3099-Y3150 VanDerWaalsContact OE2-CE2 3.32Å; E3099-Y3150 WeakPolarHBondContact OE2-CE2 3.41Å; T3116-Y3150 HydrophobicContact CG2-CD1 3.71Å; T3116-Y3150 HydrophobicContact CG2-CE1 3.29Å; T3116-Y3150 HydrophobicContact CG2-CG 4.49Å; Y3150-L3166 HydrophobicContact CD2-CD1 4.25Å; Y3150-L3167 CarbonylContact C-O 3.55Å; Y3150-L3167 VanDerWaalsContact CA-O 3.22Å; Y3150-L3167 WeakPolarHBondContact CA-O 3.33Å
3151	C	78.9	Confident	72.5	Confident	7 Å²	7	69.4 Å²	69.4	5%	0.047	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	151.3	164.5	62.2	0	0	0	0	111.4	L3167 L3208 T3210	C3151-L3167 PolarHBondContact N-O 3.01Å; C3151-L3167 PolarHBondContact O-N 3.32Å; C3151-L3208 HydrophobicContact CB-CB 3.91Å; C3151-T3210 HydrophobicContact CB-CG2 3.95Å
3152	I	78.7	Confident	73.4	Confident	34 Å²	34	63 Å²	63	17%	0.174	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	112.2	176.1	-47.7	170.3	0	0	0	107.2	L3101 I3114 T3155	L3101-I3152 HydrophobicContact CD1-CD1 3.67Å; L3101-I3152 HydrophobicContact CD1-CG2 4.2Å; I3114-I3152 HydrophobicContact CD1-CD1 3.5Å; I3114-I3152 HydrophobicContact CD1-CG1 3.85Å; I3114-I3152 HydrophobicContact CG1-CD1 4.37Å; I3152-T3155 HydrophobicContact CG2-CG2 3.97Å
3153	I	76.5	Confident	74.5	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	-56.5	-175.9	-79.2	167.8	0	0	0	110.9	Y3165 L3167 L3177 V3216 I3218 I3232 L3234	I3153-Y3165 PolarHBondContact N-O 2.91Å; I3153-L3167 HydrophobicContact CD1-CB 3.79Å; I3153-L3167 HydrophobicContact CD1-CD1 4.34Å; I3153-L3167 HydrophobicContact CD1-CD2 4.37Å; I3153-L3167 HydrophobicContact CD1-CG 4.41Å; I3153-L3167 HydrophobicContact CG1-CB 4.24Å; I3153-L3177 HydrophobicContact CD1-CD1 3.54Å; I3153-V3216 HydrophobicContact CB-CG1 4.29Å; I3153-V3216 HydrophobicContact CG1-CG1 4.08Å; I3153-V3216 HydrophobicContact CG2-CB 4.14Å; I3153-V3216 HydrophobicContact CG2-CG1 3.55Å; I3153-V3216 HydrophobicContact CG2-CG2 3.54Å; I3153-I3218 HydrophobicContact CD1-CD1 4.03Å; I3153-I3218 HydrophobicContact CG1-CD1 3.82Å; I3153-I3232 HydrophobicContact CD1-CD1 3.95Å; I3153-L3234 HydrophobicContact CG2-CD1 4Å; I3153-L3234 HydrophobicContact CG2-CD2 4.05Å; I3153-L3234 HydrophobicContact CG2-CG 4.37Å
3154	S	74.4	Confident	75.4	Confident	27 Å²	27	54.9 Å²	54.9	19%	0.189	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	153.1	-177.5	64.2	0	0	0	0	110.4	Y3165	S3154-Y3165 PolarHBondContact O-N 2.82Å; S3154-Y3165 WeakPolarHBondContact OG-CD2 3.5Å
3155	T	75.1	Confident	76.4	Confident	44 Å²	44	47.1 Å²	47.1	27%	0.27	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	141.1	175.5	50.9	0	0	0	0	109.8	L3101 I3152 L3162 I3163 A3164	L3101-T3155 HydrophobicContact CD1-CG2 3.88Å; L3101-T3155 HydrophobicContact CD2-CG2 4.26Å; L3101-T3155 HydrophobicContact CG-CG2 4.4Å; I3152-T3155 HydrophobicContact CG2-CG2 3.97Å; T3155-L3162 HydrophobicContact CG2-CD1 4.49Å; T3155-I3163 WeakPolarHBondContact CA-O 3.41Å; T3155-A3164 HydrophobicContact CG2-CB 3.72Å
3156	H	76	Confident	77.1	Confident	85 Å²	85	45.9 Å²	45.9	39%	0.394	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	155.7	174.1	63.1	-69.7	0	0	0	110.4	I3163 Y3165	H3156-I3163 VanDerWaalsContact CE1-CG2 3.48Å; H3156-I3163 WeakPolarHBondContact CE1-CG2 3.37Å; H3156-I3163 PolarHBondContact N-O 3.35Å; H3156-I3163 PolarHBondContact O-N 2.74Å; H3156-Y3165 AromaticContact CE1-CE2 3.84Å
3157	F	73.5	Confident	77.7	Confident	65 Å²	65	39.7 Å²	39.7	29%	0.285	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.6	171.1	-86.3	-73.3	0	0	0	110.3	L3103 N3105 L3162 V3184	L3103-F3157 HydrophobicContact CB-CE2 4.05Å; L3103-F3157 HydrophobicContact CD1-CE2 3.82Å; L3103-F3157 HydrophobicContact CD1-CZ 3.89Å; L3103-F3157 HydrophobicContact CG-CE2 4.36Å; N3105-F3157 HydrophobicContact CB-CE2 4.23Å; N3105-F3157 WeakPolarHBondContact ND2-CE2 3.46Å; F3157-L3162 HydrophobicContact CD1-CB 4.39Å; F3157-L3162 HydrophobicContact CE1-CB 4.1Å; F3157-V3184 HydrophobicContact CE1-CB 4.32Å; F3157-V3184 HydrophobicContact CE1-CG2 3.85Å; F3157-V3184 HydrophobicContact CZ-CG2 4.48Å
3158	D	72.7	Confident	78.2	Confident	77 Å²	77	37.8 Å²	37.8	41%	0.412	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	101.4	158.3	-176.3	-2.7	0	0	0	107.9	K3160 T3161 I3163	D3158-K3160 PolarHBondContact O-N 2.76Å; D3158-T3161 PolarHBondContact N-O 3.36Å; D3158-T3161 PolarHBondContact O-N 3Å; D3158-T3161 VanDerWaalsContact O-O 3.14Å; D3158-T3161 PolarHBondContact O-OG1 2.96Å; D3158-I3163 HydrophobicContact CB-CD1 3.83Å; D3158-I3163 HydrophobicContact CB-CG1 4.44Å
3159	N	71.4	Confident	78.6	Confident	155 Å²	155	36.4 Å²	36.4	83%	0.829	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	-95.9	-177.8	-67.7	-84.8	0	0	0	114
3160	K	71.2	Confident	78.8	Confident	134 Å²	134	35.9 Å²	35.9	58%	0.583	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-20.4	176.5	-76.4	178	151.9	-146.5	0	113.3	D3158 V3184 S3185	D3158-K3160 PolarHBondContact O-N 2.76Å; K3160-V3184 PolarHBondContact O-N 2.87Å; K3160-S3185 PolarHBondContact NZ-OG 2.93Å; K3160-S3185 VanDerWaalsContact NZ-OG 3.07Å
3161	T	74.1	Confident	78.7	Confident	41 Å²	41	37 Å²	37	25%	0.252	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	125.9	-176.7	29.9	0	0	0	0	110.6	D3158 I3182 D3183	D3158-T3161 PolarHBondContact N-O 3.36Å; D3158-T3161 PolarHBondContact O-N 3Å; D3158-T3161 VanDerWaalsContact O-O 3.14Å; D3158-T3161 PolarHBondContact O-OG1 2.96Å; T3161-I3182 CarbonylContact C-O 3.56Å; T3161-I3182 VanDerWaalsContact CA-O 3.31Å; T3161-I3182 WeakPolarHBondContact CA-O 3.39Å; T3161-D3183 HydrophobicContact CG2-CB 4.4Å
3162	L	76.8	Confident	78.9	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	123.3	165.9	166.8	64.4	0	0	0	108.4	L3101 L3103 L3112 T3155 F3157 I3182 V3184	L3101-L3162 HydrophobicContact CD2-CD2 3.71Å; L3103-L3162 HydrophobicContact CD1-CD1 3.76Å; L3103-L3162 HydrophobicContact CD1-CD2 3.9Å; L3103-L3162 HydrophobicContact CD1-CG 4.41Å; L3103-L3162 HydrophobicContact CD2-CD1 3.76Å; L3103-L3162 HydrophobicContact CG-CD1 4.44Å; L3112-L3162 HydrophobicContact CD1-CD2 4.25Å; L3112-L3162 HydrophobicContact CD2-CD2 3.82Å; T3155-L3162 HydrophobicContact CG2-CD1 4.49Å; F3157-L3162 HydrophobicContact CD1-CB 4.39Å; F3157-L3162 HydrophobicContact CE1-CB 4.1Å; L3162-I3182 HydrophobicContact CB-CB 4.28Å; L3162-I3182 HydrophobicContact CD2-CD1 4.31Å; L3162-I3182 PolarHBondContact N-O 2.85Å; L3162-I3182 PolarHBondContact O-N 2.88Å; L3162-V3184 HydrophobicContact CB-CG2 3.73Å
3163	I	81.7	Confident	79.1	Confident	17 Å²	17	38.1 Å²	38.1	9%	0.087	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	118.4	172.2	-58.9	177.6	0	0	0	108.2	T3155 H3156 D3158 Y3165 K3179 C3180	T3155-I3163 WeakPolarHBondContact CA-O 3.41Å; H3156-I3163 VanDerWaalsContact CE1-CG2 3.48Å; H3156-I3163 WeakPolarHBondContact CE1-CG2 3.37Å; H3156-I3163 PolarHBondContact N-O 3.35Å; H3156-I3163 PolarHBondContact O-N 2.74Å; D3158-I3163 HydrophobicContact CB-CD1 3.83Å; D3158-I3163 HydrophobicContact CB-CG1 4.44Å; I3163-Y3165 HydrophobicContact CG2-CE2 4.21Å; I3163-K3179 HydrophobicContact CG2-CD 4.28Å; I3163-K3179 HydrophobicContact CG2-CG 4.01Å; I3163-C3180 WeakPolarHBondContact CA-O 3.4Å
3164	A	80.6	Confident	79.5	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.008	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.2	179.2	0	0	0	0	0	111.2	F3127 T3155 K3179 C3180	F3127-A3164 HydrophobicContact CE1-CB 4.49Å; T3155-A3164 HydrophobicContact CG2-CB 3.72Å; A3164-K3179 WeakPolarHBondContact O-CA 3.44Å; A3164-C3180 HydrophobicContact CB-CB 4.43Å; A3164-C3180 PolarHBondContact N-O 2.99Å; A3164-C3180 PolarHBondContact O-N 2.97Å
3165	Y	84.6	Confident	80	Confident	39 Å²	39	38.6 Å²	38.6	15%	0.153	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	123.9	171.6	-66.9	-84.1	0	0	0	109.8	I3153 S3154 H3156 I3163 F3178 K3179 I3196 L3234	I3153-Y3165 PolarHBondContact N-O 2.91Å; S3154-Y3165 PolarHBondContact O-N 2.82Å; S3154-Y3165 WeakPolarHBondContact OG-CD2 3.5Å; H3156-Y3165 AromaticContact CE1-CE2 3.84Å; I3163-Y3165 HydrophobicContact CG2-CE2 4.21Å; Y3165-F3178 WeakPolarHBondContact CA-O 3.44Å; Y3165-K3179 HydrophobicContact CD1-CB 3.91Å; Y3165-K3179 HydrophobicContact CD1-CG 4.42Å; Y3165-K3179 HydrophobicContact CE1-CB 3.83Å; Y3165-K3179 HydrophobicContact CE1-CD 3.82Å; Y3165-K3179 HydrophobicContact CE1-CG 4.02Å; Y3165-I3196 HydrophobicContact CD1-CD1 4.02Å; Y3165-I3196 HydrophobicContact CE1-CD1 3.66Å; Y3165-L3234 HydrophobicContact CD1-CD2 3.88Å; Y3165-L3234 HydrophobicContact CD2-CD1 4.22Å; Y3165-L3234 HydrophobicContact CD2-CD2 4.41Å; Y3165-L3234 HydrophobicContact CE1-CD2 4.26Å; Y3165-L3234 HydrophobicContact CE2-CD1 4.38Å; Y3165-L3234 HydrophobicContact CG-CD2 3.96Å
3166	L	84.7	Confident	80.5	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	129	-173	176.3	65.6	0	0	0	109.1	I3125 I3138 Y3150 L3168 F3178	I3125-L3166 HydrophobicContact CD1-CD2 4.1Å; I3125-L3166 HydrophobicContact CG2-CD2 4.19Å; I3138-L3166 HydrophobicContact CD1-CD2 4.06Å; Y3150-L3166 HydrophobicContact CD2-CD1 4.25Å; L3166-L3168 HydrophobicContact CD1-CD2 4.02Å; L3166-L3168 HydrophobicContact CD2-CD2 4Å; L3166-L3168 HydrophobicContact CG-CD2 3.77Å; L3166-L3168 HydrophobicContact CG-CG 4.39Å; L3166-F3178 HydrophobicContact CB-CB 4.44Å; L3166-F3178 PolarHBondContact N-O 3.25Å; L3166-F3178 PolarHBondContact O-N 2.76Å
3167	L	86.5	Confident	81.1	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	122.8	177.9	-166.5	71.3	0	0	0	109.9	Y3150 C3151 I3153 L3175 L3177 L3208 I3218 I3232	Y3150-L3167 CarbonylContact C-O 3.55Å; Y3150-L3167 VanDerWaalsContact CA-O 3.22Å; Y3150-L3167 WeakPolarHBondContact CA-O 3.33Å; C3151-L3167 PolarHBondContact N-O 3.01Å; C3151-L3167 PolarHBondContact O-N 3.32Å; I3153-L3167 HydrophobicContact CD1-CB 3.79Å; I3153-L3167 HydrophobicContact CD1-CD1 4.34Å; I3153-L3167 HydrophobicContact CD1-CD2 4.37Å; I3153-L3167 HydrophobicContact CD1-CG 4.41Å; I3153-L3167 HydrophobicContact CG1-CB 4.24Å; L3167-L3175 HydrophobicContact CD1-CB 4.23Å; L3167-L3175 HydrophobicContact CD2-CD1 4.39Å; L3167-L3175 HydrophobicContact CD2-CD2 3.89Å; L3167-L3175 HydrophobicContact CG-CB 4.49Å; L3167-L3175 HydrophobicContact CG-CD2 3.9Å; L3167-L3177 HydrophobicContact CD1-CB 3.99Å; L3167-L3177 HydrophobicContact CD1-CD1 4.31Å; L3167-L3208 HydrophobicContact CD2-CD1 4.5Å; L3167-I3218 HydrophobicContact CD2-CD1 3.49Å; L3167-I3218 VanDerWaalsContact CD2-CD1 3.49Å; L3167-I3218 HydrophobicContact CD2-CG2 4.49Å; L3167-I3232 HydrophobicContact CD1-CD1 4.14Å; L3167-I3232 HydrophobicContact CD2-CD1 3.92Å
3168	L	86.2	Confident	81.6	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.2	178.7	-52.6	-172.7	0	0	0	110.1	I3125 V3147 L3166 L3175 R3176 F3178	I3125-L3168 HydrophobicContact CD1-CD1 3.64Å; I3125-L3168 HydrophobicContact CD1-CD2 3.35Å; I3125-L3168 HydrophobicContact CD1-CG 4.16Å; V3147-L3168 HydrophobicContact CG2-CD1 4.47Å; L3166-L3168 HydrophobicContact CD1-CD2 4.02Å; L3166-L3168 HydrophobicContact CD2-CD2 4Å; L3166-L3168 HydrophobicContact CG-CD2 3.77Å; L3166-L3168 HydrophobicContact CG-CG 4.39Å; L3168-L3175 CarbonylContact O-C 3.5Å; L3168-L3175 WeakPolarHBondContact O-CA 3.47Å; L3168-R3176 PolarHBondContact N-O 3.16Å; L3168-R3176 PolarHBondContact O-N 2.98Å; L3168-F3178 HydrophobicContact CB-CE2 4.29Å; L3168-F3178 HydrophobicContact CD1-CD2 3.95Å; L3168-F3178 HydrophobicContact CD1-CE2 3.58Å; L3168-F3178 HydrophobicContact CD1-CZ 4.34Å; L3168-F3178 HydrophobicContact CG-CD2 3.95Å; L3168-F3178 HydrophobicContact CG-CE2 3.89Å
3169	A	85.2	Confident	82.3	Confident	2 Å²	2	29 Å²	29	2%	0.017	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	139	160.7	0	0	0	0	0	109.3	V3147 T3148 A3149 L3175 I3205 L3208	V3147-A3169 WeakPolarHBondContact CA-O 3.44Å; T3148-A3169 PolarHBondContact N-O 3.33Å; T3148-A3169 WeakPolarHBondContact OG1-CB 3.48Å; T3148-A3169 PolarHBondContact OG1-O 3.15Å; A3149-A3169 HydrophobicContact CB-CB 4.15Å; A3149-A3169 PolarHBondContact O-N 2.86Å; A3169-L3175 HydrophobicContact CB-CD2 3.85Å; A3169-I3205 HydrophobicContact CB-CB 3.81Å; A3169-I3205 HydrophobicContact CB-CD1 4.44Å; A3169-I3205 HydrophobicContact CB-CG2 4.03Å; A3169-L3208 HydrophobicContact CB-CD1 4.18Å
3170	T	83.3	Confident	82.9	Confident	2 Å²	2	21.6 Å²	21.6	1%	0.012	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	160.3	-178.8	42.5	0	0	0	0	112.2	L3145 Q3146 V3147 D3172 S3173 F3174 R3176	L3145-T3170 HydrophobicContact CB-CG2 4.37Å; Q3146-T3170 WeakPolarHBondContact O-CA 3.49Å; V3147-T3170 HydrophobicContact CG2-CG2 4.33Å; T3170-D3172 VanDerWaalsContact CB-OD1 3.24Å; T3170-D3172 WeakPolarHBondContact CB-OD1 3.44Å; T3170-D3172 PolarHBondContact O-N 3.37Å; T3170-D3172 PolarHBondContact OG1-OD1 3.07Å; T3170-S3173 PolarHBondContact O-N 3.24Å; T3170-F3174 PolarHBondContact N-O 2.99Å; T3170-F3174 VanDerWaalsContact N-O 3.17Å; T3170-F3174 PolarHBondContact OG1-O 2.85Å; T3170-R3176 PolarHBondContact OG1-NH1 3.18Å
3171	S	81.1	Confident	83.5	Confident	43 Å²	43	16.9 Å²	16.9	30%	0.301	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-16.6	-176.1	39.8	0	0	0	0	115.5	Q3146 S3173	Q3146-S3171 PolarHBondContact N-OG 2.77Å; Q3146-S3171 PolarHBondContact O-N 3.47Å; Q3146-S3171 PolarHBondContact O-OG 3.08Å; S3171-S3173 VanDerWaalsContact C-N 3.26Å; S3171-S3173 PolarHBondContact O-N 3.22Å
3172	D	83.5	Confident	83.6	Confident	45 Å²	45	15 Å²	15	24%	0.241	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	4.7	172.1	61	-16.9	0	0	0	114.6	L3145 T3170 F3174 R3176	L3145-D3172 WeakPolarHBondContact CD1-OD2 3.27Å; L3145-D3172 HydrophobicContact CD2-CB 3.67Å; T3170-D3172 VanDerWaalsContact CB-OD1 3.24Å; T3170-D3172 WeakPolarHBondContact CB-OD1 3.44Å; T3170-D3172 PolarHBondContact O-N 3.37Å; T3170-D3172 PolarHBondContact OG1-OD1 3.07Å; D3172-F3174 HydrophobicContact CB-CD2 4.05Å; D3172-F3174 VanDerWaalsContact O-CD2 3.27Å; D3172-F3174 WeakPolarHBondContact O-CD2 3.47Å; D3172-F3174 WeakPolarHBondContact OD2-CD2 3.35Å; D3172-R3176 VanDerWaalsContact CG-NH1 3.28Å; D3172-R3176 IonicContact OD1-CZ 3.61Å; D3172-R3176 IonicContact OD1-NH1 2.86Å; D3172-R3176 PolarHBondContact OD1-NH1 3.2Å; D3172-R3176 IonicContact OD2-CZ 3.45Å; D3172-R3176 VanDerWaalsContact OD2-CZ 3.23Å; D3172-R3176 IonicContact OD2-NH1 2.91Å; D3172-R3176 PolarHBondContact OD2-NH1 3.05Å; D3172-R3176 IonicContact OD2-NH2 3.17Å; D3172-R3176 PolarHBondContact OD2-NH2 3.45Å
3173	S	82.8	Confident	83.5	Confident	20 Å²	20	16.1 Å²	16.1	14%	0.14	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	65	46.1	-179.5	-51.8	0	0	0	0	114	T3170 S3171 T3201 G3202 E3203 Q3204	T3170-S3173 PolarHBondContact O-N 3.24Å; S3171-S3173 VanDerWaalsContact C-N 3.26Å; S3171-S3173 PolarHBondContact O-N 3.22Å; S3173-T3201 PolarHBondContact O-N 3.38Å; S3173-T3201 PolarHBondContact O-OG1 2.81Å; S3173-G3202 PolarHBondContact O-N 2.81Å; S3173-E3203 VanDerWaalsContact OG-C 3.26Å; S3173-Q3204 PolarHBondContact OG-N 2.85Å; S3173-Q3204 VanDerWaalsContact OG-N 3.14Å
3174	F	83.8	Confident	82.8	Confident	34 Å²	34	16.1 Å²	16.1	15%	0.149	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	149.7	174.1	-74.5	-89.4	0	0	0	111.4	T3170 D3172 I3198 Y3199 P3200	T3170-F3174 PolarHBondContact N-O 2.99Å; T3170-F3174 VanDerWaalsContact N-O 3.17Å; T3170-F3174 PolarHBondContact OG1-O 2.85Å; D3172-F3174 HydrophobicContact CB-CD2 4.05Å; D3172-F3174 VanDerWaalsContact O-CD2 3.27Å; D3172-F3174 WeakPolarHBondContact O-CD2 3.47Å; D3172-F3174 WeakPolarHBondContact OD2-CD2 3.35Å; F3174-I3198 HydrophobicContact CB-CG2 4.04Å; F3174-I3198 HydrophobicContact CD1-CG2 3.48Å; F3174-I3198 VanDerWaalsContact CD1-CG2 3.48Å; F3174-I3198 HydrophobicContact CE1-CG2 4.21Å; F3174-I3198 HydrophobicContact CG-CG2 4.06Å; F3174-Y3199 CarbonylContact C-O 3.49Å; F3174-Y3199 WeakPolarHBondContact CA-O 3.39Å; F3174-P3200 VanDerWaalsContact CD1-CA 3.45Å; F3174-P3200 HydrophobicContact CD1-CB 3.9Å; F3174-P3200 HydrophobicContact CE1-CB 3.63Å; F3174-P3200 HydrophobicContact CE1-CG 4.41Å; F3174-P3200 HydrophobicContact CZ-CB 4.37Å
3175	L	84.6	Confident	81.8	Confident	3 Å²	3	17.1 Å²	17.1	2%	0.016	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	125.1	164.9	-75.7	164.7	0	0	0	110.2	L3167 L3168 A3169 I3198 Y3199 T3201 I3205 L3208	L3167-L3175 HydrophobicContact CD1-CB 4.23Å; L3167-L3175 HydrophobicContact CD2-CD1 4.39Å; L3167-L3175 HydrophobicContact CD2-CD2 3.89Å; L3167-L3175 HydrophobicContact CG-CB 4.49Å; L3167-L3175 HydrophobicContact CG-CD2 3.9Å; L3168-L3175 CarbonylContact O-C 3.5Å; L3168-L3175 WeakPolarHBondContact O-CA 3.47Å; A3169-L3175 HydrophobicContact CB-CD2 3.85Å; L3175-I3198 CarbonylContact O-C 3.49Å; L3175-I3198 WeakPolarHBondContact O-CA 3.2Å; L3175-Y3199 HydrophobicContact CB-CD2 4.28Å; L3175-Y3199 PolarHBondContact N-O 3.48Å; L3175-Y3199 PolarHBondContact O-N 3.49Å; L3175-T3201 HydrophobicContact CB-CG2 4.27Å; L3175-T3201 HydrophobicContact CD1-CG2 3.51Å; L3175-T3201 HydrophobicContact CG-CG2 3.57Å; L3175-I3205 HydrophobicContact CD1-CD1 3.76Å; L3175-I3205 HydrophobicContact CD2-CD1 3.81Å; L3175-I3205 HydrophobicContact CG-CD1 3.8Å; L3175-L3208 HydrophobicContact CD2-CD1 3.85Å; L3175-L3208 HydrophobicContact CD2-CD2 3.92Å; L3175-L3208 HydrophobicContact CD2-CG 4.47Å
3176	R	86.5	Confident	80.4	Confident	18 Å²	18	19.9 Å²	19.9	7%	0.068	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	118.4	179.3	-67.7	173.1	162.2	71.3	-1.4	109.7	L3168 T3170 D3172 F3178 I3198	L3168-R3176 PolarHBondContact N-O 3.16Å; L3168-R3176 PolarHBondContact O-N 2.98Å; T3170-R3176 PolarHBondContact OG1-NH1 3.18Å; D3172-R3176 VanDerWaalsContact CG-NH1 3.28Å; D3172-R3176 IonicContact OD1-CZ 3.61Å; D3172-R3176 IonicContact OD1-NH1 2.86Å; D3172-R3176 PolarHBondContact OD1-NH1 3.2Å; D3172-R3176 IonicContact OD2-CZ 3.45Å; D3172-R3176 VanDerWaalsContact OD2-CZ 3.23Å; D3172-R3176 IonicContact OD2-NH1 2.91Å; D3172-R3176 PolarHBondContact OD2-NH1 3.05Å; D3172-R3176 IonicContact OD2-NH2 3.17Å; D3172-R3176 PolarHBondContact OD2-NH2 3.45Å; R3176-F3178 HydrophobicContact CB-CD2 4.24Å; R3176-F3178 HydrophobicContact CB-CE2 3.49Å; R3176-F3178 VanDerWaalsContact CB-CE2 3.49Å; R3176-F3178 HydrophobicContact CB-CZ 4.15Å; R3176-F3178 WeakPolarHBondContact O-CD2 3.2Å; R3176-I3198 HydrophobicContact CG-CG1 4.27Å; R3176-I3198 HydrophobicContact CG-CG2 4.35Å
3177	L	87.2	Confident	78.9	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	118.3	177.2	175.8	63.2	0	0	0	109.9	I3153 L3167 Q3195 I3196 K3197 L3234	I3153-L3177 HydrophobicContact CD1-CD1 3.54Å; L3167-L3177 HydrophobicContact CD1-CB 3.99Å; L3167-L3177 HydrophobicContact CD1-CD1 4.31Å; L3177-Q3195 CarbonylContact O-C 3.56Å; L3177-I3196 HydrophobicContact CD2-CB 4.32Å; L3177-I3196 HydrophobicContact CD2-CD1 4.46Å; L3177-I3196 HydrophobicContact CG-CB 4.38Å; L3177-I3196 HydrophobicContact CG-CD1 4.47Å; L3177-I3196 PolarHBondContact O-N 2.85Å; L3177-K3197 HydrophobicContact CB-CB 4.22Å; L3177-K3197 HydrophobicContact CD2-CB 4.3Å; L3177-K3197 HydrophobicContact CD2-CD 4.14Å; L3177-K3197 HydrophobicContact CD2-CG 4.41Å; L3177-K3197 PolarHBondContact N-O 2.88Å; L3177-L3234 HydrophobicContact CD2-CD2 4.42Å
3178	F	85.8	Confident	77.3	Confident	3 Å²	3	31.5 Å²	31.5	1%	0.013	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	150.7	174.1	-64.1	-95.2	0	0	0	111.1	L3140 Y3165 L3166 L3168 R3176 W3193 E3194 Q3195	L3140-F3178 HydrophobicContact CD2-CZ 4.19Å; Y3165-F3178 WeakPolarHBondContact CA-O 3.44Å; L3166-F3178 HydrophobicContact CB-CB 4.44Å; L3166-F3178 PolarHBondContact N-O 3.25Å; L3166-F3178 PolarHBondContact O-N 2.76Å; L3168-F3178 HydrophobicContact CB-CE2 4.29Å; L3168-F3178 HydrophobicContact CD1-CD2 3.95Å; L3168-F3178 HydrophobicContact CD1-CE2 3.58Å; L3168-F3178 HydrophobicContact CD1-CZ 4.34Å; L3168-F3178 HydrophobicContact CG-CD2 3.95Å; L3168-F3178 HydrophobicContact CG-CE2 3.89Å; R3176-F3178 HydrophobicContact CB-CD2 4.24Å; R3176-F3178 HydrophobicContact CB-CE2 3.49Å; R3176-F3178 VanDerWaalsContact CB-CE2 3.49Å; R3176-F3178 HydrophobicContact CB-CZ 4.15Å; R3176-F3178 WeakPolarHBondContact O-CD2 3.2Å; F3178-W3193 AromaticContact CD1-CE3 3.82Å; F3178-W3193 HydrophobicContact CD1-CE3 3.82Å; F3178-W3193 HydrophobicContact CD1-CZ3 4.13Å; F3178-W3193 AromaticContact CE1-CE3 3.93Å; F3178-W3193 HydrophobicContact CE1-CE3 3.93Å; F3178-W3193 AromaticContact CE1-CZ3 3.74Å; F3178-W3193 HydrophobicContact CE1-CZ3 3.74Å; F3178-E3194 CarbonylContact C-O 3.52Å; F3178-E3194 VanDerWaalsContact CA-O 3.29Å; F3178-E3194 WeakPolarHBondContact CA-O 3.4Å; F3178-Q3195 HydrophobicContact CD1-CB 3.85Å; F3178-Q3195 HydrophobicContact CD1-CG 4.22Å; F3178-Q3195 HydrophobicContact CE1-CB 3.69Å; F3178-Q3195 HydrophobicContact CE1-CG 3.9Å; F3178-Q3195 HydrophobicContact CE2-CG 4.49Å; F3178-Q3195 HydrophobicContact CZ-CB 4.34Å; F3178-Q3195 HydrophobicContact CZ-CG 4.04Å
3179	K	86.4	Confident	75.8	Confident	48 Å²	48	40.6 Å²	40.6	21%	0.209	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124	166.5	163.6	179.4	157	-141.5	0	108.7	I3163 A3164 Y3165 W3193 E3194 I3196	I3163-K3179 HydrophobicContact CG2-CD 4.28Å; I3163-K3179 HydrophobicContact CG2-CG 4.01Å; A3164-K3179 WeakPolarHBondContact O-CA 3.44Å; Y3165-K3179 HydrophobicContact CD1-CB 3.91Å; Y3165-K3179 HydrophobicContact CD1-CG 4.42Å; Y3165-K3179 HydrophobicContact CE1-CB 3.83Å; Y3165-K3179 HydrophobicContact CE1-CD 3.82Å; Y3165-K3179 HydrophobicContact CE1-CG 4.02Å; K3179-W3193 CarbonylContact O-C 3.57Å; K3179-W3193 VanDerWaalsContact O-CA 3.3Å; K3179-W3193 WeakPolarHBondContact O-CA 3.25Å; K3179-E3194 HydrophobicContact CB-CG 4.08Å; K3179-E3194 VanDerWaalsContact CD-OE1 3.32Å; K3179-E3194 WeakPolarHBondContact CD-OE1 3.39Å; K3179-E3194 WeakPolarHBondContact CE-OE1 3.48Å; K3179-E3194 HydrophobicContact CG-CG 4.46Å; K3179-E3194 PolarHBondContact N-O 2.89Å; K3179-E3194 IonicContact NZ-OE1 3.93Å; K3179-E3194 PolarHBondContact NZ-OE1 2.79Å; K3179-E3194 PolarHBondContact O-N 3.22Å; K3179-I3196 HydrophobicContact CB-CD1 3.54Å; K3179-I3196 HydrophobicContact CB-CG1 4.08Å; K3179-I3196 HydrophobicContact CD-CD1 4.2Å
3180	C	84.2	Confident	74.6	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118.1	179.9	-58.3	0	0	0	0	108.2	F3127 L3136 I3163 A3164 I3182	F3127-C3180 HydrophobicContact CZ-CB 4.44Å; L3136-C3180 HydrophobicContact CD2-CB 3.66Å; I3163-C3180 WeakPolarHBondContact CA-O 3.4Å; A3164-C3180 HydrophobicContact CB-CB 4.43Å; A3164-C3180 PolarHBondContact N-O 2.99Å; A3164-C3180 PolarHBondContact O-N 2.97Å; C3180-I3182 HydrophobicContact CB-CD1 4.17Å; C3180-I3182 HydrophobicContact CB-CG1 4.25Å
3181	S	83.1	Confident	73.9	Confident	36 Å²	36	44 Å²	44	25%	0.252	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	113.5	169.8	-56.7	0	0	0	0	107.7	S3191 K3192	S3181-S3191 CarbonylContact O-C 3.6Å; S3181-S3191 VanDerWaalsContact O-CA 3.31Å; S3181-S3191 WeakPolarHBondContact O-CA 3.4Å; S3181-K3192 PolarHBondContact N-O 2.8Å; S3181-K3192 PolarHBondContact O-N 2.96Å
3182	I	77	Confident	73.8	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122.8	-169.5	-62.7	167.2	0	0	0	107.6	F3127 L3135 L3136 T3161 L3162 C3180	F3127-I3182 HydrophobicContact CB-CD1 4.23Å; F3127-I3182 HydrophobicContact CD1-CD1 3.35Å; F3127-I3182 HydrophobicContact CD2-CD1 4.21Å; F3127-I3182 HydrophobicContact CE1-CD1 3.59Å; F3127-I3182 HydrophobicContact CE2-CD1 4.42Å; F3127-I3182 HydrophobicContact CG-CD1 3.68Å; F3127-I3182 HydrophobicContact CZ-CD1 4.13Å; L3135-I3182 HydrophobicContact CB-CG2 3.79Å; L3135-I3182 HydrophobicContact CD1-CG2 3.46Å; L3135-I3182 VanDerWaalsContact CD1-CG2 3.46Å; L3135-I3182 HydrophobicContact CG-CG2 4.31Å; L3136-I3182 HydrophobicContact CB-CG1 4.36Å; L3136-I3182 HydrophobicContact CD2-CD1 4.25Å; L3136-I3182 HydrophobicContact CD2-CG1 3.93Å; T3161-I3182 CarbonylContact C-O 3.56Å; T3161-I3182 VanDerWaalsContact CA-O 3.31Å; T3161-I3182 WeakPolarHBondContact CA-O 3.39Å; L3162-I3182 HydrophobicContact CB-CB 4.28Å; L3162-I3182 HydrophobicContact CD2-CD1 4.31Å; L3162-I3182 PolarHBondContact N-O 2.85Å; L3162-I3182 PolarHBondContact O-N 2.88Å; C3180-I3182 HydrophobicContact CB-CD1 4.17Å; C3180-I3182 HydrophobicContact CB-CG1 4.25Å
3183	D	73.5	Confident	73.7	Confident	24 Å²	24	51.5 Å²	51.5	13%	0.128	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	138.6	173.4	-154.9	-39	0	0	0	110.1	T3161 S3185 S3190 S3191	T3161-D3183 HydrophobicContact CG2-CB 4.4Å; D3183-S3185 VanDerWaalsContact OD1-CB 3.26Å; D3183-S3185 WeakPolarHBondContact OD1-CB 3.32Å; D3183-S3185 PolarHBondContact OD1-N 2.86Å; D3183-S3185 PolarHBondContact OD1-OG 2.88Å; D3183-S3190 WeakPolarHBondContact CB-OG 3.3Å; D3183-S3190 PolarHBondContact OD2-OG 2.83Å; D3183-S3191 PolarHBondContact N-OG 3.5Å
3184	V	67.2	Low	73.7	Confident	17 Å²	17	55.1 Å²	55.1	10%	0.103	28%	0.279	C	S	.	.			trans	-113.4	10.1	-178.4	-159.9	0	0	0	0	111	K3110 F3157 K3160 L3162	K3110-V3184 HydrophobicContact CD-CG1 3.53Å; K3110-V3184 PolarHBondContact NZ-O 3.16Å; F3157-V3184 HydrophobicContact CE1-CB 4.32Å; F3157-V3184 HydrophobicContact CE1-CG2 3.85Å; F3157-V3184 HydrophobicContact CZ-CG2 4.48Å; K3160-V3184 PolarHBondContact O-N 2.87Å; L3162-V3184 HydrophobicContact CB-CG2 3.73Å
3185	S	61.2	Low	73.7	Confident	23 Å²	23	57.3 Å²	57.3	16%	0.161	29%	0.29	C	S	.	.	S	Bend	trans	-82.3	146	151	-27.9	0	0	0	0	108.9	K3160 D3183 E3187	K3160-S3185 PolarHBondContact NZ-OG 2.93Å; K3160-S3185 VanDerWaalsContact NZ-OG 3.07Å; D3183-S3185 VanDerWaalsContact OD1-CB 3.26Å; D3183-S3185 WeakPolarHBondContact OD1-CB 3.32Å; D3183-S3185 PolarHBondContact OD1-N 2.86Å; D3183-S3185 PolarHBondContact OD1-OG 2.88Å; S3185-E3187 PolarHBondContact O-N 2.86Å
3186	D	55.2	Low	73.7	Confident	97 Å²	97	60.5 Å²	60.5	52%	0.519	31%	0.307	S	S	.	.	S	Bend	trans	-75.2	25.8	-179	-51.9	-90.4	0	0	0	114.4	N3129 N3131	N3129-D3186 PolarHBondContact ND2-OD1 3.49Å; N3131-D3186 PolarHBondContact ND2-OD1 2.81Å
3187	E	52.7	Low	73.6	Confident	149 Å²	149	62.8 Å²	62.8	70%	0.696	32%	0.317	S	S	*	.			trans	-97.9	91.6	174.2	-71.7	177.8	-161.4	0	0	109.2	S3185 E3189 S3190	S3185-E3187 PolarHBondContact O-N 2.86Å; E3187-E3189 VanDerWaalsContact C-N 3.29Å; E3187-E3189 PolarHBondContact O-N 3.04Å; E3187-E3189 VanDerWaalsContact O-N 3.08Å; E3187-S3190 PolarHBondContact O-OG 2.92Å
3188	S	52.5	Low	73.4	Confident	96 Å²	96	65.9 Å²	65.9	67%	0.671	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	3	-160.3	53.1	0	0	0	0	117.8
3189	E	54.4	Low	73.1	Confident	192 Å²	192	68.9 Å²	68.9	90%	0.897	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-7.2	-172.9	-62.5	-165.6	154.7	0	0	115.1	E3187	E3187-E3189 VanDerWaalsContact C-N 3.29Å; E3187-E3189 PolarHBondContact O-N 3.04Å; E3187-E3189 VanDerWaalsContact O-N 3.08Å
3190	S	59.7	Low	72.6	Confident	52 Å²	52	69 Å²	69	36%	0.364	35%	0.351	S	S	.	.			trans	-95.5	-21.5	-171.6	45.3	0	0	0	0	115.4	D3183 E3187	D3183-S3190 WeakPolarHBondContact CB-OG 3.3Å; D3183-S3190 PolarHBondContact OD2-OG 2.83Å; E3187-S3190 PolarHBondContact O-OG 2.92Å
3191	S	68.7	Low	72	Confident	23 Å²	23	69.8 Å²	69.8	16%	0.161	36%	0.355	C	S	.	.			trans	-66	131.8	-175.7	-62.3	0	0	0	0	113.6	L3135 S3181 D3183	L3135-S3191 WeakPolarHBondContact O-CB 3.1Å; L3135-S3191 PolarHBondContact O-OG 2.89Å; S3181-S3191 CarbonylContact O-C 3.6Å; S3181-S3191 VanDerWaalsContact O-CA 3.31Å; S3181-S3191 WeakPolarHBondContact O-CA 3.4Å; D3183-S3191 PolarHBondContact N-OG 3.5Å
3192	K	79.5	Confident	71.3	Confident	143 Å²	143	69.2 Å²	69.2	62%	0.622	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.9	155	-175.7	-68.5	177	-174.3	169.9	0	112.6	S3181	S3181-K3192 PolarHBondContact N-O 2.8Å; S3181-K3192 PolarHBondContact O-N 2.96Å
3193	W	81.5	Confident	71	Confident	104 Å²	104	71.9 Å²	71.9	39%	0.394	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.5	170	59.9	-99	0	0	0	111.9	L3136 I3138 F3178 K3179	L3136-W3193 HydrophobicContact CD2-CB 4.49Å; I3138-W3193 HydrophobicContact CG1-CG 4.2Å; I3138-W3193 HydrophobicContact CG2-CD2 4.23Å; I3138-W3193 HydrophobicContact CG2-CG 4.48Å; I3138-W3193 HydrophobicContact CG2-CZ2 4.23Å; F3178-W3193 AromaticContact CD1-CE3 3.82Å; F3178-W3193 HydrophobicContact CD1-CE3 3.82Å; F3178-W3193 HydrophobicContact CD1-CZ3 4.13Å; F3178-W3193 AromaticContact CE1-CE3 3.93Å; F3178-W3193 HydrophobicContact CE1-CE3 3.93Å; F3178-W3193 AromaticContact CE1-CZ3 3.74Å; F3178-W3193 HydrophobicContact CE1-CZ3 3.74Å; K3179-W3193 CarbonylContact O-C 3.57Å; K3179-W3193 VanDerWaalsContact O-CA 3.3Å; K3179-W3193 WeakPolarHBondContact O-CA 3.25Å
3194	E	83.9	Confident	71.4	Confident	95 Å²	95	72.9 Å²	72.9	44%	0.444	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	141.3	172.6	66.7	-174.6	159	0	0	110.8	F3178 K3179 I3196	F3178-E3194 CarbonylContact C-O 3.52Å; F3178-E3194 VanDerWaalsContact CA-O 3.29Å; F3178-E3194 WeakPolarHBondContact CA-O 3.4Å; K3179-E3194 HydrophobicContact CB-CG 4.08Å; K3179-E3194 VanDerWaalsContact CD-OE1 3.32Å; K3179-E3194 WeakPolarHBondContact CD-OE1 3.39Å; K3179-E3194 WeakPolarHBondContact CE-OE1 3.48Å; K3179-E3194 HydrophobicContact CG-CG 4.46Å; K3179-E3194 PolarHBondContact N-O 2.89Å; K3179-E3194 IonicContact NZ-OE1 3.93Å; K3179-E3194 PolarHBondContact NZ-OE1 2.79Å; K3179-E3194 PolarHBondContact O-N 3.22Å; E3194-I3196 HydrophobicContact CG-CG1 4.33Å
3195	Q	84.1	Confident	72.2	Confident	81 Å²	81	72.1 Å²	72.1	38%	0.379	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	113.2	174	-171.6	-164.3	-116	0	0	109.1	L3177 F3178	L3177-Q3195 CarbonylContact O-C 3.56Å; F3178-Q3195 HydrophobicContact CD1-CB 3.85Å; F3178-Q3195 HydrophobicContact CD1-CG 4.22Å; F3178-Q3195 HydrophobicContact CE1-CB 3.69Å; F3178-Q3195 HydrophobicContact CE1-CG 3.9Å; F3178-Q3195 HydrophobicContact CE2-CG 4.49Å; F3178-Q3195 HydrophobicContact CZ-CB 4.34Å; F3178-Q3195 HydrophobicContact CZ-CG 4.04Å
3196	I	83.8	Confident	73.2	Confident	70 Å²	70	74 Å²	74	36%	0.359	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-50.6	-171.7	-48.8	176.2	0	0	0	112	Y3165 L3177 K3179 E3194	Y3165-I3196 HydrophobicContact CD1-CD1 4.02Å; Y3165-I3196 HydrophobicContact CE1-CD1 3.66Å; L3177-I3196 HydrophobicContact CD2-CB 4.32Å; L3177-I3196 HydrophobicContact CD2-CD1 4.46Å; L3177-I3196 HydrophobicContact CG-CB 4.38Å; L3177-I3196 HydrophobicContact CG-CD1 4.47Å; L3177-I3196 PolarHBondContact O-N 2.85Å; K3179-I3196 HydrophobicContact CB-CD1 3.54Å; K3179-I3196 HydrophobicContact CB-CG1 4.08Å; K3179-I3196 HydrophobicContact CD-CD1 4.2Å; E3194-I3196 HydrophobicContact CG-CG1 4.33Å
3197	K	83.4	Confident	74.6	Confident	66 Å²	66	71.9 Å²	71.9	29%	0.287	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	150.3	-171.5	-62.8	171.9	-171.2	156.6	0	110	L3177 Y3199 E3233 L3234	L3177-K3197 HydrophobicContact CB-CB 4.22Å; L3177-K3197 HydrophobicContact CD2-CB 4.3Å; L3177-K3197 HydrophobicContact CD2-CD 4.14Å; L3177-K3197 HydrophobicContact CD2-CG 4.41Å; L3177-K3197 PolarHBondContact N-O 2.88Å; K3197-Y3199 HydrophobicContact CB-CE1 4.47Å; K3197-Y3199 HydrophobicContact CB-CE2 4.02Å; K3197-Y3199 HydrophobicContact CD-CE1 4.49Å; K3197-Y3199 WeakPolarHBondContact CD-OH 3.31Å; K3197-E3233 PolarHBondContact NZ-O 2.87Å; K3197-L3234 PolarHBondContact NZ-OXT 3.17Å
3198	I	83.1	Confident	76.2	Confident	64 Å²	64	65.3 Å²	65.3	33%	0.328	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	135.2	168.9	-54.2	-177.4	0	0	0	107.7	F3174 L3175 R3176	F3174-I3198 HydrophobicContact CB-CG2 4.04Å; F3174-I3198 HydrophobicContact CD1-CG2 3.48Å; F3174-I3198 VanDerWaalsContact CD1-CG2 3.48Å; F3174-I3198 HydrophobicContact CE1-CG2 4.21Å; F3174-I3198 HydrophobicContact CG-CG2 4.06Å; L3175-I3198 CarbonylContact O-C 3.49Å; L3175-I3198 WeakPolarHBondContact O-CA 3.2Å; R3176-I3198 HydrophobicContact CG-CG1 4.27Å; R3176-I3198 HydrophobicContact CG-CG2 4.35Å
3199	Y	79.7	Confident	77.6	Confident	66 Å²	66	61.4 Å²	61.4	26%	0.259	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	124.8	176.9	-48.8	-83.8	0	0	0	110.2	F3174 L3175 K3197 T3201 I3232	F3174-Y3199 CarbonylContact C-O 3.49Å; F3174-Y3199 WeakPolarHBondContact CA-O 3.39Å; L3175-Y3199 HydrophobicContact CB-CD2 4.28Å; L3175-Y3199 PolarHBondContact N-O 3.48Å; L3175-Y3199 PolarHBondContact O-N 3.49Å; K3197-Y3199 HydrophobicContact CB-CE1 4.47Å; K3197-Y3199 HydrophobicContact CB-CE2 4.02Å; K3197-Y3199 HydrophobicContact CD-CE1 4.49Å; K3197-Y3199 WeakPolarHBondContact CD-OH 3.31Å; Y3199-T3201 PolarHBondContact O-N 3.4Å; Y3199-I3232 HydrophobicContact CE2-CD1 4.32Å
3200	P	76	Confident	78.7	Confident	52 Å²	52	53.9 Å²	53.9	34%	0.338	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	125.6	171.5	27.6	-31.3	0	0	0	110.1	F3174	F3174-P3200 VanDerWaalsContact CD1-CA 3.45Å; F3174-P3200 HydrophobicContact CD1-CB 3.9Å; F3174-P3200 HydrophobicContact CE1-CB 3.63Å; F3174-P3200 HydrophobicContact CE1-CG 4.41Å; F3174-P3200 HydrophobicContact CZ-CB 4.37Å
3201	T	71.7	Confident	79.4	Confident	16 Å²	16	51.6 Å²	51.6	10%	0.098	25%	0.25	C	S	.	.			trans	-97.6	-18.4	173.9	59.1	0	0	0	0	111.7	S3173 L3175 Y3199 E3203 I3205	S3173-T3201 PolarHBondContact O-N 3.38Å; S3173-T3201 PolarHBondContact O-OG1 2.81Å; L3175-T3201 HydrophobicContact CB-CG2 4.27Å; L3175-T3201 HydrophobicContact CD1-CG2 3.51Å; L3175-T3201 HydrophobicContact CG-CG2 3.57Å; Y3199-T3201 PolarHBondContact O-N 3.4Å; T3201-E3203 PolarHBondContact O-N 3.42Å; T3201-E3203 PolarHBondContact OG1-O 3.05Å; T3201-I3205 HydrophobicContact CG2-CD1 3.64Å; T3201-I3205 HydrophobicContact CG2-CG1 4.45Å
3202	G	67.7	Low	79.4	Confident	23 Å²	23	52.6 Å²	52.6	24%	0.237	25%	0.254	C	S	.	.	S	Bend	trans	79.1	-25.8	174.3	0	0	0	0	0	115.4	A2760 S3173	A2760-G3202 WeakPolarHBondContact CB-O 3.3Å; S3173-G3202 PolarHBondContact O-N 2.81Å
3203	E	72.7	Confident	78.7	Confident	56 Å²	56	53 Å²	53	26%	0.262	26%	0.256	S	S	.	.	S	Bend	trans	-130.6	154.3	167.9	-179.7	166.5	-143.6	0	0	111	S3173 T3201 I3205 L3222 Q3223 S3224	S3173-E3203 VanDerWaalsContact OG-C 3.26Å; T3201-E3203 PolarHBondContact O-N 3.42Å; T3201-E3203 PolarHBondContact OG1-O 3.05Å; E3203-I3205 PolarHBondContact O-N 3.17Å; E3203-L3222 HydrophobicContact CB-CD1 4.45Å; E3203-L3222 HydrophobicContact CB-CD2 4.25Å; E3203-L3222 HydrophobicContact CG-CB 4.28Å; E3203-L3222 WeakPolarHBondContact OE2-CB 3.41Å; E3203-Q3223 HydrophobicContact CG-CB 4.07Å; E3203-S3224 VanDerWaalsContact CD-N 3.3Å; E3203-S3224 WeakPolarHBondContact OE1-CB 3.34Å; E3203-S3224 PolarHBondContact OE1-N 3.08Å; E3203-S3224 WeakPolarHBondContact OE2-CB 3.49Å; E3203-S3224 PolarHBondContact OE2-N 3.05Å; E3203-S3224 PolarHBondContact OE2-OG 3.34Å
3204	Q	80.4	Confident	78	Confident	45 Å²	45	54.9 Å²	54.9	21%	0.21	27%	0.273	C	S	.	.			trans	-65	113.8	178.6	-170.9	-174.9	2.9	0	0	110.4	T3148 S3173 K3206 Q3223	T3148-Q3204 HydrophobicContact CG2-CG 3.91Å; S3173-Q3204 PolarHBondContact OG-N 2.85Å; S3173-Q3204 VanDerWaalsContact OG-N 3.14Å; Q3204-K3206 VanDerWaalsContact NE2-NZ 3.15Å; Q3204-Q3223 PolarHBondContact O-N 2.75Å
3205	I	84.6	Confident	77.2	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	135.3	170.2	-71.2	168.9	0	0	0	109.7	T3148 A3149 A3169 L3175 T3201 E3203 K3207 L3208 C3220 C3221 L3222	T3148-I3205 VanDerWaalsContact CB-O 3.28Å; T3148-I3205 WeakPolarHBondContact CB-O 3.32Å; T3148-I3205 PolarHBondContact OG1-O 3.11Å; A3149-I3205 HydrophobicContact CB-CG2 4.07Å; A3169-I3205 HydrophobicContact CB-CB 3.81Å; A3169-I3205 HydrophobicContact CB-CD1 4.44Å; A3169-I3205 HydrophobicContact CB-CG2 4.03Å; L3175-I3205 HydrophobicContact CD1-CD1 3.76Å; L3175-I3205 HydrophobicContact CD2-CD1 3.81Å; L3175-I3205 HydrophobicContact CG-CD1 3.8Å; T3201-I3205 HydrophobicContact CG2-CD1 3.64Å; T3201-I3205 HydrophobicContact CG2-CG1 4.45Å; E3203-I3205 PolarHBondContact O-N 3.17Å; I3205-K3207 VanDerWaalsContact CG2-O 3.22Å; I3205-K3207 WeakPolarHBondContact CG2-O 3.24Å; I3205-L3208 HydrophobicContact CD1-CD2 4.14Å; I3205-L3208 HydrophobicContact CG2-CD2 4Å; I3205-L3208 HydrophobicContact CG2-CG 3.97Å; I3205-C3220 HydrophobicContact CD1-CB 3.64Å; I3205-C3220 HydrophobicContact CG1-CB 4.16Å; I3205-C3221 CarbonylContact C-O 3.6Å; I3205-C3221 WeakPolarHBondContact CA-O 3.45Å; I3205-L3222 HydrophobicContact CG1-CD2 3.54Å
3206	K	82.8	Confident	76.7	Confident	62 Å²	62	49.4 Å²	49.4	27%	0.27	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-25.3	175	-61.7	-60.7	-179.8	-174.9	0	113.5	P2822 I2823 Q3204 C3221 Q3223	P2822-K3206 HydrophobicContact CB-CG 4.4Å; I2823-K3206 VanDerWaalsContact O-CB 3.27Å; I2823-K3206 WeakPolarHBondContact O-CB 3.12Å; Q3204-K3206 VanDerWaalsContact NE2-NZ 3.15Å; K3206-C3221 PolarHBondContact N-O 3.4Å; K3206-Q3223 HydrophobicContact CG-CB 4.42Å
3207	K	83.8	Confident	76.5	Confident	54 Å²	54	47 Å²	47	24%	0.235	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	141.5	174.6	-161.4	72.7	176.9	-173	0	111.3	A2826 I3205 V3209 C3221	A2826-K3207 HydrophobicContact CB-CG 4.34Å; I3205-K3207 VanDerWaalsContact CG2-O 3.22Å; I3205-K3207 WeakPolarHBondContact CG2-O 3.24Å; K3207-V3209 HydrophobicContact CG-CG2 4.28Å; K3207-C3221 HydrophobicContact CB-CB 3.96Å; K3207-C3221 PolarHBondContact O-N 3.24Å
3208	L	85.7	Confident	76.4	Confident	10 Å²	10	43.9 Å²	43.9	5%	0.052	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138	169.9	-72.5	172.2	0	0	0	109	A3149 C3151 L3167 A3169 L3175 I3205 I3218 C3220	A3149-L3208 HydrophobicContact CB-CB 4.3Å; A3149-L3208 HydrophobicContact CB-CD1 4.09Å; A3149-L3208 HydrophobicContact CB-CG 3.88Å; C3151-L3208 HydrophobicContact CB-CB 3.91Å; L3167-L3208 HydrophobicContact CD2-CD1 4.5Å; A3169-L3208 HydrophobicContact CB-CD1 4.18Å; L3175-L3208 HydrophobicContact CD2-CD1 3.85Å; L3175-L3208 HydrophobicContact CD2-CD2 3.92Å; L3175-L3208 HydrophobicContact CD2-CG 4.47Å; I3205-L3208 HydrophobicContact CD1-CD2 4.14Å; I3205-L3208 HydrophobicContact CG2-CD2 4Å; I3205-L3208 HydrophobicContact CG2-CG 3.97Å; L3208-I3218 HydrophobicContact CD2-CG2 3.96Å; L3208-C3220 HydrophobicContact CD2-CB 4.29Å; L3208-C3220 WeakPolarHBondContact CD2-SG 3.46Å
3209	V	81.9	Confident	76.5	Confident	15 Å²	15	40.8 Å²	40.8	9%	0.091	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	116.6	175.2	-176.2	0	0	0	0	109.6	A2826 Y2828 K3207 I3218 M3219	A2826-V3209 HydrophobicContact CB-CG2 3.89Å; A2826-V3209 WeakPolarHBondContact O-CG2 3.3Å; Y2828-V3209 HydrophobicContact CD1-CG1 3.76Å; Y2828-V3209 HydrophobicContact CE1-CG1 4.23Å; K3207-V3209 HydrophobicContact CG-CG2 4.28Å; V3209-I3218 WeakPolarHBondContact O-CA 3.39Å; V3209-M3219 HydrophobicContact CB-CB 4.34Å; V3209-M3219 HydrophobicContact CB-CE 3.91Å; V3209-M3219 HydrophobicContact CG1-CE 4.29Å; V3209-M3219 HydrophobicContact CG2-CE 3.96Å; V3209-M3219 PolarHBondContact N-O 2.89Å; V3209-M3219 PolarHBondContact O-N 3Å
3210	T	79.1	Confident	76.8	Confident	33 Å²	33	37.7 Å²	37.7	20%	0.202	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	117.7	170.7	46.4	0	0	0	0	109.9	Y2828 C3151 I3218	Y2828-T3210 WeakPolarHBondContact CE1-O 3.08Å; C3151-T3210 HydrophobicContact CB-CG2 3.95Å; T3210-I3218 HydrophobicContact CG2-CD1 4.31Å; T3210-I3218 HydrophobicContact CG2-CG1 4.11Å
3211	F	74	Confident	77.2	Confident	5 Å²	5	35.2 Å²	35.2	2%	0.022	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	-9.8	-172	68.6	-90	0	0	0	114.9	Y2828 Q2836 K3217 M3219 F3229	Y2828-F3211 HydrophobicContact CD1-CB 3.64Å; Y2828-F3211 HydrophobicContact CD2-CB 3.71Å; Y2828-F3211 HydrophobicContact CE1-CB 3.82Å; Y2828-F3211 HydrophobicContact CE2-CB 3.88Å; Y2828-F3211 HydrophobicContact CG-CB 3.59Å; Q2836-F3211 PolarHBondContact NE2-O 2.75Å; Q2836-F3211 VanDerWaalsContact OE1-CD2 3.23Å; F3211-K3217 HydrophobicContact CD1-CB 4.33Å; F3211-K3217 WeakPolarHBondContact CD1-O 3.25Å; F3211-K3217 HydrophobicContact CD2-CB 4.31Å; F3211-K3217 HydrophobicContact CE1-CB 3.75Å; F3211-K3217 HydrophobicContact CE2-CB 3.74Å; F3211-K3217 HydrophobicContact CE2-CD 4.13Å; F3211-K3217 HydrophobicContact CZ-CB 3.44Å; F3211-K3217 VanDerWaalsContact CZ-CB 3.44Å; F3211-K3217 HydrophobicContact CZ-CD 4.3Å; F3211-K3217 HydrophobicContact CZ-CG 4.42Å; F3211-K3217 PolarHBondContact N-O 2.72Å; F3211-M3219 HydrophobicContact CD1-CB 4.13Å; F3211-M3219 HydrophobicContact CE1-CB 4.12Å; F3211-F3229 AromaticContact CE1-CD1 3.56Å; F3211-F3229 HydrophobicContact CE1-CD1 3.56Å; F3211-F3229 AromaticContact CE1-CE1 3.75Å; F3211-F3229 HydrophobicContact CE1-CE1 3.75Å; F3211-F3229 AromaticContact CZ-CD1 3.59Å; F3211-F3229 HydrophobicContact CZ-CD1 3.59Å; F3211-F3229 AromaticContact CZ-CE1 3.84Å; F3211-F3229 HydrophobicContact CZ-CE1 3.84Å
3212	N	68.4	Low	77.6	Confident	44 Å²	44	34.7 Å²	34.7	24%	0.235	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	148.6	160.2	-163.6	-15.4	0	0	0	108.6	D3214 V3216 K3217	N3212-D3214 PolarHBondContact OD1-N 2.91Å; N3212-V3216 WeakPolarHBondContact O-CA 3.32Å; N3212-K3217 HydrophobicContact CB-CB 3.95Å; N3212-K3217 HydrophobicContact CB-CD 4.01Å; N3212-K3217 HydrophobicContact CB-CG 4.1Å; N3212-K3217 PolarHBondContact O-N 3.41Å
3213	K	65.3	Low	78.2	Confident	152 Å²	152	37.3 Å²	37.3	66%	0.661	19%	0.185	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	-18.3	-178.5	-69.8	-175.7	176.8	179	0	113.5	V3216	K3213-V3216 WeakPolarHBondContact O-CG2 3.41Å
3214	D	65.5	Low	78.2	Confident	143 Å²	143	36.7 Å²	36.7	77%	0.765	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-145.5	104.5	178.5	-167.3	8.1	0	0	0	111.9	N3212	N3212-D3214 PolarHBondContact OD1-N 2.91Å
3215	P	67.8	Low	77.8	Confident	57 Å²	57	34.6 Å²	34.6	37%	0.37	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	cis	-64.2	159.3	-13.9	31.5	-35.8	0	0	0	110.6	K3217 T3231	P3215-K3217 PolarHBondContact O-N 3.46Å; P3215-T3231 HydrophobicContact CB-CG2 3.83Å; P3215-T3231 HydrophobicContact CG-CG2 3.9Å
3216	V	73.3	Confident	77.3	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.024	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	120.8	-179.5	177.5	0	0	0	0	109.7	I3153 N3212 K3213 I3218 T3231 I3232 L3234	I3153-V3216 HydrophobicContact CB-CG1 4.29Å; I3153-V3216 HydrophobicContact CG1-CG1 4.08Å; I3153-V3216 HydrophobicContact CG2-CB 4.14Å; I3153-V3216 HydrophobicContact CG2-CG1 3.55Å; I3153-V3216 HydrophobicContact CG2-CG2 3.54Å; N3212-V3216 WeakPolarHBondContact O-CA 3.32Å; K3213-V3216 WeakPolarHBondContact O-CG2 3.41Å; V3216-I3218 HydrophobicContact CG1-CD1 3.95Å; V3216-I3218 HydrophobicContact CG1-CG1 3.88Å; V3216-T3231 CarbonylContact O-C 3.57Å; V3216-T3231 VanDerWaalsContact O-CA 3.31Å; V3216-T3231 WeakPolarHBondContact O-CA 3.23Å; V3216-I3232 HydrophobicContact CB-CB 4.26Å; V3216-I3232 HydrophobicContact CG1-CB 4.29Å; V3216-I3232 PolarHBondContact O-N 2.6Å; V3216-L3234 HydrophobicContact CG2-CD1 3.97Å; V3216-L3234 HydrophobicContact CG2-CG 4.28Å
3217	K	79.1	Confident	77	Confident	19 Å²	19	36.8 Å²	36.8	8%	0.083	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	131.4	177	-62.8	177.1	-177.9	172	0	111.3	D2854 F3211 N3212 P3215 T3231	D2854-K3217 IonicContact OD1-NZ 3.45Å; D2854-K3217 PolarHBondContact OD1-NZ 3.42Å; D2854-K3217 IonicContact OD2-NZ 3.71Å; D2854-K3217 PolarHBondContact OD2-NZ 3.16Å; F3211-K3217 HydrophobicContact CD1-CB 4.33Å; F3211-K3217 WeakPolarHBondContact CD1-O 3.25Å; F3211-K3217 HydrophobicContact CD2-CB 4.31Å; F3211-K3217 HydrophobicContact CE1-CB 3.75Å; F3211-K3217 HydrophobicContact CE2-CB 3.74Å; F3211-K3217 HydrophobicContact CE2-CD 4.13Å; F3211-K3217 HydrophobicContact CZ-CB 3.44Å; F3211-K3217 VanDerWaalsContact CZ-CB 3.44Å; F3211-K3217 HydrophobicContact CZ-CD 4.3Å; F3211-K3217 HydrophobicContact CZ-CG 4.42Å; F3211-K3217 PolarHBondContact N-O 2.72Å; N3212-K3217 HydrophobicContact CB-CB 3.95Å; N3212-K3217 HydrophobicContact CB-CD 4.01Å; N3212-K3217 HydrophobicContact CB-CG 4.1Å; N3212-K3217 PolarHBondContact O-N 3.41Å; P3215-K3217 PolarHBondContact O-N 3.46Å; K3217-T3231 HydrophobicContact CG-CG2 4.34Å
3218	I	82.8	Confident	76.7	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	123.3	-169.6	-46.6	-175	0	0	0	109.6	I3153 L3167 L3208 V3209 T3210 V3216 Y3230 I3232	I3153-I3218 HydrophobicContact CD1-CD1 4.03Å; I3153-I3218 HydrophobicContact CG1-CD1 3.82Å; L3167-I3218 HydrophobicContact CD2-CD1 3.49Å; L3167-I3218 VanDerWaalsContact CD2-CD1 3.49Å; L3167-I3218 HydrophobicContact CD2-CG2 4.49Å; L3208-I3218 HydrophobicContact CD2-CG2 3.96Å; V3209-I3218 WeakPolarHBondContact O-CA 3.39Å; T3210-I3218 HydrophobicContact CG2-CD1 4.31Å; T3210-I3218 HydrophobicContact CG2-CG1 4.11Å; V3216-I3218 HydrophobicContact CG1-CD1 3.95Å; V3216-I3218 HydrophobicContact CG1-CG1 3.88Å; I3218-Y3230 PolarHBondContact N-O 3.41Å; I3218-Y3230 PolarHBondContact O-N 3.39Å; I3218-I3232 HydrophobicContact CD1-CD1 3.56Å; I3218-I3232 HydrophobicContact CD1-CG1 4.09Å
3219	M	84.8	Confident	76.4	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	126.9	170.4	-177.1	172.8	51.4	0	0	108.5	A2826 C2838 T2840 V3209 F3211 I3227 F3229	A2826-M3219 HydrophobicContact CB-CE 3.77Å; C2838-M3219 HydrophobicContact CB-CE 4.25Å; C2838-M3219 HydrophobicContact CB-SD 3.82Å; T2840-M3219 HydrophobicContact CG2-SD 4.19Å; V3209-M3219 HydrophobicContact CB-CB 4.34Å; V3209-M3219 HydrophobicContact CB-CE 3.91Å; V3209-M3219 HydrophobicContact CG1-CE 4.29Å; V3209-M3219 HydrophobicContact CG2-CE 3.96Å; V3209-M3219 PolarHBondContact N-O 2.89Å; V3209-M3219 PolarHBondContact O-N 3Å; F3211-M3219 HydrophobicContact CD1-CB 4.13Å; F3211-M3219 HydrophobicContact CE1-CB 4.12Å; M3219-I3227 HydrophobicContact CG-CG2 3.41Å; M3219-I3227 VanDerWaalsContact CG-CG2 3.41Å; M3219-I3227 HydrophobicContact SD-CG2 3.86Å; M3219-F3229 HydrophobicContact CB-CD1 4.06Å; M3219-F3229 HydrophobicContact CB-CE1 3.7Å; M3219-F3229 HydrophobicContact CB-CZ 4.32Å; M3219-F3229 HydrophobicContact CG-CD1 4.31Å; M3219-F3229 HydrophobicContact CG-CE1 3.71Å; M3219-F3229 HydrophobicContact CG-CE2 4.46Å; M3219-F3229 HydrophobicContact CG-CZ 3.8Å; M3219-F3229 HydrophobicContact SD-CE1 3.93Å; M3219-F3229 HydrophobicContact SD-CZ 3.69Å
3220	C	85.7	Confident	76.1	Confident	1 Å²	1	40 Å²	40	1%	0.007	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	111.6	-176.8	-67.9	0	0	0	0	109.1	I3205 L3208 D3228 Y3230	I3205-C3220 HydrophobicContact CD1-CB 3.64Å; I3205-C3220 HydrophobicContact CG1-CB 4.16Å; L3208-C3220 HydrophobicContact CD2-CB 4.29Å; L3208-C3220 WeakPolarHBondContact CD2-SG 3.46Å; C3220-D3228 HydrophobicContact CB-CB 4.22Å; C3220-D3228 PolarHBondContact N-O 3.03Å; C3220-D3228 PolarHBondContact O-N 2.65Å; C3220-Y3230 HydrophobicContact CB-CD2 3.95Å; C3220-Y3230 HydrophobicContact CB-CE2 3.84Å; C3220-Y3230 WeakPolarHBondContact SG-CD2 3.32Å
3221	C	84.1	Confident	76	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	118.4	-174.6	-57.5	0	0	0	0	110.2	I2823 I3205 K3206 K3207	I2823-C3221 HydrophobicContact CB-CB 3.84Å; I2823-C3221 HydrophobicContact CD1-CB 4.21Å; I2823-C3221 HydrophobicContact CG2-CB 3.6Å; I3205-C3221 CarbonylContact C-O 3.6Å; I3205-C3221 WeakPolarHBondContact CA-O 3.45Å; K3206-C3221 PolarHBondContact N-O 3.4Å; K3207-C3221 HydrophobicContact CB-CB 3.96Å; K3207-C3221 PolarHBondContact O-N 3.24Å
3222	L	81.2	Confident	75.9	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.026	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	160.8	-171.1	-58.3	178.5	0	0	0	113.1	E3203 I3205 S3224 G3225 Q3226	E3203-L3222 HydrophobicContact CB-CD1 4.45Å; E3203-L3222 HydrophobicContact CB-CD2 4.25Å; E3203-L3222 HydrophobicContact CG-CB 4.28Å; E3203-L3222 WeakPolarHBondContact OE2-CB 3.41Å; I3205-L3222 HydrophobicContact CG1-CD2 3.54Å; L3222-S3224 VanDerWaalsContact C-N 3.28Å; L3222-S3224 PolarHBondContact O-N 3.28Å; L3222-G3225 PolarHBondContact O-N 2.86Å; L3222-Q3226 HydrophobicContact CB-CB 4.42Å; L3222-Q3226 WeakPolarHBondContact CB-O 3.29Å; L3222-Q3226 HydrophobicContact CD1-CB 4.05Å; L3222-Q3226 HydrophobicContact CD1-CG 4.02Å; L3222-Q3226 PolarHBondContact N-O 3.02Å
3223	Q	79.1	Confident	76	Confident	78 Å²	78	48 Å²	48	36%	0.364	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-26.5	179.5	-174.6	166.2	-41.6	0	0	113.8	P2822 E3203 Q3204 K3206 G3225	P2822-Q3223 VanDerWaalsContact CA-O 3.29Å; P2822-Q3223 WeakPolarHBondContact CA-O 3.46Å; P2822-Q3223 HydrophobicContact CB-CG 4.33Å; P2822-Q3223 HydrophobicContact CG-CG 4Å; P2822-Q3223 WeakPolarHBondContact CG-O 3.41Å; E3203-Q3223 HydrophobicContact CG-CB 4.07Å; Q3204-Q3223 PolarHBondContact O-N 2.75Å; K3206-Q3223 HydrophobicContact CG-CB 4.42Å; Q3223-G3225 PolarHBondContact O-N 3.4Å
3224	S	73.5	Confident	75.9	Confident	43 Å²	43	45.4 Å²	45.4	30%	0.301	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	1.7	175	61.6	0	0	0	0	115	Q2818 E3203 L3222 Q3226	Q2818-S3224 PolarHBondContact NE2-O 2.91Å; E3203-S3224 VanDerWaalsContact CD-N 3.3Å; E3203-S3224 WeakPolarHBondContact OE1-CB 3.34Å; E3203-S3224 PolarHBondContact OE1-N 3.08Å; E3203-S3224 WeakPolarHBondContact OE2-CB 3.49Å; E3203-S3224 PolarHBondContact OE2-N 3.05Å; E3203-S3224 PolarHBondContact OE2-OG 3.34Å; L3222-S3224 VanDerWaalsContact C-N 3.28Å; L3222-S3224 PolarHBondContact O-N 3.28Å; S3224-Q3226 VanDerWaalsContact C-N 3.25Å; S3224-Q3226 PolarHBondContact O-N 2.99Å
3225	G	70.9	Confident	76.4	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.01	21%	0.207	C	C	.	.	S	Bend	trans	78.6	6.8	-174	0	0	0	0	0	114.6	Q2818 H2819 G2821 I2823 L3222 Q3223	Q2818-G3225 VanDerWaalsContact CG-O 3.25Å; Q2818-G3225 WeakPolarHBondContact CG-O 3.42Å; H2819-G3225 PolarHBondContact N-O 2.72Å; G2821-G3225 WeakPolarHBondContact O-CA 3.21Å; G2821-G3225 PolarHBondContact O-N 3.3Å; I2823-G3225 WeakPolarHBondContact CD1-O 3.17Å; L3222-G3225 PolarHBondContact O-N 2.86Å; Q3223-G3225 PolarHBondContact O-N 3.4Å
3226	Q	74.8	Confident	76.9	Confident	80 Å²	80	39.7 Å²	39.7	37%	0.374	20%	0.199	S	C	.	.			trans	-77.5	150.6	168	177.6	173.4	-35.9	0	0	111	L3222 S3224 D3228	L3222-Q3226 HydrophobicContact CB-CB 4.42Å; L3222-Q3226 WeakPolarHBondContact CB-O 3.29Å; L3222-Q3226 HydrophobicContact CD1-CB 4.05Å; L3222-Q3226 HydrophobicContact CD1-CG 4.02Å; L3222-Q3226 PolarHBondContact N-O 3.02Å; S3224-Q3226 VanDerWaalsContact C-N 3.25Å; S3224-Q3226 PolarHBondContact O-N 2.99Å; Q3226-D3228 PolarHBondContact NE2-OD1 3.38Å
3227	I	76.3	Confident	77.1	Confident	28 Å²	28	41.7 Å²	41.7	14%	0.144	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	123	173	-55.2	161.8	0	0	0	108	I2823 T2840 W2850 M3219 F3229	I2823-I3227 HydrophobicContact CD1-CD1 4.31Å; I2823-I3227 HydrophobicContact CD1-CG1 3.53Å; T2840-I3227 HydrophobicContact CG2-CD1 3.57Å; T2840-I3227 HydrophobicContact CG2-CG1 4.27Å; W2850-I3227 HydrophobicContact CD2-CD1 4.22Å; W2850-I3227 HydrophobicContact CH2-CD1 4.39Å; W2850-I3227 HydrophobicContact CZ2-CD1 3.49Å; W2850-I3227 VanDerWaalsContact CZ2-CD1 3.49Å; W2850-I3227 VanDerWaalsContact NE1-CD1 3.28Å; M3219-I3227 HydrophobicContact CG-CG2 3.41Å; M3219-I3227 VanDerWaalsContact CG-CG2 3.41Å; M3219-I3227 HydrophobicContact SD-CG2 3.86Å; I3227-F3229 HydrophobicContact CB-CE2 4.42Å; I3227-F3229 HydrophobicContact CG2-CD2 4.08Å; I3227-F3229 HydrophobicContact CG2-CE2 3.51Å; I3227-F3229 HydrophobicContact CG2-CZ 3.93Å
3228	D	78.3	Confident	76.9	Confident	32 Å²	32	43 Å²	43	17%	0.171	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	150.9	170	-75	-1.3	0	0	0	110.3	C3220 Q3226 Y3230	C3220-D3228 HydrophobicContact CB-CB 4.22Å; C3220-D3228 PolarHBondContact N-O 3.03Å; C3220-D3228 PolarHBondContact O-N 2.65Å; Q3226-D3228 PolarHBondContact NE2-OD1 3.38Å; D3228-Y3230 HydrophobicContact CB-CD2 4.13Å; D3228-Y3230 HydrophobicContact CB-CE2 3.38Å; D3228-Y3230 PolarHBondContact OD2-OH 3.24Å
3229	F	77.6	Confident	76.6	Confident	51 Å²	51	45.7 Å²	45.7	22%	0.224	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	120.7	175.5	-74	-90.6	0	0	0	110.3	C2838 V2852 Y2886 F3211 M3219 I3227	C2838-F3229 HydrophobicContact CB-CZ 4.46Å; V2852-F3229 HydrophobicContact CG2-CE1 4.41Å; V2852-F3229 HydrophobicContact CG2-CZ 4.27Å; Y2886-F3229 AromaticContact CD1-CD2 3.76Å; Y2886-F3229 HydrophobicContact CD1-CD2 3.76Å; Y2886-F3229 AromaticContact CD1-CE2 3.55Å; Y2886-F3229 HydrophobicContact CD1-CE2 3.55Å; Y2886-F3229 HydrophobicContact CD1-CG 4.34Å; Y2886-F3229 AromaticContact CD1-CZ 3.98Å; Y2886-F3229 HydrophobicContact CD1-CZ 3.98Å; Y2886-F3229 HydrophobicContact CE1-CB 4.13Å; Y2886-F3229 AromaticContact CE1-CD1 3.7Å; Y2886-F3229 HydrophobicContact CE1-CD1 3.7Å; Y2886-F3229 AromaticContact CE1-CD2 3.29Å; Y2886-F3229 HydrophobicContact CE1-CD2 3.29Å; Y2886-F3229 AromaticContact CE1-CE1 3.83Å; Y2886-F3229 HydrophobicContact CE1-CE1 3.83Å; Y2886-F3229 AromaticContact CE1-CE2 3.43Å; Y2886-F3229 HydrophobicContact CE1-CE2 3.43Å; Y2886-F3229 VanDerWaalsContact CE1-CE2 3.43Å; Y2886-F3229 AromaticContact CE1-CG 3.42Å; Y2886-F3229 HydrophobicContact CE1-CG 3.42Å; Y2886-F3229 VanDerWaalsContact CE1-CG 3.42Å; Y2886-F3229 AromaticContact CE1-CZ 3.7Å; Y2886-F3229 HydrophobicContact CE1-CZ 3.7Å; Y2886-F3229 HydrophobicContact CE2-CD2 4.42Å; Y2886-F3229 HydrophobicContact CG-CE2 4.49Å; Y2886-F3229 AromaticContact CZ-CD2 3.69Å; Y2886-F3229 AromaticContact CZ-CG 3.59Å; Y2886-F3229 VanDerWaalsContact OH-CB 3.26Å; Y2886-F3229 WeakPolarHBondContact OH-CB 3.48Å; Y2886-F3229 WeakPolarHBondContact OH-CG 3.15Å; F3211-F3229 AromaticContact CE1-CD1 3.56Å; F3211-F3229 HydrophobicContact CE1-CD1 3.56Å; F3211-F3229 AromaticContact CE1-CE1 3.75Å; F3211-F3229 HydrophobicContact CE1-CE1 3.75Å; F3211-F3229 AromaticContact CZ-CD1 3.59Å; F3211-F3229 HydrophobicContact CZ-CD1 3.59Å; F3211-F3229 AromaticContact CZ-CE1 3.84Å; F3211-F3229 HydrophobicContact CZ-CE1 3.84Å; M3219-F3229 HydrophobicContact CB-CD1 4.06Å; M3219-F3229 HydrophobicContact CB-CE1 3.7Å; M3219-F3229 HydrophobicContact CB-CZ 4.32Å; M3219-F3229 HydrophobicContact CG-CD1 4.31Å; M3219-F3229 HydrophobicContact CG-CE1 3.71Å; M3219-F3229 HydrophobicContact CG-CE2 4.46Å; M3219-F3229 HydrophobicContact CG-CZ 3.8Å; M3219-F3229 HydrophobicContact SD-CE1 3.93Å; M3219-F3229 HydrophobicContact SD-CZ 3.69Å; I3227-F3229 HydrophobicContact CB-CE2 4.42Å; I3227-F3229 HydrophobicContact CG2-CD2 4.08Å; I3227-F3229 HydrophobicContact CG2-CE2 3.51Å; I3227-F3229 HydrophobicContact CG2-CZ 3.93Å
3230	Y	76.9	Confident	76	Confident	65 Å²	65	48.7 Å²	48.7	26%	0.255	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	131.5	179.6	-64.8	-97.1	0	0	0	109.7	I3218 C3220 D3228	I3218-Y3230 PolarHBondContact N-O 3.41Å; I3218-Y3230 PolarHBondContact O-N 3.39Å; C3220-Y3230 HydrophobicContact CB-CD2 3.95Å; C3220-Y3230 HydrophobicContact CB-CE2 3.84Å; C3220-Y3230 WeakPolarHBondContact SG-CD2 3.32Å; D3228-Y3230 HydrophobicContact CB-CD2 4.13Å; D3228-Y3230 HydrophobicContact CB-CE2 3.38Å; D3228-Y3230 PolarHBondContact OD2-OH 3.24Å
3231	T	75.9	Confident	75.3	Confident	77 Å²	77	52.1 Å²	52.1	47%	0.472	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122.8	163.9	-56.9	0	0	0	0	107.5	P3215 V3216 K3217	P3215-T3231 HydrophobicContact CB-CG2 3.83Å; P3215-T3231 HydrophobicContact CG-CG2 3.9Å; V3216-T3231 CarbonylContact O-C 3.57Å; V3216-T3231 VanDerWaalsContact O-CA 3.31Å; V3216-T3231 WeakPolarHBondContact O-CA 3.23Å; K3217-T3231 HydrophobicContact CG-CG2 4.34Å
3232	I	73.2	Confident	74.7	Confident	9 Å²	9	56.2 Å²	56.2	5%	0.046	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	110.1	178.1	-63.2	-168.5	0	0	0	109.2	I3153 L3167 Y3199 V3216 I3218 L3234	I3153-I3232 HydrophobicContact CD1-CD1 3.95Å; L3167-I3232 HydrophobicContact CD1-CD1 4.14Å; L3167-I3232 HydrophobicContact CD2-CD1 3.92Å; Y3199-I3232 HydrophobicContact CE2-CD1 4.32Å; V3216-I3232 HydrophobicContact CB-CB 4.26Å; V3216-I3232 HydrophobicContact CG1-CB 4.29Å; V3216-I3232 PolarHBondContact O-N 2.6Å; I3218-I3232 HydrophobicContact CD1-CD1 3.56Å; I3218-I3232 HydrophobicContact CD1-CG1 4.09Å; I3232-L3234 HydrophobicContact CG2-CD2 4.14Å; I3232-L3234 HydrophobicContact CG2-CG 4.43Å; I3232-L3234 PolarHBondContact O-N 2.84Å
3233	E	70.1	Confident	74.1	Confident	164 Å²	164	60.4 Å²	60.4	77%	0.766	30%	0.303	S	S	*	.			trans	-75	112.9	158.6	-63.4	178.7	173.7	0	0	107.6	K3197	K3197-E3233 PolarHBondContact NZ-O 2.87Å
3234	L	63.1	Low	73.7	Confident	97 Å²	97	58.8 Å²	58.8	51%	0.508	30%	0.297	S	S	.	.			trans	-70.5	0	-179.4	-77.6	173.9	0	0	0	111	I3153 Y3165 L3177 K3197 V3216 I3232	I3153-L3234 HydrophobicContact CG2-CD1 4Å; I3153-L3234 HydrophobicContact CG2-CD2 4.05Å; I3153-L3234 HydrophobicContact CG2-CG 4.37Å; Y3165-L3234 HydrophobicContact CD1-CD2 3.88Å; Y3165-L3234 HydrophobicContact CD2-CD1 4.22Å; Y3165-L3234 HydrophobicContact CD2-CD2 4.41Å; Y3165-L3234 HydrophobicContact CE1-CD2 4.26Å; Y3165-L3234 HydrophobicContact CE2-CD1 4.38Å; Y3165-L3234 HydrophobicContact CG-CD2 3.96Å; L3177-L3234 HydrophobicContact CD2-CD2 4.42Å; K3197-L3234 PolarHBondContact NZ-OXT 3.17Å; V3216-L3234 HydrophobicContact CG2-CD1 3.97Å; V3216-L3234 HydrophobicContact CG2-CG 4.28Å; I3232-L3234 HydrophobicContact CG2-CD2 4.14Å; I3232-L3234 HydrophobicContact CG2-CG 4.43Å; I3232-L3234 PolarHBondContact O-N 2.84Å

Retrieved 3,234 of 3,234 residues in 4213.3 ms (Link to these results)

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