A0A5K4FF20_SCHMA Loading...

C2 domain-containing protein AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A5K4FF20, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,860 aa.

						>A0A5K4FF20_SCHMA|A0A5K4FF20
MTSFLSRKYFCFLGRSSQISDHPNQRNLVQVYTVLPPGIDSKVTAHLILIVRLFRPNSSFTGSRRLEFGSNSLNDIYVQVRWWGEPAGEKCAIFYPRLAHKVGHKQATCTKARYRITVPLDRFSAYLKDMRELRLDVIDIRHQRIIGRGRLDRVDRLTPTTPIDAILPVINELGEKLGDLNISLMIEPVINTNSKSMIDSIQSQQNNGVVNEHPVDLDIGSLDQDNYHSSHNVNLLDNSNNYRLRTTIHGHGRELTNTDKDSFSTHSGNNNDVNFSKREQLLSLALEKSKHLREALSCSSIFNHQDYNDNESDDKNNMDGLRASRSYTSDGRFSGGLTPNKLHHSSPDLRSIMFEECIHNHDNRIHLASQTKTKSNNFDLIKYILDNESLDDPVQVNTQNHDNHHRQHHVSYKKGVHLQNIMFANGNDSNLHADKGIGVTQDYPLSNNNMVVQFGNSEYIKEDDELIENLLYSNENSIDENELLNSNTLFKQSNNVQPLKQDTLNGKIVNQHYLSKSGCNLKGANLHFKCLSLCRKYAENKMSNVVNSSKSTLYNKTSRNPTKLLSQKSHPISVSSVLPFNKVKSNDINTLSDSIFMELEVSVPTLSSLSSSNKIGGTWTTTSFTLSTELRNQFEVKSTKRKQQNDDAYVNFYCLTNKKINNSNDAYIQVNFNHQLHSNDKVNNHDNHIRLRLFRLSNPVKEDEDTTQWESELIGVNFVNPDEIRSIILSKVHLNSSNLTTHLYIHLCSGQKMKTKNSNVIGRLELELEPIWNTIATSRNQMNINILKKDNESFGSIQKSMKNDKFHSVQNSMYHKPDLTKELVPSNTVILNTILHISEGKELKLSNNYRNKQLLTSKYITKLPNDCIVIEHSYLIVRLPWCHQIHSSSDLSTINLDQYHSNVAWLSGSCPQYAFTIRSQCLLNQHPMIPVDTWLPIIDPFSGCENGQIHVLLAVGTQEQIDNLLTLQNLKCTIDADNNTITNTADQGRKSGIIECKEITRDNSCVDLTVEHRIGITFEQLFDFDPRIPLQYDSNYNGAVPWGDLDCYVQYFFPTDTKAKCLASTRTTTQMLNKPSMITNHTIQEQIAKHISCEFISANSLSKKENASSSTIKSPPSSSSSYWSHTHRLCTNIQITSESQNKMDLIRSKIETEFIQWILDMLTRADFESNKLNLKRGLLIELWLRIYSPNLHDCLAAKGYIPEELLCKLISKNKSLKSGDDEEDDRNDEHNHQSIRFFIDLYDVNSSSGCLNGRLQISMDYCYNIINRSSTKFDNTLTKSITAQPTTLFNKQSILISTSSNQPIHNSILILPSQTQFNHHIQICLNGISGMKFSIMKHPNEISYTNRIFHARLHCLLLIPNDKRYSHSPMDELYHIHLIKSTISSPIYNTHYTMELNCKLDIQLPTSWLIAYQQYNNQSNLINNQNRNNYEITLLEAILNGDQYQMEQYRRPIIKPCLQYTNFEQQSNENINSIINPGKEYQLISSCRVPLSALIFSSHGNLPSRWYPLTSFINVDDDIGKYGDDNSLISWQSKFSGAIQLSMRLTDPHLIKIVPCNNLTTTIDNNNNNAMNNIHSPSIINCLRDWNILFNVEKLENGQNSIVAFKNEFELWKDGLDEYGCQYKHFTIYLNFAYLPKIKQLLNDTIDFNNPLPRNYTIENNFKAYTFVRFQFPNYGTQMSQLIFLPNDDDHTSDRQSTIVEFKEYKEFVIPVSAELRNFLAESTLEFQVWIIWTDENLKELDKSNNNYETGLQKFIIDELNNKEYPKRHQVPAPRHIGTATIPLYHLLYPRPQVTSHSNTNSINCLEGDPSGIRWWNNQQQWMGTDRINSSGLAVYPLYRANTANFYDSWIAVHIEMTGSKTENCLWSKRYHTCKMNKLILPEIDGHLGWNLKHYKVPSLVNNPLYNSNNNCHLTTEFYDDNYKKNETFPAEIIVEKAYHLRLSHHNKFDNSTESSENSEPYFKTNDDDDDDDDNNNNKETADYSVFVTFPVNGGNHYCFNNKHSITGNTNQNEKLWKQITKLSNINSNRIALTPKVKNLEYAHWNYCRFVRIPLELIQPSCNQGLMFHVWAMKHDDDDYDLNNDSSYTPKLIGIATVDLTTLSHLFSDPIHSTNNEFNQIYGWYHVLNNDTGCPSGQILIGVKPLINIGQQHLTNYYSSSLNNNEFTTNNNFSSLSHNVYTDQIKPFGNYSIFQYGLNSTLSNCDLAKSTHSLNDCNTGKVSDDILVNKEESNHSELNRSVLFENLRTRLNELDEINTKLKNRLNLSTSNEKFFSHADNNTTDIDKNYNDDTNMKNESFFNQSSQNKLQSLNEEIDYSTLVNDLSLSQHQPHYSQHLADLHANDENMLYVNSKFQCTVLQSQLNHDSDDNTYFTHKINDDFTINKFINQCNHHFTIDDCSFTNSTNENIDCLISNSLKQSTENGRLNTMEKDNDNNNIDVESALTNDGDNDDDAHNKENIVNTDKDDEQSEISVVSPLLHDQSSNISDAHDYNDDEDIISIGTDIQHITSCNEISREGGGSYDTDCNNDEKKLEEDNVKQLHNNNNDSRSSNKIVHNESEQYSPMNNKLSHTEINNVLTELLNQKSLSETSASSVWLPDDDDDNVDNSSNNGILYENDPSSLYTRSTITQSPPSIDNQSIRQVEVSLTNSQNIQMNKPIISHEHELTQNRIIQNKVYESNEEKMDRNRDNEEEQRDKAKILRLDNDDDDDNSAGYSDKLKLLNKDDDLAETSRWDTEQPLSVNSKLTPMFIPNFFPSTSRIEELFTSRTNDCQEDSNSMDSNTNLSNNNKNIDPLRNRLNNRLSEAVLYTMNTTMTDSNPQTNNNANLIINDTLSAFITNGYKTRSLKKAERVFNMTFK
					

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

Download 9 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	31	Very low	36.1	Very low	208 Å²	208	154.1 Å²	154.1	100%	1.025	76%	0.761	S	S	*	*				0	-45.9	0	-93.9	-171	160.6	0	0	112.9	S3 F4	M1-S3 VanDerWaalsContact C-N 3.31Å; M1-S3 PolarHBondContact O-N 3.49Å; M1-F4 PolarHBondContact O-N 2.82Å
2	T	35.2	Very low	35.5	Very low	129 Å²	129	157.4 Å²	157.4	79%	0.791	77%	0.769	S	S	*	*	H	α-helix	trans	-61.4	-29.5	177	38.5	0	0	0	0	114.8
3	S	32.9	Very low	35	Very low	93 Å²	93	156.8 Å²	156.8	65%	0.65	77%	0.77	S	S	*	*	H	α-helix	trans	-73	-24.7	175.5	66.2	0	0	0	0	114.2	M1	M1-S3 VanDerWaalsContact C-N 3.31Å; M1-S3 PolarHBondContact O-N 3.49Å
4	F	36.4	Very low	34.4	Very low	179 Å²	179	150.5 Å²	150.5	79%	0.785	77%	0.766	S	S	*	*	H	α-helix	trans	-77.1	-27.8	-179.5	-123.6	-89.1	0	0	0	112	M1	M1-F4 PolarHBondContact O-N 2.82Å
5	L	42.1	Very low	33.8	Very low	125 Å²	125	156.7 Å²	156.7	65%	0.654	78%	0.776	S	S	*	*	H	α-helix	trans	-76.7	-28.4	178.7	-83	155.6	0	0	0	113.5
6	S	41.1	Very low	33.4	Very low	86 Å²	86	154.2 Å²	154.2	60%	0.601	78%	0.778	S	S	*	*	H	α-helix	trans	-75.5	-25.3	178	-77.9	0	0	0	0	114
7	R	37.3	Very low	33	Very low	213 Å²	213	150.6 Å²	150.6	80%	0.804	77%	0.771	S	S	*	*	H	α-helix	trans	-78.1	-23.1	-178.4	-105.7	-179	-179.5	-177.8	0.2	114.3
8	K	38.7	Very low	32.6	Very low	185 Å²	185	153.3 Å²	153.3	80%	0.804	78%	0.78	S	S	*	*	H	α-helix	trans	-79.5	-25.9	177.6	-111.2	-176.5	177.4	-176.3	0	113.6
9	Y	35.2	Very low	32.4	Very low	200 Å²	200	152.2 Å²	152.2	78%	0.784	77%	0.774	S	S	*	*	H	α-helix	trans	-80.5	-17.5	179.1	-91.3	-81.6	0	0	0	114.4
10	F	35	Very low	32	Very low	167 Å²	167	149.6 Å²	149.6	73%	0.732	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-88.3	-8.8	-178	-114.9	-83.3	0	0	0	115.3
11	C	31.8	Very low	31.7	Very low	110 Å²	110	149.8 Å²	149.8	74%	0.743	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-89.5	4	-178.8	-72	0	0	0	0	115.1
12	F	29	Very low	31.4	Very low	194 Å²	194	146.9 Å²	146.9	85%	0.851	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-106.3	4.8	177.3	-103.8	-80.6	0	0	0	115.6	G14	F12-G14 VanDerWaalsContact C-N 3.31Å; F12-G14 PolarHBondContact O-N 3.43Å
13	L	29.9	Very low	31.2	Very low	149 Å²	149	146 Å²	146	78%	0.78	75%	0.753	S	S	*	*	S	Bend	trans	-91.7	74.6	164.3	-77.9	157.8	0	0	0	108.6	R15	L13-R15 PolarHBondContact O-N 3.25Å; L13-R15 VanDerWaalsContact O-N 3.16Å
14	G	26	Very low	31.1	Very low	69 Å²	69	149.1 Å²	149.1	71%	0.711	76%	0.762	S	S	*	*			trans	-57.1	115	174.1	0	0	0	0	0	111	F12 S16	F12-G14 VanDerWaalsContact C-N 3.31Å; F12-G14 PolarHBondContact O-N 3.43Å; G14-S16 PolarHBondContact O-N 3.14Å
15	R	25.2	Very low	31.3	Very low	244 Å²	244	146.5 Å²	146.5	92%	0.921	75%	0.753	S	S	*	*			trans	10.6	96.3	158.9	-76.1	176.3	169.3	172.7	-3.9	115.1	L13 S17	L13-R15 PolarHBondContact O-N 3.25Å; L13-R15 VanDerWaalsContact O-N 3.16Å; R15-S17 PolarHBondContact O-N 3.04Å
16	S	27.4	Very low	31.5	Very low	116 Å²	116	151.6 Å²	151.6	81%	0.811	76%	0.763	S	S	*	*			trans	-67.8	113.2	157.9	70.5	0	0	0	0	108.3	G14	G14-S16 PolarHBondContact O-N 3.14Å
17	S	26.8	Very low	32.5	Very low	93 Å²	93	152.2 Å²	152.2	65%	0.65	76%	0.76	S	S	*	*			trans	-48.8	134	165.1	29.5	0	0	0	0	110.6	R15 I19	R15-S17 PolarHBondContact O-N 3.04Å; S17-I19 PolarHBondContact O-N 3.44Å
18	Q	25.9	Very low	34.5	Very low	200 Å²	200	145.5 Å²	145.5	94%	0.935	74%	0.739	S	S	*	*			trans	-56	105.4	175	-70.7	170.6	-23.2	0	0	109.6
19	I	28.1	Very low	36.8	Very low	132 Å²	132	137.1 Å²	137.1	68%	0.677	70%	0.704	S	S	*	*			trans	-112.5	120.1	169.9	-67	171.4	0	0	0	106.7	S17	S17-I19 PolarHBondContact O-N 3.44Å
20	S	26	Very low	39.2	Very low	99 Å²	99	133.6 Å²	133.6	69%	0.692	70%	0.695	S	S	*	*			trans	-41.6	130.3	178	49.3	0	0	0	0	114.1	H22	S20-H22 PolarHBondContact O-N 2.73Å
21	D	24.3	Very low	41.7	Very low	155 Å²	155	127.1 Å²	127.1	83%	0.829	67%	0.669	S	S	*	*			trans	-59.8	106	-178.5	-71.1	-53.4	0	0	0	113.7
22	H	26.2	Very low	44.2	Very low	146 Å²	146	127.1 Å²	127.1	68%	0.676	65%	0.654	S	S	*	*			trans	-122.1	113	152.8	-79.6	-46	0	0	0	109.2	S20 N24	S20-H22 PolarHBondContact O-N 2.73Å; H22-N24 PolarHBondContact O-N 3.25Å
23	P	29.7	Very low	46.9	Very low	112 Å²	112	118.8 Å²	118.8	73%	0.727	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-5.8	-164.4	24.2	-31.9	0	0	0	115.8
24	N	31.7	Very low	49.7	Very low	157 Å²	157	113.1 Å²	113.1	84%	0.84	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	1.2	-175.6	-73.3	-8.5	0	0	0	115.4	H22	H22-N24 PolarHBondContact O-N 3.25Å
25	Q	39.2	Very low	52.7	Low	124 Å²	124	109.8 Å²	109.8	58%	0.579	56%	0.556	S	S	*	*			trans	-90.5	-10.2	-174.2	-77.1	-174.5	-14.6	0	0	116	N27 L28	Q25-N27 PolarHBondContact O-N 2.95Å; Q25-L28 HydrophobicContact CG-CD1 4.27Å; Q25-L28 PolarHBondContact O-N 2.82Å
26	R	47.4	Very low	55.8	Low	232 Å²	232	98.5 Å²	98.5	88%	0.875	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-14.8	-166.7	-75.7	-174.1	177.4	166.7	1.6	116.6
27	N	62.4	Low	58.6	Low	100 Å²	100	93.4 Å²	93.4	54%	0.535	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	12.9	-176.7	-64.2	-13.7	0	0	0	114.3	Q25	Q25-N27 PolarHBondContact O-N 2.95Å
28	L	79.5	Confident	61.1	Low	71 Å²	71	90.4 Å²	90.4	37%	0.372	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	126.2	178.6	-75.7	168.1	0	0	0	111.1	Q25 K111	Q25-L28 HydrophobicContact CG-CD1 4.27Å; Q25-L28 PolarHBondContact O-N 2.82Å; L28-K111 CarbonylContact C-O 3.58Å; L28-K111 WeakPolarHBondContact CA-O 3.29Å; L28-K111 HydrophobicContact CD2-CB 4.41Å; L28-K111 HydrophobicContact CD2-CD 4.22Å; L28-K111 HydrophobicContact CD2-CG 4.01Å
29	V	86.3	Confident	63.7	Low	9 Å²	9	81.3 Å²	81.3	6%	0.055	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	129.1	171.5	172.5	0	0	0	0	108.7	V31 A92 I93 F94 C109 K111 A112	V29-V31 PolarHBondContact O-N 2.95Å; V29-A92 HydrophobicContact CG1-CB 3.97Å; V29-I93 VanDerWaalsContact CG1-O 3.26Å; V29-I93 WeakPolarHBondContact CG1-O 3.44Å; V29-F94 HydrophobicContact CB-CD1 4.47Å; V29-F94 HydrophobicContact CB-CE1 4.31Å; V29-F94 HydrophobicContact CG1-CD2 4.44Å; V29-F94 HydrophobicContact CG1-CE1 4.44Å; V29-F94 HydrophobicContact CG1-CE2 4.26Å; V29-F94 HydrophobicContact CG1-CZ 4.28Å; V29-F94 HydrophobicContact CG2-CD1 3.63Å; V29-F94 HydrophobicContact CG2-CE1 3.9Å; V29-F94 HydrophobicContact CG2-CG 4.06Å; V29-C109 HydrophobicContact CG2-CB 4.17Å; V29-C109 WeakPolarHBondContact CG2-O 3.28Å; V29-C109 WeakPolarHBondContact CG2-SG 3.41Å; V29-K111 PolarHBondContact N-O 2.82Å; V29-A112 HydrophobicContact CB-CB 3.91Å; V29-A112 HydrophobicContact CG1-CB 4.19Å
30	Q	85.7	Confident	66	Low	127 Å²	127	81.6 Å²	81.6	59%	0.593	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-65.6	124.3	173.5	-172.9	63.7	40.5	0	0	109.6	Y32	Q30-Y32 HydrophobicContact CG-CD1 4.38Å; Q30-Y32 HydrophobicContact CG-CE1 3.68Å; Q30-Y32 HydrophobicContact CG-CE2 4.27Å
31	V	88	Confident	68.5	Low	31 Å²	31	79 Å²	79	19%	0.188	41%	0.405	C	S	.	.			trans	-105.7	148.7	171.8	-60.5	0	0	0	0	109.4	V29 A92 A112 R113 Y114	V29-V31 PolarHBondContact O-N 2.95Å; V31-A92 HydrophobicContact CG1-CB 4.48Å; V31-A112 HydrophobicContact CG1-CB 3.75Å; V31-R113 WeakPolarHBondContact CG2-O 3.46Å; V31-Y114 HydrophobicContact CB-CD1 3.88Å; V31-Y114 HydrophobicContact CB-CE1 3.78Å; V31-Y114 HydrophobicContact CG1-CD1 3.73Å; V31-Y114 HydrophobicContact CG1-CD2 4.17Å; V31-Y114 HydrophobicContact CG1-CE1 3.44Å; V31-Y114 VanDerWaalsContact CG1-CE1 3.44Å; V31-Y114 HydrophobicContact CG1-CE2 3.91Å; V31-Y114 HydrophobicContact CG1-CG 4.08Å; V31-Y114 HydrophobicContact CG2-CD1 4.45Å
32	Y	84.2	Confident	71.3	Confident	109 Å²	109	78.4 Å²	78.4	43%	0.427	40%	0.395	S	S	.	.			trans	-117.7	-7.3	-175.7	-54.8	-81.3	0	0	0	112.8	Q30 K90 C91	Q30-Y32 HydrophobicContact CG-CD1 4.38Å; Q30-Y32 HydrophobicContact CG-CE1 3.68Å; Q30-Y32 HydrophobicContact CG-CE2 4.27Å; Y32-K90 WeakPolarHBondContact CB-O 3.16Å; Y32-K90 HydrophobicContact CD1-CB 4.13Å; Y32-K90 HydrophobicContact CD2-CB 3.78Å; Y32-K90 WeakPolarHBondContact CD2-O 3.2Å; Y32-K90 HydrophobicContact CE1-CB 4.06Å; Y32-K90 HydrophobicContact CE1-CD 4.05Å; Y32-K90 HydrophobicContact CE2-CB 3.72Å; Y32-K90 HydrophobicContact CG-CB 3.98Å; Y32-C91 VanDerWaalsContact CE2-O 3.31Å; Y32-C91 WeakPolarHBondContact CE2-O 3.35Å
33	T	85.2	Confident	74.2	Confident	19 Å²	19	72.6 Å²	72.6	12%	0.117	37%	0.37	C	S	.	.			trans	-127.5	151.1	-177.4	-166	0	0	0	0	112.1	L35 P37 E85 Y114	T33-L35 HydrophobicContact CG2-CD2 4.36Å; T33-P37 HydrophobicContact CG2-CG 4.45Å; T33-P37 WeakPolarHBondContact OG1-CB 3.41Å; T33-E85 HydrophobicContact CG2-CG 4.2Å; T33-Y114 HydrophobicContact CG2-CD1 4.32Å; T33-Y114 HydrophobicContact CG2-CE1 4.3Å
34	V	88.9	Confident	77	Confident	30 Å²	30	69.4 Å²	69.4	18%	0.182	35%	0.349	C	S	.	.			trans	-88.2	164.5	164.5	-66.2	0	0	0	0	109	P36 P37 I39 R115 T117	V34-P36 CarbonylContact C-O 3.5Å; V34-P36 CarbonylContact O-C 3.54Å; V34-P37 VanDerWaalsContact O-CA 3.23Å; V34-P37 WeakPolarHBondContact O-CA 3.36Å; V34-I39 WeakPolarHBondContact CG2-O 3.43Å; V34-R115 HydrophobicContact CG1-CB 4.29Å; V34-T117 HydrophobicContact CB-CG2 4Å; V34-T117 HydrophobicContact CG1-CG2 4.13Å; V34-T117 HydrophobicContact CG2-CG2 4.46Å
35	L	89.4	Confident	79.9	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-121.3	123	-179.5	-64.3	179.7	0	0	0	111.1	T33 P37 L47 W82 Y114 R115 I116 T117 F123	T33-L35 HydrophobicContact CG2-CD2 4.36Å; L35-P37 HydrophobicContact CD2-CG 4.42Å; L35-L47 HydrophobicContact CD1-CB 4.18Å; L35-L47 HydrophobicContact CD1-CD2 3.6Å; L35-L47 HydrophobicContact CD1-CG 4.46Å; L35-W82 HydrophobicContact CD1-CD2 4.03Å; L35-W82 HydrophobicContact CD1-CE3 4.26Å; L35-W82 HydrophobicContact CD1-CH2 4.27Å; L35-W82 HydrophobicContact CD1-CZ2 4.02Å; L35-W82 HydrophobicContact CD1-CZ3 4.38Å; L35-W82 HydrophobicContact CD2-CB 3.83Å; L35-W82 HydrophobicContact CD2-CD2 3.63Å; L35-W82 HydrophobicContact CD2-CE3 4.03Å; L35-W82 HydrophobicContact CD2-CG 3.52Å; L35-Y114 VanDerWaalsContact CD1-CB 3.47Å; L35-Y114 HydrophobicContact CD1-CD1 4.13Å; L35-Y114 HydrophobicContact CD1-CD2 4.37Å; L35-Y114 HydrophobicContact CD1-CG 3.76Å; L35-Y114 HydrophobicContact CG-CD1 4.23Å; L35-Y114 HydrophobicContact CG-CG 4.26Å; L35-R115 PolarHBondContact N-O 3.42Å; L35-I116 HydrophobicContact CB-CG1 4.43Å; L35-I116 VanDerWaalsContact O-CA 3.25Å; L35-I116 WeakPolarHBondContact O-CA 3.39Å; L35-T117 PolarHBondContact O-N 3.44Å; L35-F123 HydrophobicContact CB-CE2 3.84Å; L35-F123 HydrophobicContact CB-CZ 4.44Å; L35-F123 HydrophobicContact CD1-CZ 4.47Å
36	P	89.2	Confident	82.5	Confident	7 Å²	7	57.4 Å²	57.4	5%	0.045	29%	0.287	C	S	.	.	S	Bend	cis	-60.4	149.8	-10.3	-22.7	34.4	0	0	0	113.5	V34 I39 V118 Y126	V34-P36 CarbonylContact C-O 3.5Å; V34-P36 CarbonylContact O-C 3.54Å; P36-I39 HydrophobicContact CB-CD1 3.86Å; P36-I39 HydrophobicContact CB-CG1 4.44Å; P36-I39 HydrophobicContact CG-CD1 3.95Å; P36-V118 VanDerWaalsContact CD-CG2 3.47Å; P36-V118 HydrophobicContact CG-CG1 4.4Å; P36-V118 HydrophobicContact CG-CG2 4.14Å; P36-Y126 HydrophobicContact CB-CD2 3.66Å; P36-Y126 HydrophobicContact CB-CE2 3.8Å; P36-Y126 HydrophobicContact CB-CG 4.08Å; P36-Y126 HydrophobicContact CG-CD1 4.25Å; P36-Y126 HydrophobicContact CG-CD2 3.77Å; P36-Y126 HydrophobicContact CG-CE2 4.35Å; P36-Y126 HydrophobicContact CG-CG 3.7Å
37	P	86.5	Confident	84.8	Confident	8 Å²	8	46.4 Å²	46.4	5%	0.052	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	146.8	175.2	-28.5	38	0	0	0	113	T33 V34 L35 I39 W82 W83 G84 E85 Y126	T33-P37 HydrophobicContact CG2-CG 4.45Å; T33-P37 WeakPolarHBondContact OG1-CB 3.41Å; V34-P37 VanDerWaalsContact O-CA 3.23Å; V34-P37 WeakPolarHBondContact O-CA 3.36Å; L35-P37 HydrophobicContact CD2-CG 4.42Å; P37-I39 VanDerWaalsContact C-N 3.26Å; P37-I39 PolarHBondContact O-N 3.26Å; P37-W82 HydrophobicContact CG-CB 4.48Å; P37-W83 WeakPolarHBondContact CD-O 3.49Å; P37-W83 WeakPolarHBondContact CG-O 3.45Å; P37-G84 WeakPolarHBondContact CB-O 3.26Å; P37-E85 HydrophobicContact CG-CB 4.27Å; P37-Y126 WeakPolarHBondContact CD-OH 3.48Å
38	G	80.3	Confident	86.3	Confident	31 Å²	31	41.7 Å²	41.7	32%	0.32	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	-14	178	0	0	0	0	0	115.9	D40	G38-D40 PolarHBondContact O-N 2.91Å
39	I	80.3	Confident	87.1	Confident	9 Å²	9	38.3 Å²	38.3	5%	0.046	20%	0.203	C	C	.	.			trans	-93.1	96.4	-178.5	-55	-178.3	0	0	0	110.7	V34 P36 P37 S41 T117 V118 Y1036 A1039	V34-I39 WeakPolarHBondContact CG2-O 3.43Å; P36-I39 HydrophobicContact CB-CD1 3.86Å; P36-I39 HydrophobicContact CB-CG1 4.44Å; P36-I39 HydrophobicContact CG-CD1 3.95Å; P37-I39 VanDerWaalsContact C-N 3.26Å; P37-I39 PolarHBondContact O-N 3.26Å; I39-S41 PolarHBondContact O-N 3.21Å; I39-T117 WeakPolarHBondContact O-CB 3.43Å; I39-T117 WeakPolarHBondContact O-CG2 3.05Å; I39-T117 PolarHBondContact O-OG1 3.4Å; I39-V118 HydrophobicContact CD1-CG1 3.74Å; I39-V118 HydrophobicContact CG2-CG1 3.97Å; I39-Y1036 HydrophobicContact CD1-CE1 4.37Å; I39-A1039 HydrophobicContact CG2-CB 3.74Å
40	D	76.4	Confident	87.5	Confident	137 Å²	137	38.9 Å²	38.9	73%	0.733	21%	0.206	S	C	*	.			trans	-88.9	95.9	175.5	-164.9	17.4	0	0	0	111.2	G38	G38-D40 PolarHBondContact O-N 2.91Å
41	S	78.5	Confident	87.9	Confident	46 Å²	46	32.9 Å²	32.9	32%	0.322	18%	0.177	S	C	.	.	S	Bend	trans	-145.5	-179.1	176.5	76.1	0	0	0	0	111.3	I39 V43 T117	I39-S41 PolarHBondContact O-N 3.21Å; S41-V43 PolarHBondContact O-N 2.98Å; S41-T117 WeakPolarHBondContact O-CG2 2.84Å; S41-T117 WeakPolarHBondContact OG-CB 3.27Å; S41-T117 PolarHBondContact OG-O 3.44Å
42	K	82.4	Confident	88	Confident	142 Å²	142	36 Å²	36	62%	0.617	19%	0.186	S	C	*	.			trans	-62.3	132.5	-177.6	-174.5	179.5	174.6	-174.3	0	110.5	T44 N191	K42-T44 PolarHBondContact O-N 3.13Å; K42-N191 PolarHBondContact NZ-OD1 3.09Å
43	V	87.1	Confident	88.3	Confident	23 Å²	23	32.8 Å²	32.8	14%	0.139	18%	0.176	C	C	.	.			trans	-62.7	125.1	177.7	-168.2	0	0	0	0	110.5	S41 A45 R115 I116 V189	S41-V43 PolarHBondContact O-N 2.98Å; V43-A45 WeakPolarHBondContact CG1-O 3.23Å; V43-R115 HydrophobicContact CG1-CB 4.18Å; V43-R115 HydrophobicContact CG2-CB 4.18Å; V43-R115 HydrophobicContact CG2-CG 4.3Å; V43-I116 CarbonylContact C-O 3.6Å; V43-I116 WeakPolarHBondContact CA-O 3.45Å; V43-I116 WeakPolarHBondContact CG1-O 3.45Å; V43-V189 HydrophobicContact CG1-CG2 4.14Å
44	T	88.6	Confident	88.7	Confident	46 Å²	46	31.9 Å²	31.9	28%	0.282	17%	0.17	S	C	.	.			trans	-98.4	-34.4	176.7	58.1	0	0	0	0	111.5	K42 I116 V118 V189	K42-T44 PolarHBondContact O-N 3.13Å; T44-I116 PolarHBondContact N-O 3.21Å; T44-I116 PolarHBondContact OG1-O 3.45Å; T44-V118 PolarHBondContact OG1-O 2.88Å; T44-V189 WeakPolarHBondContact O-CB 3.31Å; T44-V189 PolarHBondContact O-N 2.89Å
45	A	92.2	Very high	88.7	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	169.7	-178.8	0	0	0	0	0	110.8	V43 I116 L120 I186 E187	V43-A45 WeakPolarHBondContact CG1-O 3.23Å; A45-I116 HydrophobicContact CB-CB 4.18Å; A45-I116 HydrophobicContact CB-CD1 3.87Å; A45-I116 PolarHBondContact N-O 3.32Å; A45-I116 WeakPolarHBondContact O-CA 3.3Å; A45-I116 WeakPolarHBondContact O-CB 3.18Å; A45-I116 PolarHBondContact O-N 3.08Å; A45-L120 HydrophobicContact CB-CD2 3.73Å; A45-L120 HydrophobicContact CB-CG 4.41Å; A45-I186 HydrophobicContact CB-CG2 3.89Å; A45-E187 CarbonylContact C-O 3.55Å; A45-E187 VanDerWaalsContact CA-O 3.32Å; A45-E187 WeakPolarHBondContact CA-O 3.29Å
46	H	93.8	Very high	88.6	Confident	29 Å²	29	38.1 Å²	38.1	13%	0.134	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.2	169.5	-63.5	81.3	0	0	0	109.5	R113 Y114 I186 E187	H46-R113 HydrophobicContact CB-CG 4.05Å; H46-R113 PolarHBondContact CD2-NE 2.82Å; H46-R113 PolarHBondContact ND1-NH2 3.41Å; H46-Y114 CarbonylContact C-O 3.54Å; H46-Y114 VanDerWaalsContact CA-O 3.27Å; H46-Y114 WeakPolarHBondContact CA-O 3.28Å; H46-I186 CarbonylContact O-C 3.45Å; H46-I186 WeakPolarHBondContact O-CA 3.48Å; H46-E187 HydrophobicContact CB-CB 4.44Å; H46-E187 PolarHBondContact N-O 2.84Å; H46-E187 PolarHBondContact O-N 2.75Å
47	L	95.4	Very high	88.2	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.6	167.7	-176.1	99.6	0	0	0	108.7	L35 W82 R113 Y114 I116 F123 L157 I186	L35-L47 HydrophobicContact CD1-CB 4.18Å; L35-L47 HydrophobicContact CD1-CD2 3.6Å; L35-L47 HydrophobicContact CD1-CG 4.46Å; L47-W82 HydrophobicContact CD2-CH2 3.31Å; L47-W82 HydrophobicContact CD2-CZ2 3.23Å; L47-W82 HydrophobicContact CD2-CZ3 4.37Å; L47-R113 CarbonylContact O-C 3.53Å; L47-R113 WeakPolarHBondContact O-CA 3.4Å; L47-Y114 HydrophobicContact CD2-CD2 4.03Å; L47-Y114 PolarHBondContact N-O 3.49Å; L47-Y114 PolarHBondContact O-N 2.98Å; L47-I116 HydrophobicContact CB-CD1 4.02Å; L47-I116 HydrophobicContact CB-CG1 4.22Å; L47-F123 HydrophobicContact CD1-CE1 4.11Å; L47-F123 HydrophobicContact CD1-CZ 4.15Å; L47-L157 HydrophobicContact CD1-CD2 3.28Å; L47-I186 HydrophobicContact CD1-CG1 3.98Å
48	I	94.8	Very high	87.4	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	121.5	172.3	-63.8	177.7	0	0	0	108.5	I50 K111 A112 R113 L184 M185 E187	I48-I50 HydrophobicContact CG2-CD1 4.15Å; I48-I50 HydrophobicContact CG2-CG1 3.78Å; I48-K111 HydrophobicContact CG2-CD 4.33Å; I48-K111 HydrophobicContact CG2-CG 4.04Å; I48-A112 WeakPolarHBondContact CA-O 3.46Å; I48-R113 HydrophobicContact CG1-CG 4.27Å; I48-L184 WeakPolarHBondContact O-CA 3Å; I48-M185 HydrophobicContact CB-CG 3.74Å; I48-M185 HydrophobicContact CD1-CG 4.43Å; I48-M185 HydrophobicContact CD1-SD 4.43Å; I48-M185 HydrophobicContact CG1-CG 4.5Å; I48-M185 HydrophobicContact CG2-CG 4.29Å; I48-M185 PolarHBondContact N-O 2.81Å; I48-M185 PolarHBondContact O-N 3.3Å; I48-E187 HydrophobicContact CD1-CG 3.86Å; I48-E187 WeakPolarHBondContact CD1-OE1 3.36Å
49	L	95.6	Very high	86.6	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.4	170.8	171.3	60.9	0	0	0	108.6	V51 V80 W82 F94 K111 A112 Y114 S183 L184	L49-V51 HydrophobicContact CD1-CG2 4.42Å; L49-V51 HydrophobicContact CG-CG2 4.38Å; L49-V80 HydrophobicContact CD2-CB 4.37Å; L49-V80 HydrophobicContact CD2-CG1 3.88Å; L49-V80 HydrophobicContact CD2-CG2 4.2Å; L49-W82 HydrophobicContact CD2-CZ2 4.5Å; L49-F94 HydrophobicContact CB-CZ 4.4Å; L49-F94 HydrophobicContact CD2-CE1 4.37Å; L49-F94 HydrophobicContact CD2-CE2 4.11Å; L49-F94 HydrophobicContact CD2-CZ 3.61Å; L49-F94 HydrophobicContact CG-CE1 4.13Å; L49-F94 HydrophobicContact CG-CZ 3.85Å; L49-K111 CarbonylContact O-C 3.48Å; L49-K111 WeakPolarHBondContact O-CA 3.39Å; L49-A112 PolarHBondContact N-O 3.16Å; L49-A112 PolarHBondContact O-N 3.31Å; L49-Y114 HydrophobicContact CB-CE2 4.11Å; L49-Y114 HydrophobicContact CD2-CE2 4.35Å; L49-S183 CarbonylContact C-O 3.58Å; L49-S183 WeakPolarHBondContact CA-O 3.18Å; L49-L184 HydrophobicContact CD1-CD1 3.54Å; L49-L184 HydrophobicContact CD1-CD2 4.44Å; L49-L184 HydrophobicContact CD1-CG 3.71Å
50	I	94.7	Very high	85.7	Confident	22 Å²	22	49.4 Å²	49.4	11%	0.113	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	124.6	177	-44.5	-178.7	0	0	0	108.9	I48 R52 T110 K111 I182 S183	I48-I50 HydrophobicContact CG2-CD1 4.15Å; I48-I50 HydrophobicContact CG2-CG1 3.78Å; I50-R52 HydrophobicContact CB-CG 4.35Å; I50-R52 HydrophobicContact CG2-CG 3.45Å; I50-R52 VanDerWaalsContact CG2-CG 3.45Å; I50-T110 CarbonylContact C-O 3.57Å; I50-T110 WeakPolarHBondContact CA-O 3.22Å; I50-T110 WeakPolarHBondContact CG2-O 3.02Å; I50-K111 HydrophobicContact CG1-CG 4.22Å; I50-I182 CarbonylContact O-C 3.48Å; I50-I182 WeakPolarHBondContact O-CA 3.44Å; I50-S183 PolarHBondContact N-O 3.47Å; I50-S183 PolarHBondContact O-N 3.47Å
51	V	94	Very high	84.7	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	93.1	172.5	-174.5	0	0	0	0	107.1	L49 V78 F94 P96 T110 L135 L180 I182	L49-V51 HydrophobicContact CD1-CG2 4.42Å; L49-V51 HydrophobicContact CG-CG2 4.38Å; V51-V78 HydrophobicContact CG1-CB 4.41Å; V51-V78 HydrophobicContact CG1-CG1 4.49Å; V51-V78 HydrophobicContact CG1-CG2 4.29Å; V51-F94 HydrophobicContact CB-CB 3.99Å; V51-F94 HydrophobicContact CB-CD1 3.73Å; V51-F94 HydrophobicContact CB-CE1 4.45Å; V51-F94 HydrophobicContact CB-CG 3.98Å; V51-F94 HydrophobicContact CG1-CB 4.42Å; V51-F94 HydrophobicContact CG2-CB 4.22Å; V51-F94 HydrophobicContact CG2-CD1 3.54Å; V51-F94 HydrophobicContact CG2-CD2 4.21Å; V51-F94 HydrophobicContact CG2-CE1 3.88Å; V51-F94 HydrophobicContact CG2-CG 3.74Å; V51-F94 HydrophobicContact CG2-CZ 4.35Å; V51-P96 HydrophobicContact CG1-CB 4.21Å; V51-T110 PolarHBondContact N-O 3.33Å; V51-T110 WeakPolarHBondContact O-CB 3.46Å; V51-T110 VanDerWaalsContact O-CG2 3.28Å; V51-T110 WeakPolarHBondContact O-CG2 3.23Å; V51-L135 HydrophobicContact CG2-CD2 4.03Å; V51-L180 HydrophobicContact CG1-CD1 3.64Å; V51-L180 HydrophobicContact CG1-CD2 4.05Å; V51-L180 HydrophobicContact CG1-CG 3.99Å; V51-I182 HydrophobicContact CG1-CG2 4.26Å; V51-I182 HydrophobicContact CG2-CG2 4.17Å
52	R	90	Very high	83.2	Confident	98 Å²	98	45.7 Å²	45.7	37%	0.37	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	-52.8	-162.4	-67.2	-178.2	177.4	126.8	-1.7	113.2	I50 R97 D164 N181	I50-R52 HydrophobicContact CB-CG 4.35Å; I50-R52 HydrophobicContact CG2-CG 3.45Å; I50-R52 VanDerWaalsContact CG2-CG 3.45Å; R52-R97 PolarHBondContact O-N 2.81Å; R52-D164 IonicContact NH1-OD1 3.39Å; R52-D164 PolarHBondContact NH1-OD1 2.75Å; R52-N181 PolarHBondContact N-O 3.22Å
53	L	91.3	Very high	81.4	Confident	41 Å²	41	44.7 Å²	44.7	22%	0.215	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	133.9	-164.6	179.1	71.4	0	0	0	109.3	R97 A99 N181	L53-R97 CarbonylContact C-O 3.58Å; L53-R97 WeakPolarHBondContact CA-O 3.46Å; L53-R97 HydrophobicContact CD1-CB 4.07Å; L53-R97 HydrophobicContact CD1-CG 4.21Å; L53-R97 WeakPolarHBondContact CD1-O 3.4Å; L53-A99 HydrophobicContact CD1-CB 3.95Å; L53-N181 HydrophobicContact CB-CB 4.15Å; L53-N181 PolarHBondContact O-N 2.91Å
54	F	92.4	Very high	79	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.3	164.7	177.2	-100.3	0	0	0	109.4	P56 L73 I76 P96 R97 L98 A99 V169 D179 L180	F54-P56 HydrophobicContact CD1-CG 4.08Å; F54-P56 HydrophobicContact CE1-CB 3.8Å; F54-P56 HydrophobicContact CE1-CG 3.72Å; F54-P56 HydrophobicContact CZ-CB 4.38Å; F54-L73 HydrophobicContact CE1-CD2 3.34Å; F54-L73 HydrophobicContact CZ-CD2 3.5Å; F54-I76 HydrophobicContact CB-CD1 4.02Å; F54-I76 HydrophobicContact CD1-CD1 3.35Å; F54-I76 HydrophobicContact CD1-CG1 4.45Å; F54-I76 HydrophobicContact CD2-CD1 4.24Å; F54-I76 HydrophobicContact CE1-CD1 3.78Å; F54-I76 HydrophobicContact CG-CD1 3.59Å; F54-I76 HydrophobicContact CZ-CD1 4.39Å; F54-P96 HydrophobicContact CB-CB 4.32Å; F54-P96 HydrophobicContact CB-CG 4.02Å; F54-R97 PolarHBondContact N-O 3.43Å; F54-L98 HydrophobicContact CB-CD2 4.1Å; F54-L98 HydrophobicContact CD1-CD2 3.85Å; F54-L98 HydrophobicContact CG-CD2 4.46Å; F54-A99 PolarHBondContact O-N 3.5Å; F54-V169 HydrophobicContact CD2-CG2 4.27Å; F54-V169 HydrophobicContact CE2-CB 4.08Å; F54-V169 HydrophobicContact CE2-CG1 4.45Å; F54-V169 HydrophobicContact CE2-CG2 3.81Å; F54-D179 WeakPolarHBondContact CA-O 3.33Å; F54-L180 HydrophobicContact CB-CD1 3.93Å; F54-L180 HydrophobicContact CD2-CB 4.4Å; F54-L180 HydrophobicContact CD2-CD1 4.04Å; F54-L180 HydrophobicContact CG-CD1 4.47Å
55	R	90.1	Very high	76.3	Confident	149 Å²	149	63.7 Å²	63.7	56%	0.562	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.6	99.4	178.1	-174.8	-179.7	-70	160	-4.1	108.4	A99 G178 D179	R55-A99 HydrophobicContact CB-CB 3.99Å; R55-A99 HydrophobicContact CG-CB 3.95Å; R55-G178 CarbonylContact O-C 3.59Å; R55-G178 WeakPolarHBondContact O-CA 3.04Å; R55-D179 PolarHBondContact N-O 2.67Å; R55-D179 PolarHBondContact O-N 3.45Å
56	P	85.9	Confident	73.6	Confident	12 Å²	12	70.4 Å²	70.4	8%	0.078	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	150.9	175.5	0.7	7.2	0	0	0	110.9	F54 T61 L73 H100 L177	F54-P56 HydrophobicContact CD1-CG 4.08Å; F54-P56 HydrophobicContact CE1-CB 3.8Å; F54-P56 HydrophobicContact CE1-CG 3.72Å; F54-P56 HydrophobicContact CZ-CB 4.38Å; P56-T61 HydrophobicContact CB-CG2 3.96Å; P56-T61 HydrophobicContact CG-CG2 4.12Å; P56-L73 HydrophobicContact CB-CB 4.41Å; P56-L73 HydrophobicContact CB-CD2 4.5Å; P56-H100 WeakPolarHBondContact CG-ND1 3.41Å; P56-L177 WeakPolarHBondContact CA-O 3.5Å
57	N	82	Confident	70.9	Confident	66 Å²	66	77.2 Å²	77.2	35%	0.353	39%	0.385	S	S	.	.			trans	-71	145.1	174.2	-167.4	7.4	0	0	0	110.2	S59 F60 K176 L177	N57-S59 PolarHBondContact O-N 3.4Å; N57-S59 VanDerWaalsContact O-N 3.15Å; N57-F60 HydrophobicContact CB-CD2 4.1Å; N57-F60 PolarHBondContact O-N 3.37Å; N57-K176 PolarHBondContact ND2-O 3.44Å; N57-L177 WeakPolarHBondContact CB-O 3.4Å; N57-L177 PolarHBondContact N-O 3.29Å
58	S	69.6	Low	68	Low	91 Å²	91	86.9 Å²	86.9	64%	0.636	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-58.9	-32.9	-169.8	57	0	0	0	0	113.1	F60 T61	S58-F60 PolarHBondContact O-N 3.41Å; S58-F60 VanDerWaalsContact O-N 3.16Å; S58-T61 WeakPolarHBondContact CA-OG1 3.41Å; S58-T61 PolarHBondContact O-N 3.43Å; S58-T61 VanDerWaalsContact O-N 3.1Å; S58-T61 PolarHBondContact O-OG1 3.16Å
59	S	63.6	Low	65.2	Low	79 Å²	79	90.7 Å²	90.7	55%	0.552	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-56.1	-28.6	175.5	54.2	0	0	0	0	113.6	N57	N57-S59 PolarHBondContact O-N 3.4Å; N57-S59 VanDerWaalsContact O-N 3.15Å
60	F	61	Low	62.6	Low	55 Å²	55	96 Å²	96	24%	0.241	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-100.1	-4.2	-178.3	-60.7	-77.4	0	0	0	113.8	N57 S58 L73 L177	N57-F60 HydrophobicContact CB-CD2 4.1Å; N57-F60 PolarHBondContact O-N 3.37Å; S58-F60 PolarHBondContact O-N 3.41Å; S58-F60 VanDerWaalsContact O-N 3.16Å; F60-L73 HydrophobicContact CB-CD1 3.65Å; F60-L73 HydrophobicContact CD1-CD1 4.44Å; F60-L73 HydrophobicContact CG-CD1 4.09Å; F60-L177 HydrophobicContact CD2-CD2 4.37Å; F60-L177 HydrophobicContact CE1-CD2 4.04Å; F60-L177 HydrophobicContact CE2-CD2 3.82Å; F60-L177 HydrophobicContact CZ-CD2 3.63Å
61	T	54.8	Low	60.1	Low	69 Å²	69	99.1 Å²	99.1	42%	0.423	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-11.4	177	60.9	0	0	0	0	113.5	P56 S58 S63 H100	P56-T61 HydrophobicContact CB-CG2 3.96Å; P56-T61 HydrophobicContact CG-CG2 4.12Å; S58-T61 WeakPolarHBondContact CA-OG1 3.41Å; S58-T61 PolarHBondContact O-N 3.43Å; S58-T61 VanDerWaalsContact O-N 3.1Å; S58-T61 PolarHBondContact O-OG1 3.16Å; T61-S63 PolarHBondContact O-N 3.04Å; T61-H100 HydrophobicContact CG2-CB 4.36Å
62	G	48.5	Very low	58.2	Low	36 Å²	36	100.1 Å²	100.1	37%	0.371	53%	0.528	S	S	.	.			trans	-67.5	115	-173.5	0	0	0	0	0	113	R64	G62-R64 PolarHBondContact O-N 3.26Å
63	S	43	Very low	56.8	Low	122 Å²	122	96.4 Å²	96.4	85%	0.853	52%	0.515	S	S	*	.			trans	-68.3	15	172.6	-173.9	0	0	0	0	114.3	T61 R65	T61-S63 PolarHBondContact O-N 3.04Å; S63-R65 PolarHBondContact O-N 2.98Å
64	R	37.3	Very low	55.7	Low	222 Å²	222	97.8 Å²	97.8	84%	0.838	52%	0.522	S	S	*	.			trans	-73.2	102.9	175.3	-86.9	-170	-179.3	-167.4	1.4	108.7	G62 L66	G62-R64 PolarHBondContact O-N 3.26Å; R64-L66 VanDerWaalsContact C-N 3.31Å; R64-L66 PolarHBondContact O-N 2.93Å
65	R	31.6	Very low	55	Low	245 Å²	245	101.1 Å²	101.1	93%	0.925	54%	0.54	S	S	*	.			trans	-36.8	89.8	161.8	-116.1	179.2	179.2	-175.6	-0.8	109.9	S63	S63-R65 PolarHBondContact O-N 2.98Å
66	L	36.2	Very low	54.9	Low	142 Å²	142	94.4 Å²	94.4	74%	0.743	52%	0.515	S	S	*	.			trans	-107.3	116.9	155.8	-117.8	79.3	0	0	0	104.9	R64	R64-L66 VanDerWaalsContact C-N 3.31Å; R64-L66 PolarHBondContact O-N 2.93Å
67	E	37.3	Very low	55.2	Low	172 Å²	172	94.8 Å²	94.8	80%	0.804	52%	0.516	S	S	*	.	S	Bend	trans	-56.2	143.4	166.5	-64.7	171.8	171.2	0	0	107.5
68	F	34.8	Very low	55.7	Low	203 Å²	203	91.7 Å²	91.7	89%	0.89	50%	0.499	S	S	*	.	S	Bend	trans	92.3	101.9	-165.1	-51.6	-68.8	0	0	0	114.4
69	G	36.3	Very low	56.9	Low	80 Å²	80	89.7 Å²	89.7	83%	0.825	48%	0.479	S	S	*	.	S	Bend	trans	-73.3	141.2	-159	0	0	0	0	0	117.5
70	S	40.2	Very low	58.3	Low	111 Å²	111	85.9 Å²	85.9	78%	0.776	45%	0.453	S	S	*	.			trans	173.2	12.2	146.2	54.4	0	0	0	0	112.4	S72	S70-S72 PolarHBondContact O-N 3.43Å; S70-S72 VanDerWaalsContact O-N 3.1Å
71	N	42.7	Very low	59.6	Low	89 Å²	89	87.6 Å²	87.6	48%	0.476	46%	0.458	S	S	.	.			trans	-77.8	95	173.4	-76.8	-10.9	0	0	0	111.4
72	S	53.4	Low	61.4	Low	21 Å²	21	84.6 Å²	84.6	15%	0.147	44%	0.439	C	S	.	.				-177.6	101.4	127.4	60.9	0	0	0	0	111	S70 N74 R141	S70-S72 PolarHBondContact O-N 3.43Å; S70-S72 VanDerWaalsContact O-N 3.1Å; S72-N74 PolarHBondContact O-N 3.39Å; S72-R141 PolarHBondContact O-NH2 3.48Å; S72-R141 PolarHBondContact OG-NH1 3.16Å; S72-R141 PolarHBondContact OG-NH2 3.29Å
73	L	60.9	Low	63.2	Low	20 Å²	20	87.2 Å²	87.2	11%	0.105	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	33.3	161.8	-94	119	0	0	0	112.2	F54 P56 F60 I76 H100 I146	F54-L73 HydrophobicContact CE1-CD2 3.34Å; F54-L73 HydrophobicContact CZ-CD2 3.5Å; P56-L73 HydrophobicContact CB-CB 4.41Å; P56-L73 HydrophobicContact CB-CD2 4.5Å; F60-L73 HydrophobicContact CB-CD1 3.65Å; F60-L73 HydrophobicContact CD1-CD1 4.44Å; F60-L73 HydrophobicContact CG-CD1 4.09Å; L73-I76 HydrophobicContact CD2-CG2 4.37Å; L73-H100 PolarHBondContact O-CE1 2.99Å; L73-H100 VanDerWaalsContact O-CE1 3.24Å; L73-I146 HydrophobicContact CD2-CD1 3.68Å; L73-I146 HydrophobicContact CG-CD1 4.09Å
74	N	67.5	Low	65.1	Low	69 Å²	69	82.6 Å²	82.6	37%	0.369	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-31.9	-172.7	-75.6	-5.1	0	0	0	111.7	S72 L98 H100 K101	S72-N74 PolarHBondContact O-N 3.39Å; N74-L98 WeakPolarHBondContact O-CD1 3.13Å; N74-H100 PolarHBondContact OD1-NE2 2.79Å; N74-K101 WeakPolarHBondContact O-CE 3.45Å; N74-K101 PolarHBondContact O-NZ 3.13Å
75	D	78.8	Confident	67.2	Low	71 Å²	71	72.7 Å²	72.7	38%	0.38	37%	0.372	S	S	.	.	S	Bend	trans	-135	96.2	-174.9	-63.4	-41	0	0	0	109	K101 I140	D75-K101 IonicContact OD1-NZ 3.82Å; D75-K101 PolarHBondContact OD1-NZ 3.05Å; D75-I140 HydrophobicContact CB-CB 4.23Å; D75-I140 HydrophobicContact CB-CD1 3.93Å; D75-I140 HydrophobicContact CB-CG1 4.49Å; D75-I140 WeakPolarHBondContact O-CB 3.25Å; D75-I140 PolarHBondContact O-N 2.9Å
76	I	88.1	Confident	69.1	Low	7 Å²	7	63.9 Å²	63.9	4%	0.036	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	158.1	179.3	60.2	154.3	0	0	0	110.6	F54 L73 L98 V137 I138 I146	F54-I76 HydrophobicContact CB-CD1 4.02Å; F54-I76 HydrophobicContact CD1-CD1 3.35Å; F54-I76 HydrophobicContact CD1-CG1 4.45Å; F54-I76 HydrophobicContact CD2-CD1 4.24Å; F54-I76 HydrophobicContact CE1-CD1 3.78Å; F54-I76 HydrophobicContact CG-CD1 3.59Å; F54-I76 HydrophobicContact CZ-CD1 4.39Å; L73-I76 HydrophobicContact CD2-CG2 4.37Å; I76-L98 HydrophobicContact CD1-CD2 3.82Å; I76-L98 HydrophobicContact CG1-CD2 3.63Å; I76-V137 HydrophobicContact CB-CG1 4.13Å; I76-V137 HydrophobicContact CD1-CG1 3.61Å; I76-V137 HydrophobicContact CG1-CG1 4.48Å; I76-V137 HydrophobicContact CG2-CG1 4.35Å; I76-I138 VanDerWaalsContact CA-O 3.28Å; I76-I138 WeakPolarHBondContact CA-O 3.49Å; I76-I146 HydrophobicContact CG2-CD1 3.75Å
77	Y	91.9	Very high	70.8	Confident	21 Å²	21	60.7 Å²	60.7	8%	0.082	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	163.9	161.1	67	-90.8	0	0	0	110	Q79 I93 F94 I138 I140 Q143	Y77-Q79 HydrophobicContact CE2-CB 4.27Å; Y77-I93 HydrophobicContact CD2-CB 4.48Å; Y77-I93 HydrophobicContact CD2-CG1 4.34Å; Y77-I93 HydrophobicContact CD2-CG2 3.51Å; Y77-I93 HydrophobicContact CE2-CD1 4.35Å; Y77-I93 HydrophobicContact CE2-CG1 4.33Å; Y77-I93 HydrophobicContact CE2-CG2 4.22Å; Y77-I93 HydrophobicContact CG-CG2 3.88Å; Y77-F94 CarbonylContact C-O 3.58Å; Y77-F94 WeakPolarHBondContact CA-O 3.3Å; Y77-F94 WeakPolarHBondContact CB-O 3.45Å; Y77-I138 HydrophobicContact CD1-CB 4.28Å; Y77-I138 HydrophobicContact CD1-CG2 4.34Å; Y77-I138 HydrophobicContact CD2-CB 4.27Å; Y77-I138 HydrophobicContact CD2-CD1 4.44Å; Y77-I138 HydrophobicContact CE1-CB 3.85Å; Y77-I138 HydrophobicContact CE1-CG2 3.52Å; Y77-I138 HydrophobicContact CE2-CB 3.84Å; Y77-I138 HydrophobicContact CE2-CD1 3.55Å; Y77-I138 HydrophobicContact CE2-CG1 4.24Å; Y77-I138 HydrophobicContact CE2-CG2 4.17Å; Y77-I138 VanDerWaalsContact CZ-CG2 3.44Å; Y77-I138 PolarHBondContact N-O 2.73Å; Y77-I138 PolarHBondContact O-N 3Å; Y77-I138 WeakPolarHBondContact OH-CG2 3.37Å; Y77-I140 HydrophobicContact CD1-CG1 3.62Å; Y77-I140 HydrophobicContact CE1-CG1 4.31Å; Y77-Q143 PolarHBondContact OH-OE1 3.2Å
78	V	93.3	Very high	72.2	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	119.5	177.8	-178.2	0	0	0	0	108.7	V51 V80 F94 P96 L135 D136 V137 L180	V51-V78 HydrophobicContact CG1-CB 4.41Å; V51-V78 HydrophobicContact CG1-CG1 4.49Å; V51-V78 HydrophobicContact CG1-CG2 4.29Å; V78-V80 HydrophobicContact CG1-CG2 4.27Å; V78-F94 HydrophobicContact CB-CB 4.27Å; V78-F94 PolarHBondContact N-O 3.22Å; V78-F94 PolarHBondContact O-N 3.48Å; V78-P96 HydrophobicContact CG2-CG 3.94Å; V78-L135 HydrophobicContact CG1-CB 3.79Å; V78-L135 HydrophobicContact CG1-CD2 4.15Å; V78-D136 CarbonylContact C-O 3.58Å; V78-D136 WeakPolarHBondContact CA-O 3.3Å; V78-V137 HydrophobicContact CG2-CG2 4.25Å; V78-L180 HydrophobicContact CG1-CD2 4.09Å; V78-L180 HydrophobicContact CG2-CD1 4.01Å; V78-L180 HydrophobicContact CG2-CD2 4.3Å
79	Q	92.8	Very high	74	Confident	49 Å²	49	52.4 Å²	52.4	23%	0.229	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	130.4	174.6	-174.4	175.8	-3.1	0	0	109.7	Y77 C91 D136 I138	Y77-Q79 HydrophobicContact CE2-CB 4.27Å; Q79-C91 HydrophobicContact CG-CB 3.99Å; Q79-C91 PolarHBondContact NE2-SG 3.07Å; Q79-D136 PolarHBondContact N-O 2.67Å; Q79-D136 PolarHBondContact O-N 3.46Å; Q79-I138 HydrophobicContact CB-CD1 3.87Å
80	V	93.3	Very high	75.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.4	177.2	-174.4	0	0	0	0	108.8	L49 V78 C91 A92 F94 L133 L135	L49-V80 HydrophobicContact CD2-CB 4.37Å; L49-V80 HydrophobicContact CD2-CG1 3.88Å; L49-V80 HydrophobicContact CD2-CG2 4.2Å; V78-V80 HydrophobicContact CG1-CG2 4.27Å; V80-C91 WeakPolarHBondContact O-CB 3.06Å; V80-A92 PolarHBondContact N-O 2.89Å; V80-A92 PolarHBondContact O-N 3.49Å; V80-F94 HydrophobicContact CB-CD2 4.41Å; V80-F94 HydrophobicContact CB-CE2 3.87Å; V80-F94 HydrophobicContact CG2-CD2 3.71Å; V80-F94 HydrophobicContact CG2-CE2 3.52Å; V80-F94 HydrophobicContact CG2-CZ 4.45Å; V80-L133 HydrophobicContact CG1-CD1 3.87Å; V80-L133 HydrophobicContact CG1-CD2 4.34Å; V80-L133 HydrophobicContact CG1-CG 4.34Å; V80-L135 HydrophobicContact CG2-CB 4.39Å; V80-L135 HydrophobicContact CG2-CD2 3.75Å; V80-L135 HydrophobicContact CG2-CG 3.85Å
81	R	89.9	Confident	77.9	Confident	91 Å²	91	50.8 Å²	50.8	34%	0.343	28%	0.284	S	S	.	.			trans	-123.8	130.8	176.7	-176.4	175.9	-71.8	-172.2	-10.8	109.5	E85 A87 C91	R81-E85 WeakPolarHBondContact CA-OE2 3.49Å; R81-E85 HydrophobicContact CG-CB 4.07Å; R81-E85 HydrophobicContact CG-CG 4.44Å; R81-A87 VanDerWaalsContact NH1-CA 3.26Å; R81-A87 PolarHBondContact NH1-O 3.49Å; R81-A87 PolarHBondContact NH2-O 3.32Å; R81-C91 PolarHBondContact NE-SG 3.21Å; R81-C91 PolarHBondContact NH2-SG 3.47Å
82	W	91.1	Very high	80.1	Confident	6 Å²	6	46.6 Å²	46.6	2%	0.023	26%	0.262	C	S	.	.			trans	-86.3	157.7	177.5	-70.6	89.5	0	0	0	111.5	L35 P37 L47 L49 E85 Y114 Y126 L127 M130 L133 L184	L35-W82 HydrophobicContact CD1-CD2 4.03Å; L35-W82 HydrophobicContact CD1-CE3 4.26Å; L35-W82 HydrophobicContact CD1-CH2 4.27Å; L35-W82 HydrophobicContact CD1-CZ2 4.02Å; L35-W82 HydrophobicContact CD1-CZ3 4.38Å; L35-W82 HydrophobicContact CD2-CB 3.83Å; L35-W82 HydrophobicContact CD2-CD2 3.63Å; L35-W82 HydrophobicContact CD2-CE3 4.03Å; L35-W82 HydrophobicContact CD2-CG 3.52Å; P37-W82 HydrophobicContact CG-CB 4.48Å; L47-W82 HydrophobicContact CD2-CH2 3.31Å; L47-W82 HydrophobicContact CD2-CZ2 3.23Å; L47-W82 HydrophobicContact CD2-CZ3 4.37Å; L49-W82 HydrophobicContact CD2-CZ2 4.5Å; W82-E85 PolarHBondContact N-OE2 3.12Å; W82-E85 VanDerWaalsContact O-CB 3.27Å; W82-E85 WeakPolarHBondContact O-CB 3.44Å; W82-E85 PolarHBondContact O-N 3.22Å; W82-Y114 AromaticContact CD1-CE1 3.6Å; W82-Y114 AromaticContact CD1-CZ 3.85Å; W82-Y114 HydrophobicContact CZ2-CE2 4.35Å; W82-Y114 AromaticContact NE1-CD1 3.88Å; W82-Y114 AromaticContact NE1-CE1 3.29Å; W82-Y114 VanDerWaalsContact NE1-CE1 3.29Å; W82-Y114 AromaticContact NE1-CE2 3.59Å; W82-Y114 AromaticContact NE1-CZ 3.12Å; W82-Y114 PolarHBondContact NE1-OH 2.85Å; W82-Y126 HydrophobicContact CE3-CE1 4.39Å; W82-L127 HydrophobicContact CZ3-CD2 4.17Å; W82-M130 HydrophobicContact CE3-CE 4.11Å; W82-M130 HydrophobicContact CE3-SD 3.83Å; W82-M130 HydrophobicContact CZ3-SD 4.22Å; W82-L133 HydrophobicContact CD2-CD1 4.22Å; W82-L133 HydrophobicContact CE3-CD1 4.19Å; W82-L133 HydrophobicContact CH2-CD2 4Å; W82-L133 HydrophobicContact CZ2-CD2 4.17Å; W82-L133 HydrophobicContact CZ3-CD1 4.35Å; W82-L133 HydrophobicContact CZ3-CD2 4.46Å; W82-L184 HydrophobicContact CH2-CD2 4.16Å
83	W	87.1	Confident	81.9	Confident	91 Å²	91	48.5 Å²	48.5	35%	0.345	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	133.3	176.2	-177.8	65.6	0	0	0	110.6	P37 E85 Y126 D129 M130 S1188	P37-W83 WeakPolarHBondContact CD-O 3.49Å; P37-W83 WeakPolarHBondContact CG-O 3.45Å; W83-E85 VanDerWaalsContact C-N 3.31Å; W83-Y126 AromaticContact CE3-CD2 3.8Å; W83-Y126 HydrophobicContact CE3-CD2 3.8Å; W83-Y126 AromaticContact CE3-CE2 3.51Å; W83-Y126 HydrophobicContact CE3-CE2 3.51Å; W83-Y126 AromaticContact CZ3-CD2 3.99Å; W83-Y126 HydrophobicContact CZ3-CD2 3.99Å; W83-Y126 HydrophobicContact CZ3-CE2 4.12Å; W83-Y126 PolarHBondContact N-OH 3Å; W83-Y126 WeakPolarHBondContact O-CE2 3.03Å; W83-Y126 PolarHBondContact O-OH 3.03Å; W83-D129 HydrophobicContact CH2-CB 4.21Å; W83-D129 HydrophobicContact CZ3-CB 3.99Å; W83-M130 HydrophobicContact CB-CB 4.03Å; W83-M130 HydrophobicContact CB-CE 4.15Å; W83-M130 HydrophobicContact CB-CG 3.65Å; W83-M130 HydrophobicContact CB-SD 3.7Å; W83-M130 HydrophobicContact CE3-CB 4.29Å; W83-M130 HydrophobicContact CG-CB 4.4Å; W83-M130 HydrophobicContact CG-CG 4.37Å; W83-S1188 VanDerWaalsContact CH2-CB 3.43Å; W83-S1188 WeakPolarHBondContact CZ3-OG 3.49Å
84	G	82.1	Confident	83.5	Confident	24 Å²	24	47.6 Å²	47.6	25%	0.247	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	-4.5	-171.1	0	0	0	0	0	114.8	P37	P37-G84 WeakPolarHBondContact CB-O 3.26Å
85	E	82.2	Confident	84.6	Confident	14 Å²	14	48.9 Å²	48.9	7%	0.065	27%	0.265	C	S	.	.			trans	-75.1	126.7	174.3	-169.1	176.5	-175.3	0	0	110.1	T33 P37 R81 W82 W83 A87	T33-E85 HydrophobicContact CG2-CG 4.2Å; P37-E85 HydrophobicContact CG-CB 4.27Å; R81-E85 WeakPolarHBondContact CA-OE2 3.49Å; R81-E85 HydrophobicContact CG-CB 4.07Å; R81-E85 HydrophobicContact CG-CG 4.44Å; W82-E85 PolarHBondContact N-OE2 3.12Å; W82-E85 VanDerWaalsContact O-CB 3.27Å; W82-E85 WeakPolarHBondContact O-CB 3.44Å; W82-E85 PolarHBondContact O-N 3.22Å; W83-E85 VanDerWaalsContact C-N 3.31Å; E85-A87 PolarHBondContact O-N 3.07Å
86	P	70.9	Confident	85.1	Confident	60 Å²	60	45.8 Å²	45.8	39%	0.39	25%	0.249	S	C	.	.			trans	-62	134.3	-173.5	22.1	-32.5	0	0	0	112.4	G88 E89	P86-G88 VanDerWaalsContact C-N 3.28Å; P86-G88 PolarHBondContact O-N 2.89Å; P86-E89 HydrophobicContact CB-CG 4.23Å; P86-E89 HydrophobicContact CG-CB 4.04Å; P86-E89 HydrophobicContact CG-CG 3.72Å; P86-E89 VanDerWaalsContact CG-OE2 3.32Å; P86-E89 WeakPolarHBondContact CG-OE2 3.01Å; P86-E89 PolarHBondContact O-N 3.17Å
87	A	71.4	Confident	85.1	Confident	75 Å²	75	50.3 Å²	50.3	62%	0.62	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.1	-167.1	0	0	0	0	0	115.2	R81 E85	R81-A87 VanDerWaalsContact NH1-CA 3.26Å; R81-A87 PolarHBondContact NH1-O 3.49Å; R81-A87 PolarHBondContact NH2-O 3.32Å; E85-A87 PolarHBondContact O-N 3.07Å
88	G	67.4	Low	84.8	Confident	84 Å²	84	49.8 Å²	49.8	87%	0.866	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-7.7	179.4	0	0	0	0	0	114.8	P86	P86-G88 VanDerWaalsContact C-N 3.28Å; P86-G88 PolarHBondContact O-N 2.89Å
89	E	72.6	Confident	84.3	Confident	118 Å²	118	51 Å²	51	55%	0.551	28%	0.275	S	S	*	.	S	Bend	trans	-90.9	165.7	-178.9	-65.6	-170.5	176.2	0	0	112.7	P86	P86-E89 HydrophobicContact CB-CG 4.23Å; P86-E89 HydrophobicContact CG-CB 4.04Å; P86-E89 HydrophobicContact CG-CG 3.72Å; P86-E89 VanDerWaalsContact CG-OE2 3.32Å; P86-E89 WeakPolarHBondContact CG-OE2 3.01Å; P86-E89 PolarHBondContact O-N 3.17Å
90	K	75.9	Confident	83.6	Confident	150 Å²	150	51.9 Å²	51.9	65%	0.652	28%	0.279	S	S	*	.			trans	-67.2	135.3	177.8	-66	-178.6	179.8	178.4	0	110	Y32	Y32-K90 WeakPolarHBondContact CB-O 3.16Å; Y32-K90 HydrophobicContact CD1-CB 4.13Å; Y32-K90 HydrophobicContact CD2-CB 3.78Å; Y32-K90 WeakPolarHBondContact CD2-O 3.2Å; Y32-K90 HydrophobicContact CE1-CB 4.06Å; Y32-K90 HydrophobicContact CE1-CD 4.05Å; Y32-K90 HydrophobicContact CE2-CB 3.72Å; Y32-K90 HydrophobicContact CG-CB 3.98Å
91	C	83.5	Confident	82.5	Confident	6 Å²	6	54.2 Å²	54.2	4%	0.041	29%	0.289	C	S	.	.			trans	-106.5	168.3	176.8	-37.2	0	0	0	0	110.7	Y32 Q79 V80 R81 I93	Y32-C91 VanDerWaalsContact CE2-O 3.31Å; Y32-C91 WeakPolarHBondContact CE2-O 3.35Å; Q79-C91 HydrophobicContact CG-CB 3.99Å; Q79-C91 PolarHBondContact NE2-SG 3.07Å; V80-C91 WeakPolarHBondContact O-CB 3.06Å; R81-C91 PolarHBondContact NE-SG 3.21Å; R81-C91 PolarHBondContact NH2-SG 3.47Å; C91-I93 PolarHBondContact O-N 3.39Å
92	A	89.1	Confident	81.3	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.008	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	129.9	175.3	0	0	0	0	0	111.2	V29 V31 V80 F94 Y114	V29-A92 HydrophobicContact CG1-CB 3.97Å; V31-A92 HydrophobicContact CG1-CB 4.48Å; V80-A92 PolarHBondContact N-O 2.89Å; V80-A92 PolarHBondContact O-N 3.49Å; A92-F94 HydrophobicContact CB-CE2 3.75Å; A92-F94 HydrophobicContact CB-CZ 4.39Å; A92-Y114 WeakPolarHBondContact CB-OH 3.32Å
93	I	90.6	Very high	80	Confident	62 Å²	62	56.8 Å²	56.8	32%	0.318	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	123.2	-179.8	-65.4	171.9	0	0	0	109.1	V29 Y77 C91 Y95	V29-I93 VanDerWaalsContact CG1-O 3.26Å; V29-I93 WeakPolarHBondContact CG1-O 3.44Å; Y77-I93 HydrophobicContact CD2-CB 4.48Å; Y77-I93 HydrophobicContact CD2-CG1 4.34Å; Y77-I93 HydrophobicContact CD2-CG2 3.51Å; Y77-I93 HydrophobicContact CE2-CD1 4.35Å; Y77-I93 HydrophobicContact CE2-CG1 4.33Å; Y77-I93 HydrophobicContact CE2-CG2 4.22Å; Y77-I93 HydrophobicContact CG-CG2 3.88Å; C91-I93 PolarHBondContact O-N 3.39Å; I93-Y95 HydrophobicContact CG2-CD2 4.4Å; I93-Y95 HydrophobicContact CG2-CE2 3.75Å
94	F	93.5	Very high	78.9	Confident	0 Å²	0	59 Å²	59	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	139.6	-179.5	-61.7	-106.5	0	0	0	110.1	V29 L49 V51 Y77 V78 V80 A92 P96 C109 T110 A112	V29-F94 HydrophobicContact CB-CD1 4.47Å; V29-F94 HydrophobicContact CB-CE1 4.31Å; V29-F94 HydrophobicContact CG1-CD2 4.44Å; V29-F94 HydrophobicContact CG1-CE1 4.44Å; V29-F94 HydrophobicContact CG1-CE2 4.26Å; V29-F94 HydrophobicContact CG1-CZ 4.28Å; V29-F94 HydrophobicContact CG2-CD1 3.63Å; V29-F94 HydrophobicContact CG2-CE1 3.9Å; V29-F94 HydrophobicContact CG2-CG 4.06Å; L49-F94 HydrophobicContact CB-CZ 4.4Å; L49-F94 HydrophobicContact CD2-CE1 4.37Å; L49-F94 HydrophobicContact CD2-CE2 4.11Å; L49-F94 HydrophobicContact CD2-CZ 3.61Å; L49-F94 HydrophobicContact CG-CE1 4.13Å; L49-F94 HydrophobicContact CG-CZ 3.85Å; V51-F94 HydrophobicContact CB-CB 3.99Å; V51-F94 HydrophobicContact CB-CD1 3.73Å; V51-F94 HydrophobicContact CB-CE1 4.45Å; V51-F94 HydrophobicContact CB-CG 3.98Å; V51-F94 HydrophobicContact CG1-CB 4.42Å; V51-F94 HydrophobicContact CG2-CB 4.22Å; V51-F94 HydrophobicContact CG2-CD1 3.54Å; V51-F94 HydrophobicContact CG2-CD2 4.21Å; V51-F94 HydrophobicContact CG2-CE1 3.88Å; V51-F94 HydrophobicContact CG2-CG 3.74Å; V51-F94 HydrophobicContact CG2-CZ 4.35Å; Y77-F94 CarbonylContact C-O 3.58Å; Y77-F94 WeakPolarHBondContact CA-O 3.3Å; Y77-F94 WeakPolarHBondContact CB-O 3.45Å; V78-F94 HydrophobicContact CB-CB 4.27Å; V78-F94 PolarHBondContact N-O 3.22Å; V78-F94 PolarHBondContact O-N 3.48Å; V80-F94 HydrophobicContact CB-CD2 4.41Å; V80-F94 HydrophobicContact CB-CE2 3.87Å; V80-F94 HydrophobicContact CG2-CD2 3.71Å; V80-F94 HydrophobicContact CG2-CE2 3.52Å; V80-F94 HydrophobicContact CG2-CZ 4.45Å; A92-F94 HydrophobicContact CB-CE2 3.75Å; A92-F94 HydrophobicContact CB-CZ 4.39Å; F94-P96 VanDerWaalsContact O-CD 3.29Å; F94-P96 WeakPolarHBondContact O-CD 3.24Å; F94-C109 CarbonylContact C-O 3.57Å; F94-C109 WeakPolarHBondContact CA-O 3.24Å; F94-T110 WeakPolarHBondContact CD1-O 3.43Å; F94-A112 HydrophobicContact CE1-CB 3.6Å; F94-A112 HydrophobicContact CE2-CB 4.41Å; F94-A112 HydrophobicContact CZ-CB 3.33Å
95	Y	90.7	Very high	78.1	Confident	96 Å²	96	68.5 Å²	68.5	38%	0.376	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-111.8	87.5	171.2	-64.9	-88	0	0	0	108.1	I93 T108 C109 T110 I140	I93-Y95 HydrophobicContact CG2-CD2 4.4Å; I93-Y95 HydrophobicContact CG2-CE2 3.75Å; Y95-T108 WeakPolarHBondContact O-CA 3.49Å; Y95-T108 WeakPolarHBondContact O-CB 3.46Å; Y95-C109 HydrophobicContact CD2-CB 3.98Å; Y95-C109 PolarHBondContact N-O 3.42Å; Y95-C109 PolarHBondContact O-N 3.04Å; Y95-T110 WeakPolarHBondContact O-CG2 3.36Å; Y95-I140 HydrophobicContact CD1-CD1 4.49Å; Y95-I140 HydrophobicContact CE1-CD1 4.07Å
96	P	90.7	Very high	77.8	Confident	7 Å²	7	70 Å²	70	5%	0.045	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-66.3	157	177.9	28.5	-34.2	0	0	0	110.9	V51 F54 V78 F94 L180	V51-P96 HydrophobicContact CG1-CB 4.21Å; F54-P96 HydrophobicContact CB-CB 4.32Å; F54-P96 HydrophobicContact CB-CG 4.02Å; V78-P96 HydrophobicContact CG2-CG 3.94Å; F94-P96 VanDerWaalsContact O-CD 3.29Å; F94-P96 WeakPolarHBondContact O-CD 3.24Å; P96-L180 HydrophobicContact CG-CD1 4.44Å
97	R	87.7	Confident	78	Confident	102 Å²	102	71.9 Å²	71.9	39%	0.385	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	141.5	167.2	-172.5	170.9	174.8	163.3	-4.9	109.2	R52 L53 F54 T108	R52-R97 PolarHBondContact O-N 2.81Å; L53-R97 CarbonylContact C-O 3.58Å; L53-R97 WeakPolarHBondContact CA-O 3.46Å; L53-R97 HydrophobicContact CD1-CB 4.07Å; L53-R97 HydrophobicContact CD1-CG 4.21Å; L53-R97 WeakPolarHBondContact CD1-O 3.4Å; F54-R97 PolarHBondContact N-O 3.43Å; R97-T108 HydrophobicContact CB-CG2 4.25Å
98	L	86.2	Confident	78.5	Confident	9 Å²	9	70.5 Å²	70.5	5%	0.047	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.7	176.2	-60.8	176.3	0	0	0	110	F54 N74 I76 H100 K101 Q106	F54-L98 HydrophobicContact CB-CD2 4.1Å; F54-L98 HydrophobicContact CD1-CD2 3.85Å; F54-L98 HydrophobicContact CG-CD2 4.46Å; N74-L98 WeakPolarHBondContact O-CD1 3.13Å; I76-L98 HydrophobicContact CD1-CD2 3.82Å; I76-L98 HydrophobicContact CG1-CD2 3.63Å; L98-H100 PolarHBondContact O-N 3.34Å; L98-K101 HydrophobicContact CB-CB 4.36Å; L98-K101 HydrophobicContact CD1-CD 4.14Å; L98-K101 PolarHBondContact O-N 3.28Å; L98-K101 VanDerWaalsContact O-N 3.08Å; L98-Q106 PolarHBondContact O-NE2 3.03Å
99	A	82.7	Confident	79.5	Confident	27 Å²	27	67.8 Å²	67.8	22%	0.223	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-63.4	-25.9	-173.9	0	0	0	0	0	113.9	L53 F54 R55 V102	L53-A99 HydrophobicContact CD1-CB 3.95Å; F54-A99 PolarHBondContact O-N 3.5Å; R55-A99 HydrophobicContact CB-CB 3.99Å; R55-A99 HydrophobicContact CG-CB 3.95Å; A99-V102 WeakPolarHBondContact O-CG2 3.38Å
100	H	76.2	Confident	80.2	Confident	67 Å²	67	63.5 Å²	63.5	31%	0.31	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-85.3	-8.1	178.5	64.7	-83.6	0	0	0	113.2	P56 T61 L73 N74 L98	P56-H100 WeakPolarHBondContact CG-ND1 3.41Å; T61-H100 HydrophobicContact CG2-CB 4.36Å; L73-H100 PolarHBondContact O-CE1 2.99Å; L73-H100 VanDerWaalsContact O-CE1 3.24Å; N74-H100 PolarHBondContact OD1-NE2 2.79Å; L98-H100 PolarHBondContact O-N 3.34Å
101	K	72	Confident	81	Confident	49 Å²	49	60.2 Å²	60.2	21%	0.213	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-104.6	25.3	175.1	-70.6	-175.4	175.7	179.7	0	112	N74 D75 L98 G103 H104 Q106	N74-K101 WeakPolarHBondContact O-CE 3.45Å; N74-K101 PolarHBondContact O-NZ 3.13Å; D75-K101 IonicContact OD1-NZ 3.82Å; D75-K101 PolarHBondContact OD1-NZ 3.05Å; L98-K101 HydrophobicContact CB-CB 4.36Å; L98-K101 HydrophobicContact CD1-CD 4.14Å; L98-K101 PolarHBondContact O-N 3.28Å; L98-K101 VanDerWaalsContact O-N 3.08Å; K101-G103 PolarHBondContact O-N 2.85Å; K101-H104 PolarHBondContact O-N 3.09Å; K101-Q106 VanDerWaalsContact C-NE2 3.32Å; K101-Q106 HydrophobicContact CB-CG 4.27Å; K101-Q106 VanDerWaalsContact CB-NE2 3.28Å; K101-Q106 PolarHBondContact O-NE2 3.18Å
102	V	63.9	Low	81.5	Confident	77 Å²	77	60 Å²	60	47%	0.467	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	135	177.2	171.4	0	0	0	0	109.5	A99	A99-V102 WeakPolarHBondContact O-CG2 3.38Å
103	G	62.9	Low	81.7	Confident	73 Å²	73	65 Å²	65	75%	0.753	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.3	-17.4	-174.6	0	0	0	0	0	115.6	K101	K101-G103 PolarHBondContact O-N 2.85Å
104	H	64.1	Low	81.9	Confident	139 Å²	139	62.1 Å²	62.1	64%	0.644	33%	0.327	S	S	*	.	S	Bend	trans	-90.1	144.6	175.6	-63.1	-71.6	0	0	0	111.9	K101 Q106	K101-H104 PolarHBondContact O-N 3.09Å; H104-Q106 PolarHBondContact O-N 3.03Å
105	K	65.9	Low	81.9	Confident	222 Å²	222	68.2 Å²	68.2	97%	0.965	35%	0.35	S	S	*	.			trans	-64.4	106.1	171.1	-72.4	-175	179.8	-179.7	0	109.1
106	Q	75.3	Confident	82	Confident	46 Å²	46	63.6 Å²	63.6	22%	0.215	33%	0.332	C	S	.	.			trans	-105.2	127	177.8	-65.2	178.8	55.9	0	0	109.5	L98 K101 H104 T108	L98-Q106 PolarHBondContact O-NE2 3.03Å; K101-Q106 VanDerWaalsContact C-NE2 3.32Å; K101-Q106 HydrophobicContact CB-CG 4.27Å; K101-Q106 VanDerWaalsContact CB-NE2 3.28Å; K101-Q106 PolarHBondContact O-NE2 3.18Å; H104-Q106 PolarHBondContact O-N 3.03Å; Q106-T108 HydrophobicContact CB-CG2 4.04Å; Q106-T108 PolarHBondContact O-N 3.24Å
107	A	75.3	Confident	81.9	Confident	100 Å²	100	63.4 Å²	63.4	83%	0.826	33%	0.331	S	S	*	.			trans	-73.2	113.8	166.9	0	0	0	0	0	108
108	T	82.6	Confident	81.9	Confident	45 Å²	45	59 Å²	59	28%	0.276	32%	0.315	S	S	.	.			trans	-121.2	147.8	-177.3	61.2	0	0	0	0	110.2	Y95 R97 Q106	Y95-T108 WeakPolarHBondContact O-CA 3.49Å; Y95-T108 WeakPolarHBondContact O-CB 3.46Å; R97-T108 HydrophobicContact CB-CG2 4.25Å; Q106-T108 HydrophobicContact CB-CG2 4.04Å; Q106-T108 PolarHBondContact O-N 3.24Å
109	C	87.6	Confident	82	Confident	27 Å²	27	61.9 Å²	61.9	18%	0.182	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-142	94.6	175.4	-164.2	0	0	0	0	106.7	V29 F94 Y95	V29-C109 HydrophobicContact CG2-CB 4.17Å; V29-C109 WeakPolarHBondContact CG2-O 3.28Å; V29-C109 WeakPolarHBondContact CG2-SG 3.41Å; F94-C109 CarbonylContact C-O 3.57Å; F94-C109 WeakPolarHBondContact CA-O 3.24Å; Y95-C109 HydrophobicContact CD2-CB 3.98Å; Y95-C109 PolarHBondContact N-O 3.42Å; Y95-C109 PolarHBondContact O-N 3.04Å
110	T	88.9	Confident	82.2	Confident	29 Å²	29	63 Å²	63	18%	0.178	34%	0.336	C	S	.	.			trans	-114.1	-13.1	-160.4	56.4	0	0	0	0	113.8	I50 V51 F94 Y95	I50-T110 CarbonylContact C-O 3.57Å; I50-T110 WeakPolarHBondContact CA-O 3.22Å; I50-T110 WeakPolarHBondContact CG2-O 3.02Å; V51-T110 PolarHBondContact N-O 3.33Å; V51-T110 WeakPolarHBondContact O-CB 3.46Å; V51-T110 VanDerWaalsContact O-CG2 3.28Å; V51-T110 WeakPolarHBondContact O-CG2 3.23Å; F94-T110 WeakPolarHBondContact CD1-O 3.43Å; Y95-T110 WeakPolarHBondContact O-CG2 3.36Å
111	K	92.8	Very high	82.5	Confident	81 Å²	81	66.4 Å²	66.4	35%	0.352	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	119	-171.8	-178.9	175.3	-179.5	175.9	0	111.1	L28 V29 I48 L49 I50	L28-K111 CarbonylContact C-O 3.58Å; L28-K111 WeakPolarHBondContact CA-O 3.29Å; L28-K111 HydrophobicContact CD2-CB 4.41Å; L28-K111 HydrophobicContact CD2-CD 4.22Å; L28-K111 HydrophobicContact CD2-CG 4.01Å; V29-K111 PolarHBondContact N-O 2.82Å; I48-K111 HydrophobicContact CG2-CD 4.33Å; I48-K111 HydrophobicContact CG2-CG 4.04Å; L49-K111 CarbonylContact O-C 3.48Å; L49-K111 WeakPolarHBondContact O-CA 3.39Å; I50-K111 HydrophobicContact CG1-CG 4.22Å
112	A	93.6	Very high	83	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	148.1	169.6	0	0	0	0	0	110.5	V29 V31 I48 L49 F94 Y114	V29-A112 HydrophobicContact CB-CB 3.91Å; V29-A112 HydrophobicContact CG1-CB 4.19Å; V31-A112 HydrophobicContact CG1-CB 3.75Å; I48-A112 WeakPolarHBondContact CA-O 3.46Å; L49-A112 PolarHBondContact N-O 3.16Å; L49-A112 PolarHBondContact O-N 3.31Å; F94-A112 HydrophobicContact CE1-CB 3.6Å; F94-A112 HydrophobicContact CE2-CB 4.41Å; F94-A112 HydrophobicContact CZ-CB 3.33Å; A112-Y114 HydrophobicContact CB-CD2 4.25Å; A112-Y114 HydrophobicContact CB-CE2 3.56Å
113	R	93.6	Very high	84.2	Confident	108 Å²	108	64.1 Å²	64.1	41%	0.408	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	106.5	175.8	-170.3	-177.9	-166.1	-147.6	6.3	109.7	V31 H46 L47 I48 E187	V31-R113 WeakPolarHBondContact CG2-O 3.46Å; H46-R113 HydrophobicContact CB-CG 4.05Å; H46-R113 PolarHBondContact CD2-NE 2.82Å; H46-R113 PolarHBondContact ND1-NH2 3.41Å; L47-R113 CarbonylContact O-C 3.53Å; L47-R113 WeakPolarHBondContact O-CA 3.4Å; I48-R113 HydrophobicContact CG1-CG 4.27Å; R113-E187 IonicContact NE-OE2 3.45Å; R113-E187 IonicContact NH2-OE2 3.66Å; R113-E187 PolarHBondContact NH2-OE2 2.7Å
114	Y	94.2	Very high	85.4	Confident	1 Å²	1	63.4 Å²	63.4	0%	0.004	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	141.3	178	-58.6	-97	0	0	0	110.3	V31 T33 L35 H46 L47 L49 W82 A92 A112	V31-Y114 HydrophobicContact CB-CD1 3.88Å; V31-Y114 HydrophobicContact CB-CE1 3.78Å; V31-Y114 HydrophobicContact CG1-CD1 3.73Å; V31-Y114 HydrophobicContact CG1-CD2 4.17Å; V31-Y114 HydrophobicContact CG1-CE1 3.44Å; V31-Y114 VanDerWaalsContact CG1-CE1 3.44Å; V31-Y114 HydrophobicContact CG1-CE2 3.91Å; V31-Y114 HydrophobicContact CG1-CG 4.08Å; V31-Y114 HydrophobicContact CG2-CD1 4.45Å; T33-Y114 HydrophobicContact CG2-CD1 4.32Å; T33-Y114 HydrophobicContact CG2-CE1 4.3Å; L35-Y114 VanDerWaalsContact CD1-CB 3.47Å; L35-Y114 HydrophobicContact CD1-CD1 4.13Å; L35-Y114 HydrophobicContact CD1-CD2 4.37Å; L35-Y114 HydrophobicContact CD1-CG 3.76Å; L35-Y114 HydrophobicContact CG-CD1 4.23Å; L35-Y114 HydrophobicContact CG-CG 4.26Å; H46-Y114 CarbonylContact C-O 3.54Å; H46-Y114 VanDerWaalsContact CA-O 3.27Å; H46-Y114 WeakPolarHBondContact CA-O 3.28Å; L47-Y114 HydrophobicContact CD2-CD2 4.03Å; L47-Y114 PolarHBondContact N-O 3.49Å; L47-Y114 PolarHBondContact O-N 2.98Å; L49-Y114 HydrophobicContact CB-CE2 4.11Å; L49-Y114 HydrophobicContact CD2-CE2 4.35Å; W82-Y114 AromaticContact CD1-CE1 3.6Å; W82-Y114 AromaticContact CD1-CZ 3.85Å; W82-Y114 HydrophobicContact CZ2-CE2 4.35Å; W82-Y114 AromaticContact NE1-CD1 3.88Å; W82-Y114 AromaticContact NE1-CE1 3.29Å; W82-Y114 VanDerWaalsContact NE1-CE1 3.29Å; W82-Y114 AromaticContact NE1-CE2 3.59Å; W82-Y114 AromaticContact NE1-CZ 3.12Å; W82-Y114 PolarHBondContact NE1-OH 2.85Å; A92-Y114 WeakPolarHBondContact CB-OH 3.32Å; A112-Y114 HydrophobicContact CB-CD2 4.25Å; A112-Y114 HydrophobicContact CB-CE2 3.56Å
115	R	92.9	Very high	86.4	Confident	127 Å²	127	57.9 Å²	57.9	48%	0.479	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	127.5	175	-64.2	169.1	67.6	-177.8	-1.1	108.6	V34 L35 V43	V34-R115 HydrophobicContact CG1-CB 4.29Å; L35-R115 PolarHBondContact N-O 3.42Å; V43-R115 HydrophobicContact CG1-CB 4.18Å; V43-R115 HydrophobicContact CG2-CB 4.18Å; V43-R115 HydrophobicContact CG2-CG 4.3Å
116	I	92.3	Very high	87.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	123.2	170.6	-58.7	165.2	0	0	0	107.9	L35 V43 T44 A45 L47 V118 F123 I186	L35-I116 HydrophobicContact CB-CG1 4.43Å; L35-I116 VanDerWaalsContact O-CA 3.25Å; L35-I116 WeakPolarHBondContact O-CA 3.39Å; V43-I116 CarbonylContact C-O 3.6Å; V43-I116 WeakPolarHBondContact CA-O 3.45Å; V43-I116 WeakPolarHBondContact CG1-O 3.45Å; T44-I116 PolarHBondContact N-O 3.21Å; T44-I116 PolarHBondContact OG1-O 3.45Å; A45-I116 HydrophobicContact CB-CB 4.18Å; A45-I116 HydrophobicContact CB-CD1 3.87Å; A45-I116 PolarHBondContact N-O 3.32Å; A45-I116 WeakPolarHBondContact O-CA 3.3Å; A45-I116 WeakPolarHBondContact O-CB 3.18Å; A45-I116 PolarHBondContact O-N 3.08Å; L47-I116 HydrophobicContact CB-CD1 4.02Å; L47-I116 HydrophobicContact CB-CG1 4.22Å; I116-V118 HydrophobicContact CG2-CG2 4.25Å; I116-V118 WeakPolarHBondContact CG2-O 3.43Å; I116-F123 HydrophobicContact CD1-CD1 3.78Å; I116-F123 HydrophobicContact CD1-CE1 3.57Å; I116-F123 HydrophobicContact CD1-CE2 4.47Å; I116-F123 HydrophobicContact CD1-CG 4.29Å; I116-F123 HydrophobicContact CD1-CZ 3.96Å; I116-F123 HydrophobicContact CG1-CD1 4.45Å; I116-F123 HydrophobicContact CG1-CD2 4.44Å; I116-F123 HydrophobicContact CG1-CE1 4.22Å; I116-F123 HydrophobicContact CG1-CE2 4.24Å; I116-F123 HydrophobicContact CG1-CZ 4.12Å; I116-F123 HydrophobicContact CG2-CB 4.1Å; I116-F123 HydrophobicContact CG2-CD1 4.4Å; I116-F123 HydrophobicContact CG2-CD2 3.9Å; I116-F123 HydrophobicContact CG2-CE2 4.49Å; I116-F123 HydrophobicContact CG2-CG 3.86Å; I116-I186 HydrophobicContact CD1-CG1 4.43Å; I116-I186 HydrophobicContact CD1-CG2 4.2Å
117	T	89.2	Confident	88.3	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.018	25%	0.245	C	C	.	.			trans	-103.8	-15.8	-174	53.9	0	0	0	0	112.7	V34 L35 I39 S41	V34-T117 HydrophobicContact CB-CG2 4Å; V34-T117 HydrophobicContact CG1-CG2 4.13Å; V34-T117 HydrophobicContact CG2-CG2 4.46Å; L35-T117 PolarHBondContact O-N 3.44Å; I39-T117 WeakPolarHBondContact O-CB 3.43Å; I39-T117 WeakPolarHBondContact O-CG2 3.05Å; I39-T117 PolarHBondContact O-OG1 3.4Å; S41-T117 WeakPolarHBondContact O-CG2 2.84Å; S41-T117 WeakPolarHBondContact OG-CB 3.27Å; S41-T117 PolarHBondContact OG-O 3.44Å
118	V	87.8	Confident	88.8	Confident	10 Å²	10	47.1 Å²	47.1	6%	0.061	23%	0.234	C	C	.	.	S	Bend	trans	-97.9	156	176.6	-59.7	0	0	0	0	112	P36 I39 T44 I116 R122 F123	P36-V118 VanDerWaalsContact CD-CG2 3.47Å; P36-V118 HydrophobicContact CG-CG1 4.4Å; P36-V118 HydrophobicContact CG-CG2 4.14Å; I39-V118 HydrophobicContact CD1-CG1 3.74Å; I39-V118 HydrophobicContact CG2-CG1 3.97Å; T44-V118 PolarHBondContact OG1-O 2.88Å; I116-V118 HydrophobicContact CG2-CG2 4.25Å; I116-V118 WeakPolarHBondContact CG2-O 3.43Å; V118-R122 HydrophobicContact CB-CB 4.39Å; V118-R122 HydrophobicContact CG2-CB 4.37Å; V118-F123 HydrophobicContact CG2-CB 3.88Å; V118-F123 HydrophobicContact CG2-CD2 4.44Å
119	P	87.8	Confident	88.9	Confident	69 Å²	69	47.7 Å²	47.7	45%	0.448	24%	0.235	S	C	.	.			trans	-52.8	146.3	169.8	-26.3	34.6	0	0	0	112.6	D121 R122 F123	P119-D121 VanDerWaalsContact C-N 3.3Å; P119-D121 PolarHBondContact O-N 3.46Å; P119-R122 WeakPolarHBondContact O-CA 3.35Å; P119-R122 WeakPolarHBondContact O-CB 2.96Å; P119-R122 PolarHBondContact O-N 2.83Å; P119-F123 PolarHBondContact O-N 3.32Å
120	L	87.7	Confident	88.8	Confident	49 Å²	49	47.4 Å²	47.4	26%	0.257	23%	0.232	S	C	.	.	H	α-helix	trans	-59.6	-36.6	-172.6	-73	170.3	0	0	0	113.8	A45 R122 F123 S124 P159 I186 P188	A45-L120 HydrophobicContact CB-CD2 3.73Å; A45-L120 HydrophobicContact CB-CG 4.41Å; L120-R122 VanDerWaalsContact C-N 3.25Å; L120-R122 PolarHBondContact O-N 3.09Å; L120-F123 WeakPolarHBondContact O-CB 3.46Å; L120-F123 PolarHBondContact O-N 3.31Å; L120-S124 PolarHBondContact O-N 3.12Å; L120-P159 HydrophobicContact CD1-CG 3.64Å; L120-P159 HydrophobicContact CD2-CG 4.4Å; L120-I186 HydrophobicContact CD2-CG2 3.7Å; L120-P188 HydrophobicContact CD1-CB 4.41Å
121	D	83	Confident	88.6	Confident	140 Å²	140	55 Å²	55	75%	0.749	26%	0.257	S	S	*	.	H	α-helix	trans	-61	-37.6	176.4	-55.7	-30.4	0	0	0	111.2	P119 S124	P119-D121 VanDerWaalsContact C-N 3.3Å; P119-D121 PolarHBondContact O-N 3.46Å; D121-S124 PolarHBondContact O-OG 3.03Å
122	R	81.6	Confident	88.4	Confident	77 Å²	77	52.7 Å²	52.7	29%	0.291	25%	0.248	S	C	.	.	H	α-helix	trans	-76.8	-35.9	176.1	-60.7	-168.6	179.3	-81	15.7	112.3	V118 P119 L120 S124 A125 Y126 S1034 N1035	V118-R122 HydrophobicContact CB-CB 4.39Å; V118-R122 HydrophobicContact CG2-CB 4.37Å; P119-R122 WeakPolarHBondContact O-CA 3.35Å; P119-R122 WeakPolarHBondContact O-CB 2.96Å; P119-R122 PolarHBondContact O-N 2.83Å; L120-R122 VanDerWaalsContact C-N 3.25Å; L120-R122 PolarHBondContact O-N 3.09Å; R122-S124 PolarHBondContact O-N 2.82Å; R122-A125 WeakPolarHBondContact O-CB 3.27Å; R122-A125 PolarHBondContact O-N 3.24Å; R122-Y126 PolarHBondContact O-N 3.28Å; R122-S1034 PolarHBondContact NH2-O 2.82Å; R122-S1034 PolarHBondContact NH2-OG 2.94Å; R122-S1034 VanDerWaalsContact NH2-OG 3.15Å; R122-N1035 PolarHBondContact NH1-OD1 2.83Å; R122-N1035 PolarHBondContact NH2-OD1 3.43Å; R122-N1035 VanDerWaalsContact NH2-OD1 3.16Å
123	F	90.1	Very high	88.4	Confident	1 Å²	1	52.7 Å²	52.7	0%	0.004	25%	0.248	C	C	.	.	H	α-helix	trans	-59	-35.8	173.5	-175.1	-118.9	0	0	0	111.3	L35 L47 I116 V118 P119 L120 A125 Y126 L127 I186	L35-F123 HydrophobicContact CB-CE2 3.84Å; L35-F123 HydrophobicContact CB-CZ 4.44Å; L35-F123 HydrophobicContact CD1-CZ 4.47Å; L47-F123 HydrophobicContact CD1-CE1 4.11Å; L47-F123 HydrophobicContact CD1-CZ 4.15Å; I116-F123 HydrophobicContact CD1-CD1 3.78Å; I116-F123 HydrophobicContact CD1-CE1 3.57Å; I116-F123 HydrophobicContact CD1-CE2 4.47Å; I116-F123 HydrophobicContact CD1-CG 4.29Å; I116-F123 HydrophobicContact CD1-CZ 3.96Å; I116-F123 HydrophobicContact CG1-CD1 4.45Å; I116-F123 HydrophobicContact CG1-CD2 4.44Å; I116-F123 HydrophobicContact CG1-CE1 4.22Å; I116-F123 HydrophobicContact CG1-CE2 4.24Å; I116-F123 HydrophobicContact CG1-CZ 4.12Å; I116-F123 HydrophobicContact CG2-CB 4.1Å; I116-F123 HydrophobicContact CG2-CD1 4.4Å; I116-F123 HydrophobicContact CG2-CD2 3.9Å; I116-F123 HydrophobicContact CG2-CE2 4.49Å; I116-F123 HydrophobicContact CG2-CG 3.86Å; V118-F123 HydrophobicContact CG2-CB 3.88Å; V118-F123 HydrophobicContact CG2-CD2 4.44Å; P119-F123 PolarHBondContact O-N 3.32Å; L120-F123 WeakPolarHBondContact O-CB 3.46Å; L120-F123 PolarHBondContact O-N 3.31Å; F123-A125 VanDerWaalsContact C-N 3.3Å; F123-A125 PolarHBondContact O-N 2.78Å; F123-Y126 HydrophobicContact CD2-CD1 4.09Å; F123-Y126 AromaticContact CE2-CD1 3.77Å; F123-Y126 HydrophobicContact CE2-CD1 3.77Å; F123-Y126 HydrophobicContact CE2-CE1 4.19Å; F123-Y126 WeakPolarHBondContact O-CB 3.15Å; F123-Y126 PolarHBondContact O-N 3.4Å; F123-L127 HydrophobicContact CD1-CD1 4.1Å; F123-L127 HydrophobicContact CD1-CG 4.43Å; F123-L127 HydrophobicContact CE1-CD1 3.68Å; F123-L127 HydrophobicContact CE1-CD2 4.3Å; F123-L127 HydrophobicContact CE1-CG 4.07Å; F123-L127 HydrophobicContact CE2-CD2 4.26Å; F123-L127 HydrophobicContact CE2-CG 4.4Å; F123-L127 HydrophobicContact CZ-CD1 4.1Å; F123-L127 HydrophobicContact CZ-CD2 3.85Å; F123-L127 HydrophobicContact CZ-CG 4.05Å; F123-L127 WeakPolarHBondContact O-CG 3.16Å; F123-L127 PolarHBondContact O-N 3.23Å; F123-I186 HydrophobicContact CD1-CD1 4.05Å; F123-I186 HydrophobicContact CE1-CD1 3.91Å; F123-I186 HydrophobicContact CE1-CG1 4.49Å
124	S	88.1	Confident	88.4	Confident	57 Å²	57	53.8 Å²	53.8	40%	0.399	25%	0.252	S	S	.	.	H	α-helix	trans	-61.2	-35.5	174.3	83	0	0	0	0	113.3	L120 D121 R122 L127 K128	L120-S124 PolarHBondContact O-N 3.12Å; D121-S124 PolarHBondContact O-OG 3.03Å; R122-S124 PolarHBondContact O-N 2.82Å; S124-L127 PolarHBondContact O-N 3.5Å; S124-K128 WeakPolarHBondContact O-CB 3.42Å; S124-K128 PolarHBondContact O-N 3.14Å
125	A	84.5	Confident	88.4	Confident	24 Å²	24	53.8 Å²	53.8	20%	0.198	25%	0.252	C	S	.	.	H	α-helix	trans	-67.9	-43.1	175.6	0	0	0	0	0	111.7	R122 F123 L127 K128 D129 P1189	R122-A125 WeakPolarHBondContact O-CB 3.27Å; R122-A125 PolarHBondContact O-N 3.24Å; F123-A125 VanDerWaalsContact C-N 3.3Å; F123-A125 PolarHBondContact O-N 2.78Å; A125-L127 VanDerWaalsContact C-N 3.32Å; A125-L127 PolarHBondContact O-N 3.16Å; A125-K128 WeakPolarHBondContact O-CB 3.18Å; A125-K128 PolarHBondContact O-N 3.45Å; A125-K128 VanDerWaalsContact O-N 3.11Å; A125-D129 PolarHBondContact O-N 2.84Å; A125-P1189 HydrophobicContact CB-CB 4.17Å
126	Y	90.4	Very high	88.4	Confident	1 Å²	1	49 Å²	49	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-56.5	-44.7	172.4	167.7	-97.8	0	0	0	112	P36 P37 W82 W83 R122 F123 K128 D129 M130	P36-Y126 HydrophobicContact CB-CD2 3.66Å; P36-Y126 HydrophobicContact CB-CE2 3.8Å; P36-Y126 HydrophobicContact CB-CG 4.08Å; P36-Y126 HydrophobicContact CG-CD1 4.25Å; P36-Y126 HydrophobicContact CG-CD2 3.77Å; P36-Y126 HydrophobicContact CG-CE2 4.35Å; P36-Y126 HydrophobicContact CG-CG 3.7Å; P37-Y126 WeakPolarHBondContact CD-OH 3.48Å; W82-Y126 HydrophobicContact CE3-CE1 4.39Å; W83-Y126 AromaticContact CE3-CD2 3.8Å; W83-Y126 HydrophobicContact CE3-CD2 3.8Å; W83-Y126 AromaticContact CE3-CE2 3.51Å; W83-Y126 HydrophobicContact CE3-CE2 3.51Å; W83-Y126 AromaticContact CZ3-CD2 3.99Å; W83-Y126 HydrophobicContact CZ3-CD2 3.99Å; W83-Y126 HydrophobicContact CZ3-CE2 4.12Å; W83-Y126 PolarHBondContact N-OH 3Å; W83-Y126 WeakPolarHBondContact O-CE2 3.03Å; W83-Y126 PolarHBondContact O-OH 3.03Å; R122-Y126 PolarHBondContact O-N 3.28Å; F123-Y126 HydrophobicContact CD2-CD1 4.09Å; F123-Y126 AromaticContact CE2-CD1 3.77Å; F123-Y126 HydrophobicContact CE2-CD1 3.77Å; F123-Y126 HydrophobicContact CE2-CE1 4.19Å; F123-Y126 WeakPolarHBondContact O-CB 3.15Å; F123-Y126 PolarHBondContact O-N 3.4Å; Y126-K128 VanDerWaalsContact C-N 3.31Å; Y126-K128 PolarHBondContact O-N 3.4Å; Y126-D129 PolarHBondContact O-N 3.21Å; Y126-M130 HydrophobicContact CE1-SD 4.46Å; Y126-M130 WeakPolarHBondContact O-CB 3.29Å; Y126-M130 PolarHBondContact O-N 3.19Å
127	L	90.8	Very high	88.5	Confident	1 Å²	1	49 Å²	49	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-33.8	176.8	-65	-178	0	0	0	112.9	W82 F123 S124 A125 R131 V154 L157	W82-L127 HydrophobicContact CZ3-CD2 4.17Å; F123-L127 HydrophobicContact CD1-CD1 4.1Å; F123-L127 HydrophobicContact CD1-CG 4.43Å; F123-L127 HydrophobicContact CE1-CD1 3.68Å; F123-L127 HydrophobicContact CE1-CD2 4.3Å; F123-L127 HydrophobicContact CE1-CG 4.07Å; F123-L127 HydrophobicContact CE2-CD2 4.26Å; F123-L127 HydrophobicContact CE2-CG 4.4Å; F123-L127 HydrophobicContact CZ-CD1 4.1Å; F123-L127 HydrophobicContact CZ-CD2 3.85Å; F123-L127 HydrophobicContact CZ-CG 4.05Å; F123-L127 WeakPolarHBondContact O-CG 3.16Å; F123-L127 PolarHBondContact O-N 3.23Å; S124-L127 PolarHBondContact O-N 3.5Å; A125-L127 VanDerWaalsContact C-N 3.32Å; A125-L127 PolarHBondContact O-N 3.16Å; L127-R131 PolarHBondContact O-N 2.84Å; L127-V154 HydrophobicContact CD2-CG1 3.89Å; L127-L157 HydrophobicContact CD1-CB 4.06Å; L127-L157 HydrophobicContact CD1-CD2 4.24Å
128	K	85.1	Confident	88.5	Confident	140 Å²	140	49.2 Å²	49.2	61%	0.609	24%	0.237	S	C	*	.	H	α-helix	trans	-67	-41.8	175.7	-171.5	-177.6	178.9	-175.3	0	112.3	S124 A125 Y126 R131 D155	S124-K128 WeakPolarHBondContact O-CB 3.42Å; S124-K128 PolarHBondContact O-N 3.14Å; A125-K128 WeakPolarHBondContact O-CB 3.18Å; A125-K128 PolarHBondContact O-N 3.45Å; A125-K128 VanDerWaalsContact O-N 3.11Å; Y126-K128 VanDerWaalsContact C-N 3.31Å; Y126-K128 PolarHBondContact O-N 3.4Å; K128-R131 VanDerWaalsContact O-CG 3.32Å; K128-R131 WeakPolarHBondContact O-CG 3.27Å; K128-R131 PolarHBondContact O-N 3.06Å; K128-D155 HydrophobicContact CB-CB 4.17Å
129	D	85.4	Confident	88.4	Confident	56 Å²	56	49.4 Å²	49.4	30%	0.299	24%	0.237	S	C	.	.	H	α-helix	trans	-71.3	-37.6	178.8	-85.4	14.7	0	0	0	112.2	W83 A125 Y126 R131 P1189	W83-D129 HydrophobicContact CH2-CB 4.21Å; W83-D129 HydrophobicContact CZ3-CB 3.99Å; A125-D129 PolarHBondContact O-N 2.84Å; Y126-D129 PolarHBondContact O-N 3.21Å; D129-R131 VanDerWaalsContact C-N 3.29Å; D129-R131 PolarHBondContact O-N 3.03Å; D129-P1189 VanDerWaalsContact OD2-C 3.24Å
130	M	86.2	Confident	88.1	Confident	21 Å²	21	49 Å²	49	10%	0.103	23%	0.231	C	C	.	.	H	α-helix	trans	-62.2	-35.1	174.3	176.9	168.5	-177.1	0	0	112.7	W82 W83 Y126 E132 L133	W82-M130 HydrophobicContact CE3-CE 4.11Å; W82-M130 HydrophobicContact CE3-SD 3.83Å; W82-M130 HydrophobicContact CZ3-SD 4.22Å; W83-M130 HydrophobicContact CB-CB 4.03Å; W83-M130 HydrophobicContact CB-CE 4.15Å; W83-M130 HydrophobicContact CB-CG 3.65Å; W83-M130 HydrophobicContact CB-SD 3.7Å; W83-M130 HydrophobicContact CE3-CB 4.29Å; W83-M130 HydrophobicContact CG-CB 4.4Å; W83-M130 HydrophobicContact CG-CG 4.37Å; Y126-M130 HydrophobicContact CE1-SD 4.46Å; Y126-M130 WeakPolarHBondContact O-CB 3.29Å; Y126-M130 PolarHBondContact O-N 3.19Å; M130-E132 WeakPolarHBondContact CE-O 3.02Å; M130-E132 WeakPolarHBondContact CG-O 3.22Å; M130-E132 PolarHBondContact O-N 3.07Å; M130-L133 HydrophobicContact CE-CB 3.91Å; M130-L133 HydrophobicContact CE-CD1 3.37Å; M130-L133 HydrophobicContact CE-CG 4.25Å
131	R	83.1	Confident	87.6	Confident	188 Å²	188	52.7 Å²	52.7	71%	0.709	24%	0.241	S	C	*	.			trans	62.7	-46.5	-179.6	-58.2	176.8	-176.3	-166.7	0.8	116.1	L127 K128 D129 R153	L127-R131 PolarHBondContact O-N 2.84Å; K128-R131 VanDerWaalsContact O-CG 3.32Å; K128-R131 WeakPolarHBondContact O-CG 3.27Å; K128-R131 PolarHBondContact O-N 3.06Å; D129-R131 VanDerWaalsContact C-N 3.29Å; D129-R131 PolarHBondContact O-N 3.03Å; R131-R153 PolarHBondContact O-N 3.27Å
132	E	90	Very high	87.3	Confident	34 Å²	34	51.5 Å²	51.5	16%	0.159	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	145.5	-175.8	68.1	-175.1	-124.6	0	0	112.4	M130 R134 R150 L151	M130-E132 WeakPolarHBondContact CE-O 3.02Å; M130-E132 WeakPolarHBondContact CG-O 3.22Å; M130-E132 PolarHBondContact O-N 3.07Å; E132-R134 IonicContact OE1-CZ 3.27Å; E132-R134 IonicContact OE1-NE 3.69Å; E132-R134 PolarHBondContact OE1-NE 2.94Å; E132-R134 IonicContact OE1-NH2 2.85Å; E132-R134 PolarHBondContact OE1-NH2 2.95Å; E132-R150 HydrophobicContact CB-CG 4.49Å; E132-R150 IonicContact OE1-CZ 3.34Å; E132-R150 IonicContact OE1-NE 2.87Å; E132-R150 IonicContact OE2-CZ 3.67Å; E132-R150 IonicContact OE2-NE 2.86Å; E132-R150 PolarHBondContact OE2-NE 2.92Å; E132-R150 VanDerWaalsContact OE2-NE 3.16Å; E132-R150 IonicContact OE2-NH1 3.84Å; E132-R150 IonicContact OE2-NH2 2.94Å; E132-R150 PolarHBondContact OE2-NH2 2.69Å; E132-L151 CarbonylContact C-O 3.6Å; E132-L151 VanDerWaalsContact CA-O 3.27Å; E132-L151 WeakPolarHBondContact CA-O 3.46Å
133	L	93.7	Very high	87.3	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	126.1	170.2	179.2	68.3	0	0	0	109.4	V80 W82 M130 L135 L151 V154 L184	V80-L133 HydrophobicContact CG1-CD1 3.87Å; V80-L133 HydrophobicContact CG1-CD2 4.34Å; V80-L133 HydrophobicContact CG1-CG 4.34Å; W82-L133 HydrophobicContact CD2-CD1 4.22Å; W82-L133 HydrophobicContact CE3-CD1 4.19Å; W82-L133 HydrophobicContact CH2-CD2 4Å; W82-L133 HydrophobicContact CZ2-CD2 4.17Å; W82-L133 HydrophobicContact CZ3-CD1 4.35Å; W82-L133 HydrophobicContact CZ3-CD2 4.46Å; M130-L133 HydrophobicContact CE-CB 3.91Å; M130-L133 HydrophobicContact CE-CD1 3.37Å; M130-L133 HydrophobicContact CE-CG 4.25Å; L133-L135 HydrophobicContact CD2-CD1 4.47Å; L133-L135 HydrophobicContact CG-CD1 4.22Å; L133-L151 HydrophobicContact CB-CB 4.32Å; L133-L151 PolarHBondContact N-O 2.81Å; L133-L151 PolarHBondContact O-N 2.82Å; L133-V154 HydrophobicContact CB-CG2 3.83Å; L133-L184 HydrophobicContact CD2-CD2 4.26Å
134	R	92.4	Very high	86.8	Confident	131 Å²	131	62.3 Å²	62.3	49%	0.494	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136	179.5	-65.2	174.6	-177.2	152.6	2.1	110.1	E132 R148	E132-R134 IonicContact OE1-CZ 3.27Å; E132-R134 IonicContact OE1-NE 3.69Å; E132-R134 PolarHBondContact OE1-NE 2.94Å; E132-R134 IonicContact OE1-NH2 2.85Å; E132-R134 PolarHBondContact OE1-NH2 2.95Å; R134-R148 HydrophobicContact CB-CG 4.37Å
135	L	95.2	Very high	86.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	108.6	178.3	-63.9	91.7	0	0	0	108	V51 V78 V80 L133 R148 G149 L167 L180 I182	V51-L135 HydrophobicContact CG2-CD2 4.03Å; V78-L135 HydrophobicContact CG1-CB 3.79Å; V78-L135 HydrophobicContact CG1-CD2 4.15Å; V80-L135 HydrophobicContact CG2-CB 4.39Å; V80-L135 HydrophobicContact CG2-CD2 3.75Å; V80-L135 HydrophobicContact CG2-CG 3.85Å; L133-L135 HydrophobicContact CD2-CD1 4.47Å; L133-L135 HydrophobicContact CG-CD1 4.22Å; L135-R148 WeakPolarHBondContact O-CA 3.35Å; L135-G149 PolarHBondContact N-O 3.18Å; L135-G149 PolarHBondContact O-N 3.21Å; L135-L167 HydrophobicContact CD1-CD1 3.67Å; L135-L180 HydrophobicContact CB-CD2 4.16Å; L135-L180 HydrophobicContact CD2-CD2 3.96Å; L135-I182 HydrophobicContact CD2-CG2 3.93Å
136	D	93	Very high	86.7	Confident	28 Å²	28	64.4 Å²	64.4	15%	0.15	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	120.5	-174.3	-71.4	1.5	0	0	0	109	V78 Q79 I145 R148	V78-D136 CarbonylContact C-O 3.58Å; V78-D136 WeakPolarHBondContact CA-O 3.3Å; Q79-D136 PolarHBondContact N-O 2.67Å; Q79-D136 PolarHBondContact O-N 3.46Å; D136-I145 HydrophobicContact CB-CD1 4.46Å; D136-I145 HydrophobicContact CB-CG1 4.44Å; D136-I145 HydrophobicContact CB-CG2 4.39Å; D136-R148 WeakPolarHBondContact OD1-CD 3.46Å; D136-R148 WeakPolarHBondContact OD1-CG 3.45Å; D136-R148 IonicContact OD1-CZ 2.8Å; D136-R148 IonicContact OD1-NE 3.95Å; D136-R148 PolarHBondContact OD1-NE 2.71Å; D136-R148 IonicContact OD1-NH2 3.99Å; D136-R148 PolarHBondContact OD1-NH2 3.36Å; D136-R148 IonicContact OD2-CZ 2.66Å; D136-R148 IonicContact OD2-NE 2.87Å; D136-R148 IonicContact OD2-NH2 2.73Å; D136-R148 PolarHBondContact OD2-NH2 3.39Å
137	V	92.7	Very high	86.7	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.9	176.5	-172.2	0	0	0	0	108	I76 V78 I145 I146 G147 V169	I76-V137 HydrophobicContact CB-CG1 4.13Å; I76-V137 HydrophobicContact CD1-CG1 3.61Å; I76-V137 HydrophobicContact CG1-CG1 4.48Å; I76-V137 HydrophobicContact CG2-CG1 4.35Å; V78-V137 HydrophobicContact CG2-CG2 4.25Å; V137-I145 WeakPolarHBondContact O-CA 3.49Å; V137-I146 HydrophobicContact CB-CG1 4.14Å; V137-I146 HydrophobicContact CG1-CD1 3.86Å; V137-I146 HydrophobicContact CG1-CG1 3.9Å; V137-I146 WeakPolarHBondContact O-CG1 3.4Å; V137-I146 PolarHBondContact O-N 2.84Å; V137-G147 WeakPolarHBondContact CB-O 3.45Å; V137-G147 PolarHBondContact N-O 2.87Å; V137-G147 PolarHBondContact O-N 2.85Å; V137-V169 HydrophobicContact CB-CG1 4.11Å; V137-V169 HydrophobicContact CG2-CB 4.4Å; V137-V169 HydrophobicContact CG2-CG1 3.58Å; V137-V169 HydrophobicContact CG2-CG2 3.88Å
138	I	89.3	Confident	86.8	Confident	6 Å²	6	69.4 Å²	69.4	3%	0.031	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134.8	-173.2	-64.2	164.2	0	0	0	109.5	I76 Y77 Q79 R144 I145	I76-I138 VanDerWaalsContact CA-O 3.28Å; I76-I138 WeakPolarHBondContact CA-O 3.49Å; Y77-I138 HydrophobicContact CD1-CB 4.28Å; Y77-I138 HydrophobicContact CD1-CG2 4.34Å; Y77-I138 HydrophobicContact CD2-CB 4.27Å; Y77-I138 HydrophobicContact CD2-CD1 4.44Å; Y77-I138 HydrophobicContact CE1-CB 3.85Å; Y77-I138 HydrophobicContact CE1-CG2 3.52Å; Y77-I138 HydrophobicContact CE2-CB 3.84Å; Y77-I138 HydrophobicContact CE2-CD1 3.55Å; Y77-I138 HydrophobicContact CE2-CG1 4.24Å; Y77-I138 HydrophobicContact CE2-CG2 4.17Å; Y77-I138 VanDerWaalsContact CZ-CG2 3.44Å; Y77-I138 PolarHBondContact N-O 2.73Å; Y77-I138 PolarHBondContact O-N 3Å; Y77-I138 WeakPolarHBondContact OH-CG2 3.37Å; Q79-I138 HydrophobicContact CB-CD1 3.87Å; I138-R144 WeakPolarHBondContact CA-O 3.49Å; I138-I145 HydrophobicContact CD1-CG1 4.33Å; I138-I145 HydrophobicContact CG1-CB 4.48Å; I138-I145 HydrophobicContact CG1-CG1 3.89Å
139	D	85.7	Confident	87.3	Confident	14 Å²	14	62.8 Å²	62.8	8%	0.075	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	123.1	170.6	-177.7	-15.5	0	0	0	109.2	R141 H142 Q143 R144 I146	D139-R141 PolarHBondContact O-N 2.87Å; D139-R141 WeakPolarHBondContact OD1-CB 3.3Å; D139-R141 PolarHBondContact OD1-N 3.24Å; D139-R141 IonicContact OD1-NE 2.78Å; D139-R141 PolarHBondContact OD1-NE 2.65Å; D139-R141 IonicContact OD2-CZ 3.29Å; D139-R141 IonicContact OD2-NE 3.98Å; D139-R141 IonicContact OD2-NH2 3.54Å; D139-R141 PolarHBondContact OD2-NH2 2.91Å; D139-H142 PolarHBondContact O-N 3.43Å; D139-H142 IonicContact OD1-ND1 3.82Å; D139-H142 IonicContact OD2-CE1 3.48Å; D139-H142 IonicContact OD2-CG 3.96Å; D139-H142 IonicContact OD2-ND1 3.91Å; D139-H142 PolarHBondContact OD2-ND1 2.88Å; D139-Q143 WeakPolarHBondContact O-CA 3.47Å; D139-Q143 PolarHBondContact O-N 2.85Å; D139-R144 PolarHBondContact N-O 3.49Å; D139-R144 VanDerWaalsContact N-O 3.09Å; D139-I146 HydrophobicContact CB-CG2 3.82Å
140	I	83	Confident	87.6	Confident	62 Å²	62	66.1 Å²	66.1	32%	0.318	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-36.2	-178.8	-70.4	168.5	0	0	0	111.5	D75 Y77 Y95 Q143	D75-I140 HydrophobicContact CB-CB 4.23Å; D75-I140 HydrophobicContact CB-CD1 3.93Å; D75-I140 HydrophobicContact CB-CG1 4.49Å; D75-I140 WeakPolarHBondContact O-CB 3.25Å; D75-I140 PolarHBondContact O-N 2.9Å; Y77-I140 HydrophobicContact CD1-CG1 3.62Å; Y77-I140 HydrophobicContact CE1-CG1 4.31Å; Y95-I140 HydrophobicContact CD1-CD1 4.49Å; Y95-I140 HydrophobicContact CE1-CD1 4.07Å; I140-Q143 PolarHBondContact O-NE2 2.95Å
141	R	76.8	Confident	88	Confident	125 Å²	125	65.6 Å²	65.6	47%	0.472	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-40	-173.6	-62.7	176.1	-61.7	173.5	3.5	112.3	S72 D139	S72-R141 PolarHBondContact O-NH2 3.48Å; S72-R141 PolarHBondContact OG-NH1 3.16Å; S72-R141 PolarHBondContact OG-NH2 3.29Å; D139-R141 PolarHBondContact O-N 2.87Å; D139-R141 WeakPolarHBondContact OD1-CB 3.3Å; D139-R141 PolarHBondContact OD1-N 3.24Å; D139-R141 IonicContact OD1-NE 2.78Å; D139-R141 PolarHBondContact OD1-NE 2.65Å; D139-R141 IonicContact OD2-CZ 3.29Å; D139-R141 IonicContact OD2-NE 3.98Å; D139-R141 IonicContact OD2-NH2 3.54Å; D139-R141 PolarHBondContact OD2-NH2 2.91Å
142	H	75.8	Confident	88.3	Confident	116 Å²	116	60.6 Å²	60.6	54%	0.537	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-13.9	-174.5	-58.1	102.5	0	0	0	112.9	D139 R144	D139-H142 PolarHBondContact O-N 3.43Å; D139-H142 IonicContact OD1-ND1 3.82Å; D139-H142 IonicContact OD2-CE1 3.48Å; D139-H142 IonicContact OD2-CG 3.96Å; D139-H142 IonicContact OD2-ND1 3.91Å; D139-H142 PolarHBondContact OD2-ND1 2.88Å; H142-R144 HydrophobicContact CB-CB 4.33Å; H142-R144 HydrophobicContact CB-CG 4.38Å; H142-R144 PolarHBondContact O-N 2.86Å
143	Q	80.9	Confident	88.1	Confident	117 Å²	117	65.6 Å²	65.6	55%	0.547	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	36.2	-172.3	-62.3	-65	-31.2	0	0	112.3	Y77 D139 I140	Y77-Q143 PolarHBondContact OH-OE1 3.2Å; D139-Q143 WeakPolarHBondContact O-CA 3.47Å; D139-Q143 PolarHBondContact O-N 2.85Å; I140-Q143 PolarHBondContact O-NE2 2.95Å
144	R	80.1	Confident	87.9	Confident	188 Å²	188	65.6 Å²	65.6	71%	0.709	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	140.7	178.6	-72.4	-178.9	-175.8	-168.9	-0.4	110.4	I138 D139 H142 I146	I138-R144 WeakPolarHBondContact CA-O 3.49Å; D139-R144 PolarHBondContact N-O 3.49Å; D139-R144 VanDerWaalsContact N-O 3.09Å; H142-R144 HydrophobicContact CB-CB 4.33Å; H142-R144 HydrophobicContact CB-CG 4.38Å; H142-R144 PolarHBondContact O-N 2.86Å; R144-I146 PolarHBondContact O-N 3.49Å
145	I	85.6	Confident	87.7	Confident	78 Å²	78	61.9 Å²	61.9	40%	0.4	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	118.5	172.5	-58.2	170.1	0	0	0	107.3	D136 V137 I138	D136-I145 HydrophobicContact CB-CD1 4.46Å; D136-I145 HydrophobicContact CB-CG1 4.44Å; D136-I145 HydrophobicContact CB-CG2 4.39Å; V137-I145 WeakPolarHBondContact O-CA 3.49Å; I138-I145 HydrophobicContact CD1-CG1 4.33Å; I138-I145 HydrophobicContact CG1-CB 4.48Å; I138-I145 HydrophobicContact CG1-CG1 3.89Å
146	I	85.2	Confident	87.3	Confident	46 Å²	46	69.3 Å²	69.3	24%	0.236	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-31.3	176.1	55.5	171	0	0	0	111	L73 I76 V137 D139 R144 N171 L177	L73-I146 HydrophobicContact CD2-CD1 3.68Å; L73-I146 HydrophobicContact CG-CD1 4.09Å; I76-I146 HydrophobicContact CG2-CD1 3.75Å; V137-I146 HydrophobicContact CB-CG1 4.14Å; V137-I146 HydrophobicContact CG1-CD1 3.86Å; V137-I146 HydrophobicContact CG1-CG1 3.9Å; V137-I146 WeakPolarHBondContact O-CG1 3.4Å; V137-I146 PolarHBondContact O-N 2.84Å; D139-I146 HydrophobicContact CB-CG2 3.82Å; R144-I146 PolarHBondContact O-N 3.49Å; I146-N171 WeakPolarHBondContact O-CB 3.3Å; I146-L177 HydrophobicContact CB-CD1 4.1Å; I146-L177 HydrophobicContact CD1-CD1 4.45Å; I146-L177 HydrophobicContact CG1-CD1 4.22Å; I146-L177 WeakPolarHBondContact O-CD1 3.2Å
147	G	90.4	Very high	87.3	Confident	4 Å²	4	68.1 Å²	68.1	4%	0.041	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	175.2	175.7	0	0	0	0	0	112.4	V137 I170	V137-G147 WeakPolarHBondContact CB-O 3.45Å; V137-G147 PolarHBondContact N-O 2.87Å; V137-G147 PolarHBondContact O-N 2.85Å; G147-I170 CarbonylContact C-O 3.55Å; G147-I170 WeakPolarHBondContact CA-O 3.29Å
148	R	94.1	Very high	87.1	Confident	104 Å²	104	70.3 Å²	70.3	39%	0.392	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	129.7	-172.4	-179	173.8	-75.1	156.5	0.9	110.7	R134 L135 D136 I170	R134-R148 HydrophobicContact CB-CG 4.37Å; L135-R148 WeakPolarHBondContact O-CA 3.35Å; D136-R148 WeakPolarHBondContact OD1-CD 3.46Å; D136-R148 WeakPolarHBondContact OD1-CG 3.45Å; D136-R148 IonicContact OD1-CZ 2.8Å; D136-R148 IonicContact OD1-NE 3.95Å; D136-R148 PolarHBondContact OD1-NE 2.71Å; D136-R148 IonicContact OD1-NH2 3.99Å; D136-R148 PolarHBondContact OD1-NH2 3.36Å; D136-R148 IonicContact OD2-CZ 2.66Å; D136-R148 IonicContact OD2-NE 2.87Å; D136-R148 IonicContact OD2-NH2 2.73Å; D136-R148 PolarHBondContact OD2-NH2 3.39Å; R148-I170 PolarHBondContact N-O 2.93Å; R148-I170 PolarHBondContact O-N 3.22Å; R148-I170 VanDerWaalsContact O-N 3.12Å
149	G	93.8	Very high	86.9	Confident	0 Å²	0	73 Å²	73	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	138.1	165.9	0	0	0	0	0	109.9	L135	L135-G149 PolarHBondContact N-O 3.18Å; L135-G149 PolarHBondContact O-N 3.21Å
150	R	93.4	Very high	87	Confident	127 Å²	127	78.2 Å²	78.2	48%	0.479	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	118.2	-178.3	179.6	179.1	165.7	174.5	-0.3	110.3	E132 D152 L167	E132-R150 HydrophobicContact CB-CG 4.49Å; E132-R150 IonicContact OE1-CZ 3.34Å; E132-R150 IonicContact OE1-NE 2.87Å; E132-R150 IonicContact OE2-CZ 3.67Å; E132-R150 IonicContact OE2-NE 2.86Å; E132-R150 PolarHBondContact OE2-NE 2.92Å; E132-R150 VanDerWaalsContact OE2-NE 3.16Å; E132-R150 IonicContact OE2-NH1 3.84Å; E132-R150 IonicContact OE2-NH2 2.94Å; E132-R150 PolarHBondContact OE2-NH2 2.69Å; R150-D152 IonicContact CZ-OD1 2.71Å; R150-D152 IonicContact NE-OD1 3.34Å; R150-D152 PolarHBondContact NE-OD1 3.21Å; R150-D152 IonicContact NE-OD2 3.69Å; R150-D152 IonicContact NH2-OD1 2.67Å; R150-D152 PolarHBondContact NH2-OD1 3.25Å; R150-L167 WeakPolarHBondContact O-CD2 3.5Å
151	L	93.1	Very high	87.3	Confident	10 Å²	10	78.4 Å²	78.4	5%	0.052	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	105.8	169.7	178.7	65.8	0	0	0	109.1	E132 L133 V154 I163 A165 L167 I182 L184	E132-L151 CarbonylContact C-O 3.6Å; E132-L151 VanDerWaalsContact CA-O 3.27Å; E132-L151 WeakPolarHBondContact CA-O 3.46Å; L133-L151 HydrophobicContact CB-CB 4.32Å; L133-L151 PolarHBondContact N-O 2.81Å; L133-L151 PolarHBondContact O-N 2.82Å; L151-V154 HydrophobicContact CD2-CG2 4.26Å; L151-V154 HydrophobicContact CG-CG2 4.27Å; L151-I163 HydrophobicContact CD1-CG2 4.03Å; L151-I163 HydrophobicContact CD2-CG2 4.39Å; L151-A165 HydrophobicContact CD1-CB 4.03Å; L151-L167 HydrophobicContact CB-CD1 4.07Å; L151-L167 HydrophobicContact CB-CD2 4.2Å; L151-L167 HydrophobicContact CD1-CD2 4.06Å; L151-I182 HydrophobicContact CB-CD1 4.19Å; L151-I182 HydrophobicContact CD1-CD1 4.29Å; L151-I182 HydrophobicContact CD2-CD1 3.89Å; L151-I182 HydrophobicContact CG-CD1 4.35Å; L151-L184 HydrophobicContact CD2-CD1 3.76Å; L151-L184 HydrophobicContact CD2-CD2 4.24Å
152	D	89.7	Confident	88.1	Confident	83 Å²	83	75.8 Å²	75.8	44%	0.444	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	155.9	172.5	-69.7	-51	0	0	0	111.9	R150	R150-D152 IonicContact CZ-OD1 2.71Å; R150-D152 IonicContact NE-OD1 3.34Å; R150-D152 PolarHBondContact NE-OD1 3.21Å; R150-D152 IonicContact NE-OD2 3.69Å; R150-D152 IonicContact NH2-OD1 2.67Å; R150-D152 PolarHBondContact NH2-OD1 3.25Å
153	R	85.4	Confident	88.9	Confident	139 Å²	139	71.3 Å²	71.3	53%	0.525	34%	0.34	S	S	.	.			trans	57.7	50.7	173.1	-65.1	-160.6	59.2	-156.5	-8.2	113.8	R131 D155 R156	R131-R153 PolarHBondContact O-N 3.27Å; R153-D155 WeakPolarHBondContact CA-OD1 3.45Å; R153-D155 WeakPolarHBondContact CB-OD1 3.02Å; R153-D155 IonicContact NE-OD1 3.05Å; R153-D155 IonicContact NH2-OD2 3.66Å; R153-D155 PolarHBondContact O-N 3.31Å; R153-R156 HydrophobicContact CB-CG 4.09Å; R153-R156 WeakPolarHBondContact O-CB 3.4Å; R153-R156 WeakPolarHBondContact O-CG 3.29Å; R153-R156 PolarHBondContact O-N 3.27Å
154	V	89.8	Confident	89.4	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-62.5	-22.6	176.5	-163.5	0	0	0	0	111.3	L127 L133 L151 R156 L157 L184	L127-V154 HydrophobicContact CD2-CG1 3.89Å; L133-V154 HydrophobicContact CB-CG2 3.83Å; L151-V154 HydrophobicContact CD2-CG2 4.26Å; L151-V154 HydrophobicContact CG-CG2 4.27Å; V154-R156 PolarHBondContact O-N 3.39Å; V154-L157 VanDerWaalsContact O-CB 3.27Å; V154-L157 WeakPolarHBondContact O-CB 3.43Å; V154-L157 PolarHBondContact O-N 3.49Å; V154-L184 HydrophobicContact CG1-CD2 4.42Å
155	D	87.9	Confident	90.1	Very high	53 Å²	53	62.8 Å²	62.8	28%	0.283	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-55.5	-18	172.4	66.1	-60.2	0	0	0	114.8	K128 R153 L157	K128-D155 HydrophobicContact CB-CB 4.17Å; R153-D155 WeakPolarHBondContact CA-OD1 3.45Å; R153-D155 WeakPolarHBondContact CB-OD1 3.02Å; R153-D155 IonicContact NE-OD1 3.05Å; R153-D155 IonicContact NH2-OD2 3.66Å; R153-D155 PolarHBondContact O-N 3.31Å; D155-L157 PolarHBondContact O-N 3.17Å
156	R	88.5	Confident	90.5	Very high	155 Å²	155	64.5 Å²	64.5	59%	0.585	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-73.4	-12.6	175.6	-63.7	175.3	65.8	-160.7	-2.6	113.5	R153 V154 T158 T161 I163	R153-R156 HydrophobicContact CB-CG 4.09Å; R153-R156 WeakPolarHBondContact O-CB 3.4Å; R153-R156 WeakPolarHBondContact O-CG 3.29Å; R153-R156 PolarHBondContact O-N 3.27Å; V154-R156 PolarHBondContact O-N 3.39Å; R156-T158 PolarHBondContact O-N 3.31Å; R156-T161 PolarHBondContact O-OG1 3.35Å; R156-I163 HydrophobicContact CB-CD1 4.48Å
157	L	91.6	Very high	90.9	Very high	3 Å²	3	62.7 Å²	62.7	2%	0.016	31%	0.314	C	S	.	.			trans	-73.1	121	179.7	-175.6	67.4	0	0	0	110	L47 L127 V154 D155 I163 L184 I186	L47-L157 HydrophobicContact CD1-CD2 3.28Å; L127-L157 HydrophobicContact CD1-CB 4.06Å; L127-L157 HydrophobicContact CD1-CD2 4.24Å; V154-L157 VanDerWaalsContact O-CB 3.27Å; V154-L157 WeakPolarHBondContact O-CB 3.43Å; V154-L157 PolarHBondContact O-N 3.49Å; D155-L157 PolarHBondContact O-N 3.17Å; L157-I163 HydrophobicContact CB-CD1 3.78Å; L157-I163 HydrophobicContact CB-CG1 4.24Å; L157-I163 HydrophobicContact CD1-CD1 4.4Å; L157-I163 HydrophobicContact CD1-CG1 4.07Å; L157-L184 HydrophobicContact CD1-CB 4.07Å; L157-L184 WeakPolarHBondContact CD1-O 3.31Å; L157-L184 HydrophobicContact CD2-CB 4.13Å; L157-L184 HydrophobicContact CD2-CD2 4.32Å; L157-I186 HydrophobicContact CD2-CD1 3.98Å; L157-I186 HydrophobicContact CD2-CG1 3.91Å; L157-I186 HydrophobicContact CG-CD1 3.83Å; L157-I186 HydrophobicContact CG-CG1 4Å
158	T	88.6	Confident	91.1	Very high	47 Å²	47	65.2 Å²	65.2	29%	0.288	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-133	166.8	171.2	76	0	0	0	0	109.2	R156 T160 T161	R156-T158 PolarHBondContact O-N 3.31Å; T158-T160 PolarHBondContact O-N 3.03Å; T158-T160 VanDerWaalsContact O-N 3.1Å; T158-T160 PolarHBondContact OG1-N 3.37Å; T158-T160 PolarHBondContact OG1-OG1 2.9Å; T158-T160 VanDerWaalsContact OG1-OG1 3.1Å; T158-T161 WeakPolarHBondContact CB-OG1 3.28Å; T158-T161 WeakPolarHBondContact CG2-OG1 3Å; T158-T161 PolarHBondContact N-O 3Å; T158-T161 PolarHBondContact N-OG1 2.79Å; T158-T161 CarbonylContact O-C 3.56Å; T158-T161 PolarHBondContact O-N 3.08Å; T158-T161 VanDerWaalsContact O-N 3.07Å; T158-T161 WeakPolarHBondContact OG1-CB 3.38Å; T158-T161 PolarHBondContact OG1-N 3.05Å; T158-T161 PolarHBondContact OG1-OG1 2.99Å
159	P	86.3	Confident	91	Very high	63 Å²	63	60.2 Å²	60.2	41%	0.409	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-28.8	175.1	-24	33.3	0	0	0	113.9	L120 I186	L120-P159 HydrophobicContact CD1-CG 3.64Å; L120-P159 HydrophobicContact CD2-CG 4.4Å; P159-I186 HydrophobicContact CG-CG2 4.25Å
160	T	86.4	Confident	90.9	Very high	123 Å²	123	63.7 Å²	63.7	76%	0.755	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-15.8	179.2	48.1	0	0	0	0	113.9	T158 P162	T158-T160 PolarHBondContact O-N 3.03Å; T158-T160 VanDerWaalsContact O-N 3.1Å; T158-T160 PolarHBondContact OG1-N 3.37Å; T158-T160 PolarHBondContact OG1-OG1 2.9Å; T158-T160 VanDerWaalsContact OG1-OG1 3.1Å; T160-P162 WeakPolarHBondContact O-CD 3.38Å
161	T	89.8	Confident	90.6	Very high	66 Å²	66	59.1 Å²	59.1	41%	0.405	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-123.8	81.8	-176.9	59.4	0	0	0	0	110.8	R156 T158	R156-T161 PolarHBondContact O-OG1 3.35Å; T158-T161 WeakPolarHBondContact CB-OG1 3.28Å; T158-T161 WeakPolarHBondContact CG2-OG1 3Å; T158-T161 PolarHBondContact N-O 3Å; T158-T161 PolarHBondContact N-OG1 2.79Å; T158-T161 CarbonylContact O-C 3.56Å; T158-T161 PolarHBondContact O-N 3.08Å; T158-T161 VanDerWaalsContact O-N 3.07Å; T158-T161 WeakPolarHBondContact OG1-CB 3.38Å; T158-T161 PolarHBondContact OG1-N 3.05Å; T158-T161 PolarHBondContact OG1-OG1 2.99Å
162	P	93.3	Very high	90	Very high	69 Å²	69	67.7 Å²	67.7	45%	0.448	35%	0.354	S	S	.	.			trans	-64.5	156.5	170.8	29.9	-35	0	0	0	110.8	T160 L184 M185	T160-P162 WeakPolarHBondContact O-CD 3.38Å; P162-L184 CarbonylContact C-O 3.52Å; P162-L184 VanDerWaalsContact CA-O 3.29Å; P162-L184 WeakPolarHBondContact CA-O 3.23Å; P162-L184 WeakPolarHBondContact CB-O 3.41Å; P162-M185 HydrophobicContact CB-CB 3.92Å
163	I	92.9	Very high	89.6	Confident	23 Å²	23	70.6 Å²	70.6	12%	0.118	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	113.1	176.4	-61.7	176.8	0	0	0	108	L151 R156 L157 A165 S183 L184	L151-I163 HydrophobicContact CD1-CG2 4.03Å; L151-I163 HydrophobicContact CD2-CG2 4.39Å; R156-I163 HydrophobicContact CB-CD1 4.48Å; L157-I163 HydrophobicContact CB-CD1 3.78Å; L157-I163 HydrophobicContact CB-CG1 4.24Å; L157-I163 HydrophobicContact CD1-CD1 4.4Å; L157-I163 HydrophobicContact CD1-CG1 4.07Å; I163-A165 HydrophobicContact CG2-CB 4.17Å; I163-S183 CarbonylContact O-C 3.54Å; I163-S183 VanDerWaalsContact O-CA 3.24Å; I163-S183 WeakPolarHBondContact O-CA 3.41Å; I163-L184 HydrophobicContact CB-CB 4.34Å; I163-L184 PolarHBondContact N-O 2.88Å; I163-L184 PolarHBondContact O-N 2.96Å
164	D	92.4	Very high	89.4	Confident	104 Å²	104	66.6 Å²	66.6	56%	0.556	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	120.7	163.7	-73.2	-61.9	0	0	0	108.4	R52 S183	R52-D164 IonicContact NH1-OD1 3.39Å; R52-D164 PolarHBondContact NH1-OD1 2.75Å; D164-S183 WeakPolarHBondContact OD1-CB 3.35Å; D164-S183 PolarHBondContact OD1-OG 3.19Å
165	A	93.4	Very high	89.1	Confident	22 Å²	22	71.2 Å²	71.2	18%	0.182	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	147.8	-172.9	0	0	0	0	0	112.5	L151 I163 L167 I182	L151-A165 HydrophobicContact CD1-CB 4.03Å; I163-A165 HydrophobicContact CG2-CB 4.17Å; A165-L167 HydrophobicContact CB-CD2 4.05Å; A165-I182 HydrophobicContact CB-CD1 4.42Å; A165-I182 HydrophobicContact CB-CG1 3.99Å; A165-I182 PolarHBondContact N-O 2.82Å; A165-I182 WeakPolarHBondContact O-CG1 3.04Å; A165-I182 PolarHBondContact O-N 2.89Å
166	I	94.5	Very high	89.2	Confident	113 Å²	113	72.9 Å²	72.9	58%	0.579	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	113.2	168.8	-58.9	174.6	0	0	0	106.7	D179 L180	I166-D179 HydrophobicContact CG2-CB 3.71Å; I166-L180 CarbonylContact C-O 3.57Å; I166-L180 WeakPolarHBondContact CA-O 2.81Å
167	L	94.1	Very high	89.1	Confident	8 Å²	8	66 Å²	66	4%	0.042	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125	-176.6	-54.4	-174.7	0	0	0	110.4	L135 R150 L151 A165 V169 D179 L180 I182	L135-L167 HydrophobicContact CD1-CD1 3.67Å; R150-L167 WeakPolarHBondContact O-CD2 3.5Å; L151-L167 HydrophobicContact CB-CD1 4.07Å; L151-L167 HydrophobicContact CB-CD2 4.2Å; L151-L167 HydrophobicContact CD1-CD2 4.06Å; A165-L167 HydrophobicContact CB-CD2 4.05Å; L167-V169 PolarHBondContact O-N 2.66Å; L167-D179 WeakPolarHBondContact O-CA 3.16Å; L167-L180 HydrophobicContact CB-CB 4.46Å; L167-L180 PolarHBondContact N-O 2.83Å; L167-L180 PolarHBondContact O-N 2.96Å; L167-I182 HydrophobicContact CD1-CD1 3.48Å; L167-I182 VanDerWaalsContact CD1-CD1 3.48Å; L167-I182 HydrophobicContact CD1-CG1 4.1Å; L167-I182 HydrophobicContact CD1-CG2 4.48Å; L167-I182 HydrophobicContact CD2-CD1 4.27Å; L167-I182 HydrophobicContact CG-CD1 3.87Å; L167-I182 HydrophobicContact CG-CG1 4.03Å
168	P	93.2	Very high	89.1	Confident	57 Å²	57	65.9 Å²	65.9	37%	0.37	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	130	168.2	28.8	-32.5	0	0	0	109.2	I170 K176	P168-I170 HydrophobicContact CB-CG1 4.48Å; P168-K176 HydrophobicContact CB-CD 4.29Å; P168-K176 HydrophobicContact CB-CG 4.41Å
169	V	93.9	Very high	89.4	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	119.4	174.4	177.7	0	0	0	0	108.2	F54 V137 L167 K176 L177 G178 L180	F54-V169 HydrophobicContact CD2-CG2 4.27Å; F54-V169 HydrophobicContact CE2-CB 4.08Å; F54-V169 HydrophobicContact CE2-CG1 4.45Å; F54-V169 HydrophobicContact CE2-CG2 3.81Å; V137-V169 HydrophobicContact CB-CG1 4.11Å; V137-V169 HydrophobicContact CG2-CB 4.4Å; V137-V169 HydrophobicContact CG2-CG1 3.58Å; V137-V169 HydrophobicContact CG2-CG2 3.88Å; L167-V169 PolarHBondContact O-N 2.66Å; V169-K176 CarbonylContact O-C 3.49Å; V169-L177 HydrophobicContact CG1-CB 4.38Å; V169-L177 PolarHBondContact O-N 3.02Å; V169-G178 PolarHBondContact N-O 2.69Å; V169-L180 HydrophobicContact CG2-CB 3.83Å
170	I	89.9	Confident	89.8	Confident	73 Å²	73	62.7 Å²	62.7	37%	0.374	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.7	-172.9	-51.8	176.2	0	0	0	109.1	G147 R148 P168 E175	G147-I170 CarbonylContact C-O 3.55Å; G147-I170 WeakPolarHBondContact CA-O 3.29Å; R148-I170 PolarHBondContact N-O 2.93Å; R148-I170 PolarHBondContact O-N 3.22Å; R148-I170 VanDerWaalsContact O-N 3.12Å; P168-I170 HydrophobicContact CB-CG1 4.48Å; I170-E175 WeakPolarHBondContact CA-O 3.1Å
171	N	87.2	Confident	90.2	Very high	30 Å²	30	59.1 Å²	59.1	16%	0.16	33%	0.325	C	S	.	.			trans	-82	178.8	174.8	70.3	6.6	0	0	0	112.1	I146 L173 G174 E175 L177	I146-N171 WeakPolarHBondContact O-CB 3.3Å; N171-L173 PolarHBondContact O-N 3.45Å; N171-L173 WeakPolarHBondContact OD1-CA 3.32Å; N171-L173 WeakPolarHBondContact OD1-CB 3.23Å; N171-L173 PolarHBondContact OD1-N 2.76Å; N171-L173 VanDerWaalsContact OD1-N 3.09Å; N171-G174 PolarHBondContact O-N 2.72Å; N171-G174 VanDerWaalsContact O-N 3.08Å; N171-G174 PolarHBondContact OD1-N 2.92Å; N171-G174 VanDerWaalsContact OD1-N 3.07Å; N171-E175 PolarHBondContact N-O 2.91Å; N171-E175 PolarHBondContact ND2-OE2 3.18Å; N171-E175 WeakPolarHBondContact OD1-CA 3.41Å; N171-E175 WeakPolarHBondContact OD1-CB 3.25Å; N171-E175 PolarHBondContact OD1-N 3.07Å; N171-E175 PolarHBondContact OD1-O 3.32Å; N171-L177 HydrophobicContact CB-CD1 4.14Å; N171-L177 HydrophobicContact CB-CD2 4.26Å; N171-L177 HydrophobicContact CB-CG 4.16Å
172	E	81.3	Confident	90.5	Very high	190 Å²	190	56 Å²	56	89%	0.888	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.1	178.8	-59.9	-173.9	166.5	0	0	113.5	G174	E172-G174 VanDerWaalsContact C-N 3.28Å
173	L	82.1	Confident	90.6	Very high	144 Å²	144	52.7 Å²	52.7	75%	0.754	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-5.8	176.4	-58.3	175.9	0	0	0	113	N171 E175	N171-L173 PolarHBondContact O-N 3.45Å; N171-L173 WeakPolarHBondContact OD1-CA 3.32Å; N171-L173 WeakPolarHBondContact OD1-CB 3.23Å; N171-L173 PolarHBondContact OD1-N 2.76Å; N171-L173 VanDerWaalsContact OD1-N 3.09Å; L173-E175 HydrophobicContact CB-CG 4.19Å
174	G	81.1	Confident	90.7	Very high	55 Å²	55	51.6 Å²	51.6	57%	0.567	28%	0.279	S	S	*	.	S	Bend	trans	85.4	7.9	-176.8	0	0	0	0	0	114.6	N171 E172	N171-G174 PolarHBondContact O-N 2.72Å; N171-G174 VanDerWaalsContact O-N 3.08Å; N171-G174 PolarHBondContact OD1-N 2.92Å; N171-G174 VanDerWaalsContact OD1-N 3.07Å; E172-G174 VanDerWaalsContact C-N 3.28Å
175	E	83.7	Confident	90.8	Very high	98 Å²	98	49.5 Å²	49.5	46%	0.458	27%	0.267	S	S	.	.			trans	-84.3	137.5	179.3	-52.7	175.1	140.8	0	0	111.3	I170 N171 L173 L177	I170-E175 WeakPolarHBondContact CA-O 3.1Å; N171-E175 PolarHBondContact N-O 2.91Å; N171-E175 PolarHBondContact ND2-OE2 3.18Å; N171-E175 WeakPolarHBondContact OD1-CA 3.41Å; N171-E175 WeakPolarHBondContact OD1-CB 3.25Å; N171-E175 PolarHBondContact OD1-N 3.07Å; N171-E175 PolarHBondContact OD1-O 3.32Å; L173-E175 HydrophobicContact CB-CG 4.19Å; E175-L177 PolarHBondContact O-N 2.92Å
176	K	88.8	Confident	90.9	Very high	88 Å²	88	49 Å²	49	38%	0.383	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	110.1	177.3	-175.4	-176.3	175.5	-175.5	0	110.8	N57 P168 V169 G178 D179	N57-K176 PolarHBondContact ND2-O 3.44Å; P168-K176 HydrophobicContact CB-CD 4.29Å; P168-K176 HydrophobicContact CB-CG 4.41Å; V169-K176 CarbonylContact O-C 3.49Å; K176-G178 WeakPolarHBondContact CE-O 3.47Å; K176-D179 VanDerWaalsContact CE-CG 3.5Å; K176-D179 WeakPolarHBondContact CE-OD1 3.09Å; K176-D179 IonicContact NZ-OD1 3.74Å; K176-D179 PolarHBondContact NZ-OD1 2.67Å; K176-D179 IonicContact NZ-OD2 3.97Å; K176-D179 PolarHBondContact NZ-OD2 2.71Å
177	L	87.1	Confident	90.8	Very high	9 Å²	9	47.2 Å²	47.2	5%	0.047	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-28.1	177.2	-60.6	-172.6	0	0	0	113.4	P56 N57 F60 I146 V169 N171 E175	P56-L177 WeakPolarHBondContact CA-O 3.5Å; N57-L177 WeakPolarHBondContact CB-O 3.4Å; N57-L177 PolarHBondContact N-O 3.29Å; F60-L177 HydrophobicContact CD2-CD2 4.37Å; F60-L177 HydrophobicContact CE1-CD2 4.04Å; F60-L177 HydrophobicContact CE2-CD2 3.82Å; F60-L177 HydrophobicContact CZ-CD2 3.63Å; I146-L177 HydrophobicContact CB-CD1 4.1Å; I146-L177 HydrophobicContact CD1-CD1 4.45Å; I146-L177 HydrophobicContact CG1-CD1 4.22Å; I146-L177 WeakPolarHBondContact O-CD1 3.2Å; V169-L177 HydrophobicContact CG1-CB 4.38Å; V169-L177 PolarHBondContact O-N 3.02Å; N171-L177 HydrophobicContact CB-CD1 4.14Å; N171-L177 HydrophobicContact CB-CD2 4.26Å; N171-L177 HydrophobicContact CB-CG 4.16Å; E175-L177 PolarHBondContact O-N 2.92Å
178	G	91	Very high	90.5	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.1	-168.8	-176.9	0	0	0	0	0	113.2	R55 V169 K176	R55-G178 CarbonylContact O-C 3.59Å; R55-G178 WeakPolarHBondContact O-CA 3.04Å; V169-G178 PolarHBondContact N-O 2.69Å; K176-G178 WeakPolarHBondContact CE-O 3.47Å
179	D	94.2	Very high	90.1	Very high	44 Å²	44	50.1 Å²	50.1	24%	0.235	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.6	178.6	-70.7	-51	0	0	0	110.7	F54 R55 I166 L167 K176	F54-D179 WeakPolarHBondContact CA-O 3.33Å; R55-D179 PolarHBondContact N-O 2.67Å; R55-D179 PolarHBondContact O-N 3.45Å; I166-D179 HydrophobicContact CG2-CB 3.71Å; L167-D179 WeakPolarHBondContact O-CA 3.16Å; K176-D179 VanDerWaalsContact CE-CG 3.5Å; K176-D179 WeakPolarHBondContact CE-OD1 3.09Å; K176-D179 IonicContact NZ-OD1 3.74Å; K176-D179 PolarHBondContact NZ-OD1 2.67Å; K176-D179 IonicContact NZ-OD2 3.97Å; K176-D179 PolarHBondContact NZ-OD2 2.71Å
180	L	95.1	Very high	89.1	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	118.6	178.9	-171.8	69.9	0	0	0	110.3	V51 F54 V78 P96 L135 I166 L167 V169 I182	V51-L180 HydrophobicContact CG1-CD1 3.64Å; V51-L180 HydrophobicContact CG1-CD2 4.05Å; V51-L180 HydrophobicContact CG1-CG 3.99Å; F54-L180 HydrophobicContact CB-CD1 3.93Å; F54-L180 HydrophobicContact CD2-CB 4.4Å; F54-L180 HydrophobicContact CD2-CD1 4.04Å; F54-L180 HydrophobicContact CG-CD1 4.47Å; V78-L180 HydrophobicContact CG1-CD2 4.09Å; V78-L180 HydrophobicContact CG2-CD1 4.01Å; V78-L180 HydrophobicContact CG2-CD2 4.3Å; P96-L180 HydrophobicContact CG-CD1 4.44Å; L135-L180 HydrophobicContact CB-CD2 4.16Å; L135-L180 HydrophobicContact CD2-CD2 3.96Å; I166-L180 CarbonylContact C-O 3.57Å; I166-L180 WeakPolarHBondContact CA-O 2.81Å; L167-L180 HydrophobicContact CB-CB 4.46Å; L167-L180 PolarHBondContact N-O 2.83Å; L167-L180 PolarHBondContact O-N 2.96Å; V169-L180 HydrophobicContact CG2-CB 3.83Å; L180-I182 HydrophobicContact CD2-CG2 4.05Å; L180-I182 HydrophobicContact CG-CG2 4Å
181	N	95.4	Very high	87.3	Confident	48 Å²	48	58.2 Å²	58.2	26%	0.257	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.4	177.5	-174.8	-31.1	0	0	0	110.4	R52 L53	R52-N181 PolarHBondContact N-O 3.22Å; L53-N181 HydrophobicContact CB-CB 4.15Å; L53-N181 PolarHBondContact O-N 2.91Å
182	I	95.5	Very high	84.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.8	-179.7	67.9	161.6	0	0	0	112.6	I50 V51 L135 L151 A165 L167 L180 L184	I50-I182 CarbonylContact O-C 3.48Å; I50-I182 WeakPolarHBondContact O-CA 3.44Å; V51-I182 HydrophobicContact CG1-CG2 4.26Å; V51-I182 HydrophobicContact CG2-CG2 4.17Å; L135-I182 HydrophobicContact CD2-CG2 3.93Å; L151-I182 HydrophobicContact CB-CD1 4.19Å; L151-I182 HydrophobicContact CD1-CD1 4.29Å; L151-I182 HydrophobicContact CD2-CD1 3.89Å; L151-I182 HydrophobicContact CG-CD1 4.35Å; A165-I182 HydrophobicContact CB-CD1 4.42Å; A165-I182 HydrophobicContact CB-CG1 3.99Å; A165-I182 PolarHBondContact N-O 2.82Å; A165-I182 WeakPolarHBondContact O-CG1 3.04Å; A165-I182 PolarHBondContact O-N 2.89Å; L167-I182 HydrophobicContact CD1-CD1 3.48Å; L167-I182 VanDerWaalsContact CD1-CD1 3.48Å; L167-I182 HydrophobicContact CD1-CG1 4.1Å; L167-I182 HydrophobicContact CD1-CG2 4.48Å; L167-I182 HydrophobicContact CD2-CD1 4.27Å; L167-I182 HydrophobicContact CG-CD1 3.87Å; L167-I182 HydrophobicContact CG-CG1 4.03Å; L180-I182 HydrophobicContact CD2-CG2 4.05Å; L180-I182 HydrophobicContact CG-CG2 4Å; I182-L184 HydrophobicContact CD1-CD1 3.87Å
183	S	95.3	Very high	82.6	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	132.1	175	-170.5	0	0	0	0	110.3	L49 I50 I163 D164	L49-S183 CarbonylContact C-O 3.58Å; L49-S183 WeakPolarHBondContact CA-O 3.18Å; I50-S183 PolarHBondContact N-O 3.47Å; I50-S183 PolarHBondContact O-N 3.47Å; I163-S183 CarbonylContact O-C 3.54Å; I163-S183 VanDerWaalsContact O-CA 3.24Å; I163-S183 WeakPolarHBondContact O-CA 3.41Å; D164-S183 WeakPolarHBondContact OD1-CB 3.35Å; D164-S183 PolarHBondContact OD1-OG 3.19Å
184	L	96.1	Very high	80.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.2	173.3	-71.6	81.2	0	0	0	109.7	I48 L49 W82 L133 L151 V154 L157 P162 I163 I182	I48-L184 WeakPolarHBondContact O-CA 3Å; L49-L184 HydrophobicContact CD1-CD1 3.54Å; L49-L184 HydrophobicContact CD1-CD2 4.44Å; L49-L184 HydrophobicContact CD1-CG 3.71Å; W82-L184 HydrophobicContact CH2-CD2 4.16Å; L133-L184 HydrophobicContact CD2-CD2 4.26Å; L151-L184 HydrophobicContact CD2-CD1 3.76Å; L151-L184 HydrophobicContact CD2-CD2 4.24Å; V154-L184 HydrophobicContact CG1-CD2 4.42Å; L157-L184 HydrophobicContact CD1-CB 4.07Å; L157-L184 WeakPolarHBondContact CD1-O 3.31Å; L157-L184 HydrophobicContact CD2-CB 4.13Å; L157-L184 HydrophobicContact CD2-CD2 4.32Å; P162-L184 CarbonylContact C-O 3.52Å; P162-L184 VanDerWaalsContact CA-O 3.29Å; P162-L184 WeakPolarHBondContact CA-O 3.23Å; P162-L184 WeakPolarHBondContact CB-O 3.41Å; I163-L184 HydrophobicContact CB-CB 4.34Å; I163-L184 PolarHBondContact N-O 2.88Å; I163-L184 PolarHBondContact O-N 2.96Å; I182-L184 HydrophobicContact CD1-CD1 3.87Å
185	M	94.9	Very high	77.5	Confident	60 Å²	60	64.4 Å²	64.4	30%	0.296	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	155.8	174.6	64.3	-175.9	66.2	0	0	111.5	I48 P162	I48-M185 HydrophobicContact CB-CG 3.74Å; I48-M185 HydrophobicContact CD1-CG 4.43Å; I48-M185 HydrophobicContact CD1-SD 4.43Å; I48-M185 HydrophobicContact CG1-CG 4.5Å; I48-M185 HydrophobicContact CG2-CG 4.29Å; I48-M185 PolarHBondContact N-O 2.81Å; I48-M185 PolarHBondContact O-N 3.3Å; P162-M185 HydrophobicContact CB-CB 3.92Å
186	I	94.9	Very high	74.8	Confident	12 Å²	12	64.9 Å²	64.9	6%	0.062	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.1	177.7	-63.5	173	0	0	0	108.9	A45 H46 L47 I116 L120 F123 L157 P159 P188	A45-I186 HydrophobicContact CB-CG2 3.89Å; H46-I186 CarbonylContact O-C 3.45Å; H46-I186 WeakPolarHBondContact O-CA 3.48Å; L47-I186 HydrophobicContact CD1-CG1 3.98Å; I116-I186 HydrophobicContact CD1-CG1 4.43Å; I116-I186 HydrophobicContact CD1-CG2 4.2Å; L120-I186 HydrophobicContact CD2-CG2 3.7Å; F123-I186 HydrophobicContact CD1-CD1 4.05Å; F123-I186 HydrophobicContact CE1-CD1 3.91Å; F123-I186 HydrophobicContact CE1-CG1 4.49Å; L157-I186 HydrophobicContact CD2-CD1 3.98Å; L157-I186 HydrophobicContact CD2-CG1 3.91Å; L157-I186 HydrophobicContact CG-CD1 3.83Å; L157-I186 HydrophobicContact CG-CG1 4Å; P159-I186 HydrophobicContact CG-CG2 4.25Å; I186-P188 WeakPolarHBondContact O-CD 3.36Å
187	E	91.8	Very high	71.8	Confident	75 Å²	75	69.2 Å²	69.2	35%	0.35	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	103.3	171.2	-68.7	-178.3	167.4	0	0	109.6	A45 H46 I48 R113	A45-E187 CarbonylContact C-O 3.55Å; A45-E187 VanDerWaalsContact CA-O 3.32Å; A45-E187 WeakPolarHBondContact CA-O 3.29Å; H46-E187 HydrophobicContact CB-CB 4.44Å; H46-E187 PolarHBondContact N-O 2.84Å; H46-E187 PolarHBondContact O-N 2.75Å; I48-E187 HydrophobicContact CD1-CG 3.86Å; I48-E187 WeakPolarHBondContact CD1-OE1 3.36Å; R113-E187 IonicContact NE-OE2 3.45Å; R113-E187 IonicContact NH2-OE2 3.66Å; R113-E187 PolarHBondContact NH2-OE2 2.7Å
188	P	87.2	Confident	69	Low	71 Å²	71	75.4 Å²	75.4	46%	0.461	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	142.3	175.4	26	-32.4	0	0	0	111.5	L120 I186 I190	L120-P188 HydrophobicContact CD1-CB 4.41Å; I186-P188 WeakPolarHBondContact O-CD 3.36Å; P188-I190 PolarHBondContact O-N 3.33Å
189	V	85.1	Confident	65.9	Low	54 Å²	54	82.6 Å²	82.6	33%	0.327	45%	0.45	S	S	.	.			trans	-80	111.7	174.9	179.1	0	0	0	0	108.8	V43 T44 N191	V43-V189 HydrophobicContact CG1-CG2 4.14Å; T44-V189 WeakPolarHBondContact O-CB 3.31Å; T44-V189 PolarHBondContact O-N 2.89Å; V189-N191 PolarHBondContact O-N 3.3Å; V189-N191 VanDerWaalsContact O-N 3.11Å
190	I	74.4	Confident	62.6	Low	143 Å²	143	85.7 Å²	85.7	73%	0.733	48%	0.475	S	S	*	.			trans	-73.6	101.6	175.2	-53.8	171.6	0	0	0	108	P188 T192	P188-I190 PolarHBondContact O-N 3.33Å; I190-T192 HydrophobicContact CG2-CG2 4.37Å; I190-T192 PolarHBondContact O-N 3.36Å
191	N	51.8	Low	59.4	Low	100 Å²	100	93.1 Å²	93.1	54%	0.535	51%	0.513	S	S	.	.			trans	-67.7	96.7	172.2	-79.1	-35.6	0	0	0	109.1	K42 V189 N193	K42-N191 PolarHBondContact NZ-OD1 3.09Å; V189-N191 PolarHBondContact O-N 3.3Å; V189-N191 VanDerWaalsContact O-N 3.11Å; N191-N193 PolarHBondContact O-N 3.27Å
192	T	35.9	Very low	56	Low	112 Å²	112	100.2 Å²	100.2	69%	0.687	55%	0.545	S	S	*	.			trans	-77.2	55.2	168.1	45.8	0	0	0	0	110.8	I190	I190-T192 HydrophobicContact CG2-CG2 4.37Å; I190-T192 PolarHBondContact O-N 3.36Å
193	N	34.3	Very low	52.6	Low	147 Å²	147	104.6 Å²	104.6	79%	0.786	58%	0.575	S	S	*	*			trans	-102.5	36	173.2	-85.8	12.2	0	0	0	112.5	N191	N191-N193 PolarHBondContact O-N 3.27Å
194	S	28.9	Very low	49.2	Very low	111 Å²	111	113 Å²	113	78%	0.776	62%	0.615	S	S	*	*			trans	-133.7	60.8	165.3	54.4	0	0	0	0	109.9
195	K	27	Very low	45.8	Very low	180 Å²	180	121.6 Å²	121.6	78%	0.783	66%	0.655	S	S	*	*			trans	-108.8	69	170.5	-145	178.2	-172.7	-175.1	0	109.2
196	S	27.1	Very low	42.4	Very low	108 Å²	108	126 Å²	126	76%	0.755	68%	0.68	S	S	*	*			trans	-87.4	115.3	152.9	57.3	0	0	0	0	107.1
197	M	25.9	Very low	39	Very low	179 Å²	179	132.7 Å²	132.7	88%	0.882	72%	0.715	S	S	*	*	S	Bend	trans	60.8	99.3	170.7	-73.6	-171.9	161.3	0	0	116.9
198	I	27.8	Very low	35.8	Very low	139 Å²	139	132.3 Å²	132.3	71%	0.713	73%	0.732	S	S	*	*				-161.2	96.4	116	-81.4	142	0	0	0	103.9
199	D	25.1	Very low	32.8	Very low	152 Å²	152	134.6 Å²	134.6	81%	0.813	74%	0.744	S	S	*	*			trans	-79.4	151.4	159.8	-86.4	-32	0	0	0	108.8
200	S	26.1	Very low	29.9	Very low	109 Å²	109	137.6 Å²	137.6	76%	0.762	76%	0.762	S	S	*	*			trans	88.5	72.8	163.7	-41.6	0	0	0	0	117.5
201	I	26	Very low	27.4	Very low	155 Å²	155	137.7 Å²	137.7	80%	0.795	77%	0.765	S	S	*	*			trans	-131	90	136.7	-57.1	-179.1	0	0	0	107.7
202	Q	24.2	Very low	26.1	Very low	198 Å²	198	141 Å²	141	93%	0.925	78%	0.776	S	S	*	*			trans	-74.1	112.1	157.6	-77.4	179.4	-16.8	0	0	107.4
203	S	24.8	Very low	25.5	Very low	92 Å²	92	143.9 Å²	143.9	64%	0.643	78%	0.782	S	S	*	*			trans	-142.1	89.9	163	64.1	0	0	0	0	110.2
204	Q	24	Very low	25	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.822	78%	0.783	S	S	*	*			trans	49.8	104	137.5	-66	179.6	-15.6	0	0	118.2	N206	Q204-N206 PolarHBondContact O-N 3.12Å
205	Q	23.9	Very low	24.8	Very low	180 Å²	180	143.5 Å²	143.5	84%	0.841	78%	0.782	S	S	*	*			trans	-55.3	109.9	154.9	-67.9	171	-12.8	0	0	110
206	N	24.5	Very low	24.8	Very low	153 Å²	153	142 Å²	142	82%	0.818	78%	0.783	S	S	*	*			trans	-105.4	101.1	158.4	-87.8	-14.8	0	0	0	108.3	Q204 G208	Q204-N206 PolarHBondContact O-N 3.12Å; N206-G208 PolarHBondContact O-N 3.39Å
207	N	24.2	Very low	24.9	Very low	152 Å²	152	144.6 Å²	144.6	81%	0.813	79%	0.787	S	S	*	*			trans	-65.9	93.4	169.6	-78.5	-20.9	0	0	0	109.6
208	G	24	Very low	24.9	Very low	68 Å²	68	142.3 Å²	142.3	70%	0.701	78%	0.779	S	S	*	*			trans	-108.8	87.8	165.1	0	0	0	0	0	109.5	N206 V210	N206-G208 PolarHBondContact O-N 3.39Å; G208-V210 PolarHBondContact O-N 2.8Å
209	V	23.2	Very low	25	Very low	119 Å²	119	144 Å²	144	72%	0.721	79%	0.788	S	S	*	*			trans	-69.7	104.1	172.6	175.7	0	0	0	0	108.1
210	V	24.2	Very low	25.1	Very low	116 Å²	116	139.8 Å²	139.8	70%	0.703	78%	0.78	S	S	*	*			trans	-118.1	103.5	164.6	-179	0	0	0	0	107.2	G208 E212	G208-V210 PolarHBondContact O-N 2.8Å; V210-E212 HydrophobicContact CG1-CG 4.09Å; V210-E212 PolarHBondContact O-N 3.24Å
211	N	22.7	Very low	25	Very low	146 Å²	146	139.7 Å²	139.7	78%	0.781	78%	0.78	S	S	*	*			trans	-73.4	94.7	174.7	-74.5	-35.6	0	0	0	109.1
212	E	23.4	Very low	25.2	Very low	168 Å²	168	140.7 Å²	140.7	79%	0.785	79%	0.786	S	S	*	*			trans	-107.5	106.8	167	-79.9	178.9	-171.6	0	0	109.8	V210 P214	V210-E212 HydrophobicContact CG1-CG 4.09Å; V210-E212 PolarHBondContact O-N 3.24Å; E212-P214 WeakPolarHBondContact O-CD 3.27Å
213	H	23.5	Very low	25.4	Very low	173 Å²	173	137.9 Å²	137.9	80%	0.801	78%	0.777	S	S	*	*			trans	-71.3	120.2	167.2	-80.3	-62.8	0	0	0	109	V215	H213-V215 PolarHBondContact O-N 3.03Å; H213-V215 VanDerWaalsContact O-N 3.14Å
214	P	24.6	Very low	25.7	Very low	124 Å²	124	142.6 Å²	142.6	81%	0.805	79%	0.789	S	S	*	*			trans	-77.6	106	178.5	30.2	-30.2	0	0	0	109.2	E212	E212-P214 WeakPolarHBondContact O-CD 3.27Å
215	V	25.3	Very low	25.9	Very low	127 Å²	127	141.6 Å²	141.6	77%	0.77	79%	0.789	S	S	*	*			trans	-91.6	102.3	163.5	-179.7	0	0	0	0	106.2	H213 L217	H213-V215 PolarHBondContact O-N 3.03Å; H213-V215 VanDerWaalsContact O-N 3.14Å; V215-L217 PolarHBondContact O-N 3.44Å
216	D	27.1	Very low	26.2	Very low	147 Å²	147	140.2 Å²	140.2	79%	0.786	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-65.3	121.8	175.9	-100.2	-25.7	0	0	0	110.2
217	L	27.9	Very low	26.1	Very low	163 Å²	163	142.1 Å²	142.1	85%	0.853	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-73.2	137.1	-177.8	-74.6	158.5	0	0	0	112.2	V215 I219	V215-L217 PolarHBondContact O-N 3.44Å; L217-I219 PolarHBondContact O-N 2.97Å
218	D	26.2	Very low	26.2	Very low	132 Å²	132	143 Å²	143	71%	0.706	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-59.1	116.1	173.1	-82.2	-38.9	0	0	0	111.9	G220	D218-G220 PolarHBondContact O-N 3.34Å
219	I	30.6	Very low	26.4	Very low	174 Å²	174	145 Å²	145	89%	0.892	79%	0.786	S	S	*	*			trans	-90.7	94.8	158.2	-63.9	175.4	0	0	0	106.5	L217	L217-I219 PolarHBondContact O-N 2.97Å
220	G	27.5	Very low	26.4	Very low	64 Å²	64	144.3 Å²	144.3	66%	0.66	79%	0.787	S	S	*	*			trans	-67.5	147.9	-178.6	0	0	0	0	0	114.1	D218	D218-G220 PolarHBondContact O-N 3.34Å
221	S	24.1	Very low	26.6	Very low	107 Å²	107	147.6 Å²	147.6	75%	0.748	79%	0.794	S	S	*	*			trans	-47.1	125.1	168.3	-153	0	0	0	0	112.7
222	L	28.4	Very low	26.6	Very low	176 Å²	176	148.3 Å²	148.3	92%	0.921	80%	0.798	S	S	*	*			trans	-117.4	75.6	162.9	-155.6	83.6	0	0	0	108
223	D	28.8	Very low	26.9	Very low	139 Å²	139	147 Å²	147	74%	0.743	80%	0.802	S	S	*	*			trans	-97.7	116.5	160.4	-77.3	-33	0	0	0	106.6
224	Q	31.9	Very low	26.9	Very low	191 Å²	191	145.5 Å²	145.5	89%	0.893	80%	0.799	S	S	*	*			trans	-173.1	103.5	143.2	-106.2	167.6	15.3	0	0	110.2
225	D	28.4	Very low	26.8	Very low	155 Å²	155	146.8 Å²	146.8	83%	0.829	80%	0.798	S	S	*	*			trans	-58.3	128.9	163.2	-60.8	-57.8	0	0	0	110.9
226	N	29.4	Very low	26.7	Very low	151 Å²	151	147.7 Å²	147.7	81%	0.807	80%	0.798	S	S	*	*			trans	-167.6	104.4	146.3	-103.4	-23	0	0	0	112.7
227	Y	23.5	Very low	26.5	Very low	193 Å²	193	147.9 Å²	147.9	76%	0.757	80%	0.799	S	S	*	*			trans	34.3	130.4	135.1	-80.5	-78.3	0	0	0	123.2
228	H	25.6	Very low	26.4	Very low	171 Å²	171	147.1 Å²	147.1	79%	0.792	80%	0.796	S	S	*	*			trans	67.7	104	147.1	-63.8	-55.8	0	0	0	119.5
229	S	27.8	Very low	26.3	Very low	109 Å²	109	145.1 Å²	145.1	76%	0.762	79%	0.792	S	S	*	*				168.2	129.9	106.5	-173.3	0	0	0	0	110.1
230	S	23.3	Very low	26	Very low	105 Å²	105	143 Å²	143	73%	0.734	78%	0.783	S	S	*	*			trans	-66.2	120.7	175.3	49.9	0	0	0	0	112.2
231	H	28.2	Very low	25.9	Very low	185 Å²	185	148 Å²	148	86%	0.856	79%	0.794	S	S	*	*			trans	-144.7	109	148.9	-92.1	-48.4	0	0	0	110.7
232	N	23.2	Very low	25.9	Very low	161 Å²	161	153.1 Å²	153.1	86%	0.861	80%	0.799	S	S	*	*			trans	-67.5	120.2	165	-75.3	-34.5	0	0	0	109.4
233	V	29	Very low	25.5	Very low	141 Å²	141	155.8 Å²	155.8	86%	0.855	80%	0.797	S	S	*	*			trans	-139.7	134.9	149.6	-178.4	0	0	0	0	108.6
234	N	23.9	Very low	25.3	Very low	141 Å²	141	156.8 Å²	156.8	75%	0.754	80%	0.801	S	S	*	*			trans	-77.9	163.5	-167.3	-72.4	-49.2	0	0	0	115.4
235	L	23.2	Very low	24.7	Very low	150 Å²	150	158.1 Å²	158.1	79%	0.785	80%	0.798	S	S	*	*			trans	68.2	112.6	157.1	-96.6	86.2	0	0	0	117
236	L	23	Very low	24.4	Very low	146 Å²	146	157.1 Å²	157.1	76%	0.764	80%	0.797	S	S	*	*				61.5	99.9	93.7	-116.7	79.3	0	0	0	112.1
237	D	23.7	Very low	24.2	Very low	151 Å²	151	155 Å²	155	81%	0.807	79%	0.791	S	S	*	*				-178	151.5	122.1	-94.5	-22.1	0	0	0	112.9
238	N	25.3	Very low	24.1	Very low	147 Å²	147	154 Å²	154	79%	0.786	80%	0.796	S	S	*	*			trans	75.8	106.1	168.5	-79.4	-21.7	0	0	0	117.7
239	S	23.7	Very low	24	Very low	90 Å²	90	154.2 Å²	154.2	63%	0.629	80%	0.797	S	S	*	*				115.5	143.8	63.9	64.5	0	0	0	0	106
240	N	25.4	Very low	23.8	Very low	131 Å²	131	152.1 Å²	152.1	70%	0.701	79%	0.793	S	S	*	*			cis	-160.5	108.6	-3.1	-99.1	-29.1	0	0	0	103.4	Y242	N240-Y242 PolarHBondContact O-N 2.84Å
241	N	24.4	Very low	23.9	Very low	167 Å²	167	155.9 Å²	155.9	89%	0.893	80%	0.799	S	S	*	*			trans	-83.1	109.2	170.2	-85.9	-30.6	0	0	0	108.3	R243	N241-R243 PolarHBondContact O-N 2.82Å
242	Y	23.8	Very low	23.5	Very low	215 Å²	215	150.8 Å²	150.8	84%	0.843	80%	0.796	S	S	*	*			trans	-59.9	93.4	172	-76	-87.8	0	0	0	110.4	N240	N240-Y242 PolarHBondContact O-N 2.84Å
243	R	21	Very low	23.6	Very low	233 Å²	233	153.8 Å²	153.8	88%	0.879	80%	0.795	S	S	*	*			trans	-102.9	94.8	168.8	-145.2	175.3	-173.7	164.5	2	106.9	N241 R245	N241-R243 PolarHBondContact O-N 2.82Å; R243-R245 PolarHBondContact O-N 3.18Å
244	L	22.9	Very low	23.2	Very low	159 Å²	159	155.8 Å²	155.8	83%	0.832	80%	0.795	S	S	*	*			trans	-58.9	105	171	-104.5	81.7	0	0	0	108.4
245	R	20.6	Very low	23.2	Very low	220 Å²	220	157 Å²	157	83%	0.83	80%	0.801	S	S	*	*			trans	-108.3	94.3	176.2	-145.6	-177.1	-167.6	-174.4	3.3	106.8	R243 T247	R243-R245 PolarHBondContact O-N 3.18Å; R245-T247 PolarHBondContact O-N 2.77Å
246	T	22.4	Very low	23.2	Very low	133 Å²	133	155.1 Å²	155.1	82%	0.816	80%	0.796	S	S	*	*			trans	-69.1	95.3	170.9	37.2	0	0	0	0	108.6
247	T	24.4	Very low	23.2	Very low	108 Å²	108	155.2 Å²	155.2	66%	0.663	80%	0.797	S	S	*	*			trans	-86.7	112.6	172.1	15.3	0	0	0	0	108.4	R245 H249	R245-T247 PolarHBondContact O-N 2.77Å; T247-H249 PolarHBondContact O-N 3.15Å; T247-H249 VanDerWaalsContact O-N 3.15Å
248	I	22.3	Very low	23.5	Very low	170 Å²	170	154.3 Å²	154.3	87%	0.872	80%	0.797	S	S	*	*			trans	-60.3	106.9	171.4	-63.2	164.6	0	0	0	107.6
249	H	23.1	Very low	23.5	Very low	176 Å²	176	154.1 Å²	154.1	82%	0.815	80%	0.796	S	S	*	*			trans	-92.4	115.9	168.6	-102.1	71.4	0	0	0	108.8	T247	T247-H249 PolarHBondContact O-N 3.15Å; T247-H249 VanDerWaalsContact O-N 3.15Å
250	G	22.2	Very low	23.8	Very low	66 Å²	66	159.5 Å²	159.5	68%	0.68	81%	0.808	S	S	*	*			trans	-65.7	136.5	171	0	0	0	0	0	111.3
251	H	25.4	Very low	23.7	Very low	184 Å²	184	160.5 Å²	160.5	85%	0.852	81%	0.813	S	S	*	*			trans	-122	95	161.8	-124.2	37.9	0	0	0	107.5
252	G	21.3	Very low	23.9	Very low	77 Å²	77	157.8 Å²	157.8	79%	0.794	81%	0.807	S	S	*	*			trans	-71.8	127	165.5	0	0	0	0	0	109.2
253	R	25	Very low	23.9	Very low	225 Å²	225	156.9 Å²	156.9	85%	0.849	81%	0.808	S	S	*	*			trans	-127.9	104.9	155.4	-88	-170	177.2	-175	-0.4	108.1
254	E	20.1	Very low	23.9	Very low	183 Å²	183	150.2 Å²	150.2	86%	0.855	80%	0.798	S	S	*	*			trans	-57	121.1	162.1	-169.3	173.3	-155.5	0	0	109.1
255	L	24.6	Very low	23.9	Very low	167 Å²	167	148.2 Å²	148.2	87%	0.874	79%	0.792	S	S	*	*			trans	-135.4	123.5	164.6	-90.8	161.2	0	0	0	107.8
256	T	22.9	Very low	24.1	Very low	110 Å²	110	146.7 Å²	146.7	68%	0.675	79%	0.794	S	S	*	*			trans	-85.6	148.3	-165.1	42	0	0	0	0	112.5
257	N	23.6	Very low	24.3	Very low	148 Å²	148	145.5 Å²	145.5	79%	0.791	79%	0.791	S	S	*	*			trans	32.5	128.7	148.8	-64.5	-10	0	0	0	120.2
258	T	29.1	Very low	24.5	Very low	132 Å²	132	144 Å²	144	81%	0.81	80%	0.797	S	S	*	*				-173	117.2	115.4	22.9	0	0	0	0	112.1
259	D	24.4	Very low	24.9	Very low	143 Å²	143	142.6 Å²	142.6	77%	0.765	79%	0.791	S	S	*	*			trans	13.6	127	144.9	-49.7	-32.8	0	0	0	120.2
260	K	30.1	Very low	25.2	Very low	203 Å²	203	141 Å²	141	88%	0.883	79%	0.789	S	S	*	*				178.2	140.9	101.8	-93.7	172.8	-175	177	0	113
261	D	23.3	Very low	25.9	Very low	151 Å²	151	143 Å²	143	81%	0.807	78%	0.784	S	S	*	*			trans	-59.6	139.7	-174.4	-54.9	-67.7	0	0	0	116
262	S	30.2	Very low	26.5	Very low	110 Å²	110	141 Å²	141	77%	0.769	78%	0.779	S	S	*	*			trans	-172.2	111.3	130.7	53.5	0	0	0	0	111.6
263	F	22.3	Very low	27.5	Very low	196 Å²	196	142.9 Å²	142.9	86%	0.86	78%	0.776	S	S	*	*			trans	-0.1	142.3	147.1	-60.5	-90.3	0	0	0	117.6
264	S	21.8	Very low	28.2	Very low	94 Å²	94	137.4 Å²	137.4	66%	0.657	76%	0.763	S	S	*	*			cis	-174.7	158.5	2.6	53.3	0	0	0	0	108.8
265	T	22.1	Very low	29	Very low	116 Å²	116	135.2 Å²	135.2	71%	0.712	75%	0.751	S	S	*	*			trans	64.4	97.7	159.8	62.5	0	0	0	0	118.9
266	H	25.1	Very low	29.9	Very low	188 Å²	188	130.3 Å²	130.3	87%	0.87	73%	0.731	S	S	*	*				-162.8	119.8	123.6	-94.1	-59.6	0	0	0	112
267	S	27.3	Very low	30.9	Very low	108 Å²	108	131.6 Å²	131.6	76%	0.755	73%	0.727	S	S	*	*			trans	48.5	84.4	143.7	-172.3	0	0	0	0	118	N269	S267-N269 PolarHBondContact O-N 3.27Å
268	G	28	Very low	31.9	Very low	77 Å²	77	131.6 Å²	131.6	79%	0.794	72%	0.716	S	S	*	*			trans	-68.7	112.7	169.9	0	0	0	0	0	112.9	N270	G268-N270 PolarHBondContact O-N 2.83Å
269	N	30.2	Very low	33.1	Very low	140 Å²	140	132 Å²	132	75%	0.749	71%	0.708	S	S	*	*			trans	-58	113.6	163.4	-86.7	-24.8	0	0	0	110.9	S267	S267-N269 PolarHBondContact O-N 3.27Å
270	N	30.9	Very low	34.4	Very low	143 Å²	143	131.4 Å²	131.4	77%	0.765	70%	0.701	S	S	*	*			trans	-126.8	32	166.9	-94	-14.4	0	0	0	111.9	G268	G268-N270 PolarHBondContact O-N 2.83Å
271	N	35.3	Very low	35.6	Very low	108 Å²	108	127 Å²	127	58%	0.578	69%	0.686	S	S	*	*			trans	-93.2	-13.3	-177	-74.4	-13.9	0	0	0	115	V273 N274 F275	N271-V273 PolarHBondContact O-N 2.93Å; N271-N274 PolarHBondContact O-N 2.99Å; N271-F275 WeakPolarHBondContact O-CD2 2.79Å
272	D	38.9	Very low	36.8	Very low	141 Å²	141	124.2 Å²	124.2	75%	0.754	67%	0.671	S	S	*	*	H	α-helix	trans	-77.6	-23.1	-174.4	-71.3	-25.2	0	0	0	114.3
273	V	41.7	Very low	37.9	Very low	118 Å²	118	122.4 Å²	122.4	72%	0.715	66%	0.658	S	S	*	*	H	α-helix	trans	-79.1	-26.8	177.2	-177	0	0	0	0	111.9	N271	N271-V273 PolarHBondContact O-N 2.93Å
274	N	39.8	Very low	39.9	Very low	110 Å²	110	117.4 Å²	117.4	59%	0.588	64%	0.64	S	S	*	*	H	α-helix	trans	-76.8	-28.4	179	-88	-18.5	0	0	0	113.2	N271 R278	N271-N274 PolarHBondContact O-N 2.99Å; N274-R278 WeakPolarHBondContact O-CB 3.39Å; N274-R278 PolarHBondContact O-N 3.07Å; N274-R278 VanDerWaalsContact O-N 3.08Å
275	F	38.5	Very low	41.4	Very low	136 Å²	136	115.7 Å²	115.7	60%	0.596	63%	0.632	S	S	*	*	H	α-helix	trans	-68.5	-43.9	177.8	-91.5	-81.3	0	0	0	112.8	N271 K277 R278 E279	N271-F275 WeakPolarHBondContact O-CD2 2.79Å; F275-K277 VanDerWaalsContact C-N 3.34Å; F275-K277 PolarHBondContact O-N 2.91Å; F275-R278 PolarHBondContact O-N 2.98Å; F275-E279 PolarHBondContact O-N 2.85Å
276	S	41.4	Very low	43.1	Very low	64 Å²	64	115.3 Å²	115.3	45%	0.448	63%	0.625	S	S	.	*	H	α-helix	trans	-66.6	-36.4	179.4	-168.1	0	0	0	0	112.2	R278 E279 Q280	S276-R278 VanDerWaalsContact C-N 3.34Å; S276-R278 PolarHBondContact O-N 3.24Å; S276-E279 PolarHBondContact O-N 3.12Å; S276-Q280 WeakPolarHBondContact O-CG 3.28Å; S276-Q280 PolarHBondContact O-N 2.78Å
277	K	45.7	Very low	45.1	Very low	137 Å²	137	112 Å²	112	60%	0.596	61%	0.61	S	S	*	*	H	α-helix	trans	-67.9	-34.7	175.3	-152	171.3	-172.2	176.9	0	112	F275 L281	F275-K277 VanDerWaalsContact C-N 3.34Å; F275-K277 PolarHBondContact O-N 2.91Å; K277-L281 WeakPolarHBondContact O-CB 3.3Å; K277-L281 VanDerWaalsContact O-CG 3.27Å; K277-L281 WeakPolarHBondContact O-CG 3.29Å; K277-L281 PolarHBondContact O-N 2.77Å
278	R	43.8	Very low	46.2	Very low	149 Å²	149	113.8 Å²	113.8	56%	0.562	60%	0.604	S	S	*	*	H	α-helix	trans	-68.3	-42.6	175.7	-174.3	175.4	178.1	166.3	1	112.2	N274 F275 S276 L281 L282	N274-R278 WeakPolarHBondContact O-CB 3.39Å; N274-R278 PolarHBondContact O-N 3.07Å; N274-R278 VanDerWaalsContact O-N 3.08Å; F275-R278 PolarHBondContact O-N 2.98Å; S276-R278 VanDerWaalsContact C-N 3.34Å; S276-R278 PolarHBondContact O-N 3.24Å; R278-L281 PolarHBondContact O-N 2.86Å; R278-L282 HydrophobicContact CG-CD1 4.13Å; R278-L282 WeakPolarHBondContact O-CB 3.37Å; R278-L282 PolarHBondContact O-N 2.75Å
279	E	53.9	Low	47.1	Very low	139 Å²	139	112 Å²	112	65%	0.65	58%	0.58	S	S	*	*	H	α-helix	trans	-62.5	-45.4	173.4	-91.8	-171.6	150.5	0	0	111.6	F275 S276 L281 L282 S283	F275-E279 PolarHBondContact O-N 2.85Å; S276-E279 PolarHBondContact O-N 3.12Å; E279-L281 VanDerWaalsContact C-N 3.34Å; E279-L281 PolarHBondContact O-N 2.82Å; E279-L282 PolarHBondContact O-N 2.78Å; E279-S283 WeakPolarHBondContact O-CB 3.49Å; E279-S283 PolarHBondContact O-N 2.77Å; E279-S283 PolarHBondContact O-OG 3.25Å; E279-S283 VanDerWaalsContact O-OG 3.11Å
280	Q	53.1	Low	48.2	Very low	131 Å²	131	111.1 Å²	111.1	61%	0.612	57%	0.569	S	S	*	*	H	α-helix	trans	-61.8	-40.1	177.5	-73.8	179.9	3.6	0	0	112.6	S276 L284	S276-Q280 WeakPolarHBondContact O-CG 3.28Å; S276-Q280 PolarHBondContact O-N 2.78Å; Q280-L284 VanDerWaalsContact O-CB 3.3Å; Q280-L284 WeakPolarHBondContact O-CB 3.29Å; Q280-L284 PolarHBondContact O-N 3.23Å
281	L	53.8	Low	49	Very low	110 Å²	110	110.1 Å²	110.1	58%	0.576	56%	0.559	S	S	*	*	H	α-helix	trans	-68.3	-37.4	176	-73.4	170.7	0	0	0	112.2	K277 R278 E279 L284 A285	K277-L281 WeakPolarHBondContact O-CB 3.3Å; K277-L281 VanDerWaalsContact O-CG 3.27Å; K277-L281 WeakPolarHBondContact O-CG 3.29Å; K277-L281 PolarHBondContact O-N 2.77Å; R278-L281 PolarHBondContact O-N 2.86Å; E279-L281 VanDerWaalsContact C-N 3.34Å; E279-L281 PolarHBondContact O-N 2.82Å; L281-L284 PolarHBondContact O-N 3.21Å; L281-A285 VanDerWaalsContact O-CB 3.27Å; L281-A285 WeakPolarHBondContact O-CB 3.46Å; L281-A285 PolarHBondContact O-N 2.85Å
282	L	48.4	Very low	49.3	Very low	93 Å²	93	110.3 Å²	110.3	49%	0.487	56%	0.56	S	S	.	*	H	α-helix	trans	-66	-44.2	174.4	-92.9	156.7	0	0	0	111.8	R278 E279 A285 L286	R278-L282 HydrophobicContact CG-CD1 4.13Å; R278-L282 WeakPolarHBondContact O-CB 3.37Å; R278-L282 PolarHBondContact O-N 2.75Å; E279-L282 PolarHBondContact O-N 2.78Å; L282-A285 PolarHBondContact O-N 3.32Å; L282-L286 VanDerWaalsContact O-CB 3.32Å; L282-L286 WeakPolarHBondContact O-CB 3.46Å; L282-L286 WeakPolarHBondContact O-CG 3.28Å; L282-L286 PolarHBondContact O-N 3.08Å
283	S	53.6	Low	49.3	Very low	72 Å²	72	110.8 Å²	110.8	50%	0.503	55%	0.551	S	S	.	*	H	α-helix	trans	-62.1	-44.2	174.5	-61.7	0	0	0	0	111.4	E279 A285 L286 E287	E279-S283 WeakPolarHBondContact O-CB 3.49Å; E279-S283 PolarHBondContact O-N 2.77Å; E279-S283 PolarHBondContact O-OG 3.25Å; E279-S283 VanDerWaalsContact O-OG 3.11Å; S283-A285 PolarHBondContact O-N 3.34Å; S283-L286 PolarHBondContact O-N 2.9Å; S283-E287 VanDerWaalsContact O-CB 3.29Å; S283-E287 WeakPolarHBondContact O-CB 3.37Å; S283-E287 PolarHBondContact O-N 3.5Å
284	L	64.8	Low	49.3	Very low	92 Å²	92	109.5 Å²	109.5	48%	0.482	54%	0.537	S	S	.	.	H	α-helix	trans	-64.7	-39.6	177.2	-163.8	87	0	0	0	112.1	Q280 L281 K288	Q280-L284 VanDerWaalsContact O-CB 3.3Å; Q280-L284 WeakPolarHBondContact O-CB 3.29Å; Q280-L284 PolarHBondContact O-N 3.23Å; L281-L284 PolarHBondContact O-N 3.21Å; L284-K288 WeakPolarHBondContact O-CB 3.34Å; L284-K288 WeakPolarHBondContact O-CG 3.39Å; L284-K288 PolarHBondContact O-N 3.32Å
285	A	52.7	Low	49.3	Very low	58 Å²	58	107.2 Å²	107.2	48%	0.479	53%	0.534	S	S	.	.	H	α-helix	trans	-68.7	-41.2	176.9	0	0	0	0	0	111.8	L281 L282 S283 K288 S289	L281-A285 VanDerWaalsContact O-CB 3.27Å; L281-A285 WeakPolarHBondContact O-CB 3.46Å; L281-A285 PolarHBondContact O-N 2.85Å; L282-A285 PolarHBondContact O-N 3.32Å; S283-A285 PolarHBondContact O-N 3.34Å; A285-K288 PolarHBondContact O-N 3.21Å; A285-S289 WeakPolarHBondContact O-CB 3.22Å; A285-S289 PolarHBondContact O-N 3.21Å
286	L	57.8	Low	49	Very low	107 Å²	107	106.2 Å²	106.2	56%	0.56	53%	0.534	S	S	*	.	H	α-helix	trans	-64.2	-42.9	174.8	-83.9	163.2	0	0	0	111.5	L282 S283 S289 K290	L282-L286 VanDerWaalsContact O-CB 3.32Å; L282-L286 WeakPolarHBondContact O-CB 3.46Å; L282-L286 WeakPolarHBondContact O-CG 3.28Å; L282-L286 PolarHBondContact O-N 3.08Å; S283-L286 PolarHBondContact O-N 2.9Å; L286-S289 PolarHBondContact O-N 3.25Å; L286-S289 PolarHBondContact O-OG 3.44Å; L286-K290 PolarHBondContact O-N 2.97Å
287	E	66.9	Low	48.7	Very low	119 Å²	119	107.5 Å²	107.5	56%	0.556	54%	0.543	S	S	*	.	H	α-helix	trans	-67	-41.4	177.6	-168.4	160.8	-157	0	0	111.7	S283 S289 K290 H291	S283-E287 VanDerWaalsContact O-CB 3.29Å; S283-E287 WeakPolarHBondContact O-CB 3.37Å; S283-E287 PolarHBondContact O-N 3.5Å; E287-S289 VanDerWaalsContact C-N 3.34Å; E287-S289 PolarHBondContact O-N 3.39Å; E287-K290 WeakPolarHBondContact O-CB 3.37Å; E287-K290 PolarHBondContact O-N 3.5Å; E287-K290 VanDerWaalsContact O-N 3.16Å; E287-H291 PolarHBondContact O-N 2.96Å
288	K	51	Low	47.8	Very low	145 Å²	145	105.9 Å²	105.9	63%	0.63	55%	0.548	S	S	*	.	H	α-helix	trans	-59.7	-41.6	169.5	-81.3	-175.2	175.7	-176.2	0	112.2	L284 A285 K290 H291 L292	L284-K288 WeakPolarHBondContact O-CB 3.34Å; L284-K288 WeakPolarHBondContact O-CG 3.39Å; L284-K288 PolarHBondContact O-N 3.32Å; A285-K288 PolarHBondContact O-N 3.21Å; K288-K290 VanDerWaalsContact C-N 3.27Å; K288-K290 PolarHBondContact O-N 3.04Å; K288-H291 PolarHBondContact O-N 3.39Å; K288-L292 VanDerWaalsContact O-CB 3.3Å; K288-L292 WeakPolarHBondContact O-CB 3.16Å; K288-L292 PolarHBondContact O-N 3.42Å
289	S	46.5	Very low	47	Very low	41 Å²	41	102.7 Å²	102.7	29%	0.287	55%	0.548	S	S	.	.	H	α-helix	trans	-66.2	-30.5	177	84.2	0	0	0	0	112.6	A285 L286 E287 R293	A285-S289 WeakPolarHBondContact O-CB 3.22Å; A285-S289 PolarHBondContact O-N 3.21Å; L286-S289 PolarHBondContact O-N 3.25Å; L286-S289 PolarHBondContact O-OG 3.44Å; E287-S289 VanDerWaalsContact C-N 3.34Å; E287-S289 PolarHBondContact O-N 3.39Å; S289-R293 WeakPolarHBondContact O-CB 3.38Å; S289-R293 WeakPolarHBondContact O-CG 3.4Å; S289-R293 PolarHBondContact O-N 3.1Å; S289-R293 VanDerWaalsContact O-N 3.1Å; S289-R293 PolarHBondContact O-NE 3.01Å; S289-R293 PolarHBondContact OG-NH2 3.16Å
290	K	53.5	Low	45.7	Very low	121 Å²	121	100.9 Å²	100.9	53%	0.526	55%	0.551	S	S	.	*	H	α-helix	trans	-73.9	-47.1	176.6	-166.7	-173.4	176.6	-161.9	0	110.2	L286 E287 K288 L292 R293 E294	L286-K290 PolarHBondContact O-N 2.97Å; E287-K290 WeakPolarHBondContact O-CB 3.37Å; E287-K290 PolarHBondContact O-N 3.5Å; E287-K290 VanDerWaalsContact O-N 3.16Å; K288-K290 VanDerWaalsContact C-N 3.27Å; K288-K290 PolarHBondContact O-N 3.04Å; K290-L292 VanDerWaalsContact C-N 3.29Å; K290-L292 PolarHBondContact O-N 3.15Å; K290-R293 WeakPolarHBondContact O-CB 3.41Å; K290-R293 PolarHBondContact O-N 3.25Å; K290-R293 VanDerWaalsContact O-N 3.16Å; K290-E294 VanDerWaalsContact CE-OE1 3.29Å; K290-E294 WeakPolarHBondContact CE-OE1 3.47Å; K290-E294 IonicContact NZ-OE1 3.11Å; K290-E294 PolarHBondContact O-N 3.1Å
291	H	48.6	Very low	44.3	Very low	121 Å²	121	101.2 Å²	101.2	56%	0.56	56%	0.556	S	S	*	*	H	α-helix	trans	-61	-37	173.7	-97.8	-52.4	0	0	0	112.7	E287 K288 E294 A295	E287-H291 PolarHBondContact O-N 2.96Å; K288-H291 PolarHBondContact O-N 3.39Å; H291-E294 IonicContact ND1-OE2 3.53Å; H291-E294 PolarHBondContact O-N 3.3Å; H291-A295 VanDerWaalsContact O-CB 3.23Å; H291-A295 WeakPolarHBondContact O-CB 3.36Å; H291-A295 PolarHBondContact O-N 3.31Å
292	L	41.6	Very low	43	Very low	113 Å²	113	105.4 Å²	105.4	59%	0.592	57%	0.569	S	S	*	*	H	α-helix	trans	-69.1	-37	176.9	-158.6	136.2	0	0	0	111.3	K288 K290 L296	K288-L292 VanDerWaalsContact O-CB 3.3Å; K288-L292 WeakPolarHBondContact O-CB 3.16Å; K288-L292 PolarHBondContact O-N 3.42Å; K290-L292 VanDerWaalsContact C-N 3.29Å; K290-L292 PolarHBondContact O-N 3.15Å; L292-L296 HydrophobicContact CD2-CD1 3.68Å; L292-L296 HydrophobicContact CD2-CG 4.41Å; L292-L296 WeakPolarHBondContact O-CB 3.38Å; L292-L296 WeakPolarHBondContact O-CG 3.15Å; L292-L296 PolarHBondContact O-N 3.16Å
293	R	38.8	Very low	42	Very low	150 Å²	150	107.7 Å²	107.7	57%	0.566	58%	0.582	S	S	*	*	H	α-helix	trans	-65.7	-41.6	170.5	-84.7	-179.7	-75.5	-147.3	-1.2	112.9	S289 K290 S297	S289-R293 WeakPolarHBondContact O-CB 3.38Å; S289-R293 WeakPolarHBondContact O-CG 3.4Å; S289-R293 PolarHBondContact O-N 3.1Å; S289-R293 VanDerWaalsContact O-N 3.1Å; S289-R293 PolarHBondContact O-NE 3.01Å; S289-R293 PolarHBondContact OG-NH2 3.16Å; K290-R293 WeakPolarHBondContact O-CB 3.41Å; K290-R293 PolarHBondContact O-N 3.25Å; K290-R293 VanDerWaalsContact O-N 3.16Å; R293-S297 WeakPolarHBondContact O-CB 3.33Å; R293-S297 PolarHBondContact O-N 3.29Å; R293-S297 PolarHBondContact O-OG 3.47Å
294	E	40.7	Very low	40.7	Very low	91 Å²	91	113.1 Å²	113.1	43%	0.425	60%	0.599	S	S	.	*	H	α-helix	trans	-69.1	-40.9	177.9	-75.3	173.2	-175.1	0	0	111.5	K290 H291 L296 S297 C298	K290-E294 VanDerWaalsContact CE-OE1 3.29Å; K290-E294 WeakPolarHBondContact CE-OE1 3.47Å; K290-E294 IonicContact NZ-OE1 3.11Å; K290-E294 PolarHBondContact O-N 3.1Å; H291-E294 IonicContact ND1-OE2 3.53Å; H291-E294 PolarHBondContact O-N 3.3Å; E294-L296 PolarHBondContact O-N 3.45Å; E294-S297 CarbonylContact O-C 3.56Å; E294-S297 PolarHBondContact O-N 2.99Å; E294-S297 VanDerWaalsContact O-N 3.1Å; E294-C298 PolarHBondContact O-N 3.46Å
295	A	39.7	Very low	39	Very low	62 Å²	62	116.7 Å²	116.7	51%	0.512	61%	0.613	S	S	.	*	H	α-helix	trans	-63.1	-42.8	174.8	0	0	0	0	0	111.7	H291 S297 C298 S299	H291-A295 VanDerWaalsContact O-CB 3.23Å; H291-A295 WeakPolarHBondContact O-CB 3.36Å; H291-A295 PolarHBondContact O-N 3.31Å; A295-S297 VanDerWaalsContact C-N 3.26Å; A295-S297 PolarHBondContact O-N 2.95Å; A295-C298 PolarHBondContact O-N 2.95Å; A295-S299 WeakPolarHBondContact O-CB 3.24Å; A295-S299 PolarHBondContact O-N 3.07Å; A295-S299 VanDerWaalsContact O-N 3.11Å; A295-S299 PolarHBondContact O-OG 3.33Å
296	L	33.5	Very low	37.8	Very low	116 Å²	116	120.8 Å²	120.8	61%	0.607	63%	0.627	S	S	*	*	H	α-helix	trans	-66.9	-28	173.4	-71.1	172.3	0	0	0	112.6	L292 E294 S299	L292-L296 HydrophobicContact CD2-CD1 3.68Å; L292-L296 HydrophobicContact CD2-CG 4.41Å; L292-L296 WeakPolarHBondContact O-CB 3.38Å; L292-L296 WeakPolarHBondContact O-CG 3.15Å; L292-L296 PolarHBondContact O-N 3.16Å; E294-L296 PolarHBondContact O-N 3.45Å; L296-S299 PolarHBondContact O-OG 2.88Å
297	S	34.8	Very low	36.3	Very low	90 Å²	90	125.5 Å²	125.5	63%	0.629	64%	0.639	S	S	*	*	H	α-helix	trans	-78.8	-24.1	176.4	-58.7	0	0	0	0	112.8	R293 E294 A295	R293-S297 WeakPolarHBondContact O-CB 3.33Å; R293-S297 PolarHBondContact O-N 3.29Å; R293-S297 PolarHBondContact O-OG 3.47Å; E294-S297 CarbonylContact O-C 3.56Å; E294-S297 PolarHBondContact O-N 2.99Å; E294-S297 VanDerWaalsContact O-N 3.1Å; A295-S297 VanDerWaalsContact C-N 3.26Å; A295-S297 PolarHBondContact O-N 2.95Å
298	C	26.6	Very low	34.5	Very low	104 Å²	104	126.3 Å²	126.3	70%	0.703	65%	0.647	S	S	*	*	H	α-helix	trans	-97.3	-9.7	178.8	-69.2	0	0	0	0	114.2	E294 A295 S300	E294-C298 PolarHBondContact O-N 3.46Å; A295-C298 PolarHBondContact O-N 2.95Å; C298-S300 VanDerWaalsContact C-N 3.33Å; C298-S300 PolarHBondContact O-N 2.82Å
299	S	26.3	Very low	33.4	Very low	81 Å²	81	125.3 Å²	125.3	57%	0.566	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	13.4	-178.3	62.5	0	0	0	0	115.5	A295 L296	A295-S299 WeakPolarHBondContact O-CB 3.24Å; A295-S299 PolarHBondContact O-N 3.07Å; A295-S299 VanDerWaalsContact O-N 3.11Å; A295-S299 PolarHBondContact O-OG 3.33Å; L296-S299 PolarHBondContact O-OG 2.88Å
300	S	26.3	Very low	32.6	Very low	102 Å²	102	130.3 Å²	130.3	71%	0.713	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	13.1	178.2	78	0	0	0	0	115.1	C298	C298-S300 VanDerWaalsContact C-N 3.33Å; C298-S300 PolarHBondContact O-N 2.82Å
301	I	25.1	Very low	31.3	Very low	138 Å²	138	133.4 Å²	133.4	71%	0.708	69%	0.689	S	S	*	*			trans	-115.4	70	171	-49.8	177	0	0	0	108.6
302	F	25.7	Very low	30.4	Very low	197 Å²	197	133.2 Å²	133.2	86%	0.864	70%	0.701	S	S	*	*			trans	-123.7	92.9	155	-102.4	-86.6	0	0	0	106.2	H304	F302-H304 PolarHBondContact O-N 3.17Å
303	N	27.5	Very low	29.9	Very low	141 Å²	141	134.7 Å²	134.7	75%	0.754	71%	0.709	S	S	*	*			trans	-63.7	115.6	171	-79.8	-24.8	0	0	0	108	Q305	N303-Q305 PolarHBondContact O-N 2.67Å; N303-Q305 VanDerWaalsContact O-N 3.11Å
304	H	27.1	Very low	29.4	Very low	187 Å²	187	134.5 Å²	134.5	87%	0.866	72%	0.72	S	S	*	*			trans	-60.2	105.5	160.8	-115.8	-70.9	0	0	0	107.2	F302 D306	F302-H304 PolarHBondContact O-N 3.17Å; H304-D306 PolarHBondContact O-N 3.29Å
305	Q	27.8	Very low	28.9	Very low	166 Å²	166	139.2 Å²	139.2	78%	0.776	74%	0.739	S	S	*	*			trans	-70.5	124.2	171.4	-148.4	96.4	1.8	0	0	107.9	N303 Y307	N303-Q305 PolarHBondContact O-N 2.67Å; N303-Q305 VanDerWaalsContact O-N 3.11Å; Q305-Y307 PolarHBondContact O-N 3.23Å
306	D	28.9	Very low	28.5	Very low	145 Å²	145	143.4 Å²	143.4	78%	0.775	75%	0.753	S	S	*	*			trans	-54.8	115.9	-178.6	-65.7	-55.4	0	0	0	112.5	H304 N308	H304-D306 PolarHBondContact O-N 3.29Å; D306-N308 PolarHBondContact O-N 2.88Å
307	Y	26.2	Very low	28	Very low	205 Å²	205	145.2 Å²	145.2	80%	0.804	76%	0.763	S	S	*	*			trans	-77.2	100.3	153.9	-99.7	-92.6	0	0	0	107.2	Q305	Q305-Y307 PolarHBondContact O-N 3.23Å
308	N	29.1	Very low	27.8	Very low	137 Å²	137	149.1 Å²	149.1	73%	0.733	77%	0.773	S	S	*	*			trans	-120.3	82.3	160.4	-93.2	-32.7	0	0	0	107.8	D306 N310	D306-N308 PolarHBondContact O-N 2.88Å; N308-N310 PolarHBondContact O-N 3.33Å
309	D	27.8	Very low	27.6	Very low	124 Å²	124	151.5 Å²	151.5	66%	0.663	78%	0.779	S	S	*	*			trans	-64.8	113.7	157.1	-68	-40.1	0	0	0	107.9
310	N	28.4	Very low	27.7	Very low	146 Å²	146	151.2 Å²	151.2	78%	0.781	79%	0.789	S	S	*	*			trans	-141.9	72.3	153.6	-81.4	-45.9	0	0	0	106.7	N308 S312	N308-N310 PolarHBondContact O-N 3.33Å; N310-S312 PolarHBondContact O-N 2.99Å
311	E	27.3	Very low	27.6	Very low	185 Å²	185	155 Å²	155	86%	0.864	80%	0.8	S	S	*	*			trans	-62.8	102.7	149.7	-79.9	-179.3	151.5	0	0	107.1
312	S	29.9	Very low	27.7	Very low	117 Å²	117	160 Å²	160	82%	0.818	81%	0.81	S	S	*	*			trans	-102.1	99.8	160.5	61.5	0	0	0	0	107.6	N310	N310-S312 PolarHBondContact O-N 2.99Å
313	D	30.5	Very low	27.6	Very low	144 Å²	144	154.5 Å²	154.5	77%	0.77	80%	0.801	S	S	*	*			trans	-47.2	136.4	177.8	-85.7	-45.2	0	0	0	114.4
314	D	28.7	Very low	27.5	Very low	147 Å²	147	152.7 Å²	152.7	79%	0.786	80%	0.799	S	S	*	*			trans	-44.5	133	148.9	-77.9	-44.7	0	0	0	111.4
315	K	30.4	Very low	27.2	Very low	190 Å²	190	155.1 Å²	155.1	83%	0.826	80%	0.801	S	S	*	*			trans	-177.1	102.6	133.9	-97.7	150.2	-167	169.1	0	112.9
316	N	29.8	Very low	27	Very low	150 Å²	150	152 Å²	152	80%	0.802	80%	0.797	S	S	*	*				20	119.3	127.5	-63.7	-29.9	0	0	0	118.8
317	N	24.7	Very low	26.7	Very low	154 Å²	154	155.2 Å²	155.2	82%	0.824	80%	0.8	S	S	*	*			trans	6.9	117.7	130.1	-75.9	-16	0	0	0	116.5
318	M	29	Very low	26.6	Very low	171 Å²	171	151.4 Å²	151.4	84%	0.842	80%	0.798	S	S	*	*				174.3	146	104	-93.9	-63.8	-113.9	0	0	111.5
319	D	23.8	Very low	26.4	Very low	154 Å²	154	149.7 Å²	149.7	82%	0.824	80%	0.797	S	S	*	*			trans	-47.9	151.6	178.8	-65.2	-58.2	0	0	0	116.7
320	G	28.6	Very low	26.3	Very low	75 Å²	75	152 Å²	152	77%	0.773	81%	0.809	S	S	*	*			trans	166.2	78.7	165	0	0	0	0	0	115.4
321	L	24.4	Very low	26.2	Very low	181 Å²	181	148.5 Å²	148.5	95%	0.948	81%	0.808	S	S	*	*			trans	-41	138.8	160.5	-67.4	153.8	0	0	0	112.2
322	R	25.3	Very low	26.1	Very low	245 Å²	245	151.1 Å²	151.1	93%	0.925	81%	0.81	S	S	*	*				166.4	130.6	115.1	-162.6	168.5	-165.8	179.2	2.5	112.3
323	A	23.6	Very low	25.9	Very low	81 Å²	81	155.1 Å²	155.1	67%	0.669	81%	0.813	S	S	*	*			trans	-44.6	148.9	175.3	0	0	0	0	0	117
324	S	25.3	Very low	25.6	Very low	102 Å²	102	153.9 Å²	153.9	71%	0.713	82%	0.815	S	S	*	*				156.1	136.5	109.6	-69.9	0	0	0	0	112.1
325	R	22.7	Very low	25.3	Very low	239 Å²	239	150.7 Å²	150.7	90%	0.902	82%	0.817	S	S	*	*			trans	51.9	139.9	136.5	-67.5	175.9	175.2	-178	-2	117.5
326	S	23.4	Very low	25	Very low	99 Å²	99	145 Å²	145	69%	0.692	81%	0.813	S	S	*	*			cis	177.6	147.2	21.4	31	0	0	0	0	106.8
327	Y	22.2	Very low	24.6	Very low	214 Å²	214	146.2 Å²	146.2	84%	0.839	82%	0.818	S	S	*	*			trans	5.3	130.9	147.3	-60.8	-89.4	0	0	0	118.8
328	T	24.6	Very low	24.6	Very low	125 Å²	125	145.7 Å²	145.7	77%	0.767	82%	0.82	S	S	*	*				163.7	152.6	95.9	39.2	0	0	0	0	112.2
329	S	24.5	Very low	24.4	Very low	101 Å²	101	142.9 Å²	142.9	71%	0.706	82%	0.815	S	S	*	*			trans	83.5	101.9	148.5	72.6	0	0	0	0	119.5
330	D	25.7	Very low	24.4	Very low	171 Å²	171	143.1 Å²	143.1	91%	0.914	82%	0.817	S	S	*	*				41.8	98.5	110.5	-66	-19.3	0	0	0	117.4
331	G	26.7	Very low	24.2	Very low	73 Å²	73	148.8 Å²	148.8	75%	0.753	82%	0.82	S	S	*	*			trans	-138.6	95.3	165.5	0	0	0	0	0	109.9	F333	G331-F333 PolarHBondContact O-N 2.8Å
332	R	25.1	Very low	24.2	Very low	241 Å²	241	147.6 Å²	147.6	91%	0.909	81%	0.813	S	S	*	*			trans	-54	125.5	169.3	-60.9	174.6	-175.7	-177.1	0.5	109.8
333	F	25.5	Very low	24	Very low	201 Å²	201	145 Å²	145	88%	0.882	81%	0.812	S	S	*	*			trans	-141.4	108.5	150.8	-90.2	-74.8	0	0	0	110.5	G331	G331-F333 PolarHBondContact O-N 2.8Å
334	S	23.6	Very low	24	Very low	118 Å²	118	149.7 Å²	149.7	83%	0.825	82%	0.819	S	S	*	*			trans	-56.9	139.8	154.5	47.5	0	0	0	0	111.5
335	G	23.2	Very low	23.7	Very low	80 Å²	80	150 Å²	150	83%	0.825	82%	0.822	S	S	*	*			trans	137.1	89.3	175.8	0	0	0	0	0	107.9
336	G	23.2	Very low	23.7	Very low	71 Å²	71	143.9 Å²	143.9	73%	0.732	82%	0.815	S	S	*	*				106.4	73.6	52.2	0	0	0	0	0	107
337	L	22.5	Very low	23.8	Very low	174 Å²	174	145.4 Å²	145.4	91%	0.911	82%	0.823	S	S	*	*			trans	-155.7	90.5	167.4	-74.5	-178.8	0	0	0	107.8
338	T	23.3	Very low	23.9	Very low	143 Å²	143	142.4 Å²	142.4	88%	0.877	82%	0.821	S	S	*	*			trans	-84.5	138.8	162.4	43.8	0	0	0	0	109.7
339	P	25.9	Very low	23.8	Very low	113 Å²	113	144.9 Å²	144.9	73%	0.734	83%	0.829	S	S	*	*			trans	-95.1	154.5	-157	2.2	20.8	0	0	0	111.8	K341	P339-K341 PolarHBondContact O-N 3.02Å; P339-K341 VanDerWaalsContact O-N 3.08Å
340	N	22.9	Very low	23.6	Very low	159 Å²	159	151 Å²	151	85%	0.85	84%	0.836	S	S	*	*			trans	-33.9	104.9	169.6	-66.3	-29.6	0	0	0	113.5	L342	N340-L342 PolarHBondContact O-N 3Å
341	K	24.8	Very low	23.4	Very low	194 Å²	194	147.6 Å²	147.6	84%	0.843	83%	0.826	S	S	*	*			trans	-81	100.4	162.8	-89.3	-179.1	174.3	178.9	0	108.8	P339	P339-K341 PolarHBondContact O-N 3.02Å; P339-K341 VanDerWaalsContact O-N 3.08Å
342	L	23.6	Very low	23.1	Very low	155 Å²	155	151.2 Å²	151.2	81%	0.812	83%	0.827	S	S	*	*			trans	-68.3	122.5	164.3	-85.7	149.7	0	0	0	109.1	N340 H344	N340-L342 PolarHBondContact O-N 3Å; L342-H344 PolarHBondContact O-N 2.75Å
343	H	22.6	Very low	22.9	Very low	192 Å²	192	147.1 Å²	147.1	89%	0.889	82%	0.82	S	S	*	*			trans	-74.3	108.1	-177.1	-79.6	-98.9	0	0	0	111
344	H	21.8	Very low	22.8	Very low	178 Å²	178	146.6 Å²	146.6	82%	0.824	82%	0.818	S	S	*	*			trans	-91.3	132.2	159.9	-77.8	-77.9	0	0	0	109.9	L342 S346	L342-H344 PolarHBondContact O-N 2.75Å; H344-S346 PolarHBondContact O-N 3.12Å
345	S	20	Very low	22.7	Very low	110 Å²	110	149.6 Å²	149.6	77%	0.769	82%	0.819	S	S	*	*	S	Bend	trans	-62.5	112.4	178.9	47.9	0	0	0	0	113.1
346	S	23.1	Very low	22.6	Very low	110 Å²	110	154.5 Å²	154.5	77%	0.769	82%	0.82	S	S	*	*			trans	-174.6	134.4	143.8	-76.5	0	0	0	0	108	H344 D348	H344-S346 PolarHBondContact O-N 3.12Å; S346-D348 PolarHBondContact O-N 3.23Å
347	P	24.7	Very low	22.5	Very low	130 Å²	130	157 Å²	157	84%	0.844	83%	0.825	S	S	*	*			trans	-87.2	103.2	-168	33.3	-29.7	0	0	0	110.9
348	D	24.2	Very low	22.4	Very low	151 Å²	151	155.1 Å²	155.1	81%	0.807	81%	0.814	S	S	*	*			trans	-90.1	121.8	166.8	-98.9	-20.1	0	0	0	110.6	S346 R350	S346-D348 PolarHBondContact O-N 3.23Å; D348-R350 VanDerWaalsContact C-N 3.33Å; D348-R350 PolarHBondContact O-N 2.84Å
349	L	22	Very low	22.4	Very low	178 Å²	178	156.8 Å²	156.8	93%	0.932	81%	0.812	S	S	*	*			trans	-60	87.5	170.8	-70.9	163.1	0	0	0	110.3
350	R	21.3	Very low	22.2	Very low	228 Å²	228	157.6 Å²	157.6	86%	0.86	81%	0.81	S	S	*	*			trans	-131.3	90.9	165.2	-75.7	-168.4	-179.8	-171.4	1.4	110.2	D348	D348-R350 VanDerWaalsContact C-N 3.33Å; D348-R350 PolarHBondContact O-N 2.84Å
351	S	21.7	Very low	22.3	Very low	101 Å²	101	158.2 Å²	158.2	71%	0.706	81%	0.807	S	S	*	*			trans	-171.2	85.6	140.4	-169.1	0	0	0	0	109.1
352	I	21.2	Very low	22.2	Very low	148 Å²	148	155.6 Å²	155.6	76%	0.759	80%	0.803	S	S	*	*			trans	-123	93.1	142.2	-59.4	-178.7	0	0	0	104.6	F354	I352-F354 HydrophobicContact CG2-CD2 3.74Å; I352-F354 HydrophobicContact CG2-CE2 3.46Å; I352-F354 VanDerWaalsContact CG2-CE2 3.46Å; I352-F354 HydrophobicContact CG2-CZ 4.39Å; I352-F354 PolarHBondContact O-N 2.78Å
353	M	19.9	Very low	22.3	Very low	156 Å²	156	155.4 Å²	155.4	77%	0.768	80%	0.802	S	S	*	*			trans	-58.2	122.2	166.5	-65.8	-105.5	72.6	0	0	108
354	F	23.7	Very low	22.2	Very low	190 Å²	190	157.1 Å²	157.1	83%	0.833	80%	0.801	S	S	*	*			trans	-121.8	119.7	152.5	-84.3	-71.9	0	0	0	107.6	I352	I352-F354 HydrophobicContact CG2-CD2 3.74Å; I352-F354 HydrophobicContact CG2-CE2 3.46Å; I352-F354 VanDerWaalsContact CG2-CE2 3.46Å; I352-F354 HydrophobicContact CG2-CZ 4.39Å; I352-F354 PolarHBondContact O-N 2.78Å
355	E	21.4	Very low	22.2	Very low	181 Å²	181	156.4 Å²	156.4	85%	0.846	80%	0.801	S	S	*	*			trans	-54.1	147.2	-178.8	-73.2	171	129.8	0	0	112.6	C357	E355-C357 PolarHBondContact O-N 2.79Å
356	E	20.8	Very low	22.2	Very low	183 Å²	183	158.8 Å²	158.8	86%	0.855	80%	0.8	S	S	*	*			trans	-57.3	99.5	168.4	-67.8	173.5	140.4	0	0	111.1	I358	E356-I358 PolarHBondContact O-N 3.35Å
357	C	20.8	Very low	22.1	Very low	122 Å²	122	161.9 Å²	161.9	82%	0.824	81%	0.807	S	S	*	*			trans	-90.1	93.2	158.5	-79.7	0	0	0	0	109	E355 H359	E355-C357 PolarHBondContact O-N 2.79Å; C357-H359 PolarHBondContact O-N 2.78Å
358	I	21.1	Very low	21.9	Very low	135 Å²	135	159.8 Å²	159.8	69%	0.692	80%	0.801	S	S	*	*			trans	-55.8	114	164.5	-62.8	166.6	0	0	0	108.6	E356	E356-I358 PolarHBondContact O-N 3.35Å
359	H	23.5	Very low	21.8	Very low	178 Å²	178	158.4 Å²	158.4	82%	0.824	80%	0.803	S	S	*	*			trans	-135.2	96.9	154.5	-97	-51.9	0	0	0	110.4	C357 H361	C357-H359 PolarHBondContact O-N 2.78Å; H359-H361 PolarHBondContact O-N 2.94Å
360	N	21.7	Very low	21.7	Very low	130 Å²	130	158.5 Å²	158.5	70%	0.695	80%	0.799	S	S	*	*			trans	-47.6	126.4	151.8	-79.1	-31	0	0	0	109.8
361	H	24.3	Very low	21.8	Very low	173 Å²	173	154.4 Å²	154.4	80%	0.801	80%	0.799	S	S	*	*			trans	-148.4	95.3	139.8	-103	-59.7	0	0	0	109.6	H359 N363	H359-H361 PolarHBondContact O-N 2.94Å; H361-N363 PolarHBondContact O-N 3.03Å
362	D	23.1	Very low	21.7	Very low	139 Å²	139	158.9 Å²	158.9	74%	0.743	81%	0.806	S	S	*	*			trans	-44.5	130.3	143.5	-81.5	-50.4	0	0	0	109.6
363	N	25.1	Very low	21.7	Very low	151 Å²	151	158 Å²	158	81%	0.807	81%	0.808	S	S	*	*			trans	-159.2	97.2	140.2	-96.6	-25	0	0	0	110.8	H361	H361-N363 PolarHBondContact O-N 3.03Å
364	R	20	Very low	22	Very low	228 Å²	228	160.9 Å²	160.9	86%	0.86	82%	0.816	S	S	*	*			trans	-45.9	130.1	151.8	-67.8	170.2	175	166.4	-1.4	110.2
365	I	22.9	Very low	22	Very low	162 Å²	162	156.4 Å²	156.4	83%	0.831	81%	0.808	S	S	*	*			trans	-140.1	111.1	140.3	-61.4	-174	0	0	0	108.6
366	H	20.1	Very low	22.1	Very low	160 Å²	160	154.6 Å²	154.6	74%	0.741	80%	0.804	S	S	*	*			trans	-51.5	143.4	161.4	-92.5	-117.7	0	0	0	111.3
367	L	20.8	Very low	22.3	Very low	175 Å²	175	154.1 Å²	154.1	92%	0.916	81%	0.808	S	S	*	*				-156.1	114.6	127.3	-126.7	88.9	0	0	0	110.1
368	A	19.4	Very low	22.5	Very low	87 Å²	87	158.1 Å²	158.1	72%	0.719	81%	0.812	S	S	*	*			trans	-80.4	140.3	170.1	0	0	0	0	0	109.9
369	S	22.9	Very low	22.8	Very low	122 Å²	122	159.1 Å²	159.1	85%	0.853	82%	0.818	S	S	*	*			trans	-144.7	100.2	153.1	63.6	0	0	0	0	109.7
370	Q	19.5	Very low	22.8	Very low	180 Å²	180	158.3 Å²	158.3	84%	0.841	82%	0.819	S	S	*	*			trans	-69.6	152	162.7	-67.5	172.6	-7.3	0	0	110.4
371	T	23.1	Very low	23	Very low	141 Å²	141	156 Å²	156	87%	0.865	81%	0.806	S	S	*	*			trans	162.9	98.8	137.6	37.7	0	0	0	0	108.5
372	K	21.2	Very low	23.2	Very low	195 Å²	195	156.5 Å²	156.5	85%	0.848	81%	0.806	S	S	*	*				57.6	104.8	84	-86.7	-171.7	177.7	179.1	0	116.8
373	T	21.4	Very low	23.4	Very low	130 Å²	130	158.9 Å²	158.9	80%	0.798	81%	0.805	S	S	*	*				55.3	130.3	127.6	59.1	0	0	0	0	121.7
374	K	25.1	Very low	23.5	Very low	217 Å²	217	159.4 Å²	159.4	94%	0.943	81%	0.807	S	S	*	*			trans	-151.8	152.9	141.1	-105.6	177.4	-174.9	-178.1	0	111.6
375	S	23.4	Very low	23.7	Very low	95 Å²	95	155.4 Å²	155.4	66%	0.664	80%	0.802	S	S	*	*			trans	-124.4	170.7	-151.5	51.5	0	0	0	0	113.7
376	N	23.3	Very low	23.9	Very low	143 Å²	143	153.5 Å²	153.5	77%	0.765	79%	0.793	S	S	*	*			trans	81.2	118	153.7	-64.6	-5.6	0	0	0	120.2
377	N	26	Very low	24	Very low	174 Å²	174	153.1 Å²	153.1	93%	0.93	80%	0.797	S	S	*	*			trans	-158.8	52.7	149.2	-93.4	-18.2	0	0	0	110.4
378	F	25.5	Very low	24.3	Very low	206 Å²	206	153.3 Å²	153.3	90%	0.904	79%	0.793	S	S	*	*			trans	-116.4	84.6	165.1	-104.5	-84.2	0	0	0	106.5
379	D	25.7	Very low	24.6	Very low	155 Å²	155	153.7 Å²	153.7	83%	0.829	79%	0.79	S	S	*	*			trans	-179	38.9	161.8	-89.6	-24.8	0	0	0	110.4
380	L	24.6	Very low	24.7	Very low	162 Å²	162	156.3 Å²	156.3	85%	0.848	79%	0.794	S	S	*	*	S	Bend	trans	-111.1	56.8	155.6	-152.6	77.3	0	0	0	108.7
381	I	26.6	Very low	25	Very low	81 Å²	81	154.1 Å²	154.1	42%	0.415	79%	0.788	S	S	.	*			trans	50.8	113	132.1	-35.4	151.8	0	0	0	111.5	Y383	I381-Y383 HydrophobicContact CB-CD2 4.42Å; I381-Y383 HydrophobicContact CB-CG 4.44Å; I381-Y383 HydrophobicContact CD1-CD2 4.22Å; I381-Y383 VanDerWaalsContact CG2-CA 3.49Å; I381-Y383 HydrophobicContact CG2-CD2 3.68Å; I381-Y383 HydrophobicContact CG2-CG 4.02Å; I381-Y383 PolarHBondContact O-N 3.08Å
382	K	27.4	Very low	25.1	Very low	184 Å²	184	154.6 Å²	154.6	80%	0.8	79%	0.785	S	S	*	*	S	Bend		44.5	8.6	56.2	-153	-178.8	172.5	-177.5	0	112.4
383	Y	28.6	Very low	26	Very low	188 Å²	188	150 Å²	150	74%	0.737	78%	0.775	S	S	*	*			trans	-107.5	-16.8	-178.4	-152.8	-103.3	0	0	0	109.8	I381 L385	I381-Y383 HydrophobicContact CB-CD2 4.42Å; I381-Y383 HydrophobicContact CB-CG 4.44Å; I381-Y383 HydrophobicContact CD1-CD2 4.22Å; I381-Y383 VanDerWaalsContact CG2-CA 3.49Å; I381-Y383 HydrophobicContact CG2-CD2 3.68Å; I381-Y383 HydrophobicContact CG2-CG 4.02Å; I381-Y383 PolarHBondContact O-N 3.08Å; Y383-L385 VanDerWaalsContact C-N 3.26Å
384	I	25.5	Very low	26.2	Very low	163 Å²	163	150.9 Å²	150.9	84%	0.836	78%	0.78	S	S	*	*	S	Bend	trans	-88.8	-3.8	178.2	-54.8	178.2	0	0	0	109.6
385	L	25.9	Very low	26.1	Very low	144 Å²	144	148.5 Å²	148.5	75%	0.754	77%	0.772	S	S	*	*	S	Bend	trans	-108.5	8.7	-175.1	-85.6	172.7	0	0	0	115.6	Y383	Y383-L385 VanDerWaalsContact C-N 3.26Å
386	D	26.2	Very low	26.1	Very low	121 Å²	121	149.8 Å²	149.8	65%	0.647	78%	0.776	S	S	*	*	S	Bend	trans	-141.1	129.4	172.9	-70.8	-49.4	0	0	0	109.2
387	N	23	Very low	26.2	Very low	153 Å²	153	149.2 Å²	149.2	82%	0.818	77%	0.773	S	S	*	*			trans	96.8	120	-176.6	-53.2	-28.2	0	0	0	112.9
388	E	27.3	Very low	26.1	Very low	179 Å²	179	146.5 Å²	146.5	84%	0.836	76%	0.762	S	S	*	*			cis	-156	132	29.1	-112.8	154.9	-153.9	0	0	110.4
389	S	24.1	Very low	26	Very low	94 Å²	94	144.3 Å²	144.3	66%	0.657	76%	0.755	S	S	*	*			trans	-52.7	131	159.3	46.7	0	0	0	0	112.4
390	L	26.5	Very low	26	Very low	178 Å²	178	142.7 Å²	142.7	93%	0.932	75%	0.746	S	S	*	*			trans	-132.6	108.8	152.8	-141.8	84.9	0	0	0	108.6
391	D	25.2	Very low	26.2	Very low	133 Å²	133	142.6 Å²	142.6	71%	0.711	74%	0.741	S	S	*	*			trans	-75.1	154.3	-176.8	-73.2	-52.5	0	0	0	113.5
392	D	24.8	Very low	26.2	Very low	151 Å²	151	144.8 Å²	144.8	81%	0.807	75%	0.754	S	S	*	*			trans	94.1	151	133.2	-88	-1.7	0	0	0	122.7
393	P	40	Very low	26.3	Very low	100 Å²	100	142.5 Å²	142.5	65%	0.649	75%	0.75	S	S	*	*				-118.9	165.3	-129.7	41.8	-31.2	0	0	0	113.4
394	V	26	Very low	26.2	Very low	148 Å²	148	140.8 Å²	140.8	90%	0.897	75%	0.749	S	S	*	*			trans	-130.5	95.7	159.2	-178.1	0	0	0	0	108.8
395	Q	22.4	Very low	26.4	Very low	166 Å²	166	141.2 Å²	141.2	78%	0.776	75%	0.747	S	S	*	*			trans	-71.5	154.7	150.4	-69.9	179.7	-6	0	0	108.6
396	V	24.8	Very low	26.5	Very low	122 Å²	122	144.4 Å²	144.4	74%	0.739	75%	0.749	S	S	*	*				165.3	127.6	128.4	158.5	0	0	0	0	111.5
397	N	25	Very low	26.4	Very low	132 Å²	132	145.2 Å²	145.2	71%	0.706	75%	0.749	S	S	*	*			trans	74.5	107.7	155.7	-62.7	-9.8	0	0	0	120.6
398	T	22.7	Very low	26.7	Very low	116 Å²	116	146 Å²	146	71%	0.712	75%	0.747	S	S	*	*				58.9	113.8	70.4	63.8	0	0	0	0	114.3
399	Q	24.3	Very low	26.6	Very low	161 Å²	161	145 Å²	145	75%	0.752	74%	0.742	S	S	*	*				161.5	133	111.5	-93.6	-178.4	-14.5	0	0	112.6
400	N	24.5	Very low	26.7	Very low	120 Å²	120	146.5 Å²	146.5	64%	0.642	75%	0.747	S	S	*	*			trans	66.2	142.4	141.5	-48.4	-17.9	0	0	0	118.2
401	H	29.1	Very low	26.5	Very low	160.5 Å²	160.5	142.5 Å²	142.5	74%	0.743	73%	0.734	S	S	*	*				-76.2	145.7	84.1	-87.3	-75.6	0	0	0	115.5
402	D	26.9	Very low	26.5	Very low	127 Å²	127	145.7 Å²	145.7	68%	0.679	74%	0.737	S	S	*	*				-110.7	152.2	86	-99.5	-32.7	0	0	0	113.8
403	N	28.7	Very low	26.5	Very low	135.5 Å²	135.5	147 Å²	147	73%	0.725	74%	0.736	S	S	*	*			trans	140.3	119.1	143.8	-88.4	-33.4	0	0	0	119.3
404	H	27.3	Very low	25.8	Very low	153 Å²	153	151.6 Å²	151.6	71%	0.708	75%	0.746	S	S	*	*			trans	13.9	122	150.1	-76.3	-68.2	0	0	0	118.5
405	H	30.2	Very low	25.7	Very low	171.5 Å²	171.5	148.2 Å²	148.2	79%	0.794	74%	0.741	S	S	*	*			trans	162.4	115.2	137	-81.1	-52.3	0	0	0	118.2
406	R	27.1	Very low	25.8	Very low	211.5 Å²	211.5	146.1 Å²	146.1	80%	0.798	74%	0.739	S	S	*	*			trans	9.8	124.1	154.1	-78.5	-179.4	170.6	-174.4	-0.7	118.3
407	Q	25.3	Very low	25.8	Very low	137 Å²	137	148 Å²	148	64%	0.64	74%	0.74	S	S	*	*				66.1	114.7	117	-67.8	-179.7	-52.2	0	0	119.9
408	H	28.4	Very low	25.7	Very low	170.5 Å²	170.5	147.9 Å²	147.9	79%	0.789	74%	0.738	S	S	*	*			trans	143.5	108.9	134.4	-75.6	-69.2	0	0	0	116.4
409	H	24.3	Very low	25.7	Very low	158 Å²	158	149.5 Å²	149.5	73%	0.731	74%	0.738	S	S	*	*			trans	-1.5	122.8	142.7	-77.8	-71.9	0	0	0	116.2
410	V	26.6	Very low	25.7	Very low	124 Å²	124	147.7 Å²	147.7	75%	0.752	73%	0.733	S	S	*	*			trans	152.4	102.7	131.7	178.8	0	0	0	0	114.3	Y412	V410-Y412 HydrophobicContact CG1-CD2 4.13Å
411	S	23.8	Very low	25.8	Very low	94 Å²	94	149.2 Å²	149.2	66%	0.657	74%	0.739	S	S	*	*			trans	-175.3	137	146.4	62.8	0	0	0	0	116.9
412	Y	24.7	Very low	25.5	Very low	200.5 Å²	200.5	149 Å²	149	79%	0.786	74%	0.741	S	S	*	*			trans	162.2	111.6	146.9	-92.2	-66.6	0	0	0	118.3	V410	V410-Y412 HydrophobicContact CG1-CD2 4.13Å
413	K	25.2	Very low	25.4	Very low	178.5 Å²	178.5	152.3 Å²	152.3	78%	0.776	75%	0.75	S	S	*	*			trans	57.5	113.5	136.9	-84.7	171.6	177.5	176.5	0	122.8
414	K	23.8	Very low	25.3	Very low	196.5 Å²	196.5	150 Å²	150	85%	0.854	75%	0.749	S	S	*	*				17.4	129.9	127.2	-76.1	-175.5	172	-178.3	0	119.3
415	G	25.4	Very low	25.1	Very low	77 Å²	77	150.3 Å²	150.3	79%	0.794	76%	0.756	S	S	*	*			trans	-176.7	148.8	139.2	0	0	0	0	0	114.2
416	V	24.2	Very low	24.9	Very low	122.5 Å²	122.5	145.7 Å²	145.7	74%	0.742	76%	0.755	S	S	*	*				-145.7	149.6	-99	136.2	0	0	0	0	109.9
417	H	23.6	Very low	24.8	Very low	162.5 Å²	162.5	142 Å²	142	75%	0.752	75%	0.751	S	S	*	*			trans	66.3	139.5	160.5	-90.9	-70.9	0	0	0	121
418	L	22.8	Very low	24.9	Very low	129.5 Å²	129.5	142.5 Å²	142.5	68%	0.678	76%	0.758	S	S	*	*				132.6	163.6	56.1	-107.4	154.1	0	0	0	114.4
419	Q	24.2	Very low	24.7	Very low	149.5 Å²	149.5	139.2 Å²	139.2	70%	0.699	75%	0.754	S	S	*	*				150.1	149.2	64.8	-140	170.3	21.8	0	0	112.7
420	N	24.1	Very low	24.7	Very low	123 Å²	123	138.5 Å²	138.5	66%	0.658	76%	0.756	S	S	*	*				126.9	139.4	70.4	-108.7	-4.5	0	0	0	115.6
421	I	25.4	Very low	24.8	Very low	150.5 Å²	150.5	139.7 Å²	139.7	77%	0.772	76%	0.757	S	S	*	*			trans	145.5	122.8	150	-69.9	169	0	0	0	113.6
422	M	22.6	Very low	25	Very low	158 Å²	158	143.1 Å²	143.1	78%	0.778	76%	0.762	S	S	*	*			cis	129.3	133.3	34.4	-120.6	173.1	176.8	0	0	112.9
423	F	24.9	Very low	25.1	Very low	195 Å²	195	137.4 Å²	137.4	86%	0.855	76%	0.757	S	S	*	*			trans	4.3	143.4	159.4	-65.9	-82	0	0	0	114.5
424	A	26.7	Very low	25.2	Very low	87.5 Å²	87.5	134.5 Å²	134.5	72%	0.723	75%	0.75	S	S	*	*				-141.8	133.6	-116.1	0	0	0	0	0	111	G426	A424-G426 PolarHBondContact O-N 2.76Å
425	N	23.2	Very low	25.4	Very low	160 Å²	160	133.6 Å²	133.6	86%	0.856	75%	0.746	S	S	*	*			trans	-3	130.4	159	-74.2	-6.2	0	0	0	118.3
426	G	27.2	Very low	25.5	Very low	74 Å²	74	132.9 Å²	132.9	76%	0.763	74%	0.739	S	S	*	*			trans	175.2	127	148.1	0	0	0	0	0	113.1	A424	A424-G426 PolarHBondContact O-N 2.76Å
427	N	25	Very low	25.7	Very low	133.5 Å²	133.5	135 Å²	135	71%	0.714	74%	0.744	S	S	*	*				-121.3	158.6	-113.2	-108.2	24	0	0	0	110
428	D	26.3	Very low	25.9	Very low	147.5 Å²	147.5	130.6 Å²	130.6	79%	0.789	74%	0.743	S	S	*	*			trans	75.9	147.8	160.8	-53.7	-37.4	0	0	0	117.2
429	S	25.4	Very low	26.2	Very low	101 Å²	101	131.2 Å²	131.2	71%	0.706	75%	0.751	S	S	*	*			cis	-167.5	154.2	-2.8	53	0	0	0	0	108.9
430	N	24.1	Very low	26.2	Very low	144 Å²	144	129.5 Å²	129.5	77%	0.77	75%	0.752	S	S	*	*			trans	-15.2	143.3	159.3	-61.8	-48.8	0	0	0	116.7
431	L	28.5	Very low	26.4	Very low	149.5 Å²	149.5	131.4 Å²	131.4	78%	0.783	76%	0.756	S	S	*	*				174.2	132.8	121.2	-92.9	151.7	0	0	0	112.1
432	H	28.3	Very low	26.4	Very low	164.5 Å²	164.5	130.6 Å²	130.6	76%	0.762	75%	0.754	S	S	*	*			trans	67.3	116.3	135.4	-76.1	-71.3	0	0	0	115.8
433	A	26	Very low	26.5	Very low	82 Å²	82	132.6 Å²	132.6	68%	0.678	75%	0.754	S	S	*	*				92.4	145.8	63	0	0	0	0	0	112.2
434	D	27.9	Very low	27.2	Very low	118 Å²	118	128.3 Å²	128.3	63%	0.631	75%	0.746	S	S	*	*				142.9	130.7	90.9	-121.5	-1.2	0	0	0	117.5
435	K	28.2	Very low	27.2	Very low	176 Å²	176	132.1 Å²	132.1	77%	0.765	75%	0.753	S	S	*	*			trans	59.3	134.8	140.7	-69.2	154.9	-168.1	152	0	120.4
436	G	27	Very low	27.4	Very low	62.5 Å²	62.5	129.1 Å²	129.1	64%	0.644	74%	0.744	S	S	*	*				165.5	150.7	51	0	0	0	0	0	114.1
437	I	28.9	Very low	27.5	Very low	167.5 Å²	167.5	132.1 Å²	132.1	86%	0.859	74%	0.743	S	S	*	*				74.6	115.6	122.6	-51.9	159.3	0	0	0	112.5
438	G	26.7	Very low	27.7	Very low	69.5 Å²	69.5	131.7 Å²	131.7	72%	0.716	74%	0.741	S	S	*	*			cis	143.5	147.2	10.2	0	0	0	0	0	109.8
439	V	29.6	Very low	27.7	Very low	141.5 Å²	141.5	131.5 Å²	131.5	86%	0.858	74%	0.74	S	S	*	*				-148.7	138.1	78	-176.1	0	0	0	0	108.7
440	T	24.4	Very low	27.7	Very low	114.5 Å²	114.5	135 Å²	135	70%	0.702	75%	0.747	S	S	*	*			trans	-92.9	151.5	175.1	40.4	0	0	0	0	114
441	Q	27.7	Very low	27.6	Very low	163 Å²	163	133.7 Å²	133.7	76%	0.762	74%	0.744	S	S	*	*			trans	120.7	120.2	145.2	-84.2	167.9	-27.6	0	0	114.7
442	D	25.8	Very low	27.5	Very low	133.5 Å²	133.5	133.2 Å²	133.2	71%	0.714	75%	0.747	S	S	*	*				134.1	151.8	93.6	-90.6	-18.4	0	0	0	113.1
443	Y	23.9	Very low	27.3	Very low	200 Å²	200	133.5 Å²	133.5	78%	0.784	75%	0.749	S	S	*	*				-137.8	-167.4	-79.3	-92.6	-70.9	0	0	0	110.5
444	P	40	Very low	27.3	Very low	105 Å²	105	139.8 Å²	139.8	68%	0.682	76%	0.761	S	S	*	*				-133.4	177.9	-69.2	43.2	-24.4	0	0	0	117.7
445	L	28	Very low	27.2	Very low	167 Å²	167	137.4 Å²	137.4	87%	0.874	76%	0.764	S	S	*	*			trans	154.2	119.6	146.4	-88.2	163.8	0	0	0	118.3
446	S	26.1	Very low	26.9	Very low	96.5 Å²	96.5	136.9 Å²	136.9	68%	0.675	77%	0.77	S	S	*	*			trans	-10.8	152.9	165.6	67.4	0	0	0	0	115.6
447	N	29.2	Very low	26.8	Very low	137.5 Å²	137.5	139 Å²	139	74%	0.735	78%	0.775	S	S	*	*				-169	148.9	60.2	-119.6	-4.4	0	0	0	113.9
448	N	29.5	Very low	26.7	Very low	126 Å²	126	139 Å²	139	67%	0.674	77%	0.771	S	S	*	*			trans	82.7	94.3	147.5	-64.2	-5.8	0	0	0	121.9
449	N	26.1	Very low	26.7	Very low	142.5 Å²	142.5	146.5 Å²	146.5	76%	0.762	78%	0.78	S	S	*	*				66.7	116.8	113.6	-71.7	-0.6	0	0	0	122
450	M	25.6	Very low	26.4	Very low	174.5 Å²	174.5	145.4 Å²	145.4	86%	0.86	77%	0.767	S	S	*	*			trans	147	115.7	131.4	-79.9	-83.1	-129.1	0	0	115.6
451	V	22.6	Very low	26.6	Very low	116.5 Å²	116.5	149.3 Å²	149.3	71%	0.706	78%	0.775	S	S	*	*			trans	-16.9	115.8	160.9	178.8	0	0	0	0	113.9
452	V	26.1	Very low	26.6	Very low	140 Å²	140	149.6 Å²	149.6	85%	0.848	78%	0.776	S	S	*	*			trans	-137.7	116.8	150.4	179.3	0	0	0	0	108.1
453	Q	24.2	Very low	26.8	Very low	170.5 Å²	170.5	149.2 Å²	149.2	80%	0.797	77%	0.774	S	S	*	*			trans	-81.3	149.9	167.4	-75.4	173.8	-59.2	0	0	109.9	G455	Q453-G455 PolarHBondContact O-N 2.85Å
454	F	25.5	Very low	27.1	Very low	214.5 Å²	214.5	146.8 Å²	146.8	94%	0.941	78%	0.775	S	S	*	*			trans	-103.8	135.7	152.5	-87.2	-84.2	0	0	0	110.4
455	G	25.5	Very low	26.7	Very low	67 Å²	67	149.3 Å²	149.3	69%	0.691	78%	0.777	S	S	*	*			trans	-112.4	139.1	-172.8	0	0	0	0	0	113.7	Q453	Q453-G455 PolarHBondContact O-N 2.85Å
456	N	23.5	Very low	26.9	Very low	164.5 Å²	164.5	147 Å²	147	88%	0.88	77%	0.765	S	S	*	*			trans	-49.1	107.7	164.8	-66.8	-10.2	0	0	0	115.2
457	S	24.6	Very low	27.1	Very low	107 Å²	107	148 Å²	148	75%	0.748	76%	0.762	S	S	*	*			trans	-158.5	124.3	147.9	62.3	0	0	0	0	108.3	Y459	S457-Y459 PolarHBondContact O-N 3.04Å
458	E	25.5	Very low	27.2	Very low	168 Å²	168	148.7 Å²	148.7	79%	0.785	76%	0.761	S	S	*	*				-97	135.6	84.2	-66.7	168.4	122.5	0	0	109.5	I460	E458-I460 HydrophobicContact CB-CG1 4.5Å
459	Y	26.5	Very low	27.3	Very low	227.5 Å²	227.5	148.4 Å²	148.4	89%	0.892	76%	0.759	S	S	*	*			trans	-128.4	91	149.1	-110.7	-85.2	0	0	0	106.5	S457	S457-Y459 PolarHBondContact O-N 3.04Å
460	I	25.3	Very low	27.5	Very low	117.5 Å²	117.5	148.6 Å²	148.6	60%	0.603	76%	0.759	S	S	*	*			trans	131.7	114.4	157	-58.1	173.5	0	0	0	111.9	E458 E462	E458-I460 HydrophobicContact CB-CG1 4.5Å; I460-E462 HydrophobicContact CG2-CB 4.16Å; I460-E462 HydrophobicContact CG2-CG 3.69Å; I460-E462 PolarHBondContact O-N 3.23Å; I460-E462 VanDerWaalsContact O-N 3.11Å
461	K	27	Very low	27.6	Very low	197 Å²	197	146.3 Å²	146.3	86%	0.857	75%	0.75	S	S	*	*			trans	-120.4	129.7	145.4	-81.4	164.8	-178.7	177	0	110.2
462	E	28.1	Very low	27.9	Very low	169 Å²	169	149.6 Å²	149.6	79%	0.79	75%	0.751	S	S	*	*			trans	146.6	88.8	169.1	-76.5	169.9	-159.5	0	0	110.1	I460	I460-E462 HydrophobicContact CG2-CB 4.16Å; I460-E462 HydrophobicContact CG2-CG 3.69Å; I460-E462 PolarHBondContact O-N 3.23Å; I460-E462 VanDerWaalsContact O-N 3.11Å
463	D	30.3	Very low	27.9	Very low	126 Å²	126	148.2 Å²	148.2	67%	0.674	75%	0.748	S	S	*	*			trans	-175.8	-1.4	144.2	-93.3	-16.2	0	0	0	114.1	E465 L466	D463-E465 VanDerWaalsContact C-N 3.29Å; D463-E465 PolarHBondContact O-N 3.19Å; D463-L466 PolarHBondContact O-N 2.78Å; D463-L466 VanDerWaalsContact OD1-CD1 3.24Å; D463-L466 WeakPolarHBondContact OD1-CD1 3.28Å
464	D	30.4	Very low	28	Very low	149.5 Å²	149.5	146.9 Å²	146.9	80%	0.799	75%	0.746	S	S	*	*	H	α-helix	trans	-72.6	-4.1	176.1	-71	-39.2	0	0	0	114.4	I467 E468	D464-I467 PolarHBondContact O-N 3.33Å; D464-E468 PolarHBondContact O-N 2.8Å
465	E	31.9	Very low	28	Very low	156.5 Å²	156.5	144.9 Å²	144.9	73%	0.731	74%	0.74	S	S	*	*	H	α-helix	trans	-91.7	-12.8	-178.8	-151.9	171.6	-152.5	0	0	113.5	D463 I467 N469	D463-E465 VanDerWaalsContact C-N 3.29Å; D463-E465 PolarHBondContact O-N 3.19Å; E465-I467 VanDerWaalsContact C-N 3.33Å; E465-N469 WeakPolarHBondContact O-CB 3.48Å; E465-N469 PolarHBondContact O-N 2.83Å; E465-N469 VanDerWaalsContact O-N 3.08Å; E465-N469 PolarHBondContact O-ND2 2.89Å; E465-N469 VanDerWaalsContact O-ND2 3.09Å
466	L	31.4	Very low	28.1	Very low	120 Å²	120	148.8 Å²	148.8	63%	0.628	75%	0.745	S	S	*	*	H	α-helix	trans	-89.5	-16.3	-179.5	-94.8	163.7	0	0	0	114.3	D463 L470	D463-L466 PolarHBondContact O-N 2.78Å; D463-L466 VanDerWaalsContact OD1-CD1 3.24Å; D463-L466 WeakPolarHBondContact OD1-CD1 3.28Å; L466-L470 WeakPolarHBondContact O-CD1 3.5Å; L466-L470 PolarHBondContact O-N 2.8Å
467	I	30.7	Very low	28.1	Very low	116.5 Å²	116.5	145.6 Å²	145.6	60%	0.597	74%	0.735	S	S	*	*	H	α-helix	trans	-95.4	-35.8	-178.7	-63	178.4	0	0	0	112.2	D464 E465 N469 L470 L471	D464-I467 PolarHBondContact O-N 3.33Å; E465-I467 VanDerWaalsContact C-N 3.33Å; I467-N469 VanDerWaalsContact C-N 3.34Å; I467-N469 PolarHBondContact O-N 3.07Å; I467-L470 PolarHBondContact O-N 2.86Å; I467-L471 HydrophobicContact CG2-CD1 4.29Å; I467-L471 PolarHBondContact O-N 2.89Å
468	E	31.9	Very low	28.2	Very low	152 Å²	152	147.8 Å²	147.8	71%	0.71	74%	0.737	S	S	*	*	H	α-helix	trans	-69.1	-35.2	174.4	-76.7	-161.8	141.4	0	0	112.7	D464 L470 L471 Y472	D464-E468 PolarHBondContact O-N 2.8Å; E468-L470 VanDerWaalsContact C-N 3.27Å; E468-L470 PolarHBondContact O-N 3.11Å; E468-L471 PolarHBondContact O-N 2.68Å; E468-Y472 PolarHBondContact O-N 2.8Å
469	N	31.3	Very low	28.3	Very low	119.5 Å²	119.5	147 Å²	147	64%	0.639	74%	0.738	S	S	*	*	H	α-helix	trans	-69	-10.2	179.1	-77.4	-45.2	0	0	0	114.6	E465 I467	E465-N469 WeakPolarHBondContact O-CB 3.48Å; E465-N469 PolarHBondContact O-N 2.83Å; E465-N469 VanDerWaalsContact O-N 3.08Å; E465-N469 PolarHBondContact O-ND2 2.89Å; E465-N469 VanDerWaalsContact O-ND2 3.09Å; I467-N469 VanDerWaalsContact C-N 3.34Å; I467-N469 PolarHBondContact O-N 3.07Å
470	L	30.3	Very low	28.3	Very low	147 Å²	147	143.9 Å²	143.9	77%	0.77	73%	0.732	S	S	*	*	H	α-helix	trans	-100	-12.9	179.9	-92	165.4	0	0	0	114.6	L466 I467 E468	L466-L470 WeakPolarHBondContact O-CD1 3.5Å; L466-L470 PolarHBondContact O-N 2.8Å; I467-L470 PolarHBondContact O-N 2.86Å; E468-L470 VanDerWaalsContact C-N 3.27Å; E468-L470 PolarHBondContact O-N 3.11Å
471	L	27.9	Very low	28.3	Very low	127 Å²	127	145.2 Å²	145.2	67%	0.665	74%	0.74	S	S	*	*	H	α-helix	trans	-113.5	-26.9	-173.4	-71.2	167.2	0	0	0	114.8	I467 E468	I467-L471 HydrophobicContact CG2-CD1 4.29Å; I467-L471 PolarHBondContact O-N 2.89Å; E468-L471 PolarHBondContact O-N 2.68Å
472	Y	28.8	Very low	28.2	Very low	185 Å²	185	144.9 Å²	144.9	73%	0.725	74%	0.742	S	S	*	*			trans	-135.9	93.4	-179.5	-64	-74.3	0	0	0	112.7	E468 N474	E468-Y472 PolarHBondContact O-N 2.8Å; Y472-N474 PolarHBondContact O-N 3.02Å
473	S	24.8	Very low	28.1	Very low	111.5 Å²	111.5	144.4 Å²	144.4	78%	0.78	74%	0.743	S	S	*	*			trans	-110.1	92.3	166.6	-7.9	0	0	0	0	109.5	E475	S473-E475 PolarHBondContact O-N 3.39Å
474	N	26.9	Very low	27.7	Very low	143 Å²	143	145.7 Å²	145.7	77%	0.765	75%	0.749	S	S	*	*			trans	-85	117.9	176.4	-87.4	0.5	0	0	0	111.1	Y472 N476	Y472-N474 PolarHBondContact O-N 3.02Å; N474-N476 PolarHBondContact O-N 3.48Å
475	E	25.8	Very low	27.5	Very low	172 Å²	172	145.6 Å²	145.6	80%	0.804	75%	0.749	S	S	*	*			trans	7.7	135.6	155.8	-58.4	-170.8	151.9	0	0	116.6	S473 S477	S473-E475 PolarHBondContact O-N 3.39Å; E475-S477 PolarHBondContact O-N 2.89Å
476	N	26.7	Very low	27.3	Very low	149 Å²	149	143.2 Å²	143.2	80%	0.797	75%	0.749	S	S	*	*			trans	13.2	119	166.9	-64.5	-46.8	0	0	0	113.7	N474 I478	N474-N476 PolarHBondContact O-N 3.48Å; N476-I478 PolarHBondContact O-N 3.39Å
477	S	24.5	Very low	26.9	Very low	96.5 Å²	96.5	144.4 Å²	144.4	68%	0.675	76%	0.757	S	S	*	*				-115.1	148.7	75.5	49.8	0	0	0	0	109	E475 D479	E475-S477 PolarHBondContact O-N 2.89Å; S477-D479 PolarHBondContact O-N 3.33Å
478	I	26.8	Very low	26.5	Very low	153.5 Å²	153.5	144.2 Å²	144.2	79%	0.787	76%	0.761	S	S	*	*			trans	12	120	174.5	-59	162.9	0	0	0	110.5	N476 E480	N476-I478 PolarHBondContact O-N 3.39Å; I478-E480 PolarHBondContact O-N 3.38Å; I478-E480 VanDerWaalsContact O-N 3.14Å
479	D	26.9	Very low	26.1	Very low	152 Å²	152	144.5 Å²	144.5	81%	0.813	77%	0.767	S	S	*	*				-104.4	141.8	90	-117.1	-28.2	0	0	0	111.4	S477 N481	S477-D479 PolarHBondContact O-N 3.33Å; D479-N481 PolarHBondContact O-N 3.03Å; D479-N481 VanDerWaalsContact O-N 3.12Å
480	E	26.4	Very low	25.7	Very low	161.5 Å²	161.5	146.7 Å²	146.7	76%	0.755	77%	0.771	S	S	*	*			trans	-72.9	137.5	170.9	-65.8	-171.6	153.8	0	0	112.3	I478	I478-E480 PolarHBondContact O-N 3.38Å; I478-E480 VanDerWaalsContact O-N 3.14Å
481	N	25.9	Very low	25.5	Very low	145.5 Å²	145.5	148.2 Å²	148.2	78%	0.778	77%	0.771	S	S	*	*			trans	123.1	108.8	156.5	-67.9	-54.2	0	0	0	113.2	D479	D479-N481 PolarHBondContact O-N 3.03Å; D479-N481 VanDerWaalsContact O-N 3.12Å
482	E	25.1	Very low	25.3	Very low	191 Å²	191	151.1 Å²	151.1	89%	0.893	78%	0.781	S	S	*	*				-167.6	130.7	96.3	-90.8	-172.5	153.8	0	0	112.5
483	L	25	Very low	25	Very low	157.5 Å²	157.5	147.1 Å²	147.1	83%	0.825	78%	0.78	S	S	*	*			trans	-128.8	119.5	161.5	-90.9	115.2	0	0	0	110.3
484	L	23	Very low	25	Very low	153 Å²	153	148.7 Å²	148.7	80%	0.801	78%	0.78	S	S	*	*			trans	5	121.6	150.9	-75.2	138.1	0	0	0	112.5
485	N	26.6	Very low	24.9	Very low	148 Å²	148	148.4 Å²	148.4	79%	0.791	78%	0.778	S	S	*	*			trans	131.9	119.8	145.1	-72.1	-43.5	0	0	0	113.1
486	S	26.5	Very low	24.8	Very low	105.5 Å²	105.5	146 Å²	146	74%	0.738	78%	0.775	S	S	*	*			cis	-173.5	117.1	30.3	39.6	0	0	0	0	108.4
487	N	22.3	Very low	24.7	Very low	146 Å²	146	147.3 Å²	147.3	78%	0.781	78%	0.776	S	S	*	*			trans	-11.2	136.7	160.7	-77.4	-28.3	0	0	0	117.5
488	T	23.4	Very low	25	Very low	112.5 Å²	112.5	147.5 Å²	147.5	69%	0.69	78%	0.776	S	S	*	*			trans	68.1	121.1	137.8	59.2	0	0	0	0	119.3	F490	T488-F490 HydrophobicContact CG2-CD2 4.18Å
489	L	23.3	Very low	24.8	Very low	158.5 Å²	158.5	148.3 Å²	148.3	83%	0.83	78%	0.78	S	S	*	*				-144.6	141	113.8	-133.6	69.8	0	0	0	110.9
490	F	23.8	Very low	24.7	Very low	165.5 Å²	165.5	149.4 Å²	149.4	73%	0.726	78%	0.778	S	S	*	*			trans	144.5	132.5	172.8	-102.3	-70.6	0	0	0	115.4	T488	T488-F490 HydrophobicContact CG2-CD2 4.18Å
491	K	25.1	Very low	24.6	Very low	179 Å²	179	149.3 Å²	149.3	78%	0.778	78%	0.777	S	S	*	*			trans	81.9	125.6	146.6	-68.8	175	-174.6	176.1	0	116.1	S493	K491-S493 PolarHBondContact O-N 3.14Å
492	Q	23.3	Very low	24.5	Very low	188 Å²	188	149.2 Å²	149.2	88%	0.879	78%	0.777	S	S	*	*				-67.8	133	73.2	-67	168.7	-13.4	0	0	112.9
493	S	23.5	Very low	24.6	Very low	99.5 Å²	99.5	146.1 Å²	146.1	70%	0.696	77%	0.771	S	S	*	*				156.6	125	72.5	69.2	0	0	0	0	113.3	K491	K491-S493 PolarHBondContact O-N 3.14Å
494	N	24.2	Very low	24.6	Very low	145.5 Å²	145.5	146.2 Å²	146.2	78%	0.778	77%	0.772	S	S	*	*			trans	-126.3	150.3	177.1	-78.1	-38.2	0	0	0	111.2
495	N	24.8	Very low	24.8	Very low	137.5 Å²	137.5	146.2 Å²	146.2	74%	0.735	77%	0.772	S	S	*	*				148.6	114.4	67.8	-88.2	-19.1	0	0	0	116.1
496	V	24	Very low	24.7	Very low	121 Å²	121	142.8 Å²	142.8	73%	0.733	77%	0.773	S	S	*	*				48.1	103.9	126.3	-176.8	0	0	0	0	118
497	Q	24.2	Very low	24.7	Very low	175.5 Å²	175.5	146.8 Å²	146.8	82%	0.82	78%	0.777	S	S	*	*				128	153.9	68.8	-85	-167.6	-6.8	0	0	114.3
498	P	31.1	Very low	24.9	Very low	102.5 Å²	102.5	147.7 Å²	147.7	67%	0.666	78%	0.78	S	S	*	*				-120.3	151	-108.7	39.1	-27.1	0	0	0	113.5	K500	P498-K500 PolarHBondContact O-N 2.83Å
499	L	23.3	Very low	24.9	Very low	169 Å²	169	148.4 Å²	148.4	89%	0.885	78%	0.784	S	S	*	*			trans	-125.3	105.2	144.2	-132.3	78.6	0	0	0	111.9
500	K	24.1	Very low	25	Very low	175 Å²	175	148 Å²	148	76%	0.761	78%	0.782	S	S	*	*			trans	-22	113.6	152.4	-73.5	-173.3	171	-169.9	0	115	P498	P498-K500 PolarHBondContact O-N 2.83Å
501	Q	23.6	Very low	25	Very low	159 Å²	159	148.7 Å²	148.7	74%	0.743	79%	0.788	S	S	*	*				130.7	112.5	113.9	-88.3	177.1	-55.3	0	0	111.3
502	D	24.4	Very low	25	Very low	145 Å²	145	148 Å²	148	78%	0.775	79%	0.787	S	S	*	*				-141.5	126.9	83.5	-89	-39.9	0	0	0	110.8
503	T	26.7	Very low	25.2	Very low	124.5 Å²	124.5	150 Å²	150	76%	0.764	79%	0.788	S	S	*	*			trans	-34.1	115.1	158	24	0	0	0	0	116.7	N505	T503-N505 PolarHBondContact O-N 2.78Å
504	L	24.7	Very low	25.3	Very low	161 Å²	161	153 Å²	153	84%	0.843	80%	0.796	S	S	*	*			trans	1.5	103.6	153.6	-78.5	131.8	0	0	0	115.8	G506	L504-G506 PolarHBondContact O-N 2.9Å
505	N	27.2	Very low	25.3	Very low	151.5 Å²	151.5	150.9 Å²	150.9	81%	0.81	79%	0.792	S	S	*	*			trans	-118.6	123.5	141	-90.8	-34	0	0	0	111.8	T503 K507	T503-N505 PolarHBondContact O-N 2.78Å; N505-K507 PolarHBondContact O-N 3.02Å
506	G	25.5	Very low	25.6	Very low	78 Å²	78	154 Å²	154	80%	0.804	80%	0.8	S	S	*	*			trans	-69.8	111.5	178.6	0	0	0	0	0	112.8	L504 I508	L504-G506 PolarHBondContact O-N 2.9Å; G506-I508 PolarHBondContact O-N 2.84Å
507	K	25.9	Very low	26	Very low	189.5 Å²	189.5	152.9 Å²	152.9	82%	0.824	80%	0.797	S	S	*	*			trans	-73.6	124	169.5	-77.7	-179.4	174.5	178.9	0	110.4	N505 V509	N505-K507 PolarHBondContact O-N 3.02Å; K507-V509 PolarHBondContact O-N 2.64Å; K507-V509 VanDerWaalsContact O-N 3.15Å
508	I	26.1	Very low	26.7	Very low	163.5 Å²	163.5	147.2 Å²	147.2	84%	0.838	79%	0.786	S	S	*	*			trans	-72.4	119.5	163.1	-64.3	170	0	0	0	108.3	G506 N510	G506-I508 PolarHBondContact O-N 2.84Å; I508-N510 PolarHBondContact O-N 3.27Å
509	V	24.5	Very low	27.5	Very low	128.5 Å²	128.5	145.9 Å²	145.9	78%	0.779	78%	0.778	S	S	*	*			trans	-80.1	101	-179.3	177.4	0	0	0	0	109.7	K507	K507-V509 PolarHBondContact O-N 2.64Å; K507-V509 VanDerWaalsContact O-N 3.15Å
510	N	25.5	Very low	29.4	Very low	148.5 Å²	148.5	143.3 Å²	143.3	79%	0.794	77%	0.765	S	S	*	*	S	Bend	trans	-122	88	162.4	-90.7	-24.5	0	0	0	111.2	I508 H512	I508-N510 PolarHBondContact O-N 3.27Å; N510-H512 PolarHBondContact O-N 3.48Å; N510-H512 VanDerWaalsContact O-N 3.13Å
511	Q	24.1	Very low	31.7	Very low	181.5 Å²	181.5	135.5 Å²	135.5	85%	0.848	73%	0.732	S	S	*	*			trans	-104.8	77.9	169.7	-103.2	173.7	15.2	0	0	112.6	Y513	Q511-Y513 PolarHBondContact O-N 2.79Å
512	H	24.8	Very low	34.4	Very low	163.5 Å²	163.5	131.7 Å²	131.7	76%	0.757	71%	0.713	S	S	*	*			trans	-97.6	84.2	-179.2	-81.6	-59.7	0	0	0	113	N510 L514	N510-H512 PolarHBondContact O-N 3.48Å; N510-H512 VanDerWaalsContact O-N 3.13Å; H512-L514 PolarHBondContact O-N 2.6Å
513	Y	25.9	Very low	37.2	Very low	229.5 Å²	229.5	124.9 Å²	124.9	90%	0.9	68%	0.676	S	S	*	*			trans	-100.2	86	157.3	-84.5	-78.8	0	0	0	110.8	Q511 S515	Q511-Y513 PolarHBondContact O-N 2.79Å; Y513-S515 PolarHBondContact O-N 3.1Å
514	L	25.7	Very low	40	Very low	163.5 Å²	163.5	119 Å²	119	86%	0.856	64%	0.64	S	S	*	*			trans	-104.6	79.4	175	-103.1	133.9	0	0	0	111.4	H512 K516	H512-L514 PolarHBondContact O-N 2.6Å; L514-K516 PolarHBondContact O-N 3.42Å
515	S	25	Very low	42.8	Very low	101 Å²	101	112.2 Å²	112.2	71%	0.706	61%	0.605	S	S	*	*			trans	-113.7	76.2	175.3	54.3	0	0	0	0	112	Y513	Y513-S515 PolarHBondContact O-N 3.1Å
516	K	30.3	Very low	45.5	Very low	203.5 Å²	203.5	105.4 Å²	105.4	89%	0.885	57%	0.568	S	S	*	*	S	Bend	trans	-119.8	45.3	157.7	-88.3	-175.3	175.8	178.1	0	111.2	L514 G518	L514-K516 PolarHBondContact O-N 3.42Å; K516-G518 PolarHBondContact O-N 3.44Å; K516-G518 VanDerWaalsContact O-N 3.12Å
517	S	34	Very low	48.1	Very low	98 Å²	98	103.3 Å²	103.3	69%	0.685	54%	0.538	S	S	*	.	S	Bend	trans	127.8	88.1	166.4	58.2	0	0	0	0	111.9	C519	S517-C519 PolarHBondContact O-N 2.9Å
518	G	37.9	Very low	50.7	Low	56 Å²	56	95.5 Å²	95.5	58%	0.577	50%	0.504	S	S	*	.			trans	-91.9	86	-175.1	0	0	0	0	0	113.4	K516 N520	K516-G518 PolarHBondContact O-N 3.44Å; K516-G518 VanDerWaalsContact O-N 3.12Å; G518-N520 PolarHBondContact O-N 3.42Å
519	C	47.4	Very low	53.3	Low	73.5 Å²	73.5	92 Å²	92	50%	0.497	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	106.9	-179.9	-57.3	0	0	0	0	110.2	S517 W772	S517-C519 PolarHBondContact O-N 2.9Å; C519-W772 HydrophobicContact CB-CB 4.45Å; C519-W772 HydrophobicContact CB-CD2 4.43Å; C519-W772 HydrophobicContact CB-CE3 3.99Å; C519-W772 VanDerWaalsContact O-CE3 3.27Å; C519-W772 WeakPolarHBondContact O-CZ3 2.87Å
520	N	63.6	Low	56	Low	115 Å²	115	86.4 Å²	86.4	62%	0.615	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	129.9	174.5	-76.4	-10.5	0	0	0	110.4	G518 K522 N773	G518-N520 PolarHBondContact O-N 3.42Å; N520-K522 PolarHBondContact O-N 3.04Å; N520-K522 VanDerWaalsContact O-N 3.16Å; N520-N773 HydrophobicContact CB-CB 4.43Å; N520-N773 WeakPolarHBondContact O-CB 3.41Å; N520-N773 PolarHBondContact O-N 3.16Å; N520-N773 PolarHBondContact O-ND2 2.88Å
521	L	73	Confident	58.6	Low	12.5 Å²	12.5	79.3 Å²	79.3	7%	0.065	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	112.7	176.6	-173.3	69.4	0	0	0	110.3	F672 R725 I728 L729 P770 W772	L521-F672 HydrophobicContact CD2-CD2 4.01Å; L521-F672 HydrophobicContact CD2-CE2 3.77Å; L521-F672 HydrophobicContact CG-CD2 4.05Å; L521-F672 HydrophobicContact CG-CE2 4.09Å; L521-R725 HydrophobicContact CD2-CG 4.16Å; L521-R725 PolarHBondContact O-NH1 3.29Å; L521-I728 HydrophobicContact CD1-CG2 3.94Å; L521-I728 HydrophobicContact CD2-CB 4.17Å; L521-I728 HydrophobicContact CD2-CD1 4.46Å; L521-I728 HydrophobicContact CD2-CG2 3.7Å; L521-I728 HydrophobicContact CG-CG2 4.41Å; L521-L729 HydrophobicContact CB-CD2 4.38Å; L521-L729 HydrophobicContact CD2-CD2 4.3Å; L521-L729 HydrophobicContact CD2-CG 4.24Å; L521-P770 HydrophobicContact CD1-CB 3.81Å; L521-W772 HydrophobicContact CB-CE3 3.98Å; L521-W772 HydrophobicContact CB-CH2 4.24Å; L521-W772 HydrophobicContact CB-CZ3 3.74Å; L521-W772 HydrophobicContact CD1-CD2 3.97Å; L521-W772 HydrophobicContact CD1-CE3 4.08Å; L521-W772 HydrophobicContact CD1-CH2 4.04Å; L521-W772 HydrophobicContact CD1-CZ2 3.89Å; L521-W772 HydrophobicContact CD1-CZ3 4.13Å; L521-W772 HydrophobicContact CG-CZ3 4.45Å
522	K	79.1	Confident	61.3	Low	78.5 Å²	78.5	71.8 Å²	71.8	34%	0.341	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	-38.7	-177.5	-170.3	-171.7	-173.8	177.3	0	112	N520 N671 F672 I771 N773	N520-K522 PolarHBondContact O-N 3.04Å; N520-K522 VanDerWaalsContact O-N 3.16Å; K522-N671 PolarHBondContact O-OD1 3.37Å; K522-N671 VanDerWaalsContact O-OD1 3.09Å; K522-F672 WeakPolarHBondContact O-CA 3.06Å; K522-F672 PolarHBondContact O-N 2.82Å; K522-I771 WeakPolarHBondContact CA-O 3.41Å; K522-I771 HydrophobicContact CB-CG2 4.33Å; K522-I771 VanDerWaalsContact CB-O 3.27Å; K522-I771 WeakPolarHBondContact CB-O 3.38Å; K522-I771 HydrophobicContact CD-CG2 4.21Å; K522-I771 PolarHBondContact N-O 3.4Å; K522-N773 WeakPolarHBondContact CB-ND2 3.32Å; K522-N773 WeakPolarHBondContact CB-OD1 3.37Å; K522-N773 VanDerWaalsContact CD-OD1 3.23Å; K522-N773 WeakPolarHBondContact CD-OD1 3.4Å; K522-N773 WeakPolarHBondContact CG-OD1 3.24Å
523	G	84.5	Confident	63.7	Low	1.5 Å²	1.5	64.3 Å²	64.3	2%	0.015	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.3	-168.4	-171.1	0	0	0	0	0	112.6	V670 F672 I771	G523-V670 CarbonylContact C-O 3.51Å; G523-V670 WeakPolarHBondContact CA-O 3.41Å; G523-F672 VanDerWaalsContact CA-CD2 3.43Å; G523-F672 WeakPolarHBondContact O-CE2 3.15Å; G523-I771 PolarHBondContact N-O 3.25Å; G523-I771 VanDerWaalsContact N-O 3.13Å; G523-I771 PolarHBondContact O-N 3.36Å
524	A	84.7	Confident	65.8	Low	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	142.1	174	0	0	0	0	0	110.8	V670 F672 I724 I728 E769	A524-V670 PolarHBondContact N-O 3.08Å; A524-V670 PolarHBondContact O-N 2.84Å; A524-F672 HydrophobicContact CB-CE2 4.11Å; A524-F672 HydrophobicContact CB-CZ 3.92Å; A524-I724 HydrophobicContact CB-CG2 4.07Å; A524-I728 HydrophobicContact CB-CD1 3.48Å; A524-I728 VanDerWaalsContact CB-CD1 3.46Å; A524-E769 CarbonylContact C-O 3.53Å; A524-E769 VanDerWaalsContact CA-O 3.26Å; A524-E769 WeakPolarHBondContact CA-O 3.38Å
525	N	84.1	Confident	67.7	Low	19 Å²	19	51.2 Å²	51.2	10%	0.102	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	129.8	162	-64.1	-31.6	0	0	0	108.3	Y667 I668 L768 E769 I771	N525-Y667 HydrophobicContact CB-CD2 3.85Å; N525-Y667 HydrophobicContact CB-CG 4.27Å; N525-Y667 WeakPolarHBondContact OD1-CD2 3.49Å; N525-Y667 WeakPolarHBondContact OD1-CE2 3.34Å; N525-I668 CarbonylContact C-O 3.53Å; N525-I668 WeakPolarHBondContact CA-O 3.44Å; N525-L768 WeakPolarHBondContact O-CA 3.43Å; N525-E769 HydrophobicContact CB-CB 4.21Å; N525-E769 PolarHBondContact N-O 3.02Å; N525-E769 PolarHBondContact ND2-OE2 2.98Å; N525-E769 PolarHBondContact O-N 2.92Å; N525-I771 WeakPolarHBondContact OD1-CD1 3.41Å
526	L	83.8	Confident	69.5	Low	9 Å²	9	51.5 Å²	51.5	5%	0.047	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	107.3	171.8	-61.9	95.6	0	0	0	109.1	Y667 I668 V670 I724 L743 L766 L768	L526-Y667 CarbonylContact O-C 3.59Å; L526-Y667 VanDerWaalsContact O-CA 3.28Å; L526-Y667 WeakPolarHBondContact O-CA 3.43Å; L526-I668 HydrophobicContact CB-CB 4.37Å; L526-I668 WeakPolarHBondContact CD1-O 3.26Å; L526-I668 PolarHBondContact N-O 3.2Å; L526-I668 PolarHBondContact O-N 3.15Å; L526-V670 HydrophobicContact CD1-CB 3.84Å; L526-V670 HydrophobicContact CD1-CG2 3.29Å; L526-I724 HydrophobicContact CD1-CD1 4.47Å; L526-I724 HydrophobicContact CD2-CD1 4.05Å; L526-L743 HydrophobicContact CD2-CD2 4.2Å; L526-L766 HydrophobicContact CB-CD1 4.35Å; L526-L766 HydrophobicContact CD2-CD1 3.7Å; L526-L768 HydrophobicContact CB-CD2 4.34Å; L526-L768 HydrophobicContact CD2-CD2 3.53Å; L526-L768 VanDerWaalsContact CD2-CD2 3.47Å; L526-L768 HydrophobicContact CG-CD2 3.53Å
527	H	80.8	Confident	71.1	Confident	34.5 Å²	34.5	44.4 Å²	44.4	16%	0.16	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	126.4	175.5	-64.6	-93.9	0	0	0	109.6	K529 L766 E767 E769	H527-K529 PolarHBondContact O-N 3.36Å; H527-L766 CarbonylContact O-C 3.09Å; H527-L766 VanDerWaalsContact O-CA 3.28Å; H527-L766 WeakPolarHBondContact O-CA 3.46Å; H527-L766 WeakPolarHBondContact O-CB 3.35Å; H527-E767 HydrophobicContact CB-CB 4.26Å; H527-E767 PolarHBondContact N-O 3.14Å; H527-E767 PolarHBondContact O-N 3.13Å; H527-E769 IonicContact CD2-OE2 3.13Å; H527-E769 IonicContact CE1-OE2 3.38Å; H527-E769 IonicContact NE2-OE2 3.11Å; H527-E769 PolarHBondContact NE2-OE2 2.82Å
528	F	79.5	Confident	72.5	Confident	25.5 Å²	25.5	40.2 Å²	40.2	11%	0.112	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	124	176.8	176.1	-83.7	0	0	0	110.9	C530 L531 L599 L626 C654 L764 L766	F528-C530 VanDerWaalsContact CZ-C 3.47Å; F528-L531 HydrophobicContact CE2-CB 4.35Å; F528-L531 HydrophobicContact CZ-CB 4.03Å; F528-L599 HydrophobicContact CD2-CD2 3.79Å; F528-L599 HydrophobicContact CE2-CD2 3.7Å; F528-L626 HydrophobicContact CD1-CD2 4.35Å; F528-L626 HydrophobicContact CE1-CD2 3.62Å; F528-L626 HydrophobicContact CE2-CD1 4.1Å; F528-L626 HydrophobicContact CE2-CD2 3.95Å; F528-L626 HydrophobicContact CZ-CD1 3.86Å; F528-L626 HydrophobicContact CZ-CD2 3.39Å; F528-L626 VanDerWaalsContact CZ-CD2 3.43Å; F528-L626 HydrophobicContact CZ-CG 4.28Å; F528-C654 HydrophobicContact CD1-CB 3.97Å; F528-C654 HydrophobicContact CE1-CB 4.22Å; F528-L764 HydrophobicContact CD2-CD1 3.65Å; F528-L764 HydrophobicContact CE2-CD1 3.3Å; F528-L764 HydrophobicContact CZ-CD1 4.38Å; F528-L766 HydrophobicContact CB-CD2 4.27Å; F528-L766 HydrophobicContact CD2-CD2 4.14Å
529	K	80.1	Confident	73.6	Confident	89.5 Å²	89.5	41.5 Å²	41.5	39%	0.389	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-67.6	172	-73.6	-86.7	-176.1	-167.8	0	111.8	H527 E765 E767	H527-K529 PolarHBondContact O-N 3.36Å; K529-E765 HydrophobicContact CB-CB 4.18Å; K529-E765 HydrophobicContact CB-CG 3.91Å; K529-E765 WeakPolarHBondContact CB-O 3.31Å; K529-E765 HydrophobicContact CG-CG 4.25Å; K529-E765 PolarHBondContact N-O 3.26Å; K529-E767 WeakPolarHBondContact CE-OE2 3.38Å; K529-E767 HydrophobicContact CG-CB 4.27Å; K529-E767 IonicContact NZ-OE2 3.49Å; K529-E767 PolarHBondContact NZ-OE2 2.92Å
530	C	81.4	Confident	74.3	Confident	10 Å²	10	43 Å²	43	7%	0.068	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	165.5	-176.8	75.5	0	0	0	0	112.1	F528 F652 Y653 E765	F528-C530 VanDerWaalsContact CZ-C 3.47Å; C530-F652 WeakPolarHBondContact CA-O 3.42Å; C530-Y653 HydrophobicContact CB-CD1 3.92Å; C530-Y653 HydrophobicContact CB-CE1 3.68Å; C530-E765 PolarHBondContact O-N 3.07Å
531	L	81.7	Confident	74	Confident	0.5 Å²	0.5	39.4 Å²	39.4	0%	0.003	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	117.2	169.4	165.1	61.9	0	0	0	108.9	F528 L533 M597 L626 N651 F652 L693 L747	F528-L531 HydrophobicContact CE2-CB 4.35Å; F528-L531 HydrophobicContact CZ-CB 4.03Å; L531-L533 HydrophobicContact CD1-CD1 4.47Å; L531-L533 HydrophobicContact CD1-CD2 3.88Å; L531-L533 HydrophobicContact CD1-CG 4.35Å; L531-L533 HydrophobicContact CD2-CD1 3.9Å; L531-L533 HydrophobicContact CD2-CG 4.5Å; L531-L533 HydrophobicContact CG-CD1 4Å; L531-L533 HydrophobicContact CG-CD2 4.29Å; L531-L533 HydrophobicContact CG-CG 4.24Å; L531-M597 HydrophobicContact CD2-CE 3.54Å; L531-M597 VanDerWaalsContact CD2-CE 3.42Å; L531-M597 HydrophobicContact CD2-SD 4.3Å; L531-M597 HydrophobicContact CG-CE 4.33Å; L531-L626 HydrophobicContact CB-CD1 4.1Å; L531-L626 HydrophobicContact CD2-CD1 3.63Å; L531-L626 HydrophobicContact CG-CD1 4.46Å; L531-N651 CarbonylContact O-C 3.51Å; L531-N651 WeakPolarHBondContact O-CA 3.36Å; L531-F652 HydrophobicContact CB-CB 4.21Å; L531-F652 HydrophobicContact CD2-CB 4.46Å; L531-F652 HydrophobicContact CG-CB 4.4Å; L531-F652 PolarHBondContact N-O 3.19Å; L531-F652 PolarHBondContact O-N 3.14Å; L531-L693 HydrophobicContact CD2-CD1 3.62Å; L531-L693 HydrophobicContact CD2-CD2 3.68Å; L531-L693 HydrophobicContact CD2-CG 4.31Å; L531-L747 HydrophobicContact CD1-CD1 3.5Å
532	S	79	Confident	72.7	Confident	24.5 Å²	24.5	42.3 Å²	42.3	17%	0.171	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	110.9	177.4	-58.1	0	0	0	0	110.2	N651 G762 R763	S532-N651 PolarHBondContact OG-OD1 3Å; S532-G762 CarbonylContact O-C 3.57Å; S532-G762 WeakPolarHBondContact O-CA 3.19Å; S532-R763 PolarHBondContact N-O 3.15Å; S532-R763 PolarHBondContact O-N 3.2Å
533	L	77.1	Confident	71.2	Confident	4.5 Å²	4.5	40.9 Å²	40.9	2%	0.024	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	146.4	175.4	-80.3	158.8	0	0	0	111.6	L531 R535 Y537 M597 Y649 V650 F652 L693 I761	L531-L533 HydrophobicContact CD1-CD1 4.47Å; L531-L533 HydrophobicContact CD1-CD2 3.88Å; L531-L533 HydrophobicContact CD1-CG 4.35Å; L531-L533 HydrophobicContact CD2-CD1 3.9Å; L531-L533 HydrophobicContact CD2-CG 4.5Å; L531-L533 HydrophobicContact CG-CD1 4Å; L531-L533 HydrophobicContact CG-CD2 4.29Å; L531-L533 HydrophobicContact CG-CG 4.24Å; L533-R535 PolarHBondContact O-N 3.06Å; L533-Y537 HydrophobicContact CD2-CD1 3.93Å; L533-M597 HydrophobicContact CD1-CE 3.44Å; L533-M597 VanDerWaalsContact CD1-CE 3.48Å; L533-M597 HydrophobicContact CD1-SD 3.77Å; L533-M597 HydrophobicContact CG-CE 4.19Å; L533-Y649 CarbonylContact O-C 3.54Å; L533-Y649 VanDerWaalsContact O-CA 3.29Å; L533-Y649 WeakPolarHBondContact O-CA 3.38Å; L533-V650 PolarHBondContact N-O 3.12Å; L533-V650 PolarHBondContact O-N 3.15Å; L533-F652 HydrophobicContact CB-CE2 4.18Å; L533-F652 HydrophobicContact CD1-CD2 4.1Å; L533-F652 HydrophobicContact CD1-CE2 3.75Å; L533-F652 HydrophobicContact CD1-CZ 4.38Å; L533-F652 HydrophobicContact CG-CD2 4.32Å; L533-F652 HydrophobicContact CG-CE2 4.16Å; L533-L693 HydrophobicContact CD1-CD2 4.28Å; L533-I761 HydrophobicContact CD2-CB 4.23Å; L533-I761 HydrophobicContact CD2-CG2 3.98Å; L533-I761 WeakPolarHBondContact CD2-O 3.34Å
534	C	69.6	Low	69.2	Low	39 Å²	39	45.9 Å²	45.9	26%	0.264	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	128.4	174.6	179	0	0	0	0	110.6	K536 Y537 A538 Y649 I761	C534-K536 VanDerWaalsContact C-N 3.33Å; C534-K536 PolarHBondContact O-N 3.22Å; C534-Y537 WeakPolarHBondContact O-CB 3.45Å; C534-Y537 PolarHBondContact O-N 2.97Å; C534-A538 PolarHBondContact O-N 3.4Å; C534-A538 VanDerWaalsContact O-N 3.17Å; C534-Y649 HydrophobicContact CB-CE1 4.27Å; C534-I761 PolarHBondContact N-O 3.1Å
535	R	65.6	Low	67.1	Low	79.5 Å²	79.5	49 Å²	49	30%	0.3	25%	0.247	S	C	.	.	H	α-helix	trans	-54.5	-45.7	-174.2	174.1	175.8	-70.8	171.7	-1.2	112.6	L533 Y537 A538 E539 A648 V650	L533-R535 PolarHBondContact O-N 3.06Å; R535-Y537 PolarHBondContact O-N 3.28Å; R535-Y537 VanDerWaalsContact O-N 3.15Å; R535-A538 PolarHBondContact O-N 3.06Å; R535-A538 VanDerWaalsContact O-N 3.1Å; R535-E539 VanDerWaalsContact CD-OE1 3.28Å; R535-E539 WeakPolarHBondContact CD-OE1 3.41Å; R535-E539 HydrophobicContact CG-CG 3.99Å; R535-E539 WeakPolarHBondContact CG-OE1 3.25Å; R535-E539 WeakPolarHBondContact CG-OE2 3.32Å; R535-E539 WeakPolarHBondContact O-CB 3.46Å; R535-E539 WeakPolarHBondContact O-CG 3.28Å; R535-E539 PolarHBondContact O-N 3.19Å; R535-A648 HydrophobicContact CB-CB 4.29Å; R535-A648 WeakPolarHBondContact CB-O 3.33Å; R535-A648 PolarHBondContact N-O 2.88Å; R535-V650 HydrophobicContact CB-CG2 4.19Å; R535-V650 HydrophobicContact CG-CG2 4.42Å
536	K	62.8	Low	64.7	Low	107 Å²	107	52.7 Å²	52.7	47%	0.465	27%	0.27	S	S	.	.	H	α-helix	trans	-59.2	-30.8	178.2	-120.9	-179.4	-179.8	172.3	0	113.3	C534 N540 D646	C534-K536 VanDerWaalsContact C-N 3.33Å; C534-K536 PolarHBondContact O-N 3.22Å; K536-N540 VanDerWaalsContact O-CB 3.23Å; K536-N540 WeakPolarHBondContact O-CB 3.33Å; K536-N540 PolarHBondContact O-N 2.95Å; K536-N540 PolarHBondContact O-ND2 2.84Å; K536-N540 VanDerWaalsContact O-ND2 3.09Å; K536-D646 WeakPolarHBondContact CE-OD1 3.41Å; K536-D646 IonicContact NZ-OD1 2.67Å; K536-D646 PolarHBondContact NZ-OD1 2.79Å; K536-D646 IonicContact NZ-OD2 3.71Å; K536-D646 PolarHBondContact NZ-OD2 2.84Å
537	Y	63.8	Low	62.2	Low	54.5 Å²	54.5	58 Å²	58	21%	0.214	30%	0.299	C	S	.	.	H	α-helix	trans	-76.7	-42.5	175.8	-168.4	-90.2	0	0	0	111.7	L533 C534 R535 E539 K541 I714 I761	L533-Y537 HydrophobicContact CD2-CD1 3.93Å; C534-Y537 WeakPolarHBondContact O-CB 3.45Å; C534-Y537 PolarHBondContact O-N 2.97Å; R535-Y537 PolarHBondContact O-N 3.28Å; R535-Y537 VanDerWaalsContact O-N 3.15Å; Y537-E539 PolarHBondContact O-N 2.93Å; Y537-K541 HydrophobicContact CE1-CG 4.18Å; Y537-K541 PolarHBondContact O-N 3.24Å; Y537-I714 HydrophobicContact CE1-CG2 3.8Å; Y537-I761 HydrophobicContact CD1-CB 4.06Å; Y537-I761 HydrophobicContact CD1-CG2 3.58Å; Y537-I761 HydrophobicContact CD2-CG1 4.44Å; Y537-I761 HydrophobicContact CD2-CG2 3.85Å; Y537-I761 HydrophobicContact CE1-CB 4.04Å; Y537-I761 HydrophobicContact CE1-CD1 4.32Å; Y537-I761 HydrophobicContact CE1-CG2 3.47Å; Y537-I761 HydrophobicContact CE2-CD1 3.98Å; Y537-I761 HydrophobicContact CE2-CG1 4.06Å; Y537-I761 HydrophobicContact CE2-CG2 3.74Å; Y537-I761 HydrophobicContact CG-CB 4.39Å; Y537-I761 HydrophobicContact CG-CG2 3.77Å; Y537-I761 VanDerWaalsContact CG-CG2 3.49Å; Y537-I761 VanDerWaalsContact CZ-CG2 3.47Å
538	A	63.4	Low	59.8	Low	9.5 Å²	9.5	60.1 Å²	60.1	8%	0.079	32%	0.317	C	S	.	.	H	α-helix	trans	-60.7	-48	174.2	0	0	0	0	0	111.4	C534 R535 N540 K541 M542 V650	C534-A538 PolarHBondContact O-N 3.4Å; C534-A538 VanDerWaalsContact O-N 3.17Å; R535-A538 PolarHBondContact O-N 3.06Å; R535-A538 VanDerWaalsContact O-N 3.1Å; A538-N540 PolarHBondContact O-N 2.79Å; A538-K541 PolarHBondContact O-N 3.21Å; A538-K541 VanDerWaalsContact O-N 3.11Å; A538-M542 WeakPolarHBondContact O-CG 3.45Å; A538-M542 PolarHBondContact O-N 3.29Å; A538-M542 VanDerWaalsContact O-N 3.16Å; A538-V650 HydrophobicContact CB-CG2 4.24Å
539	E	61.5	Low	57.4	Low	83.5 Å²	83.5	63.1 Å²	63.1	39%	0.39	34%	0.342	S	S	.	.	H	α-helix	trans	-64.1	-44.3	179.9	-72	174.1	169.9	0	0	112.7	R535 Y537 K541 M542 S543	R535-E539 VanDerWaalsContact CD-OE1 3.28Å; R535-E539 WeakPolarHBondContact CD-OE1 3.41Å; R535-E539 HydrophobicContact CG-CG 3.99Å; R535-E539 WeakPolarHBondContact CG-OE1 3.25Å; R535-E539 WeakPolarHBondContact CG-OE2 3.32Å; R535-E539 WeakPolarHBondContact O-CB 3.46Å; R535-E539 WeakPolarHBondContact O-CG 3.28Å; R535-E539 PolarHBondContact O-N 3.19Å; Y537-E539 PolarHBondContact O-N 2.93Å; E539-K541 VanDerWaalsContact C-N 3.26Å; E539-K541 PolarHBondContact O-N 2.95Å; E539-M542 WeakPolarHBondContact O-CA 3.38Å; E539-M542 WeakPolarHBondContact O-CB 3.39Å; E539-M542 PolarHBondContact O-N 3.21Å; E539-S543 PolarHBondContact O-N 3.12Å; E539-S543 PolarHBondContact O-OG 2.84Å
540	N	60.4	Low	55	Low	105.5 Å²	105.5	67.7 Å²	67.7	56%	0.564	36%	0.362	S	S	*	.	H	α-helix	trans	-63.3	-28.2	176.2	-82.7	-20.8	0	0	0	113.2	K536 A538 S543	K536-N540 VanDerWaalsContact O-CB 3.23Å; K536-N540 WeakPolarHBondContact O-CB 3.33Å; K536-N540 PolarHBondContact O-N 2.95Å; K536-N540 PolarHBondContact O-ND2 2.84Å; K536-N540 VanDerWaalsContact O-ND2 3.09Å; A538-N540 PolarHBondContact O-N 2.79Å; N540-S543 PolarHBondContact O-OG 3.17Å; N540-S543 VanDerWaalsContact O-OG 3.07Å
541	K	57.5	Low	52.3	Low	38.5 Å²	38.5	71.7 Å²	71.7	17%	0.167	39%	0.389	C	S	.	.	H	α-helix	trans	-80	-27.3	172	-82	-77.5	-172.4	178.1	0	112	Y537 A538 E539 R695 E712	Y537-K541 HydrophobicContact CE1-CG 4.18Å; Y537-K541 PolarHBondContact O-N 3.24Å; A538-K541 PolarHBondContact O-N 3.21Å; A538-K541 VanDerWaalsContact O-N 3.11Å; E539-K541 VanDerWaalsContact C-N 3.26Å; E539-K541 PolarHBondContact O-N 2.95Å; K541-R695 PolarHBondContact O-NH1 3.23Å; K541-R695 VanDerWaalsContact O-NH1 3.15Å; K541-R695 PolarHBondContact O-NH2 2.78Å; K541-E712 IonicContact NZ-OE1 2.75Å; K541-E712 PolarHBondContact NZ-OE1 3.18Å; K541-E712 IonicContact NZ-OE2 3.37Å; K541-E712 PolarHBondContact NZ-OE2 2.93Å
542	M	47.2	Very low	49.7	Very low	73.5 Å²	73.5	77.8 Å²	77.8	36%	0.362	43%	0.427	S	S	.	.	H	α-helix	trans	-70.3	-42.6	173	-69.6	173.9	96.6	0	0	112.7	A538 E539 N544 V545 I595 L630	A538-M542 WeakPolarHBondContact O-CG 3.45Å; A538-M542 PolarHBondContact O-N 3.29Å; A538-M542 VanDerWaalsContact O-N 3.16Å; E539-M542 WeakPolarHBondContact O-CA 3.38Å; E539-M542 WeakPolarHBondContact O-CB 3.39Å; E539-M542 PolarHBondContact O-N 3.21Å; M542-N544 PolarHBondContact O-N 2.87Å; M542-N544 VanDerWaalsContact O-N 3.13Å; M542-V545 WeakPolarHBondContact O-CB 3.31Å; M542-V545 PolarHBondContact O-N 3.22Å; M542-I595 HydrophobicContact CE-CD1 4.04Å; M542-I595 HydrophobicContact CE-CG1 4.21Å; M542-I595 HydrophobicContact CG-CD1 3.74Å; M542-I595 HydrophobicContact CG-CG1 4.33Å; M542-I595 HydrophobicContact SD-CD1 3.73Å; M542-I595 HydrophobicContact SD-CG1 4.45Å; M542-L630 HydrophobicContact CE-CD1 3.21Å; M542-L630 HydrophobicContact SD-CD1 4.08Å
543	S	46.3	Very low	47.2	Very low	50 Å²	50	83.9 Å²	83.9	35%	0.35	46%	0.457	S	S	.	.	H	α-helix	trans	-59.1	-30.3	-176.9	57.3	0	0	0	0	113.4	E539 N540 V545 V546 N547	E539-S543 PolarHBondContact O-N 3.12Å; E539-S543 PolarHBondContact O-OG 2.84Å; N540-S543 PolarHBondContact O-OG 3.17Å; N540-S543 VanDerWaalsContact O-OG 3.07Å; S543-V545 PolarHBondContact O-N 2.83Å; S543-V546 PolarHBondContact O-N 2.83Å; S543-N547 PolarHBondContact O-N 2.96Å
544	N	42.3	Very low	44.7	Very low	106 Å²	106	93.7 Å²	93.7	57%	0.567	50%	0.495	S	S	*	.	H	α-helix	trans	-68.4	-17	175.5	-72.1	-2.5	0	0	0	114	M542 S548	M542-N544 PolarHBondContact O-N 2.87Å; M542-N544 VanDerWaalsContact O-N 3.13Å; N544-S548 PolarHBondContact O-OG 3.14Å
545	V	40.9	Very low	42.6	Very low	66 Å²	66	98.8 Å²	98.8	40%	0.4	52%	0.52	S	S	.	.	H	α-helix	trans	-86.7	-32.6	176.4	-176.9	0	0	0	0	111.7	M542 S543 N547 S548 S549	M542-V545 WeakPolarHBondContact O-CB 3.31Å; M542-V545 PolarHBondContact O-N 3.22Å; S543-V545 PolarHBondContact O-N 2.83Å; V545-N547 VanDerWaalsContact C-N 3.32Å; V545-N547 PolarHBondContact O-N 3.17Å; V545-S548 PolarHBondContact O-OG 2.95Å; V545-S549 PolarHBondContact O-OG 2.66Å; V545-S549 VanDerWaalsContact O-OG 3.05Å
546	V	32.9	Very low	40.6	Very low	95.5 Å²	95.5	105.3 Å²	105.3	58%	0.579	55%	0.55	S	S	*	*	H	α-helix	trans	-75	-27.7	178.9	-176.1	0	0	0	0	111.5	S543 S549	S543-V546 PolarHBondContact O-N 2.83Å; V546-S549 PolarHBondContact O-OG 3Å
547	N	32.3	Very low	38.8	Very low	120.5 Å²	120.5	106.1 Å²	106.1	64%	0.644	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-20.5	179.9	-73.8	-15.9	0	0	0	114.4	S543 V545 S549	S543-N547 PolarHBondContact O-N 2.96Å; V545-N547 VanDerWaalsContact C-N 3.32Å; V545-N547 PolarHBondContact O-N 3.17Å; N547-S549 VanDerWaalsContact C-N 3.25Å; N547-S549 PolarHBondContact O-N 2.69Å
548	S	30.1	Very low	37	Very low	79 Å²	79	108.8 Å²	108.8	55%	0.552	59%	0.591	S	S	*	*	H	α-helix	trans	-78.3	-15.8	177.1	57.9	0	0	0	0	113.7	N544 V545 K550	N544-S548 PolarHBondContact O-OG 3.14Å; V545-S548 PolarHBondContact O-OG 2.95Å; S548-K550 VanDerWaalsContact C-N 3.34Å; S548-K550 PolarHBondContact O-N 3.39Å
549	S	30.1	Very low	35.2	Very low	89.5 Å²	89.5	120.1 Å²	120.1	63%	0.626	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	11	-179.2	41.1	0	0	0	0	114.8	V545 V546 N547	V545-S549 PolarHBondContact O-OG 2.66Å; V545-S549 VanDerWaalsContact O-OG 3.05Å; V546-S549 PolarHBondContact O-OG 3Å; N547-S549 VanDerWaalsContact C-N 3.25Å; N547-S549 PolarHBondContact O-N 2.69Å
550	K	28.6	Very low	33.5	Very low	185.5 Å²	185.5	123.2 Å²	123.2	81%	0.807	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-128.8	8.6	-179.4	-79.9	-173	177	177.6	0	117.1	S548	S548-K550 VanDerWaalsContact C-N 3.34Å; S548-K550 PolarHBondContact O-N 3.39Å
551	S	26.1	Very low	32	Very low	93 Å²	93	123.9 Å²	123.9	65%	0.65	66%	0.661	S	S	*	*	S	Bend	trans	-124	43.4	-178	63.7	0	0	0	0	115
552	T	26.8	Very low	30.6	Very low	129.5 Å²	129.5	128.8 Å²	128.8	79%	0.794	70%	0.695	S	S	*	*			trans	-138.5	44.2	171.2	46.2	0	0	0	0	113.1
553	L	25.2	Very low	29.5	Very low	151.5 Å²	151.5	134.4 Å²	134.4	79%	0.793	72%	0.717	S	S	*	*	S	Bend	trans	-116.6	144.3	154.1	-99.5	88.4	0	0	0	108.4
554	Y	25	Very low	28.7	Very low	211 Å²	211	140.1 Å²	140.1	83%	0.827	74%	0.743	S	S	*	*	S	Bend	trans	73.4	78.9	-176.4	-62.8	-83.3	0	0	0	116.8
555	N	25.2	Very low	27.8	Very low	146.5 Å²	146.5	142.3 Å²	142.3	78%	0.783	75%	0.754	S	S	*	*				-179.1	94.7	102.9	-93.5	-23.1	0	0	0	111.2	T557	N555-T557 PolarHBondContact O-N 2.74Å
556	K	23.8	Very low	27	Very low	216 Å²	216	144.4 Å²	144.4	94%	0.939	77%	0.771	S	S	*	*			trans	-78.8	95.6	163.8	-83	-177.2	174.2	178.5	0	109.1
557	T	26.2	Very low	26.7	Very low	124.5 Å²	124.5	149 Å²	149	76%	0.764	79%	0.787	S	S	*	*			trans	-128.7	102.6	156.9	49.9	0	0	0	0	108.9	N555 R559	N555-T557 PolarHBondContact O-N 2.74Å; T557-R559 PolarHBondContact O-N 2.71Å
558	S	24.6	Very low	26.3	Very low	111 Å²	111	152.4 Å²	152.4	78%	0.776	80%	0.795	S	S	*	*			trans	-64.2	129.7	176	51.3	0	0	0	0	111.4
559	R	26	Very low	26	Very low	246 Å²	246	154.2 Å²	154.2	93%	0.928	81%	0.808	S	S	*	*			trans	-134.9	130.1	147.5	-95.7	171.9	-176.8	178.9	0.9	108.5	T557	T557-R559 PolarHBondContact O-N 2.71Å
560	N	26.6	Very low	25.7	Very low	148 Å²	148	157.5 Å²	157.5	79%	0.791	81%	0.813	S	S	*	*			trans	-71.1	150	-167.6	-78.1	-27.7	0	0	0	113.1	T562	N560-T562 PolarHBondContact O-N 2.94Å
561	P	28.9	Very low	25.5	Very low	121 Å²	121	154.5 Å²	154.5	79%	0.786	81%	0.813	S	S	*	*			trans	-83.5	138.7	-177.3	34.1	-33.9	0	0	0	111.7	K563	P561-K563 PolarHBondContact O-N 2.85Å
562	T	26.5	Very low	25.5	Very low	141.5 Å²	141.5	157.5 Å²	157.5	87%	0.868	82%	0.82	S	S	*	*			trans	-99.2	121.5	168.1	-24.7	0	0	0	0	109.5	N560 L564	N560-T562 PolarHBondContact O-N 2.94Å; T562-L564 PolarHBondContact O-N 2.76Å
563	K	25.7	Very low	25.3	Very low	190 Å²	190	156.2 Å²	156.2	83%	0.826	82%	0.816	S	S	*	*			trans	-63	126	174	-62.3	172	178.1	177.2	0	112	P561	P561-K563 PolarHBondContact O-N 2.85Å
564	L	27.7	Very low	25.2	Very low	170.5 Å²	170.5	155.6 Å²	155.6	89%	0.893	82%	0.819	S	S	*	*			trans	-142.6	110.3	151.9	-120.3	118.4	0	0	0	107.8	T562	T562-L564 PolarHBondContact O-N 2.76Å
565	L	25.2	Very low	25.2	Very low	152 Å²	152	149 Å²	149	80%	0.796	80%	0.803	S	S	*	*			trans	1.9	135	140.6	-90.4	94.1	0	0	0	115.1	Q567	L565-Q567 PolarHBondContact O-N 2.69Å
566	S	24.4	Very low	25.1	Very low	111 Å²	111	147.2 Å²	147.2	78%	0.776	80%	0.802	S	S	*	*			trans	4.9	120.2	170.7	54.9	0	0	0	0	114.3
567	Q	25.4	Very low	25.1	Very low	191.5 Å²	191.5	142.3 Å²	142.3	90%	0.895	79%	0.79	S	S	*	*				-101.2	137	92.6	-73.7	176.9	-22.6	0	0	111.5	L565 S569	L565-Q567 PolarHBondContact O-N 2.69Å; Q567-S569 PolarHBondContact O-N 3.34Å; Q567-S569 VanDerWaalsContact O-N 3.09Å
568	K	23.4	Very low	25	Very low	191.5 Å²	191.5	142.3 Å²	142.3	83%	0.833	79%	0.785	S	S	*	*			trans	-82.2	122.7	172.4	-72	177.8	174.9	-179.5	0	109.8
569	S	25.4	Very low	25	Very low	116.5 Å²	116.5	142.4 Å²	142.4	82%	0.815	78%	0.782	S	S	*	*			trans	-109.8	126.2	156.6	51.1	0	0	0	0	108.7	Q567	Q567-S569 PolarHBondContact O-N 3.34Å; Q567-S569 VanDerWaalsContact O-N 3.09Å
570	H	23.2	Very low	25	Very low	159 Å²	159	138.3 Å²	138.3	74%	0.736	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-75.8	146.4	178.2	-72.3	-92.1	0	0	0	111.1	I572	H570-I572 PolarHBondContact O-N 3.49Å
571	P	24.5	Very low	25	Very low	123 Å²	123	138.6 Å²	138.6	80%	0.799	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-86.4	124.5	164.7	31	-30.1	0	0	0	110.2	S573	P571-S573 PolarHBondContact O-N 3.13Å
572	I	24.9	Very low	25.1	Very low	155 Å²	155	139.2 Å²	139.2	80%	0.795	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-76.5	120.2	176	-67.3	166.7	0	0	0	108.6	H570 V574	H570-I572 PolarHBondContact O-N 3.49Å; I572-V574 HydrophobicContact CG2-CG2 4.17Å; I572-V574 PolarHBondContact O-N 2.88Å
573	S	23.2	Very low	25.5	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-68.8	120.1	174.5	52.3	0	0	0	0	111.3	P571 S575	P571-S573 PolarHBondContact O-N 3.13Å; S573-S575 PolarHBondContact O-N 3.49Å
574	V	23.8	Very low	25.8	Very low	140 Å²	140	135.5 Å²	135.5	85%	0.848	74%	0.742	S	S	*	*			trans	-93.3	87.5	167.9	-172.6	0	0	0	0	109.1	I572	I572-V574 HydrophobicContact CG2-CG2 4.17Å; I572-V574 PolarHBondContact O-N 2.88Å
575	S	23.7	Very low	26.3	Very low	70.5 Å²	70.5	129.9 Å²	129.9	49%	0.493	72%	0.717	S	S	.	*			trans	-70.4	134.9	163.3	51.8	0	0	0	0	109.4	S573 V577	S573-S575 PolarHBondContact O-N 3.49Å; S575-V577 PolarHBondContact O-N 2.93Å; S575-V577 VanDerWaalsContact O-N 3.12Å
576	S	23	Very low	26.9	Very low	110.5 Å²	110.5	128.7 Å²	128.7	77%	0.773	71%	0.711	S	S	*	*			trans	-67.9	92.1	178.5	46.7	0	0	0	0	111.7	L578	S576-L578 PolarHBondContact O-N 3.48Å
577	V	25.1	Very low	27.7	Very low	113 Å²	113	128.5 Å²	128.5	69%	0.685	70%	0.701	S	S	*	*			trans	-72.1	108.8	170.5	-180	0	0	0	0	108	S575 P579	S575-V577 PolarHBondContact O-N 2.93Å; S575-V577 VanDerWaalsContact O-N 3.12Å; V577-P579 WeakPolarHBondContact O-CD 3.21Å
578	L	24	Very low	28.6	Very low	124 Å²	124	121.6 Å²	121.6	65%	0.649	67%	0.67	S	S	*	*			trans	-65.5	124.2	166.9	-86	159.9	0	0	0	108.3	S576 F580	S576-L578 PolarHBondContact O-N 3.48Å; L578-F580 VanDerWaalsContact C-N 3.33Å; L578-F580 HydrophobicContact CB-CD2 4.37Å; L578-F580 HydrophobicContact CB-CE2 4.09Å; L578-F580 WeakPolarHBondContact O-CD2 3.15Å; L578-F580 PolarHBondContact O-N 3.22Å
579	P	24.1	Very low	29.4	Very low	112 Å²	112	118.4 Å²	118.4	73%	0.727	66%	0.662	S	S	*	*			trans	-76.9	88.7	-173.3	31.2	-33.7	0	0	0	110.1	V577 N581	V577-P579 WeakPolarHBondContact O-CD 3.21Å; P579-N581 PolarHBondContact O-N 3.1Å; P579-N581 VanDerWaalsContact O-N 3.17Å
580	F	26.3	Very low	30.2	Very low	160.5 Å²	160.5	118.1 Å²	118.1	70%	0.704	66%	0.656	S	S	*	*			trans	-75	111	164.8	-81	-83.5	0	0	0	109.2	L578 K582	L578-F580 VanDerWaalsContact C-N 3.33Å; L578-F580 HydrophobicContact CB-CD2 4.37Å; L578-F580 HydrophobicContact CB-CE2 4.09Å; L578-F580 WeakPolarHBondContact O-CD2 3.15Å; L578-F580 PolarHBondContact O-N 3.22Å; F580-K582 PolarHBondContact O-N 2.89Å
581	N	25.9	Very low	31.3	Very low	155.5 Å²	155.5	114.4 Å²	114.4	83%	0.832	64%	0.641	S	S	*	*			trans	-61	90.9	170.5	-81.5	-29.3	0	0	0	109.6	P579 V583	P579-N581 PolarHBondContact O-N 3.1Å; P579-N581 VanDerWaalsContact O-N 3.17Å; N581-V583 PolarHBondContact O-N 2.79Å
582	K	32.5	Very low	32.4	Very low	133 Å²	133	113.7 Å²	113.7	58%	0.578	64%	0.639	S	S	*	*			trans	-57.5	131.4	167.9	-82.6	-172.9	172.9	-175.9	0	108.7	F580 K584 E598	F580-K582 PolarHBondContact O-N 2.89Å; K582-K584 PolarHBondContact O-N 2.8Å; K582-K584 VanDerWaalsContact O-N 3.07Å; K582-E598 IonicContact NZ-OE1 2.65Å; K582-E598 IonicContact NZ-OE2 3.98Å; K582-E598 PolarHBondContact NZ-OE2 3.46Å
583	V	34.1	Very low	33.6	Very low	76 Å²	76	111.4 Å²	111.4	46%	0.461	63%	0.628	S	S	.	*			trans	-54.1	125.2	179.8	176.3	0	0	0	0	108.9	N581 S585 D587 I588	N581-V583 PolarHBondContact O-N 2.79Å; V583-S585 VanDerWaalsContact C-N 3.32Å; V583-S585 PolarHBondContact O-N 2.94Å; V583-D587 HydrophobicContact CG1-CB 4.04Å; V583-I588 HydrophobicContact CG1-CG1 4.24Å
584	K	32.1	Very low	35.2	Very low	178.5 Å²	178.5	107.3 Å²	107.3	78%	0.776	60%	0.6	S	S	*	*			trans	-63.5	109	178.1	-72.7	-173.5	176.4	-176	0	109.4	K582 N586 D587	K582-K584 PolarHBondContact O-N 2.8Å; K582-K584 VanDerWaalsContact O-N 3.07Å; K584-N586 PolarHBondContact O-N 2.86Å; K584-D587 PolarHBondContact O-N 2.83Å
585	S	38.7	Very low	37.3	Very low	52.5 Å²	52.5	102 Å²	102	37%	0.367	57%	0.566	S	S	.	*	H	α-helix	trans	-69	38.5	178.2	48.1	0	0	0	0	113.2	V583 D587	V583-S585 VanDerWaalsContact C-N 3.32Å; V583-S585 PolarHBondContact O-N 2.94Å; S585-D587 PolarHBondContact O-N 3.08Å
586	N	36.4	Very low	39.6	Very low	127 Å²	127	99.8 Å²	99.8	68%	0.679	55%	0.548	S	S	*	.	H	α-helix	trans	-69.7	-19.8	-175.5	-68.7	-11.1	0	0	0	114.7	K584 I588	K584-N586 PolarHBondContact O-N 2.86Å; N586-I588 PolarHBondContact O-N 3.34Å
587	D	41.1	Very low	42.4	Very low	105.5 Å²	105.5	94.7 Å²	94.7	56%	0.564	51%	0.512	S	S	*	.	H	α-helix	trans	-76.3	-23.7	-174.6	-66.8	-23.3	0	0	0	112.8	V583 K584 S585 N589 T590	V583-D587 HydrophobicContact CG1-CB 4.04Å; K584-D587 PolarHBondContact O-N 2.83Å; S585-D587 PolarHBondContact O-N 3.08Å; D587-N589 VanDerWaalsContact C-N 3.27Å; D587-N589 PolarHBondContact O-N 3.12Å; D587-T590 PolarHBondContact O-N 2.77Å; D587-T590 PolarHBondContact O-OG1 3.04Å
588	I	45	Very low	45.2	Very low	47.5 Å²	47.5	90.5 Å²	90.5	24%	0.244	49%	0.485	C	S	.	.	H	α-helix	trans	-68.5	-28.1	-175.2	-60.4	175.9	0	0	0	112.5	V583 N586 T590 L591 F596 W709	V583-I588 HydrophobicContact CG1-CG1 4.24Å; N586-I588 PolarHBondContact O-N 3.34Å; I588-T590 PolarHBondContact O-N 2.98Å; I588-L591 PolarHBondContact O-N 3.27Å; I588-F596 HydrophobicContact CG2-CD1 4.45Å; I588-F596 HydrophobicContact CG2-CD2 3.97Å; I588-F596 HydrophobicContact CG2-CE1 4.12Å; I588-F596 HydrophobicContact CG2-CE2 3.62Å; I588-F596 HydrophobicContact CG2-CG 4.38Å; I588-F596 HydrophobicContact CG2-CZ 4.06Å; I588-W709 HydrophobicContact CB-CH2 4.3Å; I588-W709 HydrophobicContact CB-CZ2 4.15Å; I588-W709 HydrophobicContact CD1-CH2 4.49Å; I588-W709 HydrophobicContact CD1-CZ2 3.97Å; I588-W709 HydrophobicContact CG2-CH2 3.36Å; I588-W709 HydrophobicContact CG2-CZ2 3.7Å; I588-W709 HydrophobicContact CG2-CZ3 4.38Å
589	N	39.7	Very low	48.1	Very low	124 Å²	124	84.7 Å²	84.7	66%	0.663	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	0.5	-174.6	-73.6	-28.1	0	0	0	115.1	D587	D587-N589 VanDerWaalsContact C-N 3.27Å; D587-N589 PolarHBondContact O-N 3.12Å
590	T	43.4	Very low	50.9	Low	110.5 Å²	110.5	81.5 Å²	81.5	68%	0.678	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-8.1	-174.1	59	0	0	0	0	114.9	D587 I588	D587-T590 PolarHBondContact O-N 2.77Å; D587-T590 PolarHBondContact O-OG1 3.04Å; I588-T590 PolarHBondContact O-N 2.98Å
591	L	45.8	Very low	53.7	Low	80 Å²	80	74.1 Å²	74.1	42%	0.419	40%	0.398	S	S	.	.			trans	-117	85.5	-177.7	-70.1	139.7	0	0	0	111.3	I588 D593 S594 F596 L630	I588-L591 PolarHBondContact O-N 3.27Å; L591-D593 VanDerWaalsContact C-N 3.25Å; L591-D593 PolarHBondContact O-N 3.26Å; L591-S594 WeakPolarHBondContact CB-OG 3.37Å; L591-S594 VanDerWaalsContact CD2-OG 3.26Å; L591-S594 WeakPolarHBondContact CD2-OG 3.2Å; L591-S594 PolarHBondContact O-N 3.12Å; L591-S594 PolarHBondContact O-OG 2.86Å; L591-F596 HydrophobicContact CB-CZ 4.41Å; L591-L630 HydrophobicContact CD2-CD1 3.83Å
592	S	47	Very low	56.3	Low	108.5 Å²	108.5	66.9 Å²	66.9	76%	0.759	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-21.5	-178.8	19.7	0	0	0	0	114.3
593	D	51.5	Low	58.6	Low	107 Å²	107	61.1 Å²	61.1	57%	0.572	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	5.4	-167.9	-64.7	-5.2	0	0	0	113.6	L591	L591-D593 VanDerWaalsContact C-N 3.25Å; L591-D593 PolarHBondContact O-N 3.26Å
594	S	56.1	Low	60.3	Low	18 Å²	18	59.2 Å²	59.2	13%	0.126	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	132.7	-178.3	-3.2	0	0	0	0	112.6	L591 F596	L591-S594 WeakPolarHBondContact CB-OG 3.37Å; L591-S594 VanDerWaalsContact CD2-OG 3.26Å; L591-S594 WeakPolarHBondContact CD2-OG 3.2Å; L591-S594 PolarHBondContact O-N 3.12Å; L591-S594 PolarHBondContact O-OG 2.86Å; S594-F596 WeakPolarHBondContact O-CD2 3.35Å; S594-F596 WeakPolarHBondContact OG-CE2 3.37Å; S594-F596 WeakPolarHBondContact OG-CZ 3.3Å
595	I	67	Low	61.6	Low	28.5 Å²	28.5	53.1 Å²	53.1	15%	0.146	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	126.5	171.8	-55	170.6	0	0	0	108.8	M542 M597 S627 T628 L630 F652	M542-I595 HydrophobicContact CE-CD1 4.04Å; M542-I595 HydrophobicContact CE-CG1 4.21Å; M542-I595 HydrophobicContact CG-CD1 3.74Å; M542-I595 HydrophobicContact CG-CG1 4.33Å; M542-I595 HydrophobicContact SD-CD1 3.73Å; M542-I595 HydrophobicContact SD-CG1 4.45Å; I595-M597 HydrophobicContact CG2-CG 4.37Å; I595-S627 WeakPolarHBondContact O-CA 3.35Å; I595-T628 HydrophobicContact CB-CG2 4.22Å; I595-T628 HydrophobicContact CD1-CG2 4.32Å; I595-T628 HydrophobicContact CG1-CG2 4.48Å; I595-L630 HydrophobicContact CD1-CD1 4.03Å; I595-L630 HydrophobicContact CG1-CD1 4.1Å; I595-F652 HydrophobicContact CB-CE1 3.89Å; I595-F652 HydrophobicContact CB-CZ 4.31Å; I595-F652 HydrophobicContact CD1-CZ 4.25Å; I595-F652 HydrophobicContact CG2-CE1 3.86Å; I595-F652 HydrophobicContact CG2-CZ 4.2Å
596	F	73.8	Confident	62.3	Low	23.5 Å²	23.5	57.3 Å²	57.3	10%	0.103	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	136.2	172.7	-59.5	-84.3	0	0	0	111.2	I588 L591 S594 T625 L626 L655 L696	I588-F596 HydrophobicContact CG2-CD1 4.45Å; I588-F596 HydrophobicContact CG2-CD2 3.97Å; I588-F596 HydrophobicContact CG2-CE1 4.12Å; I588-F596 HydrophobicContact CG2-CE2 3.62Å; I588-F596 HydrophobicContact CG2-CG 4.38Å; I588-F596 HydrophobicContact CG2-CZ 4.06Å; L591-F596 HydrophobicContact CB-CZ 4.41Å; S594-F596 WeakPolarHBondContact O-CD2 3.35Å; S594-F596 WeakPolarHBondContact OG-CE2 3.37Å; S594-F596 WeakPolarHBondContact OG-CZ 3.3Å; F596-T625 HydrophobicContact CD1-CG2 4.47Å; F596-L626 WeakPolarHBondContact CA-O 3.25Å; F596-L655 HydrophobicContact CD1-CD1 3.96Å; F596-L655 HydrophobicContact CE1-CD1 3.79Å; F596-L696 HydrophobicContact CB-CB 4.14Å; F596-L696 HydrophobicContact CB-CD1 4.09Å; F596-L696 PolarHBondContact O-N 3.12Å; F596-L696 VanDerWaalsContact O-N 3.14Å
597	M	81.2	Confident	62.7	Low	4.5 Å²	4.5	55.5 Å²	55.5	2%	0.022	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	160.1	171.6	-68.5	-169.8	-62.6	0	0	109.8	L531 L533 I595 T625 L626 F652 L693 F694 I714	L531-M597 HydrophobicContact CD2-CE 3.54Å; L531-M597 VanDerWaalsContact CD2-CE 3.42Å; L531-M597 HydrophobicContact CD2-SD 4.3Å; L531-M597 HydrophobicContact CG-CE 4.33Å; L533-M597 HydrophobicContact CD1-CE 3.44Å; L533-M597 VanDerWaalsContact CD1-CE 3.48Å; L533-M597 HydrophobicContact CD1-SD 3.77Å; L533-M597 HydrophobicContact CG-CE 4.19Å; I595-M597 HydrophobicContact CG2-CG 4.37Å; M597-T625 CarbonylContact O-C 3.56Å; M597-T625 WeakPolarHBondContact O-CA 3.27Å; M597-L626 HydrophobicContact CB-CB 4.35Å; M597-L626 PolarHBondContact N-O 3.38Å; M597-L626 PolarHBondContact O-N 2.86Å; M597-F652 HydrophobicContact CE-CB 4.11Å; M597-F652 HydrophobicContact CE-CD1 3.33Å; M597-F652 HydrophobicContact CE-CD2 3.59Å; M597-F652 VanDerWaalsContact CE-CD2 3.42Å; M597-F652 HydrophobicContact CE-CE1 3.42Å; M597-F652 VanDerWaalsContact CE-CE1 3.42Å; M597-F652 HydrophobicContact CE-CE2 3.72Å; M597-F652 HydrophobicContact CE-CG 3.4Å; M597-F652 VanDerWaalsContact CE-CG 3.47Å; M597-F652 HydrophobicContact CE-CZ 3.63Å; M597-F652 HydrophobicContact CG-CE1 4.36Å; M597-F652 HydrophobicContact SD-CE1 4.12Å; M597-F652 HydrophobicContact SD-CZ 4.24Å; M597-L693 HydrophobicContact CB-CD1 4.13Å; M597-L693 HydrophobicContact CE-CD1 4.14Å; M597-L693 HydrophobicContact CE-CD2 4.42Å; M597-L693 HydrophobicContact SD-CD1 4.21Å; M597-L693 HydrophobicContact SD-CD2 4.04Å; M597-L693 HydrophobicContact SD-CG 4.28Å; M597-F694 CarbonylContact C-O 3.57Å; M597-F694 VanDerWaalsContact CA-O 3.27Å; M597-F694 WeakPolarHBondContact CA-O 3.31Å; M597-F694 WeakPolarHBondContact CB-O 3.36Å; M597-I714 HydrophobicContact CG-CD1 4.24Å; M597-I714 HydrophobicContact SD-CD1 3.65Å; M597-I714 VanDerWaalsContact SD-CD1 3.59Å
598	E	83.7	Confident	62.4	Low	25 Å²	25	55.2 Å²	55.2	12%	0.117	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	119.8	175.8	-172.5	164.4	-168.1	0	0	109.1	K582 S623 F624 F694 L696	K582-E598 IonicContact NZ-OE1 2.65Å; K582-E598 IonicContact NZ-OE2 3.98Å; K582-E598 PolarHBondContact NZ-OE2 3.46Å; E598-S623 VanDerWaalsContact OE1-CB 3.28Å; E598-S623 WeakPolarHBondContact OE1-CB 3.44Å; E598-S623 PolarHBondContact OE1-OG 3.26Å; E598-F624 CarbonylContact C-O 3.52Å; E598-F624 WeakPolarHBondContact CA-O 3.41Å; E598-F694 HydrophobicContact CB-CB 4.41Å; E598-F694 PolarHBondContact N-O 3.27Å; E598-F694 PolarHBondContact O-N 3.08Å; E598-L696 HydrophobicContact CB-CD1 4.23Å; E598-L696 HydrophobicContact CB-CD2 4.41Å; E598-L696 HydrophobicContact CB-CG 4.32Å
599	L	84.6	Confident	61.9	Low	1.5 Å²	1.5	61.8 Å²	61.8	1%	0.008	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	110.3	174.4	174	68.9	0	0	0	108.6	F528 V601 S623 F624 L626 R692 L693 L764	F528-L599 HydrophobicContact CD2-CD2 3.79Å; F528-L599 HydrophobicContact CE2-CD2 3.7Å; L599-V601 HydrophobicContact CD2-CG2 4.32Å; L599-V601 HydrophobicContact CG-CG2 4.1Å; L599-S623 CarbonylContact O-C 3.53Å; L599-S623 VanDerWaalsContact O-CA 3.3Å; L599-S623 WeakPolarHBondContact O-CA 2.99Å; L599-F624 HydrophobicContact CB-CB 4.4Å; L599-F624 PolarHBondContact N-O 3.38Å; L599-F624 PolarHBondContact O-N 3.08Å; L599-L626 HydrophobicContact CB-CD1 3.98Å; L599-L626 HydrophobicContact CB-CG 4.44Å; L599-R692 CarbonylContact C-O 3.53Å; L599-R692 WeakPolarHBondContact CA-O 3.32Å; L599-L693 HydrophobicContact CB-CD1 4.25Å; L599-L693 HydrophobicContact CD1-CD1 4.42Å; L599-L764 HydrophobicContact CD2-CD1 3.83Å; L599-L764 HydrophobicContact CD2-CD2 4.29Å
600	E	83.8	Confident	61.6	Low	45.5 Å²	45.5	60.5 Å²	60.5	21%	0.213	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	133.4	166.8	-66.6	-174.1	152.3	0	0	110.2	T621 T622 L691 R692 F694	E600-T621 HydrophobicContact CB-CG2 3.97Å; E600-T621 HydrophobicContact CG-CG2 4.2Å; E600-T622 CarbonylContact C-O 3.54Å; E600-T622 WeakPolarHBondContact CA-O 3.35Å; E600-L691 CarbonylContact O-C 3.55Å; E600-L691 WeakPolarHBondContact O-CA 3.13Å; E600-R692 HydrophobicContact CB-CB 4.25Å; E600-R692 PolarHBondContact N-O 2.74Å; E600-R692 PolarHBondContact O-N 2.92Å; E600-R692 WeakPolarHBondContact OE2-CD 3.33Å; E600-R692 IonicContact OE2-CZ 3.71Å; E600-R692 IonicContact OE2-NH1 2.68Å; E600-R692 PolarHBondContact OE2-NH1 2.85Å; E600-R692 VanDerWaalsContact OE2-NH1 3.07Å; E600-F694 HydrophobicContact CB-CE2 4.24Å; E600-F694 VanDerWaalsContact CD-CE2 3.48Å; E600-F694 HydrophobicContact CG-CD2 4.19Å; E600-F694 HydrophobicContact CG-CE2 3.75Å; E600-F694 VanDerWaalsContact OE2-CE2 3.29Å; E600-F694 WeakPolarHBondContact OE2-CE2 3.39Å
601	V	83.9	Confident	61	Low	4.33333 Å²	4.33333	60.6 Å²	60.6	3%	0.026	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	115.1	169.7	-170.7	0	0	0	0	108.9	L599 V603 T621 T622 F624 I668 I689 R690 L691	L599-V601 HydrophobicContact CD2-CG2 4.32Å; L599-V601 HydrophobicContact CG-CG2 4.1Å; V601-V603 HydrophobicContact CG1-CG2 4.5Å; V601-T621 CarbonylContact O-C 3.43Å; V601-T621 WeakPolarHBondContact O-CA 3.32Å; V601-T622 PolarHBondContact N-O 3.29Å; V601-T622 PolarHBondContact O-N 2.89Å; V601-T622 PolarHBondContact O-OG1 3.07Å; V601-T622 VanDerWaalsContact O-OG1 3.1Å; V601-F624 HydrophobicContact CG2-CD2 4.36Å; V601-F624 HydrophobicContact CG2-CE2 4.11Å; V601-I668 HydrophobicContact CB-CD1 3.59Å; V601-I668 HydrophobicContact CG1-CD1 3.68Å; V601-I668 HydrophobicContact CG1-CG2 4.44Å; V601-I668 HydrophobicContact CG2-CD1 3.52Å; V601-I668 VanDerWaalsContact CG2-CD1 3.5Å; V601-I689 HydrophobicContact CG1-CG2 3.73Å; V601-R690 WeakPolarHBondContact CA-O 3.47Å; V601-L691 HydrophobicContact CB-CD2 4.03Å; V601-L691 HydrophobicContact CG1-CD2 3.58Å; V601-L691 HydrophobicContact CG2-CD2 3.51Å; V601-L691 VanDerWaalsContact CG2-CD2 3.45Å
602	S	80.6	Confident	60.3	Low	3.33333 Å²	3.33333	62 Å²	62	2%	0.023	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	119.8	179.9	-49.7	0	0	0	0	110	W619 T620 T621 R690	S602-W619 VanDerWaalsContact CB-CE3 3.46Å; S602-T620 CarbonylContact C-O 3.55Å; S602-T620 WeakPolarHBondContact CA-O 3.29Å; S602-T621 WeakPolarHBondContact CB-OG1 3.3Å; S602-T621 WeakPolarHBondContact OG-CG2 3.3Å; S602-T621 PolarHBondContact OG-OG1 3.37Å; S602-R690 PolarHBondContact N-O 3.13Å; S602-R690 PolarHBondContact O-N 3.19Å
603	V	81.2	Confident	59.6	Low	11.6667 Å²	11.6667	64.2 Å²	64.2	7%	0.071	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	133	176.9	-175.9	0	0	0	0	108.9	V601 T605 W619 T620 I668 V670 I689	V601-V603 HydrophobicContact CG1-CG2 4.5Å; V603-T605 PolarHBondContact O-N 3.1Å; V603-W619 CarbonylContact O-C 3.39Å; V603-W619 VanDerWaalsContact O-CA 3.31Å; V603-W619 WeakPolarHBondContact O-CA 3.41Å; V603-T620 PolarHBondContact N-O 3.17Å; V603-T620 PolarHBondContact O-N 3.13Å; V603-T620 PolarHBondContact O-OG1 2.99Å; V603-I668 HydrophobicContact CG2-CG2 3.79Å; V603-V670 HydrophobicContact CG1-CG2 4.17Å; V603-V670 HydrophobicContact CG2-CG2 4.1Å; V603-I689 HydrophobicContact CG2-CG1 4.49Å; V603-I689 HydrophobicContact CG2-CG2 4.26Å
604	P	69.3	Low	58.7	Low	35.3333 Å²	35.3333	68.5 Å²	68.5	23%	0.229	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	135.6	175.3	11.6	-12.8	0	0	0	111.5	W619	P604-W619 HydrophobicContact CG-CE3 4.41Å; P604-W619 HydrophobicContact CG-CZ3 4.32Å
605	T	60.5	Low	57.5	Low	52.3333 Å²	52.3333	76.3 Å²	76.3	32%	0.321	44%	0.436	S	S	.	.			trans	-103.8	142.4	177.5	46.8	0	0	0	0	112.8	V603 S607 T618 T620	V603-T605 PolarHBondContact O-N 3.1Å; T605-S607 PolarHBondContact O-N 3.36Å; T605-S607 VanDerWaalsContact O-N 3.16Å; T605-T618 PolarHBondContact N-O 2.77Å; T605-T618 PolarHBondContact O-OG1 2.83Å; T605-T618 VanDerWaalsContact OG1-C 3.28Å; T605-T618 VanDerWaalsContact OG1-CB 3.3Å; T605-T618 WeakPolarHBondContact OG1-CB 3.33Å; T605-T618 PolarHBondContact OG1-O 3.16Å; T605-T618 PolarHBondContact OG1-OG1 3.22Å; T605-T620 HydrophobicContact CG2-CG2 3.4Å; T605-T620 WeakPolarHBondContact CG2-OG1 3.25Å
606	L	52.4	Low	56	Low	139.333 Å²	139.333	77.6 Å²	77.6	73%	0.729	46%	0.457	S	S	*	.			trans	-72.2	106.2	170.2	-143.2	74.3	0	0	0	109.3	S608	L606-S608 PolarHBondContact O-N 3.26Å
607	S	44.8	Very low	54.7	Low	89.6667 Å²	89.6667	79.2 Å²	79.2	63%	0.627	48%	0.48	S	S	*	.			trans	-67.8	116.9	173.3	52.9	0	0	0	0	110.3	T605 L609	T605-S607 PolarHBondContact O-N 3.36Å; T605-S607 VanDerWaalsContact O-N 3.16Å; S607-L609 PolarHBondContact O-N 3.06Å
608	S	35.1	Very low	53.5	Low	100 Å²	100	82.5 Å²	82.5	70%	0.699	50%	0.5	S	S	*	.			trans	-58.4	136	172.2	53.5	0	0	0	0	111.3	L606 S610	L606-S608 PolarHBondContact O-N 3.26Å; S608-S610 VanDerWaalsContact C-N 3.26Å; S608-S610 PolarHBondContact O-N 3.15Å
609	L	33.8	Very low	52.7	Low	184.667 Å²	184.667	84.6 Å²	84.6	97%	0.967	51%	0.507	S	S	*	.	S	Bend	trans	-56.2	53.4	-174.5	-101	85	0	0	0	116.4	S607	S607-L609 PolarHBondContact O-N 3.06Å
610	S	33.8	Very low	52.1	Low	97.3333 Å²	97.3333	87.6 Å²	87.6	68%	0.681	53%	0.526	S	S	*	.			trans	-149.3	56.2	175.8	63	0	0	0	0	113.1	S608	S608-S610 VanDerWaalsContact C-N 3.26Å; S608-S610 PolarHBondContact O-N 3.15Å
611	S	31.8	Very low	51.8	Low	112.667 Å²	112.667	88.3 Å²	88.3	79%	0.788	53%	0.533	S	S	*	.			trans	-174.6	99.3	148.3	29.8	0	0	0	0	109.9	N613	S611-N613 PolarHBondContact O-N 2.89Å
612	S	30.7	Very low	51.5	Low	108.667 Å²	108.667	90.2 Å²	90.2	76%	0.76	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	140.9	160.8	45	0	0	0	0	109.7
613	N	31.6	Very low	51.3	Low	155 Å²	155	92.8 Å²	92.8	83%	0.829	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	97.2	38.1	168.7	-54.5	-11.4	0	0	0	118.4	S611	S611-N613 PolarHBondContact O-N 2.89Å
614	K	32.3	Very low	51.2	Low	198.667 Å²	198.667	93.1 Å²	93.1	86%	0.864	56%	0.563	S	S	*	*			trans	-136.7	103.5	153.2	-87.5	178.8	-177.4	175.9	0	111.8	G616	K614-G616 PolarHBondContact O-N 3.11Å; K614-G616 VanDerWaalsContact O-N 3.13Å
615	I	31.7	Very low	51.7	Low	180.667 Å²	180.667	93.4 Å²	93.4	93%	0.926	57%	0.565	S	S	*	*			trans	-72.9	98.6	174.7	-60.9	161.6	0	0	0	108.1
616	G	35.5	Very low	52.7	Low	56.6667 Å²	56.6667	91 Å²	91	58%	0.584	55%	0.55	S	S	*	.	S	Bend	trans	168.3	103.1	176.9	0	0	0	0	0	110.6	K614 T618	K614-G616 PolarHBondContact O-N 3.11Å; K614-G616 VanDerWaalsContact O-N 3.13Å; G616-T618 PolarHBondContact O-N 3.12Å
617	G	47.4	Very low	53.8	Low	57.3333 Å²	57.3333	85.5 Å²	85.5	59%	0.591	52%	0.523	S	S	*	.			trans	-54.9	134.5	178.6	0	0	0	0	0	111.2	W619	G617-W619 VanDerWaalsContact O-CD1 3.23Å
618	T	55.2	Low	55.2	Low	73.6667 Å²	73.6667	81.9 Å²	81.9	45%	0.452	50%	0.497	S	S	.	.			trans	-81.5	135.3	179.2	46.3	0	0	0	0	110	T605 G616	T605-T618 PolarHBondContact N-O 2.77Å; T605-T618 PolarHBondContact O-OG1 2.83Å; T605-T618 VanDerWaalsContact OG1-C 3.28Å; T605-T618 VanDerWaalsContact OG1-CB 3.3Å; T605-T618 WeakPolarHBondContact OG1-CB 3.33Å; T605-T618 PolarHBondContact OG1-O 3.16Å; T605-T618 PolarHBondContact OG1-OG1 3.22Å; G616-T618 PolarHBondContact O-N 3.12Å
619	W	66.4	Low	56.2	Low	67.6667 Å²	67.6667	83.7 Å²	83.7	26%	0.256	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	130.4	177.7	-62.8	62.8	0	0	0	108.8	S602 V603 P604 G617 T621 H688 R690	S602-W619 VanDerWaalsContact CB-CE3 3.46Å; V603-W619 CarbonylContact O-C 3.39Å; V603-W619 VanDerWaalsContact O-CA 3.31Å; V603-W619 WeakPolarHBondContact O-CA 3.41Å; P604-W619 HydrophobicContact CG-CE3 4.41Å; P604-W619 HydrophobicContact CG-CZ3 4.32Å; G617-W619 VanDerWaalsContact O-CD1 3.23Å; W619-T621 PolarHBondContact O-N 3.4Å; W619-H688 VanDerWaalsContact CH2-O 3.31Å; W619-H688 WeakPolarHBondContact CH2-O 3.31Å; W619-H688 VanDerWaalsContact CZ3-O 3.24Å; W619-H688 WeakPolarHBondContact CZ3-O 3.29Å; W619-R690 HydrophobicContact CE3-CB 4.41Å; W619-R690 HydrophobicContact CH2-CB 4.32Å; W619-R690 HydrophobicContact CZ3-CB 3.7Å
620	T	73	Confident	56.9	Low	65.6667 Å²	65.6667	77.2 Å²	77.2	40%	0.403	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	113.9	163.3	36.1	0	0	0	0	108.8	S602 V603 T605	S602-T620 CarbonylContact C-O 3.55Å; S602-T620 WeakPolarHBondContact CA-O 3.29Å; V603-T620 PolarHBondContact N-O 3.17Å; V603-T620 PolarHBondContact O-N 3.13Å; V603-T620 PolarHBondContact O-OG1 2.99Å; T605-T620 HydrophobicContact CG2-CG2 3.4Å; T605-T620 WeakPolarHBondContact CG2-OG1 3.25Å
621	T	77	Confident	57	Low	59.6667 Å²	59.6667	82 Å²	82	37%	0.366	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.6	175.1	-56.8	0	0	0	0	109.9	E600 V601 S602 W619	E600-T621 HydrophobicContact CB-CG2 3.97Å; E600-T621 HydrophobicContact CG-CG2 4.2Å; V601-T621 CarbonylContact O-C 3.43Å; V601-T621 WeakPolarHBondContact O-CA 3.32Å; S602-T621 WeakPolarHBondContact CB-OG1 3.3Å; S602-T621 WeakPolarHBondContact OG-CG2 3.3Å; S602-T621 PolarHBondContact OG-OG1 3.37Å; W619-T621 PolarHBondContact O-N 3.4Å
622	T	77.1	Confident	57.3	Low	43.3333 Å²	43.3333	83.7 Å²	83.7	27%	0.266	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	133.6	172.8	50.1	0	0	0	0	108.5	E600 V601	E600-T622 CarbonylContact C-O 3.54Å; E600-T622 WeakPolarHBondContact CA-O 3.35Å; V601-T622 PolarHBondContact N-O 3.29Å; V601-T622 PolarHBondContact O-N 2.89Å; V601-T622 PolarHBondContact O-OG1 3.07Å; V601-T622 VanDerWaalsContact O-OG1 3.1Å
623	S	77.1	Confident	57.5	Low	59 Å²	59	84.6 Å²	84.6	41%	0.413	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	138.4	177.2	76	0	0	0	0	112.2	E598 L599	E598-S623 VanDerWaalsContact OE1-CB 3.28Å; E598-S623 WeakPolarHBondContact OE1-CB 3.44Å; E598-S623 PolarHBondContact OE1-OG 3.26Å; L599-S623 CarbonylContact O-C 3.53Å; L599-S623 VanDerWaalsContact O-CA 3.3Å; L599-S623 WeakPolarHBondContact O-CA 2.99Å
624	F	79.7	Confident	57.5	Low	17 Å²	17	84.4 Å²	84.4	8%	0.075	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	120.8	-179.6	-58.4	-91.6	0	0	0	109.2	E598 L599 V601 L626 A666 I668	E598-F624 CarbonylContact C-O 3.52Å; E598-F624 WeakPolarHBondContact CA-O 3.41Å; L599-F624 HydrophobicContact CB-CB 4.4Å; L599-F624 PolarHBondContact N-O 3.38Å; L599-F624 PolarHBondContact O-N 3.08Å; V601-F624 HydrophobicContact CG2-CD2 4.36Å; V601-F624 HydrophobicContact CG2-CE2 4.11Å; F624-L626 HydrophobicContact CB-CD2 4.28Å; F624-L626 PolarHBondContact O-N 3.48Å; F624-A666 HydrophobicContact CD1-CB 4.01Å; F624-A666 HydrophobicContact CE1-CB 3.65Å; F624-I668 HydrophobicContact CE2-CD1 3.61Å; F624-I668 HydrophobicContact CE2-CG1 3.75Å; F624-I668 HydrophobicContact CZ-CD1 3.84Å; F624-I668 HydrophobicContact CZ-CG1 3.49Å; F624-I668 VanDerWaalsContact CZ-CG1 3.45Å
625	T	78.7	Confident	57.3	Low	43.3333 Å²	43.3333	83.5 Å²	83.5	27%	0.266	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	120.2	172.5	-47.4	0	0	0	0	109.4	F596 M597 L655 L696	F596-T625 HydrophobicContact CD1-CG2 4.47Å; M597-T625 CarbonylContact O-C 3.56Å; M597-T625 WeakPolarHBondContact O-CA 3.27Å; T625-L655 HydrophobicContact CG2-CD1 4.14Å; T625-L655 PolarHBondContact O-N 3.18Å; T625-L696 HydrophobicContact CG2-CD1 4.34Å
626	L	81.7	Confident	57.3	Low	0 Å²	0	80.3 Å²	80.3	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	140	-176.7	-53.4	179.4	0	0	0	110.4	F528 L531 F596 M597 L599 F624 F652 Y653 C654 L693	F528-L626 HydrophobicContact CD1-CD2 4.35Å; F528-L626 HydrophobicContact CE1-CD2 3.62Å; F528-L626 HydrophobicContact CE2-CD1 4.1Å; F528-L626 HydrophobicContact CE2-CD2 3.95Å; F528-L626 HydrophobicContact CZ-CD1 3.86Å; F528-L626 HydrophobicContact CZ-CD2 3.39Å; F528-L626 VanDerWaalsContact CZ-CD2 3.43Å; F528-L626 HydrophobicContact CZ-CG 4.28Å; L531-L626 HydrophobicContact CB-CD1 4.1Å; L531-L626 HydrophobicContact CD2-CD1 3.63Å; L531-L626 HydrophobicContact CG-CD1 4.46Å; F596-L626 WeakPolarHBondContact CA-O 3.25Å; M597-L626 HydrophobicContact CB-CB 4.35Å; M597-L626 PolarHBondContact N-O 3.38Å; M597-L626 PolarHBondContact O-N 2.86Å; L599-L626 HydrophobicContact CB-CD1 3.98Å; L599-L626 HydrophobicContact CB-CG 4.44Å; F624-L626 HydrophobicContact CB-CD2 4.28Å; F624-L626 PolarHBondContact O-N 3.48Å; L626-F652 HydrophobicContact CB-CB 4.19Å; L626-Y653 CarbonylContact C-O 3.55Å; L626-Y653 VanDerWaalsContact CA-O 3.3Å; L626-Y653 WeakPolarHBondContact CA-O 3.39Å; L626-C654 HydrophobicContact CD2-CB 4.16Å; L626-L693 HydrophobicContact CD1-CD1 4.24Å
627	S	76.1	Confident	56.9	Low	24.3333 Å²	24.3333	87.5 Å²	87.5	17%	0.17	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	161.7	174.4	67	0	0	0	0	112.8	I595 F652 Y653 L655	I595-S627 WeakPolarHBondContact O-CA 3.35Å; S627-F652 WeakPolarHBondContact O-CA 3.42Å; S627-Y653 PolarHBondContact N-O 3.07Å; S627-Y653 PolarHBondContact O-N 2.81Å; S627-Y653 VanDerWaalsContact O-N 3.09Å; S627-L655 WeakPolarHBondContact OG-CD1 3.14Å; S627-L655 WeakPolarHBondContact OG-CG 3.28Å
628	T	73.1	Confident	56	Low	14.3333 Å²	14.3333	89.6 Å²	89.6	9%	0.088	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	134	172.8	86.7	0	0	0	0	110.6	I595 L630 V650 N651 F652	I595-T628 HydrophobicContact CB-CG2 4.22Å; I595-T628 HydrophobicContact CD1-CG2 4.32Å; I595-T628 HydrophobicContact CG1-CG2 4.48Å; T628-L630 HydrophobicContact CG2-CD2 3.79Å; T628-L630 HydrophobicContact CG2-CG 4.29Å; T628-L630 PolarHBondContact O-N 3.15Å; T628-V650 HydrophobicContact CG2-CG1 3.94Å; T628-N651 VanDerWaalsContact CB-O 3.32Å; T628-N651 WeakPolarHBondContact CB-O 3.43Å; T628-N651 WeakPolarHBondContact CG2-O 3.45Å; T628-N651 PolarHBondContact OG1-O 3.34Å; T628-F652 HydrophobicContact CG2-CB 4.31Å; T628-F652 HydrophobicContact CG2-CD1 3.6Å; T628-F652 HydrophobicContact CG2-CD2 4.09Å; T628-F652 HydrophobicContact CG2-CE1 3.28Å; T628-F652 HydrophobicContact CG2-CE2 4.01Å; T628-F652 HydrophobicContact CG2-CG 4.09Å; T628-F652 VanDerWaalsContact CG2-CG 3.47Å; T628-F652 HydrophobicContact CG2-CZ 3.5Å; T628-F652 VanDerWaalsContact CG2-CZ 3.47Å
629	E	56.9	Low	54.8	Low	137 Å²	137	92.3 Å²	92.3	64%	0.64	47%	0.473	S	S	*	.			trans	-82.6	106.4	169.6	-84.7	-168	159	0	0	110.2	R631 Y653	E629-R631 VanDerWaalsContact C-N 3.25Å; E629-R631 PolarHBondContact O-N 3.1Å; E629-R631 VanDerWaalsContact O-N 3.13Å; E629-R631 WeakPolarHBondContact OE1-CD 3.44Å; E629-Y653 HydrophobicContact CB-CD2 4.32Å; E629-Y653 HydrophobicContact CB-CE2 4.37Å; E629-Y653 HydrophobicContact CG-CD2 4Å; E629-Y653 HydrophobicContact CG-CE2 4.3Å
630	L	47.3	Very low	53.1	Low	48.6667 Å²	48.6667	98.3 Å²	98.3	26%	0.255	50%	0.501	S	S	.	.			trans	-74.8	-11.1	177.3	-83.2	169.5	0	0	0	114	M542 L591 I595 T628 N632 Q633 F634 V650	M542-L630 HydrophobicContact CE-CD1 3.21Å; M542-L630 HydrophobicContact SD-CD1 4.08Å; L591-L630 HydrophobicContact CD2-CD1 3.83Å; I595-L630 HydrophobicContact CD1-CD1 4.03Å; I595-L630 HydrophobicContact CG1-CD1 4.1Å; T628-L630 HydrophobicContact CG2-CD2 3.79Å; T628-L630 HydrophobicContact CG2-CG 4.29Å; T628-L630 PolarHBondContact O-N 3.15Å; L630-N632 VanDerWaalsContact C-N 3.29Å; L630-N632 PolarHBondContact O-N 3.27Å; L630-N632 VanDerWaalsContact O-N 3.16Å; L630-Q633 PolarHBondContact O-N 3.11Å; L630-F634 HydrophobicContact CB-CD2 3.85Å; L630-F634 HydrophobicContact CB-CE2 3.89Å; L630-F634 HydrophobicContact CD1-CE2 4.11Å; L630-F634 HydrophobicContact CD2-CD2 4.45Å; L630-F634 HydrophobicContact CD2-CE2 3.7Å; L630-F634 HydrophobicContact CG-CE2 4.09Å; L630-F634 WeakPolarHBondContact O-CD2 3.46Å; L630-F634 PolarHBondContact O-N 3.22Å; L630-V650 HydrophobicContact CD2-CG1 4.42Å
631	R	37.6	Very low	51	Low	199.333 Å²	199.333	107.4 Å²	107.4	75%	0.752	53%	0.528	S	S	*	.	H	α-helix	trans	-65.5	-25.1	-167.3	-138.2	173	-179	-179.3	-0.6	114.6	E629 Q633	E629-R631 VanDerWaalsContact C-N 3.25Å; E629-R631 PolarHBondContact O-N 3.1Å; E629-R631 VanDerWaalsContact O-N 3.13Å; E629-R631 WeakPolarHBondContact OE1-CD 3.44Å; R631-Q633 VanDerWaalsContact C-N 3.31Å; R631-Q633 PolarHBondContact O-N 3.06Å
632	N	36.6	Very low	48.8	Very low	147.667 Å²	147.667	113 Å²	113	79%	0.79	55%	0.547	S	S	*	.	H	α-helix	trans	-85.9	1.8	-177.3	-72.7	-16.2	0	0	0	115.1	L630	L630-N632 VanDerWaalsContact C-N 3.29Å; L630-N632 PolarHBondContact O-N 3.27Å; L630-N632 VanDerWaalsContact O-N 3.16Å
633	Q	35.5	Very low	46.7	Very low	126.667 Å²	126.667	119.7 Å²	119.7	59%	0.592	58%	0.576	S	S	*	*	H	α-helix	trans	-105.5	-11.4	177.6	-67.3	-166.2	8.6	0	0	115	L630 R631	L630-Q633 PolarHBondContact O-N 3.11Å; R631-Q633 VanDerWaalsContact C-N 3.31Å; R631-Q633 PolarHBondContact O-N 3.06Å
634	F	32.1	Very low	44.7	Very low	152.333 Å²	152.333	124.7 Å²	124.7	67%	0.668	59%	0.592	S	S	*	*	H	α-helix	trans	-108.4	4.7	-171.4	-79.6	-72.4	0	0	0	116.6	L630 V636	L630-F634 HydrophobicContact CB-CD2 3.85Å; L630-F634 HydrophobicContact CB-CE2 3.89Å; L630-F634 HydrophobicContact CD1-CE2 4.11Å; L630-F634 HydrophobicContact CD2-CD2 4.45Å; L630-F634 HydrophobicContact CD2-CE2 3.7Å; L630-F634 HydrophobicContact CG-CE2 4.09Å; L630-F634 WeakPolarHBondContact O-CD2 3.46Å; L630-F634 PolarHBondContact O-N 3.22Å; F634-V636 PolarHBondContact O-N 3.08Å
635	E	27.3	Very low	42.7	Very low	179.333 Å²	179.333	129.7 Å²	129.7	84%	0.838	62%	0.62	S	S	*	*			trans	-101.7	62.5	170.8	-101.6	-174.9	-177.5	0	0	113.1
636	V	31.3	Very low	40.9	Very low	112.333 Å²	112.333	132.2 Å²	132.2	68%	0.681	63%	0.632	S	S	*	*			trans	-121.5	84.7	158.1	-172.8	0	0	0	0	108.8	F634 S638	F634-V636 PolarHBondContact O-N 3.08Å; V636-S638 VanDerWaalsContact C-N 3.28Å; V636-S638 PolarHBondContact O-N 3.22Å
637	K	28.1	Very low	39.1	Very low	208 Å²	208	137.1 Å²	137.1	90%	0.904	66%	0.658	S	S	*	*			trans	-66	86.4	166	-75.4	-178.3	177.6	176.4	0	110.5	T639	K637-T639 PolarHBondContact O-N 2.81Å
638	S	29	Very low	38.2	Very low	102 Å²	102	137.1 Å²	137.1	71%	0.713	66%	0.659	S	S	*	*	S	Bend	trans	-116.5	101.1	168	55.6	0	0	0	0	111.5	V636 K640	V636-S638 VanDerWaalsContact C-N 3.28Å; V636-S638 PolarHBondContact O-N 3.22Å; S638-K640 PolarHBondContact O-N 2.95Å
639	T	28.9	Very low	37.9	Very low	130.667 Å²	130.667	143.1 Å²	143.1	80%	0.802	68%	0.682	S	S	*	*			trans	-95.4	112.6	169	43.5	0	0	0	0	110.5	K637	K637-T639 PolarHBondContact O-N 2.81Å
640	K	30.5	Very low	38.5	Very low	193 Å²	193	137.6 Å²	137.6	84%	0.839	66%	0.657	S	S	*	*			trans	152.7	116.6	154	-83.6	164.5	-174.3	-177.6	0	111.8	S638 K642	S638-K640 PolarHBondContact O-N 2.95Å; K640-K642 PolarHBondContact O-N 3.44Å
641	R	28.7	Very low	40	Very low	256.667 Å²	256.667	138 Å²	138	97%	0.969	66%	0.66	S	S	*	*			trans	-18.2	97.6	165.9	-71.1	178.7	173.4	172.1	-3.2	112.8
642	K	30.8	Very low	41.9	Very low	177 Å²	177	128.7 Å²	128.7	77%	0.77	62%	0.624	S	S	*	*			trans	-98.7	122.6	159	-79.3	-175.9	174.5	179.7	0	108.3	K640 Q644	K640-K642 PolarHBondContact O-N 3.44Å; K642-Q644 PolarHBondContact O-N 3.14Å
643	Q	32.9	Very low	43.8	Very low	184.667 Å²	184.667	127 Å²	127	86%	0.863	61%	0.608	S	S	*	*			trans	-52.1	128.6	166.3	-83.6	163.2	-45.2	0	0	109.6	N645	Q643-N645 PolarHBondContact O-N 2.7Å
644	Q	35.2	Very low	45.7	Very low	164.333 Å²	164.333	122.5 Å²	122.5	77%	0.768	59%	0.59	S	S	*	*			trans	-81.4	116.1	179.2	-103.2	169	-33.5	0	0	109	K642 D646	K642-Q644 PolarHBondContact O-N 3.14Å; Q644-D646 PolarHBondContact O-N 3.18Å
645	N	39.2	Very low	47.3	Very low	122.333 Å²	122.333	118.9 Å²	118.9	65%	0.654	58%	0.577	S	S	*	*			trans	-69.3	112.9	173.2	-97.5	0.1	0	0	0	109.9	Q643 D647 A648	Q643-N645 PolarHBondContact O-N 2.7Å; N645-D647 VanDerWaalsContact C-N 3.28Å; N645-D647 PolarHBondContact O-N 2.87Å; N645-A648 PolarHBondContact O-N 3.14Å
646	D	41	Very low	48.5	Very low	95.3333 Å²	95.3333	114.3 Å²	114.3	51%	0.51	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.4	-18.7	-176.4	-98.6	-8.3	0	0	0	113.6	K536 Q644 A648	K536-D646 WeakPolarHBondContact CE-OD1 3.41Å; K536-D646 IonicContact NZ-OD1 2.67Å; K536-D646 PolarHBondContact NZ-OD1 2.79Å; K536-D646 IonicContact NZ-OD2 3.71Å; K536-D646 PolarHBondContact NZ-OD2 2.84Å; Q644-D646 PolarHBondContact O-N 3.18Å; D646-A648 VanDerWaalsContact C-N 3.32Å; D646-A648 PolarHBondContact O-N 3.26Å
647	D	43.3	Very low	48.9	Very low	103.333 Å²	103.333	114.6 Å²	114.6	55%	0.553	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	16.2	-172	-64.9	-33.4	0	0	0	115.5	N645 Y649	N645-D647 VanDerWaalsContact C-N 3.28Å; N645-D647 PolarHBondContact O-N 2.87Å; D647-Y649 VanDerWaalsContact O-CD2 3.31Å; D647-Y649 WeakPolarHBondContact O-CD2 3.28Å; D647-Y649 WeakPolarHBondContact O-CE2 3.45Å; D647-Y649 PolarHBondContact O-N 2.89Å
648	A	56	Low	49.3	Very low	24.3333 Å²	24.3333	114.7 Å²	114.7	20%	0.201	56%	0.56	C	S	.	*			trans	-69.7	143.1	178	0	0	0	0	0	112.3	R535 N645 D646	R535-A648 HydrophobicContact CB-CB 4.29Å; R535-A648 WeakPolarHBondContact CB-O 3.33Å; R535-A648 PolarHBondContact N-O 2.88Å; N645-A648 PolarHBondContact O-N 3.14Å; D646-A648 VanDerWaalsContact C-N 3.32Å; D646-A648 PolarHBondContact O-N 3.26Å
649	Y	66.9	Low	49.4	Very low	140.667 Å²	140.667	118.7 Å²	118.7	55%	0.552	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-102.4	151.3	171.7	-69.3	-92.5	0	0	0	111	L533 C534 D647	L533-Y649 CarbonylContact O-C 3.54Å; L533-Y649 VanDerWaalsContact O-CA 3.29Å; L533-Y649 WeakPolarHBondContact O-CA 3.38Å; C534-Y649 HydrophobicContact CB-CE1 4.27Å; D647-Y649 VanDerWaalsContact O-CD2 3.31Å; D647-Y649 WeakPolarHBondContact O-CD2 3.28Å; D647-Y649 WeakPolarHBondContact O-CE2 3.45Å; D647-Y649 PolarHBondContact O-N 2.89Å
650	V	70.2	Confident	49.4	Very low	20 Å²	20	119.4 Å²	119.4	12%	0.121	56%	0.561	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-111	119.9	172.4	-178.9	0	0	0	0	108	L533 R535 A538 T628 L630 F652	L533-V650 PolarHBondContact N-O 3.12Å; L533-V650 PolarHBondContact O-N 3.15Å; R535-V650 HydrophobicContact CB-CG2 4.19Å; R535-V650 HydrophobicContact CG-CG2 4.42Å; A538-V650 HydrophobicContact CB-CG2 4.24Å; T628-V650 HydrophobicContact CG2-CG1 3.94Å; L630-V650 HydrophobicContact CD2-CG1 4.42Å; V650-F652 HydrophobicContact CB-CE2 4.18Å; V650-F652 HydrophobicContact CG1-CD2 4.34Å; V650-F652 HydrophobicContact CG1-CE2 3.74Å; V650-F652 HydrophobicContact CG1-CZ 4.27Å; V650-F652 WeakPolarHBondContact O-CD2 3.41Å
651	N	78.1	Confident	49.4	Very low	59 Å²	59	117.1 Å²	117.1	32%	0.316	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.9	135.3	-179.3	-65.4	-3.5	0	0	0	110.8	L531 S532 T628 Y653	L531-N651 CarbonylContact O-C 3.51Å; L531-N651 WeakPolarHBondContact O-CA 3.36Å; S532-N651 PolarHBondContact OG-OD1 3Å; T628-N651 VanDerWaalsContact CB-O 3.32Å; T628-N651 WeakPolarHBondContact CB-O 3.43Å; T628-N651 WeakPolarHBondContact CG2-O 3.45Å; T628-N651 PolarHBondContact OG1-O 3.34Å; N651-Y653 HydrophobicContact CB-CE2 3.78Å; N651-Y653 PolarHBondContact ND2-OH 2.87Å; N651-Y653 VanDerWaalsContact ND2-OH 3.15Å
652	F	77.5	Confident	49.5	Very low	2 Å²	2	112.7 Å²	112.7	1%	0.009	55%	0.554	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.9	135.3	176	-69.6	-104	0	0	0	109.3	C530 L531 L533 I595 M597 L626 S627 T628 V650	C530-F652 WeakPolarHBondContact CA-O 3.42Å; L531-F652 HydrophobicContact CB-CB 4.21Å; L531-F652 HydrophobicContact CD2-CB 4.46Å; L531-F652 HydrophobicContact CG-CB 4.4Å; L531-F652 PolarHBondContact N-O 3.19Å; L531-F652 PolarHBondContact O-N 3.14Å; L533-F652 HydrophobicContact CB-CE2 4.18Å; L533-F652 HydrophobicContact CD1-CD2 4.1Å; L533-F652 HydrophobicContact CD1-CE2 3.75Å; L533-F652 HydrophobicContact CD1-CZ 4.38Å; L533-F652 HydrophobicContact CG-CD2 4.32Å; L533-F652 HydrophobicContact CG-CE2 4.16Å; I595-F652 HydrophobicContact CB-CE1 3.89Å; I595-F652 HydrophobicContact CB-CZ 4.31Å; I595-F652 HydrophobicContact CD1-CZ 4.25Å; I595-F652 HydrophobicContact CG2-CE1 3.86Å; I595-F652 HydrophobicContact CG2-CZ 4.2Å; M597-F652 HydrophobicContact CE-CB 4.11Å; M597-F652 HydrophobicContact CE-CD1 3.33Å; M597-F652 HydrophobicContact CE-CD2 3.59Å; M597-F652 VanDerWaalsContact CE-CD2 3.42Å; M597-F652 HydrophobicContact CE-CE1 3.42Å; M597-F652 VanDerWaalsContact CE-CE1 3.42Å; M597-F652 HydrophobicContact CE-CE2 3.72Å; M597-F652 HydrophobicContact CE-CG 3.4Å; M597-F652 VanDerWaalsContact CE-CG 3.47Å; M597-F652 HydrophobicContact CE-CZ 3.63Å; M597-F652 HydrophobicContact CG-CE1 4.36Å; M597-F652 HydrophobicContact SD-CE1 4.12Å; M597-F652 HydrophobicContact SD-CZ 4.24Å; L626-F652 HydrophobicContact CB-CB 4.19Å; S627-F652 WeakPolarHBondContact O-CA 3.42Å; T628-F652 HydrophobicContact CG2-CB 4.31Å; T628-F652 HydrophobicContact CG2-CD1 3.6Å; T628-F652 HydrophobicContact CG2-CD2 4.09Å; T628-F652 HydrophobicContact CG2-CE1 3.28Å; T628-F652 HydrophobicContact CG2-CE2 4.01Å; T628-F652 HydrophobicContact CG2-CG 4.09Å; T628-F652 VanDerWaalsContact CG2-CG 3.47Å; T628-F652 HydrophobicContact CG2-CZ 3.5Å; T628-F652 VanDerWaalsContact CG2-CZ 3.47Å; V650-F652 HydrophobicContact CB-CE2 4.18Å; V650-F652 HydrophobicContact CG1-CD2 4.34Å; V650-F652 HydrophobicContact CG1-CE2 3.74Å; V650-F652 HydrophobicContact CG1-CZ 4.27Å; V650-F652 WeakPolarHBondContact O-CD2 3.41Å
653	Y	78.2	Confident	49.7	Very low	112.667 Å²	112.667	109.4 Å²	109.4	44%	0.442	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.3	153.5	-177.1	-59.4	-83.1	0	0	0	110.4	C530 L626 S627 E629 N651	C530-Y653 HydrophobicContact CB-CD1 3.92Å; C530-Y653 HydrophobicContact CB-CE1 3.68Å; L626-Y653 CarbonylContact C-O 3.55Å; L626-Y653 VanDerWaalsContact CA-O 3.3Å; L626-Y653 WeakPolarHBondContact CA-O 3.39Å; S627-Y653 PolarHBondContact N-O 3.07Å; S627-Y653 PolarHBondContact O-N 2.81Å; S627-Y653 VanDerWaalsContact O-N 3.09Å; E629-Y653 HydrophobicContact CB-CD2 4.32Å; E629-Y653 HydrophobicContact CB-CE2 4.37Å; E629-Y653 HydrophobicContact CG-CD2 4Å; E629-Y653 HydrophobicContact CG-CE2 4.3Å; N651-Y653 HydrophobicContact CB-CE2 3.78Å; N651-Y653 PolarHBondContact ND2-OH 2.87Å; N651-Y653 VanDerWaalsContact ND2-OH 3.15Å
654	C	74.7	Confident	50	Low	32.3333 Å²	32.3333	107 Å²	107	22%	0.218	55%	0.547	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	132.9	179	-170.2	0	0	0	0	111.1	F528 L626 T656	F528-C654 HydrophobicContact CD1-CB 3.97Å; F528-C654 HydrophobicContact CE1-CB 4.22Å; L626-C654 HydrophobicContact CD2-CB 4.16Å; C654-T656 PolarHBondContact O-N 3.16Å
655	L	65.3	Low	50.8	Low	77.3333 Å²	77.3333	104.9 Å²	104.9	41%	0.405	54%	0.541	S	S	.	.			trans	-74.2	88.7	170.3	-89.8	149.4	0	0	0	109.8	F596 T625 S627	F596-L655 HydrophobicContact CD1-CD1 3.96Å; F596-L655 HydrophobicContact CE1-CD1 3.79Å; T625-L655 HydrophobicContact CG2-CD1 4.14Å; T625-L655 PolarHBondContact O-N 3.18Å; S627-L655 WeakPolarHBondContact OG-CD1 3.14Å; S627-L655 WeakPolarHBondContact OG-CG 3.28Å
656	T	53.1	Low	51.7	Low	83.3333 Å²	83.3333	100.7 Å²	100.7	51%	0.511	52%	0.523	S	S	.	.			trans	-82.4	126.3	166.1	51.4	0	0	0	0	109.4	C654 K658 A666	C654-T656 PolarHBondContact O-N 3.16Å; T656-K658 PolarHBondContact O-N 2.95Å; T656-K658 VanDerWaalsContact O-N 3.1Å; T656-A666 HydrophobicContact CG2-CB 3.92Å
657	N	38.7	Very low	53.3	Low	116.667 Å²	116.667	101.7 Å²	101.7	62%	0.624	52%	0.52	S	S	*	.			trans	-60.4	109.5	177.5	-90.4	-24.2	0	0	0	109.8	K659 I660	N657-K659 PolarHBondContact O-N 3.12Å; N657-I660 PolarHBondContact O-N 2.76Å
658	K	36.1	Very low	54.9	Low	212 Å²	212	97.3 Å²	97.3	92%	0.922	50%	0.497	S	S	*	.	S	Bend	trans	-62.5	13.7	178.4	-89.4	-175.8	176	174.7	0	115.6	T656	T656-K658 PolarHBondContact O-N 2.95Å; T656-K658 VanDerWaalsContact O-N 3.1Å
659	K	31.8	Very low	56	Low	184.667 Å²	184.667	101.5 Å²	101.5	80%	0.803	51%	0.512	S	S	*	.	S	Bend	trans	-135.5	59.4	178.8	-74.3	-175.5	-179.5	173.8	0	111.5	N657	N657-K659 PolarHBondContact O-N 3.12Å
660	I	30.1	Very low	56.7	Low	145 Å²	145	95 Å²	95	74%	0.744	49%	0.487	S	S	*	.	S	Bend	trans	-155.7	124.4	150.3	-77.8	155.8	0	0	0	107.4	N657	N657-I660 PolarHBondContact O-N 2.76Å
661	N	29.3	Very low	57.1	Low	146 Å²	146	98 Å²	98	78%	0.781	50%	0.503	S	S	*	.			trans	-15.9	130.4	178.9	-60.2	-20.6	0	0	0	117.7	S663	N661-S663 PolarHBondContact O-N 3.06Å
662	N	32.1	Very low	57	Low	164 Å²	164	95.6 Å²	95.6	88%	0.877	49%	0.489	S	S	*	.	S	Bend	trans	-12.7	106.1	163.3	-64.6	-9	0	0	0	115.9
663	S	34.3	Very low	56.2	Low	107.667 Å²	107.667	99.4 Å²	99.4	75%	0.753	51%	0.51	S	S	*	.			trans	141.1	3.9	148.8	66.2	0	0	0	0	117.1	N661 D665	N661-S663 PolarHBondContact O-N 3.06Å; S663-D665 PolarHBondContact O-N 3.22Å
664	N	39.4	Very low	55	Low	135 Å²	135	98.2 Å²	98.2	72%	0.722	51%	0.508	S	S	*	.			trans	-98.6	78.2	179.1	-72.7	-8.5	0	0	0	112.6
665	D	51.9	Low	53.3	Low	120 Å²	120	104.5 Å²	104.5	64%	0.642	53%	0.534	S	S	*	.			trans	-62.7	140.6	158.3	-77.6	-36.9	0	0	0	109.5	S663 Y667	S663-D665 PolarHBondContact O-N 3.22Å; D665-Y667 VanDerWaalsContact O-CD1 3.29Å; D665-Y667 WeakPolarHBondContact O-CD1 3.32Å; D665-Y667 PolarHBondContact O-N 3.08Å; D665-Y667 VanDerWaalsContact O-N 3.13Å
666	A	58.5	Low	51.8	Low	33.6667 Å²	33.6667	108.8 Å²	108.8	28%	0.278	56%	0.556	S	S	.	*			trans	-81.4	97.2	-171.8	0	0	0	0	0	110.3	F624 T656	F624-A666 HydrophobicContact CD1-CB 4.01Å; F624-A666 HydrophobicContact CE1-CB 3.65Å; T656-A666 HydrophobicContact CG2-CB 3.92Å
667	Y	73.2	Confident	50.8	Low	116.333 Å²	116.333	112.3 Å²	112.3	46%	0.456	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.3	159.7	-178.5	71.1	-92.7	0	0	0	113.8	N525 L526 D665 Q669	N525-Y667 HydrophobicContact CB-CD2 3.85Å; N525-Y667 HydrophobicContact CB-CG 4.27Å; N525-Y667 WeakPolarHBondContact OD1-CD2 3.49Å; N525-Y667 WeakPolarHBondContact OD1-CE2 3.34Å; L526-Y667 CarbonylContact O-C 3.59Å; L526-Y667 VanDerWaalsContact O-CA 3.28Å; L526-Y667 WeakPolarHBondContact O-CA 3.43Å; D665-Y667 VanDerWaalsContact O-CD1 3.29Å; D665-Y667 WeakPolarHBondContact O-CD1 3.32Å; D665-Y667 PolarHBondContact O-N 3.08Å; D665-Y667 VanDerWaalsContact O-N 3.13Å; Y667-Q669 HydrophobicContact CE2-CB 4.49Å
668	I	77.9	Confident	50.5	Low	10.3333 Å²	10.3333	111.6 Å²	111.6	5%	0.053	57%	0.571	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.5	123	177.7	-49.9	162.8	0	0	0	108.2	N525 L526 V601 V603 F624	N525-I668 CarbonylContact C-O 3.53Å; N525-I668 WeakPolarHBondContact CA-O 3.44Å; L526-I668 HydrophobicContact CB-CB 4.37Å; L526-I668 WeakPolarHBondContact CD1-O 3.26Å; L526-I668 PolarHBondContact N-O 3.2Å; L526-I668 PolarHBondContact O-N 3.15Å; V601-I668 HydrophobicContact CB-CD1 3.59Å; V601-I668 HydrophobicContact CG1-CD1 3.68Å; V601-I668 HydrophobicContact CG1-CG2 4.44Å; V601-I668 HydrophobicContact CG2-CD1 3.52Å; V601-I668 VanDerWaalsContact CG2-CD1 3.5Å; V603-I668 HydrophobicContact CG2-CG2 3.79Å; F624-I668 HydrophobicContact CE2-CD1 3.61Å; F624-I668 HydrophobicContact CE2-CG1 3.75Å; F624-I668 HydrophobicContact CZ-CD1 3.84Å; F624-I668 HydrophobicContact CZ-CG1 3.49Å; F624-I668 VanDerWaalsContact CZ-CG1 3.45Å
669	Q	79.6	Confident	50.2	Low	113.333 Å²	113.333	108.4 Å²	108.4	53%	0.53	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.7	122	178.5	-166.9	173	18.4	0	0	111	Y667 I771	Y667-Q669 HydrophobicContact CE2-CB 4.49Å; Q669-I771 HydrophobicContact CG-CD1 3.88Å; Q669-I771 VanDerWaalsContact NE2-CD1 3.3Å
670	V	81.2	Confident	50.3	Low	2.66667 Å²	2.66667	106.8 Å²	106.8	2%	0.016	56%	0.564	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.4	128.7	172.3	171.7	0	0	0	0	108.8	G523 A524 L526 V603 F672 I689 P721	G523-V670 CarbonylContact C-O 3.51Å; G523-V670 WeakPolarHBondContact CA-O 3.41Å; A524-V670 PolarHBondContact N-O 3.08Å; A524-V670 PolarHBondContact O-N 2.84Å; L526-V670 HydrophobicContact CD1-CB 3.84Å; L526-V670 HydrophobicContact CD1-CG2 3.29Å; V603-V670 HydrophobicContact CG1-CG2 4.17Å; V603-V670 HydrophobicContact CG2-CG2 4.1Å; V670-F672 HydrophobicContact CG1-CD1 4.15Å; V670-F672 HydrophobicContact CG1-CE1 3.79Å; V670-F672 HydrophobicContact CG1-CZ 4.46Å; V670-I689 HydrophobicContact CB-CD1 4.44Å; V670-I689 HydrophobicContact CG1-CD1 4.01Å; V670-I689 HydrophobicContact CG2-CD1 3.67Å; V670-I689 HydrophobicContact CG2-CG1 4.35Å; V670-P721 HydrophobicContact CG1-CB 4.43Å
671	N	79.1	Confident	50.4	Low	85 Å²	85	107.7 Å²	107.7	46%	0.455	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.6	128.5	-177.2	-162.7	-4.7	0	0	0	109.3	K522 N673	K522-N671 PolarHBondContact O-OD1 3.37Å; K522-N671 VanDerWaalsContact O-OD1 3.09Å; N671-N673 WeakPolarHBondContact OD1-CB 3.36Å; N671-N673 PolarHBondContact OD1-N 2.97Å; N671-N673 VanDerWaalsContact OD1-N 3.12Å
672	F	75.9	Confident	50.7	Low	8.33333 Å²	8.33333	105.9 Å²	105.9	4%	0.037	56%	0.557	C	S	.	*			trans	-97.4	8	-176.1	-54.5	-52.9	0	0	0	114	L521 K522 G523 A524 V670 H674 P721 I724 R725 I728	L521-F672 HydrophobicContact CD2-CD2 4.01Å; L521-F672 HydrophobicContact CD2-CE2 3.77Å; L521-F672 HydrophobicContact CG-CD2 4.05Å; L521-F672 HydrophobicContact CG-CE2 4.09Å; K522-F672 WeakPolarHBondContact O-CA 3.06Å; K522-F672 PolarHBondContact O-N 2.82Å; G523-F672 VanDerWaalsContact CA-CD2 3.43Å; G523-F672 WeakPolarHBondContact O-CE2 3.15Å; A524-F672 HydrophobicContact CB-CE2 4.11Å; A524-F672 HydrophobicContact CB-CZ 3.92Å; V670-F672 HydrophobicContact CG1-CD1 4.15Å; V670-F672 HydrophobicContact CG1-CE1 3.79Å; V670-F672 HydrophobicContact CG1-CZ 4.46Å; F672-H674 PolarHBondContact O-N 3.07Å; F672-P721 HydrophobicContact CD1-CB 4.08Å; F672-P721 HydrophobicContact CE1-CB 4.13Å; F672-P721 VanDerWaalsContact CE1-O 3.26Å; F672-P721 WeakPolarHBondContact CE1-O 3.33Å; F672-I724 HydrophobicContact CE1-CB 4.18Å; F672-I724 HydrophobicContact CE1-CG2 4.4Å; F672-I724 HydrophobicContact CZ-CB 4.02Å; F672-I724 HydrophobicContact CZ-CG2 3.82Å; F672-R725 VanDerWaalsContact CB-CZ 3.45Å; F672-R725 VanDerWaalsContact CB-NH2 3.26Å; F672-R725 HydrophobicContact CD1-CB 4.31Å; F672-R725 HydrophobicContact CD2-CB 4.49Å; F672-R725 HydrophobicContact CD2-CG 4.27Å; F672-R725 HydrophobicContact CE1-CB 4.31Å; F672-R725 HydrophobicContact CE2-CB 4.29Å; F672-R725 HydrophobicContact CE2-CG 4.45Å; F672-R725 HydrophobicContact CG-CB 4.49Å; F672-R725 HydrophobicContact CG-CG 4.41Å; F672-R725 HydrophobicContact CZ-CB 4.19Å; F672-R725 PolarHBondContact O-NH2 2.94Å; F672-I728 HydrophobicContact CE2-CD1 4.4Å; F672-I728 HydrophobicContact CZ-CD1 4.35Å
673	N	60.1	Low	50.8	Low	81 Å²	81	103.8 Å²	103.8	43%	0.433	55%	0.546	S	S	.	.			trans	-73	69.6	178.4	-76.5	-2.9	0	0	0	112.1	N671 Q675	N671-N673 WeakPolarHBondContact OD1-CB 3.36Å; N671-N673 PolarHBondContact OD1-N 2.97Å; N671-N673 VanDerWaalsContact OD1-N 3.12Å; N673-Q675 PolarHBondContact O-N 3.25Å
674	H	52.8	Low	51	Low	87 Å²	87	105.8 Å²	105.8	40%	0.403	55%	0.548	S	S	.	.			trans	-89.4	97.3	161.7	-74.7	-72.4	0	0	0	108.8	F672 L676 N687	F672-H674 PolarHBondContact O-N 3.07Å; H674-L676 VanDerWaalsContact C-N 3.31Å; H674-L676 PolarHBondContact O-N 3.13Å; H674-L676 VanDerWaalsContact O-N 3.11Å; H674-N687 PolarHBondContact CE1-ND2 2.76Å; H674-N687 VanDerWaalsContact CE1-ND2 3.28Å; H674-N687 PolarHBondContact CE1-OD1 2.85Å
675	Q	39.1	Very low	51.1	Low	166 Å²	166	105.8 Å²	105.8	78%	0.776	54%	0.543	S	S	*	.			trans	-69.8	99.6	158.8	-83	-176.4	-46.9	0	0	107.6	N673 H677	N673-Q675 PolarHBondContact O-N 3.25Å; Q675-H677 VanDerWaalsContact C-N 3.27Å; Q675-H677 PolarHBondContact O-N 3.14Å
676	L	34.7	Very low	51	Low	166.667 Å²	166.667	104.7 Å²	104.7	87%	0.873	54%	0.537	S	S	*	.			trans	-64	86	163.4	-82.7	150.3	0	0	0	108.3	H674 S678	H674-L676 VanDerWaalsContact C-N 3.31Å; H674-L676 PolarHBondContact O-N 3.13Å; H674-L676 VanDerWaalsContact O-N 3.11Å; L676-S678 VanDerWaalsContact C-N 3.32Å; L676-S678 PolarHBondContact O-N 3.02Å; L676-S678 VanDerWaalsContact O-N 3.11Å
677	H	31.8	Very low	51.3	Low	156 Å²	156	106.5 Å²	106.5	72%	0.722	54%	0.542	S	S	*	.			trans	-67.7	100	159.7	-84.5	-72.9	0	0	0	107.5	Q675 N679	Q675-H677 VanDerWaalsContact C-N 3.27Å; Q675-H677 PolarHBondContact O-N 3.14Å; H677-N679 PolarHBondContact O-N 3.02Å
678	S	31	Very low	51.4	Low	102.333 Å²	102.333	103.8 Å²	103.8	72%	0.716	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	116.9	168.1	51.9	0	0	0	0	109.2	L676	L676-S678 VanDerWaalsContact C-N 3.32Å; L676-S678 PolarHBondContact O-N 3.02Å; L676-S678 VanDerWaalsContact O-N 3.11Å
679	N	30.8	Very low	51.5	Low	146.333 Å²	146.333	103.6 Å²	103.6	78%	0.783	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	150.2	10.3	150.3	-75.3	-13.3	0	0	0	114.7	H677 K681	H677-N679 PolarHBondContact O-N 3.02Å; N679-K681 PolarHBondContact O-N 2.94Å
680	D	33.1	Very low	51.6	Low	150.667 Å²	150.667	101 Å²	101	81%	0.806	52%	0.518	S	S	*	.			trans	-109.9	114.7	166.1	-80.3	-38.4	0	0	0	112.4	V682	D680-V682 VanDerWaalsContact C-N 3.28Å; D680-V682 HydrophobicContact CB-CG2 4.4Å; D680-V682 PolarHBondContact O-N 2.95Å
681	K	33.6	Very low	51.7	Low	163.667 Å²	163.667	101 Å²	101	71%	0.712	52%	0.518	S	S	*	.			trans	-69.3	93.8	170.2	-71	-175	177.9	-177.8	0	110.5	N679 N969 K971 T973	N679-K681 PolarHBondContact O-N 2.94Å; K681-N969 WeakPolarHBondContact CE-OD1 3.45Å; K681-N969 PolarHBondContact NZ-O 3.1Å; K681-K971 PolarHBondContact NZ-O 3.06Å; K681-T973 HydrophobicContact CD-CG2 4.05Å; K681-T973 PolarHBondContact NZ-OG1 2.77Å
682	V	34.2	Very low	51.8	Low	108.667 Å²	108.667	100.7 Å²	100.7	66%	0.659	51%	0.51	S	S	*	.			trans	-138.8	112.4	167.8	-173.5	0	0	0	0	112.5	D680 N684	D680-V682 VanDerWaalsContact C-N 3.28Å; D680-V682 HydrophobicContact CB-CG2 4.4Å; D680-V682 PolarHBondContact O-N 2.95Å; V682-N684 PolarHBondContact O-N 3.15Å
683	N	35.3	Very low	52.3	Low	119.667 Å²	119.667	100.3 Å²	100.3	64%	0.64	51%	0.509	S	S	*	.			trans	43.5	118.5	152.9	-74.2	-25.8	0	0	0	114.9	H685 D686	N683-H685 PolarHBondContact O-CD2 3.21Å; N683-H685 VanDerWaalsContact O-CD2 3.3Å; N683-H685 PolarHBondContact O-N 2.83Å; N683-D686 PolarHBondContact O-N 3.08Å
684	N	37.5	Very low	53.2	Low	149 Å²	149	97.8 Å²	97.8	80%	0.797	49%	0.494	S	S	*	.			trans	-52.8	66.5	173	-81.9	-17.6	0	0	0	113.3	V682 H688	V682-N684 PolarHBondContact O-N 3.15Å; N684-H688 PolarHBondContact O-CE1 2.81Å
685	H	42.6	Very low	54.5	Low	135.667 Å²	135.667	95.6 Å²	95.6	63%	0.628	48%	0.482	S	S	*	.			trans	-88	86.3	172.5	-71.8	-54.4	0	0	0	110.9	N683 N687	N683-H685 PolarHBondContact O-CD2 3.21Å; N683-H685 VanDerWaalsContact O-CD2 3.3Å; N683-H685 PolarHBondContact O-N 2.83Å; H685-N687 PolarHBondContact O-N 3.09Å
686	D	49.5	Very low	56.1	Low	95.3333 Å²	95.3333	88.7 Å²	88.7	51%	0.51	45%	0.451	S	S	.	.			trans	-69.3	64.9	-179.4	-73.5	-37.9	0	0	0	112.6	N683 H688	N683-D686 PolarHBondContact O-N 3.08Å; D686-H688 PolarHBondContact O-N 3.07Å; D686-H688 IonicContact OD1-ND1 2.83Å
687	N	64.1	Low	57.4	Low	71.6667 Å²	71.6667	82.6 Å²	82.6	38%	0.383	42%	0.422	S	S	.	.			trans	-81.2	23.6	177.4	-78.3	-16.5	0	0	0	113.9	H674 H685 P721	H674-N687 PolarHBondContact CE1-ND2 2.76Å; H674-N687 VanDerWaalsContact CE1-ND2 3.28Å; H674-N687 PolarHBondContact CE1-OD1 2.85Å; H685-N687 PolarHBondContact O-N 3.09Å; N687-P721 VanDerWaalsContact O-CD 3.23Å; N687-P721 WeakPolarHBondContact O-CD 3.26Å; N687-P721 WeakPolarHBondContact O-CG 3.16Å
688	H	76.2	Confident	58.6	Low	60.3333 Å²	60.3333	80.8 Å²	80.8	28%	0.279	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-91.5	138.2	-178.6	-60.6	60.6	0	0	0	111.7	W619 N684 D686 R690 F718	W619-H688 VanDerWaalsContact CH2-O 3.31Å; W619-H688 WeakPolarHBondContact CH2-O 3.31Å; W619-H688 VanDerWaalsContact CZ3-O 3.24Å; W619-H688 WeakPolarHBondContact CZ3-O 3.29Å; N684-H688 PolarHBondContact O-CE1 2.81Å; D686-H688 PolarHBondContact O-N 3.07Å; D686-H688 IonicContact OD1-ND1 2.83Å; H688-R690 PolarHBondContact O-N 3.21Å; H688-F718 HydrophobicContact CB-CB 4.21Å; H688-F718 HydrophobicContact CB-CD1 4.19Å
689	I	79.6	Confident	59.3	Low	6.66667 Å²	6.66667	78.1 Å²	78.1	3%	0.034	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	124.1	167.9	-60.4	157	0	0	0	107.8	V601 V603 V670 F718 V719 P721 I724	V601-I689 HydrophobicContact CG1-CG2 3.73Å; V603-I689 HydrophobicContact CG2-CG1 4.49Å; V603-I689 HydrophobicContact CG2-CG2 4.26Å; V670-I689 HydrophobicContact CB-CD1 4.44Å; V670-I689 HydrophobicContact CG1-CD1 4.01Å; V670-I689 HydrophobicContact CG2-CD1 3.67Å; V670-I689 HydrophobicContact CG2-CG1 4.35Å; I689-F718 CarbonylContact O-C 3.55Å; I689-F718 VanDerWaalsContact O-CA 3.29Å; I689-F718 WeakPolarHBondContact O-CA 3.38Å; I689-V719 HydrophobicContact CB-CB 4.4Å; I689-V719 WeakPolarHBondContact CB-O 3.4Å; I689-V719 PolarHBondContact N-O 2.77Å; I689-V719 PolarHBondContact O-N 3.12Å; I689-P721 HydrophobicContact CD1-CG 4.28Å; I689-P721 HydrophobicContact CG1-CG 4.3Å; I689-I724 HydrophobicContact CD1-CD1 3.43Å; I689-I724 VanDerWaalsContact CD1-CD1 3.47Å
690	R	81.7	Confident	60	Low	58 Å²	58	75.3 Å²	75.3	22%	0.219	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.5	-176.9	-178.4	-174.6	-67.3	159.4	-2.4	110.4	V601 S602 W619 H688 R692 V716 F718	V601-R690 WeakPolarHBondContact CA-O 3.47Å; S602-R690 PolarHBondContact N-O 3.13Å; S602-R690 PolarHBondContact O-N 3.19Å; W619-R690 HydrophobicContact CE3-CB 4.41Å; W619-R690 HydrophobicContact CH2-CB 4.32Å; W619-R690 HydrophobicContact CZ3-CB 3.7Å; H688-R690 PolarHBondContact O-N 3.21Å; R690-R692 HydrophobicContact CG-CG 4.28Å; R690-V716 HydrophobicContact CG-CG1 4.3Å; R690-F718 HydrophobicContact CB-CD1 4.14Å; R690-F718 HydrophobicContact CB-CE1 4.15Å; R690-F718 HydrophobicContact CG-CD1 4.19Å; R690-F718 HydrophobicContact CG-CE1 3.82Å; R690-F718 HydrophobicContact CG-CZ 4.22Å; R690-F718 VanDerWaalsContact NE-CE1 3.34Å
691	L	83.7	Confident	60.5	Low	4 Å²	4	77.1 Å²	77.1	2%	0.021	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	126.5	178	-61.7	160	0	0	0	108.9	E600 V601 V716 N717 V719 I745 L747 L764	E600-L691 CarbonylContact O-C 3.55Å; E600-L691 WeakPolarHBondContact O-CA 3.13Å; V601-L691 HydrophobicContact CB-CD2 4.03Å; V601-L691 HydrophobicContact CG1-CD2 3.58Å; V601-L691 HydrophobicContact CG2-CD2 3.51Å; V601-L691 VanDerWaalsContact CG2-CD2 3.45Å; L691-V716 CarbonylContact O-C 3.5Å; L691-V716 VanDerWaalsContact O-CA 3.29Å; L691-V716 WeakPolarHBondContact O-CA 3.43Å; L691-N717 WeakPolarHBondContact CB-O 3.44Å; L691-N717 PolarHBondContact N-O 3.06Å; L691-N717 PolarHBondContact O-N 2.94Å; L691-V719 HydrophobicContact CD1-CG2 3.76Å; L691-I745 HydrophobicContact CD1-CB 4.47Å; L691-I745 HydrophobicContact CD1-CD1 3.73Å; L691-I745 VanDerWaalsContact CD1-CD1 3.46Å; L691-I745 HydrophobicContact CD1-CG2 3.88Å; L691-L747 HydrophobicContact CB-CD2 4.45Å; L691-L764 HydrophobicContact CD1-CD2 4.15Å; L691-L764 HydrophobicContact CD2-CD2 4.11Å
692	R	81.8	Confident	61	Low	76.6667 Å²	76.6667	76.2 Å²	76.2	29%	0.289	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	127.5	177.4	-66.1	173.8	166.8	158	-4.9	110	L599 E600 R690 F694 L713 G715 V716	L599-R692 CarbonylContact C-O 3.53Å; L599-R692 WeakPolarHBondContact CA-O 3.32Å; E600-R692 HydrophobicContact CB-CB 4.25Å; E600-R692 PolarHBondContact N-O 2.74Å; E600-R692 PolarHBondContact O-N 2.92Å; E600-R692 WeakPolarHBondContact OE2-CD 3.33Å; E600-R692 IonicContact OE2-CZ 3.71Å; E600-R692 IonicContact OE2-NH1 2.68Å; E600-R692 PolarHBondContact OE2-NH1 2.85Å; E600-R692 VanDerWaalsContact OE2-NH1 3.07Å; R690-R692 HydrophobicContact CG-CG 4.28Å; R692-F694 HydrophobicContact CB-CD2 4.26Å; R692-F694 HydrophobicContact CB-CE2 3.53Å; R692-F694 VanDerWaalsContact CB-CE2 3.48Å; R692-F694 HydrophobicContact CB-CZ 4.15Å; R692-F694 HydrophobicContact CG-CE2 4.44Å; R692-L713 HydrophobicContact CB-CD1 3.9Å; R692-L713 HydrophobicContact CG-CD1 4.27Å; R692-G715 CarbonylContact C-O 3.5Å; R692-G715 WeakPolarHBondContact CA-O 3.36Å; R692-V716 HydrophobicContact CG-CG1 4.4Å; R692-V716 HydrophobicContact CG-CG2 4.3Å
693	L	84.7	Confident	61.2	Low	0.333333 Å²	0.333333	77.6 Å²	77.6	0%	0.002	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	123.1	176.3	-177.8	70.1	0	0	0	109.7	L531 L533 M597 L599 L626 I714 G715 L747	L531-L693 HydrophobicContact CD2-CD1 3.62Å; L531-L693 HydrophobicContact CD2-CD2 3.68Å; L531-L693 HydrophobicContact CD2-CG 4.31Å; L533-L693 HydrophobicContact CD1-CD2 4.28Å; M597-L693 HydrophobicContact CB-CD1 4.13Å; M597-L693 HydrophobicContact CE-CD1 4.14Å; M597-L693 HydrophobicContact CE-CD2 4.42Å; M597-L693 HydrophobicContact SD-CD1 4.21Å; M597-L693 HydrophobicContact SD-CD2 4.04Å; M597-L693 HydrophobicContact SD-CG 4.28Å; L599-L693 HydrophobicContact CB-CD1 4.25Å; L599-L693 HydrophobicContact CD1-CD1 4.42Å; L626-L693 HydrophobicContact CD1-CD1 4.24Å; L693-I714 HydrophobicContact CD2-CB 4.44Å; L693-I714 HydrophobicContact CD2-CD1 4.39Å; L693-I714 HydrophobicContact CD2-CG2 4.36Å; L693-I714 HydrophobicContact CG-CB 4.45Å; L693-I714 HydrophobicContact CG-CD1 4.37Å; L693-I714 WeakPolarHBondContact O-CA 3.36Å; L693-I714 WeakPolarHBondContact O-CB 3.46Å; L693-I714 PolarHBondContact O-N 3.36Å; L693-G715 PolarHBondContact N-O 3.28Å; L693-G715 PolarHBondContact O-N 3.23Å; L693-L747 HydrophobicContact CB-CD1 4.11Å; L693-L747 HydrophobicContact CD2-CD1 3.94Å; L693-L747 HydrophobicContact CG-CD1 4.49Å
694	F	80.3	Confident	61.8	Low	29.6667 Å²	29.6667	81.4 Å²	81.4	13%	0.13	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	145.4	177.4	-62.7	-95	0	0	0	111.2	M597 E598 E600 R692 E712 L713	M597-F694 CarbonylContact C-O 3.57Å; M597-F694 VanDerWaalsContact CA-O 3.27Å; M597-F694 WeakPolarHBondContact CA-O 3.31Å; M597-F694 WeakPolarHBondContact CB-O 3.36Å; E598-F694 HydrophobicContact CB-CB 4.41Å; E598-F694 PolarHBondContact N-O 3.27Å; E598-F694 PolarHBondContact O-N 3.08Å; E600-F694 HydrophobicContact CB-CE2 4.24Å; E600-F694 VanDerWaalsContact CD-CE2 3.48Å; E600-F694 HydrophobicContact CG-CD2 4.19Å; E600-F694 HydrophobicContact CG-CE2 3.75Å; E600-F694 VanDerWaalsContact OE2-CE2 3.29Å; E600-F694 WeakPolarHBondContact OE2-CE2 3.39Å; R692-F694 HydrophobicContact CB-CD2 4.26Å; R692-F694 HydrophobicContact CB-CE2 3.53Å; R692-F694 VanDerWaalsContact CB-CE2 3.48Å; R692-F694 HydrophobicContact CB-CZ 4.15Å; R692-F694 HydrophobicContact CG-CE2 4.44Å; F694-E712 CarbonylContact C-O 3.5Å; F694-E712 VanDerWaalsContact CA-O 3.29Å; F694-E712 WeakPolarHBondContact CA-O 3.24Å; F694-L713 HydrophobicContact CD1-CB 3.97Å; F694-L713 HydrophobicContact CD1-CD1 4.1Å; F694-L713 HydrophobicContact CD2-CD1 4.41Å; F694-L713 HydrophobicContact CE1-CB 3.83Å; F694-L713 HydrophobicContact CE1-CD1 3.76Å; F694-L713 HydrophobicContact CE1-CG 4.36Å; F694-L713 HydrophobicContact CE2-CD1 4.08Å; F694-L713 HydrophobicContact CG-CD1 4.42Å; F694-L713 HydrophobicContact CZ-CD1 3.75Å
695	R	78.7	Confident	62.2	Low	40 Å²	40	81.3 Å²	81.3	15%	0.151	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	136	164.9	-167	-175.3	179.3	-172.2	6.9	108.6	K541 S711 E712 I714	K541-R695 PolarHBondContact O-NH1 3.23Å; K541-R695 VanDerWaalsContact O-NH1 3.15Å; K541-R695 PolarHBondContact O-NH2 2.78Å; R695-S711 CarbonylContact O-C 3.5Å; R695-S711 VanDerWaalsContact O-CA 3.26Å; R695-S711 WeakPolarHBondContact O-CA 3.28Å; R695-E712 HydrophobicContact CB-CB 4.21Å; R695-E712 PolarHBondContact N-O 3.14Å; R695-E712 PolarHBondContact O-N 3.14Å; R695-I714 HydrophobicContact CB-CD1 3.62Å; R695-I714 HydrophobicContact CB-CG1 3.87Å; R695-I714 HydrophobicContact CG-CD1 4.39Å; R695-I714 VanDerWaalsContact N-CG1 3.29Å
696	L	72.7	Confident	62.1	Low	21.3333 Å²	21.3333	79.7 Å²	79.7	11%	0.112	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	120.2	167.7	-67.6	168.1	0	0	0	108.9	F596 E598 T625 W709	F596-L696 HydrophobicContact CB-CB 4.14Å; F596-L696 HydrophobicContact CB-CD1 4.09Å; F596-L696 PolarHBondContact O-N 3.12Å; F596-L696 VanDerWaalsContact O-N 3.14Å; E598-L696 HydrophobicContact CB-CD1 4.23Å; E598-L696 HydrophobicContact CB-CD2 4.41Å; E598-L696 HydrophobicContact CB-CG 4.32Å; T625-L696 HydrophobicContact CG2-CD1 4.34Å; L696-W709 HydrophobicContact CB-CE3 3.95Å; L696-W709 HydrophobicContact CB-CZ3 4.26Å; L696-W709 HydrophobicContact CD2-CB 4.29Å; L696-W709 HydrophobicContact CD2-CD2 4.48Å; L696-W709 HydrophobicContact CD2-CE3 4.24Å
697	S	63	Low	61.8	Low	38 Å²	38	79 Å²	79	27%	0.266	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-87.6	150.6	172.4	0.4	0	0	0	0	110.6	W709 E710	S697-W709 WeakPolarHBondContact O-CZ3 3.22Å; S697-E710 VanDerWaalsContact CB-O 3.27Å; S697-E710 WeakPolarHBondContact CB-O 3.29Å; S697-E710 PolarHBondContact N-O 3.12Å; S697-E710 VanDerWaalsContact OG-CB 3.31Å; S697-E710 WeakPolarHBondContact OG-CB 3.27Å; S697-E710 PolarHBondContact OG-O 3.12Å
698	N	55.8	Low	60.8	Low	119.667 Å²	119.667	82.8 Å²	82.8	64%	0.64	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-54.3	141.7	-178.3	-82.2	-6.1	0	0	0	111.9	V700	N698-V700 PolarHBondContact O-N 3.1Å
699	P	47	Very low	59.8	Low	45 Å²	45	82.7 Å²	82.7	29%	0.292	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-64.4	125.6	-174.1	25.3	-33.8	0	0	0	111.3	K701 T707 W709	P699-K701 PolarHBondContact O-N 3.39Å; P699-T707 HydrophobicContact CB-CG2 4.17Å; P699-W709 HydrophobicContact CB-CZ2 4.37Å; P699-W709 HydrophobicContact CG-CH2 4.28Å; P699-W709 HydrophobicContact CG-CZ2 4.3Å
700	V	45.4	Very low	58.6	Low	87.6667 Å²	87.6667	89.1 Å²	89.1	53%	0.531	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	120.1	165.5	-177.1	0	0	0	0	106.9	N698 E702	N698-V700 PolarHBondContact O-N 3.1Å; V700-E702 HydrophobicContact CG1-CG 4.13Å; V700-E702 PolarHBondContact O-N 3.22Å; V700-E702 VanDerWaalsContact O-N 3.13Å
701	K	42.8	Very low	58	Low	188 Å²	188	89.5 Å²	89.5	82%	0.817	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	96.5	173	-72.1	-170	177	-171.4	0	108.8	P699 T707	P699-K701 PolarHBondContact O-N 3.39Å; K701-T707 HydrophobicContact CG-CG2 4.45Å
702	E	44.7	Very low	57.4	Low	145.333 Å²	145.333	92 Å²	92	68%	0.679	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	-5.3	169.6	-71.6	-169.7	162.5	0	0	111.2	V700	V700-E702 HydrophobicContact CG1-CG 4.13Å; V700-E702 PolarHBondContact O-N 3.22Å; V700-E702 VanDerWaalsContact O-N 3.13Å
703	D	39	Very low	57	Low	138 Å²	138	91.2 Å²	91.2	74%	0.738	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-177	162.7	171.4	-77.3	-36.7	0	0	0	114.7	D705 T706	D703-D705 PolarHBondContact O-N 3.1Å; D703-T706 PolarHBondContact O-N 2.8Å
704	E	47.2	Very low	56.5	Low	199.667 Å²	199.667	91.6 Å²	91.6	93%	0.933	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	3.8	-170.1	-68.3	-163.3	148.5	0	0	113.8
705	D	46.2	Very low	56.1	Low	146 Å²	146	90.2 Å²	90.2	78%	0.781	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133	-9.7	165.7	-86.7	-34.4	0	0	0	115.3	D703	D703-D705 PolarHBondContact O-N 3.1Å
706	T	39	Very low	56	Low	101.333 Å²	101.333	90 Å²	90	62%	0.622	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.9	99.9	-177.3	43.5	0	0	0	0	112.6	D703 Q708	D703-T706 PolarHBondContact O-N 2.8Å; T706-Q708 VanDerWaalsContact C-N 3.32Å; T706-Q708 PolarHBondContact O-N 2.91Å
707	T	44.4	Very low	56.2	Low	81.6667 Å²	81.6667	91.3 Å²	91.3	50%	0.501	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	97.4	169.2	30.7	0	0	0	0	110.2	P699 K701 W709	P699-T707 HydrophobicContact CB-CG2 4.17Å; K701-T707 HydrophobicContact CG-CG2 4.45Å; T707-W709 VanDerWaalsContact O-CD1 3.23Å; T707-W709 PolarHBondContact O-N 2.82Å
708	Q	43.6	Very low	56.9	Low	150.667 Å²	150.667	94.1 Å²	94.1	70%	0.704	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	124.6	173.7	-162.4	165.5	-3.1	0	0	109.8	T706	T706-Q708 VanDerWaalsContact C-N 3.32Å; T706-Q708 PolarHBondContact O-N 2.91Å
709	W	53.6	Low	57.9	Low	58.6667 Å²	58.6667	88.8 Å²	88.8	22%	0.222	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-91.8	125.1	176.1	-68.4	74.5	0	0	0	109.2	I588 L696 S697 P699 T707 S711	I588-W709 HydrophobicContact CB-CH2 4.3Å; I588-W709 HydrophobicContact CB-CZ2 4.15Å; I588-W709 HydrophobicContact CD1-CH2 4.49Å; I588-W709 HydrophobicContact CD1-CZ2 3.97Å; I588-W709 HydrophobicContact CG2-CH2 3.36Å; I588-W709 HydrophobicContact CG2-CZ2 3.7Å; I588-W709 HydrophobicContact CG2-CZ3 4.38Å; L696-W709 HydrophobicContact CB-CE3 3.95Å; L696-W709 HydrophobicContact CB-CZ3 4.26Å; L696-W709 HydrophobicContact CD2-CB 4.29Å; L696-W709 HydrophobicContact CD2-CD2 4.48Å; L696-W709 HydrophobicContact CD2-CE3 4.24Å; S697-W709 WeakPolarHBondContact O-CZ3 3.22Å; P699-W709 HydrophobicContact CB-CZ2 4.37Å; P699-W709 HydrophobicContact CG-CH2 4.28Å; P699-W709 HydrophobicContact CG-CZ2 4.3Å; T707-W709 VanDerWaalsContact O-CD1 3.23Å; T707-W709 PolarHBondContact O-N 2.82Å; W709-S711 PolarHBondContact O-N 3.41Å; W709-S711 VanDerWaalsContact O-N 3.16Å
710	E	54.7	Low	59.3	Low	140.667 Å²	140.667	89.2 Å²	89.2	66%	0.657	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-76.6	115.3	168	-72.6	-168.8	156	0	0	109.5	S697	S697-E710 VanDerWaalsContact CB-O 3.27Å; S697-E710 WeakPolarHBondContact CB-O 3.29Å; S697-E710 PolarHBondContact N-O 3.12Å; S697-E710 VanDerWaalsContact OG-CB 3.31Å; S697-E710 WeakPolarHBondContact OG-CB 3.27Å; S697-E710 PolarHBondContact OG-O 3.12Å
711	S	68.6	Low	60.8	Low	67 Å²	67	85.5 Å²	85.5	47%	0.469	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	125.1	177	54.9	0	0	0	0	111.5	R695 W709	R695-S711 CarbonylContact O-C 3.5Å; R695-S711 VanDerWaalsContact O-CA 3.26Å; R695-S711 WeakPolarHBondContact O-CA 3.28Å; W709-S711 PolarHBondContact O-N 3.41Å; W709-S711 VanDerWaalsContact O-N 3.16Å
712	E	72.3	Confident	62.2	Low	56.3333 Å²	56.3333	80.6 Å²	80.6	26%	0.263	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	118.9	178.1	-170.6	-167.9	-178.1	0	0	110.1	K541 F694 R695 I714 Q751	K541-E712 IonicContact NZ-OE1 2.75Å; K541-E712 PolarHBondContact NZ-OE1 3.18Å; K541-E712 IonicContact NZ-OE2 3.37Å; K541-E712 PolarHBondContact NZ-OE2 2.93Å; F694-E712 CarbonylContact C-O 3.5Å; F694-E712 VanDerWaalsContact CA-O 3.29Å; F694-E712 WeakPolarHBondContact CA-O 3.24Å; R695-E712 HydrophobicContact CB-CB 4.21Å; R695-E712 PolarHBondContact N-O 3.14Å; R695-E712 PolarHBondContact O-N 3.14Å; E712-I714 WeakPolarHBondContact O-CG1 3.32Å; E712-I714 PolarHBondContact O-N 3.13Å; E712-Q751 PolarHBondContact OE1-NE2 3.33Å; E712-Q751 PolarHBondContact OE1-OE1 3.26Å
713	L	73.7	Confident	63.6	Low	60.3333 Å²	60.3333	77.9 Å²	77.9	32%	0.316	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	113	176.3	-178.3	68.5	0	0	0	110.6	R692 F694 V716 Q751	R692-L713 HydrophobicContact CB-CD1 3.9Å; R692-L713 HydrophobicContact CG-CD1 4.27Å; F694-L713 HydrophobicContact CD1-CB 3.97Å; F694-L713 HydrophobicContact CD1-CD1 4.1Å; F694-L713 HydrophobicContact CD2-CD1 4.41Å; F694-L713 HydrophobicContact CE1-CB 3.83Å; F694-L713 HydrophobicContact CE1-CD1 3.76Å; F694-L713 HydrophobicContact CE1-CG 4.36Å; F694-L713 HydrophobicContact CE2-CD1 4.08Å; F694-L713 HydrophobicContact CG-CD1 4.42Å; F694-L713 HydrophobicContact CZ-CD1 3.75Å; L713-V716 HydrophobicContact CD1-CG2 3.96Å; L713-V716 HydrophobicContact CD2-CG2 3.81Å; L713-V716 HydrophobicContact CG-CG2 4.18Å; L713-Q751 WeakPolarHBondContact O-CG 3.47Å
714	I	73.4	Confident	65.3	Low	9 Å²	9	71.4 Å²	71.4	5%	0.046	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-42.9	-179.4	-42.8	173.6	0	0	0	111.1	Y537 M597 L693 R695 E712 S749 G750 I761	Y537-I714 HydrophobicContact CE1-CG2 3.8Å; M597-I714 HydrophobicContact CG-CD1 4.24Å; M597-I714 HydrophobicContact SD-CD1 3.65Å; M597-I714 VanDerWaalsContact SD-CD1 3.59Å; L693-I714 HydrophobicContact CD2-CB 4.44Å; L693-I714 HydrophobicContact CD2-CD1 4.39Å; L693-I714 HydrophobicContact CD2-CG2 4.36Å; L693-I714 HydrophobicContact CG-CB 4.45Å; L693-I714 HydrophobicContact CG-CD1 4.37Å; L693-I714 WeakPolarHBondContact O-CA 3.36Å; L693-I714 WeakPolarHBondContact O-CB 3.46Å; L693-I714 PolarHBondContact O-N 3.36Å; R695-I714 HydrophobicContact CB-CD1 3.62Å; R695-I714 HydrophobicContact CB-CG1 3.87Å; R695-I714 HydrophobicContact CG-CD1 4.39Å; R695-I714 VanDerWaalsContact N-CG1 3.29Å; E712-I714 WeakPolarHBondContact O-CG1 3.32Å; E712-I714 PolarHBondContact O-N 3.13Å; I714-S749 CarbonylContact O-C 3.52Å; I714-S749 WeakPolarHBondContact O-CA 3.29Å; I714-G750 PolarHBondContact O-N 2.85Å; I714-I761 HydrophobicContact CB-CD1 4.39Å; I714-I761 HydrophobicContact CG2-CD1 3.94Å; I714-I761 HydrophobicContact CG2-CG2 4.45Å; I714-I761 WeakPolarHBondContact O-CD1 3.33Å
715	G	72.8	Confident	66.7	Low	0.333333 Å²	0.333333	65.4 Å²	65.4	0%	0.003	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	152.9	-171.8	0	0	0	0	0	114.1	R692 L693 C748	R692-G715 CarbonylContact C-O 3.5Å; R692-G715 WeakPolarHBondContact CA-O 3.36Å; L693-G715 PolarHBondContact N-O 3.28Å; L693-G715 PolarHBondContact O-N 3.23Å; G715-C748 CarbonylContact C-O 3.52Å; G715-C748 WeakPolarHBondContact CA-O 3.41Å
716	V	74.9	Confident	67.8	Low	35 Å²	35	61.9 Å²	61.9	21%	0.212	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	142.7	178	-176.3	0	0	0	0	109.4	R690 L691 R692 L713 F718 C748	R690-V716 HydrophobicContact CG-CG1 4.3Å; L691-V716 CarbonylContact O-C 3.5Å; L691-V716 VanDerWaalsContact O-CA 3.29Å; L691-V716 WeakPolarHBondContact O-CA 3.43Å; R692-V716 HydrophobicContact CG-CG1 4.4Å; R692-V716 HydrophobicContact CG-CG2 4.3Å; L713-V716 HydrophobicContact CD1-CG2 3.96Å; L713-V716 HydrophobicContact CD2-CG2 3.81Å; L713-V716 HydrophobicContact CG-CG2 4.18Å; V716-F718 HydrophobicContact CG1-CD2 4.38Å; V716-F718 HydrophobicContact CG1-CE2 3.76Å; V716-F718 HydrophobicContact CG1-CZ 4.15Å; V716-C748 PolarHBondContact N-O 3.36Å; V716-C748 PolarHBondContact O-N 3.32Å
717	N	78.2	Confident	69.1	Low	48 Å²	48	58.9 Å²	58.9	26%	0.257	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	166.5	160.9	-154.1	-4.6	0	0	0	111.5	L691 I745 H746 L747	L691-N717 WeakPolarHBondContact CB-O 3.44Å; L691-N717 PolarHBondContact N-O 3.06Å; L691-N717 PolarHBondContact O-N 2.94Å; N717-I745 HydrophobicContact CB-CG2 4.12Å; N717-I745 VanDerWaalsContact ND2-CG2 3.33Å; N717-I745 WeakPolarHBondContact ND2-CG2 3.35Å; N717-H746 WeakPolarHBondContact CB-O 3.48Å; N717-H746 PolarHBondContact ND2-O 3.01Å; N717-L747 HydrophobicContact CB-CD2 4.18Å
718	F	77.3	Confident	70.3	Confident	97.6667 Å²	97.6667	55.1 Å²	55.1	43%	0.428	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	139.1	179.2	-61.9	-96.6	0	0	0	109.3	H688 I689 R690 V716	H688-F718 HydrophobicContact CB-CB 4.21Å; H688-F718 HydrophobicContact CB-CD1 4.19Å; I689-F718 CarbonylContact O-C 3.55Å; I689-F718 VanDerWaalsContact O-CA 3.29Å; I689-F718 WeakPolarHBondContact O-CA 3.38Å; R690-F718 HydrophobicContact CB-CD1 4.14Å; R690-F718 HydrophobicContact CB-CE1 4.15Å; R690-F718 HydrophobicContact CG-CD1 4.19Å; R690-F718 HydrophobicContact CG-CE1 3.82Å; R690-F718 HydrophobicContact CG-CZ 4.22Å; R690-F718 VanDerWaalsContact NE-CE1 3.34Å; V716-F718 HydrophobicContact CG1-CD2 4.38Å; V716-F718 HydrophobicContact CG1-CE2 3.76Å; V716-F718 HydrophobicContact CG1-CZ 4.15Å
719	V	76.3	Confident	71.5	Confident	8 Å²	8	51.8 Å²	51.8	5%	0.048	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	129.4	177.7	-179.6	0	0	0	0	109	I689 L691 I724 I745	I689-V719 HydrophobicContact CB-CB 4.4Å; I689-V719 WeakPolarHBondContact CB-O 3.4Å; I689-V719 PolarHBondContact N-O 2.77Å; I689-V719 PolarHBondContact O-N 3.12Å; L691-V719 HydrophobicContact CD1-CG2 3.76Å; V719-I724 HydrophobicContact CG1-CD1 4.11Å; V719-I724 HydrophobicContact CG1-CG1 4Å; V719-I745 HydrophobicContact CG2-CD1 3.74Å; V719-I745 HydrophobicContact CG2-CG1 4.07Å; V719-I745 HydrophobicContact CG2-CG2 4.26Å
720	N	78.1	Confident	71.8	Confident	54 Å²	54	52.1 Å²	52.1	29%	0.289	28%	0.276	S	S	.	.			trans	-77.9	129	174.5	-174.7	-20.8	0	0	0	109.6	D722 E723	N720-D722 PolarHBondContact ND2-OD2 2.89Å; N720-D722 PolarHBondContact O-N 2.8Å; N720-D722 VanDerWaalsContact O-N 3.13Å; N720-D722 PolarHBondContact OD1-N 2.83Å; N720-D722 PolarHBondContact OD1-OD2 2.82Å; N720-E723 HydrophobicContact CB-CG 4.17Å; N720-E723 WeakPolarHBondContact O-CB 3.42Å; N720-E723 PolarHBondContact O-N 3.02Å
721	P	76.2	Confident	71.8	Confident	9.66667 Å²	9.66667	49.8 Å²	49.8	6%	0.063	26%	0.264	C	S	.	.	H	α-helix	trans	-51.3	-33.3	173.4	-26.6	33.7	0	0	0	114.3	V670 F672 N687 I689 E723 I724 R725	V670-P721 HydrophobicContact CG1-CB 4.43Å; F672-P721 HydrophobicContact CD1-CB 4.08Å; F672-P721 HydrophobicContact CE1-CB 4.13Å; F672-P721 VanDerWaalsContact CE1-O 3.26Å; F672-P721 WeakPolarHBondContact CE1-O 3.33Å; N687-P721 VanDerWaalsContact O-CD 3.23Å; N687-P721 WeakPolarHBondContact O-CD 3.26Å; N687-P721 WeakPolarHBondContact O-CG 3.16Å; I689-P721 HydrophobicContact CD1-CG 4.28Å; I689-P721 HydrophobicContact CG1-CG 4.3Å; P721-E723 VanDerWaalsContact C-N 3.3Å; P721-E723 PolarHBondContact O-N 3.26Å; P721-I724 WeakPolarHBondContact O-CB 3.33Å; P721-I724 PolarHBondContact O-N 2.93Å; P721-I724 VanDerWaalsContact O-N 3.17Å; P721-R725 PolarHBondContact O-N 2.95Å
722	D	72.3	Confident	71	Confident	85.6667 Å²	85.6667	50.4 Å²	50.4	46%	0.458	27%	0.265	S	S	.	.	H	α-helix	trans	-68.2	-26.4	179	-68.7	-41.7	0	0	0	113.3	N720 R725 S726	N720-D722 PolarHBondContact ND2-OD2 2.89Å; N720-D722 PolarHBondContact O-N 2.8Å; N720-D722 VanDerWaalsContact O-N 3.13Å; N720-D722 PolarHBondContact OD1-N 2.83Å; N720-D722 PolarHBondContact OD1-OD2 2.82Å; D722-R725 WeakPolarHBondContact O-CB 3.42Å; D722-R725 PolarHBondContact O-N 3.02Å; D722-R725 IonicContact OD1-NH1 3.94Å; D722-R725 PolarHBondContact OD1-NH1 2.92Å; D722-S726 WeakPolarHBondContact O-CB 3.26Å; D722-S726 PolarHBondContact O-N 3.31Å; D722-S726 PolarHBondContact O-OG 2.95Å
723	E	72.7	Confident	69.6	Low	89 Å²	89	52.2 Å²	52.2	42%	0.416	27%	0.273	S	S	.	.	H	α-helix	trans	-65.9	-43.4	171.3	-101.4	168.7	-162.1	0	0	110.7	N720 P721 R725 S726 I727	N720-E723 HydrophobicContact CB-CG 4.17Å; N720-E723 WeakPolarHBondContact O-CB 3.42Å; N720-E723 PolarHBondContact O-N 3.02Å; P721-E723 VanDerWaalsContact C-N 3.3Å; P721-E723 PolarHBondContact O-N 3.26Å; E723-R725 VanDerWaalsContact C-N 3.33Å; E723-R725 PolarHBondContact O-N 3.18Å; E723-S726 PolarHBondContact O-N 2.85Å; E723-I727 HydrophobicContact CG-CD1 3.74Å; E723-I727 WeakPolarHBondContact O-CB 3.47Å; E723-I727 WeakPolarHBondContact O-CD1 3.44Å; E723-I727 VanDerWaalsContact O-CG1 3.27Å; E723-I727 WeakPolarHBondContact O-CG1 3.38Å; E723-I727 PolarHBondContact O-N 3.21Å
724	I	76.5	Confident	67.9	Low	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.5	-43.4	176.1	-53.5	174.2	0	0	0	109.9	A524 L526 F672 I689 V719 P721 S726 I727 I728 L743 L768	A524-I724 HydrophobicContact CB-CG2 4.07Å; L526-I724 HydrophobicContact CD1-CD1 4.47Å; L526-I724 HydrophobicContact CD2-CD1 4.05Å; F672-I724 HydrophobicContact CE1-CB 4.18Å; F672-I724 HydrophobicContact CE1-CG2 4.4Å; F672-I724 HydrophobicContact CZ-CB 4.02Å; F672-I724 HydrophobicContact CZ-CG2 3.82Å; I689-I724 HydrophobicContact CD1-CD1 3.43Å; I689-I724 VanDerWaalsContact CD1-CD1 3.47Å; V719-I724 HydrophobicContact CG1-CD1 4.11Å; V719-I724 HydrophobicContact CG1-CG1 4Å; P721-I724 WeakPolarHBondContact O-CB 3.33Å; P721-I724 PolarHBondContact O-N 2.93Å; P721-I724 VanDerWaalsContact O-N 3.17Å; I724-S726 PolarHBondContact O-N 3.03Å; I724-I727 PolarHBondContact O-N 2.91Å; I724-I728 HydrophobicContact CG2-CD1 4.06Å; I724-I728 WeakPolarHBondContact O-CG1 3.33Å; I724-I728 PolarHBondContact O-N 3.06Å; I724-I728 VanDerWaalsContact O-N 3.09Å; I724-L743 HydrophobicContact CG1-CD2 4.29Å; I724-L768 HydrophobicContact CG2-CD1 3.85Å; I724-L768 HydrophobicContact CG2-CD2 3.99Å; I724-L768 HydrophobicContact CG2-CG 4.37Å
725	R	74.8	Confident	66.3	Low	74 Å²	74	63.4 Å²	63.4	28%	0.279	33%	0.333	S	S	.	.	H	α-helix	trans	-59.3	-47	175.9	-177.3	-177.8	-121.4	125.3	-8.3	111.4	L521 F672 P721 D722 E723 I728 L729	L521-R725 HydrophobicContact CD2-CG 4.16Å; L521-R725 PolarHBondContact O-NH1 3.29Å; F672-R725 VanDerWaalsContact CB-CZ 3.45Å; F672-R725 VanDerWaalsContact CB-NH2 3.26Å; F672-R725 HydrophobicContact CD1-CB 4.31Å; F672-R725 HydrophobicContact CD2-CB 4.49Å; F672-R725 HydrophobicContact CD2-CG 4.27Å; F672-R725 HydrophobicContact CE1-CB 4.31Å; F672-R725 HydrophobicContact CE2-CB 4.29Å; F672-R725 HydrophobicContact CE2-CG 4.45Å; F672-R725 HydrophobicContact CG-CB 4.49Å; F672-R725 HydrophobicContact CG-CG 4.41Å; F672-R725 HydrophobicContact CZ-CB 4.19Å; F672-R725 PolarHBondContact O-NH2 2.94Å; P721-R725 PolarHBondContact O-N 2.95Å; D722-R725 WeakPolarHBondContact O-CB 3.42Å; D722-R725 PolarHBondContact O-N 3.02Å; D722-R725 IonicContact OD1-NH1 3.94Å; D722-R725 PolarHBondContact OD1-NH1 2.92Å; E723-R725 VanDerWaalsContact C-N 3.33Å; E723-R725 PolarHBondContact O-N 3.18Å; R725-I728 PolarHBondContact O-N 3.01Å; R725-L729 HydrophobicContact CG-CD1 3.89Å; R725-L729 HydrophobicContact CG-CG 4.5Å; R725-L729 WeakPolarHBondContact O-CB 3.25Å; R725-L729 VanDerWaalsContact O-CG 3.28Å; R725-L729 WeakPolarHBondContact O-CG 3.19Å; R725-L729 PolarHBondContact O-N 3.11Å
726	S	69.3	Low	64.7	Low	72.3333 Å²	72.3333	66.4 Å²	66.4	51%	0.506	35%	0.354	S	S	.	.	H	α-helix	trans	-64.1	-42.4	179	-93.9	0	0	0	0	112.6	D722 E723 I724 I728 L729 S730	D722-S726 WeakPolarHBondContact O-CB 3.26Å; D722-S726 PolarHBondContact O-N 3.31Å; D722-S726 PolarHBondContact O-OG 2.95Å; E723-S726 PolarHBondContact O-N 2.85Å; I724-S726 PolarHBondContact O-N 3.03Å; S726-I728 VanDerWaalsContact C-N 3.27Å; S726-I728 PolarHBondContact O-N 2.88Å; S726-L729 PolarHBondContact O-N 3Å; S726-S730 VanDerWaalsContact O-CB 3.31Å; S726-S730 WeakPolarHBondContact O-CB 3.3Å; S726-S730 PolarHBondContact O-N 2.91Å; S726-S730 PolarHBondContact O-OG 3.25Å
727	I	67.2	Low	63.3	Low	39.3333 Å²	39.3333	70.4 Å²	70.4	20%	0.202	38%	0.383	C	S	.	.	H	α-helix	trans	-61.3	-42.4	177.5	-70.3	167.1	0	0	0	111.2	E723 I724 S730 K731 T741 L743 L768 W905	E723-I727 HydrophobicContact CG-CD1 3.74Å; E723-I727 WeakPolarHBondContact O-CB 3.47Å; E723-I727 WeakPolarHBondContact O-CD1 3.44Å; E723-I727 VanDerWaalsContact O-CG1 3.27Å; E723-I727 WeakPolarHBondContact O-CG1 3.38Å; E723-I727 PolarHBondContact O-N 3.21Å; I724-I727 PolarHBondContact O-N 2.91Å; I727-S730 PolarHBondContact O-N 2.89Å; I727-S730 PolarHBondContact O-OG 2.99Å; I727-S730 VanDerWaalsContact O-OG 3.14Å; I727-K731 PolarHBondContact O-N 2.95Å; I727-T741 HydrophobicContact CG2-CG2 3.54Å; I727-T741 VanDerWaalsContact CG2-CG2 3.49Å; I727-L743 HydrophobicContact CD1-CD1 3.7Å; I727-L768 HydrophobicContact CB-CD1 4.42Å; I727-L768 HydrophobicContact CG2-CD1 3.98Å; I727-W905 HydrophobicContact CD1-CH2 3.92Å; I727-W905 HydrophobicContact CG1-CH2 4.29Å
728	I	69.9	Low	61.9	Low	1.66667 Å²	1.66667	73.3 Å²	73.3	1%	0.009	40%	0.398	C	S	.	.	H	α-helix	trans	-66	-46.5	176.7	-71.2	168.8	0	0	0	111.1	L521 A524 F672 I724 R725 S726 S730 K731 V732 L768 P770 W772	L521-I728 HydrophobicContact CD1-CG2 3.94Å; L521-I728 HydrophobicContact CD2-CB 4.17Å; L521-I728 HydrophobicContact CD2-CD1 4.46Å; L521-I728 HydrophobicContact CD2-CG2 3.7Å; L521-I728 HydrophobicContact CG-CG2 4.41Å; A524-I728 HydrophobicContact CB-CD1 3.48Å; A524-I728 VanDerWaalsContact CB-CD1 3.46Å; F672-I728 HydrophobicContact CE2-CD1 4.4Å; F672-I728 HydrophobicContact CZ-CD1 4.35Å; I724-I728 HydrophobicContact CG2-CD1 4.06Å; I724-I728 WeakPolarHBondContact O-CG1 3.33Å; I724-I728 PolarHBondContact O-N 3.06Å; I724-I728 VanDerWaalsContact O-N 3.09Å; R725-I728 PolarHBondContact O-N 3.01Å; S726-I728 VanDerWaalsContact C-N 3.27Å; S726-I728 PolarHBondContact O-N 2.88Å; I728-S730 VanDerWaalsContact C-N 3.3Å; I728-S730 PolarHBondContact O-N 2.84Å; I728-K731 PolarHBondContact O-N 3.24Å; I728-K731 VanDerWaalsContact O-N 3.11Å; I728-V732 HydrophobicContact CG2-CG2 4.2Å; I728-V732 VanDerWaalsContact O-CG2 3.28Å; I728-V732 WeakPolarHBondContact O-CG2 3.36Å; I728-V732 PolarHBondContact O-N 3.01Å; I728-L768 HydrophobicContact CD1-CB 4.43Å; I728-L768 HydrophobicContact CG1-CB 4.42Å; I728-L768 HydrophobicContact CG1-CD1 4.35Å; I728-P770 HydrophobicContact CD1-CB 4.35Å; I728-P770 HydrophobicContact CG2-CB 3.67Å; I728-P770 HydrophobicContact CG2-CG 4.46Å; I728-W772 HydrophobicContact CG2-CZ2 4.35Å
729	L	68.2	Low	61.1	Low	82 Å²	82	74.6 Å²	74.6	43%	0.429	41%	0.409	S	S	.	.	H	α-helix	trans	-69.4	-30.3	-176.3	-69.6	173.4	0	0	0	113	L521 R725 S726 K731 H733 W772	L521-L729 HydrophobicContact CB-CD2 4.38Å; L521-L729 HydrophobicContact CD2-CD2 4.3Å; L521-L729 HydrophobicContact CD2-CG 4.24Å; R725-L729 HydrophobicContact CG-CD1 3.89Å; R725-L729 HydrophobicContact CG-CG 4.5Å; R725-L729 WeakPolarHBondContact O-CB 3.25Å; R725-L729 VanDerWaalsContact O-CG 3.28Å; R725-L729 WeakPolarHBondContact O-CG 3.19Å; R725-L729 PolarHBondContact O-N 3.11Å; S726-L729 PolarHBondContact O-N 3Å; L729-K731 VanDerWaalsContact C-N 3.3Å; L729-K731 PolarHBondContact O-N 3.06Å; L729-H733 PolarHBondContact O-ND1 3.02Å; L729-W772 HydrophobicContact CD2-CH2 4.14Å; L729-W772 HydrophobicContact CD2-CZ3 4.47Å
730	S	61	Low	60.8	Low	65 Å²	65	75.9 Å²	75.9	46%	0.455	42%	0.417	S	S	.	.	H	α-helix	trans	-64.8	-29.1	176.8	69.1	0	0	0	0	113.4	S726 I727 I728	S726-S730 VanDerWaalsContact O-CB 3.31Å; S726-S730 WeakPolarHBondContact O-CB 3.3Å; S726-S730 PolarHBondContact O-N 2.91Å; S726-S730 PolarHBondContact O-OG 3.25Å; I727-S730 PolarHBondContact O-N 2.89Å; I727-S730 PolarHBondContact O-OG 2.99Å; I727-S730 VanDerWaalsContact O-OG 3.14Å; I728-S730 VanDerWaalsContact C-N 3.3Å; I728-S730 PolarHBondContact O-N 2.84Å
731	K	54.6	Low	60.5	Low	91.3333 Å²	91.3333	73.9 Å²	73.9	40%	0.397	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	3.6	-175.2	-127.7	-174.3	-179.4	-173.4	0	113.1	I727 I728 L729 H733 L734 T740 T741	I727-K731 PolarHBondContact O-N 2.95Å; I728-K731 PolarHBondContact O-N 3.24Å; I728-K731 VanDerWaalsContact O-N 3.11Å; L729-K731 VanDerWaalsContact C-N 3.3Å; L729-K731 PolarHBondContact O-N 3.06Å; K731-H733 PolarHBondContact O-CD2 3.19Å; K731-H733 PolarHBondContact O-N 3.34Å; K731-L734 WeakPolarHBondContact O-CB 3.44Å; K731-L734 PolarHBondContact O-N 3.43Å; K731-T740 PolarHBondContact NZ-O 3.48Å; K731-T741 HydrophobicContact CD-CG2 3.94Å; K731-T741 VanDerWaalsContact CD-OG1 3.24Å; K731-T741 WeakPolarHBondContact CD-OG1 3.36Å
732	V	50.7	Low	60.4	Low	80.6667 Å²	80.6667	77.1 Å²	77.1	49%	0.489	42%	0.421	S	S	.	.	H	α-helix	trans	-74	14.1	-179	-179.2	0	0	0	0	112.2	I728 L734 P770 W772	I728-V732 HydrophobicContact CG2-CG2 4.2Å; I728-V732 VanDerWaalsContact O-CG2 3.28Å; I728-V732 WeakPolarHBondContact O-CG2 3.36Å; I728-V732 PolarHBondContact O-N 3.01Å; V732-L734 PolarHBondContact O-N 3.26Å; V732-L734 VanDerWaalsContact O-N 3.15Å; V732-P770 HydrophobicContact CG2-CG 4.13Å; V732-W772 HydrophobicContact CB-CZ2 3.92Å; V732-W772 HydrophobicContact CG1-CH2 4.35Å; V732-W772 HydrophobicContact CG1-CZ2 3.86Å; V732-W772 HydrophobicContact CG2-CH2 4.22Å; V732-W772 HydrophobicContact CG2-CZ2 4.07Å
733	H	43.5	Very low	60.7	Low	93.6667 Å²	93.6667	73.6 Å²	73.6	43%	0.434	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	28.7	175.6	-79.2	-6.6	0	0	0	113.4	L729 K731 N735 S736 T741	L729-H733 PolarHBondContact O-ND1 3.02Å; K731-H733 PolarHBondContact O-CD2 3.19Å; K731-H733 PolarHBondContact O-N 3.34Å; H733-N735 VanDerWaalsContact C-N 3.33Å; H733-N735 PolarHBondContact O-N 3.18Å; H733-S736 PolarHBondContact ND1-OG 3.47Å; H733-T741 PolarHBondContact NE2-OG1 2.84Å
734	L	37.8	Very low	60.9	Low	135.333 Å²	135.333	73.9 Å²	73.9	71%	0.709	40%	0.4	S	S	*	.	S	Bend	trans	-77.2	72.9	-179.8	-64.1	167.1	0	0	0	112.6	K731 V732 S736	K731-L734 WeakPolarHBondContact O-CB 3.44Å; K731-L734 PolarHBondContact O-N 3.43Å; V732-L734 PolarHBondContact O-N 3.26Å; V732-L734 VanDerWaalsContact O-N 3.15Å; L734-S736 VanDerWaalsContact C-N 3.28Å; L734-S736 PolarHBondContact O-N 3.15Å
735	N	40.3	Very low	60.9	Low	169.333 Å²	169.333	74.4 Å²	74.4	91%	0.906	40%	0.403	S	S	*	.			trans	-64.4	25.6	169.4	-65.6	-14.6	0	0	0	116.6	H733	H733-N735 VanDerWaalsContact C-N 3.33Å; H733-N735 PolarHBondContact O-N 3.18Å
736	S	38.9	Very low	60.9	Low	63 Å²	63	74.9 Å²	74.9	44%	0.441	41%	0.408	S	S	.	.			trans	-81.6	132.4	173.2	103.7	0	0	0	0	110.8	H733 L734 N738	H733-S736 PolarHBondContact ND1-OG 3.47Å; L734-S736 VanDerWaalsContact C-N 3.28Å; L734-S736 PolarHBondContact O-N 3.15Å; S736-N738 PolarHBondContact O-N 3.12Å; S736-N738 VanDerWaalsContact O-N 3.12Å; S736-N738 PolarHBondContact OG-N 2.85Å; S736-N738 PolarHBondContact OG-O 3.12Å
737	S	46.2	Very low	60.9	Low	119 Å²	119	71.5 Å²	71.5	83%	0.832	38%	0.384	S	S	*	.	S	Bend	trans	-63.6	-17.1	179	55	0	0	0	0	114.6
738	N	49	Very low	60.9	Low	108.333 Å²	108.333	71.7 Å²	71.7	58%	0.579	39%	0.389	S	S	*	.			trans	-102.5	115.9	179.8	-67.5	0.7	0	0	0	109.5	S736 T740	S736-N738 PolarHBondContact O-N 3.12Å; S736-N738 VanDerWaalsContact O-N 3.12Å; S736-N738 PolarHBondContact OG-N 2.85Å; S736-N738 PolarHBondContact OG-O 3.12Å; N738-T740 PolarHBondContact O-N 3.11Å
739	L	60.3	Low	60.6	Low	126 Å²	126	72.7 Å²	72.7	66%	0.66	40%	0.396	S	S	*	.			trans	-72.4	-8.2	179.3	-79.5	150.2	0	0	0	113.7	P770	L739-P770 WeakPolarHBondContact O-CD 3.26Å
740	T	69.4	Low	59.7	Low	35 Å²	35	71 Å²	71	22%	0.215	40%	0.399	C	S	.	.			trans	-108	152.5	-170.3	55.3	0	0	0	0	113.7	K731 N738 E767 L768 E769	K731-T740 PolarHBondContact NZ-O 3.48Å; N738-T740 PolarHBondContact O-N 3.11Å; T740-E767 VanDerWaalsContact CB-OE1 3.25Å; T740-E767 WeakPolarHBondContact CB-OE1 3.37Å; T740-E767 HydrophobicContact CG2-CG 4.12Å; T740-E767 PolarHBondContact OG1-OE1 3.08Å; T740-L768 CarbonylContact C-O 3.54Å; T740-L768 WeakPolarHBondContact CA-O 3.39Å; T740-E769 HydrophobicContact CG2-CB 4.11Å; T740-E769 HydrophobicContact CG2-CG 4.37Å
741	T	70.9	Confident	58.9	Low	12.3333 Å²	12.3333	72.1 Å²	72.1	8%	0.076	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	134.1	-179.2	-61.2	0	0	0	0	111.6	I727 K731 H733 L768	I727-T741 HydrophobicContact CG2-CG2 3.54Å; I727-T741 VanDerWaalsContact CG2-CG2 3.49Å; K731-T741 HydrophobicContact CD-CG2 3.94Å; K731-T741 VanDerWaalsContact CD-OG1 3.24Å; K731-T741 WeakPolarHBondContact CD-OG1 3.36Å; H733-T741 PolarHBondContact NE2-OG1 2.84Å; T741-L768 PolarHBondContact N-O 3.38Å; T741-L768 WeakPolarHBondContact O-CA 3.34Å; T741-L768 VanDerWaalsContact O-CB 3.26Å; T741-L768 WeakPolarHBondContact O-CB 3.26Å; T741-L768 VanDerWaalsContact O-CG 3.3Å; T741-L768 WeakPolarHBondContact O-CG 3.39Å; T741-L768 PolarHBondContact O-N 3.05Å
742	H	74.9	Confident	58	Low	76.6667 Å²	76.6667	77.4 Å²	77.4	36%	0.355	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	136	178.7	-70.2	-111.2	0	0	0	112.1	Y744 E765 L766	H742-Y744 HydrophobicContact CB-CE2 3.92Å; H742-E765 IonicContact CE1-OE1 2.98Å; H742-E765 PolarHBondContact CE1-OE1 2.97Å; H742-E765 VanDerWaalsContact CE1-OE1 3.29Å; H742-E765 IonicContact CG-OE1 3.33Å; H742-E765 IonicContact ND1-OE1 3.3Å; H742-E765 PolarHBondContact ND1-OE1 3.09Å; H742-L766 CarbonylContact C-O 3.52Å; H742-L766 VanDerWaalsContact CA-O 3.29Å; H742-L766 WeakPolarHBondContact CA-O 3.33Å
743	L	78.2	Confident	57.1	Low	12.3333 Å²	12.3333	78.7 Å²	78.7	7%	0.065	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134	171.7	173	64.1	0	0	0	109.4	L526 I724 I727 I745 L766 L768	L526-L743 HydrophobicContact CD2-CD2 4.2Å; I724-L743 HydrophobicContact CG1-CD2 4.29Å; I727-L743 HydrophobicContact CD1-CD1 3.7Å; L743-I745 HydrophobicContact CD1-CG1 4.45Å; L743-I745 HydrophobicContact CD2-CD1 3.94Å; L743-I745 HydrophobicContact CD2-CG1 4.38Å; L743-I745 HydrophobicContact CG-CD1 4.1Å; L743-I745 HydrophobicContact CG-CG1 4.09Å; L743-L766 HydrophobicContact CB-CB 4.34Å; L743-L766 HydrophobicContact CD2-CD1 4.38Å; L743-L766 PolarHBondContact N-O 3.18Å; L743-L766 WeakPolarHBondContact O-CA 3.28Å; L743-L766 PolarHBondContact O-N 2.95Å; L743-L768 HydrophobicContact CB-CD1 3.9Å; L743-L768 HydrophobicContact CB-CD2 4.11Å; L743-L768 HydrophobicContact CB-CG 3.93Å; L743-L768 HydrophobicContact CD2-CD1 4.44Å; L743-L768 HydrophobicContact CD2-CD2 4.06Å
744	Y	78.2	Confident	56.8	Low	94 Å²	94	83.6 Å²	83.6	37%	0.369	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.3	-177.8	-62.9	-75	0	0	0	110.9	H742 R763 L764 E765	H742-Y744 HydrophobicContact CB-CE2 3.92Å; Y744-R763 VanDerWaalsContact CD1-NH2 3.28Å; Y744-R763 VanDerWaalsContact CD2-NH2 3.29Å; Y744-R763 VanDerWaalsContact CG-NH2 3.29Å; Y744-L764 WeakPolarHBondContact CA-O 3.42Å; Y744-E765 HydrophobicContact CD1-CB 4.04Å; Y744-E765 HydrophobicContact CD1-CG 3.84Å; Y744-E765 HydrophobicContact CE1-CB 4.04Å; Y744-E765 HydrophobicContact CE1-CG 3.59Å; Y744-E765 VanDerWaalsContact CE1-OE1 3.23Å; Y744-E765 WeakPolarHBondContact CE1-OE1 3.39Å; Y744-E765 VanDerWaalsContact CZ-OE1 3.32Å; Y744-E765 PolarHBondContact OH-OE1 2.99Å
745	I	75.2	Confident	56.6	Low	11 Å²	11	81.7 Å²	81.7	6%	0.056	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	120.4	-173.9	-58.7	155.5	0	0	0	109.1	L691 N717 V719 L743 R763 L764 L766	L691-I745 HydrophobicContact CD1-CB 4.47Å; L691-I745 HydrophobicContact CD1-CD1 3.73Å; L691-I745 VanDerWaalsContact CD1-CD1 3.46Å; L691-I745 HydrophobicContact CD1-CG2 3.88Å; N717-I745 HydrophobicContact CB-CG2 4.12Å; N717-I745 VanDerWaalsContact ND2-CG2 3.33Å; N717-I745 WeakPolarHBondContact ND2-CG2 3.35Å; V719-I745 HydrophobicContact CG2-CD1 3.74Å; V719-I745 HydrophobicContact CG2-CG1 4.07Å; V719-I745 HydrophobicContact CG2-CG2 4.26Å; L743-I745 HydrophobicContact CD1-CG1 4.45Å; L743-I745 HydrophobicContact CD2-CD1 3.94Å; L743-I745 HydrophobicContact CD2-CG1 4.38Å; L743-I745 HydrophobicContact CG-CD1 4.1Å; L743-I745 HydrophobicContact CG-CG1 4.09Å; I745-R763 WeakPolarHBondContact O-CA 3.4Å; I745-L764 HydrophobicContact CB-CB 4.27Å; I745-L764 HydrophobicContact CD1-CD2 4.24Å; I745-L764 PolarHBondContact N-O 3.12Å; I745-L764 WeakPolarHBondContact O-CB 3.33Å; I745-L764 PolarHBondContact O-N 3.16Å; I745-L766 HydrophobicContact CD1-CD1 3.67Å; I745-L766 HydrophobicContact CD1-CG 4.39Å
746	H	74.9	Confident	56.4	Low	84 Å²	84	82.4 Å²	82.4	39%	0.389	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	136.8	173.5	-73	-70.6	0	0	0	110.7	N717 V760 G762	N717-H746 WeakPolarHBondContact CB-O 3.48Å; N717-H746 PolarHBondContact ND2-O 3.01Å; H746-V760 HydrophobicContact CB-CG1 4Å; H746-V760 HydrophobicContact CB-CG2 4.39Å; H746-G762 WeakPolarHBondContact CA-O 3.34Å
747	L	70.1	Confident	56.3	Low	1.33333 Å²	1.33333	84.4 Å²	84.4	1%	0.007	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	124	175.6	-68.1	174.5	0	0	0	109.9	L531 L691 L693 N717 V760 I761 G762 L764	L531-L747 HydrophobicContact CD1-CD1 3.5Å; L691-L747 HydrophobicContact CB-CD2 4.45Å; L693-L747 HydrophobicContact CB-CD1 4.11Å; L693-L747 HydrophobicContact CD2-CD1 3.94Å; L693-L747 HydrophobicContact CG-CD1 4.49Å; N717-L747 HydrophobicContact CB-CD2 4.18Å; L747-V760 CarbonylContact O-C 3.57Å; L747-V760 WeakPolarHBondContact O-CA 3.36Å; L747-I761 HydrophobicContact CB-CG1 4.21Å; L747-I761 VanDerWaalsContact O-CG1 3.24Å; L747-I761 WeakPolarHBondContact O-CG1 3.22Å; L747-I761 PolarHBondContact O-N 3.22Å; L747-G762 PolarHBondContact N-O 3.01Å; L747-L764 HydrophobicContact CD1-CB 4.41Å
748	C	66.4	Low	56.1	Low	44.6667 Å²	44.6667	83 Å²	83	30%	0.302	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	144.6	179.9	-66.1	0	0	0	0	111.2	G715 V716 G750 N759	G715-C748 CarbonylContact C-O 3.52Å; G715-C748 WeakPolarHBondContact CA-O 3.41Å; V716-C748 PolarHBondContact N-O 3.36Å; V716-C748 PolarHBondContact O-N 3.32Å; C748-G750 PolarHBondContact O-N 2.92Å; C748-N759 CarbonylContact C-O 3.43Å; C748-N759 VanDerWaalsContact CA-O 3.31Å; C748-N759 WeakPolarHBondContact CA-O 3.32Å
749	S	63.1	Low	56.6	Low	22.6667 Å²	22.6667	81.1 Å²	81.1	16%	0.159	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	127.3	178.7	-177.8	0	0	0	0	112.2	I714 Q751 N759 I761	I714-S749 CarbonylContact O-C 3.52Å; I714-S749 WeakPolarHBondContact O-CA 3.29Å; S749-Q751 VanDerWaalsContact C-N 3.27Å; S749-Q751 PolarHBondContact O-N 3.06Å; S749-Q751 PolarHBondContact OG-N 3.27Å; S749-Q751 PolarHBondContact OG-O 3.48Å; S749-Q751 VanDerWaalsContact OG-O 3.12Å; S749-N759 PolarHBondContact N-O 2.94Å; S749-N759 VanDerWaalsContact N-O 3.13Å; S749-I761 VanDerWaalsContact CB-CD1 3.49Å
750	G	49.9	Very low	56.6	Low	46.3333 Å²	46.3333	77.6 Å²	77.6	48%	0.478	40%	0.4	S	S	.	.	S	Bend	trans	-78.9	-11.6	178.7	0	0	0	0	0	114.6	I714 C748	I714-G750 PolarHBondContact O-N 2.85Å; C748-G750 PolarHBondContact O-N 2.92Å
751	Q	45.1	Very low	56.6	Low	87.6667 Å²	87.6667	76.2 Å²	76.2	41%	0.41	39%	0.391	S	S	.	.	S	Bend	trans	-96.9	132.8	-178.5	-77.5	178.7	-1.8	0	0	111.6	E712 L713 S749 M753	E712-Q751 PolarHBondContact OE1-NE2 3.33Å; E712-Q751 PolarHBondContact OE1-OE1 3.26Å; L713-Q751 WeakPolarHBondContact O-CG 3.47Å; S749-Q751 VanDerWaalsContact C-N 3.27Å; S749-Q751 PolarHBondContact O-N 3.06Å; S749-Q751 PolarHBondContact OG-N 3.27Å; S749-Q751 PolarHBondContact OG-O 3.48Å; S749-Q751 VanDerWaalsContact OG-O 3.12Å; Q751-M753 HydrophobicContact CB-CB 4.4Å; Q751-M753 HydrophobicContact CB-CG 3.87Å; Q751-M753 PolarHBondContact O-N 2.88Å
752	K	35.8	Very low	56.7	Low	203 Å²	203	75.8 Å²	75.8	88%	0.883	39%	0.389	S	S	*	.			trans	-65.1	74.7	164.5	-72.3	-178.6	177.6	174.4	0	110.4
753	M	31.1	Very low	56.9	Low	106.667 Å²	106.667	76.1 Å²	76.1	53%	0.525	39%	0.387	S	S	.	.			trans	-69.4	140.1	172.1	-80.5	-109.6	91.1	0	0	110.2	Q751 T755	Q751-M753 HydrophobicContact CB-CB 4.4Å; Q751-M753 HydrophobicContact CB-CG 3.87Å; Q751-M753 PolarHBondContact O-N 2.88Å; M753-T755 PolarHBondContact O-N 3.09Å; M753-T755 VanDerWaalsContact O-N 3.12Å
754	K	36.9	Very low	57.1	Low	196.333 Å²	196.333	75.5 Å²	75.5	85%	0.854	38%	0.384	S	S	*	.	S	Bend	trans	-74.3	13.3	-177.8	-74.8	-175.1	175.8	-180	0	114.3
755	T	33.4	Very low	57.2	Low	96.6667 Å²	96.6667	72.9 Å²	72.9	59%	0.593	38%	0.375	S	S	*	.	S	Bend	trans	-117	131.3	-177.8	49	0	0	0	0	111.2	M753 N757	M753-T755 PolarHBondContact O-N 3.09Å; M753-T755 VanDerWaalsContact O-N 3.12Å; T755-N757 VanDerWaalsContact C-N 3.3Å; T755-N757 PolarHBondContact O-N 2.95Å
756	K	35.7	Very low	57.6	Low	183 Å²	183	72.6 Å²	72.6	80%	0.796	37%	0.374	S	S	*	.	S	Bend	trans	-73.4	25	-165.2	-65.1	-178.3	146	-176	0	116.1	Y1392	K756-Y1392 PolarHBondContact NZ-OH 2.91Å
757	N	38	Very low	57.9	Low	106 Å²	106	70.2 Å²	70.2	57%	0.567	36%	0.363	S	S	*	.	S	Bend	trans	-109.3	129.5	-175.4	-68.6	-7.2	0	0	0	111.6	T755 N759	T755-N757 VanDerWaalsContact C-N 3.3Å; T755-N757 PolarHBondContact O-N 2.95Å; N757-N759 VanDerWaalsContact C-N 3.32Å; N757-N759 PolarHBondContact O-N 3.13Å
758	S	42.4	Very low	58.6	Low	90 Å²	90	70.2 Å²	70.2	63%	0.629	36%	0.363	S	S	*	.			trans	-56	109.4	175.6	47	0	0	0	0	111.9	V760 S1329	S758-V760 PolarHBondContact O-N 3.16Å; S758-S1329 PolarHBondContact O-OG 3.1Å; S758-S1329 VanDerWaalsContact O-OG 3.09Å; S758-S1329 PolarHBondContact OG-OG 3.3Å
759	N	58.8	Low	59.3	Low	66.6667 Å²	66.6667	71.6 Å²	71.6	36%	0.357	37%	0.365	S	S	.	.			trans	-75.9	38.3	-179.3	-76.1	-19.2	0	0	0	113.6	C748 S749 N757 I761	C748-N759 CarbonylContact C-O 3.43Å; C748-N759 VanDerWaalsContact CA-O 3.31Å; C748-N759 WeakPolarHBondContact CA-O 3.32Å; S749-N759 PolarHBondContact N-O 2.94Å; S749-N759 VanDerWaalsContact N-O 3.13Å; N757-N759 VanDerWaalsContact C-N 3.32Å; N757-N759 PolarHBondContact O-N 3.13Å; N759-I761 PolarHBondContact O-N 3.19Å
760	V	61.1	Low	60.3	Low	53.6667 Å²	53.6667	71.3 Å²	71.3	33%	0.325	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	113.9	175.1	179.6	0	0	0	0	108.6	H746 L747 S758 G762	H746-V760 HydrophobicContact CB-CG1 4Å; H746-V760 HydrophobicContact CB-CG2 4.39Å; L747-V760 CarbonylContact O-C 3.57Å; L747-V760 WeakPolarHBondContact O-CA 3.36Å; S758-V760 PolarHBondContact O-N 3.16Å; V760-G762 WeakPolarHBondContact CG1-O 3.38Å
761	I	67.7	Low	61.7	Low	5.66667 Å²	5.66667	70.7 Å²	70.7	3%	0.029	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-28.5	-179	-23.4	170.7	0	0	0	111.1	L533 C534 Y537 I714 L747 S749 N759	L533-I761 HydrophobicContact CD2-CB 4.23Å; L533-I761 HydrophobicContact CD2-CG2 3.98Å; L533-I761 WeakPolarHBondContact CD2-O 3.34Å; C534-I761 PolarHBondContact N-O 3.1Å; Y537-I761 HydrophobicContact CD1-CB 4.06Å; Y537-I761 HydrophobicContact CD1-CG2 3.58Å; Y537-I761 HydrophobicContact CD2-CG1 4.44Å; Y537-I761 HydrophobicContact CD2-CG2 3.85Å; Y537-I761 HydrophobicContact CE1-CB 4.04Å; Y537-I761 HydrophobicContact CE1-CD1 4.32Å; Y537-I761 HydrophobicContact CE1-CG2 3.47Å; Y537-I761 HydrophobicContact CE2-CD1 3.98Å; Y537-I761 HydrophobicContact CE2-CG1 4.06Å; Y537-I761 HydrophobicContact CE2-CG2 3.74Å; Y537-I761 HydrophobicContact CG-CB 4.39Å; Y537-I761 HydrophobicContact CG-CG2 3.77Å; Y537-I761 VanDerWaalsContact CG-CG2 3.49Å; Y537-I761 VanDerWaalsContact CZ-CG2 3.47Å; I714-I761 HydrophobicContact CB-CD1 4.39Å; I714-I761 HydrophobicContact CG2-CD1 3.94Å; I714-I761 HydrophobicContact CG2-CG2 4.45Å; I714-I761 WeakPolarHBondContact O-CD1 3.33Å; L747-I761 HydrophobicContact CB-CG1 4.21Å; L747-I761 VanDerWaalsContact O-CG1 3.24Å; L747-I761 WeakPolarHBondContact O-CG1 3.22Å; L747-I761 PolarHBondContact O-N 3.22Å; S749-I761 VanDerWaalsContact CB-CD1 3.49Å; N759-I761 PolarHBondContact O-N 3.19Å
762	G	73.5	Confident	63.1	Low	2.66667 Å²	2.66667	70.4 Å²	70.4	3%	0.027	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	-170.6	179.7	0	0	0	0	0	114.3	S532 H746 L747 V760	S532-G762 CarbonylContact O-C 3.57Å; S532-G762 WeakPolarHBondContact O-CA 3.19Å; H746-G762 WeakPolarHBondContact CA-O 3.34Å; L747-G762 PolarHBondContact N-O 3.01Å; V760-G762 WeakPolarHBondContact CG1-O 3.38Å
763	R	79.7	Confident	64.6	Low	83 Å²	83	63.4 Å²	63.4	31%	0.313	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	126.4	-177.3	-176.6	-176	-173.4	-171.3	2.8	109.9	S532 Y744 I745 E765	S532-R763 PolarHBondContact N-O 3.15Å; S532-R763 PolarHBondContact O-N 3.2Å; Y744-R763 VanDerWaalsContact CD1-NH2 3.28Å; Y744-R763 VanDerWaalsContact CD2-NH2 3.29Å; Y744-R763 VanDerWaalsContact CG-NH2 3.29Å; I745-R763 WeakPolarHBondContact O-CA 3.4Å; R763-E765 IonicContact CZ-OE1 3.76Å; R763-E765 IonicContact NE-OE1 3.7Å; R763-E765 IonicContact NH1-OE1 3.16Å; R763-E765 PolarHBondContact NH1-OE1 3.12Å
764	L	81	Confident	65.5	Low	0.333333 Å²	0.333333	64 Å²	64	0%	0.002	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	133.5	171.4	176.3	66.3	0	0	0	109.1	F528 L599 L691 Y744 I745 L747 L766	F528-L764 HydrophobicContact CD2-CD1 3.65Å; F528-L764 HydrophobicContact CE2-CD1 3.3Å; F528-L764 HydrophobicContact CZ-CD1 4.38Å; L599-L764 HydrophobicContact CD2-CD1 3.83Å; L599-L764 HydrophobicContact CD2-CD2 4.29Å; L691-L764 HydrophobicContact CD1-CD2 4.15Å; L691-L764 HydrophobicContact CD2-CD2 4.11Å; Y744-L764 WeakPolarHBondContact CA-O 3.42Å; I745-L764 HydrophobicContact CB-CB 4.27Å; I745-L764 HydrophobicContact CD1-CD2 4.24Å; I745-L764 PolarHBondContact N-O 3.12Å; I745-L764 WeakPolarHBondContact O-CB 3.33Å; I745-L764 PolarHBondContact O-N 3.16Å; L747-L764 HydrophobicContact CD1-CB 4.41Å; L764-L766 HydrophobicContact CD1-CD2 4.22Å; L764-L766 HydrophobicContact CD2-CD1 4.32Å; L764-L766 HydrophobicContact CD2-CD2 4.27Å; L764-L766 HydrophobicContact CD2-CG 4.33Å; L764-L766 HydrophobicContact CG-CD2 4.17Å; L764-L766 HydrophobicContact CG-CG 4.17Å
765	E	82	Confident	65.6	Low	39 Å²	39	61.6 Å²	61.6	18%	0.182	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	121.2	176.9	-149.1	-179.6	-174.8	0	0	110.9	K529 C530 H742 Y744 R763	K529-E765 HydrophobicContact CB-CB 4.18Å; K529-E765 HydrophobicContact CB-CG 3.91Å; K529-E765 WeakPolarHBondContact CB-O 3.31Å; K529-E765 HydrophobicContact CG-CG 4.25Å; K529-E765 PolarHBondContact N-O 3.26Å; C530-E765 PolarHBondContact O-N 3.07Å; H742-E765 IonicContact CE1-OE1 2.98Å; H742-E765 PolarHBondContact CE1-OE1 2.97Å; H742-E765 VanDerWaalsContact CE1-OE1 3.29Å; H742-E765 IonicContact CG-OE1 3.33Å; H742-E765 IonicContact ND1-OE1 3.3Å; H742-E765 PolarHBondContact ND1-OE1 3.09Å; Y744-E765 HydrophobicContact CD1-CB 4.04Å; Y744-E765 HydrophobicContact CD1-CG 3.84Å; Y744-E765 HydrophobicContact CE1-CB 4.04Å; Y744-E765 HydrophobicContact CE1-CG 3.59Å; Y744-E765 VanDerWaalsContact CE1-OE1 3.23Å; Y744-E765 WeakPolarHBondContact CE1-OE1 3.39Å; Y744-E765 VanDerWaalsContact CZ-OE1 3.32Å; Y744-E765 PolarHBondContact OH-OE1 2.99Å; R763-E765 IonicContact CZ-OE1 3.76Å; R763-E765 IonicContact NE-OE1 3.7Å; R763-E765 IonicContact NH1-OE1 3.16Å; R763-E765 PolarHBondContact NH1-OE1 3.12Å
766	L	82.4	Confident	65.6	Low	5.33333 Å²	5.33333	61 Å²	61	3%	0.028	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	139.9	177.5	-27.9	149.8	0	0	0	110.8	L526 H527 F528 H742 L743 I745 L764	L526-L766 HydrophobicContact CB-CD1 4.35Å; L526-L766 HydrophobicContact CD2-CD1 3.7Å; H527-L766 CarbonylContact O-C 3.09Å; H527-L766 VanDerWaalsContact O-CA 3.28Å; H527-L766 WeakPolarHBondContact O-CA 3.46Å; H527-L766 WeakPolarHBondContact O-CB 3.35Å; F528-L766 HydrophobicContact CB-CD2 4.27Å; F528-L766 HydrophobicContact CD2-CD2 4.14Å; H742-L766 CarbonylContact C-O 3.52Å; H742-L766 VanDerWaalsContact CA-O 3.29Å; H742-L766 WeakPolarHBondContact CA-O 3.33Å; L743-L766 HydrophobicContact CB-CB 4.34Å; L743-L766 HydrophobicContact CD2-CD1 4.38Å; L743-L766 PolarHBondContact N-O 3.18Å; L743-L766 WeakPolarHBondContact O-CA 3.28Å; L743-L766 PolarHBondContact O-N 2.95Å; I745-L766 HydrophobicContact CD1-CD1 3.67Å; I745-L766 HydrophobicContact CD1-CG 4.39Å; L764-L766 HydrophobicContact CD1-CD2 4.22Å; L764-L766 HydrophobicContact CD2-CD1 4.32Å; L764-L766 HydrophobicContact CD2-CD2 4.27Å; L764-L766 HydrophobicContact CD2-CG 4.33Å; L764-L766 HydrophobicContact CG-CD2 4.17Å; L764-L766 HydrophobicContact CG-CG 4.17Å
767	E	82.4	Confident	65.4	Low	34.3333 Å²	34.3333	58.2 Å²	58.2	16%	0.16	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	122.7	166.2	-177.1	172.5	-161.3	0	0	109.4	H527 K529 T740	H527-E767 HydrophobicContact CB-CB 4.26Å; H527-E767 PolarHBondContact N-O 3.14Å; H527-E767 PolarHBondContact O-N 3.13Å; K529-E767 WeakPolarHBondContact CE-OE2 3.38Å; K529-E767 HydrophobicContact CG-CB 4.27Å; K529-E767 IonicContact NZ-OE2 3.49Å; K529-E767 PolarHBondContact NZ-OE2 2.92Å; T740-E767 VanDerWaalsContact CB-OE1 3.25Å; T740-E767 WeakPolarHBondContact CB-OE1 3.37Å; T740-E767 HydrophobicContact CG2-CG 4.12Å; T740-E767 PolarHBondContact OG1-OE1 3.08Å
768	L	83.8	Confident	64.8	Low	0.333333 Å²	0.333333	58.7 Å²	58.7	0%	0.002	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.3	-175.2	-54.5	178.6	0	0	0	110.2	N525 L526 I724 I727 I728 T740 T741 L743	N525-L768 WeakPolarHBondContact O-CA 3.43Å; L526-L768 HydrophobicContact CB-CD2 4.34Å; L526-L768 HydrophobicContact CD2-CD2 3.53Å; L526-L768 VanDerWaalsContact CD2-CD2 3.47Å; L526-L768 HydrophobicContact CG-CD2 3.53Å; I724-L768 HydrophobicContact CG2-CD1 3.85Å; I724-L768 HydrophobicContact CG2-CD2 3.99Å; I724-L768 HydrophobicContact CG2-CG 4.37Å; I727-L768 HydrophobicContact CB-CD1 4.42Å; I727-L768 HydrophobicContact CG2-CD1 3.98Å; I728-L768 HydrophobicContact CD1-CB 4.43Å; I728-L768 HydrophobicContact CG1-CB 4.42Å; I728-L768 HydrophobicContact CG1-CD1 4.35Å; T740-L768 CarbonylContact C-O 3.54Å; T740-L768 WeakPolarHBondContact CA-O 3.39Å; T741-L768 PolarHBondContact N-O 3.38Å; T741-L768 WeakPolarHBondContact O-CA 3.34Å; T741-L768 VanDerWaalsContact O-CB 3.26Å; T741-L768 WeakPolarHBondContact O-CB 3.26Å; T741-L768 VanDerWaalsContact O-CG 3.3Å; T741-L768 WeakPolarHBondContact O-CG 3.39Å; T741-L768 PolarHBondContact O-N 3.05Å; L743-L768 HydrophobicContact CB-CD1 3.9Å; L743-L768 HydrophobicContact CB-CD2 4.11Å; L743-L768 HydrophobicContact CB-CG 3.93Å; L743-L768 HydrophobicContact CD2-CD1 4.44Å; L743-L768 HydrophobicContact CD2-CD2 4.06Å
769	E	82.3	Confident	64.1	Low	74.6667 Å²	74.6667	65.2 Å²	65.2	35%	0.349	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	121	173.4	179.5	-168.3	-170.2	0	0	109.4	A524 N525 H527 T740	A524-E769 CarbonylContact C-O 3.53Å; A524-E769 VanDerWaalsContact CA-O 3.26Å; A524-E769 WeakPolarHBondContact CA-O 3.38Å; N525-E769 HydrophobicContact CB-CB 4.21Å; N525-E769 PolarHBondContact N-O 3.02Å; N525-E769 PolarHBondContact ND2-OE2 2.98Å; N525-E769 PolarHBondContact O-N 2.92Å; H527-E769 IonicContact CD2-OE2 3.13Å; H527-E769 IonicContact CE1-OE2 3.38Å; H527-E769 IonicContact NE2-OE2 3.11Å; H527-E769 PolarHBondContact NE2-OE2 2.82Å; T740-E769 HydrophobicContact CG2-CB 4.11Å; T740-E769 HydrophobicContact CG2-CG 4.37Å
770	P	83.2	Confident	62.7	Low	16.3333 Å²	16.3333	69.3 Å²	69.3	11%	0.106	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	135.6	-173.5	31.9	-35.5	0	0	0	112.8	L521 I728 V732 L739 W772	L521-P770 HydrophobicContact CD1-CB 3.81Å; I728-P770 HydrophobicContact CD1-CB 4.35Å; I728-P770 HydrophobicContact CG2-CB 3.67Å; I728-P770 HydrophobicContact CG2-CG 4.46Å; V732-P770 HydrophobicContact CG2-CG 4.13Å; L739-P770 WeakPolarHBondContact O-CD 3.26Å; P770-W772 HydrophobicContact CB-CZ2 4.3Å
771	I	78.9	Confident	61	Low	34.3333 Å²	34.3333	76.4 Å²	76.4	18%	0.176	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	114.8	176.9	-50.2	174.8	0	0	0	108.8	K522 G523 N525 Q669	K522-I771 WeakPolarHBondContact CA-O 3.41Å; K522-I771 HydrophobicContact CB-CG2 4.33Å; K522-I771 VanDerWaalsContact CB-O 3.27Å; K522-I771 WeakPolarHBondContact CB-O 3.38Å; K522-I771 HydrophobicContact CD-CG2 4.21Å; K522-I771 PolarHBondContact N-O 3.4Å; G523-I771 PolarHBondContact N-O 3.25Å; G523-I771 VanDerWaalsContact N-O 3.13Å; G523-I771 PolarHBondContact O-N 3.36Å; N525-I771 WeakPolarHBondContact OD1-CD1 3.41Å; Q669-I771 HydrophobicContact CG-CD1 3.88Å; Q669-I771 VanDerWaalsContact NE2-CD1 3.3Å
772	W	75.5	Confident	58.9	Low	81 Å²	81	84.1 Å²	84.1	31%	0.307	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	145	-179.5	-58.2	92.7	0	0	0	111.5	C519 L521 I728 L729 V732 P770 T774	C519-W772 HydrophobicContact CB-CB 4.45Å; C519-W772 HydrophobicContact CB-CD2 4.43Å; C519-W772 HydrophobicContact CB-CE3 3.99Å; C519-W772 VanDerWaalsContact O-CE3 3.27Å; C519-W772 WeakPolarHBondContact O-CZ3 2.87Å; L521-W772 HydrophobicContact CB-CE3 3.98Å; L521-W772 HydrophobicContact CB-CH2 4.24Å; L521-W772 HydrophobicContact CB-CZ3 3.74Å; L521-W772 HydrophobicContact CD1-CD2 3.97Å; L521-W772 HydrophobicContact CD1-CE3 4.08Å; L521-W772 HydrophobicContact CD1-CH2 4.04Å; L521-W772 HydrophobicContact CD1-CZ2 3.89Å; L521-W772 HydrophobicContact CD1-CZ3 4.13Å; L521-W772 HydrophobicContact CG-CZ3 4.45Å; I728-W772 HydrophobicContact CG2-CZ2 4.35Å; L729-W772 HydrophobicContact CD2-CH2 4.14Å; L729-W772 HydrophobicContact CD2-CZ3 4.47Å; V732-W772 HydrophobicContact CB-CZ2 3.92Å; V732-W772 HydrophobicContact CG1-CH2 4.35Å; V732-W772 HydrophobicContact CG1-CZ2 3.86Å; V732-W772 HydrophobicContact CG2-CH2 4.22Å; V732-W772 HydrophobicContact CG2-CZ2 4.07Å; P770-W772 HydrophobicContact CB-CZ2 4.3Å; W772-T774 VanDerWaalsContact C-N 3.34Å; W772-T774 PolarHBondContact O-N 3.11Å
773	N	66.5	Low	56.7	Low	54.6667 Å²	54.6667	91 Å²	91	29%	0.292	47%	0.472	S	S	.	.			trans	-74.6	103.9	166.8	-82.2	-32	0	0	0	109.1	N520 K522 I775	N520-N773 HydrophobicContact CB-CB 4.43Å; N520-N773 WeakPolarHBondContact O-CB 3.41Å; N520-N773 PolarHBondContact O-N 3.16Å; N520-N773 PolarHBondContact O-ND2 2.88Å; K522-N773 WeakPolarHBondContact CB-ND2 3.32Å; K522-N773 WeakPolarHBondContact CB-OD1 3.37Å; K522-N773 VanDerWaalsContact CD-OD1 3.23Å; K522-N773 WeakPolarHBondContact CD-OD1 3.4Å; K522-N773 WeakPolarHBondContact CG-OD1 3.24Å; N773-I775 PolarHBondContact O-N 3.32Å
774	T	51	Low	54.3	Low	120.333 Å²	120.333	94.8 Å²	94.8	74%	0.738	50%	0.497	S	S	*	.			trans	-78.6	106.8	163.8	48.2	0	0	0	0	108.6	W772 A776	W772-T774 VanDerWaalsContact C-N 3.34Å; W772-T774 PolarHBondContact O-N 3.11Å; T774-A776 VanDerWaalsContact C-N 3.3Å; T774-A776 PolarHBondContact O-N 2.88Å
775	I	39.1	Very low	51.6	Low	144.667 Å²	144.667	101.8 Å²	101.8	74%	0.742	53%	0.534	S	S	*	.			trans	-71	84.5	167	-57.3	174.6	0	0	0	106.9	N773 T777	N773-I775 PolarHBondContact O-N 3.32Å; I775-T777 PolarHBondContact O-N 3.45Å; I775-T777 VanDerWaalsContact O-N 3.11Å
776	A	32.7	Very low	49	Very low	84.6667 Å²	84.6667	107.7 Å²	107.7	70%	0.7	57%	0.565	S	S	*	*			trans	-71.5	97.2	173.5	0	0	0	0	0	108.4	T774 S778	T774-A776 VanDerWaalsContact C-N 3.3Å; T774-A776 PolarHBondContact O-N 2.88Å; A776-S778 PolarHBondContact O-N 3.04Å
777	T	31.2	Very low	46.3	Very low	125 Å²	125	115 Å²	115	77%	0.767	60%	0.604	S	S	*	*			trans	-57.7	105	159.1	37.9	0	0	0	0	108.5	I775 R779	I775-T777 PolarHBondContact O-N 3.45Å; I775-T777 VanDerWaalsContact O-N 3.11Å; T777-R779 VanDerWaalsContact C-N 3.3Å; T777-R779 PolarHBondContact O-N 3.22Å
778	S	26.5	Very low	43.6	Very low	117 Å²	117	122.5 Å²	122.5	82%	0.818	64%	0.636	S	S	*	*			trans	-67.9	80.1	172.8	60.3	0	0	0	0	110.1	A776 N780	A776-S778 PolarHBondContact O-N 3.04Å; S778-N780 PolarHBondContact O-N 3.36Å; S778-N780 VanDerWaalsContact O-N 3.1Å
779	R	27.4	Very low	40.8	Very low	225.667 Å²	225.667	130.9 Å²	130.9	85%	0.852	67%	0.672	S	S	*	*			trans	-130.6	117.1	166.7	-123.2	170.6	-174	168.3	1.5	108.6	T777 Q781	T777-R779 VanDerWaalsContact C-N 3.3Å; T777-R779 PolarHBondContact O-N 3.22Å; R779-Q781 PolarHBondContact O-N 3.19Å
780	N	28.5	Very low	38.1	Very low	152 Å²	152	133.4 Å²	133.4	81%	0.813	69%	0.688	S	S	*	*			trans	57.2	66.4	166.2	-57.1	-10.8	0	0	0	116.5	S778 M782	S778-N780 PolarHBondContact O-N 3.36Å; S778-N780 VanDerWaalsContact O-N 3.1Å; N780-M782 VanDerWaalsContact C-N 3.31Å; N780-M782 PolarHBondContact O-N 3.21Å
781	Q	25.5	Very low	35.2	Very low	202.667 Å²	202.667	139.6 Å²	139.6	95%	0.947	72%	0.72	S	S	*	*			trans	-96	76.3	150.9	-92.3	177.7	-0.1	0	0	110.6	R779	R779-Q781 PolarHBondContact O-N 3.19Å
782	M	24.6	Very low	32.7	Very low	169 Å²	169	146.2 Å²	146.2	83%	0.833	75%	0.75	S	S	*	*			trans	-143.7	122.9	157	-109.7	-173.9	178.5	0	0	108.7	N780	N780-M782 VanDerWaalsContact C-N 3.31Å; N780-M782 PolarHBondContact O-N 3.21Å
783	N	27.7	Very low	30.3	Very low	146.333 Å²	146.333	147.1 Å²	147.1	78%	0.783	77%	0.769	S	S	*	*			trans	69.1	73.5	160.6	-59	-14.8	0	0	0	118.5	N785	N783-N785 PolarHBondContact O-N 2.77Å
784	I	27.7	Very low	28.3	Very low	163 Å²	163	154.6 Å²	154.6	84%	0.836	80%	0.799	S	S	*	*			trans	-111.6	81.7	146.1	-55.1	178.3	0	0	0	108.7
785	N	24.5	Very low	27	Very low	148.333 Å²	148.333	151.9 Å²	151.9	79%	0.793	80%	0.796	S	S	*	*			trans	-79.2	107	152.9	-77	-23.8	0	0	0	109.9	N783	N783-N785 PolarHBondContact O-N 2.77Å
786	I	28.6	Very low	26.3	Very low	162.667 Å²	162.667	150.7 Å²	150.7	83%	0.834	80%	0.8	S	S	*	*			trans	164.9	104.5	156	-78.3	152.7	0	0	0	108.5
787	L	25.2	Very low	26	Very low	158.333 Å²	158.333	153.5 Å²	153.5	83%	0.829	80%	0.802	S	S	*	*			trans	-144.4	91.3	160.9	-93.8	121.9	0	0	0	110.6
788	K	24.5	Very low	25.6	Very low	192 Å²	192	156.3 Å²	156.3	84%	0.835	81%	0.806	S	S	*	*			trans	-78.2	136.3	149.6	-83.2	177.4	175.9	178.3	0	112
789	K	25.2	Very low	25.6	Very low	176 Å²	176	159.8 Å²	159.8	77%	0.765	81%	0.806	S	S	*	*			trans	78.6	125.3	158.8	-73.8	-175.7	165.3	-147.3	0	115.3
790	D	26.5	Very low	25.5	Very low	127.667 Å²	127.667	154.1 Å²	154.1	68%	0.683	80%	0.801	S	S	*	*				-163.6	136.1	61.5	-63.7	-36.5	0	0	0	113.5
791	N	23.1	Very low	25.2	Very low	146.667 Å²	146.667	155.2 Å²	155.2	78%	0.784	80%	0.804	S	S	*	*				-163.8	135.7	113.4	-88.4	-9.9	0	0	0	110.1
792	E	25.8	Very low	25.2	Very low	172 Å²	172	155 Å²	155	80%	0.804	80%	0.8	S	S	*	*			trans	80.7	121.3	155.2	-73.3	176.2	-163.5	0	0	115.7
793	S	24.5	Very low	25.2	Very low	99.6667 Å²	99.6667	153.8 Å²	153.8	70%	0.697	80%	0.796	S	S	*	*				81	146	107.6	63.1	0	0	0	0	117.1
794	F	23.7	Very low	25.2	Very low	212.667 Å²	212.667	153 Å²	153	93%	0.933	79%	0.792	S	S	*	*			trans	-107.1	127.7	165.6	-75.3	-88.8	0	0	0	116
795	G	25.4	Very low	25.1	Very low	64.3333 Å²	64.3333	153.4 Å²	153.4	66%	0.663	79%	0.788	S	S	*	*			trans	115.4	98.3	145.2	0	0	0	0	0	116	I797	G795-I797 PolarHBondContact O-N 2.97Å; G795-I797 VanDerWaalsContact O-N 3.14Å
796	S	24.3	Very low	25.1	Very low	118.333 Å²	118.333	155.2 Å²	155.2	83%	0.828	79%	0.789	S	S	*	*				-18.6	123.3	123.7	62.1	0	0	0	0	112.7
797	I	25.4	Very low	24.9	Very low	144 Å²	144	155.8 Å²	155.8	74%	0.738	79%	0.788	S	S	*	*			trans	-130.9	119.3	149.5	-86.1	174.4	0	0	0	109.3	G795 K799	G795-I797 PolarHBondContact O-N 2.97Å; G795-I797 VanDerWaalsContact O-N 3.14Å; I797-K799 HydrophobicContact CG2-CG 4.26Å; I797-K799 PolarHBondContact O-N 3.03Å
798	Q	22.9	Very low	24.9	Very low	183.333 Å²	183.333	153.1 Å²	153.1	86%	0.857	78%	0.782	S	S	*	*			trans	-26.7	125.9	160.1	-75.8	171.1	-20.2	0	0	114.6
799	K	27.1	Very low	24.9	Very low	190.667 Å²	190.667	149.8 Å²	149.8	83%	0.829	78%	0.778	S	S	*	*			trans	-143	99.1	142	-90.1	-179.9	179.9	175.3	0	109.9	I797	I797-K799 HydrophobicContact CG2-CG 4.26Å; I797-K799 PolarHBondContact O-N 3.03Å
800	S	24.6	Very low	24.8	Very low	106 Å²	106	149.9 Å²	149.9	74%	0.741	78%	0.781	S	S	*	*				14.7	110.1	129.8	62.1	0	0	0	0	114.3	K802	S800-K802 PolarHBondContact O-N 2.73Å
801	M	21.8	Very low	24.8	Very low	175.25 Å²	175.25	150.9 Å²	150.9	86%	0.863	79%	0.787	S	S	*	*			trans	-60.6	122.7	139.3	-98.7	176.5	139.1	0	0	111.6
802	K	26.8	Very low	24.8	Very low	198.75 Å²	198.75	148.9 Å²	148.9	86%	0.864	78%	0.784	S	S	*	*			trans	-122.6	134.4	162.3	-92.1	-178.9	175.8	-179.6	0	110.2	S800 D804	S800-K802 PolarHBondContact O-N 2.73Å; K802-D804 PolarHBondContact O-N 2.93Å
803	N	24.1	Very low	24.8	Very low	143 Å²	143	148.7 Å²	148.7	77%	0.765	79%	0.785	S	S	*	*			trans	-75.6	130.4	177.4	-59.6	-23.3	0	0	0	110.5
804	D	27.4	Very low	24.9	Very low	129.75 Å²	129.75	154.4 Å²	154.4	69%	0.694	79%	0.793	S	S	*	*			trans	-119.7	126.8	146.8	-92.2	-36.9	0	0	0	109.7	K802 F806	K802-D804 PolarHBondContact O-N 2.93Å; D804-F806 WeakPolarHBondContact O-CD2 3.12Å; D804-F806 PolarHBondContact O-N 3.1Å; D804-F806 VanDerWaalsContact O-N 3.13Å
805	K	25.1	Very low	25	Very low	172.5 Å²	172.5	153.2 Å²	153.2	75%	0.75	79%	0.79	S	S	*	*			trans	-66.7	121.5	159.7	-83.1	169.8	178.9	148.1	0	112.7	H807	K805-H807 PolarHBondContact O-N 3.18Å
806	F	24.9	Very low	25.1	Very low	185.25 Å²	185.25	159.4 Å²	159.4	81%	0.813	80%	0.798	S	S	*	*			trans	-32.8	117	152.2	-74.1	-78.5	0	0	0	115.9	D804 S808	D804-F806 WeakPolarHBondContact O-CD2 3.12Å; D804-F806 PolarHBondContact O-N 3.1Å; D804-F806 VanDerWaalsContact O-N 3.13Å; F806-S808 PolarHBondContact O-N 3.16Å
807	H	25.6	Very low	25.5	Very low	174.75 Å²	174.75	159.1 Å²	159.1	81%	0.809	79%	0.794	S	S	*	*			trans	-69.8	111.5	148.6	-84.6	-81	0	0	0	113	K805 V809	K805-H807 PolarHBondContact O-N 3.18Å; H807-V809 PolarHBondContact O-N 3.21Å
808	S	24.3	Very low	25.5	Very low	102.25 Å²	102.25	159.7 Å²	159.7	72%	0.715	80%	0.798	S	S	*	*			trans	-64.3	113.1	153.7	58	0	0	0	0	111.7	F806 Q810	F806-S808 PolarHBondContact O-N 3.16Å; S808-Q810 PolarHBondContact O-N 3.23Å
809	V	24.7	Very low	25.7	Very low	123.5 Å²	123.5	158.2 Å²	158.2	75%	0.748	80%	0.796	S	S	*	*			trans	-101.7	120.4	150	170.8	0	0	0	0	109.8	H807 N811	H807-V809 PolarHBondContact O-N 3.21Å; V809-N811 PolarHBondContact O-N 3.4Å
810	Q	23.7	Very low	25.7	Very low	178 Å²	178	155.2 Å²	155.2	83%	0.832	79%	0.794	S	S	*	*			trans	-55.1	124	165	-76.1	170.5	-44.1	0	0	114	S808	S808-Q810 PolarHBondContact O-N 3.23Å
811	N	26	Very low	25.9	Very low	148 Å²	148	159.1 Å²	159.1	79%	0.791	80%	0.797	S	S	*	*			trans	-136.4	121.9	150.5	-88.8	-15.9	0	0	0	113.5	V809 M813	V809-N811 PolarHBondContact O-N 3.4Å; N811-M813 PolarHBondContact O-N 2.88Å
812	S	23.7	Very low	26.1	Very low	104.5 Å²	104.5	159.5 Å²	159.5	73%	0.731	80%	0.797	S	S	*	*			trans	-75.3	143.6	170.6	58.9	0	0	0	0	113.6	Y814	S812-Y814 PolarHBondContact O-N 2.77Å
813	M	24.4	Very low	26.1	Very low	167.75 Å²	167.75	158 Å²	158	83%	0.826	80%	0.797	S	S	*	*			trans	-137.4	119	157.7	-98.3	-176.6	170.4	0	0	112.6	N811 H815	N811-M813 PolarHBondContact O-N 2.88Å; M813-H815 PolarHBondContact O-N 2.78Å
814	Y	26.2	Very low	26.4	Very low	220 Å²	220	156.8 Å²	156.8	86%	0.863	80%	0.795	S	S	*	*			trans	-61.5	118	156.7	-79	-82.9	0	0	0	114.5	S812 K816	S812-Y814 PolarHBondContact O-N 2.77Å; Y814-K816 PolarHBondContact O-N 2.97Å
815	H	27.2	Very low	26.5	Very low	186.5 Å²	186.5	155.6 Å²	155.6	86%	0.863	79%	0.794	S	S	*	*			trans	-117.7	127.3	150.9	-90.1	-78.5	0	0	0	109.8	M813	M813-H815 PolarHBondContact O-N 2.78Å
816	K	26.9	Very low	26.8	Very low	194.75 Å²	194.75	152.2 Å²	152.2	85%	0.847	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-109.6	148.4	175.7	-121.9	-177.5	177.7	-179.7	0	108.6	Y814	Y814-K816 PolarHBondContact O-N 2.97Å
817	P	33	Very low	27.4	Very low	113 Å²	113	150.4 Å²	150.4	73%	0.734	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-88.2	149.1	-163.7	29	-25.5	0	0	0	113	L819	P817-L819 VanDerWaalsContact C-N 3.26Å; P817-L819 PolarHBondContact O-N 3.12Å
818	D	25.9	Very low	28.1	Very low	155.25 Å²	155.25	147.5 Å²	147.5	83%	0.83	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-92.2	126.3	156.8	-90.1	-45.1	0	0	0	112.4	T820	D818-T820 PolarHBondContact O-N 3.13Å; D818-T820 VanDerWaalsContact O-N 3.13Å
819	L	27.2	Very low	29.4	Very low	153.25 Å²	153.25	146.3 Å²	146.3	80%	0.802	77%	0.774	S	S	*	*			trans	-68.7	84.7	173.8	-142.2	83.2	0	0	0	113.2	P817 K821	P817-L819 VanDerWaalsContact C-N 3.26Å; P817-L819 PolarHBondContact O-N 3.12Å; L819-K821 HydrophobicContact CD2-CD 3.97Å; L819-K821 HydrophobicContact CD2-CG 4.19Å; L819-K821 HydrophobicContact CG-CG 4.22Å; L819-K821 PolarHBondContact O-N 2.8Å
820	T	26.8	Very low	30.9	Very low	127.5 Å²	127.5	145.1 Å²	145.1	78%	0.782	76%	0.763	S	S	*	*			trans	-68.9	97	162.1	51.2	0	0	0	0	113.6	D818 E822	D818-T820 PolarHBondContact O-N 3.13Å; D818-T820 VanDerWaalsContact O-N 3.13Å; T820-E822 PolarHBondContact O-N 2.83Å; T820-E822 VanDerWaalsContact O-N 3.16Å
821	K	28.1	Very low	32.5	Very low	187.5 Å²	187.5	137.1 Å²	137.1	82%	0.815	73%	0.725	S	S	*	*			trans	-71.5	126.3	156.9	-81.4	173.8	179.1	178.3	0	110.8	L819 L823	L819-K821 HydrophobicContact CD2-CD 3.97Å; L819-K821 HydrophobicContact CD2-CG 4.19Å; L819-K821 HydrophobicContact CG-CG 4.22Å; L819-K821 PolarHBondContact O-N 2.8Å; K821-L823 PolarHBondContact O-N 3.06Å
822	E	26.6	Very low	34.2	Very low	182.75 Å²	182.75	131.4 Å²	131.4	85%	0.854	70%	0.695	S	S	*	*			trans	-29.8	115.9	167	-71.6	174.5	135	0	0	112.1	T820 V824	T820-E822 PolarHBondContact O-N 2.83Å; T820-E822 VanDerWaalsContact O-N 3.16Å; E822-V824 VanDerWaalsContact C-N 3.29Å; E822-V824 PolarHBondContact O-N 3.01Å; E822-V824 VanDerWaalsContact O-N 3.09Å
823	L	27.1	Very low	36.1	Very low	167.75 Å²	167.75	127.5 Å²	127.5	88%	0.878	67%	0.667	S	S	*	*			trans	-70.1	98.1	162.4	-130.3	82.6	0	0	0	107.2	K821 P825	K821-L823 PolarHBondContact O-N 3.06Å; L823-P825 WeakPolarHBondContact O-CD 3.42Å; L823-P825 VanDerWaalsContact O-N 3.09Å
824	V	29.5	Very low	38.1	Very low	118.5 Å²	118.5	120.4 Å²	120.4	72%	0.718	63%	0.632	S	S	*	*			trans	-53.1	124.6	168.6	178.4	0	0	0	0	107.4	E822 S826	E822-V824 VanDerWaalsContact C-N 3.29Å; E822-V824 PolarHBondContact O-N 3.01Å; E822-V824 VanDerWaalsContact O-N 3.09Å; V824-S826 PolarHBondContact O-N 2.79Å
825	P	29.3	Very low	40.2	Very low	105 Å²	105	111.8 Å²	111.8	68%	0.682	60%	0.601	S	S	*	*			trans	-60	121.7	-174.2	12.1	-16.6	0	0	0	109.2	L823 N827	L823-P825 WeakPolarHBondContact O-CD 3.42Å; L823-P825 VanDerWaalsContact O-N 3.09Å; P825-N827 PolarHBondContact O-N 3.23Å; P825-N827 PolarHBondContact O-OD1 3.14Å
826	S	30.7	Very low	42.2	Very low	100 Å²	100	104.6 Å²	104.6	70%	0.699	57%	0.567	S	S	*	*			trans	-60.8	104.3	177.1	49.1	0	0	0	0	108.7	V824 T828	V824-S826 PolarHBondContact O-N 2.79Å; S826-T828 VanDerWaalsContact C-N 3.29Å; S826-T828 PolarHBondContact O-N 3.11Å
827	N	38.6	Very low	44.2	Very low	147 Å²	147	97.1 Å²	97.1	79%	0.786	54%	0.536	S	S	*	.			trans	-51.1	97.2	-178.7	-77.9	-17.5	0	0	0	110.2	P825 V829	P825-N827 PolarHBondContact O-N 3.23Å; P825-N827 PolarHBondContact O-OD1 3.14Å; N827-V829 VanDerWaalsContact C-N 3.28Å; N827-V829 PolarHBondContact O-N 3.1Å; N827-V829 VanDerWaalsContact O-N 3.09Å
828	T	40.9	Very low	45.7	Very low	114.75 Å²	114.75	93.7 Å²	93.7	70%	0.704	52%	0.515	S	S	*	.			trans	-72.1	97.2	176.5	41.6	0	0	0	0	108.3	S826 I830	S826-T828 VanDerWaalsContact C-N 3.29Å; S826-T828 PolarHBondContact O-N 3.11Å; T828-I830 PolarHBondContact O-N 3.12Å
829	V	51.5	Low	47.6	Very low	76.75 Å²	76.75	91.4 Å²	91.4	47%	0.465	50%	0.499	S	S	.	.			trans	-70.7	116.1	175.4	-178	0	0	0	0	108.3	N827 L831 L922 T957	N827-V829 VanDerWaalsContact C-N 3.28Å; N827-V829 PolarHBondContact O-N 3.1Å; N827-V829 VanDerWaalsContact O-N 3.09Å; V829-L831 HydrophobicContact CG1-CD2 4.14Å; V829-L831 PolarHBondContact O-N 3.01Å; V829-L922 HydrophobicContact CB-CD1 4.36Å; V829-L922 HydrophobicContact CB-CD2 4.28Å; V829-L922 HydrophobicContact CG1-CD2 3.76Å; V829-L922 HydrophobicContact CG2-CD1 3.87Å; V829-L922 HydrophobicContact CG2-CD2 4.33Å; V829-T957 HydrophobicContact CG1-CG2 4.09Å
830	I	55	Low	49.3	Very low	99.5 Å²	99.5	85.6 Å²	85.6	51%	0.51	48%	0.476	S	S	.	.			trans	-77.7	117.6	177.1	-58.9	173.8	0	0	0	107.9	T828 T916 Q920	T828-I830 PolarHBondContact O-N 3.12Å; I830-T916 HydrophobicContact CG2-CG2 3.7Å; I830-Q920 HydrophobicContact CG2-CB 4.21Å; I830-Q920 HydrophobicContact CG2-CG 3.66Å
831	L	57.1	Low	50.9	Low	8.75 Å²	8.75	82.8 Å²	82.8	5%	0.046	45%	0.453	C	S	.	.			trans	-96.5	131	171.1	-61.3	-175	0	0	0	109.3	V829 F915 T916 I917 Q920 C921 L922 L923 V955 G956 T957	V829-L831 HydrophobicContact CG1-CD2 4.14Å; V829-L831 PolarHBondContact O-N 3.01Å; L831-F915 HydrophobicContact CB-CD2 4.14Å; L831-F915 HydrophobicContact CD1-CB 4.34Å; L831-T916 WeakPolarHBondContact O-CG2 3.29Å; L831-I917 HydrophobicContact CD1-CB 4.13Å; L831-I917 HydrophobicContact CD1-CD1 3.75Å; L831-I917 HydrophobicContact CD1-CG1 3.86Å; L831-Q920 WeakPolarHBondContact O-CA 3.09Å; L831-C921 WeakPolarHBondContact CB-O 3.23Å; L831-C921 WeakPolarHBondContact CD1-O 3.23Å; L831-C921 WeakPolarHBondContact CG-O 3.48Å; L831-L922 HydrophobicContact CD2-CD2 4.09Å; L831-L923 HydrophobicContact CD1-CB 4.32Å; L831-L923 HydrophobicContact CD1-CD1 4.37Å; L831-V955 HydrophobicContact CB-CG1 4.18Å; L831-V955 HydrophobicContact CD1-CG1 4.21Å; L831-G956 CarbonylContact C-O 3.5Å; L831-G956 WeakPolarHBondContact CA-O 3.39Å; L831-G956 WeakPolarHBondContact CB-O 3.24Å; L831-T957 HydrophobicContact CD2-CG2 4.08Å; L831-T957 VanDerWaalsContact CD2-CG2 3.44Å
832	N	62.5	Low	52.6	Low	28.75 Å²	28.75	79.7 Å²	79.7	15%	0.154	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	154.1	170.6	-74.1	-17.9	0	0	0	109.6	Q912 T916 S919 V955 G956 Q958 I961	N832-Q912 PolarHBondContact OD1-NE2 2.86Å; N832-T916 WeakPolarHBondContact OD1-CG2 3.32Å; N832-T916 PolarHBondContact OD1-OG1 3.38Å; N832-S919 CarbonylContact C-O 3.54Å; N832-S919 WeakPolarHBondContact CA-O 3.41Å; N832-V955 CarbonylContact O-C 3.53Å; N832-V955 VanDerWaalsContact O-CA 3.27Å; N832-V955 WeakPolarHBondContact O-CA 3.35Å; N832-G956 WeakPolarHBondContact CA-O 3.32Å; N832-G956 PolarHBondContact N-O 3.09Å; N832-G956 PolarHBondContact O-N 3.01Å; N832-G956 VanDerWaalsContact O-N 3.08Å; N832-Q958 VanDerWaalsContact ND2-CA 3.3Å; N832-Q958 WeakPolarHBondContact ND2-CA 3.3Å; N832-Q958 VanDerWaalsContact ND2-CB 3.35Å; N832-Q958 WeakPolarHBondContact ND2-CB 3.31Å; N832-Q958 VanDerWaalsContact ND2-CD 3.31Å; N832-Q958 PolarHBondContact ND2-OE1 3.25Å; N832-I961 VanDerWaalsContact C-CD1 3.46Å; N832-I961 HydrophobicContact CB-CB 4.44Å; N832-I961 HydrophobicContact CB-CD1 3.59Å; N832-I961 VanDerWaalsContact CB-CD1 3.46Å; N832-I961 HydrophobicContact CB-CG1 4.18Å; N832-I961 HydrophobicContact CB-CG2 4.25Å; N832-I961 WeakPolarHBondContact O-CD1 3.32Å
833	T	63.4	Low	54.3	Low	23.5 Å²	23.5	74.9 Å²	74.9	14%	0.144	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	140.4	173.3	-53.7	0	0	0	0	108.9	Y913 F915 I917 R918 S919 L953 A954 V955	T833-Y913 HydrophobicContact CG2-CD2 4.24Å; T833-F915 CarbonylContact C-O 3.54Å; T833-F915 VanDerWaalsContact CA-O 3.31Å; T833-F915 WeakPolarHBondContact CA-O 3.22Å; T833-F915 WeakPolarHBondContact CB-O 3.24Å; T833-F915 HydrophobicContact CG2-CE1 4.24Å; T833-F915 HydrophobicContact CG2-CE2 3.8Å; T833-F915 HydrophobicContact CG2-CZ 4.05Å; T833-F915 PolarHBondContact N-O 3.03Å; T833-F915 PolarHBondContact O-N 2.99Å; T833-F915 WeakPolarHBondContact OG1-CE2 3.49Å; T833-F915 WeakPolarHBondContact OG1-CZ 3.44Å; T833-I917 CarbonylContact C-O 3.57Å; T833-I917 CarbonylContact O-C 3.5Å; T833-R918 VanDerWaalsContact O-CA 3.27Å; T833-R918 WeakPolarHBondContact O-CA 3.39Å; T833-S919 VanDerWaalsContact CB-OG 3.23Å; T833-S919 WeakPolarHBondContact CB-OG 3.45Å; T833-S919 PolarHBondContact N-O 3.28Å; T833-S919 PolarHBondContact OG1-O 3.5Å; T833-S919 PolarHBondContact OG1-OG 2.73Å; T833-L953 HydrophobicContact CG2-CD1 3.56Å; T833-L953 VanDerWaalsContact CG2-CD1 3.49Å; T833-A954 CarbonylContact C-O 3.55Å; T833-A954 VanDerWaalsContact CA-O 3.24Å; T833-A954 WeakPolarHBondContact CA-O 3.38Å; T833-A954 WeakPolarHBondContact CG2-O 3.43Å; T833-V955 HydrophobicContact CG2-CG2 4.08Å
834	I	67.3	Low	55.8	Low	17.5 Å²	17.5	71.8 Å²	71.8	9%	0.09	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.6	163.4	-69.5	-178	0	0	0	107.8	H836 Q912 T916 I917 L953 A954 I961 L964 L965	I834-H836 HydrophobicContact CG2-CB 4Å; I834-Q912 HydrophobicContact CG2-CG 4.23Å; I834-T916 HydrophobicContact CB-CG2 4.46Å; I834-T916 HydrophobicContact CD1-CG2 3.58Å; I834-T916 HydrophobicContact CG1-CG2 3.68Å; I834-T916 HydrophobicContact CG2-CG2 4.22Å; I834-I917 WeakPolarHBondContact CA-O 3.35Å; I834-L953 CarbonylContact O-C 3.52Å; I834-L953 VanDerWaalsContact O-CA 3.28Å; I834-L953 WeakPolarHBondContact O-CA 3.29Å; I834-L953 WeakPolarHBondContact O-CD1 3.44Å; I834-A954 PolarHBondContact N-O 2.95Å; I834-A954 PolarHBondContact O-N 2.98Å; I834-I961 HydrophobicContact CB-CD1 4.45Å; I834-I961 HydrophobicContact CD1-CB 4.42Å; I834-I961 HydrophobicContact CD1-CD1 3.85Å; I834-I961 HydrophobicContact CD1-CG1 4.17Å; I834-I961 HydrophobicContact CD1-CG2 3.37Å; I834-I961 HydrophobicContact CG1-CD1 4.15Å; I834-I961 HydrophobicContact CG1-CG1 4.26Å; I834-I961 HydrophobicContact CG1-CG2 3.79Å; I834-I961 VanDerWaalsContact CG1-CG2 3.47Å; I834-L964 HydrophobicContact CD1-CD2 4.41Å; I834-L965 HydrophobicContact CD1-CD1 3.68Å; I834-L965 HydrophobicContact CD1-CD2 3.77Å; I834-L965 HydrophobicContact CD1-CG 3.71Å
835	L	70.2	Confident	57.1	Low	40.25 Å²	40.25	71.1 Å²	71.1	21%	0.211	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	114	159.5	179.6	71.1	0	0	0	107.5	V877 L879 Y913 F915 I917 V951 L952 L953	L835-V877 HydrophobicContact CD2-CB 4.41Å; L835-V877 HydrophobicContact CD2-CG1 3.94Å; L835-V877 HydrophobicContact CD2-CG2 4.25Å; L835-L879 HydrophobicContact CD2-CD1 4.38Å; L835-Y913 PolarHBondContact N-O 2.87Å; L835-Y913 WeakPolarHBondContact O-CA 3.25Å; L835-Y913 WeakPolarHBondContact O-CB 3.18Å; L835-Y913 PolarHBondContact O-N 2.92Å; L835-Y913 VanDerWaalsContact O-O 3.11Å; L835-F915 HydrophobicContact CB-CE1 3.6Å; L835-F915 HydrophobicContact CB-CE2 3.88Å; L835-F915 HydrophobicContact CB-CZ 4.16Å; L835-F915 HydrophobicContact CD2-CE2 3.58Å; L835-F915 HydrophobicContact CD2-CZ 4.02Å; L835-F915 HydrophobicContact CG-CE2 3.44Å; L835-F915 VanDerWaalsContact CG-CE2 3.44Å; L835-F915 HydrophobicContact CG-CZ 3.95Å; L835-F915 CarbonylContact O-C 3.51Å; L835-F915 WeakPolarHBondContact O-CD2 3.41Å; L835-F915 WeakPolarHBondContact O-CE2 3.29Å; L835-I917 HydrophobicContact CB-CD1 3.87Å; L835-I917 HydrophobicContact CD2-CD1 4.11Å; L835-I917 HydrophobicContact CG-CD1 4.47Å; L835-V951 HydrophobicContact CD1-CG1 3.49Å; L835-V951 VanDerWaalsContact CD1-CG1 3.47Å; L835-L952 CarbonylContact C-O 3.48Å; L835-L952 WeakPolarHBondContact CA-O 3.39Å; L835-L953 HydrophobicContact CB-CD1 4.22Å; L835-L953 HydrophobicContact CD1-CB 4.23Å; L835-L953 HydrophobicContact CD1-CD1 4.14Å
836	H	68.8	Low	58.1	Low	34.5 Å²	34.5	68.4 Å²	68.4	16%	0.16	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.7	178	177.7	-107.4	0	0	0	109.3	I834 S838 L952	I834-H836 HydrophobicContact CG2-CB 4Å; H836-S838 VanDerWaalsContact CE1-CB 3.48Å; H836-S838 WeakPolarHBondContact CE1-CB 3.33Å; H836-L952 HydrophobicContact CB-CB 4.3Å; H836-L952 HydrophobicContact CB-CD2 4.41Å; H836-L952 PolarHBondContact N-O 3Å; H836-L952 PolarHBondContact O-N 3.29Å
837	I	68.5	Low	58.7	Low	37 Å²	37	69.1 Å²	69.1	19%	0.19	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	101.8	176.8	-57.6	-179.7	0	0	0	107	L875 V877 L906 C910 Y913 F915 I949 H950 V951	I837-L875 HydrophobicContact CB-CD2 4.4Å; I837-L875 HydrophobicContact CD1-CD2 3.79Å; I837-L875 HydrophobicContact CG2-CD2 4.19Å; I837-V877 HydrophobicContact CD1-CG2 4.04Å; I837-L906 HydrophobicContact CD1-CD1 3.74Å; I837-C910 WeakPolarHBondContact O-CB 3.11Å; I837-Y913 CarbonylContact C-O 3.55Å; I837-Y913 HydrophobicContact CG2-CD2 3.86Å; I837-Y913 CarbonylContact O-C 3.51Å; I837-Y913 WeakPolarHBondContact O-CA 3.43Å; I837-Y913 VanDerWaalsContact O-CB 3.3Å; I837-Y913 WeakPolarHBondContact O-CB 3.32Å; I837-Y913 PolarHBondContact O-N 3.36Å; I837-F915 HydrophobicContact CB-CD1 4.38Å; I837-F915 HydrophobicContact CB-CE1 3.45Å; I837-F915 VanDerWaalsContact CB-CE1 3.45Å; I837-F915 HydrophobicContact CB-CZ 3.85Å; I837-F915 HydrophobicContact CD1-CE1 3.49Å; I837-F915 VanDerWaalsContact CD1-CE1 3.49Å; I837-F915 HydrophobicContact CD1-CZ 3.3Å; I837-F915 HydrophobicContact CG1-CE1 3.41Å; I837-F915 VanDerWaalsContact CG1-CE1 3.41Å; I837-F915 HydrophobicContact CG1-CE2 4.38Å; I837-F915 HydrophobicContact CG1-CZ 3.25Å; I837-I949 HydrophobicContact CD1-CD1 4.18Å; I837-I949 HydrophobicContact CG2-CB 4.01Å; I837-I949 HydrophobicContact CG2-CD1 4.41Å; I837-I949 HydrophobicContact CG2-CG2 4.27Å; I837-H950 CarbonylContact C-O 3.51Å; I837-H950 VanDerWaalsContact CA-O 3.3Å; I837-H950 WeakPolarHBondContact CA-O 3.26Å; I837-H950 WeakPolarHBondContact CG2-O 3.26Å; I837-V951 HydrophobicContact CD1-CG2 4.14Å; I837-V951 HydrophobicContact CG1-CB 4.38Å; I837-V951 HydrophobicContact CG1-CG1 4.15Å; I837-V951 HydrophobicContact CG1-CG2 4.21Å
838	S	64.6	Low	58.7	Low	42.5 Å²	42.5	66.1 Å²	66.1	30%	0.297	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-39.8	-170.8	55.9	0	0	0	0	112.9	H836 C910 Q912 Y913 H950	H836-S838 VanDerWaalsContact CE1-CB 3.48Å; H836-S838 WeakPolarHBondContact CE1-CB 3.33Å; S838-C910 PolarHBondContact O-SG 2.93Å; S838-Q912 CarbonylContact O-C 3.07Å; S838-Q912 VanDerWaalsContact O-C 3.25Å; S838-Q912 WeakPolarHBondContact O-CA 3.38Å; S838-Q912 WeakPolarHBondContact O-CB 3.48Å; S838-Q912 WeakPolarHBondContact O-CG 3.37Å; S838-Y913 PolarHBondContact O-N 2.98Å; S838-H950 PolarHBondContact N-O 3.19Å; S838-H950 VanDerWaalsContact N-O 3.16Å; S838-H950 WeakPolarHBondContact OG-CB 3.41Å; S838-H950 PolarHBondContact OG-ND1 3.19Å
839	E	65.3	Low	58.6	Low	106.75 Å²	106.75	69.2 Å²	69.2	50%	0.499	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	157.6	-170.9	-6.5	179.8	176.4	0	0	112.2	P911 W934 I949 H950	E839-P911 CarbonylContact C-O 3.48Å; E839-P911 VanDerWaalsContact CA-O 3.3Å; E839-P911 WeakPolarHBondContact CA-O 3.47Å; E839-W934 HydrophobicContact CB-CH2 3.92Å; E839-W934 HydrophobicContact CB-CZ2 4.31Å; E839-W934 HydrophobicContact CB-CZ3 4.25Å; E839-W934 VanDerWaalsContact CD-CH2 3.48Å; E839-W934 HydrophobicContact CG-CH2 3.47Å; E839-W934 VanDerWaalsContact CG-CH2 3.47Å; E839-W934 HydrophobicContact CG-CZ2 3.77Å; E839-W934 HydrophobicContact CG-CZ3 4.29Å; E839-W934 VanDerWaalsContact OE1-CZ2 3.25Å; E839-W934 WeakPolarHBondContact OE1-CZ2 3.31Å; E839-W934 WeakPolarHBondContact OE2-CH2 3.5Å; E839-W934 WeakPolarHBondContact OE2-CZ2 3.12Å; E839-I949 CarbonylContact O-C 3.56Å; E839-I949 VanDerWaalsContact O-CA 3.3Å; E839-I949 WeakPolarHBondContact O-CA 3.19Å; E839-H950 HydrophobicContact CB-CB 4.26Å; E839-H950 HydrophobicContact CG-CB 3.56Å; E839-H950 VanDerWaalsContact CG-CB 3.45Å; E839-H950 PolarHBondContact O-N 3.01Å
840	G	63.2	Low	57.9	Low	31 Å²	31	76.3 Å²	76.3	32%	0.32	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	141.7	170.4	0	0	0	0	0	110.7	C910 P911 Q948	G840-C910 CarbonylContact O-C 3.51Å; G840-C910 WeakPolarHBondContact O-CA 3.28Å; G840-C910 WeakPolarHBondContact O-CB 3.43Å; G840-P911 PolarHBondContact N-O 2.82Å; G840-Q948 CarbonylContact C-O 3.56Å; G840-Q948 VanDerWaalsContact CA-O 3.3Å; G840-Q948 WeakPolarHBondContact CA-O 3.27Å
841	K	61.1	Low	57	Low	68.25 Å²	68.25	75.5 Å²	75.5	30%	0.297	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	151.7	177.1	74.1	-173.6	177.4	-170.9	0	111.1	L843 W934 G947 Q948	K841-L843 PolarHBondContact O-N 3.22Å; K841-L843 VanDerWaalsContact O-N 3.12Å; K841-W934 HydrophobicContact CB-CH2 3.93Å; K841-W934 HydrophobicContact CB-CZ3 3.9Å; K841-W934 HydrophobicContact CD-CD2 4Å; K841-W934 HydrophobicContact CD-CE3 3.79Å; K841-W934 HydrophobicContact CD-CH2 3.7Å; K841-W934 HydrophobicContact CD-CZ2 3.9Å; K841-W934 HydrophobicContact CD-CZ3 3.65Å; K841-W934 VanDerWaalsContact CE-CD2 3.5Å; K841-W934 VanDerWaalsContact CE-CE3 3.44Å; K841-W934 HydrophobicContact CG-CE3 3.89Å; K841-W934 HydrophobicContact CG-CH2 3.85Å; K841-W934 HydrophobicContact CG-CZ2 4.42Å; K841-W934 HydrophobicContact CG-CZ3 3.49Å; K841-W934 VanDerWaalsContact CG-CZ3 3.48Å; K841-W934 VanDerWaalsContact NZ-CG 3.3Å; K841-G947 WeakPolarHBondContact O-CA 3.46Å; K841-Q948 HydrophobicContact CG-CB 4.14Å; K841-Q948 PolarHBondContact N-O 2.8Å; K841-Q948 PolarHBondContact O-N 2.82Å
842	E	64.2	Low	56	Low	123.5 Å²	123.5	81.7 Å²	81.7	58%	0.577	40%	0.398	S	S	*	.	S	Bend	trans	53.2	29.6	178.9	-63.9	-164	-145.4	0	0	115.1	K844 G947	E842-K844 VanDerWaalsContact O-CD 3.32Å; E842-K844 WeakPolarHBondContact O-CD 3.36Å; E842-K844 WeakPolarHBondContact O-CE 3.32Å; E842-K844 VanDerWaalsContact O-CG 3.31Å; E842-K844 WeakPolarHBondContact O-CG 3.44Å; E842-K844 PolarHBondContact O-N 3.05Å; E842-K844 VanDerWaalsContact O-N 3.12Å; E842-K844 IonicContact OE2-NZ 3.28Å; E842-K844 PolarHBondContact OE2-NZ 3.09Å; E842-G947 VanDerWaalsContact O-CA 3.26Å; E842-G947 WeakPolarHBondContact O-CA 3.36Å
843	L	62.5	Low	54.8	Low	81.75 Å²	81.75	88.9 Å²	88.9	43%	0.428	43%	0.43	S	S	.	.			trans	-62.2	112.5	179.3	-59.3	-179.7	0	0	0	110.4	K841 I870 P911 I937 N946 I949	K841-L843 PolarHBondContact O-N 3.22Å; K841-L843 VanDerWaalsContact O-N 3.12Å; L843-I870 HydrophobicContact CB-CB 4.18Å; L843-I870 HydrophobicContact CB-CD1 4.08Å; L843-I870 HydrophobicContact CB-CG1 4.34Å; L843-I870 PolarHBondContact O-N 3.01Å; L843-P911 HydrophobicContact CD1-CG 3.62Å; L843-I937 HydrophobicContact CD2-CD1 3.46Å; L843-I937 VanDerWaalsContact CD2-CD1 3.47Å; L843-I937 HydrophobicContact CD2-CG1 4.41Å; L843-N946 CarbonylContact C-O 3.52Å; L843-N946 VanDerWaalsContact CA-O 3.3Å; L843-N946 WeakPolarHBondContact CA-O 3.44Å; L843-I949 HydrophobicContact CD2-CG2 4.4Å
844	K	57.8	Low	53.6	Low	103 Å²	103	94.3 Å²	94.3	45%	0.448	46%	0.458	S	S	.	.			trans	-118.6	122.7	-178	-68.5	153.1	-167.6	160.9	0	108.4	E842 S846 N946	E842-K844 VanDerWaalsContact O-CD 3.32Å; E842-K844 WeakPolarHBondContact O-CD 3.36Å; E842-K844 WeakPolarHBondContact O-CE 3.32Å; E842-K844 VanDerWaalsContact O-CG 3.31Å; E842-K844 WeakPolarHBondContact O-CG 3.44Å; E842-K844 PolarHBondContact O-N 3.05Å; E842-K844 VanDerWaalsContact O-N 3.12Å; E842-K844 IonicContact OE2-NZ 3.28Å; E842-K844 PolarHBondContact OE2-NZ 3.09Å; K844-S846 PolarHBondContact O-N 3.14Å; K844-N946 PolarHBondContact N-O 2.89Å; K844-N946 VanDerWaalsContact O-CB 3.32Å; K844-N946 WeakPolarHBondContact O-CB 3.35Å; K844-N946 VanDerWaalsContact O-CG 3.3Å; K844-N946 PolarHBondContact O-ND2 3.37Å; K844-N946 PolarHBondContact O-OD1 3.41Å
845	L	56.5	Low	52	Low	104 Å²	104	97.8 Å²	97.8	55%	0.545	48%	0.476	S	S	.	.			trans	-73.4	129.6	164.8	-81.5	105.6	0	0	0	108.7	N847 I868 I870	L845-N847 VanDerWaalsContact C-N 3.34Å; L845-N847 PolarHBondContact O-N 3.05Å; L845-I868 PolarHBondContact N-O 2.88Å; L845-I868 VanDerWaalsContact N-O 3.16Å; L845-I870 HydrophobicContact CB-CD1 4.48Å; L845-I870 HydrophobicContact CB-CG1 4.41Å; L845-I870 HydrophobicContact CD1-CD1 3.56Å; L845-I870 VanDerWaalsContact CD1-CD1 3.41Å; L845-I870 HydrophobicContact CD1-CG1 3.67Å; L845-I870 HydrophobicContact CD2-CD1 3.64Å; L845-I870 HydrophobicContact CD2-CG1 3.85Å; L845-I870 HydrophobicContact CG-CD1 3.94Å; L845-I870 HydrophobicContact CG-CG1 3.86Å
846	S	50.4	Low	50.4	Low	47 Å²	47	100.9 Å²	100.9	33%	0.329	50%	0.497	S	S	.	.			trans	-64.9	111.3	173.5	47.6	0	0	0	0	109.5	K844 N848 D939 N946	K844-S846 PolarHBondContact O-N 3.14Å; S846-N848 WeakPolarHBondContact CB-ND2 3.34Å; S846-N848 PolarHBondContact O-N 3.19Å; S846-D939 WeakPolarHBondContact CB-OD2 3.37Å; S846-D939 PolarHBondContact OG-OD2 3.12Å; S846-N946 WeakPolarHBondContact CB-ND2 3.31Å; S846-N946 WeakPolarHBondContact CB-OD1 3.28Å; S846-N946 PolarHBondContact OG-ND2 2.97Å
847	N	42.8	Very low	48.8	Very low	114.25 Å²	114.25	102.6 Å²	102.6	61%	0.611	51%	0.512	S	S	*	.			trans	-73.1	56.4	172.8	-99.1	-22.6	0	0	0	110.5	L845 Y849 D866	L845-N847 VanDerWaalsContact C-N 3.34Å; L845-N847 PolarHBondContact O-N 3.05Å; N847-Y849 HydrophobicContact CB-CD2 3.97Å; N847-Y849 HydrophobicContact CB-CE2 3.75Å; N847-Y849 WeakPolarHBondContact O-CD2 3.18Å; N847-Y849 PolarHBondContact O-N 3.13Å; N847-D866 PolarHBondContact ND2-O 2.82Å
848	N	39.9	Very low	47.6	Very low	84.25 Å²	84.25	109.2 Å²	109.2	45%	0.451	54%	0.54	S	S	.	.			trans	-69.3	108.4	174	-85.2	-24.3	0	0	0	108.8	S846 R850 N851 D939 S942	S846-N848 WeakPolarHBondContact CB-ND2 3.34Å; S846-N848 PolarHBondContact O-N 3.19Å; N848-R850 PolarHBondContact O-N 3.31Å; N848-N851 WeakPolarHBondContact O-CB 3.16Å; N848-N851 PolarHBondContact O-N 2.98Å; N848-N851 VanDerWaalsContact O-N 3.14Å; N848-D939 PolarHBondContact ND2-OD2 2.91Å; N848-S942 VanDerWaalsContact ND2-CB 3.34Å; N848-S942 WeakPolarHBondContact ND2-CB 3.3Å; N848-S942 PolarHBondContact ND2-OG 3.38Å
849	Y	38.8	Very low	46.4	Very low	180.75 Å²	180.75	114.5 Å²	114.5	71%	0.709	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-55	-13.3	-170.1	-84.6	-101.1	0	0	0	115.4	N847 N851 K852	N847-Y849 HydrophobicContact CB-CD2 3.97Å; N847-Y849 HydrophobicContact CB-CE2 3.75Å; N847-Y849 WeakPolarHBondContact O-CD2 3.18Å; N847-Y849 PolarHBondContact O-N 3.13Å; Y849-N851 VanDerWaalsContact C-N 3.28Å; Y849-N851 PolarHBondContact O-N 2.94Å; Y849-K852 HydrophobicContact CD1-CD 4.37Å; Y849-K852 WeakPolarHBondContact O-CB 3.3Å; Y849-K852 PolarHBondContact O-N 3.19Å
850	R	36.6	Very low	45	Very low	225.5 Å²	225.5	113.3 Å²	113.3	85%	0.851	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-68.8	-27	173.3	-76	-171.8	173.1	-172.3	-2.8	113.8	N848 K852 Q853	N848-R850 PolarHBondContact O-N 3.31Å; R850-K852 PolarHBondContact O-N 3.07Å; R850-K852 VanDerWaalsContact O-N 3.08Å; R850-Q853 PolarHBondContact O-N 2.92Å; R850-Q853 VanDerWaalsContact O-N 3.1Å
851	N	36.1	Very low	43.8	Very low	82.5 Å²	82.5	115.9 Å²	115.9	44%	0.441	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-80.7	8.3	179.2	-72.4	-4.8	0	0	0	113.5	N848 Y849 Q853 L854 L855	N848-N851 WeakPolarHBondContact O-CB 3.16Å; N848-N851 PolarHBondContact O-N 2.98Å; N848-N851 VanDerWaalsContact O-N 3.14Å; Y849-N851 VanDerWaalsContact C-N 3.28Å; Y849-N851 PolarHBondContact O-N 2.94Å; N851-Q853 PolarHBondContact O-N 3.26Å; N851-L854 CarbonylContact O-C 3.47Å; N851-L854 WeakPolarHBondContact O-CA 3.17Å; N851-L854 PolarHBondContact O-N 3.14Å; N851-L854 VanDerWaalsContact O-N 3.11Å; N851-L855 HydrophobicContact CB-CD1 3.58Å; N851-L855 HydrophobicContact CB-CG 4.4Å; N851-L855 WeakPolarHBondContact O-CB 3.35Å; N851-L855 WeakPolarHBondContact O-CD1 3.46Å; N851-L855 WeakPolarHBondContact O-CG 3.47Å; N851-L855 PolarHBondContact O-N 3.06Å
852	K	35.1	Very low	42.5	Very low	138.75 Å²	138.75	120.1 Å²	120.1	60%	0.603	58%	0.579	S	S	*	*	H	α-helix	trans	-56.8	-27.9	172.3	-88.3	-173	174.8	179.1	0	113.4	Y849 R850 L854 L855 T856	Y849-K852 HydrophobicContact CD1-CD 4.37Å; Y849-K852 WeakPolarHBondContact O-CB 3.3Å; Y849-K852 PolarHBondContact O-N 3.19Å; R850-K852 PolarHBondContact O-N 3.07Å; R850-K852 VanDerWaalsContact O-N 3.08Å; K852-L854 VanDerWaalsContact C-N 3.31Å; K852-L854 PolarHBondContact O-N 3Å; K852-L855 HydrophobicContact CG-CD1 4.45Å; K852-L855 CarbonylContact O-C 3.33Å; K852-L855 PolarHBondContact O-N 3.09Å; K852-T856 HydrophobicContact CB-CG2 4.32Å; K852-T856 WeakPolarHBondContact O-CA 3.4Å; K852-T856 VanDerWaalsContact O-CB 3.3Å; K852-T856 WeakPolarHBondContact O-CB 3.48Å; K852-T856 WeakPolarHBondContact O-CG2 3.18Å; K852-T856 PolarHBondContact O-N 2.92Å; K852-T856 PolarHBondContact O-OG1 3Å; K852-T856 VanDerWaalsContact O-OG1 3.14Å
853	Q	39	Very low	41.4	Very low	179.5 Å²	179.5	118.8 Å²	118.8	84%	0.839	58%	0.575	S	S	*	*	H	α-helix	trans	-75.7	-20.9	176.3	-77.7	-178.6	-19	0	0	114.1	R850 N851 T856	R850-Q853 PolarHBondContact O-N 2.92Å; R850-Q853 VanDerWaalsContact O-N 3.1Å; N851-Q853 PolarHBondContact O-N 3.26Å; Q853-T856 VanDerWaalsContact C-OG1 3.28Å; Q853-T856 WeakPolarHBondContact CA-OG1 3.18Å; Q853-T856 PolarHBondContact O-OG1 2.94Å
854	L	37.2	Very low	40.3	Very low	137.25 Å²	137.25	120.2 Å²	120.2	72%	0.719	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-21.9	175.9	-80.5	159.4	0	0	0	113.1	N851 K852 T856 S857	N851-L854 CarbonylContact O-C 3.47Å; N851-L854 WeakPolarHBondContact O-CA 3.17Å; N851-L854 PolarHBondContact O-N 3.14Å; N851-L854 VanDerWaalsContact O-N 3.11Å; K852-L854 VanDerWaalsContact C-N 3.31Å; K852-L854 PolarHBondContact O-N 3Å; L854-T856 PolarHBondContact O-N 2.72Å; L854-T856 VanDerWaalsContact O-N 3.09Å; L854-S857 WeakPolarHBondContact O-CB 3.29Å; L854-S857 PolarHBondContact O-N 2.81Å; L854-S857 PolarHBondContact O-OG 3.39Å
855	L	34.5	Very low	39.5	Very low	90.75 Å²	90.75	121.6 Å²	121.6	48%	0.475	60%	0.602	S	S	.	*			trans	-95.8	16.3	179.4	-64	169.6	0	0	0	112.7	N851 K852 S857 I860 I868	N851-L855 HydrophobicContact CB-CD1 3.58Å; N851-L855 HydrophobicContact CB-CG 4.4Å; N851-L855 WeakPolarHBondContact O-CB 3.35Å; N851-L855 WeakPolarHBondContact O-CD1 3.46Å; N851-L855 WeakPolarHBondContact O-CG 3.47Å; N851-L855 PolarHBondContact O-N 3.06Å; K852-L855 HydrophobicContact CG-CD1 4.45Å; K852-L855 CarbonylContact O-C 3.33Å; K852-L855 PolarHBondContact O-N 3.09Å; L855-S857 VanDerWaalsContact C-N 3.27Å; L855-S857 PolarHBondContact O-N 3.22Å; L855-I860 HydrophobicContact CB-CD1 4.14Å; L855-I860 HydrophobicContact CD2-CD1 3.5Å; L855-I860 HydrophobicContact CG-CD1 4.42Å; L855-I868 HydrophobicContact CB-CD1 4.34Å; L855-I868 HydrophobicContact CD1-CD1 3.64Å; L855-I868 HydrophobicContact CD2-CD1 4.34Å; L855-I868 HydrophobicContact CG-CD1 4.34Å
856	T	35.3	Very low	38.8	Very low	106.75 Å²	106.75	122.3 Å²	122.3	66%	0.655	61%	0.606	S	S	*	*			trans	-83.4	46.1	166.3	57.4	0	0	0	0	111.5	K852 Q853 L854 K858	K852-T856 HydrophobicContact CB-CG2 4.32Å; K852-T856 WeakPolarHBondContact O-CA 3.4Å; K852-T856 VanDerWaalsContact O-CB 3.3Å; K852-T856 WeakPolarHBondContact O-CB 3.48Å; K852-T856 WeakPolarHBondContact O-CG2 3.18Å; K852-T856 PolarHBondContact O-N 2.92Å; K852-T856 PolarHBondContact O-OG1 3Å; K852-T856 VanDerWaalsContact O-OG1 3.14Å; Q853-T856 VanDerWaalsContact C-OG1 3.28Å; Q853-T856 WeakPolarHBondContact CA-OG1 3.18Å; Q853-T856 PolarHBondContact O-OG1 2.94Å; L854-T856 PolarHBondContact O-N 2.72Å; L854-T856 VanDerWaalsContact O-N 3.09Å; T856-K858 PolarHBondContact O-N 3.38Å
857	S	36.3	Very low	38.1	Very low	68.75 Å²	68.75	123.8 Å²	123.8	48%	0.481	62%	0.616	S	S	.	*			trans	-63.7	120.8	168.8	85.5	0	0	0	0	111.9	L854 L855 Y859 I860 E1168	L854-S857 WeakPolarHBondContact O-CB 3.29Å; L854-S857 PolarHBondContact O-N 2.81Å; L854-S857 PolarHBondContact O-OG 3.39Å; L855-S857 VanDerWaalsContact C-N 3.27Å; L855-S857 PolarHBondContact O-N 3.22Å; S857-Y859 PolarHBondContact O-N 3.14Å; S857-Y859 PolarHBondContact OG-N 3.43Å; S857-I860 PolarHBondContact O-N 3.39Å; S857-E1168 WeakPolarHBondContact CB-OE2 3.33Å
858	K	41.8	Very low	38	Very low	175.75 Å²	175.75	122.4 Å²	122.4	76%	0.764	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-2.4	-174.9	-127.3	176.2	-178.4	178.5	0	114.5	T856	T856-K858 PolarHBondContact O-N 3.38Å
859	Y	39.7	Very low	37.9	Very low	155 Å²	155	122.1 Å²	122.1	61%	0.608	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	5.3	-165.8	-57.7	-75	0	0	0	114.3	S857 T861 E1168	S857-Y859 PolarHBondContact O-N 3.14Å; S857-Y859 PolarHBondContact OG-N 3.43Å; Y859-T861 PolarHBondContact O-N 3.28Å; Y859-E1168 WeakPolarHBondContact CD2-OE2 3.2Å; Y859-E1168 WeakPolarHBondContact CE2-OE1 3.31Å
860	I	36	Very low	38	Very low	81.5 Å²	81.5	116.7 Å²	116.7	42%	0.418	59%	0.591	S	S	.	*			trans	-96.9	94.9	173.4	-57.6	179.1	0	0	0	109	L855 S857 K862 I868	L855-I860 HydrophobicContact CB-CD1 4.14Å; L855-I860 HydrophobicContact CD2-CD1 3.5Å; L855-I860 HydrophobicContact CG-CD1 4.42Å; S857-I860 PolarHBondContact O-N 3.39Å; I860-K862 PolarHBondContact O-N 3.08Å; I860-K862 VanDerWaalsContact O-N 3.14Å; I860-I868 HydrophobicContact CG2-CB 4.01Å; I860-I868 HydrophobicContact CG2-CD1 3.99Å; I860-I868 HydrophobicContact CG2-CG1 3.67Å; I860-I868 HydrophobicContact CG2-CG2 3.72Å
861	T	38.7	Very low	38.2	Very low	85.75 Å²	85.75	111.3 Å²	111.3	53%	0.526	58%	0.575	S	S	.	*			trans	-71.7	111.1	168.2	37.6	0	0	0	0	109.7	Y859 L863 V869	Y859-T861 PolarHBondContact O-N 3.28Å; T861-L863 PolarHBondContact O-N 3.25Å; T861-L863 VanDerWaalsContact O-N 3.15Å; T861-V869 PolarHBondContact O-N 2.89Å
862	K	33.9	Very low	38.4	Very low	155.25 Å²	155.25	112.9 Å²	112.9	68%	0.675	58%	0.58	S	S	*	*	B	Isolated β-bridge	trans	-69	114.3	173.3	-77.7	-172.4	176.7	-168.1	0	110.4	I860 P864 D866 I868	I860-K862 PolarHBondContact O-N 3.08Å; I860-K862 VanDerWaalsContact O-N 3.14Å; K862-P864 WeakPolarHBondContact O-CD 3.43Å; K862-D866 WeakPolarHBondContact CE-OD1 3.3Å; K862-D866 IonicContact NZ-OD1 3.26Å; K862-D866 PolarHBondContact NZ-OD1 3.19Å; K862-D866 IonicContact NZ-OD2 3.39Å; K862-I868 HydrophobicContact CG-CG1 4.22Å
863	L	39.7	Very low	38.8	Very low	97.25 Å²	97.25	109.7 Å²	109.7	51%	0.509	58%	0.575	S	S	.	*			trans	-76.6	147.3	163.2	-113.5	72.9	0	0	0	109.5	T861 N865 D866 C867 V869	T861-L863 PolarHBondContact O-N 3.25Å; T861-L863 VanDerWaalsContact O-N 3.15Å; L863-N865 PolarHBondContact O-N 3.17Å; L863-D866 PolarHBondContact O-N 2.9Å; L863-D866 VanDerWaalsContact O-N 3.14Å; L863-C867 HydrophobicContact CB-CB 4.28Å; L863-C867 WeakPolarHBondContact CB-O 3.23Å; L863-C867 PolarHBondContact N-O 2.88Å; L863-V869 HydrophobicContact CD1-CG2 3.72Å
864	P	40.4	Very low	39.3	Very low	110.5 Å²	110.5	108.3 Å²	108.3	72%	0.718	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-5.3	178.6	-12.8	19.2	0	0	0	114.2	K862 D866	K862-P864 WeakPolarHBondContact O-CD 3.43Å; P864-D866 VanDerWaalsContact C-N 3.32Å
865	N	41.6	Very low	39.9	Very low	133 Å²	133	104.7 Å²	104.7	71%	0.711	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	34.1	178.2	-58.3	3.3	0	0	0	113.4	L863 C867	L863-N865 PolarHBondContact O-N 3.17Å; N865-C867 PolarHBondContact O-N 3.29Å; N865-C867 PolarHBondContact O-SG 3.19Å; N865-C867 VanDerWaalsContact O-SG 3.4Å
866	D	41.2	Very low	40.8	Very low	118.75 Å²	118.75	104.3 Å²	104.3	64%	0.635	54%	0.542	S	S	*	.	S	Bend	trans	66.2	31.1	174.9	-94.6	-30.2	0	0	0	114.4	N847 K862 L863 P864 I868	N847-D866 PolarHBondContact ND2-O 2.82Å; K862-D866 WeakPolarHBondContact CE-OD1 3.3Å; K862-D866 IonicContact NZ-OD1 3.26Å; K862-D866 PolarHBondContact NZ-OD1 3.19Å; K862-D866 IonicContact NZ-OD2 3.39Å; L863-D866 PolarHBondContact O-N 2.9Å; L863-D866 VanDerWaalsContact O-N 3.14Å; P864-D866 VanDerWaalsContact C-N 3.32Å; D866-I868 PolarHBondContact O-N 2.95Å
867	C	35.4	Very low	41.5	Very low	78.5 Å²	78.5	100.8 Å²	100.8	53%	0.53	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-76.8	129.7	173.1	-68.3	0	0	0	0	110.6	L863 N865 V869	L863-C867 HydrophobicContact CB-CB 4.28Å; L863-C867 WeakPolarHBondContact CB-O 3.23Å; L863-C867 PolarHBondContact N-O 2.88Å; N865-C867 PolarHBondContact O-N 3.29Å; N865-C867 PolarHBondContact O-SG 3.19Å; N865-C867 VanDerWaalsContact O-SG 3.4Å; C867-V869 PolarHBondContact O-N 3.4Å
868	I	40.4	Very low	42.1	Very low	84.5 Å²	84.5	104.9 Å²	104.9	43%	0.433	53%	0.525	S	S	.	.	B	Isolated β-bridge	trans	-87.5	116.6	171.7	-63.4	171.2	0	0	0	108	L845 L855 I860 K862 D866 I870	L845-I868 PolarHBondContact N-O 2.88Å; L845-I868 VanDerWaalsContact N-O 3.16Å; L855-I868 HydrophobicContact CB-CD1 4.34Å; L855-I868 HydrophobicContact CD1-CD1 3.64Å; L855-I868 HydrophobicContact CD2-CD1 4.34Å; L855-I868 HydrophobicContact CG-CD1 4.34Å; I860-I868 HydrophobicContact CG2-CB 4.01Å; I860-I868 HydrophobicContact CG2-CD1 3.99Å; I860-I868 HydrophobicContact CG2-CG1 3.67Å; I860-I868 HydrophobicContact CG2-CG2 3.72Å; K862-I868 HydrophobicContact CG-CG1 4.22Å; D866-I868 PolarHBondContact O-N 2.95Å; I868-I870 HydrophobicContact CG2-CG1 4.12Å; I868-I870 PolarHBondContact O-N 3.19Å
869	V	38.7	Very low	42.4	Very low	77.5 Å²	77.5	99.2 Å²	99.2	47%	0.47	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-78	119.7	171.8	-176.1	0	0	0	0	108.7	T861 L863 C867 E871	T861-V869 PolarHBondContact O-N 2.89Å; L863-V869 HydrophobicContact CD1-CG2 3.72Å; C867-V869 PolarHBondContact O-N 3.4Å; V869-E871 HydrophobicContact CG1-CG 3.85Å; V869-E871 PolarHBondContact O-N 3.42Å; V869-E871 VanDerWaalsContact O-N 3.17Å
870	I	41	Very low	42.4	Very low	68.5 Å²	68.5	95.6 Å²	95.6	35%	0.351	50%	0.498	S	S	.	.			trans	-96.4	104.4	175.9	-56.6	164.5	0	0	0	107.5	L843 L845 I868 H872	L843-I870 HydrophobicContact CB-CB 4.18Å; L843-I870 HydrophobicContact CB-CD1 4.08Å; L843-I870 HydrophobicContact CB-CG1 4.34Å; L843-I870 PolarHBondContact O-N 3.01Å; L845-I870 HydrophobicContact CB-CD1 4.48Å; L845-I870 HydrophobicContact CB-CG1 4.41Å; L845-I870 HydrophobicContact CD1-CD1 3.56Å; L845-I870 VanDerWaalsContact CD1-CD1 3.41Å; L845-I870 HydrophobicContact CD1-CG1 3.67Å; L845-I870 HydrophobicContact CD2-CD1 3.64Å; L845-I870 HydrophobicContact CD2-CG1 3.85Å; L845-I870 HydrophobicContact CG-CD1 3.94Å; L845-I870 HydrophobicContact CG-CG1 3.86Å; I868-I870 HydrophobicContact CG2-CG1 4.12Å; I868-I870 PolarHBondContact O-N 3.19Å; I870-H872 VanDerWaalsContact C-N 3.32Å; I870-H872 WeakPolarHBondContact CG2-O 3.33Å; I870-H872 PolarHBondContact O-N 2.94Å
871	E	39.9	Very low	42.8	Very low	111.5 Å²	111.5	98.8 Å²	98.8	52%	0.521	51%	0.505	S	S	.	.	S	Bend	trans	-73.7	-21.4	-178.7	-64.4	-171.7	145.7	0	0	113.6	V869 S907 G908	V869-E871 HydrophobicContact CG1-CG 3.85Å; V869-E871 PolarHBondContact O-N 3.42Å; V869-E871 VanDerWaalsContact O-N 3.17Å; E871-S907 CarbonylContact O-C 3.52Å; E871-S907 WeakPolarHBondContact O-CA 3.33Å; E871-G908 PolarHBondContact O-N 2.77Å
872	H	40.6	Very low	42.8	Very low	115.5 Å²	115.5	97.1 Å²	97.1	54%	0.535	50%	0.496	S	S	.	.			trans	-135.4	93.7	-171.7	-62	93.2	0	0	0	111.7	I870 Y874 S907 R1066	I870-H872 VanDerWaalsContact C-N 3.32Å; I870-H872 WeakPolarHBondContact CG2-O 3.33Å; I870-H872 PolarHBondContact O-N 2.94Å; H872-Y874 HydrophobicContact CB-CE2 4.45Å; H872-S907 WeakPolarHBondContact CD2-CB 3.43Å; H872-R1066 PolarHBondContact O-NH2 3.06Å
873	S	44.2	Very low	42.8	Very low	72.25 Å²	72.25	95.8 Å²	95.8	51%	0.505	49%	0.492	S	S	.	.			trans	-125.6	128.6	171.4	58.1	0	0	0	0	110.7	L906 P911 Y913	S873-L906 PolarHBondContact N-O 2.56Å; S873-L906 PolarHBondContact O-N 3.44Å; S873-P911 WeakPolarHBondContact OG-CG 3.3Å; S873-Y913 WeakPolarHBondContact CB-OH 3.47Å; S873-Y913 PolarHBondContact OG-OH 2.86Å
874	Y	47.6	Very low	42.6	Very low	149.25 Å²	149.25	96.9 Å²	96.9	59%	0.585	50%	0.495	S	S	*	.			trans	-113.9	139.7	179.4	3.6	-90.7	0	0	0	110.4	H872 I876 V903 R1066 R1185	H872-Y874 HydrophobicContact CB-CE2 4.45Å; Y874-I876 HydrophobicContact CD2-CD1 3.99Å; Y874-I876 HydrophobicContact CD2-CG1 3.7Å; Y874-I876 HydrophobicContact CE2-CD1 3.63Å; Y874-I876 HydrophobicContact CE2-CG1 3.85Å; Y874-V903 HydrophobicContact CD2-CG1 4.15Å; Y874-V903 HydrophobicContact CG-CG1 3.98Å; Y874-R1066 VanDerWaalsContact CE1-NH2 3.35Å; Y874-R1066 PolarHBondContact OH-NH1 2.96Å; Y874-R1185 PolarHBondContact OH-NH1 2.79Å
875	L	51.1	Low	42.2	Very low	61.25 Å²	61.25	97.2 Å²	97.2	32%	0.321	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	115.8	173.1	-176.8	66.8	0	0	0	109.1	I837 V877 A904 L906 Y913 F915 I937 I949	I837-L875 HydrophobicContact CB-CD2 4.4Å; I837-L875 HydrophobicContact CD1-CD2 3.79Å; I837-L875 HydrophobicContact CG2-CD2 4.19Å; L875-V877 HydrophobicContact CD2-CG2 4.3Å; L875-V877 HydrophobicContact CG-CG2 4.22Å; L875-A904 PolarHBondContact N-O 3.27Å; L875-A904 VanDerWaalsContact N-O 3.14Å; L875-A904 PolarHBondContact O-N 2.91Å; L875-L906 HydrophobicContact CB-CD1 4.17Å; L875-L906 HydrophobicContact CD2-CD1 3.79Å; L875-L906 HydrophobicContact CG-CD1 4.18Å; L875-Y913 HydrophobicContact CB-CD1 3.87Å; L875-Y913 HydrophobicContact CB-CE1 3.9Å; L875-Y913 HydrophobicContact CB-CG 4.23Å; L875-Y913 HydrophobicContact CD2-CD1 4.42Å; L875-Y913 HydrophobicContact CD2-CD2 3.94Å; L875-Y913 HydrophobicContact CD2-CE2 4.36Å; L875-Y913 HydrophobicContact CD2-CG 3.93Å; L875-F915 HydrophobicContact CD2-CE1 4.07Å; L875-I937 HydrophobicContact CD1-CD1 4.22Å; L875-I937 HydrophobicContact CD1-CG1 4.41Å; L875-I949 HydrophobicContact CD1-CD1 4.23Å; L875-I949 HydrophobicContact CD2-CD1 3.79Å
876	I	52.8	Low	41.8	Very low	82.25 Å²	82.25	98 Å²	98	42%	0.422	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	112.3	175.6	-58.7	-180	0	0	0	108.3	Y874 R878 V903 Y1187	Y874-I876 HydrophobicContact CD2-CD1 3.99Å; Y874-I876 HydrophobicContact CD2-CG1 3.7Å; Y874-I876 HydrophobicContact CE2-CD1 3.63Å; Y874-I876 HydrophobicContact CE2-CG1 3.85Å; I876-R878 HydrophobicContact CG2-CG 4.16Å; I876-V903 HydrophobicContact CB-CG2 4.32Å; I876-V903 HydrophobicContact CD1-CG2 4.3Å; I876-V903 HydrophobicContact CG1-CG1 4.11Å; I876-V903 HydrophobicContact CG1-CG2 3.96Å; I876-V903 HydrophobicContact CG2-CG1 3.94Å; I876-V903 HydrophobicContact CG2-CG2 4.13Å; I876-Y1187 VanDerWaalsContact CD1-OH 3.24Å; I876-Y1187 WeakPolarHBondContact CD1-OH 3.15Å; I876-Y1187 HydrophobicContact CG2-CE1 4.33Å
877	V	50.5	Low	41.4	Very low	33.5 Å²	33.5	97.1 Å²	97.1	20%	0.203	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	116.6	173.7	-175.1	0	0	0	0	108.7	L835 I837 L875 L879 N902 A904 L906 Y913 F915	L835-V877 HydrophobicContact CD2-CB 4.41Å; L835-V877 HydrophobicContact CD2-CG1 3.94Å; L835-V877 HydrophobicContact CD2-CG2 4.25Å; I837-V877 HydrophobicContact CD1-CG2 4.04Å; L875-V877 HydrophobicContact CD2-CG2 4.3Å; L875-V877 HydrophobicContact CG-CG2 4.22Å; V877-L879 HydrophobicContact CG1-CD1 3.72Å; V877-L879 HydrophobicContact CG1-CD2 4.4Å; V877-L879 HydrophobicContact CG1-CG 4.19Å; V877-N902 PolarHBondContact N-O 3.21Å; V877-N902 PolarHBondContact O-N 2.8Å; V877-A904 PolarHBondContact O-N 3Å; V877-L906 HydrophobicContact CG2-CD1 3.86Å; V877-Y913 HydrophobicContact CB-CD1 4.33Å; V877-Y913 HydrophobicContact CB-CE1 3.72Å; V877-Y913 HydrophobicContact CB-CE2 4.11Å; V877-Y913 HydrophobicContact CG1-CE1 4.37Å; V877-Y913 HydrophobicContact CG2-CE1 4.21Å; V877-Y913 HydrophobicContact CG2-CE2 3.76Å; V877-Y913 WeakPolarHBondContact CG2-OH 3.32Å; V877-F915 HydrophobicContact CG2-CD1 4.35Å; V877-F915 HydrophobicContact CG2-CE1 3.79Å; V877-F915 HydrophobicContact CG2-CE2 4.32Å; V877-F915 HydrophobicContact CG2-CZ 3.75Å
878	R	47.8	Very low	41.3	Very low	155 Å²	155	98.2 Å²	98.2	59%	0.585	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	119.3	173.1	-69.8	-170.5	174.3	-178.8	-1.3	109.6	I876 P880 V903 G1043 D1046 Y1187	I876-R878 HydrophobicContact CG2-CG 4.16Å; R878-P880 WeakPolarHBondContact O-CD 3.21Å; R878-V903 HydrophobicContact CG-CG2 4.15Å; R878-G1043 PolarHBondContact NH1-O 3.4Å; R878-D1046 IonicContact CZ-OD1 3.27Å; R878-D1046 IonicContact NH2-OD1 3.07Å; R878-D1046 PolarHBondContact NH2-OD1 2.69Å; R878-D1046 IonicContact NH2-OD2 3.97Å; R878-D1046 PolarHBondContact NH2-OD2 2.87Å; R878-Y1187 HydrophobicContact CG-CD1 4.29Å; R878-Y1187 HydrophobicContact CG-CE1 4.14Å; R878-Y1187 VanDerWaalsContact NE-CZ 3.27Å
879	L	48.4	Very low	41.1	Very low	56.75 Å²	56.75	99.4 Å²	99.4	30%	0.297	52%	0.515	S	S	.	.			trans	-108.7	116.7	175.4	-67.8	167.5	0	0	0	109	L835 V877 W881 C882 N902 Y913 F915 I917 L953	L835-L879 HydrophobicContact CD2-CD1 4.38Å; V877-L879 HydrophobicContact CG1-CD1 3.72Å; V877-L879 HydrophobicContact CG1-CD2 4.4Å; V877-L879 HydrophobicContact CG1-CG 4.19Å; L879-W881 HydrophobicContact CB-CE3 3.67Å; L879-W881 HydrophobicContact CB-CZ3 3.82Å; L879-W881 HydrophobicContact CD1-CE3 4.42Å; L879-W881 HydrophobicContact CD1-CZ3 4.1Å; L879-W881 PolarHBondContact O-N 2.84Å; L879-C882 WeakPolarHBondContact CB-SG 3.16Å; L879-C882 PolarHBondContact O-SG 2.88Å; L879-N902 PolarHBondContact N-O 3.07Å; L879-N902 PolarHBondContact O-N 3.47Å; L879-Y913 HydrophobicContact CD1-CD2 4.42Å; L879-Y913 HydrophobicContact CD1-CE2 3.58Å; L879-F915 HydrophobicContact CD1-CD1 3.4Å; L879-F915 VanDerWaalsContact CD1-CD1 3.4Å; L879-F915 HydrophobicContact CD1-CD2 4.04Å; L879-F915 HydrophobicContact CD1-CE1 3.41Å; L879-F915 VanDerWaalsContact CD1-CE1 3.41Å; L879-F915 HydrophobicContact CD1-CE2 4.04Å; L879-F915 HydrophobicContact CD1-CG 3.76Å; L879-F915 HydrophobicContact CD1-CZ 3.74Å; L879-F915 HydrophobicContact CD2-CE2 4.49Å; L879-F915 HydrophobicContact CD2-CZ 4.19Å; L879-I917 HydrophobicContact CD1-CB 4.41Å; L879-I917 HydrophobicContact CD1-CD1 3.15Å; L879-I917 HydrophobicContact CD1-CG1 3.72Å; L879-I917 HydrophobicContact CD1-CG2 4.24Å; L879-L953 HydrophobicContact CD2-CD1 4.41Å; L879-L953 HydrophobicContact CD2-CD2 4.24Å
880	P	40.6	Very low	41	Very low	78.75 Å²	78.75	101.9 Å²	101.9	51%	0.511	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	143.7	170.1	28.6	-30.6	0	0	0	110.6	R878 C882 Y899	R878-P880 WeakPolarHBondContact O-CD 3.21Å; P880-C882 PolarHBondContact O-N 2.76Å; P880-Y899 HydrophobicContact CB-CD1 3.9Å; P880-Y899 HydrophobicContact CB-CE1 3.86Å; P880-Y899 HydrophobicContact CB-CG 4.24Å
881	W	44.8	Very low	40.8	Very low	149.25 Å²	149.25	106.6 Å²	106.6	57%	0.565	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	154.3	83.7	170.3	13	87.8	0	0	0	114.5	L879 H883 H900 N902 A904 I917	L879-W881 HydrophobicContact CB-CE3 3.67Å; L879-W881 HydrophobicContact CB-CZ3 3.82Å; L879-W881 HydrophobicContact CD1-CE3 4.42Å; L879-W881 HydrophobicContact CD1-CZ3 4.1Å; L879-W881 PolarHBondContact O-N 2.84Å; W881-H883 AromaticContact CD1-CE1 3.73Å; W881-H883 AromaticContact CD1-ND1 3.86Å; W881-H883 AromaticContact NE1-CE1 3.6Å; W881-H883 PolarHBondContact O-N 2.69Å; W881-H883 PolarHBondContact O-ND1 2.87Å; W881-H900 HydrophobicContact CH2-CB 4.11Å; W881-H900 HydrophobicContact CZ2-CB 3.44Å; W881-H900 VanDerWaalsContact CZ2-CB 3.44Å; W881-H900 AromaticContact NE1-CD2 3.84Å; W881-N902 VanDerWaalsContact CH2-CA 3.44Å; W881-N902 HydrophobicContact CH2-CB 3.34Å; W881-N902 WeakPolarHBondContact CH2-O 3.35Å; W881-N902 HydrophobicContact CZ2-CB 3.43Å; W881-N902 VanDerWaalsContact CZ2-CB 3.43Å; W881-N902 VanDerWaalsContact CZ3-C 3.46Å; W881-N902 HydrophobicContact CZ3-CB 4.31Å; W881-N902 WeakPolarHBondContact CZ3-O 3.49Å; W881-A904 HydrophobicContact CZ3-CB 4.47Å; W881-I917 HydrophobicContact CE3-CG2 3.98Å; W881-I917 HydrophobicContact CZ3-CG1 4.16Å; W881-I917 HydrophobicContact CZ3-CG2 3.91Å
882	C	37.2	Very low	40.5	Very low	49.5 Å²	49.5	106.3 Å²	106.3	33%	0.334	56%	0.561	S	S	.	*			trans	-109.9	118.3	179.1	-7.1	0	0	0	0	111.5	L879 P880 L896 Y899 N902 Y913 F915	L879-C882 WeakPolarHBondContact CB-SG 3.16Å; L879-C882 PolarHBondContact O-SG 2.88Å; P880-C882 PolarHBondContact O-N 2.76Å; C882-L896 HydrophobicContact CB-CD1 3.73Å; C882-L896 HydrophobicContact CB-CD2 4.04Å; C882-L896 HydrophobicContact CB-CG 3.68Å; C882-Y899 WeakPolarHBondContact SG-CD1 3.44Å; C882-N902 PolarHBondContact O-ND2 2.97Å; C882-Y913 HydrophobicContact CB-CD1 3.66Å; C882-Y913 HydrophobicContact CB-CE1 4.13Å; C882-Y913 HydrophobicContact CB-CG 3.96Å; C882-F915 HydrophobicContact CB-CE1 4.21Å
883	H	35.6	Very low	40.1	Very low	128.5 Å²	128.5	106.3 Å²	106.3	60%	0.595	57%	0.57	S	S	*	*			trans	-88.8	129.2	172.8	-77.1	56.7	0	0	0	110.6	W881 I885 D897	W881-H883 AromaticContact CD1-CE1 3.73Å; W881-H883 AromaticContact CD1-ND1 3.86Å; W881-H883 AromaticContact NE1-CE1 3.6Å; W881-H883 PolarHBondContact O-N 2.69Å; W881-H883 PolarHBondContact O-ND1 2.87Å; H883-I885 VanDerWaalsContact C-N 3.34Å; H883-I885 HydrophobicContact CB-CG1 4.26Å; H883-I885 PolarHBondContact O-N 2.91Å; H883-I885 VanDerWaalsContact O-N 3.1Å; H883-D897 PolarHBondContact NE2-O 3.08Å
884	Q	33.9	Very low	39.5	Very low	119.75 Å²	119.75	109.3 Å²	109.3	56%	0.56	58%	0.579	S	S	*	*			trans	-80	101.4	171.1	-174.6	166.9	-24.1	0	0	109.8	H886 Y899	Q884-H886 PolarHBondContact NE2-CE1 3.5Å; Q884-H886 PolarHBondContact NE2-NE2 3.13Å; Q884-H886 PolarHBondContact O-N 2.99Å; Q884-Y899 WeakPolarHBondContact CB-OH 3.34Å; Q884-Y899 PolarHBondContact OE1-OH 2.88Å; Q884-Y899 VanDerWaalsContact OE1-OH 3.13Å
885	I	33.1	Very low	38.7	Very low	117.25 Å²	117.25	108.6 Å²	108.6	60%	0.601	59%	0.585	S	S	*	*			trans	-76.9	108.1	171.2	-57.1	175.1	0	0	0	107.7	H883 S887 A914	H883-I885 VanDerWaalsContact C-N 3.34Å; H883-I885 HydrophobicContact CB-CG1 4.26Å; H883-I885 PolarHBondContact O-N 2.91Å; H883-I885 VanDerWaalsContact O-N 3.1Å; I885-S887 VanDerWaalsContact C-N 3.34Å; I885-S887 PolarHBondContact O-N 3.02Å; I885-S887 VanDerWaalsContact O-N 3.08Å; I885-A914 HydrophobicContact CD1-CB 4.2Å
886	H	33.5	Very low	37.7	Very low	150.5 Å²	150.5	111.4 Å²	111.4	70%	0.697	60%	0.6	S	S	*	*			trans	-72	93.1	166.1	-70	-83.4	0	0	0	109.3	Q884 S888	Q884-H886 PolarHBondContact NE2-CE1 3.5Å; Q884-H886 PolarHBondContact NE2-NE2 3.13Å; Q884-H886 PolarHBondContact O-N 2.99Å; H886-S888 VanDerWaalsContact C-N 3.31Å; H886-S888 PolarHBondContact O-N 3.02Å; H886-S888 VanDerWaalsContact O-N 3.08Å
887	S	31.7	Very low	36.7	Very low	98.5 Å²	98.5	113.1 Å²	113.1	69%	0.689	61%	0.61	S	S	*	*			trans	-75.2	82.1	173.5	61.1	0	0	0	0	110.2	I885 S889	I885-S887 VanDerWaalsContact C-N 3.34Å; I885-S887 PolarHBondContact O-N 3.02Å; I885-S887 VanDerWaalsContact O-N 3.08Å; S887-S889 PolarHBondContact O-N 3.04Å
888	S	34.5	Very low	35.9	Very low	101.75 Å²	101.75	117.4 Å²	117.4	71%	0.712	63%	0.628	S	S	*	*			trans	-77.7	134.5	167.9	45	0	0	0	0	111.2	H886 D890	H886-S888 VanDerWaalsContact C-N 3.31Å; H886-S888 PolarHBondContact O-N 3.02Å; H886-S888 VanDerWaalsContact O-N 3.08Å; S888-D890 PolarHBondContact O-N 2.9Å
889	S	35.6	Very low	35.2	Very low	109.5 Å²	109.5	117.7 Å²	117.7	77%	0.766	63%	0.63	S	S	*	*	S	Bend	trans	-2.1	40.7	173.4	50.1	0	0	0	0	117.1	S887 L891	S887-S889 PolarHBondContact O-N 3.04Å; S889-L891 PolarHBondContact O-N 3.23Å
890	D	36	Very low	34.5	Very low	131.75 Å²	131.75	120.8 Å²	120.8	71%	0.705	64%	0.642	S	S	*	*			trans	-136.9	110.8	152	-78.7	-21.3	0	0	0	112.4	S888 S892 T893	S888-D890 PolarHBondContact O-N 2.9Å; D890-S892 PolarHBondContact O-N 3.2Å; D890-S892 VanDerWaalsContact O-N 3.09Å; D890-T893 PolarHBondContact O-N 3.16Å; D890-T893 PolarHBondContact O-OG1 3.29Å
891	L	37	Very low	34.2	Very low	166.75 Å²	166.75	119.8 Å²	119.8	87%	0.873	64%	0.638	S	S	*	*			trans	-73.7	23	-171	-167	68.1	0	0	0	114.6	S889 I894	S889-L891 PolarHBondContact O-N 3.23Å; L891-I894 HydrophobicContact CD1-CD1 4.2Å
892	S	34.3	Very low	33.7	Very low	104 Å²	104	116.4 Å²	116.4	73%	0.727	63%	0.631	S	S	*	*	S	Bend	trans	-125.4	35.8	176.5	57	0	0	0	0	114.7	D890	D890-S892 PolarHBondContact O-N 3.2Å; D890-S892 VanDerWaalsContact O-N 3.09Å
893	T	30.9	Very low	33.7	Very low	115.25 Å²	115.25	117.5 Å²	117.5	71%	0.707	64%	0.636	S	S	*	*			trans	-161.5	64.7	169.9	41.6	0	0	0	0	112.9	D890 N895	D890-T893 PolarHBondContact O-N 3.16Å; D890-T893 PolarHBondContact O-OG1 3.29Å; T893-N895 PolarHBondContact O-N 3.18Å; T893-N895 VanDerWaalsContact O-N 3.17Å
894	I	33	Very low	33.7	Very low	135.75 Å²	135.75	112.7 Å²	112.7	70%	0.696	62%	0.618	S	S	*	*			trans	-73	97.8	166.5	-58	171.8	0	0	0	108	L891 L896	L891-I894 HydrophobicContact CD1-CD1 4.2Å; I894-L896 HydrophobicContact CG2-CD1 4.12Å; I894-L896 PolarHBondContact O-N 2.79Å
895	N	30.6	Very low	33.8	Very low	135 Å²	135	114.5 Å²	114.5	72%	0.722	62%	0.62	S	S	*	*			trans	-77.8	119.7	165.7	-117	3.4	0	0	0	108.5	T893 D897	T893-N895 PolarHBondContact O-N 3.18Å; T893-N895 VanDerWaalsContact O-N 3.17Å; N895-D897 VanDerWaalsContact C-N 3.32Å; N895-D897 PolarHBondContact ND2-OD1 3.35Å; N895-D897 PolarHBondContact ND2-OD2 3.5Å; N895-D897 PolarHBondContact O-N 2.92Å; N895-D897 VanDerWaalsContact O-N 3.14Å
896	L	30.2	Very low	33.8	Very low	119.25 Å²	119.25	114.2 Å²	114.2	62%	0.624	62%	0.619	S	S	*	*			trans	-85.6	88.4	-177.3	-158.9	75.7	0	0	0	109.8	C882 I894 Q898	C882-L896 HydrophobicContact CB-CD1 3.73Å; C882-L896 HydrophobicContact CB-CD2 4.04Å; C882-L896 HydrophobicContact CB-CG 3.68Å; I894-L896 HydrophobicContact CG2-CD1 4.12Å; I894-L896 PolarHBondContact O-N 2.79Å; L896-Q898 HydrophobicContact CD2-CG 4.16Å; L896-Q898 HydrophobicContact CG-CG 4.1Å; L896-Q898 WeakPolarHBondContact O-CG 3.46Å; L896-Q898 PolarHBondContact O-N 2.99Å; L896-Q898 VanDerWaalsContact O-N 3.12Å
897	D	31.3	Very low	33.8	Very low	119 Å²	119	111.4 Å²	111.4	64%	0.636	62%	0.616	S	S	*	*			trans	-74.7	132.5	175.1	-78.9	-34.6	0	0	0	111.1	H883 N895 Y899	H883-D897 PolarHBondContact NE2-O 3.08Å; N895-D897 VanDerWaalsContact C-N 3.32Å; N895-D897 PolarHBondContact ND2-OD1 3.35Å; N895-D897 PolarHBondContact ND2-OD2 3.5Å; N895-D897 PolarHBondContact O-N 2.92Å; N895-D897 VanDerWaalsContact O-N 3.14Å; D897-Y899 PolarHBondContact O-N 3.21Å
898	Q	34.4	Very low	33.9	Very low	123.5 Å²	123.5	108.9 Å²	108.9	58%	0.577	61%	0.606	S	S	*	*			trans	-71.9	121.9	-161.5	-68.9	179.1	-15.1	0	0	115.1	L896 H900 N1073	L896-Q898 HydrophobicContact CD2-CG 4.16Å; L896-Q898 HydrophobicContact CG-CG 4.1Å; L896-Q898 WeakPolarHBondContact O-CG 3.46Å; L896-Q898 PolarHBondContact O-N 2.99Å; L896-Q898 VanDerWaalsContact O-N 3.12Å; Q898-H900 PolarHBondContact O-CD2 3.48Å; Q898-H900 PolarHBondContact O-N 2.93Å; Q898-N1073 VanDerWaalsContact NE2-CG 3.35Å; Q898-N1073 PolarHBondContact NE2-ND2 2.96Å; Q898-N1073 PolarHBondContact NE2-OD1 2.93Å; Q898-N1073 PolarHBondContact OE1-ND2 2.95Å; Q898-N1073 PolarHBondContact OE1-OD1 3.37Å
899	Y	32.6	Very low	33.8	Very low	162.25 Å²	162.25	109 Å²	109	64%	0.636	61%	0.607	S	S	*	*			trans	-71.1	105.6	177.7	-54.5	-74.9	0	0	0	114.2	P880 C882 Q884 D897	P880-Y899 HydrophobicContact CB-CD1 3.9Å; P880-Y899 HydrophobicContact CB-CE1 3.86Å; P880-Y899 HydrophobicContact CB-CG 4.24Å; C882-Y899 WeakPolarHBondContact SG-CD1 3.44Å; Q884-Y899 WeakPolarHBondContact CB-OH 3.34Å; Q884-Y899 PolarHBondContact OE1-OH 2.88Å; Q884-Y899 VanDerWaalsContact OE1-OH 3.13Å; D897-Y899 PolarHBondContact O-N 3.21Å
900	H	32.7	Very low	33.9	Very low	120 Å²	120	107.2 Å²	107.2	56%	0.556	59%	0.594	S	S	*	*			trans	-111.1	129.1	172.1	-71.7	-71.7	0	0	0	111.5	W881 Q898 N902	W881-H900 HydrophobicContact CH2-CB 4.11Å; W881-H900 HydrophobicContact CZ2-CB 3.44Å; W881-H900 VanDerWaalsContact CZ2-CB 3.44Å; W881-H900 AromaticContact NE1-CD2 3.84Å; Q898-H900 PolarHBondContact O-CD2 3.48Å; Q898-H900 PolarHBondContact O-N 2.93Å; H900-N902 PolarHBondContact O-N 2.85Å
901	S	34.5	Very low	34.1	Very low	59.75 Å²	59.75	102.5 Å²	102.5	42%	0.418	57%	0.57	S	S	.	*			trans	-86.4	123.3	171.4	58.8	0	0	0	0	110.6
902	N	35.7	Very low	34.1	Very low	77.25 Å²	77.25	100.1 Å²	100.1	41%	0.413	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.4	155.5	169.9	-69.1	-33.7	0	0	0	110.8	V877 L879 W881 C882 H900 Y913	V877-N902 PolarHBondContact N-O 3.21Å; V877-N902 PolarHBondContact O-N 2.8Å; L879-N902 PolarHBondContact N-O 3.07Å; L879-N902 PolarHBondContact O-N 3.47Å; W881-N902 VanDerWaalsContact CH2-CA 3.44Å; W881-N902 HydrophobicContact CH2-CB 3.34Å; W881-N902 WeakPolarHBondContact CH2-O 3.35Å; W881-N902 HydrophobicContact CZ2-CB 3.43Å; W881-N902 VanDerWaalsContact CZ2-CB 3.43Å; W881-N902 VanDerWaalsContact CZ3-C 3.46Å; W881-N902 HydrophobicContact CZ3-CB 4.31Å; W881-N902 WeakPolarHBondContact CZ3-O 3.49Å; C882-N902 PolarHBondContact O-ND2 2.97Å; H900-N902 PolarHBondContact O-N 2.85Å; N902-Y913 HydrophobicContact CB-CD1 4.23Å; N902-Y913 HydrophobicContact CB-CE1 3.73Å; N902-Y913 PolarHBondContact O-OH 2.85Å
903	V	35.9	Very low	34.5	Very low	73.25 Å²	73.25	97 Å²	97	44%	0.444	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.7	179.7	-180	0	0	0	0	109.1	Y874 I876 R878 W905	Y874-V903 HydrophobicContact CD2-CG1 4.15Å; Y874-V903 HydrophobicContact CG-CG1 3.98Å; I876-V903 HydrophobicContact CB-CG2 4.32Å; I876-V903 HydrophobicContact CD1-CG2 4.3Å; I876-V903 HydrophobicContact CG1-CG1 4.11Å; I876-V903 HydrophobicContact CG1-CG2 3.96Å; I876-V903 HydrophobicContact CG2-CG1 3.94Å; I876-V903 HydrophobicContact CG2-CG2 4.13Å; R878-V903 HydrophobicContact CG-CG2 4.15Å; V903-W905 HydrophobicContact CG1-CZ2 4.4Å
904	A	35.9	Very low	34.8	Very low	26.75 Å²	26.75	95 Å²	95	22%	0.221	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	137.8	169.7	0	0	0	0	0	109.4	L875 V877 W881 P911 Y913	L875-A904 PolarHBondContact N-O 3.27Å; L875-A904 VanDerWaalsContact N-O 3.14Å; L875-A904 PolarHBondContact O-N 2.91Å; V877-A904 PolarHBondContact O-N 3Å; W881-A904 HydrophobicContact CZ3-CB 4.47Å; A904-P911 HydrophobicContact CB-CB 4.17Å; A904-P911 HydrophobicContact CB-CG 3.74Å; A904-Y913 HydrophobicContact CB-CD1 4.37Å
905	W	35.5	Very low	35.1	Very low	156.5 Å²	156.5	90.5 Å²	90.5	59%	0.593	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.1	161.6	-49.1	61.9	0	0	0	110.2	I727 V903 S907 G908 C910	I727-W905 HydrophobicContact CD1-CH2 3.92Å; I727-W905 HydrophobicContact CG1-CH2 4.29Å; V903-W905 HydrophobicContact CG1-CZ2 4.4Å; W905-S907 PolarHBondContact O-N 2.99Å; W905-G908 WeakPolarHBondContact CZ3-O 3.38Å; W905-C910 HydrophobicContact CH2-CB 4.28Å; W905-C910 WeakPolarHBondContact CH2-SG 3.29Å; W905-C910 HydrophobicContact CZ2-CB 3.8Å; W905-C910 WeakPolarHBondContact CZ2-SG 3.48Å
906	L	33.6	Very low	35.4	Very low	111.5 Å²	111.5	88.9 Å²	88.9	58%	0.584	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	111.9	166.2	-78.8	176.6	0	0	0	110.6	I837 S873 L875 V877 G908 P911 Q912	I837-L906 HydrophobicContact CD1-CD1 3.74Å; S873-L906 PolarHBondContact N-O 2.56Å; S873-L906 PolarHBondContact O-N 3.44Å; L875-L906 HydrophobicContact CB-CD1 4.17Å; L875-L906 HydrophobicContact CD2-CD1 3.79Å; L875-L906 HydrophobicContact CG-CD1 4.18Å; V877-L906 HydrophobicContact CG2-CD1 3.86Å; L906-G908 PolarHBondContact O-N 3.01Å; L906-G908 VanDerWaalsContact O-N 3.13Å; L906-P911 HydrophobicContact CB-CB 4.02Å; L906-Q912 HydrophobicContact CD1-CB 3.88Å; L906-Q912 WeakPolarHBondContact CD1-O 3.42Å
907	S	33.9	Very low	35.7	Very low	92.25 Å²	92.25	85.8 Å²	85.8	65%	0.645	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	65.9	170.4	120.4	0	0	0	0	113.2	E871 H872 W905 R1066	E871-S907 CarbonylContact O-C 3.52Å; E871-S907 WeakPolarHBondContact O-CA 3.33Å; H872-S907 WeakPolarHBondContact CD2-CB 3.43Å; W905-S907 PolarHBondContact O-N 2.99Å; S907-R1066 VanDerWaalsContact CB-NH2 3.28Å
908	G	33.6	Very low	35.9	Very low	46.5 Å²	46.5	89 Å²	89	48%	0.479	48%	0.479	S	S	.	.	S	Bend	trans	-172.3	163	179.1	0	0	0	0	0	112.3	E871 W905 L906 C910	E871-G908 PolarHBondContact O-N 2.77Å; W905-G908 WeakPolarHBondContact CZ3-O 3.38Å; L906-G908 PolarHBondContact O-N 3.01Å; L906-G908 VanDerWaalsContact O-N 3.13Å; G908-C910 VanDerWaalsContact C-N 3.27Å; G908-C910 PolarHBondContact O-N 3.13Å
909	S	33.6	Very low	36.1	Very low	104 Å²	104	86.4 Å²	86.4	73%	0.727	48%	0.475	S	S	*	.	S	Bend	trans	-58.9	64.6	-176	-22.7	0	0	0	0	114.5	P911	S909-P911 WeakPolarHBondContact O-CD 3.32Å
910	C	37.2	Very low	36.1	Very low	71.25 Å²	71.25	86.5 Å²	86.5	48%	0.481	48%	0.481	S	S	.	.			trans	-100.7	108.1	-177.4	-81.8	0	0	0	0	111.6	I837 S838 G840 W905 G908 Q912	I837-C910 WeakPolarHBondContact O-CB 3.11Å; S838-C910 PolarHBondContact O-SG 2.93Å; G840-C910 CarbonylContact O-C 3.51Å; G840-C910 WeakPolarHBondContact O-CA 3.28Å; G840-C910 WeakPolarHBondContact O-CB 3.43Å; W905-C910 HydrophobicContact CH2-CB 4.28Å; W905-C910 WeakPolarHBondContact CH2-SG 3.29Å; W905-C910 HydrophobicContact CZ2-CB 3.8Å; W905-C910 WeakPolarHBondContact CZ2-SG 3.48Å; G908-C910 VanDerWaalsContact C-N 3.27Å; G908-C910 PolarHBondContact O-N 3.13Å; C910-Q912 PolarHBondContact O-N 3.1Å
911	P	40.1	Very low	36.3	Very low	32.25 Å²	32.25	84 Å²	84	21%	0.209	48%	0.477	C	S	.	.			trans	-67.9	128.4	173.3	27.7	-33	0	0	0	110.4	E839 G840 L843 S873 A904 L906 S909 Y913	E839-P911 CarbonylContact C-O 3.48Å; E839-P911 VanDerWaalsContact CA-O 3.3Å; E839-P911 WeakPolarHBondContact CA-O 3.47Å; G840-P911 PolarHBondContact N-O 2.82Å; L843-P911 HydrophobicContact CD1-CG 3.62Å; S873-P911 WeakPolarHBondContact OG-CG 3.3Å; A904-P911 HydrophobicContact CB-CB 4.17Å; A904-P911 HydrophobicContact CB-CG 3.74Å; L906-P911 HydrophobicContact CB-CB 4.02Å; S909-P911 WeakPolarHBondContact O-CD 3.32Å; P911-Y913 HydrophobicContact CB-CE1 4.16Å; P911-Y913 HydrophobicContact CB-CE2 4.06Å; P911-Y913 WeakPolarHBondContact CB-OH 3.36Å; P911-Y913 HydrophobicContact CG-CE1 4.29Å; P911-Y913 HydrophobicContact CG-CE2 3.77Å; P911-Y913 VanDerWaalsContact CG-CZ 3.43Å; P911-Y913 VanDerWaalsContact CG-OH 3.28Å; P911-Y913 WeakPolarHBondContact CG-OH 3.33Å; P911-Y913 VanDerWaalsContact O-CD2 3.28Å; P911-Y913 WeakPolarHBondContact O-CD2 3.34Å; P911-Y913 VanDerWaalsContact O-CE2 3.28Å; P911-Y913 WeakPolarHBondContact O-CE2 3.29Å
912	Q	37.5	Very low	36.5	Very low	117.25 Å²	117.25	86.5 Å²	86.5	55%	0.548	49%	0.485	S	S	.	.			trans	-89.3	117.6	176.8	-148.4	180	-15.1	0	0	110.5	N832 I834 S838 L906 C910 L965	N832-Q912 PolarHBondContact OD1-NE2 2.86Å; I834-Q912 HydrophobicContact CG2-CG 4.23Å; S838-Q912 CarbonylContact O-C 3.07Å; S838-Q912 VanDerWaalsContact O-C 3.25Å; S838-Q912 WeakPolarHBondContact O-CA 3.38Å; S838-Q912 WeakPolarHBondContact O-CB 3.48Å; S838-Q912 WeakPolarHBondContact O-CG 3.37Å; L906-Q912 HydrophobicContact CD1-CB 3.88Å; L906-Q912 WeakPolarHBondContact CD1-O 3.42Å; C910-Q912 PolarHBondContact O-N 3.1Å; Q912-L965 VanDerWaalsContact NE2-CD1 3.25Å
913	Y	42.1	Very low	36.8	Very low	38.5 Å²	38.5	88.5 Å²	88.5	15%	0.151	50%	0.495	C	S	.	.			trans	-102.7	138.4	-179.9	-54	-78	0	0	0	110.7	T833 L835 I837 S838 S873 L875 V877 L879 C882 N902 A904 P911 F915 I949	T833-Y913 HydrophobicContact CG2-CD2 4.24Å; L835-Y913 PolarHBondContact N-O 2.87Å; L835-Y913 WeakPolarHBondContact O-CA 3.25Å; L835-Y913 WeakPolarHBondContact O-CB 3.18Å; L835-Y913 PolarHBondContact O-N 2.92Å; L835-Y913 VanDerWaalsContact O-O 3.11Å; I837-Y913 CarbonylContact C-O 3.55Å; I837-Y913 HydrophobicContact CG2-CD2 3.86Å; I837-Y913 CarbonylContact O-C 3.51Å; I837-Y913 WeakPolarHBondContact O-CA 3.43Å; I837-Y913 VanDerWaalsContact O-CB 3.3Å; I837-Y913 WeakPolarHBondContact O-CB 3.32Å; I837-Y913 PolarHBondContact O-N 3.36Å; S838-Y913 PolarHBondContact O-N 2.98Å; S873-Y913 WeakPolarHBondContact CB-OH 3.47Å; S873-Y913 PolarHBondContact OG-OH 2.86Å; L875-Y913 HydrophobicContact CB-CD1 3.87Å; L875-Y913 HydrophobicContact CB-CE1 3.9Å; L875-Y913 HydrophobicContact CB-CG 4.23Å; L875-Y913 HydrophobicContact CD2-CD1 4.42Å; L875-Y913 HydrophobicContact CD2-CD2 3.94Å; L875-Y913 HydrophobicContact CD2-CE2 4.36Å; L875-Y913 HydrophobicContact CD2-CG 3.93Å; V877-Y913 HydrophobicContact CB-CD1 4.33Å; V877-Y913 HydrophobicContact CB-CE1 3.72Å; V877-Y913 HydrophobicContact CB-CE2 4.11Å; V877-Y913 HydrophobicContact CG1-CE1 4.37Å; V877-Y913 HydrophobicContact CG2-CE1 4.21Å; V877-Y913 HydrophobicContact CG2-CE2 3.76Å; V877-Y913 WeakPolarHBondContact CG2-OH 3.32Å; L879-Y913 HydrophobicContact CD1-CD2 4.42Å; L879-Y913 HydrophobicContact CD1-CE2 3.58Å; C882-Y913 HydrophobicContact CB-CD1 3.66Å; C882-Y913 HydrophobicContact CB-CE1 4.13Å; C882-Y913 HydrophobicContact CB-CG 3.96Å; N902-Y913 HydrophobicContact CB-CD1 4.23Å; N902-Y913 HydrophobicContact CB-CE1 3.73Å; N902-Y913 PolarHBondContact O-OH 2.85Å; A904-Y913 HydrophobicContact CB-CD1 4.37Å; P911-Y913 HydrophobicContact CB-CE1 4.16Å; P911-Y913 HydrophobicContact CB-CE2 4.06Å; P911-Y913 WeakPolarHBondContact CB-OH 3.36Å; P911-Y913 HydrophobicContact CG-CE1 4.29Å; P911-Y913 HydrophobicContact CG-CE2 3.77Å; P911-Y913 VanDerWaalsContact CG-CZ 3.43Å; P911-Y913 VanDerWaalsContact CG-OH 3.28Å; P911-Y913 WeakPolarHBondContact CG-OH 3.33Å; P911-Y913 VanDerWaalsContact O-CD2 3.28Å; P911-Y913 WeakPolarHBondContact O-CD2 3.34Å; P911-Y913 VanDerWaalsContact O-CE2 3.28Å; P911-Y913 WeakPolarHBondContact O-CE2 3.29Å; Y913-F915 HydrophobicContact CG-CE2 4.43Å; Y913-I949 HydrophobicContact CE2-CG2 4.43Å
914	A	36.3	Very low	37.3	Very low	72.75 Å²	72.75	90.8 Å²	90.8	60%	0.601	50%	0.504	S	S	*	.			trans	-115.7	122.8	173.1	0	0	0	0	0	109.8	I885	I885-A914 HydrophobicContact CD1-CB 4.2Å
915	F	41	Very low	38	Very low	42.5 Å²	42.5	97.4 Å²	97.4	19%	0.186	53%	0.531	C	S	.	.			trans	-133.9	138.9	175.6	2.1	-84.8	0	0	0	110.2	L831 T833 L835 I837 L875 V877 L879 C882 Y913 I917 L953 V955	L831-F915 HydrophobicContact CB-CD2 4.14Å; L831-F915 HydrophobicContact CD1-CB 4.34Å; T833-F915 CarbonylContact C-O 3.54Å; T833-F915 VanDerWaalsContact CA-O 3.31Å; T833-F915 WeakPolarHBondContact CA-O 3.22Å; T833-F915 WeakPolarHBondContact CB-O 3.24Å; T833-F915 HydrophobicContact CG2-CE1 4.24Å; T833-F915 HydrophobicContact CG2-CE2 3.8Å; T833-F915 HydrophobicContact CG2-CZ 4.05Å; T833-F915 PolarHBondContact N-O 3.03Å; T833-F915 PolarHBondContact O-N 2.99Å; T833-F915 WeakPolarHBondContact OG1-CE2 3.49Å; T833-F915 WeakPolarHBondContact OG1-CZ 3.44Å; L835-F915 HydrophobicContact CB-CE1 3.6Å; L835-F915 HydrophobicContact CB-CE2 3.88Å; L835-F915 HydrophobicContact CB-CZ 4.16Å; L835-F915 HydrophobicContact CD2-CE2 3.58Å; L835-F915 HydrophobicContact CD2-CZ 4.02Å; L835-F915 HydrophobicContact CG-CE2 3.44Å; L835-F915 VanDerWaalsContact CG-CE2 3.44Å; L835-F915 HydrophobicContact CG-CZ 3.95Å; L835-F915 CarbonylContact O-C 3.51Å; L835-F915 WeakPolarHBondContact O-CD2 3.41Å; L835-F915 WeakPolarHBondContact O-CE2 3.29Å; I837-F915 HydrophobicContact CB-CD1 4.38Å; I837-F915 HydrophobicContact CB-CE1 3.45Å; I837-F915 VanDerWaalsContact CB-CE1 3.45Å; I837-F915 HydrophobicContact CB-CZ 3.85Å; I837-F915 HydrophobicContact CD1-CE1 3.49Å; I837-F915 VanDerWaalsContact CD1-CE1 3.49Å; I837-F915 HydrophobicContact CD1-CZ 3.3Å; I837-F915 HydrophobicContact CG1-CE1 3.41Å; I837-F915 VanDerWaalsContact CG1-CE1 3.41Å; I837-F915 HydrophobicContact CG1-CE2 4.38Å; I837-F915 HydrophobicContact CG1-CZ 3.25Å; L875-F915 HydrophobicContact CD2-CE1 4.07Å; V877-F915 HydrophobicContact CG2-CD1 4.35Å; V877-F915 HydrophobicContact CG2-CE1 3.79Å; V877-F915 HydrophobicContact CG2-CE2 4.32Å; V877-F915 HydrophobicContact CG2-CZ 3.75Å; L879-F915 HydrophobicContact CD1-CD1 3.4Å; L879-F915 VanDerWaalsContact CD1-CD1 3.4Å; L879-F915 HydrophobicContact CD1-CD2 4.04Å; L879-F915 HydrophobicContact CD1-CE1 3.41Å; L879-F915 VanDerWaalsContact CD1-CE1 3.41Å; L879-F915 HydrophobicContact CD1-CE2 4.04Å; L879-F915 HydrophobicContact CD1-CG 3.76Å; L879-F915 HydrophobicContact CD1-CZ 3.74Å; L879-F915 HydrophobicContact CD2-CE2 4.49Å; L879-F915 HydrophobicContact CD2-CZ 4.19Å; C882-F915 HydrophobicContact CB-CE1 4.21Å; Y913-F915 HydrophobicContact CG-CE2 4.43Å; F915-I917 HydrophobicContact CB-CD1 4.47Å; F915-I917 HydrophobicContact CB-CG1 4.21Å; F915-I917 HydrophobicContact CD2-CD1 3.82Å; F915-I917 HydrophobicContact CD2-CG1 3.82Å; F915-I917 HydrophobicContact CE2-CD1 3.68Å; F915-I917 HydrophobicContact CE2-CG1 3.88Å; F915-I917 PolarHBondContact O-N 3.21Å; F915-L953 HydrophobicContact CZ-CD1 4.41Å; F915-V955 HydrophobicContact CD2-CG1 3.4Å; F915-V955 VanDerWaalsContact CD2-CG1 3.4Å; F915-V955 HydrophobicContact CD2-CG2 4.33Å; F915-V955 HydrophobicContact CE2-CB 4.2Å; F915-V955 HydrophobicContact CE2-CG1 3.51Å; F915-V955 HydrophobicContact CE2-CG2 3.61Å; F915-V955 HydrophobicContact CG-CG1 4.35Å; F915-V955 HydrophobicContact CZ-CG2 3.99Å
916	T	35	Very low	39	Very low	100.5 Å²	100.5	96.2 Å²	96.2	62%	0.617	53%	0.532	S	S	*	.			trans	-104.8	90.7	179.2	-12.3	0	0	0	0	110.1	I830 L831 N832 I834	I830-T916 HydrophobicContact CG2-CG2 3.7Å; L831-T916 WeakPolarHBondContact O-CG2 3.29Å; N832-T916 WeakPolarHBondContact OD1-CG2 3.32Å; N832-T916 PolarHBondContact OD1-OG1 3.38Å; I834-T916 HydrophobicContact CB-CG2 4.46Å; I834-T916 HydrophobicContact CD1-CG2 3.58Å; I834-T916 HydrophobicContact CG1-CG2 3.68Å; I834-T916 HydrophobicContact CG2-CG2 4.22Å
917	I	37.7	Very low	40.6	Very low	55.25 Å²	55.25	91.7 Å²	91.7	28%	0.283	51%	0.509	S	S	.	.			trans	-89.3	128.3	173.3	-60.4	171.6	0	0	0	109.3	L831 T833 I834 L835 L879 W881 F915 S919 C921 M928 V955	L831-I917 HydrophobicContact CD1-CB 4.13Å; L831-I917 HydrophobicContact CD1-CD1 3.75Å; L831-I917 HydrophobicContact CD1-CG1 3.86Å; T833-I917 CarbonylContact C-O 3.57Å; T833-I917 CarbonylContact O-C 3.5Å; I834-I917 WeakPolarHBondContact CA-O 3.35Å; L835-I917 HydrophobicContact CB-CD1 3.87Å; L835-I917 HydrophobicContact CD2-CD1 4.11Å; L835-I917 HydrophobicContact CG-CD1 4.47Å; L879-I917 HydrophobicContact CD1-CB 4.41Å; L879-I917 HydrophobicContact CD1-CD1 3.15Å; L879-I917 HydrophobicContact CD1-CG1 3.72Å; L879-I917 HydrophobicContact CD1-CG2 4.24Å; W881-I917 HydrophobicContact CE3-CG2 3.98Å; W881-I917 HydrophobicContact CZ3-CG1 4.16Å; W881-I917 HydrophobicContact CZ3-CG2 3.91Å; F915-I917 HydrophobicContact CB-CD1 4.47Å; F915-I917 HydrophobicContact CB-CG1 4.21Å; F915-I917 HydrophobicContact CD2-CD1 3.82Å; F915-I917 HydrophobicContact CD2-CG1 3.82Å; F915-I917 HydrophobicContact CE2-CD1 3.68Å; F915-I917 HydrophobicContact CE2-CG1 3.88Å; F915-I917 PolarHBondContact O-N 3.21Å; I917-S919 PolarHBondContact O-N 2.83Å; I917-S919 VanDerWaalsContact O-N 3.13Å; I917-C921 HydrophobicContact CG2-CB 4.06Å; I917-M928 HydrophobicContact CD1-CE 3.93Å; I917-M928 HydrophobicContact CD1-SD 4.29Å; I917-M928 HydrophobicContact CG2-SD 4.49Å; I917-V955 HydrophobicContact CD1-CG1 4.14Å
918	R	34.9	Very low	42.1	Very low	184.25 Å²	184.25	91.3 Å²	91.3	70%	0.695	50%	0.498	S	S	*	.			trans	-72	120.8	175.1	-70.9	-178.2	177.9	168.1	-0.5	110.8	T833 Q920 C921 D962	T833-R918 VanDerWaalsContact O-CA 3.27Å; T833-R918 WeakPolarHBondContact O-CA 3.39Å; R918-Q920 PolarHBondContact O-N 2.97Å; R918-C921 PolarHBondContact O-N 3.05Å; R918-D962 IonicContact NH2-OD1 3.92Å
919	S	38.3	Very low	43.9	Very low	69.75 Å²	69.75	92.5 Å²	92.5	49%	0.488	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-85.1	70.7	-179.8	55.4	0	0	0	0	114.7	N832 T833 I917 C921 L922	N832-S919 CarbonylContact C-O 3.54Å; N832-S919 WeakPolarHBondContact CA-O 3.41Å; T833-S919 VanDerWaalsContact CB-OG 3.23Å; T833-S919 WeakPolarHBondContact CB-OG 3.45Å; T833-S919 PolarHBondContact N-O 3.28Å; T833-S919 PolarHBondContact OG1-O 3.5Å; T833-S919 PolarHBondContact OG1-OG 2.73Å; I917-S919 PolarHBondContact O-N 2.83Å; I917-S919 VanDerWaalsContact O-N 3.13Å; S919-C921 VanDerWaalsContact C-N 3.3Å; S919-C921 PolarHBondContact O-N 3.34Å; S919-L922 PolarHBondContact O-N 3.11Å
920	Q	32.3	Very low	45.2	Very low	164 Å²	164	90.7 Å²	90.7	77%	0.766	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-85.2	41.9	-175.2	-71.2	176.3	-18.7	0	0	113.4	I830 L831 R918 L922	I830-Q920 HydrophobicContact CG2-CB 4.21Å; I830-Q920 HydrophobicContact CG2-CG 3.66Å; L831-Q920 WeakPolarHBondContact O-CA 3.09Å; R918-Q920 PolarHBondContact O-N 2.97Å; Q920-L922 VanDerWaalsContact C-N 3.32Å; Q920-L922 PolarHBondContact O-N 3.2Å
921	C	38.5	Very low	46.5	Very low	68 Å²	68	89.1 Å²	89.1	46%	0.459	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-115.8	62.9	172.6	-89.3	0	0	0	0	113.2	L831 I917 R918 S919 L923 N924 V955 Q960	L831-C921 WeakPolarHBondContact CB-O 3.23Å; L831-C921 WeakPolarHBondContact CD1-O 3.23Å; L831-C921 WeakPolarHBondContact CG-O 3.48Å; I917-C921 HydrophobicContact CG2-CB 4.06Å; R918-C921 PolarHBondContact O-N 3.05Å; S919-C921 VanDerWaalsContact C-N 3.3Å; S919-C921 PolarHBondContact O-N 3.34Å; C921-L923 VanDerWaalsContact C-N 3.27Å; C921-L923 PolarHBondContact O-N 2.85Å; C921-N924 PolarHBondContact O-N 3.41Å; C921-V955 WeakPolarHBondContact O-CG1 3.38Å; C921-Q960 PolarHBondContact O-NE2 2.88Å
922	L	37.6	Very low	48.3	Very low	112 Å²	112	91.4 Å²	91.4	59%	0.586	48%	0.477	S	S	*	.			trans	-71.5	63.3	177.9	-72.2	143.1	0	0	0	113.4	V829 L831 S919 Q920 T957	V829-L922 HydrophobicContact CB-CD1 4.36Å; V829-L922 HydrophobicContact CB-CD2 4.28Å; V829-L922 HydrophobicContact CG1-CD2 3.76Å; V829-L922 HydrophobicContact CG2-CD1 3.87Å; V829-L922 HydrophobicContact CG2-CD2 4.33Å; L831-L922 HydrophobicContact CD2-CD2 4.09Å; S919-L922 PolarHBondContact O-N 3.11Å; Q920-L922 VanDerWaalsContact C-N 3.32Å; Q920-L922 PolarHBondContact O-N 3.2Å; L922-T957 HydrophobicContact CD2-CG2 4.15Å
923	L	41.7	Very low	49.8	Very low	118.75 Å²	118.75	88.6 Å²	88.6	62%	0.622	47%	0.468	S	S	*	.			trans	-121.9	69.4	172.7	-76.1	166.3	0	0	0	112.9	L831 C921 M928	L831-L923 HydrophobicContact CD1-CB 4.32Å; L831-L923 HydrophobicContact CD1-CD1 4.37Å; C921-L923 VanDerWaalsContact C-N 3.27Å; C921-L923 PolarHBondContact O-N 2.85Å; L923-M928 HydrophobicContact CD1-CB 4.1Å; L923-M928 HydrophobicContact CD1-SD 4Å; L923-M928 HydrophobicContact CD2-CB 4.19Å
924	N	47.1	Very low	51.2	Low	121.5 Å²	121.5	90.1 Å²	90.1	65%	0.65	47%	0.473	S	S	*	.	S	Bend	trans	-81.6	167.2	-175.7	-72.1	-22.7	0	0	0	113.3	C921 H926 Q960	C921-N924 PolarHBondContact O-N 3.41Å; N924-H926 VanDerWaalsContact C-N 3.29Å; N924-H926 PolarHBondContact O-N 2.83Å; N924-Q960 PolarHBondContact O-NE2 3.16Å
925	Q	50.8	Low	52.9	Low	166 Å²	166	89.9 Å²	89.9	78%	0.776	46%	0.462	S	S	*	.	S	Bend	trans	-69.1	-3.6	-174.3	-71.1	179.3	-21.1	0	0	116.2	Q960	Q925-Q960 PolarHBondContact O-NE2 3.14Å
926	H	56.1	Low	54.3	Low	131.5 Å²	131.5	90.1 Å²	90.1	61%	0.609	47%	0.468	S	S	*	.	S	Bend	trans	-125.1	147.4	178.3	-64	-26.3	0	0	0	110.5	N924 M928	N924-H926 VanDerWaalsContact C-N 3.29Å; N924-H926 PolarHBondContact O-N 2.83Å; H926-M928 PolarHBondContact O-N 2.91Å
927	P	66.7	Low	56	Low	17.5 Å²	17.5	87.8 Å²	87.8	11%	0.114	45%	0.451	C	S	.	.			trans	-67	147.6	178.7	29	-31.8	0	0	0	109.8	I929 A954 V955 Q960 I961 L964	P927-I929 PolarHBondContact O-N 3.17Å; P927-A954 HydrophobicContact CB-CB 4.44Å; P927-A954 HydrophobicContact CG-CB 4.31Å; P927-V955 CarbonylContact C-O 3.54Å; P927-V955 WeakPolarHBondContact CA-O 3.37Å; P927-V955 WeakPolarHBondContact CB-O 3.49Å; P927-Q960 HydrophobicContact CB-CB 4.04Å; P927-Q960 VanDerWaalsContact CD-O 3.29Å; P927-Q960 WeakPolarHBondContact CD-O 3.32Å; P927-Q960 HydrophobicContact CG-CB 4.26Å; P927-I961 HydrophobicContact CB-CD1 3.93Å; P927-I961 HydrophobicContact CG-CD1 4.25Å; P927-L964 HydrophobicContact CG-CB 4.04Å; P927-L964 HydrophobicContact CG-CD1 4.03Å; P927-L964 HydrophobicContact CG-CD2 4.17Å; P927-L964 HydrophobicContact CG-CG 4.34Å
928	M	66.4	Low	57.2	Low	82.75 Å²	82.75	88.7 Å²	88.7	41%	0.408	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	125.1	169.4	-173.3	-174	78.7	0	0	108.6	I917 L923 H926 P930 A954 V955	I917-M928 HydrophobicContact CD1-CE 3.93Å; I917-M928 HydrophobicContact CD1-SD 4.29Å; I917-M928 HydrophobicContact CG2-SD 4.49Å; L923-M928 HydrophobicContact CD1-CB 4.1Å; L923-M928 HydrophobicContact CD1-SD 4Å; L923-M928 HydrophobicContact CD2-CB 4.19Å; H926-M928 PolarHBondContact O-N 2.91Å; M928-P930 VanDerWaalsContact C-CD 3.45Å; M928-P930 HydrophobicContact CE-CB 4.24Å; M928-P930 HydrophobicContact CE-CG 4.07Å; M928-P930 WeakPolarHBondContact O-CD 3.35Å; M928-A954 CarbonylContact O-C 3.57Å; M928-A954 VanDerWaalsContact O-CA 3.29Å; M928-A954 WeakPolarHBondContact O-CA 3.27Å; M928-V955 HydrophobicContact CE-CB 4.27Å; M928-V955 HydrophobicContact CE-CG2 4.22Å; M928-V955 PolarHBondContact N-O 3.14Å; M928-V955 PolarHBondContact O-N 3Å
929	I	70.3	Confident	58.5	Low	71.75 Å²	71.75	81 Å²	81	37%	0.368	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	86.9	176.6	-56.1	175.8	0	0	0	108.4	P927 V931 D932 L952 L953 A954 L964	P927-I929 PolarHBondContact O-N 3.17Å; I929-V931 VanDerWaalsContact C-N 3.3Å; I929-V931 WeakPolarHBondContact CG2-O 3.13Å; I929-V931 PolarHBondContact O-N 3.01Å; I929-D932 HydrophobicContact CG2-CB 3.84Å; I929-L952 HydrophobicContact CD1-CD1 4.45Å; I929-L952 HydrophobicContact CG2-CD1 3.59Å; I929-L953 WeakPolarHBondContact CA-O 3.23Å; I929-L953 WeakPolarHBondContact CG2-O 3.3Å; I929-A954 HydrophobicContact CG1-CB 4.2Å; I929-L964 HydrophobicContact CD1-CD1 3.87Å; I929-L964 HydrophobicContact CD1-CD2 4.3Å; I929-L964 HydrophobicContact CG1-CD1 4.05Å; I929-L964 HydrophobicContact CG1-CD2 4.42Å
930	P	61.4	Low	59.2	Low	66.25 Å²	66.25	81.7 Å²	81.7	43%	0.43	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	-25.9	178.5	24	-35.7	0	0	0	114.1	M928 L953 V955	M928-P930 VanDerWaalsContact C-CD 3.45Å; M928-P930 HydrophobicContact CE-CB 4.24Å; M928-P930 HydrophobicContact CE-CG 4.07Å; M928-P930 WeakPolarHBondContact O-CD 3.35Å; P930-L953 WeakPolarHBondContact CD-O 3.33Å; P930-L953 HydrophobicContact CG-CB 4.29Å; P930-L953 HydrophobicContact CG-CD2 3.87Å; P930-L953 HydrophobicContact CG-CG 3.9Å; P930-V955 HydrophobicContact CG-CG2 4.35Å
931	V	65.3	Low	60.2	Low	38 Å²	38	81.3 Å²	81.3	23%	0.23	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	126.5	179.6	-169.9	0	0	0	0	109.3	I929 T933 L935 V951 L952 L953	I929-V931 VanDerWaalsContact C-N 3.3Å; I929-V931 WeakPolarHBondContact CG2-O 3.13Å; I929-V931 PolarHBondContact O-N 3.01Å; V931-T933 HydrophobicContact CG1-CG2 3.85Å; V931-L935 HydrophobicContact CG1-CD1 4.28Å; V931-L935 HydrophobicContact CG1-CD2 4.47Å; V931-L935 HydrophobicContact CG1-CG 4.47Å; V931-V951 HydrophobicContact CG1-CB 4.45Å; V931-V951 HydrophobicContact CG1-CG1 4.49Å; V931-L952 CarbonylContact O-C 3.52Å; V931-L952 VanDerWaalsContact O-CA 3.29Å; V931-L952 WeakPolarHBondContact O-CA 3.37Å; V931-L953 HydrophobicContact CB-CB 3.87Å; V931-L953 HydrophobicContact CG2-CB 4.15Å; V931-L953 HydrophobicContact CG2-CD2 4.21Å; V931-L953 PolarHBondContact N-O 2.87Å; V931-L953 PolarHBondContact O-N 2.97Å
932	D	76.9	Confident	61.2	Low	80.5 Å²	80.5	79.6 Å²	79.6	43%	0.43	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	76.5	167.1	-171.2	20	0	0	0	107.6	I929 H950 V951 L952	I929-D932 HydrophobicContact CG2-CB 3.84Å; D932-H950 IonicContact OD1-CE1 3.06Å; D932-H950 PolarHBondContact OD1-CE1 3Å; D932-H950 VanDerWaalsContact OD1-CE1 3.28Å; D932-H950 IonicContact OD1-NE2 3.22Å; D932-V951 WeakPolarHBondContact CA-O 3.38Å; D932-L952 HydrophobicContact CB-CD1 3.84Å
933	T	69.3	Low	62.2	Low	58 Å²	58	75.7 Å²	75.7	36%	0.356	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	165.3	-170.9	171.1	0	0	0	0	112.6	V931 L935 H950 V951	V931-T933 HydrophobicContact CG1-CG2 3.85Å; T933-L935 HydrophobicContact CG2-CD2 3.89Å; T933-L935 HydrophobicContact CG2-CG 4.37Å; T933-L935 PolarHBondContact O-N 3.23Å; T933-H950 VanDerWaalsContact C-CD2 3.49Å; T933-V951 PolarHBondContact N-O 3.15Å; T933-V951 VanDerWaalsContact N-O 3.11Å; T933-V951 PolarHBondContact O-N 2.98Å
934	W	72.5	Confident	63.1	Low	70.25 Å²	70.25	72.8 Å²	72.8	27%	0.266	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	122.2	165.5	-69.6	92.5	0	0	0	110.9	E839 K841 Q948 I949 H950	E839-W934 HydrophobicContact CB-CH2 3.92Å; E839-W934 HydrophobicContact CB-CZ2 4.31Å; E839-W934 HydrophobicContact CB-CZ3 4.25Å; E839-W934 VanDerWaalsContact CD-CH2 3.48Å; E839-W934 HydrophobicContact CG-CH2 3.47Å; E839-W934 VanDerWaalsContact CG-CH2 3.47Å; E839-W934 HydrophobicContact CG-CZ2 3.77Å; E839-W934 HydrophobicContact CG-CZ3 4.29Å; E839-W934 VanDerWaalsContact OE1-CZ2 3.25Å; E839-W934 WeakPolarHBondContact OE1-CZ2 3.31Å; E839-W934 WeakPolarHBondContact OE2-CH2 3.5Å; E839-W934 WeakPolarHBondContact OE2-CZ2 3.12Å; K841-W934 HydrophobicContact CB-CH2 3.93Å; K841-W934 HydrophobicContact CB-CZ3 3.9Å; K841-W934 HydrophobicContact CD-CD2 4Å; K841-W934 HydrophobicContact CD-CE3 3.79Å; K841-W934 HydrophobicContact CD-CH2 3.7Å; K841-W934 HydrophobicContact CD-CZ2 3.9Å; K841-W934 HydrophobicContact CD-CZ3 3.65Å; K841-W934 VanDerWaalsContact CE-CD2 3.5Å; K841-W934 VanDerWaalsContact CE-CE3 3.44Å; K841-W934 HydrophobicContact CG-CE3 3.89Å; K841-W934 HydrophobicContact CG-CH2 3.85Å; K841-W934 HydrophobicContact CG-CZ2 4.42Å; K841-W934 HydrophobicContact CG-CZ3 3.49Å; K841-W934 VanDerWaalsContact CG-CZ3 3.48Å; K841-W934 VanDerWaalsContact NZ-CG 3.3Å; W934-Q948 HydrophobicContact CB-CB 4.45Å; W934-Q948 HydrophobicContact CE3-CB 3.81Å; W934-Q948 HydrophobicContact CZ3-CB 4.43Å; W934-Q948 WeakPolarHBondContact CZ3-O 3.4Å; W934-I949 CarbonylContact C-O 3.5Å; W934-I949 WeakPolarHBondContact CA-O 3.31Å; W934-I949 VanDerWaalsContact CE3-C 3.45Å; W934-H950 AromaticContact CD1-CD2 3.75Å; W934-H950 HydrophobicContact CD2-CB 3.97Å; W934-H950 AromaticContact CE2-CD2 3.89Å; W934-H950 HydrophobicContact CE3-CB 4.01Å; W934-H950 AromaticContact CG-CD2 3.98Å; W934-H950 HydrophobicContact CH2-CB 4.08Å; W934-H950 HydrophobicContact CZ2-CB 4.03Å; W934-H950 HydrophobicContact CZ3-CB 4.05Å; W934-H950 AromaticContact NE1-CD2 3.63Å
935	L	70.8	Confident	64.1	Low	68.5 Å²	68.5	71.6 Å²	71.6	36%	0.359	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	137.5	172.6	-64.2	-177.4	0	0	0	110.6	V931 T933 Q948 I949 V951	V931-L935 HydrophobicContact CG1-CD1 4.28Å; V931-L935 HydrophobicContact CG1-CD2 4.47Å; V931-L935 HydrophobicContact CG1-CG 4.47Å; T933-L935 HydrophobicContact CG2-CD2 3.89Å; T933-L935 HydrophobicContact CG2-CG 4.37Å; T933-L935 PolarHBondContact O-N 3.23Å; L935-Q948 CarbonylContact O-C 3.43Å; L935-Q948 VanDerWaalsContact O-CA 3.28Å; L935-Q948 WeakPolarHBondContact O-CA 3.3Å; L935-I949 HydrophobicContact CB-CG1 4.39Å; L935-I949 PolarHBondContact N-O 2.82Å; L935-I949 PolarHBondContact O-N 3.21Å; L935-V951 HydrophobicContact CB-CG2 4.33Å; L935-V951 HydrophobicContact CD1-CB 3.99Å; L935-V951 HydrophobicContact CD1-CG1 4.33Å; L935-V951 HydrophobicContact CD1-CG2 3.94Å; L935-V951 HydrophobicContact CG-CB 4.34Å; L935-V951 HydrophobicContact CG-CG2 4.24Å
936	P	71.8	Confident	64.9	Low	48 Å²	48	65.1 Å²	65.1	31%	0.312	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	137.7	177.1	29.9	-34.6	0	0	0	112	I938 E945 G947	P936-I938 HydrophobicContact CB-CD1 4.44Å; P936-I938 HydrophobicContact CB-CG1 4.14Å; P936-I938 HydrophobicContact CG-CD1 4.16Å; P936-I938 HydrophobicContact CG-CG1 4.21Å; P936-I938 PolarHBondContact O-N 3.15Å; P936-E945 HydrophobicContact CB-CG 3.76Å; P936-G947 CarbonylContact C-O 3.52Å; P936-G947 WeakPolarHBondContact CA-O 3.22Å
937	I	69.2	Low	65.7	Low	50.5 Å²	50.5	59 Å²	59	26%	0.259	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	106.4	166.2	-60.8	176.8	0	0	0	107.3	L843 L875 E945 N946 G947 I949	L843-I937 HydrophobicContact CD2-CD1 3.46Å; L843-I937 VanDerWaalsContact CD2-CD1 3.47Å; L843-I937 HydrophobicContact CD2-CG1 4.41Å; L875-I937 HydrophobicContact CD1-CD1 4.22Å; L875-I937 HydrophobicContact CD1-CG1 4.41Å; I937-E945 CarbonylContact O-C 3.4Å; I937-E945 WeakPolarHBondContact O-CA 3.36Å; I937-N946 HydrophobicContact CG2-CB 4.32Å; I937-N946 PolarHBondContact O-N 3.09Å; I937-G947 PolarHBondContact N-O 3Å; I937-I949 HydrophobicContact CD1-CG1 4.48Å; I937-I949 HydrophobicContact CD1-CG2 3.82Å; I937-I949 HydrophobicContact CG1-CD1 4.36Å; I937-I949 HydrophobicContact CG1-CG1 4.12Å; I937-I949 HydrophobicContact CG1-CG2 4.25Å
938	I	63.7	Low	66	Low	75.25 Å²	75.25	60.4 Å²	60.4	39%	0.386	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	125.3	-178.9	-56	175.6	0	0	0	109	P936 P940 G943 C944 R1066	P936-I938 HydrophobicContact CB-CD1 4.44Å; P936-I938 HydrophobicContact CB-CG1 4.14Å; P936-I938 HydrophobicContact CG-CD1 4.16Å; P936-I938 HydrophobicContact CG-CG1 4.21Å; P936-I938 PolarHBondContact O-N 3.15Å; I938-P940 WeakPolarHBondContact O-CD 3.36Å; I938-G943 VanDerWaalsContact CG2-C 3.48Å; I938-G943 VanDerWaalsContact CG2-O 3.31Å; I938-G943 WeakPolarHBondContact CG2-O 3.42Å; I938-C944 WeakPolarHBondContact CA-O 3.3Å; I938-R1066 HydrophobicContact CG2-CG 4.22Å; I938-R1066 VanDerWaalsContact CG2-NH2 3.33Å; I938-R1066 PolarHBondContact O-NH2 2.94Å
939	D	61.7	Low	66.4	Low	22.5 Å²	22.5	57.6 Å²	57.6	12%	0.12	32%	0.317	C	S	.	.			trans	-60.8	118.4	168.1	175	-14.1	0	0	0	109.1	S846 N848 F941 S942 G943 C944 R1066	S846-D939 WeakPolarHBondContact CB-OD2 3.37Å; S846-D939 PolarHBondContact OG-OD2 3.12Å; N848-D939 PolarHBondContact ND2-OD2 2.91Å; D939-F941 PolarHBondContact O-N 3.17Å; D939-F941 VanDerWaalsContact O-N 3.11Å; D939-F941 PolarHBondContact OD1-N 3Å; D939-S942 VanDerWaalsContact CB-OG 3.25Å; D939-S942 WeakPolarHBondContact CB-OG 3.44Å; D939-S942 PolarHBondContact O-N 3.38Å; D939-S942 PolarHBondContact OD1-N 2.97Å; D939-S942 VanDerWaalsContact OD2-CB 3.3Å; D939-S942 WeakPolarHBondContact OD2-CB 3.38Å; D939-S942 PolarHBondContact OD2-OG 2.97Å; D939-G943 VanDerWaalsContact O-CA 3.31Å; D939-G943 WeakPolarHBondContact O-CA 3.34Å; D939-G943 PolarHBondContact O-N 3.2Å; D939-C944 PolarHBondContact N-O 2.96Å; D939-R1066 PolarHBondContact O-NH2 3.03Å
940	P	53.2	Low	66.6	Low	84.75 Å²	84.75	56 Å²	56	55%	0.55	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-19.4	-174.6	25.3	-34	0	0	0	114	I938 R1066 R1185	I938-P940 WeakPolarHBondContact O-CD 3.36Å; P940-R1066 PolarHBondContact O-NH2 3.17Å; P940-R1185 PolarHBondContact O-NH1 2.85Å
941	F	53.6	Low	67.2	Low	154.75 Å²	154.75	53.3 Å²	53.3	68%	0.679	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-44.4	-178.7	-59.2	-76.2	0	0	0	112.7	D939 T1069 Y1187 N1190	D939-F941 PolarHBondContact O-N 3.17Å; D939-F941 VanDerWaalsContact O-N 3.11Å; D939-F941 PolarHBondContact OD1-N 3Å; F941-T1069 PolarHBondContact O-N 2.62Å; F941-T1069 PolarHBondContact O-OG1 3.1Å; F941-Y1187 AromaticContact CE1-CE1 3.87Å; F941-Y1187 HydrophobicContact CE1-CE1 3.87Å; F941-Y1187 WeakPolarHBondContact CE1-OH 3.18Å; F941-Y1187 HydrophobicContact CZ-CE1 4.48Å; F941-N1190 HydrophobicContact CE1-CB 4.04Å; F941-N1190 WeakPolarHBondContact CE1-OD1 3.42Å; F941-N1190 HydrophobicContact CZ-CB 3.76Å
942	S	59.2	Low	67.6	Low	33 Å²	33	51.7 Å²	51.7	23%	0.231	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-16.5	-179.1	70.6	0	0	0	0	114.2	N848 D939 C944 T1068	N848-S942 VanDerWaalsContact ND2-CB 3.34Å; N848-S942 WeakPolarHBondContact ND2-CB 3.3Å; N848-S942 PolarHBondContact ND2-OG 3.38Å; D939-S942 VanDerWaalsContact CB-OG 3.25Å; D939-S942 WeakPolarHBondContact CB-OG 3.44Å; D939-S942 PolarHBondContact O-N 3.38Å; D939-S942 PolarHBondContact OD1-N 2.97Å; D939-S942 VanDerWaalsContact OD2-CB 3.3Å; D939-S942 WeakPolarHBondContact OD2-CB 3.38Å; D939-S942 PolarHBondContact OD2-OG 2.97Å; S942-C944 PolarHBondContact O-N 3.01Å; S942-C944 VanDerWaalsContact OG-CB 3.24Å; S942-C944 WeakPolarHBondContact OG-CB 3.43Å; S942-C944 PolarHBondContact OG-N 2.97Å; S942-C944 PolarHBondContact OG-SG 2.92Å; S942-T1068 WeakPolarHBondContact O-CG2 3.39Å
943	G	59.3	Low	67.6	Low	29.75 Å²	29.75	49.6 Å²	49.6	31%	0.307	27%	0.269	S	S	.	.			trans	68.9	6.4	-171.5	0	0	0	0	0	113.9	I938 D939	I938-G943 VanDerWaalsContact CG2-C 3.48Å; I938-G943 VanDerWaalsContact CG2-O 3.31Å; I938-G943 WeakPolarHBondContact CG2-O 3.42Å; D939-G943 VanDerWaalsContact O-CA 3.31Å; D939-G943 WeakPolarHBondContact O-CA 3.34Å; D939-G943 PolarHBondContact O-N 3.2Å
944	C	59.6	Low	67.8	Low	57.25 Å²	57.25	46.8 Å²	46.8	39%	0.387	25%	0.252	S	S	.	.			trans	-78.7	139.1	-177.9	-65.1	0	0	0	0	111.7	I938 D939 S942 N946	I938-C944 WeakPolarHBondContact CA-O 3.3Å; D939-C944 PolarHBondContact N-O 2.96Å; S942-C944 PolarHBondContact O-N 3.01Å; S942-C944 VanDerWaalsContact OG-CB 3.24Å; S942-C944 WeakPolarHBondContact OG-CB 3.43Å; S942-C944 PolarHBondContact OG-N 2.97Å; S942-C944 PolarHBondContact OG-SG 2.92Å; C944-N946 PolarHBondContact O-N 3.2Å; C944-N946 PolarHBondContact O-OD1 2.88Å
945	E	68.8	Low	67.7	Low	96.25 Å²	96.25	44.1 Å²	44.1	45%	0.45	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	115.7	173	-175.3	177.2	167.5	0	0	110.5	P936 I937 G947 Q948	P936-E945 HydrophobicContact CB-CG 3.76Å; I937-E945 CarbonylContact O-C 3.4Å; I937-E945 WeakPolarHBondContact O-CA 3.36Å; E945-G947 VanDerWaalsContact C-N 3.33Å; E945-G947 PolarHBondContact O-N 3.22Å; E945-Q948 VanDerWaalsContact OE1-CD 3.32Å; E945-Q948 VanDerWaalsContact OE1-CG 3.27Å; E945-Q948 WeakPolarHBondContact OE1-CG 3.42Å; E945-Q948 PolarHBondContact OE1-NE2 3.17Å
946	N	67.6	Low	67.8	Low	30.25 Å²	30.25	40.9 Å²	40.9	16%	0.162	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	27.2	-177.4	-78.6	-6.7	0	0	0	112.3	L843 K844 S846 I937 C944	L843-N946 CarbonylContact C-O 3.52Å; L843-N946 VanDerWaalsContact CA-O 3.3Å; L843-N946 WeakPolarHBondContact CA-O 3.44Å; K844-N946 PolarHBondContact N-O 2.89Å; K844-N946 VanDerWaalsContact O-CB 3.32Å; K844-N946 WeakPolarHBondContact O-CB 3.35Å; K844-N946 VanDerWaalsContact O-CG 3.3Å; K844-N946 PolarHBondContact O-ND2 3.37Å; K844-N946 PolarHBondContact O-OD1 3.41Å; S846-N946 WeakPolarHBondContact CB-ND2 3.31Å; S846-N946 WeakPolarHBondContact CB-OD1 3.28Å; S846-N946 PolarHBondContact OG-ND2 2.97Å; I937-N946 HydrophobicContact CG2-CB 4.32Å; I937-N946 PolarHBondContact O-N 3.09Å; C944-N946 PolarHBondContact O-N 3.2Å; C944-N946 PolarHBondContact O-OD1 2.88Å
947	G	72.1	Confident	67.8	Low	3 Å²	3	40.2 Å²	40.2	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	113.9	-174.9	-176.2	0	0	0	0	0	112.5	K841 E842 P936 I937 E945	K841-G947 WeakPolarHBondContact O-CA 3.46Å; E842-G947 VanDerWaalsContact O-CA 3.26Å; E842-G947 WeakPolarHBondContact O-CA 3.36Å; P936-G947 CarbonylContact C-O 3.52Å; P936-G947 WeakPolarHBondContact CA-O 3.22Å; I937-G947 PolarHBondContact N-O 3Å; E945-G947 VanDerWaalsContact C-N 3.33Å; E945-G947 PolarHBondContact O-N 3.22Å
948	Q	73.6	Confident	67.8	Low	48 Å²	48	42.5 Å²	42.5	22%	0.224	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	151	-177.2	-59.4	-176.4	-12.3	0	0	111.1	G840 K841 W934 L935 E945	G840-Q948 CarbonylContact C-O 3.56Å; G840-Q948 VanDerWaalsContact CA-O 3.3Å; G840-Q948 WeakPolarHBondContact CA-O 3.27Å; K841-Q948 HydrophobicContact CG-CB 4.14Å; K841-Q948 PolarHBondContact N-O 2.8Å; K841-Q948 PolarHBondContact O-N 2.82Å; W934-Q948 HydrophobicContact CB-CB 4.45Å; W934-Q948 HydrophobicContact CE3-CB 3.81Å; W934-Q948 HydrophobicContact CZ3-CB 4.43Å; W934-Q948 WeakPolarHBondContact CZ3-O 3.4Å; L935-Q948 CarbonylContact O-C 3.43Å; L935-Q948 VanDerWaalsContact O-CA 3.28Å; L935-Q948 WeakPolarHBondContact O-CA 3.3Å; E945-Q948 VanDerWaalsContact OE1-CD 3.32Å; E945-Q948 VanDerWaalsContact OE1-CG 3.27Å; E945-Q948 WeakPolarHBondContact OE1-CG 3.42Å; E945-Q948 PolarHBondContact OE1-NE2 3.17Å
949	I	74.7	Confident	68.1	Low	24 Å²	24	45.7 Å²	45.7	12%	0.123	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	138.5	174	45.5	167.3	0	0	0	110.6	I837 E839 L843 L875 Y913 W934 L935 I937 V951	I837-I949 HydrophobicContact CD1-CD1 4.18Å; I837-I949 HydrophobicContact CG2-CB 4.01Å; I837-I949 HydrophobicContact CG2-CD1 4.41Å; I837-I949 HydrophobicContact CG2-CG2 4.27Å; E839-I949 CarbonylContact O-C 3.56Å; E839-I949 VanDerWaalsContact O-CA 3.3Å; E839-I949 WeakPolarHBondContact O-CA 3.19Å; L843-I949 HydrophobicContact CD2-CG2 4.4Å; L875-I949 HydrophobicContact CD1-CD1 4.23Å; L875-I949 HydrophobicContact CD2-CD1 3.79Å; Y913-I949 HydrophobicContact CE2-CG2 4.43Å; W934-I949 CarbonylContact C-O 3.5Å; W934-I949 WeakPolarHBondContact CA-O 3.31Å; W934-I949 VanDerWaalsContact CE3-C 3.45Å; L935-I949 HydrophobicContact CB-CG1 4.39Å; L935-I949 PolarHBondContact N-O 2.82Å; L935-I949 PolarHBondContact O-N 3.21Å; I937-I949 HydrophobicContact CD1-CG1 4.48Å; I937-I949 HydrophobicContact CD1-CG2 3.82Å; I937-I949 HydrophobicContact CG1-CD1 4.36Å; I937-I949 HydrophobicContact CG1-CG1 4.12Å; I937-I949 HydrophobicContact CG1-CG2 4.25Å; I949-V951 HydrophobicContact CB-CG2 4.35Å; I949-V951 HydrophobicContact CD1-CG2 3.77Å; I949-V951 HydrophobicContact CG1-CG2 3.88Å; I949-V951 PolarHBondContact O-N 3.18Å
950	H	73.6	Confident	68.7	Low	38.25 Å²	38.25	45.4 Å²	45.4	18%	0.177	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	117.3	174.5	-169.2	-98.8	0	0	0	109.4	I837 S838 E839 D932 T933 W934	I837-H950 CarbonylContact C-O 3.51Å; I837-H950 VanDerWaalsContact CA-O 3.3Å; I837-H950 WeakPolarHBondContact CA-O 3.26Å; I837-H950 WeakPolarHBondContact CG2-O 3.26Å; S838-H950 PolarHBondContact N-O 3.19Å; S838-H950 VanDerWaalsContact N-O 3.16Å; S838-H950 WeakPolarHBondContact OG-CB 3.41Å; S838-H950 PolarHBondContact OG-ND1 3.19Å; E839-H950 HydrophobicContact CB-CB 4.26Å; E839-H950 HydrophobicContact CG-CB 3.56Å; E839-H950 VanDerWaalsContact CG-CB 3.45Å; E839-H950 PolarHBondContact O-N 3.01Å; D932-H950 IonicContact OD1-CE1 3.06Å; D932-H950 PolarHBondContact OD1-CE1 3Å; D932-H950 VanDerWaalsContact OD1-CE1 3.28Å; D932-H950 IonicContact OD1-NE2 3.22Å; T933-H950 VanDerWaalsContact C-CD2 3.49Å; W934-H950 AromaticContact CD1-CD2 3.75Å; W934-H950 HydrophobicContact CD2-CB 3.97Å; W934-H950 AromaticContact CE2-CD2 3.89Å; W934-H950 HydrophobicContact CE3-CB 4.01Å; W934-H950 AromaticContact CG-CD2 3.98Å; W934-H950 HydrophobicContact CH2-CB 4.08Å; W934-H950 HydrophobicContact CZ2-CB 4.03Å; W934-H950 HydrophobicContact CZ3-CB 4.05Å; W934-H950 AromaticContact NE1-CD2 3.63Å
951	V	74.8	Confident	69.6	Low	9.5 Å²	9.5	41.6 Å²	41.6	6%	0.058	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.2	-171.6	-175.5	0	0	0	0	110.1	L835 I837 V931 D932 T933 L935 I949	L835-V951 HydrophobicContact CD1-CG1 3.49Å; L835-V951 VanDerWaalsContact CD1-CG1 3.47Å; I837-V951 HydrophobicContact CD1-CG2 4.14Å; I837-V951 HydrophobicContact CG1-CB 4.38Å; I837-V951 HydrophobicContact CG1-CG1 4.15Å; I837-V951 HydrophobicContact CG1-CG2 4.21Å; V931-V951 HydrophobicContact CG1-CB 4.45Å; V931-V951 HydrophobicContact CG1-CG1 4.49Å; D932-V951 WeakPolarHBondContact CA-O 3.38Å; T933-V951 PolarHBondContact N-O 3.15Å; T933-V951 VanDerWaalsContact N-O 3.11Å; T933-V951 PolarHBondContact O-N 2.98Å; L935-V951 HydrophobicContact CB-CG2 4.33Å; L935-V951 HydrophobicContact CD1-CB 3.99Å; L935-V951 HydrophobicContact CD1-CG1 4.33Å; L935-V951 HydrophobicContact CD1-CG2 3.94Å; L935-V951 HydrophobicContact CG-CB 4.34Å; L935-V951 HydrophobicContact CG-CG2 4.24Å; I949-V951 HydrophobicContact CB-CG2 4.35Å; I949-V951 HydrophobicContact CD1-CG2 3.77Å; I949-V951 HydrophobicContact CG1-CG2 3.88Å; I949-V951 PolarHBondContact O-N 3.18Å
952	L	73.5	Confident	70.4	Confident	3.75 Å²	3.75	36.1 Å²	36.1	2%	0.02	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	117.1	168.3	174.2	69	0	0	0	108.8	L835 H836 I929 V931 D932 L964 L970	L835-L952 CarbonylContact C-O 3.48Å; L835-L952 WeakPolarHBondContact CA-O 3.39Å; H836-L952 HydrophobicContact CB-CB 4.3Å; H836-L952 HydrophobicContact CB-CD2 4.41Å; H836-L952 PolarHBondContact N-O 3Å; H836-L952 PolarHBondContact O-N 3.29Å; I929-L952 HydrophobicContact CD1-CD1 4.45Å; I929-L952 HydrophobicContact CG2-CD1 3.59Å; V931-L952 CarbonylContact O-C 3.52Å; V931-L952 VanDerWaalsContact O-CA 3.29Å; V931-L952 WeakPolarHBondContact O-CA 3.37Å; D932-L952 HydrophobicContact CB-CD1 3.84Å; L952-L964 HydrophobicContact CD2-CD2 4.33Å; L952-L970 HydrophobicContact CD2-CD1 4.06Å; L952-L970 VanDerWaalsContact CD2-CD1 3.45Å
953	L	76.4	Confident	71	Confident	35.5 Å²	35.5	38.1 Å²	38.1	19%	0.186	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	118.6	169.4	-177.3	66.1	0	0	0	107.8	T833 I834 L835 L879 F915 I929 P930 V931	T833-L953 HydrophobicContact CG2-CD1 3.56Å; T833-L953 VanDerWaalsContact CG2-CD1 3.49Å; I834-L953 CarbonylContact O-C 3.52Å; I834-L953 VanDerWaalsContact O-CA 3.28Å; I834-L953 WeakPolarHBondContact O-CA 3.29Å; I834-L953 WeakPolarHBondContact O-CD1 3.44Å; L835-L953 HydrophobicContact CB-CD1 4.22Å; L835-L953 HydrophobicContact CD1-CB 4.23Å; L835-L953 HydrophobicContact CD1-CD1 4.14Å; L879-L953 HydrophobicContact CD2-CD1 4.41Å; L879-L953 HydrophobicContact CD2-CD2 4.24Å; F915-L953 HydrophobicContact CZ-CD1 4.41Å; I929-L953 WeakPolarHBondContact CA-O 3.23Å; I929-L953 WeakPolarHBondContact CG2-O 3.3Å; P930-L953 WeakPolarHBondContact CD-O 3.33Å; P930-L953 HydrophobicContact CG-CB 4.29Å; P930-L953 HydrophobicContact CG-CD2 3.87Å; P930-L953 HydrophobicContact CG-CG 3.9Å; V931-L953 HydrophobicContact CB-CB 3.87Å; V931-L953 HydrophobicContact CG2-CB 4.15Å; V931-L953 HydrophobicContact CG2-CD2 4.21Å; V931-L953 PolarHBondContact N-O 2.87Å; V931-L953 PolarHBondContact O-N 2.97Å
954	A	73.5	Confident	71.6	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	140.9	178.3	0	0	0	0	0	111.1	T833 I834 P927 M928 I929 I961 L964	T833-A954 CarbonylContact C-O 3.55Å; T833-A954 VanDerWaalsContact CA-O 3.24Å; T833-A954 WeakPolarHBondContact CA-O 3.38Å; T833-A954 WeakPolarHBondContact CG2-O 3.43Å; I834-A954 PolarHBondContact N-O 2.95Å; I834-A954 PolarHBondContact O-N 2.98Å; P927-A954 HydrophobicContact CB-CB 4.44Å; P927-A954 HydrophobicContact CG-CB 4.31Å; M928-A954 CarbonylContact O-C 3.57Å; M928-A954 VanDerWaalsContact O-CA 3.29Å; M928-A954 WeakPolarHBondContact O-CA 3.27Å; I929-A954 HydrophobicContact CG1-CB 4.2Å; A954-I961 HydrophobicContact CB-CD1 4.13Å; A954-L964 HydrophobicContact CB-CD1 4.31Å; A954-L964 HydrophobicContact CB-CD2 3.45Å; A954-L964 VanDerWaalsContact CB-CD2 3.43Å
955	V	71.2	Confident	72	Confident	14 Å²	14	35.8 Å²	35.8	9%	0.085	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	123.1	-178.7	-177	0	0	0	0	109.1	L831 N832 T833 F915 I917 C921 P927 M928 P930	L831-V955 HydrophobicContact CB-CG1 4.18Å; L831-V955 HydrophobicContact CD1-CG1 4.21Å; N832-V955 CarbonylContact O-C 3.53Å; N832-V955 VanDerWaalsContact O-CA 3.27Å; N832-V955 WeakPolarHBondContact O-CA 3.35Å; T833-V955 HydrophobicContact CG2-CG2 4.08Å; F915-V955 HydrophobicContact CD2-CG1 3.4Å; F915-V955 VanDerWaalsContact CD2-CG1 3.4Å; F915-V955 HydrophobicContact CD2-CG2 4.33Å; F915-V955 HydrophobicContact CE2-CB 4.2Å; F915-V955 HydrophobicContact CE2-CG1 3.51Å; F915-V955 HydrophobicContact CE2-CG2 3.61Å; F915-V955 HydrophobicContact CG-CG1 4.35Å; F915-V955 HydrophobicContact CZ-CG2 3.99Å; I917-V955 HydrophobicContact CD1-CG1 4.14Å; C921-V955 WeakPolarHBondContact O-CG1 3.38Å; P927-V955 CarbonylContact C-O 3.54Å; P927-V955 WeakPolarHBondContact CA-O 3.37Å; P927-V955 WeakPolarHBondContact CB-O 3.49Å; M928-V955 HydrophobicContact CE-CB 4.27Å; M928-V955 HydrophobicContact CE-CG2 4.22Å; M928-V955 PolarHBondContact N-O 3.14Å; M928-V955 PolarHBondContact O-N 3Å; P930-V955 HydrophobicContact CG-CG2 4.35Å
956	G	73.7	Confident	71.9	Confident	0.25 Å²	0.25	34.3 Å²	34.3	0%	0.003	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.2	178.4	-177.6	0	0	0	0	0	112.8	L831 N832	L831-G956 CarbonylContact C-O 3.5Å; L831-G956 WeakPolarHBondContact CA-O 3.39Å; L831-G956 WeakPolarHBondContact CB-O 3.24Å; N832-G956 WeakPolarHBondContact CA-O 3.32Å; N832-G956 PolarHBondContact N-O 3.09Å; N832-G956 PolarHBondContact O-N 3.01Å; N832-G956 VanDerWaalsContact O-N 3.08Å
957	T	71.5	Confident	71.6	Confident	34.5 Å²	34.5	39.3 Å²	39.3	21%	0.212	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	160.2	170.1	67.8	0	0	0	0	110.5	V829 L831 L922 E959 Q960 I961	V829-T957 HydrophobicContact CG1-CG2 4.09Å; L831-T957 HydrophobicContact CD2-CG2 4.08Å; L831-T957 VanDerWaalsContact CD2-CG2 3.44Å; L922-T957 HydrophobicContact CD2-CG2 4.15Å; T957-E959 PolarHBondContact O-N 3.12Å; T957-E959 VanDerWaalsContact O-N 3.16Å; T957-Q960 WeakPolarHBondContact O-CB 3.41Å; T957-Q960 PolarHBondContact O-N 3.15Å; T957-Q960 VanDerWaalsContact O-N 3.14Å; T957-Q960 WeakPolarHBondContact OG1-CB 3.41Å; T957-Q960 VanDerWaalsContact OG1-CG 3.23Å; T957-Q960 WeakPolarHBondContact OG1-CG 3.28Å; T957-Q960 PolarHBondContact OG1-N 3.14Å; T957-I961 WeakPolarHBondContact O-CB 3.47Å; T957-I961 WeakPolarHBondContact O-CG1 3.31Å; T957-I961 PolarHBondContact O-N 3.18Å
958	Q	68.9	Low	71	Confident	98 Å²	98	42.7 Å²	42.7	46%	0.458	22%	0.218	S	C	.	.	H	α-helix	trans	-51	-43.2	175.9	-179.4	85.7	35.7	0	0	112	N832 I961 D962	N832-Q958 VanDerWaalsContact ND2-CA 3.3Å; N832-Q958 WeakPolarHBondContact ND2-CA 3.3Å; N832-Q958 VanDerWaalsContact ND2-CB 3.35Å; N832-Q958 WeakPolarHBondContact ND2-CB 3.31Å; N832-Q958 VanDerWaalsContact ND2-CD 3.31Å; N832-Q958 PolarHBondContact ND2-OE1 3.25Å; Q958-I961 PolarHBondContact O-N 2.88Å; Q958-D962 PolarHBondContact NE2-OD1 3.14Å; Q958-D962 PolarHBondContact NE2-OD2 3.31Å; Q958-D962 VanDerWaalsContact O-CB 3.24Å; Q958-D962 WeakPolarHBondContact O-CB 3.33Å; Q958-D962 PolarHBondContact O-N 3.16Å
959	E	70.5	Confident	70.1	Confident	142.75 Å²	142.75	46.4 Å²	46.4	67%	0.667	24%	0.239	S	C	*	.	H	α-helix	trans	-65.2	-43.4	178.7	-171.2	-179.8	-169.9	0	0	112.6	T957 I961 D962 N963	T957-E959 PolarHBondContact O-N 3.12Å; T957-E959 VanDerWaalsContact O-N 3.16Å; E959-I961 VanDerWaalsContact C-N 3.3Å; E959-I961 PolarHBondContact O-N 2.99Å; E959-D962 PolarHBondContact O-N 3.24Å; E959-N963 VanDerWaalsContact O-CB 3.29Å; E959-N963 WeakPolarHBondContact O-CB 3.3Å; E959-N963 VanDerWaalsContact O-CG 3.23Å; E959-N963 PolarHBondContact O-N 3.18Å; E959-N963 PolarHBondContact O-ND2 3.09Å; E959-N963 VanDerWaalsContact O-ND2 3.12Å
960	Q	73	Confident	68.8	Low	15.75 Å²	15.75	47.3 Å²	47.3	7%	0.074	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-41.1	174.3	-74.9	171.3	-11.7	0	0	111.9	C921 N924 Q925 P927 T957 N963 L964	C921-Q960 PolarHBondContact O-NE2 2.88Å; N924-Q960 PolarHBondContact O-NE2 3.16Å; Q925-Q960 PolarHBondContact O-NE2 3.14Å; P927-Q960 HydrophobicContact CB-CB 4.04Å; P927-Q960 VanDerWaalsContact CD-O 3.29Å; P927-Q960 WeakPolarHBondContact CD-O 3.32Å; P927-Q960 HydrophobicContact CG-CB 4.26Å; T957-Q960 WeakPolarHBondContact O-CB 3.41Å; T957-Q960 PolarHBondContact O-N 3.15Å; T957-Q960 VanDerWaalsContact O-N 3.14Å; T957-Q960 WeakPolarHBondContact OG1-CB 3.41Å; T957-Q960 VanDerWaalsContact OG1-CG 3.23Å; T957-Q960 WeakPolarHBondContact OG1-CG 3.28Å; T957-Q960 PolarHBondContact OG1-N 3.14Å; Q960-N963 PolarHBondContact O-N 3.02Å; Q960-L964 WeakPolarHBondContact O-CB 3.43Å; Q960-L964 PolarHBondContact O-N 3.02Å; Q960-L964 VanDerWaalsContact O-N 3.09Å
961	I	72.5	Confident	66.9	Low	5 Å²	5	49.6 Å²	49.6	3%	0.026	25%	0.254	C	S	.	.	H	α-helix	trans	-69.8	-43.4	179.7	-77.9	-114.9	0	0	0	111.5	N832 I834 P927 A954 T957 Q958 E959 N963 L964 L965	N832-I961 VanDerWaalsContact C-CD1 3.46Å; N832-I961 HydrophobicContact CB-CB 4.44Å; N832-I961 HydrophobicContact CB-CD1 3.59Å; N832-I961 VanDerWaalsContact CB-CD1 3.46Å; N832-I961 HydrophobicContact CB-CG1 4.18Å; N832-I961 HydrophobicContact CB-CG2 4.25Å; N832-I961 WeakPolarHBondContact O-CD1 3.32Å; I834-I961 HydrophobicContact CB-CD1 4.45Å; I834-I961 HydrophobicContact CD1-CB 4.42Å; I834-I961 HydrophobicContact CD1-CD1 3.85Å; I834-I961 HydrophobicContact CD1-CG1 4.17Å; I834-I961 HydrophobicContact CD1-CG2 3.37Å; I834-I961 HydrophobicContact CG1-CD1 4.15Å; I834-I961 HydrophobicContact CG1-CG1 4.26Å; I834-I961 HydrophobicContact CG1-CG2 3.79Å; I834-I961 VanDerWaalsContact CG1-CG2 3.47Å; P927-I961 HydrophobicContact CB-CD1 3.93Å; P927-I961 HydrophobicContact CG-CD1 4.25Å; A954-I961 HydrophobicContact CB-CD1 4.13Å; T957-I961 WeakPolarHBondContact O-CB 3.47Å; T957-I961 WeakPolarHBondContact O-CG1 3.31Å; T957-I961 PolarHBondContact O-N 3.18Å; Q958-I961 PolarHBondContact O-N 2.88Å; E959-I961 VanDerWaalsContact C-N 3.3Å; E959-I961 PolarHBondContact O-N 2.99Å; I961-N963 VanDerWaalsContact C-N 3.32Å; I961-N963 PolarHBondContact O-N 3.02Å; I961-L964 PolarHBondContact O-N 3.14Å; I961-L964 VanDerWaalsContact O-N 3.15Å; I961-L965 HydrophobicContact CG2-CD1 4.34Å; I961-L965 WeakPolarHBondContact O-CB 3.31Å; I961-L965 WeakPolarHBondContact O-CG 3.33Å; I961-L965 PolarHBondContact O-N 3.03Å
962	D	69.8	Low	64.8	Low	40 Å²	40	54 Å²	54	21%	0.214	28%	0.283	C	S	.	.	H	α-helix	trans	-64	-37.5	174.1	-84.9	-47.8	0	0	0	111.7	R918 Q958 E959 L965 T966 K971	R918-D962 IonicContact NH2-OD1 3.92Å; Q958-D962 PolarHBondContact NE2-OD1 3.14Å; Q958-D962 PolarHBondContact NE2-OD2 3.31Å; Q958-D962 VanDerWaalsContact O-CB 3.24Å; Q958-D962 WeakPolarHBondContact O-CB 3.33Å; Q958-D962 PolarHBondContact O-N 3.16Å; E959-D962 PolarHBondContact O-N 3.24Å; D962-L965 PolarHBondContact O-N 3.21Å; D962-T966 WeakPolarHBondContact O-CB 3.31Å; D962-T966 VanDerWaalsContact O-CG2 3.27Å; D962-T966 WeakPolarHBondContact O-CG2 3.42Å; D962-T966 PolarHBondContact O-N 3.23Å; D962-T966 VanDerWaalsContact O-N 3.09Å; D962-T966 PolarHBondContact O-OG1 3.15Å; D962-K971 HydrophobicContact CB-CD 4.32Å; D962-K971 VanDerWaalsContact CB-NZ 3.33Å; D962-K971 VanDerWaalsContact CG-CE 3.42Å; D962-K971 WeakPolarHBondContact OD1-CE 3.45Å; D962-K971 IonicContact OD1-NZ 3.08Å; D962-K971 PolarHBondContact OD1-NZ 3.25Å; D962-K971 IonicContact OD2-NZ 3.92Å; D962-K971 PolarHBondContact OD2-NZ 2.89Å
963	N	72.2	Confident	62.6	Low	73.5 Å²	73.5	57.6 Å²	57.6	39%	0.393	31%	0.306	S	S	.	.	H	α-helix	trans	-64.9	-37.5	173.3	-73.3	-20.4	0	0	0	112.2	E959 Q960 I961 T966 L967	E959-N963 VanDerWaalsContact O-CB 3.29Å; E959-N963 WeakPolarHBondContact O-CB 3.3Å; E959-N963 VanDerWaalsContact O-CG 3.23Å; E959-N963 PolarHBondContact O-N 3.18Å; E959-N963 PolarHBondContact O-ND2 3.09Å; E959-N963 VanDerWaalsContact O-ND2 3.12Å; Q960-N963 PolarHBondContact O-N 3.02Å; I961-N963 VanDerWaalsContact C-N 3.32Å; I961-N963 PolarHBondContact O-N 3.02Å; N963-T966 VanDerWaalsContact CA-OG1 3.28Å; N963-T966 WeakPolarHBondContact CA-OG1 3.34Å; N963-T966 PolarHBondContact O-N 3.39Å; N963-T966 PolarHBondContact O-OG1 3.12Å; N963-L967 VanDerWaalsContact O-CB 3.26Å; N963-L967 WeakPolarHBondContact O-CB 3.42Å; N963-L967 WeakPolarHBondContact O-CD1 3.27Å; N963-L967 WeakPolarHBondContact O-CG 3.32Å; N963-L967 PolarHBondContact O-N 2.92Å
964	L	71.3	Confident	60.3	Low	16.25 Å²	16.25	63.3 Å²	63.3	9%	0.085	34%	0.335	C	S	.	.	H	α-helix	trans	-66.3	-45.3	174.4	-177.1	82.6	0	0	0	111.6	I834 P927 I929 L952 A954 Q960 I961 T966 L967 Q968	I834-L964 HydrophobicContact CD1-CD2 4.41Å; P927-L964 HydrophobicContact CG-CB 4.04Å; P927-L964 HydrophobicContact CG-CD1 4.03Å; P927-L964 HydrophobicContact CG-CD2 4.17Å; P927-L964 HydrophobicContact CG-CG 4.34Å; I929-L964 HydrophobicContact CD1-CD1 3.87Å; I929-L964 HydrophobicContact CD1-CD2 4.3Å; I929-L964 HydrophobicContact CG1-CD1 4.05Å; I929-L964 HydrophobicContact CG1-CD2 4.42Å; L952-L964 HydrophobicContact CD2-CD2 4.33Å; A954-L964 HydrophobicContact CB-CD1 4.31Å; A954-L964 HydrophobicContact CB-CD2 3.45Å; A954-L964 VanDerWaalsContact CB-CD2 3.43Å; Q960-L964 WeakPolarHBondContact O-CB 3.43Å; Q960-L964 PolarHBondContact O-N 3.02Å; Q960-L964 VanDerWaalsContact O-N 3.09Å; I961-L964 PolarHBondContact O-N 3.14Å; I961-L964 VanDerWaalsContact O-N 3.15Å; L964-T966 VanDerWaalsContact C-N 3.32Å; L964-T966 PolarHBondContact O-N 2.96Å; L964-L967 PolarHBondContact O-N 3.19Å; L964-Q968 HydrophobicContact CD1-CG 4.3Å; L964-Q968 WeakPolarHBondContact O-CB 3.39Å; L964-Q968 PolarHBondContact O-N 3.32Å
965	L	68.2	Low	58.1	Low	22.75 Å²	22.75	69.7 Å²	69.7	12%	0.119	37%	0.369	C	S	.	.	H	α-helix	trans	-65.4	-33.4	179.4	-72	175	0	0	0	112.8	I834 Q912 I961 D962 N969 L970 K971	I834-L965 HydrophobicContact CD1-CD1 3.68Å; I834-L965 HydrophobicContact CD1-CD2 3.77Å; I834-L965 HydrophobicContact CD1-CG 3.71Å; Q912-L965 VanDerWaalsContact NE2-CD1 3.25Å; I961-L965 HydrophobicContact CG2-CD1 4.34Å; I961-L965 WeakPolarHBondContact O-CB 3.31Å; I961-L965 WeakPolarHBondContact O-CG 3.33Å; I961-L965 PolarHBondContact O-N 3.03Å; D962-L965 PolarHBondContact O-N 3.21Å; L965-N969 CarbonylContact O-C 3.42Å; L965-N969 PolarHBondContact O-N 3.09Å; L965-L970 HydrophobicContact CB-CB 4.31Å; L965-L970 HydrophobicContact CD2-CB 3.77Å; L965-L970 HydrophobicContact CD2-CD1 4.07Å; L965-L970 HydrophobicContact CD2-CG 4.41Å; L965-L970 WeakPolarHBondContact O-CA 3.28Å; L965-L970 PolarHBondContact O-N 3.1Å; L965-K971 HydrophobicContact CB-CB 4.18Å; L965-K971 HydrophobicContact CB-CG 4.1Å; L965-K971 HydrophobicContact CD1-CG 4.17Å; L965-K971 PolarHBondContact O-N 3.08Å
966	T	66.3	Low	56	Low	66 Å²	66	72.6 Å²	72.6	41%	0.405	40%	0.395	S	S	.	.	H	α-helix	trans	-75.3	-44.6	173.9	50.3	0	0	0	0	111.7	D962 N963 L964 Q968 N969 K971	D962-T966 WeakPolarHBondContact O-CB 3.31Å; D962-T966 VanDerWaalsContact O-CG2 3.27Å; D962-T966 WeakPolarHBondContact O-CG2 3.42Å; D962-T966 PolarHBondContact O-N 3.23Å; D962-T966 VanDerWaalsContact O-N 3.09Å; D962-T966 PolarHBondContact O-OG1 3.15Å; N963-T966 VanDerWaalsContact CA-OG1 3.28Å; N963-T966 WeakPolarHBondContact CA-OG1 3.34Å; N963-T966 PolarHBondContact O-N 3.39Å; N963-T966 PolarHBondContact O-OG1 3.12Å; L964-T966 VanDerWaalsContact C-N 3.32Å; L964-T966 PolarHBondContact O-N 2.96Å; T966-Q968 VanDerWaalsContact C-N 3.33Å; T966-Q968 PolarHBondContact O-N 2.83Å; T966-N969 PolarHBondContact O-N 2.97Å; T966-N969 VanDerWaalsContact O-N 3.08Å; T966-N969 PolarHBondContact O-OD1 3.33Å; T966-K971 HydrophobicContact CG2-CB 4.01Å; T966-K971 HydrophobicContact CG2-CD 4.11Å
967	L	62.9	Low	53.8	Low	134 Å²	134	78.3 Å²	78.3	70%	0.702	43%	0.425	S	S	*	.	H	α-helix	trans	-61.9	-38.4	177.7	-106	138.8	0	0	0	113.2	N963 L964 N969	N963-L967 VanDerWaalsContact O-CB 3.26Å; N963-L967 WeakPolarHBondContact O-CB 3.42Å; N963-L967 WeakPolarHBondContact O-CD1 3.27Å; N963-L967 WeakPolarHBondContact O-CG 3.32Å; N963-L967 PolarHBondContact O-N 2.92Å; L964-L967 PolarHBondContact O-N 3.19Å; L967-N969 VanDerWaalsContact C-N 3.28Å; L967-N969 PolarHBondContact O-N 2.78Å
968	Q	59.7	Low	51.7	Low	75.25 Å²	75.25	84.1 Å²	84.1	35%	0.352	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	5.2	176.9	-67.5	-170.4	-22.1	0	0	113.5	L964 T966 L970	L964-Q968 HydrophobicContact CD1-CG 4.3Å; L964-Q968 WeakPolarHBondContact O-CB 3.39Å; L964-Q968 PolarHBondContact O-N 3.32Å; T966-Q968 VanDerWaalsContact C-N 3.33Å; T966-Q968 PolarHBondContact O-N 2.83Å; Q968-L970 HydrophobicContact CB-CD1 3.96Å; Q968-L970 HydrophobicContact CB-CG 3.8Å; Q968-L970 PolarHBondContact O-N 3.07Å; Q968-L970 VanDerWaalsContact O-N 3.11Å
969	N	52.8	Low	49.7	Very low	124.5 Å²	124.5	86.4 Å²	86.4	67%	0.666	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	16.2	-174	-72.1	-44.6	0	0	0	115.4	K681 L965 T966 L967 K971 C972 T973	K681-N969 WeakPolarHBondContact CE-OD1 3.45Å; K681-N969 PolarHBondContact NZ-O 3.1Å; L965-N969 CarbonylContact O-C 3.42Å; L965-N969 PolarHBondContact O-N 3.09Å; T966-N969 PolarHBondContact O-N 2.97Å; T966-N969 VanDerWaalsContact O-N 3.08Å; T966-N969 PolarHBondContact O-OD1 3.33Å; L967-N969 VanDerWaalsContact C-N 3.28Å; L967-N969 PolarHBondContact O-N 2.78Å; N969-K971 PolarHBondContact O-N 3.12Å; N969-C972 WeakPolarHBondContact O-CB 3.31Å; N969-C972 PolarHBondContact O-N 2.67Å; N969-T973 PolarHBondContact O-N 2.86Å; N969-T973 PolarHBondContact O-OG1 3.12Å
970	L	47.6	Very low	47.6	Very low	43 Å²	43	85.6 Å²	85.6	23%	0.225	48%	0.475	C	S	.	.			trans	-72.4	-18.3	-178.1	-64.7	178	0	0	0	113.5	L952 L965 Q968 C972 T973 I974	L952-L970 HydrophobicContact CD2-CD1 4.06Å; L952-L970 VanDerWaalsContact CD2-CD1 3.45Å; L965-L970 HydrophobicContact CB-CB 4.31Å; L965-L970 HydrophobicContact CD2-CB 3.77Å; L965-L970 HydrophobicContact CD2-CD1 4.07Å; L965-L970 HydrophobicContact CD2-CG 4.41Å; L965-L970 WeakPolarHBondContact O-CA 3.28Å; L965-L970 PolarHBondContact O-N 3.1Å; Q968-L970 HydrophobicContact CB-CD1 3.96Å; Q968-L970 HydrophobicContact CB-CG 3.8Å; Q968-L970 PolarHBondContact O-N 3.07Å; Q968-L970 VanDerWaalsContact O-N 3.11Å; L970-C972 VanDerWaalsContact C-N 3.35Å; L970-C972 PolarHBondContact O-N 2.92Å; L970-C972 PolarHBondContact O-SG 3.31Å; L970-T973 PolarHBondContact O-N 2.61Å; L970-I974 PolarHBondContact O-N 3.33Å
971	K	34.4	Very low	45.3	Very low	87.75 Å²	87.75	92.4 Å²	92.4	38%	0.382	51%	0.51	S	S	.	.			trans	-72.9	71	177.1	-147.3	169.3	-174.9	169.2	0	110.9	K681 D962 L965 T966 N969 T973	K681-K971 PolarHBondContact NZ-O 3.06Å; D962-K971 HydrophobicContact CB-CD 4.32Å; D962-K971 VanDerWaalsContact CB-NZ 3.33Å; D962-K971 VanDerWaalsContact CG-CE 3.42Å; D962-K971 WeakPolarHBondContact OD1-CE 3.45Å; D962-K971 IonicContact OD1-NZ 3.08Å; D962-K971 PolarHBondContact OD1-NZ 3.25Å; D962-K971 IonicContact OD2-NZ 3.92Å; D962-K971 PolarHBondContact OD2-NZ 2.89Å; L965-K971 HydrophobicContact CB-CB 4.18Å; L965-K971 HydrophobicContact CB-CG 4.1Å; L965-K971 HydrophobicContact CD1-CG 4.17Å; L965-K971 PolarHBondContact O-N 3.08Å; T966-K971 HydrophobicContact CG2-CB 4.01Å; T966-K971 HydrophobicContact CG2-CD 4.11Å; N969-K971 PolarHBondContact O-N 3.12Å; K971-T973 WeakPolarHBondContact CD-OG1 3.26Å; K971-T973 WeakPolarHBondContact CG-OG1 3.29Å; K971-T973 PolarHBondContact O-N 3.22Å
972	C	31.1	Very low	43	Very low	100.75 Å²	100.75	97.7 Å²	97.7	68%	0.681	54%	0.543	S	S	*	.			trans	-71.9	74.7	174	-75.9	0	0	0	0	111.4	N969 L970 I974 D975 A976	N969-C972 WeakPolarHBondContact O-CB 3.31Å; N969-C972 PolarHBondContact O-N 2.67Å; L970-C972 VanDerWaalsContact C-N 3.35Å; L970-C972 PolarHBondContact O-N 2.92Å; L970-C972 PolarHBondContact O-SG 3.31Å; C972-I974 VanDerWaalsContact C-N 3.34Å; C972-I974 PolarHBondContact O-N 2.89Å; C972-I974 VanDerWaalsContact O-N 3.09Å; C972-D975 PolarHBondContact O-N 2.88Å; C972-A976 WeakPolarHBondContact O-CA 3.48Å; C972-A976 WeakPolarHBondContact O-CB 3.23Å; C972-A976 PolarHBondContact O-N 2.79Å
973	T	26.2	Very low	40.9	Very low	80 Å²	80	103.3 Å²	103.3	49%	0.491	57%	0.573	S	S	.	*			trans	-82	103.8	167.4	11.8	0	0	0	0	110.1	K681 N969 L970 K971 D975 D977	K681-T973 HydrophobicContact CD-CG2 4.05Å; K681-T973 PolarHBondContact NZ-OG1 2.77Å; N969-T973 PolarHBondContact O-N 2.86Å; N969-T973 PolarHBondContact O-OG1 3.12Å; L970-T973 PolarHBondContact O-N 2.61Å; K971-T973 WeakPolarHBondContact CD-OG1 3.26Å; K971-T973 WeakPolarHBondContact CG-OG1 3.29Å; K971-T973 PolarHBondContact O-N 3.22Å; T973-D975 VanDerWaalsContact C-N 3.29Å; T973-D975 WeakPolarHBondContact CB-OD2 3.26Å; T973-D975 PolarHBondContact O-N 2.83Å; T973-D975 PolarHBondContact OG1-OD2 3.37Å; T973-D977 HydrophobicContact CG2-CB 4.05Å; T973-D977 WeakPolarHBondContact CG2-OD2 3.44Å
974	I	29.6	Very low	38.8	Very low	156 Å²	156	106.5 Å²	106.5	80%	0.8	60%	0.595	S	S	*	*			trans	-76.6	60.2	172.3	-57.1	173.8	0	0	0	108.4	L970 C972 A976	L970-I974 PolarHBondContact O-N 3.33Å; C972-I974 VanDerWaalsContact C-N 3.34Å; C972-I974 PolarHBondContact O-N 2.89Å; C972-I974 VanDerWaalsContact O-N 3.09Å; I974-A976 PolarHBondContact O-N 2.74Å
975	D	27	Very low	36.5	Very low	134.25 Å²	134.25	110.1 Å²	110.1	72%	0.718	63%	0.628	S	S	*	*			trans	-112.7	95.4	174.1	-75.2	-41.8	0	0	0	110.8	C972 T973 D977	C972-D975 PolarHBondContact O-N 2.88Å; T973-D975 VanDerWaalsContact C-N 3.29Å; T973-D975 WeakPolarHBondContact CB-OD2 3.26Å; T973-D975 PolarHBondContact O-N 2.83Å; T973-D975 PolarHBondContact OG1-OD2 3.37Å; D975-D977 PolarHBondContact O-N 3.13Å
976	A	27.7	Very low	34.5	Very low	75.25 Å²	75.25	115.7 Å²	115.7	62%	0.622	66%	0.658	S	S	*	*			trans	-81.5	95.9	-179.7	0	0	0	0	0	112.7	C972 I974 N978 N979	C972-A976 WeakPolarHBondContact O-CA 3.48Å; C972-A976 WeakPolarHBondContact O-CB 3.23Å; C972-A976 PolarHBondContact O-N 2.79Å; I974-A976 PolarHBondContact O-N 2.74Å; A976-N978 VanDerWaalsContact C-N 3.27Å; A976-N978 PolarHBondContact O-N 3.06Å; A976-N978 VanDerWaalsContact O-N 3.1Å; A976-N979 PolarHBondContact O-N 3.49Å
977	D	27	Very low	32.6	Very low	118.75 Å²	118.75	121.1 Å²	121.1	64%	0.635	68%	0.679	S	S	*	*			trans	-139.7	101.9	156	-72	-38.2	0	0	0	114.9	T973 D975	T973-D977 HydrophobicContact CG2-CB 4.05Å; T973-D977 WeakPolarHBondContact CG2-OD2 3.44Å; D975-D977 PolarHBondContact O-N 3.13Å
978	N	27.4	Very low	30.7	Very low	156.25 Å²	156.25	118.4 Å²	118.4	84%	0.836	68%	0.683	S	S	*	*			trans	-137.1	94.5	141.8	-82.4	-46.1	0	0	0	112.6	A976 T980	A976-N978 VanDerWaalsContact C-N 3.27Å; A976-N978 PolarHBondContact O-N 3.06Å; A976-N978 VanDerWaalsContact O-N 3.1Å; N978-T980 PolarHBondContact O-N 2.81Å
979	N	26.7	Very low	29	Very low	147.5 Å²	147.5	126.5 Å²	126.5	79%	0.789	71%	0.71	S	S	*	*			trans	-87.5	114.4	163.1	-73.3	-35.6	0	0	0	109.9	A976	A976-N979 PolarHBondContact O-N 3.49Å
980	T	25.3	Very low	27.7	Very low	124.5 Å²	124.5	130.1 Å²	130.1	76%	0.764	72%	0.72	S	S	*	*				-176.8	115.6	92	35.7	0	0	0	0	111.8	N978 T982	N978-T980 PolarHBondContact O-N 2.81Å; T980-T982 PolarHBondContact O-N 3.17Å
981	I	24.9	Very low	26.6	Very low	159.25 Å²	159.25	133.6 Å²	133.6	82%	0.817	75%	0.748	S	S	*	*			trans	-119.5	108.4	159.1	-66.8	164.9	0	0	0	108.2	N983	I981-N983 HydrophobicContact CG2-CB 4.28Å; I981-N983 WeakPolarHBondContact CG2-ND2 3.42Å
982	T	25.8	Very low	26	Very low	116.75 Å²	116.75	132.5 Å²	132.5	72%	0.716	76%	0.761	S	S	*	*			trans	-148	114.5	153	37.9	0	0	0	0	109.2	T980 T984	T980-T982 PolarHBondContact O-N 3.17Å; T982-T984 PolarHBondContact O-N 2.87Å
983	N	25.7	Very low	25.7	Very low	157.5 Å²	157.5	135 Å²	135	84%	0.842	77%	0.766	S	S	*	*			trans	-71	104.2	159.4	-65.1	-29.1	0	0	0	111.9	I981	I981-N983 HydrophobicContact CG2-CB 4.28Å; I981-N983 WeakPolarHBondContact CG2-ND2 3.42Å
984	T	26.6	Very low	25.6	Very low	140.25 Å²	140.25	138.2 Å²	138.2	86%	0.86	78%	0.779	S	S	*	*			trans	-110.3	121.9	149.2	44.5	0	0	0	0	109.5	T982	T982-T984 PolarHBondContact O-N 2.87Å
985	A	24.3	Very low	25.2	Very low	92.25 Å²	92.25	138.8 Å²	138.8	76%	0.762	78%	0.778	S	S	*	*			trans	-121.5	134.5	163.2	0	0	0	0	0	111.5
986	D	24.9	Very low	25	Very low	140 Å²	140	137.8 Å²	137.8	75%	0.749	78%	0.781	S	S	*	*			trans	136.9	127.1	143.3	-109.3	-14.3	0	0	0	115.3
987	Q	27	Very low	24.8	Very low	180.25 Å²	180.25	143 Å²	143	84%	0.842	79%	0.789	S	S	*	*			trans	92.5	116	138.5	-67.8	174	49.9	0	0	117.5	R989	Q987-R989 PolarHBondContact O-N 2.75Å
988	G	23.9	Very low	24.5	Very low	76.25 Å²	76.25	146.3 Å²	146.3	79%	0.786	80%	0.8	S	S	*	*			trans	149.1	90.8	153.3	0	0	0	0	0	116.8	K990	G988-K990 PolarHBondContact O-N 2.91Å
989	R	24.2	Very low	24.5	Very low	245.25 Å²	245.25	145.4 Å²	145.4	93%	0.925	79%	0.794	S	S	*	*			trans	-126.2	109.5	159	-77.5	175.9	-177.1	168.7	1.6	113.1	Q987 S991	Q987-R989 PolarHBondContact O-N 2.75Å; R989-S991 PolarHBondContact O-N 3.38Å
990	K	24.5	Very low	24.6	Very low	201.25 Å²	201.25	144.3 Å²	144.3	88%	0.875	79%	0.793	S	S	*	*			trans	-24.6	113.7	155.6	-72.1	171.7	-179.8	179.8	0	112.2	G988 G992	G988-K990 PolarHBondContact O-N 2.91Å; K990-G992 PolarHBondContact O-N 3.04Å; K990-G992 VanDerWaalsContact O-N 3.14Å
991	S	23.7	Very low	24.9	Very low	116 Å²	116	148.6 Å²	148.6	81%	0.811	80%	0.795	S	S	*	*			trans	-3.4	104.5	132.5	-168.5	0	0	0	0	112.3	R989 I993	R989-S991 PolarHBondContact O-N 3.38Å; S991-I993 PolarHBondContact O-N 3.29Å
992	G	23.7	Very low	25.2	Very low	64 Å²	64	147.9 Å²	147.9	66%	0.66	79%	0.794	S	S	*	*			trans	-117.8	88.5	170.1	0	0	0	0	0	108.8	K990 I994	K990-G992 PolarHBondContact O-N 3.04Å; K990-G992 VanDerWaalsContact O-N 3.14Å; G992-I994 VanDerWaalsContact C-N 3.32Å; G992-I994 PolarHBondContact O-N 2.95Å
993	I	23.3	Very low	25.8	Very low	154.5 Å²	154.5	150.1 Å²	150.1	79%	0.792	80%	0.801	S	S	*	*			trans	-61.3	100.5	168.3	-62.5	170.1	0	0	0	106.6	S991 E995	S991-I993 PolarHBondContact O-N 3.29Å; I993-E995 VanDerWaalsContact C-N 3.33Å; I993-E995 HydrophobicContact CG2-CG 4.22Å; I993-E995 PolarHBondContact O-N 3.23Å; I993-E995 VanDerWaalsContact O-N 3.07Å
994	I	25.3	Very low	26.9	Very low	146.25 Å²	146.25	145.6 Å²	145.6	75%	0.75	78%	0.782	S	S	*	*			trans	-78.1	107.4	166.5	-63.5	176	0	0	0	105.6	G992 C996	G992-I994 VanDerWaalsContact C-N 3.32Å; G992-I994 PolarHBondContact O-N 2.95Å; I994-C996 VanDerWaalsContact C-N 3.34Å; I994-C996 PolarHBondContact O-N 3.23Å
995	E	21.4	Very low	28	Very low	168.25 Å²	168.25	141.9 Å²	141.9	79%	0.786	76%	0.761	S	S	*	*			trans	-57.5	90.8	167.1	-71	-179.8	136.8	0	0	109.6	I993 K997	I993-E995 VanDerWaalsContact C-N 3.33Å; I993-E995 HydrophobicContact CG2-CG 4.22Å; I993-E995 PolarHBondContact O-N 3.23Å; I993-E995 VanDerWaalsContact O-N 3.07Å; E995-K997 PolarHBondContact O-N 3.11Å
996	C	22	Very low	29.8	Very low	114.5 Å²	114.5	139.4 Å²	139.4	77%	0.774	74%	0.736	S	S	*	*			trans	-67.2	86.6	161.3	-72	0	0	0	0	107.6	I994 E998	I994-C996 VanDerWaalsContact C-N 3.34Å; I994-C996 PolarHBondContact O-N 3.23Å; C996-E998 PolarHBondContact O-N 3.05Å; C996-E998 VanDerWaalsContact O-N 3.12Å
997	K	22.5	Very low	31.9	Very low	184 Å²	184	136.9 Å²	136.9	80%	0.8	72%	0.723	S	S	*	*			trans	-45.8	113.6	174.2	-96.9	178	178.6	175.1	0	110	E995 I999	E995-K997 PolarHBondContact O-N 3.11Å; K997-I999 PolarHBondContact O-N 3.08Å; K997-I999 VanDerWaalsContact O-N 3.17Å
998	E	22.4	Very low	34	Very low	186.75 Å²	186.75	128.9 Å²	128.9	87%	0.873	69%	0.685	S	S	*	*			trans	-55.8	105.9	169.8	-71.7	-179.4	136.9	0	0	109	C996 T1000	C996-E998 PolarHBondContact O-N 3.05Å; C996-E998 VanDerWaalsContact O-N 3.12Å; E998-T1000 VanDerWaalsContact C-N 3.26Å; E998-T1000 PolarHBondContact O-N 2.8Å
999	I	27.2	Very low	36.4	Very low	137.75 Å²	137.75	126.9 Å²	126.9	71%	0.706	66%	0.658	S	S	*	*			trans	-76	100.6	165.4	-59	175.5	0	0	0	105.4	K997 R1001	K997-I999 PolarHBondContact O-N 3.08Å; K997-I999 VanDerWaalsContact O-N 3.17Å; I999-R1001 HydrophobicContact CG2-CG 4.26Å; I999-R1001 PolarHBondContact O-N 3.15Å; I999-R1001 VanDerWaalsContact O-N 3.12Å
1000	T	27.1	Very low	39	Very low	125 Å²	125	115.3 Å²	115.3	77%	0.767	61%	0.614	S	S	*	*			trans	-51.5	104.4	170.6	45.4	0	0	0	0	109.8	E998 D1002	E998-T1000 VanDerWaalsContact C-N 3.26Å; E998-T1000 PolarHBondContact O-N 2.8Å; T1000-D1002 PolarHBondContact O-N 2.92Å
1001	R	31.7	Very low	41.7	Very low	214.6 Å²	214.6	106.6 Å²	106.6	81%	0.81	58%	0.577	S	S	*	*			trans	-101.3	117.7	170.5	-76.6	-176	177.8	161.5	-0.2	108.1	I999 N1003	I999-R1001 HydrophobicContact CG2-CG 4.26Å; I999-R1001 PolarHBondContact O-N 3.15Å; I999-R1001 VanDerWaalsContact O-N 3.12Å; R1001-N1003 PolarHBondContact O-N 3.21Å
1002	D	32.2	Very low	44.7	Very low	145.4 Å²	145.4	101.2 Å²	101.2	78%	0.778	54%	0.539	S	S	*	.			trans	-61.9	113.3	-176.8	-63.2	-53.7	0	0	0	112.3	T1000 S1004	T1000-D1002 PolarHBondContact O-N 2.92Å; D1002-S1004 VanDerWaalsContact C-N 3.3Å; D1002-S1004 PolarHBondContact O-N 3.1Å; D1002-S1004 PolarHBondContact O-OG 3.11Å
1003	N	37.8	Very low	47.6	Very low	161.8 Å²	161.8	100.4 Å²	100.4	87%	0.865	52%	0.516	S	S	*	.	S	Bend	trans	-75.3	71.8	-178.4	-80.6	-21.3	0	0	0	112.4	R1001 C1005	R1001-N1003 PolarHBondContact O-N 3.21Å; N1003-C1005 PolarHBondContact O-N 2.96Å
1004	S	50	Low	50.7	Low	63.8 Å²	63.8	93.3 Å²	93.3	45%	0.446	48%	0.479	S	S	.	.			trans	-115.1	17.2	-179.8	60.8	0	0	0	0	114.7	D1002 S1137	D1002-S1004 VanDerWaalsContact C-N 3.3Å; D1002-S1004 PolarHBondContact O-N 3.1Å; D1002-S1004 PolarHBondContact O-OG 3.11Å; S1004-S1137 PolarHBondContact O-N 3.05Å; S1004-S1137 VanDerWaalsContact O-N 3.08Å; S1004-S1137 PolarHBondContact O-OG 3.11Å; S1004-S1137 WeakPolarHBondContact OG-CB 3.42Å; S1004-S1137 PolarHBondContact OG-OG 3.32Å
1005	C	49.7	Very low	53.7	Low	61.4 Å²	61.4	86.3 Å²	86.3	42%	0.415	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	136.2	-179.8	-168.7	0	0	0	0	111.8	N1003 Q1134 I1135	N1003-C1005 PolarHBondContact O-N 2.96Å; C1005-Q1134 VanDerWaalsContact SG-CB 3.56Å; C1005-I1135 VanDerWaalsContact CA-O 3.32Å; C1005-I1135 WeakPolarHBondContact CA-O 3.36Å; C1005-I1135 PolarHBondContact SG-O 2.84Å
1006	V	62.2	Low	56.9	Low	40.4 Å²	40.4	78.3 Å²	78.3	25%	0.245	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.9	175.9	175.2	0	0	0	0	109.2	L1008 I1135 S1269 T1271	V1006-L1008 HydrophobicContact CG1-CD2 4.31Å; V1006-I1135 PolarHBondContact N-O 3.14Å; V1006-I1135 PolarHBondContact O-N 3.09Å; V1006-S1269 WeakPolarHBondContact CG1-OG 3.3Å; V1006-T1271 HydrophobicContact CG2-CG2 4.29Å
1007	D	68.4	Low	60	Low	87.8 Å²	87.8	73.2 Å²	73.2	47%	0.47	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	121.7	172.7	-66.6	-25.8	0	0	0	109.8	Q1134 S1269	D1007-Q1134 VanDerWaalsContact OD1-CG 3.3Å; D1007-Q1134 WeakPolarHBondContact OD1-CG 3.28Å; D1007-Q1134 PolarHBondContact OD1-NE2 3.2Å; D1007-S1269 PolarHBondContact O-OG 3.02Å; D1007-S1269 VanDerWaalsContact O-OG 3.04Å
1008	L	70.8	Confident	63.2	Low	11.6 Å²	11.6	64.5 Å²	64.5	6%	0.061	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	133.9	169.2	-69.2	-171.9	0	0	0	110.5	V1006 N1132 I1133 I1135 I1146 I1265 N1267 R1268	V1006-L1008 HydrophobicContact CG1-CD2 4.31Å; L1008-N1132 CarbonylContact O-C 3.53Å; L1008-N1132 VanDerWaalsContact O-CA 3.28Å; L1008-N1132 WeakPolarHBondContact O-CA 3.36Å; L1008-I1133 PolarHBondContact N-O 3.15Å; L1008-I1133 PolarHBondContact O-N 3Å; L1008-I1135 HydrophobicContact CB-CD1 4.43Å; L1008-I1135 HydrophobicContact CD1-CB 4.13Å; L1008-I1135 HydrophobicContact CD1-CD1 3.3Å; L1008-I1135 HydrophobicContact CD1-CG1 4.18Å; L1008-I1135 HydrophobicContact CG-CD1 3.62Å; L1008-I1135 HydrophobicContact CG-CG1 4.17Å; L1008-I1146 HydrophobicContact CD1-CG2 4.4Å; L1008-I1265 HydrophobicContact CD1-CD1 4.48Å; L1008-I1265 HydrophobicContact CD1-CG2 4.14Å; L1008-I1265 HydrophobicContact CD2-CG2 3.78Å; L1008-N1267 WeakPolarHBondContact CD2-O 3.15Å; L1008-R1268 HydrophobicContact CD2-CB 4.26Å; L1008-R1268 HydrophobicContact CD2-CG 3.77Å
1009	T	73.6	Confident	66.1	Low	35.4 Å²	35.4	56.4 Å²	56.4	22%	0.217	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.9	169.6	45	0	0	0	0	109.7	T1131 N1132 I1266 N1267	T1009-T1131 CarbonylContact C-O 3.49Å; T1009-T1131 WeakPolarHBondContact CA-O 3.23Å; T1009-N1132 WeakPolarHBondContact CA-OD1 3.14Å; T1009-N1132 WeakPolarHBondContact CB-OD1 3.33Å; T1009-N1132 WeakPolarHBondContact CG2-OD1 3.41Å; T1009-N1132 PolarHBondContact OG1-OD1 2.7Å; T1009-I1266 HydrophobicContact CG2-CB 4.42Å; T1009-I1266 PolarHBondContact O-N 3.05Å; T1009-N1267 HydrophobicContact CG2-CB 4.38Å; T1009-N1267 PolarHBondContact N-O 3.09Å; T1009-N1267 VanDerWaalsContact OG1-CB 3.27Å; T1009-N1267 WeakPolarHBondContact OG1-CB 3.18Å; T1009-N1267 PolarHBondContact OG1-N 2.99Å; T1009-N1267 VanDerWaalsContact OG1-N 3.13Å
1010	V	79.6	Confident	68.8	Low	0.6 Å²	0.6	51.9 Å²	51.9	0%	0.004	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	124	-179.1	-175.5	0	0	0	0	110.1	H1012 C1130 T1131 I1133 I1150 Y1263 N1264 I1265	V1010-H1012 WeakPolarHBondContact CG1-NE2 3.33Å; V1010-H1012 PolarHBondContact O-CD2 2.99Å; V1010-C1130 CarbonylContact O-C 3.55Å; V1010-C1130 VanDerWaalsContact O-CA 3.31Å; V1010-C1130 WeakPolarHBondContact O-CA 3.29Å; V1010-T1131 PolarHBondContact N-O 3.15Å; V1010-T1131 PolarHBondContact O-N 2.9Å; V1010-T1131 PolarHBondContact O-OG1 3.08Å; V1010-I1133 HydrophobicContact CB-CD1 4.31Å; V1010-I1133 HydrophobicContact CG2-CD1 3.97Å; V1010-I1150 HydrophobicContact CG1-CG2 3.97Å; V1010-I1150 HydrophobicContact CG2-CD1 4.16Å; V1010-I1150 HydrophobicContact CG2-CG1 4.28Å; V1010-Y1263 HydrophobicContact CG1-CD2 3.73Å; V1010-Y1263 HydrophobicContact CG1-CG 4.23Å; V1010-N1264 CarbonylContact C-O 3.47Å; V1010-N1264 WeakPolarHBondContact CA-O 3.33Å; V1010-I1265 HydrophobicContact CG2-CG1 4.22Å
1011	E	82	Confident	71.7	Confident	19.6 Å²	19.6	46 Å²	46	9%	0.092	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	117	170	178.3	-175.1	-145.8	0	0	109.3	R1013 R1128 L1129 Y1263 N1264 I1266	E1011-R1013 VanDerWaalsContact CD-NH2 3.33Å; E1011-R1013 HydrophobicContact CG-CG 4.34Å; E1011-R1013 IonicContact OE1-CZ 3.16Å; E1011-R1013 IonicContact OE1-NE 3.29Å; E1011-R1013 PolarHBondContact OE1-NE 2.98Å; E1011-R1013 IonicContact OE1-NH2 2.94Å; E1011-R1013 PolarHBondContact OE1-NH2 3.05Å; E1011-R1013 IonicContact OE2-CZ 3.12Å; E1011-R1013 VanDerWaalsContact OE2-CZ 3.3Å; E1011-R1013 IonicContact OE2-NE 3.38Å; E1011-R1013 PolarHBondContact OE2-NE 3.07Å; E1011-R1013 IonicContact OE2-NH2 3.5Å; E1011-R1013 PolarHBondContact OE2-NH2 3Å; E1011-R1128 VanDerWaalsContact CD-NH2 3.34Å; E1011-R1128 IonicContact OE1-CZ 3.27Å; E1011-R1128 IonicContact OE1-NE 3.51Å; E1011-R1128 PolarHBondContact OE1-NE 3.2Å; E1011-R1128 IonicContact OE1-NH2 2.96Å; E1011-R1128 PolarHBondContact OE1-NH2 3.03Å; E1011-R1128 IonicContact OE2-CZ 3.32Å; E1011-R1128 IonicContact OE2-NE 2.77Å; E1011-R1128 IonicContact OE2-NH2 3.18Å; E1011-R1128 PolarHBondContact OE2-NH2 3.11Å; E1011-L1129 CarbonylContact C-O 3.52Å; E1011-L1129 WeakPolarHBondContact CA-O 3.39Å; E1011-Y1263 CarbonylContact O-C 3.52Å; E1011-Y1263 VanDerWaalsContact O-CA 3.22Å; E1011-Y1263 WeakPolarHBondContact O-CA 3.23Å; E1011-Y1263 WeakPolarHBondContact O-CB 3.37Å; E1011-N1264 PolarHBondContact N-O 2.98Å; E1011-N1264 PolarHBondContact O-N 3.11Å; E1011-I1266 HydrophobicContact CB-CD1 3.61Å; E1011-I1266 HydrophobicContact CB-CG1 4.19Å
1012	H	86.7	Confident	74.3	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	141.4	170.6	-59.9	-96.7	0	0	0	109.5	V1010 R1128 L1129 T1131 F1154 Y1261 C1262	V1010-H1012 WeakPolarHBondContact CG1-NE2 3.33Å; V1010-H1012 PolarHBondContact O-CD2 2.99Å; H1012-R1128 CarbonylContact O-C 3.31Å; H1012-R1128 WeakPolarHBondContact O-CA 3.35Å; H1012-L1129 HydrophobicContact CB-CB 4.44Å; H1012-L1129 PolarHBondContact N-O 3.04Å; H1012-L1129 PolarHBondContact O-N 2.98Å; H1012-T1131 PolarHBondContact CD2-OG1 3.09Å; H1012-T1131 PolarHBondContact NE2-OG1 3.26Å; H1012-T1131 VanDerWaalsContact NE2-OG1 3.07Å; H1012-F1154 HydrophobicContact CB-CD1 4.44Å; H1012-F1154 HydrophobicContact CB-CD2 4.21Å; H1012-F1154 HydrophobicContact CB-CE1 3.96Å; H1012-F1154 HydrophobicContact CB-CE2 3.67Å; H1012-F1154 HydrophobicContact CB-CZ 3.52Å; H1012-F1154 VanDerWaalsContact CB-CZ 3.48Å; H1012-F1154 AromaticContact CD2-CD2 3.67Å; H1012-F1154 AromaticContact CD2-CE2 3.83Å; H1012-F1154 VanDerWaalsContact CE1-CB 3.44Å; H1012-F1154 WeakPolarHBondContact CE1-CB 3.34Å; H1012-F1154 AromaticContact CE1-CD1 3.87Å; H1012-F1154 AromaticContact CE1-CD2 3.71Å; H1012-F1154 AromaticContact CE1-CG 3.38Å; H1012-F1154 VanDerWaalsContact CE1-CG 3.46Å; H1012-F1154 WeakPolarHBondContact CE1-CG 3.38Å; H1012-F1154 AromaticContact CG-CD1 3.89Å; H1012-F1154 AromaticContact CG-CD2 3.59Å; H1012-F1154 AromaticContact CG-CE1 3.95Å; H1012-F1154 AromaticContact CG-CE2 3.58Å; H1012-F1154 AromaticContact CG-CG 3.81Å; H1012-F1154 AromaticContact CG-CZ 3.79Å; H1012-F1154 AromaticContact ND1-CD1 3.4Å; H1012-F1154 WeakPolarHBondContact ND1-CD1 3.41Å; H1012-F1154 AromaticContact ND1-CD2 3.63Å; H1012-F1154 AromaticContact ND1-CE1 3.75Å; H1012-F1154 AromaticContact ND1-CE2 3.95Å; H1012-F1154 AromaticContact ND1-CG 3.33Å; H1012-F1154 VanDerWaalsContact ND1-CG 3.34Å; H1012-F1154 WeakPolarHBondContact ND1-CG 3.3Å; H1012-F1154 AromaticContact ND1-CZ 3.92Å; H1012-F1154 AromaticContact NE2-CD2 3.75Å; H1012-F1154 AromaticContact NE2-CG 3.88Å; H1012-Y1261 HydrophobicContact CB-CE2 4.14Å; H1012-Y1261 PolarHBondContact CE1-OH 3.11Å; H1012-Y1261 AromaticContact ND1-CE2 3.75Å; H1012-Y1261 AromaticContact ND1-CZ 3.79Å; H1012-Y1261 PolarHBondContact ND1-OH 3.05Å; H1012-C1262 CarbonylContact C-O 3.52Å
1013	R	84.1	Confident	76.7	Confident	48.6 Å²	48.6	35.8 Å²	35.8	18%	0.183	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	131.7	173.4	-53.1	-170.7	-175.4	150.7	7.6	109.5	E1011 T1126 H1127 R1128 Y1261 C1262 N1264	E1011-R1013 VanDerWaalsContact CD-NH2 3.33Å; E1011-R1013 HydrophobicContact CG-CG 4.34Å; E1011-R1013 IonicContact OE1-CZ 3.16Å; E1011-R1013 IonicContact OE1-NE 3.29Å; E1011-R1013 PolarHBondContact OE1-NE 2.98Å; E1011-R1013 IonicContact OE1-NH2 2.94Å; E1011-R1013 PolarHBondContact OE1-NH2 3.05Å; E1011-R1013 IonicContact OE2-CZ 3.12Å; E1011-R1013 VanDerWaalsContact OE2-CZ 3.3Å; E1011-R1013 IonicContact OE2-NE 3.38Å; E1011-R1013 PolarHBondContact OE2-NE 3.07Å; E1011-R1013 IonicContact OE2-NH2 3.5Å; E1011-R1013 PolarHBondContact OE2-NH2 3Å; R1013-T1126 HydrophobicContact CB-CG2 4.29Å; R1013-H1127 CarbonylContact C-O 3.44Å; R1013-H1127 VanDerWaalsContact CA-O 3.24Å; R1013-H1127 WeakPolarHBondContact CA-O 3.29Å; R1013-R1128 HydrophobicContact CG-CG 4.2Å; R1013-Y1261 WeakPolarHBondContact O-CA 3.41Å; R1013-Y1261 VanDerWaalsContact O-CD2 3.32Å; R1013-Y1261 WeakPolarHBondContact O-CD2 3.35Å; R1013-C1262 PolarHBondContact N-O 3.18Å; R1013-C1262 PolarHBondContact O-N 3.07Å; R1013-C1262 VanDerWaalsContact O-N 3.08Å; R1013-N1264 PolarHBondContact NH1-OD1 3.2Å; R1013-N1264 VanDerWaalsContact NH2-CG 3.26Å; R1013-N1264 PolarHBondContact NH2-ND2 3.36Å; R1013-N1264 PolarHBondContact NH2-OD1 2.99Å
1014	I	88.6	Confident	79.1	Confident	4.2 Å²	4.2	28.1 Å²	28.1	2%	0.022	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	112.4	175.5	-66	168.2	0	0	0	108.2	I1016 F1053 T1126 H1127 F1154 I1158 D1260 Y1261	I1014-I1016 HydrophobicContact CG2-CD1 4.43Å; I1014-I1016 HydrophobicContact CG2-CG1 4.02Å; I1014-F1053 HydrophobicContact CB-CZ 4.26Å; I1014-F1053 HydrophobicContact CD1-CE1 4.48Å; I1014-F1053 HydrophobicContact CD1-CZ 3.84Å; I1014-F1053 HydrophobicContact CG2-CZ 4.28Å; I1014-T1126 CarbonylContact O-C 3.43Å; I1014-T1126 WeakPolarHBondContact O-CA 3.39Å; I1014-H1127 PolarHBondContact N-O 2.92Å; I1014-H1127 PolarHBondContact O-N 3.13Å; I1014-F1154 HydrophobicContact CD1-CE1 3.8Å; I1014-F1154 HydrophobicContact CD1-CZ 3.77Å; I1014-F1154 HydrophobicContact CG1-CE1 4.46Å; I1014-F1154 HydrophobicContact CG1-CZ 4.49Å; I1014-I1158 HydrophobicContact CD1-CD1 3.45Å; I1014-I1158 VanDerWaalsContact CD1-CD1 3.47Å; I1014-D1260 CarbonylContact C-O 3.53Å; I1014-D1260 VanDerWaalsContact CA-O 3.29Å; I1014-D1260 WeakPolarHBondContact CA-O 3.38Å; I1014-Y1261 HydrophobicContact CG1-CD2 3.81Å; I1014-Y1261 HydrophobicContact CG1-CE2 4.49Å
1015	G	87.4	Confident	80.9	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	137	167.5	0	0	0	0	0	111.4	H1125 M1259 D1260	G1015-H1125 CarbonylContact C-O 3.59Å; G1015-H1125 WeakPolarHBondContact CA-O 3.37Å; G1015-M1259 VanDerWaalsContact O-CA 3.27Å; G1015-M1259 WeakPolarHBondContact O-CA 3.4Å; G1015-D1260 WeakPolarHBondContact CA-OD1 3.35Å; G1015-D1260 PolarHBondContact N-O 3.03Å; G1015-D1260 PolarHBondContact N-OD2 2.93Å; G1015-D1260 PolarHBondContact O-N 3.1Å
1016	I	89.9	Confident	82.5	Confident	0.4 Å²	0.4	22.9 Å²	22.9	0%	0.002	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	121.9	175.6	-54.7	-180	0	0	0	107.5	I1014 F1018 Y1051 F1053 S1124 H1125 L1178 I1257 M1259	I1014-I1016 HydrophobicContact CG2-CD1 4.43Å; I1014-I1016 HydrophobicContact CG2-CG1 4.02Å; I1016-F1018 HydrophobicContact CG2-CE1 4.34Å; I1016-F1018 HydrophobicContact CG2-CE2 4.28Å; I1016-F1018 HydrophobicContact CG2-CZ 3.99Å; I1016-Y1051 HydrophobicContact CD1-CD2 4.35Å; I1016-Y1051 HydrophobicContact CD1-CE2 3.64Å; I1016-F1053 HydrophobicContact CD1-CD2 4.26Å; I1016-F1053 HydrophobicContact CD1-CE2 4.13Å; I1016-F1053 HydrophobicContact CD1-CZ 4.46Å; I1016-S1124 WeakPolarHBondContact O-CA 3.35Å; I1016-H1125 PolarHBondContact N-O 2.9Å; I1016-H1125 PolarHBondContact O-N 3.27Å; I1016-L1178 HydrophobicContact CD1-CD2 3.82Å; I1016-I1257 HydrophobicContact CG2-CG2 4.34Å; I1016-M1259 HydrophobicContact CD1-CE 3.81Å; I1016-M1259 HydrophobicContact CG1-CE 3.86Å; I1016-M1259 HydrophobicContact CG1-CG 4.4Å; I1016-M1259 HydrophobicContact CG1-SD 4.31Å; I1016-M1259 HydrophobicContact CG2-CE 4.09Å; I1016-M1259 HydrophobicContact CG2-CG 4.48Å
1017	T	86.1	Confident	83.4	Confident	7.8 Å²	7.8	24.6 Å²	24.6	5%	0.048	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.8	-177.3	-43.3	0	0	0	0	109.8	E1019 Y1122 W1123 S1124 I1257 S1258	T1017-E1019 HydrophobicContact CG2-CG 4.06Å; T1017-Y1122 HydrophobicContact CG2-CD2 3.48Å; T1017-Y1122 VanDerWaalsContact CG2-CD2 3.4Å; T1017-Y1122 HydrophobicContact CG2-CE2 4.03Å; T1017-Y1122 HydrophobicContact CG2-CG 3.94Å; T1017-W1123 CarbonylContact C-O 3.55Å; T1017-W1123 VanDerWaalsContact CA-O 3.27Å; T1017-W1123 WeakPolarHBondContact CA-O 3.35Å; T1017-W1123 WeakPolarHBondContact CG2-O 3.22Å; T1017-S1124 VanDerWaalsContact CG2-CB 3.48Å; T1017-S1124 VanDerWaalsContact CG2-OG 3.28Å; T1017-S1124 WeakPolarHBondContact CG2-OG 3.34Å; T1017-S1124 VanDerWaalsContact OG1-CB 3.31Å; T1017-S1124 WeakPolarHBondContact OG1-CB 3.27Å; T1017-S1124 PolarHBondContact OG1-OG 3.05Å; T1017-S1124 VanDerWaalsContact OG1-OG 3.08Å; T1017-I1257 WeakPolarHBondContact O-CA 3.36Å; T1017-I1257 WeakPolarHBondContact O-CG2 3.21Å; T1017-S1258 WeakPolarHBondContact CA-O 3.47Å; T1017-S1258 VanDerWaalsContact CB-O 3.31Å; T1017-S1258 WeakPolarHBondContact CB-O 3.22Å; T1017-S1258 VanDerWaalsContact CB-OG 3.23Å; T1017-S1258 WeakPolarHBondContact CB-OG 3.48Å; T1017-S1258 WeakPolarHBondContact CG2-OG 3.33Å; T1017-S1258 PolarHBondContact N-O 3.23Å; T1017-S1258 PolarHBondContact O-N 3.22Å; T1017-S1258 WeakPolarHBondContact OG1-CB 3.47Å; T1017-S1258 PolarHBondContact OG1-O 2.99Å; T1017-S1258 PolarHBondContact OG1-OG 2.83Å; T1017-S1258 VanDerWaalsContact OG1-OG 3.04Å
1018	F	88.7	Confident	84.1	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	121.6	170.8	-60.4	-65.3	0	0	0	108.3	I1016 V1049 Y1051 T1067 F1095 Y1122 W1123 I1180 L1255 I1257	I1016-F1018 HydrophobicContact CG2-CE1 4.34Å; I1016-F1018 HydrophobicContact CG2-CE2 4.28Å; I1016-F1018 HydrophobicContact CG2-CZ 3.99Å; F1018-V1049 HydrophobicContact CD1-CG1 4.22Å; F1018-V1049 HydrophobicContact CD2-CB 4.37Å; F1018-V1049 HydrophobicContact CD2-CG1 4.21Å; F1018-V1049 HydrophobicContact CE1-CG1 3.82Å; F1018-V1049 HydrophobicContact CE2-CB 4.32Å; F1018-V1049 HydrophobicContact CE2-CG1 3.81Å; F1018-V1049 HydrophobicContact CG-CG1 4.41Å; F1018-V1049 HydrophobicContact CZ-CG1 3.61Å; F1018-Y1051 AromaticContact CE2-CD1 3.75Å; F1018-Y1051 HydrophobicContact CE2-CD1 3.75Å; F1018-Y1051 AromaticContact CE2-CE1 3.64Å; F1018-Y1051 HydrophobicContact CE2-CE1 3.64Å; F1018-Y1051 AromaticContact CZ-CD1 3.72Å; F1018-Y1051 HydrophobicContact CZ-CD1 3.72Å; F1018-Y1051 AromaticContact CZ-CE1 3.93Å; F1018-Y1051 HydrophobicContact CZ-CE1 3.95Å; F1018-T1067 HydrophobicContact CB-CG2 4.38Å; F1018-T1067 HydrophobicContact CD2-CG2 3.52Å; F1018-T1067 VanDerWaalsContact CD2-CG2 3.42Å; F1018-T1067 HydrophobicContact CE2-CG2 4.12Å; F1018-T1067 HydrophobicContact CG-CG2 4.33Å; F1018-F1095 HydrophobicContact CB-CB 4.37Å; F1018-F1095 HydrophobicContact CB-CD2 4.1Å; F1018-F1095 HydrophobicContact CB-CG 4.27Å; F1018-F1095 WeakPolarHBondContact O-CB 3.23Å; F1018-Y1122 WeakPolarHBondContact O-CA 3.43Å; F1018-W1123 HydrophobicContact CB-CE3 4.47Å; F1018-W1123 HydrophobicContact CD2-CD2 4.45Å; F1018-W1123 AromaticContact CD2-CE3 3.51Å; F1018-W1123 HydrophobicContact CD2-CE3 3.51Å; F1018-W1123 VanDerWaalsContact CD2-CE3 3.45Å; F1018-W1123 HydrophobicContact CD2-CH2 4.41Å; F1018-W1123 AromaticContact CD2-CZ3 3.59Å; F1018-W1123 HydrophobicContact CD2-CZ3 3.59Å; F1018-W1123 VanDerWaalsContact CD2-CZ3 3.48Å; F1018-W1123 HydrophobicContact CE2-CE3 4.11Å; F1018-W1123 HydrophobicContact CE2-CH2 4.36Å; F1018-W1123 AromaticContact CE2-CZ3 3.69Å; F1018-W1123 HydrophobicContact CE2-CZ3 3.69Å; F1018-W1123 HydrophobicContact CG-CE3 4.41Å; F1018-W1123 PolarHBondContact N-O 3.22Å; F1018-W1123 VanDerWaalsContact N-O 3.13Å; F1018-W1123 PolarHBondContact O-N 3.09Å; F1018-W1123 VanDerWaalsContact O-N 3.13Å; F1018-I1180 HydrophobicContact CE1-CD1 4.15Å; F1018-I1180 HydrophobicContact CE1-CG1 4.48Å; F1018-I1180 HydrophobicContact CE1-CG2 4.2Å; F1018-I1180 HydrophobicContact CZ-CD1 4.08Å; F1018-I1180 HydrophobicContact CZ-CG1 4.38Å; F1018-I1180 HydrophobicContact CZ-CG2 4.44Å; F1018-L1255 HydrophobicContact CD1-CD1 4.48Å; F1018-L1255 HydrophobicContact CD1-CD2 3.63Å; F1018-L1255 HydrophobicContact CD1-CG 4.16Å; F1018-L1255 HydrophobicContact CE1-CD2 3.84Å; F1018-I1257 HydrophobicContact CD1-CD1 4.19Å; F1018-I1257 HydrophobicContact CD1-CG1 3.99Å; F1018-I1257 HydrophobicContact CE1-CD1 3.87Å; F1018-I1257 HydrophobicContact CE1-CG1 4.18Å; F1018-I1257 HydrophobicContact CE1-CG2 4.48Å
1019	E	83.7	Confident	84.6	Confident	16.6 Å²	16.6	21.8 Å²	21.8	8%	0.078	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-63.8	-174.2	-60	-179.9	165.5	0	0	110.1	T1017 E1094 F1095 S1121 Y1122 R1236 Q1256 S1258 Y1388	T1017-E1019 HydrophobicContact CG2-CG 4.06Å; E1019-E1094 WeakPolarHBondContact O-CA 3.29Å; E1019-F1095 PolarHBondContact O-N 3.06Å; E1019-F1095 VanDerWaalsContact O-N 3.08Å; E1019-S1121 VanDerWaalsContact O-O 3.1Å; E1019-Y1122 HydrophobicContact CB-CD1 4.04Å; E1019-Y1122 HydrophobicContact CB-CD2 4.01Å; E1019-Y1122 HydrophobicContact CB-CE1 4.18Å; E1019-Y1122 HydrophobicContact CB-CE2 4.14Å; E1019-Y1122 HydrophobicContact CB-CG 3.96Å; E1019-Y1122 HydrophobicContact CG-CD2 3.77Å; E1019-Y1122 HydrophobicContact CG-CE2 4.19Å; E1019-Y1122 HydrophobicContact CG-CG 4Å; E1019-Y1122 VanDerWaalsContact O-CD1 3.29Å; E1019-Y1122 WeakPolarHBondContact O-CD1 3.34Å; E1019-Y1122 WeakPolarHBondContact O-CE1 3.33Å; E1019-R1236 VanDerWaalsContact CD-NE 3.29Å; E1019-R1236 IonicContact OE1-CZ 3.34Å; E1019-R1236 IonicContact OE1-NE 2.87Å; E1019-R1236 PolarHBondContact OE1-NE 2.92Å; E1019-R1236 IonicContact OE1-NH1 3.38Å; E1019-R1236 PolarHBondContact OE1-NH1 3.01Å; E1019-R1236 IonicContact OE1-NH2 3.76Å; E1019-R1236 PolarHBondContact OE1-NH2 2.76Å; E1019-R1236 IonicContact OE2-CZ 3.41Å; E1019-R1236 IonicContact OE2-NE 2.93Å; E1019-R1236 PolarHBondContact OE2-NE 3.14Å; E1019-R1236 IonicContact OE2-NH1 3.25Å; E1019-R1236 PolarHBondContact OE2-NH1 3.28Å; E1019-R1236 IonicContact OE2-NH2 3.48Å; E1019-R1236 PolarHBondContact OE2-NH2 2.88Å; E1019-Q1256 HydrophobicContact CB-CB 4.38Å; E1019-Q1256 HydrophobicContact CB-CG 4.24Å; E1019-Q1256 PolarHBondContact N-O 3.14Å; E1019-Q1256 VanDerWaalsContact N-O 3.07Å; E1019-Q1256 VanDerWaalsContact OE2-CD 3.3Å; E1019-Q1256 WeakPolarHBondContact OE2-CG 3.46Å; E1019-Q1256 PolarHBondContact OE2-NE2 2.98Å; E1019-S1258 WeakPolarHBondContact OE1-CB 3.36Å; E1019-S1258 PolarHBondContact OE1-OG 2.82Å; E1019-Y1388 PolarHBondContact OE1-OH 2.86Å
1020	Q	85	Confident	85	Confident	44.4 Å²	44.4	20.1 Å²	20.1	21%	0.207	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	139.6	-171.4	-98.1	179	3	0	0	112	F1022 C1093 E1094 Y1122 Q1256	Q1020-F1022 HydrophobicContact CB-CD2 4.28Å; Q1020-F1022 HydrophobicContact CB-CE2 3.57Å; Q1020-F1022 HydrophobicContact CB-CZ 3.87Å; Q1020-F1022 HydrophobicContact CG-CD1 4.48Å; Q1020-F1022 HydrophobicContact CG-CD2 4.1Å; Q1020-F1022 HydrophobicContact CG-CE1 4.04Å; Q1020-F1022 HydrophobicContact CG-CE2 3.58Å; Q1020-F1022 HydrophobicContact CG-CZ 3.86Å; Q1020-C1093 CarbonylContact C-O 3.5Å; Q1020-C1093 WeakPolarHBondContact CA-O 3.38Å; Q1020-E1094 HydrophobicContact CB-CG 4.47Å; Q1020-E1094 HydrophobicContact CG-CB 4.43Å; Q1020-E1094 HydrophobicContact CG-CG 4.03Å; Q1020-E1094 PolarHBondContact NE2-OE1 3.02Å; Q1020-Y1122 HydrophobicContact CG-CE1 4.07Å; Q1020-Y1122 PolarHBondContact NE2-OH 2.89Å; Q1020-Q1256 HydrophobicContact CB-CB 4.5Å; Q1020-Q1256 WeakPolarHBondContact O-CB 3.44Å; Q1020-Q1256 PolarHBondContact O-N 3.08Å
1021	L	88.4	Confident	85	Confident	0.6 Å²	0.6	25.7 Å²	25.7	0%	0.003	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.2	166.1	-180	65.8	0	0	0	108.3	F1024 S1092 C1093 F1095 L1182 L1241 R1254 L1255	L1021-F1024 HydrophobicContact CD1-CB 4.09Å; L1021-F1024 HydrophobicContact CD2-CB 3.78Å; L1021-F1024 HydrophobicContact CD2-CD1 3.96Å; L1021-F1024 HydrophobicContact CD2-CG 3.88Å; L1021-F1024 HydrophobicContact CG-CB 3.86Å; L1021-F1024 HydrophobicContact CG-CG 4.44Å; L1021-S1092 CarbonylContact O-C 3.48Å; L1021-S1092 WeakPolarHBondContact O-CA 3.33Å; L1021-S1092 VanDerWaalsContact O-CB 3.26Å; L1021-S1092 WeakPolarHBondContact O-CB 3.4Å; L1021-C1093 HydrophobicContact CB-CB 4.29Å; L1021-C1093 HydrophobicContact CD2-CB 4.49Å; L1021-C1093 PolarHBondContact N-O 3.14Å; L1021-C1093 PolarHBondContact O-N 3.06Å; L1021-C1093 VanDerWaalsContact O-N 3.11Å; L1021-F1095 HydrophobicContact CB-CE2 3.97Å; L1021-F1095 HydrophobicContact CB-CZ 4.34Å; L1021-L1182 HydrophobicContact CD1-CD2 4.13Å; L1021-L1182 HydrophobicContact CD2-CD1 4.31Å; L1021-L1182 HydrophobicContact CD2-CD2 3.96Å; L1021-L1241 HydrophobicContact CD1-CD1 3.52Å; L1021-L1241 VanDerWaalsContact CD1-CD1 3.47Å; L1021-R1254 CarbonylContact C-O 3.51Å; L1021-R1254 WeakPolarHBondContact CA-O 3.45Å; L1021-L1255 HydrophobicContact CB-CD1 4.41Å; L1021-L1255 HydrophobicContact CD1-CD1 4.38Å
1022	F	84.5	Confident	84.5	Confident	55.6 Å²	55.6	30.8 Å²	30.8	24%	0.244	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	158.1	176.5	-62.8	-90.5	0	0	0	110.7	Q1020 F1024 I1091 F1238 G1253 R1254 Q1256	Q1020-F1022 HydrophobicContact CB-CD2 4.28Å; Q1020-F1022 HydrophobicContact CB-CE2 3.57Å; Q1020-F1022 HydrophobicContact CB-CZ 3.87Å; Q1020-F1022 HydrophobicContact CG-CD1 4.48Å; Q1020-F1022 HydrophobicContact CG-CD2 4.1Å; Q1020-F1022 HydrophobicContact CG-CE1 4.04Å; Q1020-F1022 HydrophobicContact CG-CE2 3.58Å; Q1020-F1022 HydrophobicContact CG-CZ 3.86Å; F1022-F1024 PolarHBondContact O-N 2.88Å; F1022-I1091 CarbonylContact C-O 3.45Å; F1022-F1238 HydrophobicContact CD2-CD1 4.39Å; F1022-F1238 AromaticContact CD2-CE1 3.89Å; F1022-F1238 HydrophobicContact CD2-CE1 4.06Å; F1022-F1238 HydrophobicContact CE2-CD1 4.45Å; F1022-F1238 AromaticContact CE2-CE1 3.73Å; F1022-F1238 HydrophobicContact CE2-CE1 3.73Å; F1022-F1238 HydrophobicContact CZ-CE1 4.44Å; F1022-G1253 CarbonylContact O-C 3.54Å; F1022-G1253 WeakPolarHBondContact O-CA 3.36Å; F1022-R1254 HydrophobicContact CB-CB 4.36Å; F1022-R1254 PolarHBondContact N-O 2.92Å; F1022-R1254 PolarHBondContact O-N 3.16Å; F1022-Q1256 HydrophobicContact CD2-CB 4.49Å; F1022-Q1256 HydrophobicContact CE2-CB 3.93Å; F1022-Q1256 VanDerWaalsContact CE2-OE1 3.29Å
1023	D	83.8	Confident	83.8	Confident	90.4 Å²	90.4	31.8 Å²	31.8	48%	0.483	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	51.3	28.8	167	-60.2	-27	0	0	0	115.3	H1090 I1091 G1253	D1023-H1090 HydrophobicContact CB-CB 4.36Å; D1023-H1090 PolarHBondContact O-CD2 3.03Å; D1023-H1090 VanDerWaalsContact O-CD2 3.22Å; D1023-H1090 PolarHBondContact O-ND1 2.92Å; D1023-I1091 PolarHBondContact N-O 3.17Å; D1023-G1253 VanDerWaalsContact C-CA 3.45Å; D1023-G1253 VanDerWaalsContact O-CA 3.29Å; D1023-G1253 WeakPolarHBondContact O-CA 3.34Å; D1023-G1253 PolarHBondContact O-N 3.14Å
1024	F	88.6	Confident	83.1	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	132.5	-176.9	176.7	-109.2	0	0	0	111.9	L1021 F1022 P1026 P1029 L1072 H1090 I1091 L1182 L1184 A1196 N1252	L1021-F1024 HydrophobicContact CD1-CB 4.09Å; L1021-F1024 HydrophobicContact CD2-CB 3.78Å; L1021-F1024 HydrophobicContact CD2-CD1 3.96Å; L1021-F1024 HydrophobicContact CD2-CG 3.88Å; L1021-F1024 HydrophobicContact CG-CB 3.86Å; L1021-F1024 HydrophobicContact CG-CG 4.44Å; F1022-F1024 PolarHBondContact O-N 2.88Å; F1024-P1026 HydrophobicContact CE1-CB 3.8Å; F1024-P1026 HydrophobicContact CE1-CG 4.4Å; F1024-P1026 HydrophobicContact CZ-CB 4.29Å; F1024-P1029 HydrophobicContact CZ-CG 4.35Å; F1024-L1072 HydrophobicContact CD1-CD1 4.41Å; F1024-L1072 HydrophobicContact CE1-CD1 4.01Å; F1024-H1090 CarbonylContact O-C 3.51Å; F1024-H1090 WeakPolarHBondContact O-CA 3.29Å; F1024-I1091 PolarHBondContact N-O 3.03Å; F1024-I1091 VanDerWaalsContact N-O 3.12Å; F1024-I1091 PolarHBondContact O-N 3.07Å; F1024-L1182 HydrophobicContact CD1-CD2 4.45Å; F1024-L1182 HydrophobicContact CD2-CD2 3.65Å; F1024-L1182 HydrophobicContact CE1-CD2 4.27Å; F1024-L1182 HydrophobicContact CE2-CD2 3.45Å; F1024-L1182 VanDerWaalsContact CE2-CD2 3.41Å; F1024-L1182 HydrophobicContact CG-CD2 4.16Å; F1024-L1182 HydrophobicContact CZ-CD2 3.79Å; F1024-L1184 HydrophobicContact CE1-CD2 4.08Å; F1024-L1184 HydrophobicContact CZ-CD1 4.4Å; F1024-L1184 HydrophobicContact CZ-CD2 4.25Å; F1024-L1184 HydrophobicContact CZ-CG 4.44Å; F1024-A1196 HydrophobicContact CE2-CB 4.24Å; F1024-A1196 HydrophobicContact CZ-CB 3.92Å; F1024-N1252 WeakPolarHBondContact CD2-O 3.47Å; F1024-N1252 VanDerWaalsContact CD2-OD1 3.32Å; F1024-N1252 WeakPolarHBondContact CD2-OD1 3.32Å; F1024-N1252 WeakPolarHBondContact CE2-ND2 3.27Å
1025	D	86.4	Confident	82.3	Confident	14.2 Å²	14.2	37.9 Å²	37.9	8%	0.076	19%	0.188	C	C	.	.			trans	-115	105.5	174.1	-172.7	-6.8	0	0	0	110.9	R1027 I1028 P1029 N1252	D1025-R1027 PolarHBondContact O-N 2.99Å; D1025-R1027 VanDerWaalsContact OD1-CB 3.26Å; D1025-R1027 WeakPolarHBondContact OD1-CB 3.26Å; D1025-R1027 WeakPolarHBondContact OD1-CG 3.18Å; D1025-R1027 IonicContact OD1-CZ 3.26Å; D1025-R1027 VanDerWaalsContact OD1-CZ 3.3Å; D1025-R1027 PolarHBondContact OD1-N 3Å; D1025-R1027 IonicContact OD1-NE 3.68Å; D1025-R1027 PolarHBondContact OD1-NE 2.95Å; D1025-R1027 VanDerWaalsContact OD1-NE 3.1Å; D1025-R1027 IonicContact OD1-NH2 3.6Å; D1025-R1027 PolarHBondContact OD1-NH2 3.11Å; D1025-R1027 VanDerWaalsContact OD1-NH2 3.15Å; D1025-R1027 IonicContact OD2-CZ 3.19Å; D1025-R1027 VanDerWaalsContact OD2-CZ 3.3Å; D1025-R1027 IonicContact OD2-NE 3.32Å; D1025-R1027 PolarHBondContact OD2-NE 3.07Å; D1025-R1027 IonicContact OD2-NH2 3.34Å; D1025-R1027 PolarHBondContact OD2-NH2 3.12Å; D1025-I1028 HydrophobicContact CB-CD1 4Å; D1025-I1028 HydrophobicContact CB-CG1 4.15Å; D1025-I1028 PolarHBondContact O-N 2.92Å; D1025-P1029 VanDerWaalsContact O-CD 3.3Å; D1025-P1029 WeakPolarHBondContact O-CD 3.4Å; D1025-N1252 PolarHBondContact N-OD1 3.13Å; D1025-N1252 PolarHBondContact O-ND2 3.07Å; D1025-N1252 PolarHBondContact O-OD1 3.16Å
1026	P	84.5	Confident	81.6	Confident	0.8 Å²	0.8	39.2 Å²	39.2	1%	0.005	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-13.3	179.1	28.1	-34.9	0	0	0	113.5	F1024 I1028 P1029 L1030 V1040 W1042 L1045 L1072 I1091 L1184	F1024-P1026 HydrophobicContact CE1-CB 3.8Å; F1024-P1026 HydrophobicContact CE1-CG 4.4Å; F1024-P1026 HydrophobicContact CZ-CB 4.29Å; P1026-I1028 VanDerWaalsContact C-N 3.29Å; P1026-I1028 PolarHBondContact O-N 2.94Å; P1026-P1029 WeakPolarHBondContact O-CD 3.28Å; P1026-P1029 WeakPolarHBondContact O-CG 3.33Å; P1026-L1030 HydrophobicContact CB-CD1 4.4Å; P1026-L1030 VanDerWaalsContact O-CB 3.28Å; P1026-L1030 WeakPolarHBondContact O-CB 3.4Å; P1026-L1030 WeakPolarHBondContact O-CD1 3.42Å; P1026-L1030 WeakPolarHBondContact O-CG 3.41Å; P1026-L1030 PolarHBondContact O-N 2.95Å; P1026-V1040 HydrophobicContact CB-CG1 4.43Å; P1026-V1040 HydrophobicContact CB-CG2 4.27Å; P1026-V1040 HydrophobicContact CG-CG1 3.99Å; P1026-V1040 HydrophobicContact CG-CG2 3.98Å; P1026-W1042 HydrophobicContact CG-CH2 4.44Å; P1026-L1045 HydrophobicContact CB-CD2 4.08Å; P1026-L1045 HydrophobicContact CG-CD2 4.42Å; P1026-L1072 HydrophobicContact CB-CD1 4.4Å; P1026-L1072 HydrophobicContact CG-CD1 4.46Å; P1026-I1091 VanDerWaalsContact CD-CD1 3.43Å; P1026-I1091 HydrophobicContact CG-CD1 3.53Å; P1026-I1091 VanDerWaalsContact CG-CD1 3.47Å; P1026-L1184 HydrophobicContact CB-CD1 4.2Å
1027	R	81.3	Confident	80.9	Confident	76.8 Å²	76.8	45 Å²	45	29%	0.29	22%	0.224	S	C	.	.	H	α-helix	trans	-66.5	-32	176.9	-65.4	175.7	-70	-119.4	-21.3	112.3	D1025 L1030 Q1031 G1038 V1040 K1089	D1025-R1027 PolarHBondContact O-N 2.99Å; D1025-R1027 VanDerWaalsContact OD1-CB 3.26Å; D1025-R1027 WeakPolarHBondContact OD1-CB 3.26Å; D1025-R1027 WeakPolarHBondContact OD1-CG 3.18Å; D1025-R1027 IonicContact OD1-CZ 3.26Å; D1025-R1027 VanDerWaalsContact OD1-CZ 3.3Å; D1025-R1027 PolarHBondContact OD1-N 3Å; D1025-R1027 IonicContact OD1-NE 3.68Å; D1025-R1027 PolarHBondContact OD1-NE 2.95Å; D1025-R1027 VanDerWaalsContact OD1-NE 3.1Å; D1025-R1027 IonicContact OD1-NH2 3.6Å; D1025-R1027 PolarHBondContact OD1-NH2 3.11Å; D1025-R1027 VanDerWaalsContact OD1-NH2 3.15Å; D1025-R1027 IonicContact OD2-CZ 3.19Å; D1025-R1027 VanDerWaalsContact OD2-CZ 3.3Å; D1025-R1027 IonicContact OD2-NE 3.32Å; D1025-R1027 PolarHBondContact OD2-NE 3.07Å; D1025-R1027 IonicContact OD2-NH2 3.34Å; D1025-R1027 PolarHBondContact OD2-NH2 3.12Å; R1027-L1030 CarbonylContact O-C 3.58Å; R1027-L1030 PolarHBondContact O-N 3.19Å; R1027-Q1031 VanDerWaalsContact O-CB 3.3Å; R1027-Q1031 WeakPolarHBondContact O-CB 3.37Å; R1027-Q1031 PolarHBondContact O-N 3.2Å; R1027-G1038 WeakPolarHBondContact CG-O 3.38Å; R1027-V1040 HydrophobicContact CB-CG2 4.4Å; R1027-V1040 HydrophobicContact CG-CG2 3.38Å; R1027-V1040 VanDerWaalsContact CG-CG2 3.44Å; R1027-K1089 VanDerWaalsContact NH2-C 3.34Å; R1027-K1089 VanDerWaalsContact NH2-CA 3.29Å; R1027-K1089 VanDerWaalsContact NH2-CG 3.33Å; R1027-K1089 PolarHBondContact NH2-O 3.05Å
1028	I	82.6	Confident	80.3	Confident	41.2 Å²	41.2	45.4 Å²	45.4	21%	0.211	23%	0.229	C	C	.	.	H	α-helix	trans	-61.6	-56.4	-177.7	-57.4	176	0	0	0	110.5	D1025 P1026 L1030 Q1031 Y1032 D1243 N1252	D1025-I1028 HydrophobicContact CB-CD1 4Å; D1025-I1028 HydrophobicContact CB-CG1 4.15Å; D1025-I1028 PolarHBondContact O-N 2.92Å; P1026-I1028 VanDerWaalsContact C-N 3.29Å; P1026-I1028 PolarHBondContact O-N 2.94Å; I1028-L1030 VanDerWaalsContact C-N 3.33Å; I1028-L1030 PolarHBondContact O-N 2.9Å; I1028-Q1031 VanDerWaalsContact O-CB 3.28Å; I1028-Q1031 WeakPolarHBondContact O-CB 3.23Å; I1028-Q1031 PolarHBondContact O-N 3.03Å; I1028-Y1032 VanDerWaalsContact O-CD2 3.29Å; I1028-Y1032 WeakPolarHBondContact O-CD2 3.32Å; I1028-Y1032 WeakPolarHBondContact O-CE2 3.22Å; I1028-D1243 HydrophobicContact CG2-CB 4.03Å; I1028-D1243 WeakPolarHBondContact CG2-OD1 2.95Å; I1028-N1252 HydrophobicContact CD1-CB 4.37Å
1029	P	80.9	Confident	79.6	Confident	0.2 Å²	0.2	47.7 Å²	47.7	0%	0.001	25%	0.248	C	C	.	.	H	α-helix	trans	-66.8	-37.8	177.5	25.5	-35	0	0	0	112.1	F1024 D1025 P1026 Q1031 Y1032 L1184 A1196 D1243 N1252	F1024-P1029 HydrophobicContact CZ-CG 4.35Å; D1025-P1029 VanDerWaalsContact O-CD 3.3Å; D1025-P1029 WeakPolarHBondContact O-CD 3.4Å; P1026-P1029 WeakPolarHBondContact O-CD 3.28Å; P1026-P1029 WeakPolarHBondContact O-CG 3.33Å; P1029-Q1031 VanDerWaalsContact C-N 3.25Å; P1029-Q1031 PolarHBondContact O-N 3Å; P1029-Q1031 VanDerWaalsContact O-N 3.16Å; P1029-Y1032 PolarHBondContact O-N 3.02Å; P1029-Y1032 VanDerWaalsContact O-N 3.14Å; P1029-L1184 HydrophobicContact CG-CD1 3.97Å; P1029-A1196 HydrophobicContact CB-CB 3.95Å; P1029-A1196 HydrophobicContact CG-CB 3.76Å; P1029-D1243 WeakPolarHBondContact CD-OD1 3.44Å; P1029-N1252 WeakPolarHBondContact CD-ND2 3.38Å
1030	L	82.4	Confident	79.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-71	-10.3	177.9	-65.6	174.7	0	0	0	113.9	P1026 R1027 I1028 Y1032 D1033 Y1036 N1037 G1038 V1040 L1045 L1184 I1186	P1026-L1030 HydrophobicContact CB-CD1 4.4Å; P1026-L1030 VanDerWaalsContact O-CB 3.28Å; P1026-L1030 WeakPolarHBondContact O-CB 3.4Å; P1026-L1030 WeakPolarHBondContact O-CD1 3.42Å; P1026-L1030 WeakPolarHBondContact O-CG 3.41Å; P1026-L1030 PolarHBondContact O-N 2.95Å; R1027-L1030 CarbonylContact O-C 3.58Å; R1027-L1030 PolarHBondContact O-N 3.19Å; I1028-L1030 VanDerWaalsContact C-N 3.33Å; I1028-L1030 PolarHBondContact O-N 2.9Å; L1030-Y1032 VanDerWaalsContact C-N 3.26Å; L1030-Y1032 PolarHBondContact O-N 3.09Å; L1030-D1033 HydrophobicContact CD2-CB 4.42Å; L1030-D1033 PolarHBondContact O-N 2.94Å; L1030-Y1036 HydrophobicContact CD2-CD2 4.09Å; L1030-Y1036 HydrophobicContact CD2-CE2 4.32Å; L1030-Y1036 HydrophobicContact CD2-CG 4.48Å; L1030-N1037 PolarHBondContact O-N 3.48Å; L1030-G1038 PolarHBondContact O-N 3.03Å; L1030-V1040 HydrophobicContact CD1-CB 4.48Å; L1030-V1040 HydrophobicContact CD1-CG1 4.36Å; L1030-V1040 HydrophobicContact CD1-CG2 4.27Å; L1030-L1045 HydrophobicContact CD1-CD2 4.37Å; L1030-L1184 HydrophobicContact CD2-CD1 4.39Å; L1030-L1184 HydrophobicContact CG-CD1 4.28Å; L1030-I1186 HydrophobicContact CD2-CD1 3.62Å; L1030-I1186 VanDerWaalsContact CD2-CD1 3.49Å; L1030-I1186 HydrophobicContact CD2-CG1 4.39Å
1031	Q	79.3	Confident	79.1	Confident	118 Å²	118	46.7 Å²	46.7	55%	0.551	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	-27	173.9	-170.4	151.1	33.5	0	0	112.3	R1027 I1028 P1029 N1037	R1027-Q1031 VanDerWaalsContact O-CB 3.3Å; R1027-Q1031 WeakPolarHBondContact O-CB 3.37Å; R1027-Q1031 PolarHBondContact O-N 3.2Å; I1028-Q1031 VanDerWaalsContact O-CB 3.28Å; I1028-Q1031 WeakPolarHBondContact O-CB 3.23Å; I1028-Q1031 PolarHBondContact O-N 3.03Å; P1029-Q1031 VanDerWaalsContact C-N 3.25Å; P1029-Q1031 PolarHBondContact O-N 3Å; P1029-Q1031 VanDerWaalsContact O-N 3.16Å; Q1031-N1037 PolarHBondContact NE2-O 3.04Å; Q1031-N1037 PolarHBondContact OE1-O 3.35Å
1032	Y	72.2	Confident	78.5	Confident	126 Å²	126	50.5 Å²	50.5	49%	0.494	26%	0.261	S	S	.	.	S	Bend	trans	-94.1	-9.2	177.9	-57.7	-85.2	0	0	0	112.7	I1028 P1029 L1030 S1034 D1243 N1245 S1246	I1028-Y1032 VanDerWaalsContact O-CD2 3.29Å; I1028-Y1032 WeakPolarHBondContact O-CD2 3.32Å; I1028-Y1032 WeakPolarHBondContact O-CE2 3.22Å; P1029-Y1032 PolarHBondContact O-N 3.02Å; P1029-Y1032 VanDerWaalsContact O-N 3.14Å; L1030-Y1032 VanDerWaalsContact C-N 3.26Å; L1030-Y1032 PolarHBondContact O-N 3.09Å; Y1032-S1034 PolarHBondContact O-N 3.21Å; Y1032-D1243 WeakPolarHBondContact CE2-OD2 3.08Å; Y1032-N1245 HydrophobicContact CD1-CB 3.99Å; Y1032-N1245 HydrophobicContact CD2-CB 3.28Å; Y1032-N1245 HydrophobicContact CE1-CB 4.18Å; Y1032-N1245 HydrophobicContact CE2-CB 3.5Å; Y1032-N1245 VanDerWaalsContact CE2-CB 3.45Å; Y1032-N1245 HydrophobicContact CG-CB 3.53Å; Y1032-N1245 VanDerWaalsContact CG-CB 3.5Å; Y1032-S1246 PolarHBondContact OH-OG 3.35Å
1033	D	71.1	Confident	77.8	Confident	22.4 Å²	22.4	50 Å²	50	12%	0.12	27%	0.272	C	S	.	.			trans	-77.6	118.1	171.2	-167.1	-52.1	0	0	0	110.3	L1030 N1035 Y1036 N1037 H1192	L1030-D1033 HydrophobicContact CD2-CB 4.42Å; L1030-D1033 PolarHBondContact O-N 2.94Å; D1033-N1035 PolarHBondContact O-N 3.13Å; D1033-N1035 VanDerWaalsContact O-N 3.09Å; D1033-N1035 VanDerWaalsContact OD1-CB 3.28Å; D1033-N1035 WeakPolarHBondContact OD1-CB 3.32Å; D1033-N1035 VanDerWaalsContact OD1-CG 3.27Å; D1033-N1035 PolarHBondContact OD1-N 3.05Å; D1033-N1035 PolarHBondContact OD1-ND2 3.13Å; D1033-Y1036 HydrophobicContact CB-CD2 4.07Å; D1033-Y1036 VanDerWaalsContact CG-CD2 3.48Å; D1033-Y1036 PolarHBondContact O-N 3.22Å; D1033-Y1036 VanDerWaalsContact O-N 3.12Å; D1033-N1037 PolarHBondContact O-N 3.02Å; D1033-N1037 VanDerWaalsContact O-N 3.07Å; D1033-H1192 IonicContact OD2-CD2 3.24Å; D1033-H1192 IonicContact OD2-NE2 3.13Å; D1033-H1192 PolarHBondContact OD2-NE2 3.32Å
1034	S	70.2	Confident	77.5	Confident	96 Å²	96	48.4 Å²	48.4	67%	0.671	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-20.6	-177.6	58.9	0	0	0	0	114.7	R122 Y1032	R122-S1034 PolarHBondContact NH2-O 2.82Å; R122-S1034 PolarHBondContact NH2-OG 2.94Å; R122-S1034 VanDerWaalsContact NH2-OG 3.15Å; Y1032-S1034 PolarHBondContact O-N 3.21Å
1035	N	70.7	Confident	77.1	Confident	85 Å²	85	48.4 Å²	48.4	46%	0.455	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-26.7	-179.5	-58.5	-50.9	0	0	0	112.5	R122 D1033	R122-N1035 PolarHBondContact NH1-OD1 2.83Å; R122-N1035 PolarHBondContact NH2-OD1 3.43Å; R122-N1035 VanDerWaalsContact NH2-OD1 3.16Å; D1033-N1035 PolarHBondContact O-N 3.13Å; D1033-N1035 VanDerWaalsContact O-N 3.09Å; D1033-N1035 VanDerWaalsContact OD1-CB 3.28Å; D1033-N1035 WeakPolarHBondContact OD1-CB 3.32Å; D1033-N1035 VanDerWaalsContact OD1-CG 3.27Å; D1033-N1035 PolarHBondContact OD1-N 3.05Å; D1033-N1035 PolarHBondContact OD1-ND2 3.13Å
1036	Y	73.3	Confident	77.1	Confident	25.8 Å²	25.8	48.5 Å²	48.5	10%	0.101	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-31.6	-169.2	-64.5	-73.9	0	0	0	114.2	I39 L1030 D1033 G1038 A1039 P1041 I1186 S1188 P1189 H1192	I39-Y1036 HydrophobicContact CD1-CE1 4.37Å; L1030-Y1036 HydrophobicContact CD2-CD2 4.09Å; L1030-Y1036 HydrophobicContact CD2-CE2 4.32Å; L1030-Y1036 HydrophobicContact CD2-CG 4.48Å; D1033-Y1036 HydrophobicContact CB-CD2 4.07Å; D1033-Y1036 VanDerWaalsContact CG-CD2 3.48Å; D1033-Y1036 PolarHBondContact O-N 3.22Å; D1033-Y1036 VanDerWaalsContact O-N 3.12Å; Y1036-G1038 PolarHBondContact O-N 3.16Å; Y1036-G1038 VanDerWaalsContact O-N 3.11Å; Y1036-A1039 VanDerWaalsContact CB-O 3.29Å; Y1036-A1039 WeakPolarHBondContact CB-O 3.33Å; Y1036-A1039 HydrophobicContact CD1-CB 4.38Å; Y1036-A1039 WeakPolarHBondContact CD1-O 3.46Å; Y1036-A1039 VanDerWaalsContact O-CB 3.28Å; Y1036-A1039 WeakPolarHBondContact O-CB 3.34Å; Y1036-A1039 PolarHBondContact O-N 3.03Å; Y1036-P1041 HydrophobicContact CD1-CG 4.26Å; Y1036-P1041 HydrophobicContact CE1-CB 4.09Å; Y1036-P1041 HydrophobicContact CE1-CG 3.75Å; Y1036-P1041 HydrophobicContact CE2-CG 4.45Å; Y1036-I1186 HydrophobicContact CD2-CD1 4.4Å; Y1036-I1186 HydrophobicContact CE1-CG2 4.36Å; Y1036-I1186 HydrophobicContact CE2-CD1 3.92Å; Y1036-I1186 HydrophobicContact CE2-CG2 4.03Å; Y1036-I1186 WeakPolarHBondContact OH-CG2 3.39Å; Y1036-S1188 VanDerWaalsContact OH-C 3.27Å; Y1036-S1188 PolarHBondContact OH-O 2.82Å; Y1036-P1189 WeakPolarHBondContact OH-CD 3.19Å; Y1036-H1192 AromaticContact CE2-CE1 3.9Å; Y1036-H1192 AromaticContact CE2-NE2 3.88Å
1037	N	75	Confident	77.4	Confident	123 Å²	123	48.5 Å²	48.5	66%	0.658	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.6	37.5	-176.2	-73.1	-16.5	0	0	0	113.1	L1030 Q1031 D1033	L1030-N1037 PolarHBondContact O-N 3.48Å; Q1031-N1037 PolarHBondContact NE2-O 3.04Å; Q1031-N1037 PolarHBondContact OE1-O 3.35Å; D1033-N1037 PolarHBondContact O-N 3.02Å; D1033-N1037 VanDerWaalsContact O-N 3.07Å
1038	G	72.8	Confident	77.8	Confident	16.4 Å²	16.4	45.2 Å²	45.2	17%	0.169	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	2.5	179.2	0	0	0	0	0	115	R1027 L1030 Y1036	R1027-G1038 WeakPolarHBondContact CG-O 3.38Å; L1030-G1038 PolarHBondContact O-N 3.03Å; Y1036-G1038 PolarHBondContact O-N 3.16Å; Y1036-G1038 VanDerWaalsContact O-N 3.11Å
1039	A	75.1	Confident	78.2	Confident	48 Å²	48	43.2 Å²	43.2	40%	0.397	24%	0.241	S	C	.	.			trans	-74.3	136.1	167.8	0	0	0	0	0	110.8	I39 Y1036	I39-A1039 HydrophobicContact CG2-CB 3.74Å; Y1036-A1039 VanDerWaalsContact CB-O 3.29Å; Y1036-A1039 WeakPolarHBondContact CB-O 3.33Å; Y1036-A1039 HydrophobicContact CD1-CB 4.38Å; Y1036-A1039 WeakPolarHBondContact CD1-O 3.46Å; Y1036-A1039 VanDerWaalsContact O-CB 3.28Å; Y1036-A1039 WeakPolarHBondContact O-CB 3.34Å; Y1036-A1039 PolarHBondContact O-N 3.03Å
1040	V	80	Confident	78.6	Confident	19.2 Å²	19.2	44.4 Å²	44.4	12%	0.116	25%	0.247	C	C	.	.			trans	-102.7	118.1	180	-176.1	0	0	0	0	109.2	P1026 R1027 L1030 W1042 L1045	P1026-V1040 HydrophobicContact CB-CG1 4.43Å; P1026-V1040 HydrophobicContact CB-CG2 4.27Å; P1026-V1040 HydrophobicContact CG-CG1 3.99Å; P1026-V1040 HydrophobicContact CG-CG2 3.98Å; R1027-V1040 HydrophobicContact CB-CG2 4.4Å; R1027-V1040 HydrophobicContact CG-CG2 3.38Å; R1027-V1040 VanDerWaalsContact CG-CG2 3.44Å; L1030-V1040 HydrophobicContact CD1-CB 4.48Å; L1030-V1040 HydrophobicContact CD1-CG1 4.36Å; L1030-V1040 HydrophobicContact CD1-CG2 4.27Å; V1040-W1042 VanDerWaalsContact C-N 3.28Å; V1040-W1042 HydrophobicContact CB-CD2 4.3Å; V1040-W1042 HydrophobicContact CB-CZ2 4.1Å; V1040-W1042 HydrophobicContact CG1-CD2 3.69Å; V1040-W1042 VanDerWaalsContact CG1-CE2 3.46Å; V1040-W1042 HydrophobicContact CG1-CE3 3.96Å; V1040-W1042 HydrophobicContact CG1-CG 4.25Å; V1040-W1042 HydrophobicContact CG1-CH2 4.14Å; V1040-W1042 HydrophobicContact CG1-CZ2 3.81Å; V1040-W1042 HydrophobicContact CG1-CZ3 4.17Å; V1040-W1042 HydrophobicContact CG2-CZ2 4.3Å; V1040-W1042 VanDerWaalsContact O-CD1 3.28Å; V1040-W1042 PolarHBondContact O-N 2.91Å; V1040-L1045 HydrophobicContact CG1-CD2 3.58Å; V1040-L1045 VanDerWaalsContact CG1-CD2 3.48Å
1041	P	77.1	Confident	79	Confident	20.8 Å²	20.8	44.4 Å²	44.4	14%	0.135	25%	0.247	C	C	.	.			trans	-78.3	76.1	177.2	32.1	-33.6	0	0	0	110.7	Y1036 G1043 D1044 L1045 I1186	Y1036-P1041 HydrophobicContact CD1-CG 4.26Å; Y1036-P1041 HydrophobicContact CE1-CB 4.09Å; Y1036-P1041 HydrophobicContact CE1-CG 3.75Å; Y1036-P1041 HydrophobicContact CE2-CG 4.45Å; P1041-G1043 PolarHBondContact O-N 2.93Å; P1041-D1044 HydrophobicContact CB-CB 4.39Å; P1041-D1044 CarbonylContact O-C 3.41Å; P1041-D1044 PolarHBondContact O-N 3.06Å; P1041-D1044 VanDerWaalsContact O-N 3.11Å; P1041-L1045 HydrophobicContact CG-CB 4.37Å; P1041-L1045 WeakPolarHBondContact O-CB 3.27Å; P1041-L1045 PolarHBondContact O-N 3.12Å; P1041-I1186 HydrophobicContact CG-CG2 3.9Å
1042	W	75.7	Confident	79.1	Confident	79.8 Å²	79.8	42.1 Å²	42.1	30%	0.302	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	125	179.6	-61.3	106.4	0	0	0	111.9	P1026 V1040 L1072 N1073 K1074 P1075 I1091	P1026-W1042 HydrophobicContact CG-CH2 4.44Å; V1040-W1042 VanDerWaalsContact C-N 3.28Å; V1040-W1042 HydrophobicContact CB-CD2 4.3Å; V1040-W1042 HydrophobicContact CB-CZ2 4.1Å; V1040-W1042 HydrophobicContact CG1-CD2 3.69Å; V1040-W1042 VanDerWaalsContact CG1-CE2 3.46Å; V1040-W1042 HydrophobicContact CG1-CE3 3.96Å; V1040-W1042 HydrophobicContact CG1-CG 4.25Å; V1040-W1042 HydrophobicContact CG1-CH2 4.14Å; V1040-W1042 HydrophobicContact CG1-CZ2 3.81Å; V1040-W1042 HydrophobicContact CG1-CZ3 4.17Å; V1040-W1042 HydrophobicContact CG2-CZ2 4.3Å; V1040-W1042 VanDerWaalsContact O-CD1 3.28Å; V1040-W1042 PolarHBondContact O-N 2.91Å; W1042-L1072 HydrophobicContact CZ3-CB 4.43Å; W1042-N1073 VanDerWaalsContact CZ3-C 3.45Å; W1042-N1073 VanDerWaalsContact CZ3-O 3.28Å; W1042-N1073 WeakPolarHBondContact CZ3-O 3.38Å; W1042-K1074 HydrophobicContact CB-CB 4.43Å; W1042-K1074 HydrophobicContact CD2-CB 3.6Å; W1042-K1074 HydrophobicContact CD2-CD 4.35Å; W1042-K1074 HydrophobicContact CD2-CG 3.92Å; W1042-K1074 VanDerWaalsContact CE3-CA 3.48Å; W1042-K1074 HydrophobicContact CE3-CB 3.76Å; W1042-K1074 HydrophobicContact CE3-CG 4.37Å; W1042-K1074 HydrophobicContact CG-CB 3.96Å; W1042-K1074 HydrophobicContact CG-CD 4.12Å; W1042-K1074 HydrophobicContact CG-CG 4.21Å; W1042-K1074 HydrophobicContact CH2-CB 4.38Å; W1042-K1074 HydrophobicContact CH2-CG 4.43Å; W1042-K1074 HydrophobicContact CZ2-CB 4.32Å; W1042-K1074 HydrophobicContact CZ2-CG 4.03Å; W1042-K1074 VanDerWaalsContact CZ3-CA 3.45Å; W1042-K1074 HydrophobicContact CZ3-CB 4.15Å; W1042-P1075 VanDerWaalsContact CH2-CD 3.48Å; W1042-I1091 HydrophobicContact CH2-CD1 3.38Å; W1042-I1091 HydrophobicContact CH2-CG1 3.88Å; W1042-I1091 HydrophobicContact CZ2-CD1 4.45Å; W1042-I1091 HydrophobicContact CZ3-CD1 3.56Å; W1042-I1091 VanDerWaalsContact CZ3-CD1 3.49Å; W1042-I1091 HydrophobicContact CZ3-CG1 4.32Å
1043	G	71	Confident	79.7	Confident	45.4 Å²	45.4	36.3 Å²	36.3	47%	0.468	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.5	-26.2	-174.8	0	0	0	0	0	114.1	R878 P1041 L1045	R878-G1043 PolarHBondContact NH1-O 3.4Å; P1041-G1043 PolarHBondContact O-N 2.93Å; G1043-L1045 VanDerWaalsContact C-N 3.34Å
1044	D	76.8	Confident	80	Confident	56.8 Å²	56.8	35.4 Å²	35.4	30%	0.304	21%	0.207	S	C	.	.	S	Bend	trans	-111.3	23.3	177	-72	-14.1	0	0	0	111.7	P1041 I1186 Y1187 S1188	P1041-D1044 HydrophobicContact CB-CB 4.39Å; P1041-D1044 CarbonylContact O-C 3.41Å; P1041-D1044 PolarHBondContact O-N 3.06Å; P1041-D1044 VanDerWaalsContact O-N 3.11Å; D1044-I1186 WeakPolarHBondContact O-CA 3.5Å; D1044-Y1187 WeakPolarHBondContact O-CD2 3.24Å; D1044-Y1187 PolarHBondContact O-N 3Å; D1044-Y1187 VanDerWaalsContact O-N 3.1Å; D1044-S1188 VanDerWaalsContact OD2-CB 3.25Å; D1044-S1188 WeakPolarHBondContact OD2-CB 3.44Å; D1044-S1188 PolarHBondContact OD2-OG 3.05Å
1045	L	80.5	Confident	80	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	114	-175.2	-174.1	69.9	0	0	0	111.5	P1026 L1030 V1040 P1041 G1043 L1072 L1184 I1186	P1026-L1045 HydrophobicContact CB-CD2 4.08Å; P1026-L1045 HydrophobicContact CG-CD2 4.42Å; L1030-L1045 HydrophobicContact CD1-CD2 4.37Å; V1040-L1045 HydrophobicContact CG1-CD2 3.58Å; V1040-L1045 VanDerWaalsContact CG1-CD2 3.48Å; P1041-L1045 HydrophobicContact CG-CB 4.37Å; P1041-L1045 WeakPolarHBondContact O-CB 3.27Å; P1041-L1045 PolarHBondContact O-N 3.12Å; G1043-L1045 VanDerWaalsContact C-N 3.34Å; L1045-L1072 HydrophobicContact CD2-CB 4.38Å; L1045-L1072 HydrophobicContact CD2-CD1 3.93Å; L1045-L1072 HydrophobicContact CG-CB 4.5Å; L1045-L1072 HydrophobicContact CG-CD1 4.17Å; L1045-L1072 PolarHBondContact O-N 3.06Å; L1045-L1072 VanDerWaalsContact O-N 3.1Å; L1045-L1184 HydrophobicContact CD1-CB 4.02Å; L1045-L1184 HydrophobicContact CD1-CD1 4.39Å; L1045-L1184 HydrophobicContact CD1-CD2 4.14Å; L1045-L1184 HydrophobicContact CD1-CG 4.41Å; L1045-L1184 HydrophobicContact CD2-CD2 4.35Å; L1045-L1184 HydrophobicContact CG-CD2 4.35Å; L1045-I1186 HydrophobicContact CD1-CB 4.46Å; L1045-I1186 HydrophobicContact CD1-CD1 4.41Å; L1045-I1186 HydrophobicContact CD1-CG1 3.67Å
1046	D	87.2	Confident	79.8	Confident	17 Å²	17	34 Å²	34	9%	0.091	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	161.1	169.1	-70.8	-6.2	0	0	0	110.5	R878 T1069 Q1070 M1071 L1184 R1185 Y1187	R878-D1046 IonicContact CZ-OD1 3.27Å; R878-D1046 IonicContact NH2-OD1 3.07Å; R878-D1046 PolarHBondContact NH2-OD1 2.69Å; R878-D1046 IonicContact NH2-OD2 3.97Å; R878-D1046 PolarHBondContact NH2-OD2 2.87Å; D1046-T1069 WeakPolarHBondContact OD2-CB 3.35Å; D1046-T1069 PolarHBondContact OD2-OG1 3.37Å; D1046-Q1070 CarbonylContact C-O 3.4Å; D1046-Q1070 VanDerWaalsContact CA-O 3.24Å; D1046-Q1070 WeakPolarHBondContact CA-O 3.28Å; D1046-Q1070 WeakPolarHBondContact CB-O 3.45Å; D1046-M1071 VanDerWaalsContact OD1-CA 3.26Å; D1046-M1071 WeakPolarHBondContact OD1-CA 3.39Å; D1046-M1071 WeakPolarHBondContact OD1-CB 3.46Å; D1046-M1071 PolarHBondContact OD1-N 3.22Å; D1046-L1184 CarbonylContact O-C 3.55Å; D1046-L1184 VanDerWaalsContact O-CA 3.29Å; D1046-L1184 WeakPolarHBondContact O-CA 3.32Å; D1046-R1185 HydrophobicContact CB-CB 4.37Å; D1046-R1185 PolarHBondContact N-O 3.05Å; D1046-R1185 PolarHBondContact O-N 3.15Å; D1046-Y1187 HydrophobicContact CB-CE2 4.35Å; D1046-Y1187 VanDerWaalsContact OD2-CE2 3.25Å; D1046-Y1187 WeakPolarHBondContact OD2-CE2 3.27Å; D1046-Y1187 PolarHBondContact OD2-OH 2.95Å
1047	C	89.2	Confident	79.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	154.2	165.1	70	0	0	0	0	111.7	T1069 Q1070 L1072 C1093 L1182 W1183 L1184	C1047-T1069 CarbonylContact O-C 3.5Å; C1047-T1069 WeakPolarHBondContact O-CA 3.25Å; C1047-Q1070 PolarHBondContact N-O 2.93Å; C1047-Q1070 PolarHBondContact O-N 3.13Å; C1047-Q1070 PolarHBondContact SG-O 2.84Å; C1047-L1072 HydrophobicContact CB-CD1 4.04Å; C1047-L1072 HydrophobicContact CB-CD2 4.26Å; C1047-L1072 HydrophobicContact CB-CG 4.08Å; C1047-C1093 VanDerWaalsContact SG-SG 3.63Å; C1047-L1182 HydrophobicContact CB-CD1 4.19Å; C1047-W1183 CarbonylContact C-O 3.46Å; C1047-W1183 VanDerWaalsContact CA-O 3.23Å; C1047-W1183 WeakPolarHBondContact CA-O 3.34Å; C1047-L1184 HydrophobicContact CB-CD2 3.98Å
1048	Y	90.5	Very high	78.6	Confident	8.2 Å²	8.2	36.7 Å²	36.7	3%	0.032	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	154.3	167.7	64.4	-90.4	0	0	0	110.3	Q1050 R1066 T1067 T1069 W1183 R1185 D1193	Y1048-Q1050 HydrophobicContact CD2-CB 4.46Å; Y1048-Q1050 HydrophobicContact CE2-CB 4.3Å; Y1048-R1066 HydrophobicContact CD2-CB 4.24Å; Y1048-T1067 WeakPolarHBondContact CA-OG1 3.39Å; Y1048-T1067 WeakPolarHBondContact CB-OG1 3.41Å; Y1048-T1069 HydrophobicContact CD1-CG2 3.99Å; Y1048-T1069 HydrophobicContact CG-CG2 4.4Å; Y1048-W1183 HydrophobicContact CD1-CB 4.02Å; Y1048-W1183 HydrophobicContact CD2-CB 3.98Å; Y1048-W1183 HydrophobicContact CD2-CG 4.45Å; Y1048-W1183 HydrophobicContact CE1-CB 3.63Å; Y1048-W1183 HydrophobicContact CE1-CG 4.46Å; Y1048-W1183 HydrophobicContact CE2-CB 3.57Å; Y1048-W1183 AromaticContact CE2-CD1 3.93Å; Y1048-W1183 AromaticContact CE2-CG 3.78Å; Y1048-W1183 HydrophobicContact CE2-CG 3.78Å; Y1048-W1183 HydrophobicContact CG-CB 4.21Å; Y1048-W1183 VanDerWaalsContact CZ-CB 3.47Å; Y1048-W1183 AromaticContact CZ-CG 3.8Å; Y1048-W1183 PolarHBondContact N-O 2.98Å; Y1048-W1183 PolarHBondContact O-N 3.05Å; Y1048-R1185 HydrophobicContact CD1-CB 4.45Å; Y1048-R1185 HydrophobicContact CE1-CB 4.31Å; Y1048-D1193 PolarHBondContact OH-OD2 3.16Å
1049	V	91	Very high	77.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	136	175.7	176.8	0	0	0	0	109	F1018 R1066 T1067 F1095 I1180 E1181 L1182 L1255	F1018-V1049 HydrophobicContact CD1-CG1 4.22Å; F1018-V1049 HydrophobicContact CD2-CB 4.37Å; F1018-V1049 HydrophobicContact CD2-CG1 4.21Å; F1018-V1049 HydrophobicContact CE1-CG1 3.82Å; F1018-V1049 HydrophobicContact CE2-CB 4.32Å; F1018-V1049 HydrophobicContact CE2-CG1 3.81Å; F1018-V1049 HydrophobicContact CG-CG1 4.41Å; F1018-V1049 HydrophobicContact CZ-CG1 3.61Å; V1049-R1066 CarbonylContact O-C 3.54Å; V1049-R1066 VanDerWaalsContact O-CA 3.27Å; V1049-R1066 WeakPolarHBondContact O-CA 3.35Å; V1049-R1066 WeakPolarHBondContact O-CB 3.47Å; V1049-T1067 HydrophobicContact CB-CG2 3.87Å; V1049-T1067 PolarHBondContact N-OG1 2.99Å; V1049-T1067 PolarHBondContact O-N 3.02Å; V1049-F1095 HydrophobicContact CB-CE1 4.38Å; V1049-F1095 HydrophobicContact CG2-CE1 3.8Å; V1049-F1095 HydrophobicContact CG2-CE2 4.23Å; V1049-F1095 HydrophobicContact CG2-CZ 3.51Å; V1049-F1095 VanDerWaalsContact CG2-CZ 3.47Å; V1049-I1180 HydrophobicContact CG1-CG2 3.4Å; V1049-I1180 VanDerWaalsContact CG1-CG2 3.43Å; V1049-E1181 CarbonylContact C-O 3.55Å; V1049-E1181 WeakPolarHBondContact CA-O 3.32Å; V1049-L1182 HydrophobicContact CG2-CD1 3.87Å; V1049-L1255 HydrophobicContact CG1-CD2 4.13Å; V1049-L1255 HydrophobicContact CG2-CD1 4.38Å; V1049-L1255 HydrophobicContact CG2-CD2 4.03Å
1050	Q	89.8	Confident	76.8	Confident	25 Å²	25	44.4 Å²	44.4	12%	0.117	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	143.1	177.8	-177.5	173.4	-64	0	0	110.1	Y1048 S1064 T1065 R1066 E1181	Y1048-Q1050 HydrophobicContact CD2-CB 4.46Å; Y1048-Q1050 HydrophobicContact CE2-CB 4.3Å; Q1050-S1064 VanDerWaalsContact CG-OG 3.25Å; Q1050-S1064 WeakPolarHBondContact CG-OG 3.37Å; Q1050-S1064 PolarHBondContact NE2-OG 3.06Å; Q1050-S1064 PolarHBondContact OE1-OG 3.08Å; Q1050-T1065 WeakPolarHBondContact CA-O 3.23Å; Q1050-R1066 HydrophobicContact CB-CB 4.27Å; Q1050-R1066 HydrophobicContact CG-CB 4.38Å; Q1050-E1181 HydrophobicContact CB-CB 4.47Å; Q1050-E1181 PolarHBondContact N-O 3.12Å; Q1050-E1181 PolarHBondContact NE2-OE2 2.89Å; Q1050-E1181 PolarHBondContact O-N 3.12Å
1051	Y	89.3	Confident	75.8	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	161.1	172.1	67	-83.1	0	0	0	110.3	I1016 F1018 F1053 T1065 W1123 H1127 L1178 L1179 I1180	I1016-Y1051 HydrophobicContact CD1-CD2 4.35Å; I1016-Y1051 HydrophobicContact CD1-CE2 3.64Å; F1018-Y1051 AromaticContact CE2-CD1 3.75Å; F1018-Y1051 HydrophobicContact CE2-CD1 3.75Å; F1018-Y1051 AromaticContact CE2-CE1 3.64Å; F1018-Y1051 HydrophobicContact CE2-CE1 3.64Å; F1018-Y1051 AromaticContact CZ-CD1 3.72Å; F1018-Y1051 HydrophobicContact CZ-CD1 3.72Å; F1018-Y1051 AromaticContact CZ-CE1 3.93Å; F1018-Y1051 HydrophobicContact CZ-CE1 3.95Å; Y1051-F1053 HydrophobicContact CD2-CB 4.16Å; Y1051-F1053 HydrophobicContact CD2-CD2 4.35Å; Y1051-F1053 HydrophobicContact CE2-CB 3.91Å; Y1051-F1053 HydrophobicContact CE2-CD2 4.12Å; Y1051-F1053 HydrophobicContact CE2-CG 4.27Å; Y1051-T1065 WeakPolarHBondContact CD1-O 3.47Å; Y1051-T1065 HydrophobicContact CE1-CG2 3.93Å; Y1051-T1065 HydrophobicContact CE2-CG2 4.49Å; Y1051-T1065 PolarHBondContact N-O 3.16Å; Y1051-T1065 PolarHBondContact O-N 3.16Å; Y1051-T1065 VanDerWaalsContact O-O 3.12Å; Y1051-W1123 AromaticContact CE1-CH2 3.98Å; Y1051-W1123 HydrophobicContact CE1-CH2 4.02Å; Y1051-W1123 HydrophobicContact CE1-CZ3 4.16Å; Y1051-H1127 AromaticContact CE2-NE2 3.38Å; Y1051-H1127 VanDerWaalsContact CE2-NE2 3.32Å; Y1051-H1127 WeakPolarHBondContact CE2-NE2 3.39Å; Y1051-H1127 AromaticContact CZ-NE2 3.53Å; Y1051-H1127 PolarHBondContact OH-NE2 3.02Å; Y1051-L1178 HydrophobicContact CD2-CD1 4.25Å; Y1051-L1178 HydrophobicContact CD2-CD2 4.11Å; Y1051-L1179 WeakPolarHBondContact CB-O 3.18Å; Y1051-I1180 HydrophobicContact CG-CD1 4.15Å
1052	F	83.2	Confident	75.4	Confident	69.8 Å²	69.8	47.8 Å²	47.8	31%	0.306	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128.5	-177.9	-63.2	-91.1	0	0	0	110	L1062 A1063 L1178	F1052-L1062 HydrophobicContact CB-CB 3.91Å; F1052-L1062 HydrophobicContact CB-CD1 3.87Å; F1052-L1062 HydrophobicContact CB-CG 4.46Å; F1052-A1063 CarbonylContact C-O 3.45Å; F1052-A1063 WeakPolarHBondContact CA-O 3.33Å; F1052-L1178 VanDerWaalsContact O-CD1 3.25Å; F1052-L1178 WeakPolarHBondContact O-CD1 3.19Å
1053	F	84.3	Confident	75.1	Confident	4.4 Å²	4.4	45.4 Å²	45.4	2%	0.019	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	146.7	-174.8	-151.6	-95.2	0	0	0	112	I1014 I1016 Y1051 L1062 A1063 H1127 L1129 I1158 L1178	I1014-F1053 HydrophobicContact CB-CZ 4.26Å; I1014-F1053 HydrophobicContact CD1-CE1 4.48Å; I1014-F1053 HydrophobicContact CD1-CZ 3.84Å; I1014-F1053 HydrophobicContact CG2-CZ 4.28Å; I1016-F1053 HydrophobicContact CD1-CD2 4.26Å; I1016-F1053 HydrophobicContact CD1-CE2 4.13Å; I1016-F1053 HydrophobicContact CD1-CZ 4.46Å; Y1051-F1053 HydrophobicContact CD2-CB 4.16Å; Y1051-F1053 HydrophobicContact CD2-CD2 4.35Å; Y1051-F1053 HydrophobicContact CE2-CB 3.91Å; Y1051-F1053 HydrophobicContact CE2-CD2 4.12Å; Y1051-F1053 HydrophobicContact CE2-CG 4.27Å; F1053-L1062 CarbonylContact O-C 3.36Å; F1053-L1062 WeakPolarHBondContact O-CA 3.43Å; F1053-A1063 PolarHBondContact N-O 3.09Å; F1053-A1063 PolarHBondContact O-N 3.15Å; F1053-H1127 HydrophobicContact CD1-CB 3.63Å; F1053-H1127 AromaticContact CD1-CD2 3.49Å; F1053-H1127 VanDerWaalsContact CD1-CD2 3.45Å; F1053-H1127 WeakPolarHBondContact CD1-CD2 3.18Å; F1053-H1127 AromaticContact CD1-CE1 3.73Å; F1053-H1127 AromaticContact CD1-CG 3.16Å; F1053-H1127 AromaticContact CD1-ND1 3.34Å; F1053-H1127 VanDerWaalsContact CD1-ND1 3.31Å; F1053-H1127 WeakPolarHBondContact CD1-ND1 3.34Å; F1053-H1127 AromaticContact CD1-NE2 3.81Å; F1053-H1127 HydrophobicContact CE1-CB 3.36Å; F1053-H1127 VanDerWaalsContact CE1-CB 3.49Å; F1053-H1127 AromaticContact CE1-CD2 3.71Å; F1053-H1127 AromaticContact CE1-CG 3.39Å; F1053-H1127 VanDerWaalsContact CE1-CG 3.45Å; F1053-H1127 AromaticContact CE1-ND1 3.99Å; F1053-H1127 AromaticContact CG-CD2 3.74Å; F1053-H1127 AromaticContact CG-CE1 3.81Å; F1053-H1127 AromaticContact CG-CG 3.86Å; F1053-H1127 AromaticContact CG-ND1 3.89Å; F1053-H1127 AromaticContact CG-NE2 3.7Å; F1053-H1127 HydrophobicContact CZ-CB 4.22Å; F1053-L1129 HydrophobicContact CE1-CD1 3.94Å; F1053-L1129 HydrophobicContact CZ-CD1 4.36Å; F1053-I1158 HydrophobicContact CE1-CD1 4.29Å; F1053-I1158 HydrophobicContact CE2-CD1 4.28Å; F1053-I1158 HydrophobicContact CZ-CD1 3.79Å; F1053-L1178 HydrophobicContact CD2-CD1 4.36Å; F1053-L1178 HydrophobicContact CD2-CD2 4.28Å; F1053-L1178 HydrophobicContact CE2-CD2 4.25Å
1054	P	77.5	Confident	75.4	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.013	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	138.5	176.6	-19.3	30.7	0	0	0	112	L1062 L1129 W1157 M1161	P1054-L1062 HydrophobicContact CB-CD2 4.15Å; P1054-L1062 HydrophobicContact CG-CD2 3.6Å; P1054-L1129 HydrophobicContact CB-CD1 4.49Å; P1054-L1129 HydrophobicContact CB-CD2 4.31Å; P1054-W1157 HydrophobicContact CB-CH2 3.97Å; P1054-W1157 HydrophobicContact CB-CZ2 4.3Å; P1054-W1157 HydrophobicContact CB-CZ3 4.43Å; P1054-W1157 HydrophobicContact CG-CH2 4.18Å; P1054-W1157 HydrophobicContact CG-CZ3 4.4Å; P1054-M1161 HydrophobicContact CB-CG 4.22Å; P1054-M1161 HydrophobicContact CG-CB 4.05Å; P1054-M1161 HydrophobicContact CG-CG 4.06Å
1055	T	69.1	Low	75.5	Confident	82.8 Å²	82.8	43.9 Å²	43.9	51%	0.508	23%	0.234	S	C	.	.	S	Bend	trans	-95.7	-26.9	176.2	49.2	0	0	0	0	113.9	A1063	T1055-A1063 HydrophobicContact CG2-CB 3.34Å; T1055-A1063 VanDerWaalsContact CG2-CB 3.43Å
1056	D	67.1	Low	75.6	Confident	68.6 Å²	68.6	47.8 Å²	47.8	37%	0.367	25%	0.249	S	C	.	.	S	Bend	trans	-148.8	155.4	174.9	-175	23	0	0	0	110	K1058 A1059	D1056-K1058 PolarHBondContact O-N 2.9Å; D1056-K1058 PolarHBondContact OD1-N 3.07Å; D1056-K1058 WeakPolarHBondContact OD2-CB 3.35Å; D1056-K1058 WeakPolarHBondContact OD2-CD 3.4Å; D1056-K1058 WeakPolarHBondContact OD2-CG 3.45Å; D1056-A1059 HydrophobicContact CB-CB 4.37Å; D1056-A1059 WeakPolarHBondContact O-CB 3.35Å; D1056-A1059 PolarHBondContact O-N 3.07Å; D1056-A1059 VanDerWaalsContact O-N 3.15Å
1057	T	63.8	Low	75.4	Confident	33.8 Å²	33.8	47.2 Å²	47.2	21%	0.207	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-18.9	-178.7	59.7	0	0	0	0	113.9	A1059 L1129 C1130 T1131 W1157	T1057-A1059 PolarHBondContact O-N 3.02Å; T1057-A1059 VanDerWaalsContact O-N 3.09Å; T1057-L1129 HydrophobicContact CG2-CB 4.11Å; T1057-C1130 WeakPolarHBondContact CB-O 3.33Å; T1057-C1130 VanDerWaalsContact CG2-C 3.47Å; T1057-C1130 WeakPolarHBondContact CG2-O 3.41Å; T1057-C1130 PolarHBondContact OG1-O 3.13Å; T1057-T1131 HydrophobicContact CG2-CG2 3.75Å; T1057-W1157 HydrophobicContact CG2-CH2 4.07Å; T1057-W1157 HydrophobicContact CG2-CZ2 4.07Å; T1057-W1157 PolarHBondContact O-NE1 3.17Å
1058	K	59.9	Low	74.7	Confident	172.8 Å²	172.8	48.6 Å²	48.6	75%	0.751	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-11.1	175.4	-62	177.2	-175.6	169.3	0	113.7	D1056 K1060	D1056-K1058 PolarHBondContact O-N 2.9Å; D1056-K1058 PolarHBondContact OD1-N 3.07Å; D1056-K1058 WeakPolarHBondContact OD2-CB 3.35Å; D1056-K1058 WeakPolarHBondContact OD2-CD 3.4Å; D1056-K1058 WeakPolarHBondContact OD2-CG 3.45Å; K1058-K1060 VanDerWaalsContact C-N 3.28Å; K1058-K1060 PolarHBondContact O-N 3.1Å; K1058-K1060 VanDerWaalsContact O-N 3.15Å
1059	A	53	Low	74.2	Confident	26.6 Å²	26.6	50.1 Å²	50.1	22%	0.22	27%	0.265	C	S	.	.			trans	-56.4	117.8	179.1	0	0	0	0	0	111.3	D1056 T1057 C1061 M1161	D1056-A1059 HydrophobicContact CB-CB 4.37Å; D1056-A1059 WeakPolarHBondContact O-CB 3.35Å; D1056-A1059 PolarHBondContact O-N 3.07Å; D1056-A1059 VanDerWaalsContact O-N 3.15Å; T1057-A1059 PolarHBondContact O-N 3.02Å; T1057-A1059 VanDerWaalsContact O-N 3.09Å; A1059-C1061 VanDerWaalsContact C-N 3.3Å; A1059-C1061 PolarHBondContact O-N 3.44Å; A1059-M1161 VanDerWaalsContact CA-SD 3.53Å; A1059-M1161 HydrophobicContact CB-CE 3.68Å; A1059-M1161 HydrophobicContact CB-SD 3.31Å; A1059-M1161 WeakPolarHBondContact CB-SD 3.19Å; A1059-M1161 WeakPolarHBondContact O-CE 3.29Å
1060	K	57	Low	73.7	Confident	198.6 Å²	198.6	51.4 Å²	51.4	86%	0.863	27%	0.27	S	S	*	.	S	Bend	trans	-90.6	-1.2	176.4	-68.7	-173.4	179.5	179.4	0	113.6	K1058	K1058-K1060 VanDerWaalsContact C-N 3.28Å; K1058-K1060 PolarHBondContact O-N 3.1Å; K1058-K1060 VanDerWaalsContact O-N 3.15Å
1061	C	58	Low	73	Confident	78.2 Å²	78.2	54.1 Å²	54.1	53%	0.528	28%	0.284	S	S	.	.	S	Bend	trans	-136.7	151.6	-173.1	-154.2	0	0	0	0	110.2	A1059	A1059-C1061 VanDerWaalsContact C-N 3.3Å; A1059-C1061 PolarHBondContact O-N 3.44Å
1062	L	69.4	Low	72.4	Confident	34.6 Å²	34.6	54.2 Å²	54.2	18%	0.181	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	142.1	171.8	-54	-174.1	0	0	0	109.5	F1052 F1053 P1054 M1161 L1162 A1165	F1052-L1062 HydrophobicContact CB-CB 3.91Å; F1052-L1062 HydrophobicContact CB-CD1 3.87Å; F1052-L1062 HydrophobicContact CB-CG 4.46Å; F1053-L1062 CarbonylContact O-C 3.36Å; F1053-L1062 WeakPolarHBondContact O-CA 3.43Å; P1054-L1062 HydrophobicContact CB-CD2 4.15Å; P1054-L1062 HydrophobicContact CG-CD2 3.6Å; L1062-M1161 HydrophobicContact CD2-CG 3.87Å; L1062-L1162 HydrophobicContact CD1-CD2 4.31Å; L1062-A1165 HydrophobicContact CD1-CB 3.35Å; L1062-A1165 HydrophobicContact CG-CB 3.91Å
1063	A	69.6	Low	71.8	Confident	29 Å²	29	55.4 Å²	55.4	24%	0.24	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	141.8	168.9	0	0	0	0	0	110.8	F1052 F1053 T1055 T1065	F1052-A1063 CarbonylContact C-O 3.45Å; F1052-A1063 WeakPolarHBondContact CA-O 3.33Å; F1053-A1063 PolarHBondContact N-O 3.09Å; F1053-A1063 PolarHBondContact O-N 3.15Å; T1055-A1063 HydrophobicContact CG2-CB 3.34Å; T1055-A1063 VanDerWaalsContact CG2-CB 3.43Å; A1063-T1065 PolarHBondContact O-N 3.33Å
1064	S	77.6	Confident	71.1	Confident	50 Å²	50	61.4 Å²	61.4	35%	0.35	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	124.3	170.3	176.3	0	0	0	0	110	Q1050	Q1050-S1064 VanDerWaalsContact CG-OG 3.25Å; Q1050-S1064 WeakPolarHBondContact CG-OG 3.37Å; Q1050-S1064 PolarHBondContact NE2-OG 3.06Å; Q1050-S1064 PolarHBondContact OE1-OG 3.08Å
1065	T	79.3	Confident	70.4	Confident	19.6 Å²	19.6	63.1 Å²	63.1	12%	0.12	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	132.4	170.2	-49.9	0	0	0	0	108.4	Q1050 Y1051 A1063 W1123 H1125	Q1050-T1065 WeakPolarHBondContact CA-O 3.23Å; Y1051-T1065 WeakPolarHBondContact CD1-O 3.47Å; Y1051-T1065 HydrophobicContact CE1-CG2 3.93Å; Y1051-T1065 HydrophobicContact CE2-CG2 4.49Å; Y1051-T1065 PolarHBondContact N-O 3.16Å; Y1051-T1065 PolarHBondContact O-N 3.16Å; Y1051-T1065 VanDerWaalsContact O-O 3.12Å; A1063-T1065 PolarHBondContact O-N 3.33Å; T1065-W1123 HydrophobicContact CG2-CH2 3.84Å; T1065-W1123 HydrophobicContact CG2-CZ2 4.24Å; T1065-H1125 HydrophobicContact CG2-CB 4.44Å
1066	R	83	Confident	69.6	Low	82.6 Å²	82.6	63.8 Å²	63.8	31%	0.312	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153	-178.6	68.6	174.5	-179.3	-165.4	-4.2	113.1	H872 Y874 S907 I938 D939 P940 Y1048 V1049 Q1050 W1123	H872-R1066 PolarHBondContact O-NH2 3.06Å; Y874-R1066 VanDerWaalsContact CE1-NH2 3.35Å; Y874-R1066 PolarHBondContact OH-NH1 2.96Å; S907-R1066 VanDerWaalsContact CB-NH2 3.28Å; I938-R1066 HydrophobicContact CG2-CG 4.22Å; I938-R1066 VanDerWaalsContact CG2-NH2 3.33Å; I938-R1066 PolarHBondContact O-NH2 2.94Å; D939-R1066 PolarHBondContact O-NH2 3.03Å; P940-R1066 PolarHBondContact O-NH2 3.17Å; Y1048-R1066 HydrophobicContact CD2-CB 4.24Å; V1049-R1066 CarbonylContact O-C 3.54Å; V1049-R1066 VanDerWaalsContact O-CA 3.27Å; V1049-R1066 WeakPolarHBondContact O-CA 3.35Å; V1049-R1066 WeakPolarHBondContact O-CB 3.47Å; Q1050-R1066 HydrophobicContact CB-CB 4.27Å; Q1050-R1066 HydrophobicContact CG-CB 4.38Å; R1066-W1123 VanDerWaalsContact O-CZ2 3.26Å; R1066-W1123 WeakPolarHBondContact O-CZ2 3.42Å
1067	T	81.4	Confident	68.5	Low	3.8 Å²	3.8	66.9 Å²	66.9	2%	0.023	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-72.3	167.6	171.4	67.2	0	0	0	0	111.9	F1018 Y1048 V1049 F1095 W1123	F1018-T1067 HydrophobicContact CB-CG2 4.38Å; F1018-T1067 HydrophobicContact CD2-CG2 3.52Å; F1018-T1067 VanDerWaalsContact CD2-CG2 3.42Å; F1018-T1067 HydrophobicContact CE2-CG2 4.12Å; F1018-T1067 HydrophobicContact CG-CG2 4.33Å; Y1048-T1067 WeakPolarHBondContact CA-OG1 3.39Å; Y1048-T1067 WeakPolarHBondContact CB-OG1 3.41Å; V1049-T1067 HydrophobicContact CB-CG2 3.87Å; V1049-T1067 PolarHBondContact N-OG1 2.99Å; V1049-T1067 PolarHBondContact O-N 3.02Å; T1067-F1095 HydrophobicContact CG2-CD1 4.22Å; T1067-F1095 HydrophobicContact CG2-CE1 4.46Å; T1067-W1123 HydrophobicContact CG2-CB 4.39Å; T1067-W1123 HydrophobicContact CG2-CD2 3.74Å; T1067-W1123 HydrophobicContact CG2-CE3 3.87Å; T1067-W1123 HydrophobicContact CG2-CG 4.03Å; T1067-W1123 HydrophobicContact CG2-CH2 4.41Å; T1067-W1123 HydrophobicContact CG2-CZ2 4.46Å; T1067-W1123 HydrophobicContact CG2-CZ3 4.21Å
1068	T	75.9	Confident	67.6	Low	30.2 Å²	30.2	70.8 Å²	70.8	19%	0.185	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-57.5	150.1	156.7	44.5	0	0	0	0	110.3	S942 Q1070 I1096 A1098	S942-T1068 WeakPolarHBondContact O-CG2 3.39Å; T1068-Q1070 PolarHBondContact OG1-NE2 3.12Å; T1068-Q1070 VanDerWaalsContact OG1-NE2 3.13Å; T1068-I1096 PolarHBondContact OG1-O 3.08Å; T1068-A1098 HydrophobicContact CG2-CB 3.96Å
1069	T	78.8	Confident	66.7	Low	40.2 Å²	40.2	68.7 Å²	68.7	25%	0.247	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-73.8	136.8	173	56.5	0	0	0	0	110.1	F941 D1046 C1047 Y1048 R1185	F941-T1069 PolarHBondContact O-N 2.62Å; F941-T1069 PolarHBondContact O-OG1 3.1Å; D1046-T1069 WeakPolarHBondContact OD2-CB 3.35Å; D1046-T1069 PolarHBondContact OD2-OG1 3.37Å; C1047-T1069 CarbonylContact O-C 3.5Å; C1047-T1069 WeakPolarHBondContact O-CA 3.25Å; Y1048-T1069 HydrophobicContact CD1-CG2 3.99Å; Y1048-T1069 HydrophobicContact CG-CG2 4.4Å; T1069-R1185 VanDerWaalsContact CG2-NH1 3.35Å
1070	Q	79.9	Confident	66.2	Low	25.8 Å²	25.8	73.1 Å²	73.1	12%	0.121	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.8	-179.5	-63.3	-59.7	-30.3	0	0	110.1	D1046 C1047 T1068 L1072 E1094 F1095 I1096	D1046-Q1070 CarbonylContact C-O 3.4Å; D1046-Q1070 VanDerWaalsContact CA-O 3.24Å; D1046-Q1070 WeakPolarHBondContact CA-O 3.28Å; D1046-Q1070 WeakPolarHBondContact CB-O 3.45Å; C1047-Q1070 PolarHBondContact N-O 2.93Å; C1047-Q1070 PolarHBondContact O-N 3.13Å; C1047-Q1070 PolarHBondContact SG-O 2.84Å; T1068-Q1070 PolarHBondContact OG1-NE2 3.12Å; T1068-Q1070 VanDerWaalsContact OG1-NE2 3.13Å; Q1070-L1072 PolarHBondContact O-N 3.17Å; Q1070-E1094 PolarHBondContact OE1-O 2.87Å; Q1070-F1095 HydrophobicContact CG-CD1 3.78Å; Q1070-F1095 HydrophobicContact CG-CE1 4.23Å; Q1070-F1095 HydrophobicContact CG-CG 4.45Å; Q1070-I1096 VanDerWaalsContact CD-N 3.34Å; Q1070-I1096 PolarHBondContact NE2-O 3.4Å
1071	M	76.7	Confident	65.4	Low	83.2 Å²	83.2	71.8 Å²	71.8	41%	0.41	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	127.1	-179.6	-171.9	178.9	70.7	0	0	111.2	D1046 N1073	D1046-M1071 VanDerWaalsContact OD1-CA 3.26Å; D1046-M1071 WeakPolarHBondContact OD1-CA 3.39Å; D1046-M1071 WeakPolarHBondContact OD1-CB 3.46Å; D1046-M1071 PolarHBondContact OD1-N 3.22Å; M1071-N1073 VanDerWaalsContact CE-OD1 3.32Å; M1071-N1073 WeakPolarHBondContact CE-OD1 3.4Å; M1071-N1073 PolarHBondContact O-N 2.88Å; M1071-N1073 PolarHBondContact O-ND2 2.96Å
1072	L	76.7	Confident	64.7	Low	1.2 Å²	1.2	74.2 Å²	74.2	1%	0.006	40%	0.403	C	S	.	.			trans	-83	109.2	176.5	-72.3	179.6	0	0	0	110.3	F1024 P1026 W1042 L1045 C1047 Q1070 I1091 C1093 L1184	F1024-L1072 HydrophobicContact CD1-CD1 4.41Å; F1024-L1072 HydrophobicContact CE1-CD1 4.01Å; P1026-L1072 HydrophobicContact CB-CD1 4.4Å; P1026-L1072 HydrophobicContact CG-CD1 4.46Å; W1042-L1072 HydrophobicContact CZ3-CB 4.43Å; L1045-L1072 HydrophobicContact CD2-CB 4.38Å; L1045-L1072 HydrophobicContact CD2-CD1 3.93Å; L1045-L1072 HydrophobicContact CG-CB 4.5Å; L1045-L1072 HydrophobicContact CG-CD1 4.17Å; L1045-L1072 PolarHBondContact O-N 3.06Å; L1045-L1072 VanDerWaalsContact O-N 3.1Å; C1047-L1072 HydrophobicContact CB-CD1 4.04Å; C1047-L1072 HydrophobicContact CB-CD2 4.26Å; C1047-L1072 HydrophobicContact CB-CG 4.08Å; Q1070-L1072 PolarHBondContact O-N 3.17Å; L1072-I1091 HydrophobicContact CB-CD1 4.29Å; L1072-I1091 HydrophobicContact CD1-CD1 4.31Å; L1072-I1091 HydrophobicContact CD2-CD1 4.21Å; L1072-I1091 HydrophobicContact CD2-CG2 4.12Å; L1072-I1091 HydrophobicContact CG-CD1 4.44Å; L1072-C1093 HydrophobicContact CD2-CB 4.28Å; L1072-L1184 HydrophobicContact CD1-CD2 3.49Å; L1072-L1184 VanDerWaalsContact CD1-CD2 3.47Å
1073	N	70.9	Confident	63.5	Low	94.4 Å²	94.4	80.1 Å²	80.1	51%	0.505	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-82.2	140	179.1	-75	-51.7	0	0	0	112.1	Q898 W1042 M1071	Q898-N1073 VanDerWaalsContact NE2-CG 3.35Å; Q898-N1073 PolarHBondContact NE2-ND2 2.96Å; Q898-N1073 PolarHBondContact NE2-OD1 2.93Å; Q898-N1073 PolarHBondContact OE1-ND2 2.95Å; Q898-N1073 PolarHBondContact OE1-OD1 3.37Å; W1042-N1073 VanDerWaalsContact CZ3-C 3.45Å; W1042-N1073 VanDerWaalsContact CZ3-O 3.28Å; W1042-N1073 WeakPolarHBondContact CZ3-O 3.38Å; M1071-N1073 VanDerWaalsContact CE-OD1 3.32Å; M1071-N1073 WeakPolarHBondContact CE-OD1 3.4Å; M1071-N1073 PolarHBondContact O-N 2.88Å; M1071-N1073 PolarHBondContact O-ND2 2.96Å
1074	K	68.9	Low	62.3	Low	131.4 Å²	131.4	83.3 Å²	83.3	57%	0.571	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-65.5	130.1	174.4	-171.1	175.7	179.9	179.2	0	110.1	W1042 S1076	W1042-K1074 HydrophobicContact CB-CB 4.43Å; W1042-K1074 HydrophobicContact CD2-CB 3.6Å; W1042-K1074 HydrophobicContact CD2-CD 4.35Å; W1042-K1074 HydrophobicContact CD2-CG 3.92Å; W1042-K1074 VanDerWaalsContact CE3-CA 3.48Å; W1042-K1074 HydrophobicContact CE3-CB 3.76Å; W1042-K1074 HydrophobicContact CE3-CG 4.37Å; W1042-K1074 HydrophobicContact CG-CB 3.96Å; W1042-K1074 HydrophobicContact CG-CD 4.12Å; W1042-K1074 HydrophobicContact CG-CG 4.21Å; W1042-K1074 HydrophobicContact CH2-CB 4.38Å; W1042-K1074 HydrophobicContact CH2-CG 4.43Å; W1042-K1074 HydrophobicContact CZ2-CB 4.32Å; W1042-K1074 HydrophobicContact CZ2-CG 4.03Å; W1042-K1074 VanDerWaalsContact CZ3-CA 3.45Å; W1042-K1074 HydrophobicContact CZ3-CB 4.15Å; K1074-S1076 PolarHBondContact O-N 3.03Å
1075	P	63.2	Low	60.6	Low	37 Å²	37	88.6 Å²	88.6	24%	0.24	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-58.3	132.4	174	3.1	-5.2	0	0	0	110.6	W1042 M1077 A1088 I1091	W1042-P1075 VanDerWaalsContact CH2-CD 3.48Å; P1075-M1077 PolarHBondContact O-N 3.1Å; P1075-A1088 WeakPolarHBondContact CG-O 3.34Å; P1075-I1091 HydrophobicContact CG-CG1 4.36Å
1076	S	52.4	Low	59	Low	99.2 Å²	99.2	95.4 Å²	95.4	69%	0.694	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-65.4	125.7	178.3	48	0	0	0	0	110.2	K1074 I1078	K1074-S1076 PolarHBondContact O-N 3.03Å; S1076-I1078 PolarHBondContact O-N 3.11Å
1077	M	43.8	Very low	57.1	Low	132.4 Å²	132.4	96.9 Å²	96.9	65%	0.652	51%	0.506	S	S	*	.			trans	-69.3	98.3	177.3	-66	-87.7	82.3	0	0	109.6	P1075 T1079 A1088	P1075-M1077 PolarHBondContact O-N 3.1Å; M1077-T1079 PolarHBondContact O-N 3.26Å; M1077-T1079 VanDerWaalsContact O-N 3.15Å; M1077-A1088 HydrophobicContact CE-CB 4.11Å
1078	I	45	Very low	55.7	Low	117 Å²	117	98.7 Å²	98.7	60%	0.6	52%	0.521	S	S	*	.			trans	-78.2	112.3	169.7	-60.5	173.8	0	0	0	107.4	S1076 N1080	S1076-I1078 PolarHBondContact O-N 3.11Å; I1078-N1080 VanDerWaalsContact C-N 3.27Å; I1078-N1080 HydrophobicContact CG2-CB 4.4Å; I1078-N1080 PolarHBondContact O-N 3.12Å
1079	T	40.7	Very low	54.9	Low	127 Å²	127	102 Å²	102	78%	0.779	53%	0.532	S	S	*	.			trans	-73.5	61.2	-178.4	39.2	0	0	0	0	112.5	M1077 H1081	M1077-T1079 PolarHBondContact O-N 3.26Å; M1077-T1079 VanDerWaalsContact O-N 3.15Å; T1079-H1081 PolarHBondContact O-N 3.1Å
1080	N	41.7	Very low	54.2	Low	120.4 Å²	120.4	103.7 Å²	103.7	64%	0.644	54%	0.538	S	S	*	.			trans	-120.4	100.4	167.7	-80.8	-22.5	0	0	0	109.4	I1078 T1082	I1078-N1080 VanDerWaalsContact C-N 3.27Å; I1078-N1080 HydrophobicContact CG2-CB 4.4Å; I1078-N1080 PolarHBondContact O-N 3.12Å; N1080-T1082 PolarHBondContact O-N 3.16Å
1081	H	39.9	Very low	53.8	Low	170 Å²	170	102.9 Å²	102.9	79%	0.787	53%	0.534	S	S	*	.			trans	-63.6	119.1	174	-76.1	-78.7	0	0	0	110.9	T1079	T1079-H1081 PolarHBondContact O-N 3.1Å
1082	T	43.4	Very low	53.7	Low	129.6 Å²	129.6	102.8 Å²	102.8	80%	0.795	54%	0.541	S	S	*	.	S	Bend	trans	157.9	26.2	138.4	37	0	0	0	0	114	N1080 Q1084	N1080-T1082 PolarHBondContact O-N 3.16Å; T1082-Q1084 VanDerWaalsContact C-N 3.33Å; T1082-Q1084 PolarHBondContact O-N 2.94Å
1083	I	45.3	Very low	53.7	Low	157.4 Å²	157.4	103.5 Å²	103.5	81%	0.807	55%	0.546	S	S	*	.	S	Bend	trans	-161.9	-15.5	174.4	-57.4	177.6	0	0	0	114.8	E1085	I1083-E1085 VanDerWaalsContact C-N 3.29Å; I1083-E1085 PolarHBondContact O-N 2.84Å; I1083-E1085 VanDerWaalsContact O-N 3.08Å
1084	Q	43.4	Very low	54	Low	96.8 Å²	96.8	102.3 Å²	102.3	45%	0.452	54%	0.538	S	S	.	.			trans	-89.1	-2.4	-168.4	-120.9	149.8	-9.3	0	0	116.9	T1082 Q1086 I1087 A1088	T1082-Q1084 VanDerWaalsContact C-N 3.33Å; T1082-Q1084 PolarHBondContact O-N 2.94Å; Q1084-Q1086 VanDerWaalsContact C-N 3.29Å; Q1084-Q1086 PolarHBondContact O-N 3.17Å; Q1084-Q1086 VanDerWaalsContact O-N 3.13Å; Q1084-I1087 HydrophobicContact CG-CB 4.34Å; Q1084-I1087 HydrophobicContact CG-CD1 4.48Å; Q1084-I1087 PolarHBondContact O-N 2.95Å; Q1084-I1087 VanDerWaalsContact O-N 3.11Å; Q1084-A1088 VanDerWaalsContact O-CB 3.26Å; Q1084-A1088 WeakPolarHBondContact O-CB 3.29Å; Q1084-A1088 PolarHBondContact O-N 3.2Å; Q1084-A1088 VanDerWaalsContact O-N 3.09Å
1085	E	42.3	Very low	54.1	Low	161.8 Å²	161.8	96 Å²	96	76%	0.756	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-22.1	-176.2	-76.3	-172.7	165.2	0	0	114.7	I1083 K1089	I1083-E1085 VanDerWaalsContact C-N 3.29Å; I1083-E1085 PolarHBondContact O-N 2.84Å; I1083-E1085 VanDerWaalsContact O-N 3.08Å; E1085-K1089 VanDerWaalsContact O-CE 3.24Å; E1085-K1089 WeakPolarHBondContact O-CE 3.2Å; E1085-K1089 WeakPolarHBondContact O-CG 3.42Å
1086	Q	45.2	Very low	54	Low	161.6 Å²	161.6	96.9 Å²	96.9	76%	0.755	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-28	172.8	-74.4	-174.9	-9.9	0	0	113.3	Q1084 H1090	Q1084-Q1086 VanDerWaalsContact C-N 3.29Å; Q1084-Q1086 PolarHBondContact O-N 3.17Å; Q1084-Q1086 VanDerWaalsContact O-N 3.13Å; Q1086-H1090 PolarHBondContact O-CE1 3.16Å; Q1086-H1090 VanDerWaalsContact O-CE1 3.29Å; Q1086-H1090 PolarHBondContact O-ND1 2.96Å
1087	I	44	Very low	53.9	Low	115.2 Å²	115.2	93.9 Å²	93.9	59%	0.591	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-83.9	-32.1	-178.4	-61	172.7	0	0	0	111.1	Q1084 K1089 H1090	Q1084-I1087 HydrophobicContact CG-CB 4.34Å; Q1084-I1087 HydrophobicContact CG-CD1 4.48Å; Q1084-I1087 PolarHBondContact O-N 2.95Å; Q1084-I1087 VanDerWaalsContact O-N 3.11Å; I1087-K1089 PolarHBondContact O-N 3.03Å; I1087-H1090 PolarHBondContact O-N 3.44Å
1088	A	50.6	Low	54	Low	40.6 Å²	40.6	90.5 Å²	90.5	34%	0.336	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-65.1	7.5	179.1	0	0	0	0	0	115	P1075 M1077 Q1084	P1075-A1088 WeakPolarHBondContact CG-O 3.34Å; M1077-A1088 HydrophobicContact CE-CB 4.11Å; Q1084-A1088 VanDerWaalsContact O-CB 3.26Å; Q1084-A1088 WeakPolarHBondContact O-CB 3.29Å; Q1084-A1088 PolarHBondContact O-N 3.2Å; Q1084-A1088 VanDerWaalsContact O-N 3.09Å
1089	K	59.8	Low	53.8	Low	99 Å²	99	90.5 Å²	90.5	43%	0.43	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-97.5	-29.5	-173.8	-79.5	-163.9	178.1	-176.9	0	113.8	R1027 E1085 I1087	R1027-K1089 VanDerWaalsContact NH2-C 3.34Å; R1027-K1089 VanDerWaalsContact NH2-CA 3.29Å; R1027-K1089 VanDerWaalsContact NH2-CG 3.33Å; R1027-K1089 PolarHBondContact NH2-O 3.05Å; E1085-K1089 VanDerWaalsContact O-CE 3.24Å; E1085-K1089 WeakPolarHBondContact O-CE 3.2Å; E1085-K1089 WeakPolarHBondContact O-CG 3.42Å; I1087-K1089 PolarHBondContact O-N 3.03Å
1090	H	63.8	Low	53.6	Low	77.4 Å²	77.4	87.2 Å²	87.2	36%	0.358	47%	0.468	S	S	.	.			trans	-95.8	151.6	-171.7	-54	100.7	0	0	0	112.2	D1023 F1024 Q1086 I1087	D1023-H1090 HydrophobicContact CB-CB 4.36Å; D1023-H1090 PolarHBondContact O-CD2 3.03Å; D1023-H1090 VanDerWaalsContact O-CD2 3.22Å; D1023-H1090 PolarHBondContact O-ND1 2.92Å; F1024-H1090 CarbonylContact O-C 3.51Å; F1024-H1090 WeakPolarHBondContact O-CA 3.29Å; Q1086-H1090 PolarHBondContact O-CE1 3.16Å; Q1086-H1090 VanDerWaalsContact O-CE1 3.29Å; Q1086-H1090 PolarHBondContact O-ND1 2.96Å; I1087-H1090 PolarHBondContact O-N 3.44Å
1091	I	72.7	Confident	53.2	Low	9 Å²	9	88.7 Å²	88.7	5%	0.046	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	144.4	179.6	-48.5	167.9	0	0	0	108.8	F1022 D1023 F1024 P1026 W1042 L1072 P1075	F1022-I1091 CarbonylContact C-O 3.45Å; D1023-I1091 PolarHBondContact N-O 3.17Å; F1024-I1091 PolarHBondContact N-O 3.03Å; F1024-I1091 VanDerWaalsContact N-O 3.12Å; F1024-I1091 PolarHBondContact O-N 3.07Å; P1026-I1091 VanDerWaalsContact CD-CD1 3.43Å; P1026-I1091 HydrophobicContact CG-CD1 3.53Å; P1026-I1091 VanDerWaalsContact CG-CD1 3.47Å; W1042-I1091 HydrophobicContact CH2-CD1 3.38Å; W1042-I1091 HydrophobicContact CH2-CG1 3.88Å; W1042-I1091 HydrophobicContact CZ2-CD1 4.45Å; W1042-I1091 HydrophobicContact CZ3-CD1 3.56Å; W1042-I1091 VanDerWaalsContact CZ3-CD1 3.49Å; W1042-I1091 HydrophobicContact CZ3-CG1 4.32Å; L1072-I1091 HydrophobicContact CB-CD1 4.29Å; L1072-I1091 HydrophobicContact CD1-CD1 4.31Å; L1072-I1091 HydrophobicContact CD2-CD1 4.21Å; L1072-I1091 HydrophobicContact CD2-CG2 4.12Å; L1072-I1091 HydrophobicContact CG-CD1 4.44Å; P1075-I1091 HydrophobicContact CG-CG1 4.36Å
1092	S	73.8	Confident	52.9	Low	80.6 Å²	80.6	84.9 Å²	84.9	56%	0.564	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	141.1	160.6	57.2	0	0	0	0	110.8	L1021	L1021-S1092 CarbonylContact O-C 3.48Å; L1021-S1092 WeakPolarHBondContact O-CA 3.33Å; L1021-S1092 VanDerWaalsContact O-CB 3.26Å; L1021-S1092 WeakPolarHBondContact O-CB 3.4Å
1093	C	76.7	Confident	52.3	Low	16 Å²	16	87.7 Å²	87.7	11%	0.108	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	144.5	173.5	80.1	0	0	0	0	110.5	Q1020 L1021 C1047 L1072	Q1020-C1093 CarbonylContact C-O 3.5Å; Q1020-C1093 WeakPolarHBondContact CA-O 3.38Å; L1021-C1093 HydrophobicContact CB-CB 4.29Å; L1021-C1093 HydrophobicContact CD2-CB 4.49Å; L1021-C1093 PolarHBondContact N-O 3.14Å; L1021-C1093 PolarHBondContact O-N 3.06Å; L1021-C1093 VanDerWaalsContact O-N 3.11Å; C1047-C1093 VanDerWaalsContact SG-SG 3.63Å; L1072-C1093 HydrophobicContact CD2-CB 4.28Å
1094	E	76.7	Confident	51.7	Low	68.8 Å²	68.8	89.7 Å²	89.7	32%	0.321	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	143.7	173.4	-56.7	-171	171.3	0	0	109.7	E1019 Q1020 Q1070 I1096 S1120 S1121 Y1122	E1019-E1094 WeakPolarHBondContact O-CA 3.29Å; Q1020-E1094 HydrophobicContact CB-CG 4.47Å; Q1020-E1094 HydrophobicContact CG-CB 4.43Å; Q1020-E1094 HydrophobicContact CG-CG 4.03Å; Q1020-E1094 PolarHBondContact NE2-OE1 3.02Å; Q1070-E1094 PolarHBondContact OE1-O 2.87Å; E1094-I1096 VanDerWaalsContact C-N 3.33Å; E1094-I1096 HydrophobicContact CB-CD1 4.18Å; E1094-I1096 HydrophobicContact CB-CG1 3.83Å; E1094-I1096 PolarHBondContact O-N 3.19Å; E1094-I1096 VanDerWaalsContact O-N 3.08Å; E1094-S1120 PolarHBondContact OE2-OG 3.28Å; E1094-S1121 WeakPolarHBondContact CB-OG 3.24Å; E1094-S1121 PolarHBondContact OE2-N 3.06Å; E1094-S1121 PolarHBondContact OE2-OG 3.18Å; E1094-Y1122 HydrophobicContact CB-CE1 4.25Å
1095	F	70.8	Confident	51.1	Low	0 Å²	0	92.9 Å²	92.9	0%	0	49%	0.487	C	S	.	.			trans	-89.9	103.2	179.3	-70.1	-84.2	0	0	0	110.7	F1018 E1019 L1021 V1049 T1067 Q1070 S1121 Y1122 W1123 L1182 L1255	F1018-F1095 HydrophobicContact CB-CB 4.37Å; F1018-F1095 HydrophobicContact CB-CD2 4.1Å; F1018-F1095 HydrophobicContact CB-CG 4.27Å; F1018-F1095 WeakPolarHBondContact O-CB 3.23Å; E1019-F1095 PolarHBondContact O-N 3.06Å; E1019-F1095 VanDerWaalsContact O-N 3.08Å; L1021-F1095 HydrophobicContact CB-CE2 3.97Å; L1021-F1095 HydrophobicContact CB-CZ 4.34Å; V1049-F1095 HydrophobicContact CB-CE1 4.38Å; V1049-F1095 HydrophobicContact CG2-CE1 3.8Å; V1049-F1095 HydrophobicContact CG2-CE2 4.23Å; V1049-F1095 HydrophobicContact CG2-CZ 3.51Å; V1049-F1095 VanDerWaalsContact CG2-CZ 3.47Å; T1067-F1095 HydrophobicContact CG2-CD1 4.22Å; T1067-F1095 HydrophobicContact CG2-CE1 4.46Å; Q1070-F1095 HydrophobicContact CG-CD1 3.78Å; Q1070-F1095 HydrophobicContact CG-CE1 4.23Å; Q1070-F1095 HydrophobicContact CG-CG 4.45Å; F1095-S1121 PolarHBondContact N-O 2.89Å; F1095-S1121 CarbonylContact O-C 3.4Å; F1095-S1121 VanDerWaalsContact O-C 3.31Å; F1095-Y1122 CarbonylContact O-C 3.53Å; F1095-Y1122 WeakPolarHBondContact O-CA 3.28Å; F1095-Y1122 PolarHBondContact O-N 3.05Å; F1095-W1123 HydrophobicContact CB-CB 4.04Å; F1095-W1123 PolarHBondContact O-N 3.03Å; F1095-L1182 HydrophobicContact CZ-CD1 4.43Å; F1095-L1255 HydrophobicContact CD2-CD1 4.34Å; F1095-L1255 HydrophobicContact CE2-CD1 3.54Å; F1095-L1255 VanDerWaalsContact CE2-CD1 3.49Å; F1095-L1255 HydrophobicContact CZ-CD1 4.21Å
1096	I	61.4	Low	50.7	Low	54.4 Å²	54.4	92.7 Å²	92.7	28%	0.279	49%	0.491	S	S	.	.			trans	-89.2	129	-176.1	-53.8	176	0	0	0	111	T1068 Q1070 E1094 S1100 L1101 S1121	T1068-I1096 PolarHBondContact OG1-O 3.08Å; Q1070-I1096 VanDerWaalsContact CD-N 3.34Å; Q1070-I1096 PolarHBondContact NE2-O 3.4Å; E1094-I1096 VanDerWaalsContact C-N 3.33Å; E1094-I1096 HydrophobicContact CB-CD1 4.18Å; E1094-I1096 HydrophobicContact CB-CG1 3.83Å; E1094-I1096 PolarHBondContact O-N 3.19Å; E1094-I1096 VanDerWaalsContact O-N 3.08Å; I1096-S1100 VanDerWaalsContact CG2-OG 3.27Å; I1096-S1100 WeakPolarHBondContact CG2-OG 3.39Å; I1096-L1101 HydrophobicContact CG2-CD1 4.36Å; I1096-S1121 WeakPolarHBondContact CA-O 3.47Å; I1096-S1121 WeakPolarHBondContact CG1-OG 3.5Å; I1096-S1121 WeakPolarHBondContact CG2-OG 3.26Å
1097	S	50.3	Low	50	Low	36.6 Å²	36.6	89.7 Å²	89.7	26%	0.256	49%	0.494	S	S	.	.			trans	-65.1	136.3	168.9	-176.6	0	0	0	0	111.4	N1099 S1100 S1121 Y1122 E1395	S1097-N1099 VanDerWaalsContact C-N 3.31Å; S1097-N1099 PolarHBondContact O-N 3.13Å; S1097-N1099 VanDerWaalsContact O-N 3.14Å; S1097-S1100 WeakPolarHBondContact O-CB 3.42Å; S1097-S1100 PolarHBondContact O-N 3.06Å; S1097-S1100 PolarHBondContact O-OG 3.01Å; S1097-S1100 VanDerWaalsContact O-OG 3.1Å; S1097-S1121 WeakPolarHBondContact CB-O 3.49Å; S1097-S1121 PolarHBondContact N-O 2.77Å; S1097-Y1122 WeakPolarHBondContact CB-O 3.39Å; S1097-E1395 WeakPolarHBondContact CB-OE1 3.25Å; S1097-E1395 VanDerWaalsContact CB-OE2 3.3Å; S1097-E1395 WeakPolarHBondContact CB-OE2 3.4Å; S1097-E1395 PolarHBondContact OG-OE1 2.96Å; S1097-E1395 PolarHBondContact OG-OE2 3.33Å
1098	A	45.8	Very low	49.3	Very low	61.6 Å²	61.6	89.7 Å²	89.7	51%	0.509	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-56.5	-24.6	-171.8	0	0	0	0	0	114.5	T1068 S1100	T1068-A1098 HydrophobicContact CG2-CB 3.96Å; A1098-S1100 VanDerWaalsContact C-N 3.33Å; A1098-S1100 PolarHBondContact O-N 2.96Å
1099	N	40.7	Very low	48.3	Very low	116.2 Å²	116.2	93.1 Å²	93.1	62%	0.621	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-82	-11.1	-175.1	-66.5	-10	0	0	0	114.1	S1097 L1101 S1102 E1395	S1097-N1099 VanDerWaalsContact C-N 3.31Å; S1097-N1099 PolarHBondContact O-N 3.13Å; S1097-N1099 VanDerWaalsContact O-N 3.14Å; N1099-L1101 VanDerWaalsContact C-N 3.3Å; N1099-L1101 PolarHBondContact O-N 3.02Å; N1099-S1102 PolarHBondContact O-OG 3.15Å; N1099-E1395 VanDerWaalsContact CB-OE1 3.23Å; N1099-E1395 WeakPolarHBondContact CB-OE1 3.39Å; N1099-E1395 WeakPolarHBondContact CB-OE2 3.12Å; N1099-E1395 PolarHBondContact ND2-OE2 3.33Å; N1099-E1395 VanDerWaalsContact ND2-OE2 3.1Å
1100	S	36.5	Very low	46.7	Very low	57.8 Å²	57.8	94 Å²	94	40%	0.404	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-79.7	17	-179.4	74	0	0	0	0	113.2	I1096 S1097 A1098 S1102 K1103	I1096-S1100 VanDerWaalsContact CG2-OG 3.27Å; I1096-S1100 WeakPolarHBondContact CG2-OG 3.39Å; S1097-S1100 WeakPolarHBondContact O-CB 3.42Å; S1097-S1100 PolarHBondContact O-N 3.06Å; S1097-S1100 PolarHBondContact O-OG 3.01Å; S1097-S1100 VanDerWaalsContact O-OG 3.1Å; A1098-S1100 VanDerWaalsContact C-N 3.33Å; A1098-S1100 PolarHBondContact O-N 2.96Å; S1100-S1102 VanDerWaalsContact C-N 3.29Å; S1100-S1102 PolarHBondContact O-N 3.11Å; S1100-K1103 PolarHBondContact O-N 3Å
1101	L	33.6	Very low	45	Very low	152 Å²	152	96.6 Å²	96.6	80%	0.796	57%	0.565	S	S	*	*			trans	-76.8	54.8	178.8	-138.1	81.5	0	0	0	111.5	I1096 N1099 K1103	I1096-L1101 HydrophobicContact CG2-CD1 4.36Å; N1099-L1101 VanDerWaalsContact C-N 3.3Å; N1099-L1101 PolarHBondContact O-N 3.02Å; L1101-K1103 PolarHBondContact O-N 2.96Å; L1101-K1103 VanDerWaalsContact O-N 3.12Å
1102	S	33.5	Very low	43	Very low	90.8 Å²	90.8	103.6 Å²	103.6	64%	0.635	60%	0.601	S	S	*	*			trans	-90	84.1	176.2	59.3	0	0	0	0	111.7	N1099 S1100 K1104	N1099-S1102 PolarHBondContact O-OG 3.15Å; S1100-S1102 VanDerWaalsContact C-N 3.29Å; S1100-S1102 PolarHBondContact O-N 3.11Å; S1102-K1104 PolarHBondContact O-N 3.25Å
1103	K	32.2	Very low	40.8	Very low	187.4 Å²	187.4	108.7 Å²	108.7	82%	0.815	61%	0.613	S	S	*	*			trans	-71.3	66.1	177.1	-75	170.6	179.3	178.6	0	112.9	S1100 L1101 E1105 M1394	S1100-K1103 PolarHBondContact O-N 3Å; L1101-K1103 PolarHBondContact O-N 2.96Å; L1101-K1103 VanDerWaalsContact O-N 3.12Å; K1103-E1105 VanDerWaalsContact C-N 3.34Å; K1103-E1105 PolarHBondContact O-N 3.16Å; K1103-E1105 VanDerWaalsContact O-N 3.1Å; K1103-M1394 HydrophobicContact CD-SD 4.31Å
1104	K	32.2	Very low	38.4	Very low	200.6 Å²	200.6	112.5 Å²	112.5	87%	0.872	64%	0.64	S	S	*	*			trans	-100.2	51	168.5	-86.3	-173.1	177.9	177.4	0	112.3	S1102	S1102-K1104 PolarHBondContact O-N 3.25Å
1105	E	31.4	Very low	36.1	Very low	164.4 Å²	164.4	114.7 Å²	114.7	77%	0.768	66%	0.66	S	S	*	*			trans	-111.6	126.5	167.4	-70.5	-176.3	171.2	0	0	110.9	K1103	K1103-E1105 VanDerWaalsContact C-N 3.34Å; K1103-E1105 PolarHBondContact O-N 3.16Å; K1103-E1105 VanDerWaalsContact O-N 3.1Å
1106	N	32.6	Very low	34.2	Very low	156.8 Å²	156.8	120.4 Å²	120.4	84%	0.839	70%	0.697	S	S	*	*	S	Bend	trans	74.8	56.7	170.4	-57.2	-27.4	0	0	0	117.4	S1108	N1106-S1108 VanDerWaalsContact C-N 3.35Å; N1106-S1108 PolarHBondContact O-N 3.22Å
1107	A	30.3	Very low	32.8	Very low	98.8 Å²	98.8	122.6 Å²	122.6	82%	0.817	72%	0.718	S	S	*	*			trans	-113.1	72.9	161.4	0	0	0	0	0	112.7	S1109	A1107-S1109 PolarHBondContact O-N 2.89Å
1108	S	29.2	Very low	32	Very low	115.8 Å²	115.8	125.3 Å²	125.3	81%	0.81	74%	0.737	S	S	*	*			trans	-120.9	91.3	165.1	54.3	0	0	0	0	111.3	N1106	N1106-S1108 VanDerWaalsContact C-N 3.35Å; N1106-S1108 PolarHBondContact O-N 3.22Å
1109	S	29.8	Very low	31.6	Very low	111.8 Å²	111.8	126.5 Å²	126.5	78%	0.782	74%	0.741	S	S	*	*			trans	172.7	104.8	159.3	142.8	0	0	0	0	111.8	A1107 T1111	A1107-S1109 PolarHBondContact O-N 2.89Å; S1109-T1111 PolarHBondContact O-N 2.86Å
1110	S	27.2	Very low	31.6	Very low	116.2 Å²	116.2	123.6 Å²	123.6	81%	0.813	73%	0.73	S	S	*	*			trans	-116.5	116.4	158	46.4	0	0	0	0	110.6	I1112	S1110-I1112 PolarHBondContact O-N 3.4Å
1111	T	28.4	Very low	32.4	Very low	133 Å²	133	122.3 Å²	122.3	82%	0.816	72%	0.721	S	S	*	*			trans	-130.3	109.3	165.9	18.8	0	0	0	0	111	S1109 K1113	S1109-T1111 PolarHBondContact O-N 2.86Å; T1111-K1113 PolarHBondContact O-N 3.32Å
1112	I	30.7	Very low	34.1	Very low	155.6 Å²	155.6	118.6 Å²	118.6	80%	0.798	70%	0.696	S	S	*	*			trans	-78	113.1	162.7	-55.8	175.3	0	0	0	111.3	S1110 S1114	S1110-I1112 PolarHBondContact O-N 3.4Å; I1112-S1114 VanDerWaalsContact C-N 3.25Å; I1112-S1114 PolarHBondContact O-N 2.92Å
1113	K	27	Very low	36.3	Very low	188 Å²	188	115.4 Å²	115.4	82%	0.817	67%	0.671	S	S	*	*			trans	-96.5	119	163.2	-72.3	176.2	179.5	178.2	0	110.4	T1111 D1647	T1111-K1113 PolarHBondContact O-N 3.32Å; K1113-D1647 IonicContact NZ-OD2 3.4Å; K1113-D1647 PolarHBondContact NZ-OD2 3.25Å
1114	S	25.4	Very low	38.5	Very low	96 Å²	96	108.6 Å²	108.6	67%	0.671	65%	0.647	S	S	*	*			trans	-95.5	141.6	163.3	45	0	0	0	0	110.8	I1112 P1116	I1112-S1114 VanDerWaalsContact C-N 3.25Å; I1112-S1114 PolarHBondContact O-N 2.92Å; S1114-P1116 WeakPolarHBondContact O-CD 3.31Å; S1114-P1116 VanDerWaalsContact O-N 3.15Å
1115	P	29	Very low	40.8	Very low	115.2 Å²	115.2	102.5 Å²	102.5	75%	0.748	62%	0.621	S	S	*	*			trans	-63.2	139.2	-177.4	2.8	3	0	0	0	110.4	S1117	P1115-S1117 VanDerWaalsContact C-N 3.33Å; P1115-S1117 PolarHBondContact O-N 3.05Å
1116	P	31.8	Very low	43.1	Very low	120 Å²	120	97.9 Å²	97.9	78%	0.779	60%	0.604	S	S	*	*			trans	-66.7	116	-179.2	27.6	-32.1	0	0	0	109.1	S1114 S1118	S1114-P1116 WeakPolarHBondContact O-CD 3.31Å; S1114-P1116 VanDerWaalsContact O-N 3.15Å; P1116-S1118 VanDerWaalsContact C-N 3.29Å; P1116-S1118 PolarHBondContact O-N 3.03Å; P1116-S1118 VanDerWaalsContact O-N 3.14Å
1117	S	30.9	Very low	45.5	Very low	101 Å²	101	91.2 Å²	91.2	71%	0.706	57%	0.568	S	S	*	*			trans	-48.4	100	167.5	53.7	0	0	0	0	109.1	P1115 S1119	P1115-S1117 VanDerWaalsContact C-N 3.33Å; P1115-S1117 PolarHBondContact O-N 3.05Å; S1117-S1119 VanDerWaalsContact C-N 3.3Å; S1117-S1119 PolarHBondContact O-N 3Å; S1117-S1119 VanDerWaalsContact O-N 3.11Å
1118	S	33.8	Very low	47.9	Very low	93.2 Å²	93.2	93.4 Å²	93.4	65%	0.652	56%	0.555	S	S	*	*			trans	-65.7	95.1	-176.2	40.8	0	0	0	0	111.2	P1116 S1120	P1116-S1118 VanDerWaalsContact C-N 3.29Å; P1116-S1118 PolarHBondContact O-N 3.03Å; P1116-S1118 VanDerWaalsContact O-N 3.14Å; S1118-S1120 PolarHBondContact O-N 2.95Å
1119	S	37.1	Very low	50.5	Low	86.6 Å²	86.6	88.1 Å²	88.1	61%	0.606	52%	0.517	S	S	*	.			trans	-58	72.6	154.1	-102.3	0	0	0	0	108.7	S1117 S1121	S1117-S1119 VanDerWaalsContact C-N 3.3Å; S1117-S1119 PolarHBondContact O-N 3Å; S1117-S1119 VanDerWaalsContact O-N 3.11Å; S1119-S1121 VanDerWaalsContact C-N 3.25Å; S1119-S1121 PolarHBondContact O-N 3.26Å
1120	S	40.3	Very low	52.8	Low	54.2 Å²	54.2	85.5 Å²	85.5	38%	0.379	50%	0.499	S	S	.	.			trans	-60.8	106.3	175.2	54.5	0	0	0	0	108.4	E1094 S1118 Y1122	E1094-S1120 PolarHBondContact OE2-OG 3.28Å; S1118-S1120 PolarHBondContact O-N 2.95Å; S1120-Y1122 WeakPolarHBondContact O-CD1 3.32Å; S1120-Y1122 PolarHBondContact O-N 3.42Å; S1120-Y1122 WeakPolarHBondContact OG-CE1 3.43Å; S1120-Y1122 VanDerWaalsContact OG-CZ 3.25Å; S1120-Y1122 PolarHBondContact OG-OH 2.79Å
1121	S	54.4	Low	55.3	Low	30.6 Å²	30.6	80.7 Å²	80.7	21%	0.214	47%	0.465	C	S	.	.			trans	-76.7	113.9	176.1	52	0	0	0	0	108.4	E1019 E1094 F1095 I1096 S1097 S1119	E1019-S1121 VanDerWaalsContact O-O 3.1Å; E1094-S1121 WeakPolarHBondContact CB-OG 3.24Å; E1094-S1121 PolarHBondContact OE2-N 3.06Å; E1094-S1121 PolarHBondContact OE2-OG 3.18Å; F1095-S1121 PolarHBondContact N-O 2.89Å; F1095-S1121 CarbonylContact O-C 3.4Å; F1095-S1121 VanDerWaalsContact O-C 3.31Å; I1096-S1121 WeakPolarHBondContact CA-O 3.47Å; I1096-S1121 WeakPolarHBondContact CG1-OG 3.5Å; I1096-S1121 WeakPolarHBondContact CG2-OG 3.26Å; S1097-S1121 WeakPolarHBondContact CB-O 3.49Å; S1097-S1121 PolarHBondContact N-O 2.77Å; S1119-S1121 VanDerWaalsContact C-N 3.25Å; S1119-S1121 PolarHBondContact O-N 3.26Å
1122	Y	69.8	Low	57.6	Low	73.8 Å²	73.8	79.8 Å²	79.8	29%	0.289	46%	0.455	S	S	.	.			trans	-110.6	153.6	177.5	45.3	-86.6	0	0	0	110.4	T1017 F1018 E1019 Q1020 E1094 F1095 S1097 S1120 S1124 P1386 Y1388	T1017-Y1122 HydrophobicContact CG2-CD2 3.48Å; T1017-Y1122 VanDerWaalsContact CG2-CD2 3.4Å; T1017-Y1122 HydrophobicContact CG2-CE2 4.03Å; T1017-Y1122 HydrophobicContact CG2-CG 3.94Å; F1018-Y1122 WeakPolarHBondContact O-CA 3.43Å; E1019-Y1122 HydrophobicContact CB-CD1 4.04Å; E1019-Y1122 HydrophobicContact CB-CD2 4.01Å; E1019-Y1122 HydrophobicContact CB-CE1 4.18Å; E1019-Y1122 HydrophobicContact CB-CE2 4.14Å; E1019-Y1122 HydrophobicContact CB-CG 3.96Å; E1019-Y1122 HydrophobicContact CG-CD2 3.77Å; E1019-Y1122 HydrophobicContact CG-CE2 4.19Å; E1019-Y1122 HydrophobicContact CG-CG 4Å; E1019-Y1122 VanDerWaalsContact O-CD1 3.29Å; E1019-Y1122 WeakPolarHBondContact O-CD1 3.34Å; E1019-Y1122 WeakPolarHBondContact O-CE1 3.33Å; Q1020-Y1122 HydrophobicContact CG-CE1 4.07Å; Q1020-Y1122 PolarHBondContact NE2-OH 2.89Å; E1094-Y1122 HydrophobicContact CB-CE1 4.25Å; F1095-Y1122 CarbonylContact O-C 3.53Å; F1095-Y1122 WeakPolarHBondContact O-CA 3.28Å; F1095-Y1122 PolarHBondContact O-N 3.05Å; S1097-Y1122 WeakPolarHBondContact CB-O 3.39Å; S1120-Y1122 WeakPolarHBondContact O-CD1 3.32Å; S1120-Y1122 PolarHBondContact O-N 3.42Å; S1120-Y1122 WeakPolarHBondContact OG-CE1 3.43Å; S1120-Y1122 VanDerWaalsContact OG-CZ 3.25Å; S1120-Y1122 PolarHBondContact OG-OH 2.79Å; Y1122-S1124 PolarHBondContact O-N 2.96Å; Y1122-P1386 PolarHBondContact OH-O 3.15Å; Y1122-Y1388 AromaticContact CD1-CD2 3.74Å; Y1122-Y1388 HydrophobicContact CD1-CD2 3.74Å; Y1122-Y1388 AromaticContact CD1-CE2 4Å; Y1122-Y1388 HydrophobicContact CD1-CE2 4.13Å; Y1122-Y1388 HydrophobicContact CD2-CE2 4.45Å; Y1122-Y1388 AromaticContact CE1-CD2 3.46Å; Y1122-Y1388 HydrophobicContact CE1-CD2 3.46Å; Y1122-Y1388 AromaticContact CE1-CE2 3.79Å; Y1122-Y1388 HydrophobicContact CE1-CE2 4.01Å; Y1122-Y1388 HydrophobicContact CE1-CG 4.42Å; Y1122-Y1388 HydrophobicContact CE2-CD2 4.46Å; Y1122-Y1388 HydrophobicContact CE2-CE2 4.32Å; Y1122-Y1388 HydrophobicContact CG-CD2 4.41Å; Y1122-Y1388 HydrophobicContact CG-CE2 4.36Å; Y1122-Y1388 AromaticContact CZ-CD2 3.88Å; Y1122-Y1388 AromaticContact CZ-CE2 3.93Å
1123	W	78.8	Confident	59.9	Low	24.8 Å²	24.8	72.6 Å²	72.6	9%	0.094	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	132.1	170.6	-179.7	98.7	0	0	0	108.6	T1017 F1018 Y1051 T1065 R1066 T1067 F1095 H1125	T1017-W1123 CarbonylContact C-O 3.55Å; T1017-W1123 VanDerWaalsContact CA-O 3.27Å; T1017-W1123 WeakPolarHBondContact CA-O 3.35Å; T1017-W1123 WeakPolarHBondContact CG2-O 3.22Å; F1018-W1123 HydrophobicContact CB-CE3 4.47Å; F1018-W1123 HydrophobicContact CD2-CD2 4.45Å; F1018-W1123 AromaticContact CD2-CE3 3.51Å; F1018-W1123 HydrophobicContact CD2-CE3 3.51Å; F1018-W1123 VanDerWaalsContact CD2-CE3 3.45Å; F1018-W1123 HydrophobicContact CD2-CH2 4.41Å; F1018-W1123 AromaticContact CD2-CZ3 3.59Å; F1018-W1123 HydrophobicContact CD2-CZ3 3.59Å; F1018-W1123 VanDerWaalsContact CD2-CZ3 3.48Å; F1018-W1123 HydrophobicContact CE2-CE3 4.11Å; F1018-W1123 HydrophobicContact CE2-CH2 4.36Å; F1018-W1123 AromaticContact CE2-CZ3 3.69Å; F1018-W1123 HydrophobicContact CE2-CZ3 3.69Å; F1018-W1123 HydrophobicContact CG-CE3 4.41Å; F1018-W1123 PolarHBondContact N-O 3.22Å; F1018-W1123 VanDerWaalsContact N-O 3.13Å; F1018-W1123 PolarHBondContact O-N 3.09Å; F1018-W1123 VanDerWaalsContact O-N 3.13Å; Y1051-W1123 AromaticContact CE1-CH2 3.98Å; Y1051-W1123 HydrophobicContact CE1-CH2 4.02Å; Y1051-W1123 HydrophobicContact CE1-CZ3 4.16Å; T1065-W1123 HydrophobicContact CG2-CH2 3.84Å; T1065-W1123 HydrophobicContact CG2-CZ2 4.24Å; R1066-W1123 VanDerWaalsContact O-CZ2 3.26Å; R1066-W1123 WeakPolarHBondContact O-CZ2 3.42Å; T1067-W1123 HydrophobicContact CG2-CB 4.39Å; T1067-W1123 HydrophobicContact CG2-CD2 3.74Å; T1067-W1123 HydrophobicContact CG2-CE3 3.87Å; T1067-W1123 HydrophobicContact CG2-CG 4.03Å; T1067-W1123 HydrophobicContact CG2-CH2 4.41Å; T1067-W1123 HydrophobicContact CG2-CZ2 4.46Å; T1067-W1123 HydrophobicContact CG2-CZ3 4.21Å; F1095-W1123 HydrophobicContact CB-CB 4.04Å; F1095-W1123 PolarHBondContact O-N 3.03Å; W1123-H1125 HydrophobicContact CH2-CB 3.38Å; W1123-H1125 VanDerWaalsContact CH2-CB 3.43Å; W1123-H1125 HydrophobicContact CZ2-CB 3.91Å; W1123-H1125 HydrophobicContact CZ3-CB 3.79Å
1124	S	78.9	Confident	62	Low	45.2 Å²	45.2	69 Å²	69	32%	0.316	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	142.2	-178.3	-174.2	0	0	0	0	111.3	I1016 T1017 Y1122	I1016-S1124 WeakPolarHBondContact O-CA 3.35Å; T1017-S1124 VanDerWaalsContact CG2-CB 3.48Å; T1017-S1124 VanDerWaalsContact CG2-OG 3.28Å; T1017-S1124 WeakPolarHBondContact CG2-OG 3.34Å; T1017-S1124 VanDerWaalsContact OG1-CB 3.31Å; T1017-S1124 WeakPolarHBondContact OG1-CB 3.27Å; T1017-S1124 PolarHBondContact OG1-OG 3.05Å; T1017-S1124 VanDerWaalsContact OG1-OG 3.08Å; Y1122-S1124 PolarHBondContact O-N 2.96Å
1125	H	79.9	Confident	64	Low	72.2 Å²	72.2	64.7 Å²	64.7	33%	0.334	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	138.5	175.5	-171.4	89.8	0	0	0	110.8	G1015 I1016 T1065 W1123 H1127	G1015-H1125 CarbonylContact C-O 3.59Å; G1015-H1125 WeakPolarHBondContact CA-O 3.37Å; I1016-H1125 PolarHBondContact N-O 2.9Å; I1016-H1125 PolarHBondContact O-N 3.27Å; T1065-H1125 HydrophobicContact CG2-CB 4.44Å; W1123-H1125 HydrophobicContact CH2-CB 3.38Å; W1123-H1125 VanDerWaalsContact CH2-CB 3.43Å; W1123-H1125 HydrophobicContact CZ2-CB 3.91Å; W1123-H1125 HydrophobicContact CZ3-CB 3.79Å; H1125-H1127 AromaticContact CD2-CD2 3.96Å; H1125-H1127 AromaticContact CD2-CE1 3.44Å; H1125-H1127 PolarHBondContact CD2-CE1 3.15Å; H1125-H1127 VanDerWaalsContact CD2-CE1 3.45Å; H1125-H1127 AromaticContact CD2-ND1 3.92Å; H1125-H1127 AromaticContact CD2-NE2 3.51Å; H1125-H1127 PolarHBondContact CD2-NE2 2.95Å; H1125-H1127 AromaticContact NE2-CE1 3.67Å; H1125-H1127 AromaticContact NE2-ND1 3.93Å
1126	T	80.2	Confident	65.8	Low	66.2 Å²	66.2	62.6 Å²	62.6	41%	0.406	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	115.9	-177.3	-50.6	0	0	0	0	111.5	R1013 I1014	R1013-T1126 HydrophobicContact CB-CG2 4.29Å; I1014-T1126 CarbonylContact O-C 3.43Å; I1014-T1126 WeakPolarHBondContact O-CA 3.39Å
1127	H	83.2	Confident	67	Low	17 Å²	17	59.7 Å²	59.7	8%	0.079	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	146.2	174.1	-63.4	-74.1	0	0	0	111.2	R1013 I1014 Y1051 F1053 H1125	R1013-H1127 CarbonylContact C-O 3.44Å; R1013-H1127 VanDerWaalsContact CA-O 3.24Å; R1013-H1127 WeakPolarHBondContact CA-O 3.29Å; I1014-H1127 PolarHBondContact N-O 2.92Å; I1014-H1127 PolarHBondContact O-N 3.13Å; Y1051-H1127 AromaticContact CE2-NE2 3.38Å; Y1051-H1127 VanDerWaalsContact CE2-NE2 3.32Å; Y1051-H1127 WeakPolarHBondContact CE2-NE2 3.39Å; Y1051-H1127 AromaticContact CZ-NE2 3.53Å; Y1051-H1127 PolarHBondContact OH-NE2 3.02Å; F1053-H1127 HydrophobicContact CD1-CB 3.63Å; F1053-H1127 AromaticContact CD1-CD2 3.49Å; F1053-H1127 VanDerWaalsContact CD1-CD2 3.45Å; F1053-H1127 WeakPolarHBondContact CD1-CD2 3.18Å; F1053-H1127 AromaticContact CD1-CE1 3.73Å; F1053-H1127 AromaticContact CD1-CG 3.16Å; F1053-H1127 AromaticContact CD1-ND1 3.34Å; F1053-H1127 VanDerWaalsContact CD1-ND1 3.31Å; F1053-H1127 WeakPolarHBondContact CD1-ND1 3.34Å; F1053-H1127 AromaticContact CD1-NE2 3.81Å; F1053-H1127 HydrophobicContact CE1-CB 3.36Å; F1053-H1127 VanDerWaalsContact CE1-CB 3.49Å; F1053-H1127 AromaticContact CE1-CD2 3.71Å; F1053-H1127 AromaticContact CE1-CG 3.39Å; F1053-H1127 VanDerWaalsContact CE1-CG 3.45Å; F1053-H1127 AromaticContact CE1-ND1 3.99Å; F1053-H1127 AromaticContact CG-CD2 3.74Å; F1053-H1127 AromaticContact CG-CE1 3.81Å; F1053-H1127 AromaticContact CG-CG 3.86Å; F1053-H1127 AromaticContact CG-ND1 3.89Å; F1053-H1127 AromaticContact CG-NE2 3.7Å; F1053-H1127 HydrophobicContact CZ-CB 4.22Å; H1125-H1127 AromaticContact CD2-CD2 3.96Å; H1125-H1127 AromaticContact CD2-CE1 3.44Å; H1125-H1127 PolarHBondContact CD2-CE1 3.15Å; H1125-H1127 VanDerWaalsContact CD2-CE1 3.45Å; H1125-H1127 AromaticContact CD2-ND1 3.92Å; H1125-H1127 AromaticContact CD2-NE2 3.51Å; H1125-H1127 PolarHBondContact CD2-NE2 2.95Å; H1125-H1127 AromaticContact NE2-CE1 3.67Å; H1125-H1127 AromaticContact NE2-ND1 3.93Å
1128	R	79.9	Confident	68.2	Low	145 Å²	145	63.1 Å²	63.1	55%	0.547	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.4	178.5	-59.7	178.6	88.6	154	-4	109.7	E1011 H1012 R1013	E1011-R1128 VanDerWaalsContact CD-NH2 3.34Å; E1011-R1128 IonicContact OE1-CZ 3.27Å; E1011-R1128 IonicContact OE1-NE 3.51Å; E1011-R1128 PolarHBondContact OE1-NE 3.2Å; E1011-R1128 IonicContact OE1-NH2 2.96Å; E1011-R1128 PolarHBondContact OE1-NH2 3.03Å; E1011-R1128 IonicContact OE2-CZ 3.32Å; E1011-R1128 IonicContact OE2-NE 2.77Å; E1011-R1128 IonicContact OE2-NH2 3.18Å; E1011-R1128 PolarHBondContact OE2-NH2 3.11Å; H1012-R1128 CarbonylContact O-C 3.31Å; H1012-R1128 WeakPolarHBondContact O-CA 3.35Å; R1013-R1128 HydrophobicContact CG-CG 4.2Å
1129	L	83.6	Confident	69.2	Low	3.8 Å²	3.8	59 Å²	59	2%	0.02	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	127.7	-172.2	-66.2	170.5	0	0	0	110.2	E1011 H1012 F1053 P1054 T1057 F1154 W1157 I1158	E1011-L1129 CarbonylContact C-O 3.52Å; E1011-L1129 WeakPolarHBondContact CA-O 3.39Å; H1012-L1129 HydrophobicContact CB-CB 4.44Å; H1012-L1129 PolarHBondContact N-O 3.04Å; H1012-L1129 PolarHBondContact O-N 2.98Å; F1053-L1129 HydrophobicContact CE1-CD1 3.94Å; F1053-L1129 HydrophobicContact CZ-CD1 4.36Å; P1054-L1129 HydrophobicContact CB-CD1 4.49Å; P1054-L1129 HydrophobicContact CB-CD2 4.31Å; T1057-L1129 HydrophobicContact CG2-CB 4.11Å; L1129-F1154 HydrophobicContact CB-CE2 4.46Å; L1129-F1154 HydrophobicContact CD1-CE2 4.18Å; L1129-F1154 HydrophobicContact CD1-CZ 4.25Å; L1129-W1157 HydrophobicContact CD1-CH2 3.97Å; L1129-W1157 HydrophobicContact CD1-CZ3 3.78Å; L1129-W1157 HydrophobicContact CD2-CH2 4.29Å; L1129-W1157 HydrophobicContact CG-CH2 4.46Å; L1129-I1158 HydrophobicContact CD1-CD1 4.42Å
1130	C	78.4	Confident	70	Confident	57 Å²	57	58.9 Å²	58.9	39%	0.385	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	108	-177.8	-69	0	0	0	0	111.9	V1010 T1057	V1010-C1130 CarbonylContact O-C 3.55Å; V1010-C1130 VanDerWaalsContact O-CA 3.31Å; V1010-C1130 WeakPolarHBondContact O-CA 3.29Å; T1057-C1130 WeakPolarHBondContact CB-O 3.33Å; T1057-C1130 VanDerWaalsContact CG2-C 3.47Å; T1057-C1130 WeakPolarHBondContact CG2-O 3.41Å; T1057-C1130 PolarHBondContact OG1-O 3.13Å
1131	T	79.6	Confident	70.7	Confident	17 Å²	17	63.5 Å²	63.5	10%	0.104	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	154.9	176.7	60.9	0	0	0	0	111.2	T1009 V1010 H1012 T1057 F1154	T1009-T1131 CarbonylContact C-O 3.49Å; T1009-T1131 WeakPolarHBondContact CA-O 3.23Å; V1010-T1131 PolarHBondContact N-O 3.15Å; V1010-T1131 PolarHBondContact O-N 2.9Å; V1010-T1131 PolarHBondContact O-OG1 3.08Å; H1012-T1131 PolarHBondContact CD2-OG1 3.09Å; H1012-T1131 PolarHBondContact NE2-OG1 3.26Å; H1012-T1131 VanDerWaalsContact NE2-OG1 3.07Å; T1057-T1131 HydrophobicContact CG2-CG2 3.75Å; T1131-F1154 HydrophobicContact CG2-CD2 4.09Å
1132	N	78	Confident	71.2	Confident	114 Å²	114	68.8 Å²	68.8	61%	0.61	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	126.8	168.7	-70.7	-15.4	0	0	0	108.7	L1008 T1009	L1008-N1132 CarbonylContact O-C 3.53Å; L1008-N1132 VanDerWaalsContact O-CA 3.28Å; L1008-N1132 WeakPolarHBondContact O-CA 3.36Å; T1009-N1132 WeakPolarHBondContact CA-OD1 3.14Å; T1009-N1132 WeakPolarHBondContact CB-OD1 3.33Å; T1009-N1132 WeakPolarHBondContact CG2-OD1 3.41Å; T1009-N1132 PolarHBondContact OG1-OD1 2.7Å
1133	I	77	Confident	71.1	Confident	3.2 Å²	3.2	69.5 Å²	69.5	2%	0.016	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	127.6	-174.5	-65.5	169.7	0	0	0	109.2	L1008 V1010 I1135 K1149 I1150 E1153	L1008-I1133 PolarHBondContact N-O 3.15Å; L1008-I1133 PolarHBondContact O-N 3Å; V1010-I1133 HydrophobicContact CB-CD1 4.31Å; V1010-I1133 HydrophobicContact CG2-CD1 3.97Å; I1133-I1135 HydrophobicContact CG2-CD1 4.24Å; I1133-I1135 HydrophobicContact CG2-CG1 4.28Å; I1133-K1149 HydrophobicContact CG2-CD 4.26Å; I1133-K1149 HydrophobicContact CG2-CG 4.29Å; I1133-I1150 HydrophobicContact CD1-CB 4.04Å; I1133-I1150 HydrophobicContact CD1-CG1 3.66Å; I1133-I1150 HydrophobicContact CD1-CG2 4.13Å; I1133-E1153 WeakPolarHBondContact CG2-OE2 3.35Å
1134	Q	72.5	Confident	70.6	Confident	113.6 Å²	113.6	73.2 Å²	73.2	53%	0.531	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	117.4	-178.6	-72.9	-157.3	-32.3	0	0	111	C1005 D1007 K1149	C1005-Q1134 VanDerWaalsContact SG-CB 3.56Å; D1007-Q1134 VanDerWaalsContact OD1-CG 3.3Å; D1007-Q1134 WeakPolarHBondContact OD1-CG 3.28Å; D1007-Q1134 PolarHBondContact OD1-NE2 3.2Å; Q1134-K1149 WeakPolarHBondContact O-CE 3.4Å; Q1134-K1149 PolarHBondContact O-NZ 2.8Å
1135	I	67.7	Low	70.2	Confident	4.6 Å²	4.6	75.6 Å²	75.6	2%	0.024	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	126.6	-177.9	-61.4	-163.2	0	0	0	110.3	C1005 V1006 L1008 I1133 S1139 Q1140 I1146	C1005-I1135 VanDerWaalsContact CA-O 3.32Å; C1005-I1135 WeakPolarHBondContact CA-O 3.36Å; C1005-I1135 PolarHBondContact SG-O 2.84Å; V1006-I1135 PolarHBondContact N-O 3.14Å; V1006-I1135 PolarHBondContact O-N 3.09Å; L1008-I1135 HydrophobicContact CB-CD1 4.43Å; L1008-I1135 HydrophobicContact CD1-CB 4.13Å; L1008-I1135 HydrophobicContact CD1-CD1 3.3Å; L1008-I1135 HydrophobicContact CD1-CG1 4.18Å; L1008-I1135 HydrophobicContact CG-CD1 3.62Å; L1008-I1135 HydrophobicContact CG-CG1 4.17Å; I1133-I1135 HydrophobicContact CG2-CD1 4.24Å; I1133-I1135 HydrophobicContact CG2-CG1 4.28Å; I1135-S1139 WeakPolarHBondContact CG2-OG 3.27Å; I1135-Q1140 HydrophobicContact CG2-CB 4.5Å; I1135-Q1140 HydrophobicContact CG2-CG 4.07Å; I1135-I1146 HydrophobicContact CD1-CB 4.36Å; I1135-I1146 HydrophobicContact CD1-CD1 4.02Å; I1135-I1146 HydrophobicContact CD1-CG1 3.96Å; I1135-I1146 HydrophobicContact CD1-CG2 3.69Å; I1135-I1146 HydrophobicContact CG2-CG1 4.36Å
1136	T	65.1	Low	69.9	Low	71 Å²	71	72.6 Å²	72.6	44%	0.436	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	148.8	174.5	52.2	0	0	0	0	110.9	E1138 S1139 Q1140	T1136-E1138 VanDerWaalsContact C-N 3.28Å; T1136-E1138 PolarHBondContact O-N 2.99Å; T1136-E1138 VanDerWaalsContact O-N 3.1Å; T1136-S1139 PolarHBondContact N-OG 3.01Å; T1136-S1139 PolarHBondContact O-N 3.18Å; T1136-S1139 PolarHBondContact O-OG 3.03Å; T1136-S1139 PolarHBondContact OG1-OG 2.82Å; T1136-S1139 VanDerWaalsContact OG1-OG 3.1Å; T1136-Q1140 PolarHBondContact O-N 3.04Å
1137	S	57	Low	69.7	Low	59.2 Å²	59.2	70.9 Å²	70.9	41%	0.414	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-50.9	-36.8	-178.5	50.5	0	0	0	0	114.5	S1004 S1139 Q1140	S1004-S1137 PolarHBondContact O-N 3.05Å; S1004-S1137 VanDerWaalsContact O-N 3.08Å; S1004-S1137 PolarHBondContact O-OG 3.11Å; S1004-S1137 WeakPolarHBondContact OG-CB 3.42Å; S1004-S1137 PolarHBondContact OG-OG 3.32Å; S1137-S1139 VanDerWaalsContact C-N 3.27Å; S1137-S1139 PolarHBondContact O-N 3.08Å; S1137-S1139 VanDerWaalsContact O-N 3.15Å; S1137-Q1140 WeakPolarHBondContact O-CB 3.31Å; S1137-Q1140 PolarHBondContact O-N 3.19Å
1138	E	56.1	Low	69.5	Low	172.4 Å²	172.4	72.8 Å²	72.8	81%	0.806	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-62.1	-29.9	177.1	-65.2	-174.9	161.2	0	0	113.7	T1136 Q1140	T1136-E1138 VanDerWaalsContact C-N 3.28Å; T1136-E1138 PolarHBondContact O-N 2.99Å; T1136-E1138 VanDerWaalsContact O-N 3.1Å; E1138-Q1140 VanDerWaalsContact C-N 3.33Å
1139	S	55.4	Low	69.6	Low	8.2 Å²	8.2	68.9 Å²	68.9	6%	0.057	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-89.2	-13.8	-177.2	57.4	0	0	0	0	114	I1135 T1136 S1137 N1141 K1142 I1146	I1135-S1139 WeakPolarHBondContact CG2-OG 3.27Å; T1136-S1139 PolarHBondContact N-OG 3.01Å; T1136-S1139 PolarHBondContact O-N 3.18Å; T1136-S1139 PolarHBondContact O-OG 3.03Å; T1136-S1139 PolarHBondContact OG1-OG 2.82Å; T1136-S1139 VanDerWaalsContact OG1-OG 3.1Å; S1137-S1139 VanDerWaalsContact C-N 3.27Å; S1137-S1139 PolarHBondContact O-N 3.08Å; S1137-S1139 VanDerWaalsContact O-N 3.15Å; S1139-N1141 PolarHBondContact O-N 2.92Å; S1139-N1141 VanDerWaalsContact O-N 3.12Å; S1139-K1142 PolarHBondContact O-N 3.08Å; S1139-K1142 VanDerWaalsContact O-N 3.16Å; S1139-I1146 WeakPolarHBondContact O-CD1 3.36Å; S1139-I1146 WeakPolarHBondContact O-CG1 3.44Å
1140	Q	54.1	Low	69.6	Low	83.6 Å²	83.6	68.8 Å²	68.8	39%	0.391	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-26.9	-176.9	-87.5	177.1	-16.9	0	0	113.6	I1135 T1136 S1137 E1138	I1135-Q1140 HydrophobicContact CG2-CB 4.5Å; I1135-Q1140 HydrophobicContact CG2-CG 4.07Å; T1136-Q1140 PolarHBondContact O-N 3.04Å; S1137-Q1140 WeakPolarHBondContact O-CB 3.31Å; S1137-Q1140 PolarHBondContact O-N 3.19Å; E1138-Q1140 VanDerWaalsContact C-N 3.33Å
1141	N	55.3	Low	70	Confident	150.2 Å²	150.2	66.8 Å²	66.8	80%	0.803	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-2.4	-179.9	-65.9	-22.4	0	0	0	113.9	S1139	S1139-N1141 PolarHBondContact O-N 2.92Å; S1139-N1141 VanDerWaalsContact O-N 3.12Å
1142	K	65.9	Low	70.2	Confident	142.6 Å²	142.6	69.8 Å²	69.8	62%	0.62	36%	0.362	S	S	*	.			trans	-121	88.8	-178.3	-71.7	-174.4	178.5	179.6	0	110.7	S1139 D1144 L1145 I1146	S1139-K1142 PolarHBondContact O-N 3.08Å; S1139-K1142 VanDerWaalsContact O-N 3.16Å; K1142-D1144 PolarHBondContact O-N 2.98Å; K1142-D1144 VanDerWaalsContact O-N 3.14Å; K1142-L1145 HydrophobicContact CB-CB 4.05Å; K1142-L1145 WeakPolarHBondContact O-CB 3.32Å; K1142-L1145 PolarHBondContact O-N 2.95Å; K1142-I1146 WeakPolarHBondContact O-CG1 3.46Å; K1142-I1146 PolarHBondContact O-N 3.1Å; K1142-I1146 VanDerWaalsContact O-N 3.13Å
1143	M	66.4	Low	70.6	Confident	87.8 Å²	87.8	68.3 Å²	68.3	43%	0.433	35%	0.351	S	S	.	.	H	α-helix	trans	-52.4	-35.7	179.2	-77.6	-62.8	-66.4	0	0	113.6	L1145 I1146 R1147 R1268	M1143-L1145 VanDerWaalsContact C-N 3.32Å; M1143-L1145 PolarHBondContact O-N 3.13Å; M1143-I1146 CarbonylContact O-C 3.59Å; M1143-I1146 WeakPolarHBondContact O-CB 3.27Å; M1143-I1146 PolarHBondContact O-N 2.99Å; M1143-I1146 HydrophobicContact SD-CD1 4.19Å; M1143-R1147 WeakPolarHBondContact O-CB 3.13Å; M1143-R1147 PolarHBondContact O-N 3.08Å; M1143-R1268 PolarHBondContact SD-NH2 2.96Å
1144	D	68.6	Low	71.1	Confident	104.4 Å²	104.4	68.2 Å²	68.2	56%	0.558	35%	0.351	S	S	*	.	H	α-helix	trans	-65.5	-36.7	177.8	-79.2	-26.6	0	0	0	113.2	K1142 I1146 R1147 S1148	K1142-D1144 PolarHBondContact O-N 2.98Å; K1142-D1144 VanDerWaalsContact O-N 3.14Å; D1144-I1146 VanDerWaalsContact C-N 3.33Å; D1144-R1147 PolarHBondContact O-N 3.33Å; D1144-R1147 IonicContact OD1-CZ 3.82Å; D1144-R1147 VanDerWaalsContact OD1-CZ 3.31Å; D1144-R1147 IonicContact OD1-NE 3.67Å; D1144-R1147 PolarHBondContact OD1-NE 2.94Å; D1144-R1147 VanDerWaalsContact OD1-NE 3.15Å; D1144-R1147 IonicContact OD1-NH1 3.41Å; D1144-R1147 PolarHBondContact OD1-NH1 2.95Å; D1144-R1147 VanDerWaalsContact OD1-NH1 3.16Å; D1144-R1147 IonicContact OD1-NH2 3.29Å; D1144-R1147 PolarHBondContact OD1-NH2 2.82Å; D1144-S1148 VanDerWaalsContact O-CB 3.28Å; D1144-S1148 WeakPolarHBondContact O-CB 3.39Å; D1144-S1148 PolarHBondContact O-N 3.02Å
1145	L	70.8	Confident	71.8	Confident	95.4 Å²	95.4	63.7 Å²	63.7	50%	0.499	33%	0.33	S	S	.	.	H	α-helix	trans	-70.8	-36.1	176	-167.9	66.3	0	0	0	110.7	K1142 M1143 K1149	K1142-L1145 HydrophobicContact CB-CB 4.05Å; K1142-L1145 WeakPolarHBondContact O-CB 3.32Å; K1142-L1145 PolarHBondContact O-N 2.95Å; M1143-L1145 VanDerWaalsContact C-N 3.32Å; M1143-L1145 PolarHBondContact O-N 3.13Å; L1145-K1149 VanDerWaalsContact O-CB 3.28Å; L1145-K1149 WeakPolarHBondContact O-CB 3.29Å; L1145-K1149 PolarHBondContact O-N 3.1Å
1146	I	73.5	Confident	72.7	Confident	9.2 Å²	9.2	68 Å²	68	5%	0.047	35%	0.35	C	S	.	.	H	α-helix	trans	-64.3	-50.3	173.2	-61.3	177	0	0	0	110.3	L1008 I1135 S1139 K1142 M1143 D1144 S1148 K1149 I1150 I1265	L1008-I1146 HydrophobicContact CD1-CG2 4.4Å; I1135-I1146 HydrophobicContact CD1-CB 4.36Å; I1135-I1146 HydrophobicContact CD1-CD1 4.02Å; I1135-I1146 HydrophobicContact CD1-CG1 3.96Å; I1135-I1146 HydrophobicContact CD1-CG2 3.69Å; I1135-I1146 HydrophobicContact CG2-CG1 4.36Å; S1139-I1146 WeakPolarHBondContact O-CD1 3.36Å; S1139-I1146 WeakPolarHBondContact O-CG1 3.44Å; K1142-I1146 WeakPolarHBondContact O-CG1 3.46Å; K1142-I1146 PolarHBondContact O-N 3.1Å; K1142-I1146 VanDerWaalsContact O-N 3.13Å; M1143-I1146 CarbonylContact O-C 3.59Å; M1143-I1146 WeakPolarHBondContact O-CB 3.27Å; M1143-I1146 PolarHBondContact O-N 2.99Å; M1143-I1146 HydrophobicContact SD-CD1 4.19Å; D1144-I1146 VanDerWaalsContact C-N 3.33Å; I1146-S1148 PolarHBondContact O-N 3.22Å; I1146-K1149 WeakPolarHBondContact O-CB 3.21Å; I1146-K1149 PolarHBondContact O-N 3.15Å; I1146-K1149 VanDerWaalsContact O-N 3.14Å; I1146-I1150 HydrophobicContact CG2-CD1 3.77Å; I1146-I1150 HydrophobicContact CG2-CG1 4.36Å; I1146-I1150 VanDerWaalsContact O-CG1 3.27Å; I1146-I1150 WeakPolarHBondContact O-CG1 3.35Å; I1146-I1150 PolarHBondContact O-N 3.13Å; I1146-I1265 HydrophobicContact CG2-CD1 4.44Å
1147	R	76.4	Confident	73.7	Confident	29.6 Å²	29.6	67.2 Å²	67.2	11%	0.112	34%	0.339	C	S	.	.	H	α-helix	trans	-56.2	-52	176.7	172.1	174.8	-48.8	146.1	-7.1	111.2	M1143 D1144 K1149 I1150 E1151 N1213 D1228 N1231 Y1263	M1143-R1147 WeakPolarHBondContact O-CB 3.13Å; M1143-R1147 PolarHBondContact O-N 3.08Å; D1144-R1147 PolarHBondContact O-N 3.33Å; D1144-R1147 IonicContact OD1-CZ 3.82Å; D1144-R1147 VanDerWaalsContact OD1-CZ 3.31Å; D1144-R1147 IonicContact OD1-NE 3.67Å; D1144-R1147 PolarHBondContact OD1-NE 2.94Å; D1144-R1147 VanDerWaalsContact OD1-NE 3.15Å; D1144-R1147 IonicContact OD1-NH1 3.41Å; D1144-R1147 PolarHBondContact OD1-NH1 2.95Å; D1144-R1147 VanDerWaalsContact OD1-NH1 3.16Å; D1144-R1147 IonicContact OD1-NH2 3.29Å; D1144-R1147 PolarHBondContact OD1-NH2 2.82Å; R1147-K1149 VanDerWaalsContact C-N 3.29Å; R1147-K1149 PolarHBondContact O-N 3.03Å; R1147-I1150 WeakPolarHBondContact O-CB 3.47Å; R1147-I1150 PolarHBondContact O-N 3.01Å; R1147-I1150 VanDerWaalsContact O-N 3.16Å; R1147-E1151 WeakPolarHBondContact CD-OE1 3.12Å; R1147-E1151 HydrophobicContact CG-CG 4.32Å; R1147-E1151 VanDerWaalsContact CG-OE1 3.23Å; R1147-E1151 WeakPolarHBondContact CG-OE1 3.37Å; R1147-E1151 WeakPolarHBondContact O-CG 3.23Å; R1147-E1151 PolarHBondContact O-N 3.33Å; R1147-N1213 VanDerWaalsContact NH1-CG 3.29Å; R1147-N1213 PolarHBondContact NH1-OD1 2.85Å; R1147-D1228 IonicContact CZ-OD1 2.64Å; R1147-D1228 IonicContact CZ-OD2 3.63Å; R1147-D1228 IonicContact NH1-OD1 2.89Å; R1147-D1228 PolarHBondContact NH1-OD1 2.97Å; R1147-D1228 IonicContact NH1-OD2 3.63Å; R1147-D1228 PolarHBondContact NH1-OD2 2.83Å; R1147-D1228 IonicContact NH2-OD1 3.37Å; R1147-D1228 PolarHBondContact NH2-OD1 3.32Å; R1147-D1228 VanDerWaalsContact NH2-OD1 3.16Å; R1147-D1228 IonicContact NH2-OD2 3.1Å; R1147-D1228 PolarHBondContact NH2-OD2 3.27Å; R1147-D1228 VanDerWaalsContact NH2-OD2 3.08Å; R1147-N1231 PolarHBondContact NE-OD1 3.35Å; R1147-N1231 PolarHBondContact NH2-OD1 3.08Å; R1147-Y1263 WeakPolarHBondContact CG-OH 3.43Å
1148	S	79	Confident	75.1	Confident	57.8 Å²	57.8	64.4 Å²	64.4	40%	0.404	32%	0.32	S	S	.	.	H	α-helix	trans	-59.6	-37.9	178.3	-178.5	0	0	0	0	112	D1144 I1146 T1152	D1144-S1148 VanDerWaalsContact O-CB 3.28Å; D1144-S1148 WeakPolarHBondContact O-CB 3.39Å; D1144-S1148 PolarHBondContact O-N 3.02Å; I1146-S1148 PolarHBondContact O-N 3.22Å; S1148-T1152 VanDerWaalsContact O-CB 3.29Å; S1148-T1152 WeakPolarHBondContact O-CB 3.32Å; S1148-T1152 WeakPolarHBondContact O-CG2 3.33Å; S1148-T1152 PolarHBondContact O-N 3.24Å; S1148-T1152 PolarHBondContact O-OG1 2.95Å
1149	K	82.1	Confident	76.5	Confident	62.8 Å²	62.8	56.3 Å²	56.3	27%	0.273	28%	0.281	S	S	.	.	H	α-helix	trans	-66.4	-44.2	174.8	-172.7	170.5	-175.1	172.3	0	112.5	I1133 Q1134 L1145 I1146 R1147 E1151 T1152 E1153	I1133-K1149 HydrophobicContact CG2-CD 4.26Å; I1133-K1149 HydrophobicContact CG2-CG 4.29Å; Q1134-K1149 WeakPolarHBondContact O-CE 3.4Å; Q1134-K1149 PolarHBondContact O-NZ 2.8Å; L1145-K1149 VanDerWaalsContact O-CB 3.28Å; L1145-K1149 WeakPolarHBondContact O-CB 3.29Å; L1145-K1149 PolarHBondContact O-N 3.1Å; I1146-K1149 WeakPolarHBondContact O-CB 3.21Å; I1146-K1149 PolarHBondContact O-N 3.15Å; I1146-K1149 VanDerWaalsContact O-N 3.14Å; R1147-K1149 VanDerWaalsContact C-N 3.29Å; R1147-K1149 PolarHBondContact O-N 3.03Å; K1149-E1151 PolarHBondContact O-N 2.97Å; K1149-T1152 WeakPolarHBondContact CA-OG1 3.34Å; K1149-T1152 PolarHBondContact O-N 3Å; K1149-T1152 PolarHBondContact O-OG1 2.86Å; K1149-E1153 WeakPolarHBondContact CE-OE1 3.38Å; K1149-E1153 WeakPolarHBondContact CE-OE2 3.49Å; K1149-E1153 HydrophobicContact CG-CG 4.27Å; K1149-E1153 IonicContact NZ-OE1 3.53Å; K1149-E1153 PolarHBondContact NZ-OE1 2.98Å; K1149-E1153 WeakPolarHBondContact O-CB 3.22Å; K1149-E1153 WeakPolarHBondContact O-CG 3.32Å; K1149-E1153 PolarHBondContact O-N 3Å
1150	I	83.8	Confident	77.7	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-58.4	-49.4	176.2	-67.2	166.6	0	0	0	111	V1010 I1133 I1146 R1147 F1154 Y1263 I1265	V1010-I1150 HydrophobicContact CG1-CG2 3.97Å; V1010-I1150 HydrophobicContact CG2-CD1 4.16Å; V1010-I1150 HydrophobicContact CG2-CG1 4.28Å; I1133-I1150 HydrophobicContact CD1-CB 4.04Å; I1133-I1150 HydrophobicContact CD1-CG1 3.66Å; I1133-I1150 HydrophobicContact CD1-CG2 4.13Å; I1146-I1150 HydrophobicContact CG2-CD1 3.77Å; I1146-I1150 HydrophobicContact CG2-CG1 4.36Å; I1146-I1150 VanDerWaalsContact O-CG1 3.27Å; I1146-I1150 WeakPolarHBondContact O-CG1 3.35Å; I1146-I1150 PolarHBondContact O-N 3.13Å; R1147-I1150 WeakPolarHBondContact O-CB 3.47Å; R1147-I1150 PolarHBondContact O-N 3.01Å; R1147-I1150 VanDerWaalsContact O-N 3.16Å; I1150-F1154 VanDerWaalsContact O-CB 3.23Å; I1150-F1154 WeakPolarHBondContact O-CB 3.28Å; I1150-F1154 PolarHBondContact O-N 3.05Å; I1150-F1154 VanDerWaalsContact O-N 3.13Å; I1150-Y1263 HydrophobicContact CB-CE2 4.43Å; I1150-Y1263 HydrophobicContact CD1-CD2 4.36Å; I1150-Y1263 HydrophobicContact CD1-CE2 3.72Å; I1150-Y1263 HydrophobicContact CG2-CD1 4.39Å; I1150-Y1263 HydrophobicContact CG2-CD2 3.84Å; I1150-Y1263 HydrophobicContact CG2-CE1 4.38Å; I1150-Y1263 HydrophobicContact CG2-CE2 3.9Å; I1150-Y1263 HydrophobicContact CG2-CG 4.1Å; I1150-I1265 HydrophobicContact CD1-CD1 3.94Å; I1150-I1265 HydrophobicContact CD1-CG1 4.21Å
1151	E	85.6	Confident	78.8	Confident	15.8 Å²	15.8	55.2 Å²	55.2	7%	0.074	28%	0.278	C	S	.	.	H	α-helix	trans	-62.9	-48.5	178.7	-69	171.4	-166.6	0	0	111.2	R1147 K1149 F1154 I1155 I1210 S1211 K1212 N1213 Y1263	R1147-E1151 WeakPolarHBondContact CD-OE1 3.12Å; R1147-E1151 HydrophobicContact CG-CG 4.32Å; R1147-E1151 VanDerWaalsContact CG-OE1 3.23Å; R1147-E1151 WeakPolarHBondContact CG-OE1 3.37Å; R1147-E1151 WeakPolarHBondContact O-CG 3.23Å; R1147-E1151 PolarHBondContact O-N 3.33Å; K1149-E1151 PolarHBondContact O-N 2.97Å; E1151-F1154 PolarHBondContact O-N 2.97Å; E1151-I1155 WeakPolarHBondContact O-CB 3.37Å; E1151-I1155 VanDerWaalsContact O-CD1 3.31Å; E1151-I1155 WeakPolarHBondContact O-CD1 3.34Å; E1151-I1155 WeakPolarHBondContact O-CG1 3.32Å; E1151-I1155 PolarHBondContact O-N 3.01Å; E1151-I1210 HydrophobicContact CB-CG2 4Å; E1151-I1210 VanDerWaalsContact CD-O 3.29Å; E1151-I1210 HydrophobicContact CG-CG2 4.17Å; E1151-I1210 VanDerWaalsContact CG-O 3.29Å; E1151-I1210 WeakPolarHBondContact CG-O 3.3Å; E1151-S1211 WeakPolarHBondContact CB-OG 3.23Å; E1151-S1211 VanDerWaalsContact OE2-CA 3.31Å; E1151-S1211 WeakPolarHBondContact OE2-CA 3.39Å; E1151-S1211 PolarHBondContact OE2-OG 3.15Å; E1151-K1212 PolarHBondContact OE2-N 3.4Å; E1151-N1213 PolarHBondContact OE1-ND2 2.83Å; E1151-Y1263 HydrophobicContact CG-CE1 4.47Å
1152	T	84.4	Confident	79.9	Confident	79 Å²	79	48.4 Å²	48.4	49%	0.485	24%	0.241	S	C	.	.	H	α-helix	trans	-68.4	-44	-175.6	-15.5	0	0	0	0	113.2	S1148 K1149 I1155 Q1156	S1148-T1152 VanDerWaalsContact O-CB 3.29Å; S1148-T1152 WeakPolarHBondContact O-CB 3.32Å; S1148-T1152 WeakPolarHBondContact O-CG2 3.33Å; S1148-T1152 PolarHBondContact O-N 3.24Å; S1148-T1152 PolarHBondContact O-OG1 2.95Å; K1149-T1152 WeakPolarHBondContact CA-OG1 3.34Å; K1149-T1152 PolarHBondContact O-N 3Å; K1149-T1152 PolarHBondContact O-OG1 2.86Å; T1152-I1155 PolarHBondContact O-N 2.91Å; T1152-Q1156 WeakPolarHBondContact O-CB 3.3Å; T1152-Q1156 PolarHBondContact O-N 3.06Å; T1152-Q1156 VanDerWaalsContact O-N 3.08Å
1153	E	85.1	Confident	80.1	Confident	82 Å²	82	43.2 Å²	43.2	38%	0.383	22%	0.221	S	C	.	.	H	α-helix	trans	-66.9	-38.6	177.6	-73.6	-171.1	174.1	0	0	111.4	I1133 K1149 Q1156 W1157	I1133-E1153 WeakPolarHBondContact CG2-OE2 3.35Å; K1149-E1153 WeakPolarHBondContact CE-OE1 3.38Å; K1149-E1153 WeakPolarHBondContact CE-OE2 3.49Å; K1149-E1153 HydrophobicContact CG-CG 4.27Å; K1149-E1153 IonicContact NZ-OE1 3.53Å; K1149-E1153 PolarHBondContact NZ-OE1 2.98Å; K1149-E1153 WeakPolarHBondContact O-CB 3.22Å; K1149-E1153 WeakPolarHBondContact O-CG 3.32Å; K1149-E1153 PolarHBondContact O-N 3Å; E1153-Q1156 PolarHBondContact O-N 3.11Å; E1153-W1157 VanDerWaalsContact O-CB 3.28Å; E1153-W1157 WeakPolarHBondContact O-CB 3.36Å; E1153-W1157 PolarHBondContact O-N 3.12Å
1154	F	88.7	Confident	79.9	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.009	23%	0.225	C	C	.	.	H	α-helix	trans	-69.2	-42.5	177.1	-177	-114.3	0	0	0	112.8	H1012 I1014 L1129 T1131 I1150 E1151 Q1156 W1157 I1158 I1210 Y1261	H1012-F1154 HydrophobicContact CB-CD1 4.44Å; H1012-F1154 HydrophobicContact CB-CD2 4.21Å; H1012-F1154 HydrophobicContact CB-CE1 3.96Å; H1012-F1154 HydrophobicContact CB-CE2 3.67Å; H1012-F1154 HydrophobicContact CB-CZ 3.52Å; H1012-F1154 VanDerWaalsContact CB-CZ 3.48Å; H1012-F1154 AromaticContact CD2-CD2 3.67Å; H1012-F1154 AromaticContact CD2-CE2 3.83Å; H1012-F1154 VanDerWaalsContact CE1-CB 3.44Å; H1012-F1154 WeakPolarHBondContact CE1-CB 3.34Å; H1012-F1154 AromaticContact CE1-CD1 3.87Å; H1012-F1154 AromaticContact CE1-CD2 3.71Å; H1012-F1154 AromaticContact CE1-CG 3.38Å; H1012-F1154 VanDerWaalsContact CE1-CG 3.46Å; H1012-F1154 WeakPolarHBondContact CE1-CG 3.38Å; H1012-F1154 AromaticContact CG-CD1 3.89Å; H1012-F1154 AromaticContact CG-CD2 3.59Å; H1012-F1154 AromaticContact CG-CE1 3.95Å; H1012-F1154 AromaticContact CG-CE2 3.58Å; H1012-F1154 AromaticContact CG-CG 3.81Å; H1012-F1154 AromaticContact CG-CZ 3.79Å; H1012-F1154 AromaticContact ND1-CD1 3.4Å; H1012-F1154 WeakPolarHBondContact ND1-CD1 3.41Å; H1012-F1154 AromaticContact ND1-CD2 3.63Å; H1012-F1154 AromaticContact ND1-CE1 3.75Å; H1012-F1154 AromaticContact ND1-CE2 3.95Å; H1012-F1154 AromaticContact ND1-CG 3.33Å; H1012-F1154 VanDerWaalsContact ND1-CG 3.34Å; H1012-F1154 WeakPolarHBondContact ND1-CG 3.3Å; H1012-F1154 AromaticContact ND1-CZ 3.92Å; H1012-F1154 AromaticContact NE2-CD2 3.75Å; H1012-F1154 AromaticContact NE2-CG 3.88Å; I1014-F1154 HydrophobicContact CD1-CE1 3.8Å; I1014-F1154 HydrophobicContact CD1-CZ 3.77Å; I1014-F1154 HydrophobicContact CG1-CE1 4.46Å; I1014-F1154 HydrophobicContact CG1-CZ 4.49Å; L1129-F1154 HydrophobicContact CB-CE2 4.46Å; L1129-F1154 HydrophobicContact CD1-CE2 4.18Å; L1129-F1154 HydrophobicContact CD1-CZ 4.25Å; T1131-F1154 HydrophobicContact CG2-CD2 4.09Å; I1150-F1154 VanDerWaalsContact O-CB 3.23Å; I1150-F1154 WeakPolarHBondContact O-CB 3.28Å; I1150-F1154 PolarHBondContact O-N 3.05Å; I1150-F1154 VanDerWaalsContact O-N 3.13Å; E1151-F1154 PolarHBondContact O-N 2.97Å; F1154-Q1156 VanDerWaalsContact C-N 3.33Å; F1154-Q1156 PolarHBondContact O-N 3.14Å; F1154-W1157 AromaticContact CD2-CE3 3.97Å; F1154-W1157 HydrophobicContact CD2-CE3 3.98Å; F1154-W1157 HydrophobicContact CD2-CZ3 4.42Å; F1154-W1157 AromaticContact CE2-CE3 3.9Å; F1154-W1157 HydrophobicContact CE2-CE3 3.9Å; F1154-W1157 AromaticContact CE2-CZ3 3.87Å; F1154-W1157 HydrophobicContact CE2-CZ3 3.87Å; F1154-W1157 PolarHBondContact O-N 3.15Å; F1154-I1158 HydrophobicContact CE1-CD1 4.4Å; F1154-I1158 HydrophobicContact CE2-CD1 4.45Å; F1154-I1158 HydrophobicContact CZ-CD1 4.02Å; F1154-I1158 WeakPolarHBondContact O-CB 3.3Å; F1154-I1158 WeakPolarHBondContact O-CG2 3.34Å; F1154-I1158 PolarHBondContact O-N 3.17Å; F1154-I1210 HydrophobicContact CD1-CD1 3.95Å; F1154-I1210 HydrophobicContact CD1-CG1 4.45Å; F1154-I1210 HydrophobicContact CD1-CG2 4.33Å; F1154-I1210 HydrophobicContact CE1-CD1 4Å; F1154-I1210 HydrophobicContact CE1-CG1 4.5Å; F1154-Y1261 AromaticContact CD1-CE2 3.85Å; F1154-Y1261 HydrophobicContact CD1-CE2 3.85Å; F1154-Y1261 AromaticContact CD1-CZ 4Å; F1154-Y1261 HydrophobicContact CE1-CD2 4.19Å; F1154-Y1261 AromaticContact CE1-CE2 3.51Å; F1154-Y1261 HydrophobicContact CE1-CE2 3.51Å; F1154-Y1261 VanDerWaalsContact CE1-CE2 3.45Å; F1154-Y1261 HydrophobicContact CZ-CE2 4.41Å
1155	I	87.8	Confident	79.3	Confident	20 Å²	20	43.2 Å²	43.2	10%	0.103	22%	0.22	C	C	.	.	H	α-helix	trans	-55.9	-50.8	172.2	-73.9	164.5	0	0	0	110.1	E1151 T1152 W1157 I1158 L1159 C1207 I1210 S1211	E1151-I1155 WeakPolarHBondContact O-CB 3.37Å; E1151-I1155 VanDerWaalsContact O-CD1 3.31Å; E1151-I1155 WeakPolarHBondContact O-CD1 3.34Å; E1151-I1155 WeakPolarHBondContact O-CG1 3.32Å; E1151-I1155 PolarHBondContact O-N 3.01Å; T1152-I1155 PolarHBondContact O-N 2.91Å; I1155-W1157 VanDerWaalsContact C-N 3.33Å; I1155-W1157 PolarHBondContact O-N 3.21Å; I1155-I1158 WeakPolarHBondContact O-CG2 3.31Å; I1155-I1158 PolarHBondContact O-N 2.86Å; I1155-L1159 HydrophobicContact CG2-CD1 3.58Å; I1155-L1159 HydrophobicContact CG2-CG 4.4Å; I1155-L1159 WeakPolarHBondContact O-CB 3.34Å; I1155-L1159 WeakPolarHBondContact O-CD1 3.35Å; I1155-L1159 VanDerWaalsContact O-CG 3.23Å; I1155-L1159 WeakPolarHBondContact O-CG 3.38Å; I1155-L1159 PolarHBondContact O-N 3.12Å; I1155-L1159 VanDerWaalsContact O-N 3.09Å; I1155-C1207 VanDerWaalsContact CG2-SG 3.57Å; I1155-I1210 HydrophobicContact CD1-CB 3.81Å; I1155-I1210 HydrophobicContact CD1-CG2 3.71Å; I1155-I1210 HydrophobicContact CG1-CB 3.64Å; I1155-I1210 HydrophobicContact CG1-CD1 3.77Å; I1155-I1210 HydrophobicContact CG1-CG1 4.32Å; I1155-I1210 HydrophobicContact CG1-CG2 3.51Å; I1155-I1210 VanDerWaalsContact CG1-CG2 3.46Å; I1155-S1211 WeakPolarHBondContact CD1-OG 3.36Å
1156	Q	85	Confident	78.3	Confident	94 Å²	94	39.4 Å²	39.4	44%	0.439	20%	0.201	S	C	.	.	H	α-helix	trans	-65.5	-38.7	-177.3	-174.1	54.3	77.6	0	0	111.8	T1152 E1153 F1154 D1160	T1152-Q1156 WeakPolarHBondContact O-CB 3.3Å; T1152-Q1156 PolarHBondContact O-N 3.06Å; T1152-Q1156 VanDerWaalsContact O-N 3.08Å; E1153-Q1156 PolarHBondContact O-N 3.11Å; F1154-Q1156 VanDerWaalsContact C-N 3.33Å; F1154-Q1156 PolarHBondContact O-N 3.14Å; Q1156-D1160 PolarHBondContact NE2-OD1 2.94Å; Q1156-D1160 VanDerWaalsContact O-CB 3.29Å; Q1156-D1160 WeakPolarHBondContact O-CB 3.34Å; Q1156-D1160 PolarHBondContact O-N 3.41Å; Q1156-D1160 VanDerWaalsContact O-N 3.15Å
1157	W	86.9	Confident	76.9	Confident	54.2 Å²	54.2	47 Å²	47	21%	0.205	23%	0.234	C	C	.	.	H	α-helix	trans	-67	-47.1	177	174.1	86.9	0	0	0	112.3	P1054 T1057 L1129 E1153 F1154 I1155 L1159 D1160 M1161	P1054-W1157 HydrophobicContact CB-CH2 3.97Å; P1054-W1157 HydrophobicContact CB-CZ2 4.3Å; P1054-W1157 HydrophobicContact CB-CZ3 4.43Å; P1054-W1157 HydrophobicContact CG-CH2 4.18Å; P1054-W1157 HydrophobicContact CG-CZ3 4.4Å; T1057-W1157 HydrophobicContact CG2-CH2 4.07Å; T1057-W1157 HydrophobicContact CG2-CZ2 4.07Å; T1057-W1157 PolarHBondContact O-NE1 3.17Å; L1129-W1157 HydrophobicContact CD1-CH2 3.97Å; L1129-W1157 HydrophobicContact CD1-CZ3 3.78Å; L1129-W1157 HydrophobicContact CD2-CH2 4.29Å; L1129-W1157 HydrophobicContact CG-CH2 4.46Å; E1153-W1157 VanDerWaalsContact O-CB 3.28Å; E1153-W1157 WeakPolarHBondContact O-CB 3.36Å; E1153-W1157 PolarHBondContact O-N 3.12Å; F1154-W1157 AromaticContact CD2-CE3 3.97Å; F1154-W1157 HydrophobicContact CD2-CE3 3.98Å; F1154-W1157 HydrophobicContact CD2-CZ3 4.42Å; F1154-W1157 AromaticContact CE2-CE3 3.9Å; F1154-W1157 HydrophobicContact CE2-CE3 3.9Å; F1154-W1157 AromaticContact CE2-CZ3 3.87Å; F1154-W1157 HydrophobicContact CE2-CZ3 3.87Å; F1154-W1157 PolarHBondContact O-N 3.15Å; I1155-W1157 VanDerWaalsContact C-N 3.33Å; I1155-W1157 PolarHBondContact O-N 3.21Å; W1157-L1159 VanDerWaalsContact C-N 3.35Å; W1157-L1159 PolarHBondContact O-N 3.25Å; W1157-D1160 PolarHBondContact O-N 3.01Å; W1157-M1161 HydrophobicContact CD2-CG 4.28Å; W1157-M1161 HydrophobicContact CE3-CG 4.28Å; W1157-M1161 HydrophobicContact CH2-CG 4.17Å; W1157-M1161 HydrophobicContact CZ2-CE 3.8Å; W1157-M1161 HydrophobicContact CZ2-CG 3.67Å; W1157-M1161 HydrophobicContact CZ2-SD 4.25Å; W1157-M1161 HydrophobicContact CZ3-CG 4.2Å; W1157-M1161 WeakPolarHBondContact O-CG 3.42Å; W1157-M1161 PolarHBondContact O-N 2.88Å
1158	I	86.9	Confident	75.5	Confident	1.2 Å²	1.2	53.4 Å²	53.4	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-69.1	-39.5	-176.4	-161.6	169	0	0	0	111.5	I1014 F1053 L1129 F1154 I1155 D1160 M1161 L1162 I1210	I1014-I1158 HydrophobicContact CD1-CD1 3.45Å; I1014-I1158 VanDerWaalsContact CD1-CD1 3.47Å; F1053-I1158 HydrophobicContact CE1-CD1 4.29Å; F1053-I1158 HydrophobicContact CE2-CD1 4.28Å; F1053-I1158 HydrophobicContact CZ-CD1 3.79Å; L1129-I1158 HydrophobicContact CD1-CD1 4.42Å; F1154-I1158 HydrophobicContact CE1-CD1 4.4Å; F1154-I1158 HydrophobicContact CE2-CD1 4.45Å; F1154-I1158 HydrophobicContact CZ-CD1 4.02Å; F1154-I1158 WeakPolarHBondContact O-CB 3.3Å; F1154-I1158 WeakPolarHBondContact O-CG2 3.34Å; F1154-I1158 PolarHBondContact O-N 3.17Å; I1155-I1158 WeakPolarHBondContact O-CG2 3.31Å; I1155-I1158 PolarHBondContact O-N 2.86Å; I1158-D1160 VanDerWaalsContact C-N 3.33Å; I1158-D1160 PolarHBondContact O-N 3.1Å; I1158-M1161 WeakPolarHBondContact O-CB 3.29Å; I1158-M1161 PolarHBondContact O-N 2.93Å; I1158-L1162 HydrophobicContact CG1-CD1 4.27Å; I1158-L1162 HydrophobicContact CG1-CG 4.4Å; I1158-L1162 WeakPolarHBondContact O-CB 3.34Å; I1158-L1162 VanDerWaalsContact O-CG 3.27Å; I1158-L1162 WeakPolarHBondContact O-CG 3.36Å; I1158-L1162 PolarHBondContact O-N 3.01Å; I1158-I1210 HydrophobicContact CG2-CD1 4.41Å
1159	L	84.4	Confident	73.9	Confident	0.6 Å²	0.6	53.2 Å²	53.2	0%	0.003	26%	0.264	C	S	.	.	H	α-helix	trans	-63.9	-41.1	174.8	-69.4	169.1	0	0	0	111.6	I1155 W1157 M1161 L1162 T1163 R1176 E1203 L1206	I1155-L1159 HydrophobicContact CG2-CD1 3.58Å; I1155-L1159 HydrophobicContact CG2-CG 4.4Å; I1155-L1159 WeakPolarHBondContact O-CB 3.34Å; I1155-L1159 WeakPolarHBondContact O-CD1 3.35Å; I1155-L1159 VanDerWaalsContact O-CG 3.23Å; I1155-L1159 WeakPolarHBondContact O-CG 3.38Å; I1155-L1159 PolarHBondContact O-N 3.12Å; I1155-L1159 VanDerWaalsContact O-N 3.09Å; W1157-L1159 VanDerWaalsContact C-N 3.35Å; W1157-L1159 PolarHBondContact O-N 3.25Å; L1159-M1161 VanDerWaalsContact C-N 3.32Å; L1159-M1161 PolarHBondContact O-N 2.85Å; L1159-L1162 PolarHBondContact O-N 2.98Å; L1159-T1163 WeakPolarHBondContact O-CB 3.35Å; L1159-T1163 WeakPolarHBondContact O-CG2 3.41Å; L1159-T1163 PolarHBondContact O-N 2.8Å; L1159-T1163 PolarHBondContact O-OG1 3.05Å; L1159-R1176 HydrophobicContact CD2-CB 4.36Å; L1159-E1203 HydrophobicContact CD1-CG 3.67Å; L1159-E1203 WeakPolarHBondContact CD1-OE1 3.3Å; L1159-E1203 HydrophobicContact CD2-CB 3.97Å; L1159-E1203 HydrophobicContact CD2-CG 3.88Å; L1159-E1203 HydrophobicContact CG-CG 4.45Å; L1159-L1206 HydrophobicContact CD2-CB 4.46Å; L1159-L1206 HydrophobicContact CD2-CD1 3.91Å
1160	D	80.4	Confident	71.9	Confident	52.6 Å²	52.6	53.6 Å²	53.6	28%	0.281	27%	0.269	S	S	.	.	H	α-helix	trans	-64.9	-39	175.6	-161.1	48.5	0	0	0	111.6	Q1156 W1157 I1158 L1162 T1163 R1164 R1176	Q1156-D1160 PolarHBondContact NE2-OD1 2.94Å; Q1156-D1160 VanDerWaalsContact O-CB 3.29Å; Q1156-D1160 WeakPolarHBondContact O-CB 3.34Å; Q1156-D1160 PolarHBondContact O-N 3.41Å; Q1156-D1160 VanDerWaalsContact O-N 3.15Å; W1157-D1160 PolarHBondContact O-N 3.01Å; I1158-D1160 VanDerWaalsContact C-N 3.33Å; I1158-D1160 PolarHBondContact O-N 3.1Å; D1160-L1162 VanDerWaalsContact C-N 3.35Å; D1160-L1162 PolarHBondContact O-N 2.76Å; D1160-T1163 WeakPolarHBondContact CA-OG1 3.37Å; D1160-T1163 PolarHBondContact O-N 3.08Å; D1160-T1163 PolarHBondContact O-OG1 3.17Å; D1160-T1163 VanDerWaalsContact O-OG1 3.1Å; D1160-R1164 WeakPolarHBondContact O-CB 3.44Å; D1160-R1164 VanDerWaalsContact O-CG 3.27Å; D1160-R1164 WeakPolarHBondContact O-CG 3.35Å; D1160-R1164 PolarHBondContact O-N 3.15Å; D1160-R1164 VanDerWaalsContact O-N 3.13Å; D1160-R1164 PolarHBondContact O-NE 2.83Å; D1160-R1164 PolarHBondContact O-NH2 3.41Å; D1160-R1164 IonicContact OD1-CZ 3.04Å; D1160-R1164 IonicContact OD1-NE 3.08Å; D1160-R1164 PolarHBondContact OD1-NE 3.22Å; D1160-R1164 IonicContact OD1-NH2 3.32Å; D1160-R1164 IonicContact OD2-CZ 3.31Å; D1160-R1164 VanDerWaalsContact OD2-CZ 3.23Å; D1160-R1164 IonicContact OD2-NE 3.16Å; D1160-R1164 PolarHBondContact OD2-NE 3.01Å; D1160-R1164 VanDerWaalsContact OD2-NE 3.09Å; D1160-R1164 IonicContact OD2-NH2 3Å; D1160-R1164 PolarHBondContact OD2-NH2 3.09Å; D1160-R1176 IonicContact OD1-CZ 3.98Å; D1160-R1176 IonicContact OD1-NH2 3.74Å; D1160-R1176 PolarHBondContact OD1-NH2 3.46Å
1161	M	78.4	Confident	70.1	Confident	17.4 Å²	17.4	62.8 Å²	62.8	9%	0.086	31%	0.309	C	S	.	.	H	α-helix	trans	-64.2	-45.2	174.3	-92.2	-51.1	112.2	0	0	112.8	P1054 A1059 L1062 W1157 I1158 L1159 R1164	P1054-M1161 HydrophobicContact CB-CG 4.22Å; P1054-M1161 HydrophobicContact CG-CB 4.05Å; P1054-M1161 HydrophobicContact CG-CG 4.06Å; A1059-M1161 VanDerWaalsContact CA-SD 3.53Å; A1059-M1161 HydrophobicContact CB-CE 3.68Å; A1059-M1161 HydrophobicContact CB-SD 3.31Å; A1059-M1161 WeakPolarHBondContact CB-SD 3.19Å; A1059-M1161 WeakPolarHBondContact O-CE 3.29Å; L1062-M1161 HydrophobicContact CD2-CG 3.87Å; W1157-M1161 HydrophobicContact CD2-CG 4.28Å; W1157-M1161 HydrophobicContact CE3-CG 4.28Å; W1157-M1161 HydrophobicContact CH2-CG 4.17Å; W1157-M1161 HydrophobicContact CZ2-CE 3.8Å; W1157-M1161 HydrophobicContact CZ2-CG 3.67Å; W1157-M1161 HydrophobicContact CZ2-SD 4.25Å; W1157-M1161 HydrophobicContact CZ3-CG 4.2Å; W1157-M1161 WeakPolarHBondContact O-CG 3.42Å; W1157-M1161 PolarHBondContact O-N 2.88Å; I1158-M1161 WeakPolarHBondContact O-CB 3.29Å; I1158-M1161 PolarHBondContact O-N 2.93Å; L1159-M1161 VanDerWaalsContact C-N 3.32Å; L1159-M1161 PolarHBondContact O-N 2.85Å; M1161-R1164 VanDerWaalsContact CE-CZ 3.46Å; M1161-R1164 VanDerWaalsContact CE-NH2 3.29Å; M1161-R1164 PolarHBondContact O-N 3.13Å
1162	L	78.3	Confident	68.1	Low	6.4 Å²	6.4	66.8 Å²	66.8	3%	0.034	33%	0.33	C	S	.	.	H	α-helix	trans	-67.5	-40.3	179.4	-66.3	174.2	0	0	0	111.7	L1062 I1158 L1159 D1160 R1164 A1165 G1177 L1178 L1206	L1062-L1162 HydrophobicContact CD1-CD2 4.31Å; I1158-L1162 HydrophobicContact CG1-CD1 4.27Å; I1158-L1162 HydrophobicContact CG1-CG 4.4Å; I1158-L1162 WeakPolarHBondContact O-CB 3.34Å; I1158-L1162 VanDerWaalsContact O-CG 3.27Å; I1158-L1162 WeakPolarHBondContact O-CG 3.36Å; I1158-L1162 PolarHBondContact O-N 3.01Å; L1159-L1162 PolarHBondContact O-N 2.98Å; D1160-L1162 VanDerWaalsContact C-N 3.35Å; D1160-L1162 PolarHBondContact O-N 2.76Å; L1162-R1164 VanDerWaalsContact C-N 3.3Å; L1162-R1164 PolarHBondContact O-N 3.18Å; L1162-A1165 WeakPolarHBondContact O-CB 3.26Å; L1162-A1165 PolarHBondContact O-N 3.06Å; L1162-G1177 WeakPolarHBondContact CB-O 3.31Å; L1162-L1178 HydrophobicContact CD1-CB 4.1Å; L1162-L1178 HydrophobicContact CD1-CD1 4.43Å; L1162-L1178 HydrophobicContact CD2-CD1 3.72Å; L1162-L1206 HydrophobicContact CD1-CD1 4.05Å
1163	T	70.1	Confident	66.4	Low	34.6 Å²	34.6	71 Å²	71	21%	0.212	35%	0.35	C	S	.	.	H	α-helix	trans	-65.3	-31.3	177.4	16.9	0	0	0	0	113.2	L1159 D1160 A1165 D1166 F1167 R1176	L1159-T1163 WeakPolarHBondContact O-CB 3.35Å; L1159-T1163 WeakPolarHBondContact O-CG2 3.41Å; L1159-T1163 PolarHBondContact O-N 2.8Å; L1159-T1163 PolarHBondContact O-OG1 3.05Å; D1160-T1163 WeakPolarHBondContact CA-OG1 3.37Å; D1160-T1163 PolarHBondContact O-N 3.08Å; D1160-T1163 PolarHBondContact O-OG1 3.17Å; D1160-T1163 VanDerWaalsContact O-OG1 3.1Å; T1163-A1165 PolarHBondContact O-N 3.03Å; T1163-D1166 PolarHBondContact O-N 3.15Å; T1163-F1167 HydrophobicContact CG2-CE2 4.14Å; T1163-F1167 WeakPolarHBondContact O-CD2 3.39Å; T1163-F1167 VanDerWaalsContact O-CE2 3.28Å; T1163-F1167 WeakPolarHBondContact O-CE2 3.32Å; T1163-R1176 HydrophobicContact CG2-CB 3.54Å; T1163-R1176 HydrophobicContact CG2-CG 3.76Å; T1163-R1176 VanDerWaalsContact CG2-CG 3.45Å; T1163-R1176 WeakPolarHBondContact OG1-CG 3.41Å; T1163-R1176 PolarHBondContact OG1-NE 2.8Å
1164	R	62.7	Low	64.6	Low	135.8 Å²	135.8	71.2 Å²	71.2	51%	0.512	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-17.8	177.4	-76.1	176.3	-144.8	-157.3	7.3	113.7	D1160 M1161 L1162 D1166 F1167	D1160-R1164 WeakPolarHBondContact O-CB 3.44Å; D1160-R1164 VanDerWaalsContact O-CG 3.27Å; D1160-R1164 WeakPolarHBondContact O-CG 3.35Å; D1160-R1164 PolarHBondContact O-N 3.15Å; D1160-R1164 VanDerWaalsContact O-N 3.13Å; D1160-R1164 PolarHBondContact O-NE 2.83Å; D1160-R1164 PolarHBondContact O-NH2 3.41Å; D1160-R1164 IonicContact OD1-CZ 3.04Å; D1160-R1164 IonicContact OD1-NE 3.08Å; D1160-R1164 PolarHBondContact OD1-NE 3.22Å; D1160-R1164 IonicContact OD1-NH2 3.32Å; D1160-R1164 IonicContact OD2-CZ 3.31Å; D1160-R1164 VanDerWaalsContact OD2-CZ 3.23Å; D1160-R1164 IonicContact OD2-NE 3.16Å; D1160-R1164 PolarHBondContact OD2-NE 3.01Å; D1160-R1164 VanDerWaalsContact OD2-NE 3.09Å; D1160-R1164 IonicContact OD2-NH2 3Å; D1160-R1164 PolarHBondContact OD2-NH2 3.09Å; M1161-R1164 VanDerWaalsContact CE-CZ 3.46Å; M1161-R1164 VanDerWaalsContact CE-NH2 3.29Å; M1161-R1164 PolarHBondContact O-N 3.13Å; L1162-R1164 VanDerWaalsContact C-N 3.3Å; L1162-R1164 PolarHBondContact O-N 3.18Å; R1164-D1166 VanDerWaalsContact C-N 3.35Å; R1164-F1167 HydrophobicContact CB-CE2 4.36Å; R1164-F1167 HydrophobicContact CG-CE2 4.38Å; R1164-F1167 WeakPolarHBondContact O-CD2 3.38Å; R1164-F1167 WeakPolarHBondContact O-CE2 3.03Å
1165	A	54.1	Low	63.1	Low	54.8 Å²	54.8	78.3 Å²	78.3	45%	0.453	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-28.3	176.2	0	0	0	0	0	113.4	L1062 L1162 T1163 F1167	L1062-A1165 HydrophobicContact CD1-CB 3.35Å; L1062-A1165 HydrophobicContact CG-CB 3.91Å; L1162-A1165 WeakPolarHBondContact O-CB 3.26Å; L1162-A1165 PolarHBondContact O-N 3.06Å; T1163-A1165 PolarHBondContact O-N 3.03Å; A1165-F1167 VanDerWaalsContact C-N 3.32Å; A1165-F1167 PolarHBondContact O-N 3.02Å
1166	D	50.3	Low	62.2	Low	17.2 Å²	17.2	82 Å²	82	9%	0.092	40%	0.396	C	S	.	.			trans	-87	3.9	-167.7	-85.1	-21.1	0	0	0	114.9	T1163 R1164 E1168 S1169 N1170 L1179 Y1200	T1163-D1166 PolarHBondContact O-N 3.15Å; R1164-D1166 VanDerWaalsContact C-N 3.35Å; D1166-E1168 VanDerWaalsContact C-N 3.28Å; D1166-E1168 PolarHBondContact O-N 3.14Å; D1166-E1168 VanDerWaalsContact O-N 3.11Å; D1166-S1169 PolarHBondContact O-N 2.96Å; D1166-S1169 PolarHBondContact OD1-OG 2.8Å; D1166-N1170 VanDerWaalsContact CB-ND2 3.33Å; D1166-N1170 WeakPolarHBondContact CB-ND2 3.25Å; D1166-N1170 PolarHBondContact O-N 3.17Å; D1166-N1170 VanDerWaalsContact O-N 3.15Å; D1166-N1170 PolarHBondContact O-ND2 3.18Å; D1166-L1179 WeakPolarHBondContact OD1-CD2 3.42Å; D1166-Y1200 WeakPolarHBondContact OD2-CE1 3.43Å; D1166-Y1200 PolarHBondContact OD2-OH 3.33Å
1167	F	45.6	Very low	61.9	Low	168 Å²	168	77.6 Å²	77.6	74%	0.737	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-24.6	-170.8	-90.4	-77.7	0	0	0	115.4	T1163 R1164 A1165	T1163-F1167 HydrophobicContact CG2-CE2 4.14Å; T1163-F1167 WeakPolarHBondContact O-CD2 3.39Å; T1163-F1167 VanDerWaalsContact O-CE2 3.28Å; T1163-F1167 WeakPolarHBondContact O-CE2 3.32Å; R1164-F1167 HydrophobicContact CB-CE2 4.36Å; R1164-F1167 HydrophobicContact CG-CE2 4.38Å; R1164-F1167 WeakPolarHBondContact O-CD2 3.38Å; R1164-F1167 WeakPolarHBondContact O-CE2 3.03Å; A1165-F1167 VanDerWaalsContact C-N 3.32Å; A1165-F1167 PolarHBondContact O-N 3.02Å
1168	E	46.6	Very low	61.9	Low	164.4 Å²	164.4	75.2 Å²	75.2	77%	0.768	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-22.3	-178.9	-71.9	-107.8	141	0	0	114.1	S857 Y859 D1166 N1170	S857-E1168 WeakPolarHBondContact CB-OE2 3.33Å; Y859-E1168 WeakPolarHBondContact CD2-OE2 3.2Å; Y859-E1168 WeakPolarHBondContact CE2-OE1 3.31Å; D1166-E1168 VanDerWaalsContact C-N 3.28Å; D1166-E1168 PolarHBondContact O-N 3.14Å; D1166-E1168 VanDerWaalsContact O-N 3.11Å; E1168-N1170 VanDerWaalsContact C-N 3.35Å; E1168-N1170 PolarHBondContact O-N 2.84Å
1169	S	45.7	Very low	61.9	Low	54.4 Å²	54.4	75.9 Å²	75.9	38%	0.38	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-7.2	-172.4	77.1	0	0	0	0	115.2	D1166 K1171	D1166-S1169 PolarHBondContact O-N 2.96Å; D1166-S1169 PolarHBondContact OD1-OG 2.8Å; S1169-K1171 VanDerWaalsContact C-N 3.29Å; S1169-K1171 PolarHBondContact O-N 3.14Å
1170	N	38.5	Very low	62.2	Low	70.6 Å²	70.6	75.9 Å²	75.9	38%	0.378	37%	0.371	S	S	.	.			trans	-73.8	56.6	-173.7	-99.7	-24.4	0	0	0	115.2	D1166 E1168 L1172 N1173 L1174 Y1200	D1166-N1170 VanDerWaalsContact CB-ND2 3.33Å; D1166-N1170 WeakPolarHBondContact CB-ND2 3.25Å; D1166-N1170 PolarHBondContact O-N 3.17Å; D1166-N1170 VanDerWaalsContact O-N 3.15Å; D1166-N1170 PolarHBondContact O-ND2 3.18Å; E1168-N1170 VanDerWaalsContact C-N 3.35Å; E1168-N1170 PolarHBondContact O-N 2.84Å; N1170-L1172 PolarHBondContact O-N 2.84Å; N1170-L1172 PolarHBondContact OD1-O 3.08Å; N1170-L1172 VanDerWaalsContact OD1-O 3.1Å; N1170-N1173 PolarHBondContact O-N 2.85Å; N1170-L1174 PolarHBondContact OD1-O 2.8Å; N1170-Y1200 PolarHBondContact ND2-OH 2.57Å; N1170-Y1200 PolarHBondContact OD1-OH 3.45Å
1171	K	46.5	Very low	62.7	Low	194.8 Å²	194.8	74.1 Å²	74.1	85%	0.847	36%	0.361	S	S	*	.			trans	-71.7	-14.3	160.6	-79.8	-173.3	178.1	179	0	113.1	S1169	S1169-K1171 VanDerWaalsContact C-N 3.29Å; S1169-K1171 PolarHBondContact O-N 3.14Å
1172	L	43.7	Very low	63.4	Low	98.8 Å²	98.8	73.3 Å²	73.3	52%	0.517	36%	0.357	S	S	.	.	S	Bend	trans	-100.1	112.1	175.4	-61.8	166.4	0	0	0	108.4	N1170 L1174	N1170-L1172 PolarHBondContact O-N 2.84Å; N1170-L1172 PolarHBondContact OD1-O 3.08Å; N1170-L1172 VanDerWaalsContact OD1-O 3.1Å; L1172-L1174 HydrophobicContact CB-CB 4.45Å; L1172-L1174 HydrophobicContact CB-CD1 3.57Å; L1172-L1174 VanDerWaalsContact CB-CD1 3.45Å; L1172-L1174 HydrophobicContact CB-CD2 4.47Å; L1172-L1174 HydrophobicContact CB-CG 3.77Å; L1172-L1174 VanDerWaalsContact CB-CG 3.47Å; L1172-L1174 HydrophobicContact CD1-CD1 3.92Å; L1172-L1174 HydrophobicContact CG-CD1 4.22Å; L1172-L1174 WeakPolarHBondContact O-CG 3.41Å; L1172-L1174 PolarHBondContact O-N 2.92Å; L1172-L1174 VanDerWaalsContact O-N 3.13Å
1173	N	47.8	Very low	64.1	Low	167.8 Å²	167.8	75.5 Å²	75.5	90%	0.897	37%	0.365	S	S	*	.			trans	-56.9	53	179.8	-73.8	-28.2	0	0	0	111.9	N1170	N1170-N1173 PolarHBondContact O-N 2.85Å
1174	L	47.6	Very low	65	Low	84.6 Å²	84.6	73.9 Å²	73.9	44%	0.443	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-99.1	147.2	-170.1	-69.1	172.6	0	0	0	111.8	N1170 L1172 Y1200	N1170-L1174 PolarHBondContact OD1-O 2.8Å; L1172-L1174 HydrophobicContact CB-CB 4.45Å; L1172-L1174 HydrophobicContact CB-CD1 3.57Å; L1172-L1174 VanDerWaalsContact CB-CD1 3.45Å; L1172-L1174 HydrophobicContact CB-CD2 4.47Å; L1172-L1174 HydrophobicContact CB-CG 3.77Å; L1172-L1174 VanDerWaalsContact CB-CG 3.47Å; L1172-L1174 HydrophobicContact CD1-CD1 3.92Å; L1172-L1174 HydrophobicContact CG-CD1 4.22Å; L1172-L1174 WeakPolarHBondContact O-CG 3.41Å; L1172-L1174 PolarHBondContact O-N 2.92Å; L1172-L1174 VanDerWaalsContact O-N 3.13Å; L1174-Y1200 HydrophobicContact CB-CE1 4.39Å; L1174-Y1200 HydrophobicContact CD1-CD2 3.8Å; L1174-Y1200 HydrophobicContact CD1-CE1 4.26Å; L1174-Y1200 HydrophobicContact CD1-CE2 3.62Å; L1174-Y1200 HydrophobicContact CD1-CG 4.32Å
1175	K	58.3	Low	66.2	Low	151.8 Å²	151.8	69.2 Å²	69.2	66%	0.66	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-74.4	166.1	-167.3	-60.3	175.4	178.3	178.3	0	112	G1177 E1204	K1175-G1177 PolarHBondContact O-N 2.97Å; K1175-E1204 IonicContact NZ-OE1 3.58Å; K1175-E1204 PolarHBondContact NZ-OE1 3.02Å; K1175-E1204 IonicContact NZ-OE2 3.03Å; K1175-E1204 PolarHBondContact NZ-OE2 2.94Å
1176	R	69.2	Low	67.5	Low	98 Å²	98	66.5 Å²	66.5	37%	0.37	32%	0.316	S	S	.	.	S	Bend	trans	-50.6	137	169.9	-53.1	-174.8	151.5	168.6	-5.5	110.9	L1159 D1160 T1163 E1203	L1159-R1176 HydrophobicContact CD2-CB 4.36Å; D1160-R1176 IonicContact OD1-CZ 3.98Å; D1160-R1176 IonicContact OD1-NH2 3.74Å; D1160-R1176 PolarHBondContact OD1-NH2 3.46Å; T1163-R1176 HydrophobicContact CG2-CB 3.54Å; T1163-R1176 HydrophobicContact CG2-CG 3.76Å; T1163-R1176 VanDerWaalsContact CG2-CG 3.45Å; T1163-R1176 WeakPolarHBondContact OG1-CG 3.41Å; T1163-R1176 PolarHBondContact OG1-NE 2.8Å; R1176-E1203 HydrophobicContact CB-CB 4.29Å; R1176-E1203 VanDerWaalsContact CB-OE2 3.24Å; R1176-E1203 WeakPolarHBondContact CB-OE2 3.31Å; R1176-E1203 WeakPolarHBondContact CD-OE2 3.35Å; R1176-E1203 WeakPolarHBondContact CG-OE2 3.03Å; R1176-E1203 WeakPolarHBondContact O-CB 3.39Å; R1176-E1203 PolarHBondContact O-N 3.11Å; R1176-E1203 VanDerWaalsContact O-N 3.13Å
1177	G	78.7	Confident	68.9	Low	2.6 Å²	2.6	69.2 Å²	69.2	3%	0.027	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.3	-175.6	-178.6	0	0	0	0	0	113.2	L1162 K1175 I1201	L1162-G1177 WeakPolarHBondContact CB-O 3.31Å; K1175-G1177 PolarHBondContact O-N 2.97Å; G1177-I1201 CarbonylContact C-O 3.52Å; G1177-I1201 WeakPolarHBondContact CA-O 3.27Å
1178	L	86.7	Confident	69.9	Low	3.2 Å²	3.2	63.2 Å²	63.2	2%	0.017	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	116.4	170.8	177	62.3	0	0	0	109.6	I1016 Y1051 F1052 F1053 L1162 I1180 I1201 M1259	I1016-L1178 HydrophobicContact CD1-CD2 3.82Å; Y1051-L1178 HydrophobicContact CD2-CD1 4.25Å; Y1051-L1178 HydrophobicContact CD2-CD2 4.11Å; F1052-L1178 VanDerWaalsContact O-CD1 3.25Å; F1052-L1178 WeakPolarHBondContact O-CD1 3.19Å; F1053-L1178 HydrophobicContact CD2-CD1 4.36Å; F1053-L1178 HydrophobicContact CD2-CD2 4.28Å; F1053-L1178 HydrophobicContact CE2-CD2 4.25Å; L1162-L1178 HydrophobicContact CD1-CB 4.1Å; L1162-L1178 HydrophobicContact CD1-CD1 4.43Å; L1162-L1178 HydrophobicContact CD2-CD1 3.72Å; L1178-I1180 HydrophobicContact CD2-CD1 4.05Å; L1178-I1180 HydrophobicContact CG-CD1 4.01Å; L1178-I1201 HydrophobicContact CB-CB 4.23Å; L1178-I1201 HydrophobicContact CB-CD1 4.47Å; L1178-I1201 HydrophobicContact CD2-CD1 4.21Å; L1178-I1201 HydrophobicContact CG-CD1 4.46Å; L1178-I1201 PolarHBondContact N-O 3.04Å; L1178-I1201 VanDerWaalsContact N-O 3.08Å; L1178-I1201 PolarHBondContact O-N 2.98Å; L1178-M1259 HydrophobicContact CD2-CE 4.05Å
1179	L	86.2	Confident	70.7	Confident	15.8 Å²	15.8	59 Å²	59	8%	0.083	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	129.7	172.3	171.4	63.3	0	0	0	110.6	Y1051 D1166 E1181 K1198 G1199 Y1200	Y1051-L1179 WeakPolarHBondContact CB-O 3.18Å; D1166-L1179 WeakPolarHBondContact OD1-CD2 3.42Å; L1179-E1181 HydrophobicContact CD1-CG 4.24Å; L1179-E1181 HydrophobicContact CD2-CG 4.34Å; L1179-E1181 HydrophobicContact CG-CG 4.19Å; L1179-K1198 HydrophobicContact CD1-CB 4Å; L1179-K1198 HydrophobicContact CD1-CD 3.94Å; L1179-K1198 HydrophobicContact CD1-CG 4.06Å; L1179-K1198 HydrophobicContact CD2-CD 4.5Å; L1179-K1198 VanDerWaalsContact CD2-NZ 3.29Å; L1179-G1199 WeakPolarHBondContact CD1-O 3.15Å; L1179-Y1200 HydrophobicContact CB-CD1 4.24Å; L1179-Y1200 HydrophobicContact CB-CE1 3.85Å; L1179-Y1200 HydrophobicContact CD1-CD1 4.27Å; L1179-Y1200 HydrophobicContact CD1-CD2 4.3Å; L1179-Y1200 HydrophobicContact CD1-CE1 3.84Å; L1179-Y1200 HydrophobicContact CD1-CE2 3.76Å; L1179-Y1200 HydrophobicContact CD1-CG 4.38Å; L1179-Y1200 VanDerWaalsContact CD1-CZ 3.41Å; L1179-Y1200 HydrophobicContact CG-CE1 4.33Å
1180	I	90.8	Very high	71.7	Confident	0.6 Å²	0.6	61.2 Å²	61.2	0%	0.003	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131.6	173.3	-58.5	-70.5	0	0	0	108.7	F1018 V1049 Y1051 L1178 K1198 G1199 I1201 I1239 L1255 I1257	F1018-I1180 HydrophobicContact CE1-CD1 4.15Å; F1018-I1180 HydrophobicContact CE1-CG1 4.48Å; F1018-I1180 HydrophobicContact CE1-CG2 4.2Å; F1018-I1180 HydrophobicContact CZ-CD1 4.08Å; F1018-I1180 HydrophobicContact CZ-CG1 4.38Å; F1018-I1180 HydrophobicContact CZ-CG2 4.44Å; V1049-I1180 HydrophobicContact CG1-CG2 3.4Å; V1049-I1180 VanDerWaalsContact CG1-CG2 3.43Å; Y1051-I1180 HydrophobicContact CG-CD1 4.15Å; L1178-I1180 HydrophobicContact CD2-CD1 4.05Å; L1178-I1180 HydrophobicContact CG-CD1 4.01Å; I1180-K1198 CarbonylContact O-C 3.54Å; I1180-K1198 WeakPolarHBondContact O-CA 3.34Å; I1180-G1199 PolarHBondContact N-O 3Å; I1180-G1199 PolarHBondContact O-N 2.98Å; I1180-G1199 VanDerWaalsContact O-O 3.09Å; I1180-I1201 HydrophobicContact CD1-CD1 3.83Å; I1180-I1201 VanDerWaalsContact CD1-CD1 3.45Å; I1180-I1201 HydrophobicContact CD1-CG1 4.1Å; I1180-I1201 HydrophobicContact CG1-CD1 3.91Å; I1180-I1201 HydrophobicContact CG1-CG1 4.01Å; I1180-I1239 HydrophobicContact CB-CD1 4.04Å; I1180-I1239 HydrophobicContact CD1-CD1 3.73Å; I1180-I1239 HydrophobicContact CG1-CD1 3.88Å; I1180-I1239 HydrophobicContact CG2-CD1 4.36Å; I1180-L1255 HydrophobicContact CG2-CD2 3.9Å; I1180-I1257 HydrophobicContact CD1-CD1 3.57Å; I1180-I1257 HydrophobicContact CG1-CD1 4.47Å
1181	E	91.2	Very high	73.6	Confident	14.8 Å²	14.8	62.4 Å²	62.4	7%	0.069	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.7	179.6	-59.3	-169.4	142.6	0	0	110.4	V1049 Q1050 L1179 W1183 L1195 K1198	V1049-E1181 CarbonylContact C-O 3.55Å; V1049-E1181 WeakPolarHBondContact CA-O 3.32Å; Q1050-E1181 HydrophobicContact CB-CB 4.47Å; Q1050-E1181 PolarHBondContact N-O 3.12Å; Q1050-E1181 PolarHBondContact NE2-OE2 2.89Å; Q1050-E1181 PolarHBondContact O-N 3.12Å; L1179-E1181 HydrophobicContact CD1-CG 4.24Å; L1179-E1181 HydrophobicContact CD2-CG 4.34Å; L1179-E1181 HydrophobicContact CG-CG 4.19Å; E1181-W1183 PolarHBondContact OE2-NE1 3.09Å; E1181-W1183 VanDerWaalsContact OE2-NE1 3.07Å; E1181-L1195 HydrophobicContact CB-CD1 3.78Å; E1181-L1195 HydrophobicContact CG-CD1 4.22Å; E1181-K1198 HydrophobicContact CG-CG 4.37Å; E1181-K1198 VanDerWaalsContact OE1-CE 3.27Å; E1181-K1198 WeakPolarHBondContact OE1-CE 3.37Å; E1181-K1198 IonicContact OE1-NZ 2.92Å; E1181-K1198 PolarHBondContact OE1-NZ 3.04Å; E1181-K1198 VanDerWaalsContact OE1-NZ 3.08Å
1182	L	92.7	Very high	75	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	119	169.1	-178.9	67.9	0	0	0	108.7	L1021 F1024 C1047 V1049 F1095 A1196 A1197 L1241	L1021-L1182 HydrophobicContact CD1-CD2 4.13Å; L1021-L1182 HydrophobicContact CD2-CD1 4.31Å; L1021-L1182 HydrophobicContact CD2-CD2 3.96Å; F1024-L1182 HydrophobicContact CD1-CD2 4.45Å; F1024-L1182 HydrophobicContact CD2-CD2 3.65Å; F1024-L1182 HydrophobicContact CE1-CD2 4.27Å; F1024-L1182 HydrophobicContact CE2-CD2 3.45Å; F1024-L1182 VanDerWaalsContact CE2-CD2 3.41Å; F1024-L1182 HydrophobicContact CG-CD2 4.16Å; F1024-L1182 HydrophobicContact CZ-CD2 3.79Å; C1047-L1182 HydrophobicContact CB-CD1 4.19Å; V1049-L1182 HydrophobicContact CG2-CD1 3.87Å; F1095-L1182 HydrophobicContact CZ-CD1 4.43Å; L1182-A1196 WeakPolarHBondContact O-CA 3.44Å; L1182-A1196 WeakPolarHBondContact O-CB 3.33Å; L1182-A1196 PolarHBondContact O-N 3Å; L1182-A1197 HydrophobicContact CB-CB 4.28Å; L1182-A1197 HydrophobicContact CD2-CB 4.43Å; L1182-A1197 PolarHBondContact N-O 3.16Å; L1182-A1197 PolarHBondContact O-N 3.08Å; L1182-A1197 VanDerWaalsContact O-N 3.16Å; L1182-L1241 HydrophobicContact CB-CD1 4.31Å; L1182-L1241 HydrophobicContact CD2-CD1 3.86Å
1183	W	92.2	Very high	77	Confident	52.6 Å²	52.6	53.4 Å²	53.4	20%	0.199	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143.8	-180	-72	83	0	0	0	110.7	C1047 Y1048 E1181 D1193 L1195	C1047-W1183 CarbonylContact C-O 3.46Å; C1047-W1183 VanDerWaalsContact CA-O 3.23Å; C1047-W1183 WeakPolarHBondContact CA-O 3.34Å; Y1048-W1183 HydrophobicContact CD1-CB 4.02Å; Y1048-W1183 HydrophobicContact CD2-CB 3.98Å; Y1048-W1183 HydrophobicContact CD2-CG 4.45Å; Y1048-W1183 HydrophobicContact CE1-CB 3.63Å; Y1048-W1183 HydrophobicContact CE1-CG 4.46Å; Y1048-W1183 HydrophobicContact CE2-CB 3.57Å; Y1048-W1183 AromaticContact CE2-CD1 3.93Å; Y1048-W1183 AromaticContact CE2-CG 3.78Å; Y1048-W1183 HydrophobicContact CE2-CG 3.78Å; Y1048-W1183 HydrophobicContact CG-CB 4.21Å; Y1048-W1183 VanDerWaalsContact CZ-CB 3.47Å; Y1048-W1183 AromaticContact CZ-CG 3.8Å; Y1048-W1183 PolarHBondContact N-O 2.98Å; Y1048-W1183 PolarHBondContact O-N 3.05Å; E1181-W1183 PolarHBondContact OE2-NE1 3.09Å; E1181-W1183 VanDerWaalsContact OE2-NE1 3.07Å; W1183-D1193 HydrophobicContact CE3-CB 3.96Å; W1183-D1193 HydrophobicContact CZ3-CB 4.31Å; W1183-L1195 HydrophobicContact CD2-CB 4.14Å; W1183-L1195 HydrophobicContact CD2-CD1 4.1Å; W1183-L1195 HydrophobicContact CE3-CB 3.94Å; W1183-L1195 VanDerWaalsContact CE3-N 3.34Å; W1183-L1195 HydrophobicContact CG-CD1 4.36Å; W1183-L1195 HydrophobicContact CH2-CB 3.84Å; W1183-L1195 HydrophobicContact CZ2-CB 4.02Å; W1183-L1195 HydrophobicContact CZ2-CD1 4.05Å; W1183-L1195 HydrophobicContact CZ2-CD2 4.39Å; W1183-L1195 HydrophobicContact CZ2-CG 4.4Å; W1183-L1195 HydrophobicContact CZ3-CB 3.8Å
1184	L	89.7	Confident	78.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.9	169.6	-68.1	175.8	0	0	0	109.2	F1024 P1026 P1029 L1030 L1045 D1046 C1047 L1072 D1193 C1194 A1196	F1024-L1184 HydrophobicContact CE1-CD2 4.08Å; F1024-L1184 HydrophobicContact CZ-CD1 4.4Å; F1024-L1184 HydrophobicContact CZ-CD2 4.25Å; F1024-L1184 HydrophobicContact CZ-CG 4.44Å; P1026-L1184 HydrophobicContact CB-CD1 4.2Å; P1029-L1184 HydrophobicContact CG-CD1 3.97Å; L1030-L1184 HydrophobicContact CD2-CD1 4.39Å; L1030-L1184 HydrophobicContact CG-CD1 4.28Å; L1045-L1184 HydrophobicContact CD1-CB 4.02Å; L1045-L1184 HydrophobicContact CD1-CD1 4.39Å; L1045-L1184 HydrophobicContact CD1-CD2 4.14Å; L1045-L1184 HydrophobicContact CD1-CG 4.41Å; L1045-L1184 HydrophobicContact CD2-CD2 4.35Å; L1045-L1184 HydrophobicContact CG-CD2 4.35Å; D1046-L1184 CarbonylContact O-C 3.55Å; D1046-L1184 VanDerWaalsContact O-CA 3.29Å; D1046-L1184 WeakPolarHBondContact O-CA 3.32Å; C1047-L1184 HydrophobicContact CB-CD2 3.98Å; L1072-L1184 HydrophobicContact CD1-CD2 3.49Å; L1072-L1184 VanDerWaalsContact CD1-CD2 3.47Å; L1184-D1193 CarbonylContact O-C 3.53Å; L1184-D1193 VanDerWaalsContact O-CA 3.29Å; L1184-D1193 WeakPolarHBondContact O-CA 3.37Å; L1184-C1194 HydrophobicContact CB-CB 4.44Å; L1184-C1194 PolarHBondContact N-O 3.11Å; L1184-C1194 PolarHBondContact O-N 2.96Å; L1184-A1196 HydrophobicContact CB-CB 4.46Å; L1184-A1196 HydrophobicContact CD1-CB 3.81Å; L1184-A1196 HydrophobicContact CD2-CB 4.49Å; L1184-A1196 HydrophobicContact CG-CB 3.7Å
1185	R	87	Confident	80.6	Confident	36.4 Å²	36.4	44.1 Å²	44.1	14%	0.137	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120.5	170.9	176.6	164	-102.8	167.9	3.7	109.1	Y874 P940 D1046 Y1048 T1069 Y1187 L1191 D1193	Y874-R1185 PolarHBondContact OH-NH1 2.79Å; P940-R1185 PolarHBondContact O-NH1 2.85Å; D1046-R1185 HydrophobicContact CB-CB 4.37Å; D1046-R1185 PolarHBondContact N-O 3.05Å; D1046-R1185 PolarHBondContact O-N 3.15Å; Y1048-R1185 HydrophobicContact CD1-CB 4.45Å; Y1048-R1185 HydrophobicContact CE1-CB 4.31Å; T1069-R1185 VanDerWaalsContact CG2-NH1 3.35Å; R1185-Y1187 HydrophobicContact CB-CE2 4.38Å; R1185-Y1187 VanDerWaalsContact CD-OH 3.31Å; R1185-Y1187 WeakPolarHBondContact CD-OH 3.3Å; R1185-Y1187 HydrophobicContact CG-CD2 4.29Å; R1185-Y1187 HydrophobicContact CG-CE1 4.32Å; R1185-Y1187 HydrophobicContact CG-CE2 4.01Å; R1185-L1191 HydrophobicContact CG-CD1 3.95Å; R1185-D1193 WeakPolarHBondContact CB-OD1 3.38Å; R1185-D1193 VanDerWaalsContact CG-OD1 3.31Å; R1185-D1193 WeakPolarHBondContact CG-OD1 3.39Å; R1185-D1193 IonicContact CZ-OD1 3.27Å; R1185-D1193 IonicContact CZ-OD2 3.17Å; R1185-D1193 IonicContact NE-OD1 3.48Å; R1185-D1193 PolarHBondContact NE-OD1 3.2Å; R1185-D1193 IonicContact NE-OD2 3.21Å; R1185-D1193 IonicContact NH1-OD2 2.65Å; R1185-D1193 IonicContact NH2-OD1 3.53Å; R1185-D1193 PolarHBondContact NH2-OD1 3.21Å; R1185-D1193 IonicContact NH2-OD2 2.81Å; R1185-D1193 PolarHBondContact NH2-OD2 3.09Å
1186	I	82.7	Confident	82.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.7	-173.6	-45.3	165.6	0	0	0	108.3	L1030 Y1036 P1041 D1044 L1045 S1188 L1191 H1192 C1194	L1030-I1186 HydrophobicContact CD2-CD1 3.62Å; L1030-I1186 VanDerWaalsContact CD2-CD1 3.49Å; L1030-I1186 HydrophobicContact CD2-CG1 4.39Å; Y1036-I1186 HydrophobicContact CD2-CD1 4.4Å; Y1036-I1186 HydrophobicContact CE1-CG2 4.36Å; Y1036-I1186 HydrophobicContact CE2-CD1 3.92Å; Y1036-I1186 HydrophobicContact CE2-CG2 4.03Å; Y1036-I1186 WeakPolarHBondContact OH-CG2 3.39Å; P1041-I1186 HydrophobicContact CG-CG2 3.9Å; D1044-I1186 WeakPolarHBondContact O-CA 3.5Å; L1045-I1186 HydrophobicContact CD1-CB 4.46Å; L1045-I1186 HydrophobicContact CD1-CD1 4.41Å; L1045-I1186 HydrophobicContact CD1-CG1 3.67Å; I1186-S1188 WeakPolarHBondContact CG2-O 3.48Å; I1186-L1191 CarbonylContact O-C 3.49Å; I1186-L1191 VanDerWaalsContact O-CA 3.25Å; I1186-L1191 WeakPolarHBondContact O-CA 3.43Å; I1186-H1192 PolarHBondContact N-O 3.17Å; I1186-H1192 PolarHBondContact O-N 2.99Å; I1186-C1194 HydrophobicContact CD1-CB 4.17Å
1187	Y	78.7	Confident	83	Confident	73.2 Å²	73.2	32.2 Å²	32.2	29%	0.287	17%	0.167	S	C	.	.			trans	-92.9	-29	-171.1	-66.8	-90.1	0	0	0	114.2	I876 R878 F941 D1044 D1046 R1185 N1190 L1191	I876-Y1187 VanDerWaalsContact CD1-OH 3.24Å; I876-Y1187 WeakPolarHBondContact CD1-OH 3.15Å; I876-Y1187 HydrophobicContact CG2-CE1 4.33Å; R878-Y1187 HydrophobicContact CG-CD1 4.29Å; R878-Y1187 HydrophobicContact CG-CE1 4.14Å; R878-Y1187 VanDerWaalsContact NE-CZ 3.27Å; F941-Y1187 AromaticContact CE1-CE1 3.87Å; F941-Y1187 HydrophobicContact CE1-CE1 3.87Å; F941-Y1187 WeakPolarHBondContact CE1-OH 3.18Å; F941-Y1187 HydrophobicContact CZ-CE1 4.48Å; D1044-Y1187 WeakPolarHBondContact O-CD2 3.24Å; D1044-Y1187 PolarHBondContact O-N 3Å; D1044-Y1187 VanDerWaalsContact O-N 3.1Å; D1046-Y1187 HydrophobicContact CB-CE2 4.35Å; D1046-Y1187 VanDerWaalsContact OD2-CE2 3.25Å; D1046-Y1187 WeakPolarHBondContact OD2-CE2 3.27Å; D1046-Y1187 PolarHBondContact OD2-OH 2.95Å; R1185-Y1187 HydrophobicContact CB-CE2 4.38Å; R1185-Y1187 VanDerWaalsContact CD-OH 3.31Å; R1185-Y1187 WeakPolarHBondContact CD-OH 3.3Å; R1185-Y1187 HydrophobicContact CG-CD2 4.29Å; R1185-Y1187 HydrophobicContact CG-CE1 4.32Å; R1185-Y1187 HydrophobicContact CG-CE2 4.01Å; Y1187-N1190 CarbonylContact C-O 3.53Å; Y1187-N1190 CarbonylContact O-C 3.53Å; Y1187-N1190 VanDerWaalsContact O-C 3.27Å; Y1187-L1191 HydrophobicContact CD1-CD1 3.59Å; Y1187-L1191 VanDerWaalsContact CD1-CD1 3.44Å; Y1187-L1191 HydrophobicContact CE1-CD1 3.84Å; Y1187-L1191 HydrophobicContact CG-CD1 4.21Å; Y1187-L1191 PolarHBondContact O-N 2.95Å
1188	S	66.9	Low	83.6	Confident	42.4 Å²	42.4	33.7 Å²	33.7	30%	0.297	17%	0.173	S	C	.	.	S	Bend	trans	-127.1	138.8	-174.9	-103.9	0	0	0	0	111	W83 Y1036 D1044 I1186 N1190	W83-S1188 VanDerWaalsContact CH2-CB 3.43Å; W83-S1188 WeakPolarHBondContact CZ3-OG 3.49Å; Y1036-S1188 VanDerWaalsContact OH-C 3.27Å; Y1036-S1188 PolarHBondContact OH-O 2.82Å; D1044-S1188 VanDerWaalsContact OD2-CB 3.25Å; D1044-S1188 WeakPolarHBondContact OD2-CB 3.44Å; D1044-S1188 PolarHBondContact OD2-OG 3.05Å; I1186-S1188 WeakPolarHBondContact CG2-O 3.48Å; S1188-N1190 PolarHBondContact O-N 2.79Å
1189	P	62.9	Low	83.7	Confident	75.4 Å²	75.4	33.6 Å²	33.6	49%	0.49	17%	0.172	S	C	.	.	S	Bend	cis	-81	-11.7	4.1	33.3	-36	0	0	0	114.1	A125 D129 Y1036	A125-P1189 HydrophobicContact CB-CB 4.17Å; D129-P1189 VanDerWaalsContact OD2-C 3.24Å; Y1036-P1189 WeakPolarHBondContact OH-CD 3.19Å
1190	N	67.7	Low	83.7	Confident	101.4 Å²	101.4	34.8 Å²	34.8	54%	0.542	18%	0.176	S	C	.	.	S	Bend	trans	-135.7	144.2	175.4	-69.7	-49.9	0	0	0	108.3	F941 Y1187 S1188 H1192	F941-N1190 HydrophobicContact CE1-CB 4.04Å; F941-N1190 WeakPolarHBondContact CE1-OD1 3.42Å; F941-N1190 HydrophobicContact CZ-CB 3.76Å; Y1187-N1190 CarbonylContact C-O 3.53Å; Y1187-N1190 CarbonylContact O-C 3.53Å; Y1187-N1190 VanDerWaalsContact O-C 3.27Å; S1188-N1190 PolarHBondContact O-N 2.79Å; N1190-H1192 PolarHBondContact O-CE1 3.15Å; N1190-H1192 PolarHBondContact O-N 3.22Å; N1190-H1192 VanDerWaalsContact O-N 3.17Å; N1190-H1192 PolarHBondContact O-ND1 3.02Å
1191	L	77.7	Confident	83.6	Confident	95.4 Å²	95.4	34.8 Å²	34.8	50%	0.499	18%	0.176	S	C	.	.			trans	-68.8	116.4	172.3	179.7	66.4	0	0	0	110.4	R1185 I1186 Y1187	R1185-L1191 HydrophobicContact CG-CD1 3.95Å; I1186-L1191 CarbonylContact O-C 3.49Å; I1186-L1191 VanDerWaalsContact O-CA 3.25Å; I1186-L1191 WeakPolarHBondContact O-CA 3.43Å; Y1187-L1191 HydrophobicContact CD1-CD1 3.59Å; Y1187-L1191 VanDerWaalsContact CD1-CD1 3.44Å; Y1187-L1191 HydrophobicContact CE1-CD1 3.84Å; Y1187-L1191 HydrophobicContact CG-CD1 4.21Å; Y1187-L1191 PolarHBondContact O-N 2.95Å
1192	H	76.3	Confident	83.3	Confident	48.6 Å²	48.6	36.2 Å²	36.2	23%	0.225	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	155.4	174.8	60.1	-61.8	0	0	0	111.8	D1033 Y1036 I1186 N1190	D1033-H1192 IonicContact OD2-CD2 3.24Å; D1033-H1192 IonicContact OD2-NE2 3.13Å; D1033-H1192 PolarHBondContact OD2-NE2 3.32Å; Y1036-H1192 AromaticContact CE2-CE1 3.9Å; Y1036-H1192 AromaticContact CE2-NE2 3.88Å; I1186-H1192 PolarHBondContact N-O 3.17Å; I1186-H1192 PolarHBondContact O-N 2.99Å; N1190-H1192 PolarHBondContact O-CE1 3.15Å; N1190-H1192 PolarHBondContact O-N 3.22Å; N1190-H1192 VanDerWaalsContact O-N 3.17Å; N1190-H1192 PolarHBondContact O-ND1 3.02Å
1193	D	85.8	Confident	83	Confident	56.2 Å²	56.2	39.4 Å²	39.4	30%	0.301	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.8	176.2	-64.7	-14.4	0	0	0	109.1	Y1048 W1183 L1184 R1185	Y1048-D1193 PolarHBondContact OH-OD2 3.16Å; W1183-D1193 HydrophobicContact CE3-CB 3.96Å; W1183-D1193 HydrophobicContact CZ3-CB 4.31Å; L1184-D1193 CarbonylContact O-C 3.53Å; L1184-D1193 VanDerWaalsContact O-CA 3.29Å; L1184-D1193 WeakPolarHBondContact O-CA 3.37Å; R1185-D1193 WeakPolarHBondContact CB-OD1 3.38Å; R1185-D1193 VanDerWaalsContact CG-OD1 3.31Å; R1185-D1193 WeakPolarHBondContact CG-OD1 3.39Å; R1185-D1193 IonicContact CZ-OD1 3.27Å; R1185-D1193 IonicContact CZ-OD2 3.17Å; R1185-D1193 IonicContact NE-OD1 3.48Å; R1185-D1193 PolarHBondContact NE-OD1 3.2Å; R1185-D1193 IonicContact NE-OD2 3.21Å; R1185-D1193 IonicContact NH1-OD2 2.65Å; R1185-D1193 IonicContact NH2-OD1 3.53Å; R1185-D1193 PolarHBondContact NH2-OD1 3.21Å; R1185-D1193 IonicContact NH2-OD2 2.81Å; R1185-D1193 PolarHBondContact NH2-OD2 3.09Å
1194	C	84.5	Confident	82.6	Confident	22 Å²	22	42.9 Å²	42.9	15%	0.149	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.5	178.2	-178	0	0	0	0	109.4	L1184 I1186 A1196	L1184-C1194 HydrophobicContact CB-CB 4.44Å; L1184-C1194 PolarHBondContact N-O 3.11Å; L1184-C1194 PolarHBondContact O-N 2.96Å; I1186-C1194 HydrophobicContact CD1-CB 4.17Å; C1194-A1196 PolarHBondContact O-N 3.28Å
1195	L	87.7	Confident	82.5	Confident	34.2 Å²	34.2	44.6 Å²	44.6	18%	0.179	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	115	174.7	175.7	63.7	0	0	0	109.2	E1181 W1183 K1198 V1244	E1181-L1195 HydrophobicContact CB-CD1 3.78Å; E1181-L1195 HydrophobicContact CG-CD1 4.22Å; W1183-L1195 HydrophobicContact CD2-CB 4.14Å; W1183-L1195 HydrophobicContact CD2-CD1 4.1Å; W1183-L1195 HydrophobicContact CE3-CB 3.94Å; W1183-L1195 VanDerWaalsContact CE3-N 3.34Å; W1183-L1195 HydrophobicContact CG-CD1 4.36Å; W1183-L1195 HydrophobicContact CH2-CB 3.84Å; W1183-L1195 HydrophobicContact CZ2-CB 4.02Å; W1183-L1195 HydrophobicContact CZ2-CD1 4.05Å; W1183-L1195 HydrophobicContact CZ2-CD2 4.39Å; W1183-L1195 HydrophobicContact CZ2-CG 4.4Å; W1183-L1195 HydrophobicContact CZ3-CB 3.8Å; L1195-K1198 HydrophobicContact CD1-CG 4.4Å; L1195-K1198 HydrophobicContact CD2-CD 4.44Å; L1195-K1198 VanDerWaalsContact CD2-CE 3.45Å; L1195-K1198 HydrophobicContact CD2-CG 4.43Å; L1195-V1244 HydrophobicContact CD2-CB 4.46Å; L1195-V1244 HydrophobicContact CD2-CG1 4.16Å; L1195-V1244 HydrophobicContact CD2-CG2 4.02Å; L1195-V1244 HydrophobicContact CG-CG2 3.92Å
1196	A	88	Confident	82.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-42.8	-170.7	0	0	0	0	0	113.7	F1024 P1029 L1182 L1184 C1194	F1024-A1196 HydrophobicContact CE2-CB 4.24Å; F1024-A1196 HydrophobicContact CZ-CB 3.92Å; P1029-A1196 HydrophobicContact CB-CB 3.95Å; P1029-A1196 HydrophobicContact CG-CB 3.76Å; L1182-A1196 WeakPolarHBondContact O-CA 3.44Å; L1182-A1196 WeakPolarHBondContact O-CB 3.33Å; L1182-A1196 PolarHBondContact O-N 3Å; L1184-A1196 HydrophobicContact CB-CB 4.46Å; L1184-A1196 HydrophobicContact CD1-CB 3.81Å; L1184-A1196 HydrophobicContact CD2-CB 4.49Å; L1184-A1196 HydrophobicContact CG-CB 3.7Å; C1194-A1196 PolarHBondContact O-N 3.28Å
1197	A	89.7	Confident	82.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	157.7	179.7	0	0	0	0	0	111.9	L1182 L1241 Y1242	L1182-A1197 HydrophobicContact CB-CB 4.28Å; L1182-A1197 HydrophobicContact CD2-CB 4.43Å; L1182-A1197 PolarHBondContact N-O 3.16Å; L1182-A1197 PolarHBondContact O-N 3.08Å; L1182-A1197 VanDerWaalsContact O-N 3.16Å; A1197-L1241 HydrophobicContact CB-CB 3.91Å; A1197-Y1242 CarbonylContact C-O 3.57Å; A1197-Y1242 VanDerWaalsContact CA-O 3.23Å; A1197-Y1242 WeakPolarHBondContact CA-O 3.3Å; A1197-Y1242 WeakPolarHBondContact CB-O 3.33Å
1198	K	89.7	Confident	82.9	Confident	35 Å²	35	46.4 Å²	46.4	15%	0.152	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	134.6	172.7	-73.1	-174	172	-146.3	0	110.5	L1179 I1180 E1181 L1195 Y1200 Y1242 V1244	L1179-K1198 HydrophobicContact CD1-CB 4Å; L1179-K1198 HydrophobicContact CD1-CD 3.94Å; L1179-K1198 HydrophobicContact CD1-CG 4.06Å; L1179-K1198 HydrophobicContact CD2-CD 4.5Å; L1179-K1198 VanDerWaalsContact CD2-NZ 3.29Å; I1180-K1198 CarbonylContact O-C 3.54Å; I1180-K1198 WeakPolarHBondContact O-CA 3.34Å; E1181-K1198 HydrophobicContact CG-CG 4.37Å; E1181-K1198 VanDerWaalsContact OE1-CE 3.27Å; E1181-K1198 WeakPolarHBondContact OE1-CE 3.37Å; E1181-K1198 IonicContact OE1-NZ 2.92Å; E1181-K1198 PolarHBondContact OE1-NZ 3.04Å; E1181-K1198 VanDerWaalsContact OE1-NZ 3.08Å; L1195-K1198 HydrophobicContact CD1-CG 4.4Å; L1195-K1198 HydrophobicContact CD2-CD 4.44Å; L1195-K1198 VanDerWaalsContact CD2-CE 3.45Å; L1195-K1198 HydrophobicContact CD2-CG 4.43Å; K1198-Y1200 HydrophobicContact CB-CE2 4.38Å; K1198-Y1242 PolarHBondContact N-O 3.14Å; K1198-Y1242 PolarHBondContact O-N 2.99Å; K1198-V1244 HydrophobicContact CB-CG2 4.38Å; K1198-V1244 HydrophobicContact CD-CG2 4.27Å; K1198-V1244 HydrophobicContact CG-CG2 3.83Å
1199	G	88.9	Confident	83.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	156.7	170.1	0	0	0	0	0	110.4	L1179 I1180	L1179-G1199 WeakPolarHBondContact CD1-O 3.15Å; I1180-G1199 PolarHBondContact N-O 3Å; I1180-G1199 PolarHBondContact O-N 2.98Å; I1180-G1199 VanDerWaalsContact O-O 3.09Å
1200	Y	86.4	Confident	84.8	Confident	41.4 Å²	41.4	40.9 Å²	40.9	16%	0.162	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.6	178.9	-77	-92.6	0	0	0	110.1	D1166 N1170 L1174 L1179 K1198 P1202	D1166-Y1200 WeakPolarHBondContact OD2-CE1 3.43Å; D1166-Y1200 PolarHBondContact OD2-OH 3.33Å; N1170-Y1200 PolarHBondContact ND2-OH 2.57Å; N1170-Y1200 PolarHBondContact OD1-OH 3.45Å; L1174-Y1200 HydrophobicContact CB-CE1 4.39Å; L1174-Y1200 HydrophobicContact CD1-CD2 3.8Å; L1174-Y1200 HydrophobicContact CD1-CE1 4.26Å; L1174-Y1200 HydrophobicContact CD1-CE2 3.62Å; L1174-Y1200 HydrophobicContact CD1-CG 4.32Å; L1179-Y1200 HydrophobicContact CB-CD1 4.24Å; L1179-Y1200 HydrophobicContact CB-CE1 3.85Å; L1179-Y1200 HydrophobicContact CD1-CD1 4.27Å; L1179-Y1200 HydrophobicContact CD1-CD2 4.3Å; L1179-Y1200 HydrophobicContact CD1-CE1 3.84Å; L1179-Y1200 HydrophobicContact CD1-CE2 3.76Å; L1179-Y1200 HydrophobicContact CD1-CG 4.38Å; L1179-Y1200 VanDerWaalsContact CD1-CZ 3.41Å; L1179-Y1200 HydrophobicContact CG-CE1 4.33Å; K1198-Y1200 HydrophobicContact CB-CE2 4.38Å; Y1200-P1202 WeakPolarHBondContact O-CD 3.21Å
1201	I	88.6	Confident	85.2	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	110.1	166.4	-55.1	178.1	0	0	0	106.8	G1177 L1178 I1180 L1205 L1206 F1237 I1239 I1257 M1259	G1177-I1201 CarbonylContact C-O 3.52Å; G1177-I1201 WeakPolarHBondContact CA-O 3.27Å; L1178-I1201 HydrophobicContact CB-CB 4.23Å; L1178-I1201 HydrophobicContact CB-CD1 4.47Å; L1178-I1201 HydrophobicContact CD2-CD1 4.21Å; L1178-I1201 HydrophobicContact CG-CD1 4.46Å; L1178-I1201 PolarHBondContact N-O 3.04Å; L1178-I1201 VanDerWaalsContact N-O 3.08Å; L1178-I1201 PolarHBondContact O-N 2.98Å; I1180-I1201 HydrophobicContact CD1-CD1 3.83Å; I1180-I1201 VanDerWaalsContact CD1-CD1 3.45Å; I1180-I1201 HydrophobicContact CD1-CG1 4.1Å; I1180-I1201 HydrophobicContact CG1-CD1 3.91Å; I1180-I1201 HydrophobicContact CG1-CG1 4.01Å; I1201-L1205 HydrophobicContact CG2-CB 4.26Å; I1201-L1206 HydrophobicContact CG2-CG 4.41Å; I1201-F1237 HydrophobicContact CD1-CE2 4.39Å; I1201-F1237 HydrophobicContact CD1-CZ 4.25Å; I1201-F1237 HydrophobicContact CG1-CE2 4.11Å; I1201-F1237 HydrophobicContact CG1-CZ 4.27Å; I1201-F1237 HydrophobicContact CG2-CE2 4.04Å; I1201-F1237 HydrophobicContact CG2-CZ 3.82Å; I1201-I1239 HydrophobicContact CB-CD1 4.34Å; I1201-I1239 HydrophobicContact CD1-CD1 4.49Å; I1201-I1239 HydrophobicContact CG1-CD1 4.19Å; I1201-I1239 HydrophobicContact CG1-CG2 4.06Å; I1201-I1257 HydrophobicContact CD1-CD1 3.86Å; I1201-I1257 HydrophobicContact CG1-CD1 4.21Å; I1201-M1259 HydrophobicContact CD1-CE 3.55Å; I1201-M1259 VanDerWaalsContact CD1-CE 3.45Å; I1201-M1259 HydrophobicContact CD1-SD 4.06Å; I1201-M1259 HydrophobicContact CG1-CE 4.45Å; I1201-M1259 HydrophobicContact CG2-CE 4.22Å; I1201-M1259 HydrophobicContact CG2-SD 4.31Å
1202	P	85.7	Confident	84.3	Confident	45.2 Å²	45.2	38.8 Å²	38.8	29%	0.294	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	151.9	-174.4	20.1	-24.7	0	0	0	112.2	Y1200 E1204 L1205 L1206	Y1200-P1202 WeakPolarHBondContact O-CD 3.21Å; P1202-E1204 HydrophobicContact CB-CB 4.44Å; P1202-E1204 VanDerWaalsContact CB-OE2 3.29Å; P1202-E1204 WeakPolarHBondContact CB-OE2 3.24Å; P1202-E1204 HydrophobicContact CG-CB 4.48Å; P1202-E1204 PolarHBondContact O-N 2.96Å; P1202-E1204 VanDerWaalsContact O-N 3.13Å; P1202-L1205 HydrophobicContact CB-CG 4.5Å; P1202-L1205 HydrophobicContact CG-CB 4.39Å; P1202-L1205 HydrophobicContact CG-CD1 4.22Å; P1202-L1205 HydrophobicContact CG-CG 4.08Å; P1202-L1205 PolarHBondContact O-N 3.02Å; P1202-L1206 PolarHBondContact O-N 3.34Å
1203	E	85.1	Confident	82.9	Confident	67.2 Å²	67.2	41 Å²	41	31%	0.314	21%	0.207	S	C	.	.	H	α-helix	trans	-45.5	-40.9	171	171.4	170.3	177.2	0	0	112.7	L1159 R1176 L1205 L1206 C1207	L1159-E1203 HydrophobicContact CD1-CG 3.67Å; L1159-E1203 WeakPolarHBondContact CD1-OE1 3.3Å; L1159-E1203 HydrophobicContact CD2-CB 3.97Å; L1159-E1203 HydrophobicContact CD2-CG 3.88Å; L1159-E1203 HydrophobicContact CG-CG 4.45Å; R1176-E1203 HydrophobicContact CB-CB 4.29Å; R1176-E1203 VanDerWaalsContact CB-OE2 3.24Å; R1176-E1203 WeakPolarHBondContact CB-OE2 3.31Å; R1176-E1203 WeakPolarHBondContact CD-OE2 3.35Å; R1176-E1203 WeakPolarHBondContact CG-OE2 3.03Å; R1176-E1203 WeakPolarHBondContact O-CB 3.39Å; R1176-E1203 PolarHBondContact O-N 3.11Å; R1176-E1203 VanDerWaalsContact O-N 3.13Å; E1203-L1205 VanDerWaalsContact C-N 3.27Å; E1203-L1205 PolarHBondContact O-N 3.09Å; E1203-L1205 VanDerWaalsContact O-N 3.14Å; E1203-L1206 PolarHBondContact O-N 3.1Å; E1203-L1206 VanDerWaalsContact O-N 3.12Å; E1203-C1207 WeakPolarHBondContact O-CB 3.35Å; E1203-C1207 PolarHBondContact O-N 3.01Å; E1203-C1207 PolarHBondContact O-SG 3.07Å; E1203-C1207 VanDerWaalsContact O-SG 3.36Å
1204	E	85.6	Confident	81	Confident	127.2 Å²	127.2	47.4 Å²	47.4	59%	0.594	23%	0.232	S	C	*	.	H	α-helix	trans	-57.8	-33	179.5	-63.2	135.7	-169.2	0	0	113.3	K1175 P1202 K1208	K1175-E1204 IonicContact NZ-OE1 3.58Å; K1175-E1204 PolarHBondContact NZ-OE1 3.02Å; K1175-E1204 IonicContact NZ-OE2 3.03Å; K1175-E1204 PolarHBondContact NZ-OE2 2.94Å; P1202-E1204 HydrophobicContact CB-CB 4.44Å; P1202-E1204 VanDerWaalsContact CB-OE2 3.29Å; P1202-E1204 WeakPolarHBondContact CB-OE2 3.24Å; P1202-E1204 HydrophobicContact CG-CB 4.48Å; P1202-E1204 PolarHBondContact O-N 2.96Å; P1202-E1204 VanDerWaalsContact O-N 3.13Å; E1204-K1208 VanDerWaalsContact O-CB 3.24Å; E1204-K1208 WeakPolarHBondContact O-CB 3.34Å; E1204-K1208 PolarHBondContact O-N 3.01Å; E1204-K1208 VanDerWaalsContact O-N 3.09Å
1205	L	87.1	Confident	78.7	Confident	36.4 Å²	36.4	51 Å²	51	19%	0.191	26%	0.258	C	S	.	.	H	α-helix	trans	-80.7	-36.6	177.1	-69.8	-177.1	0	0	0	112.5	I1201 P1202 E1203 K1208 L1209 I1235 F1237	I1201-L1205 HydrophobicContact CG2-CB 4.26Å; P1202-L1205 HydrophobicContact CB-CG 4.5Å; P1202-L1205 HydrophobicContact CG-CB 4.39Å; P1202-L1205 HydrophobicContact CG-CD1 4.22Å; P1202-L1205 HydrophobicContact CG-CG 4.08Å; P1202-L1205 PolarHBondContact O-N 3.02Å; E1203-L1205 VanDerWaalsContact C-N 3.27Å; E1203-L1205 PolarHBondContact O-N 3.09Å; E1203-L1205 VanDerWaalsContact O-N 3.14Å; L1205-K1208 HydrophobicContact CD2-CD 4.3Å; L1205-K1208 PolarHBondContact O-N 2.84Å; L1205-L1209 VanDerWaalsContact O-CB 3.31Å; L1205-L1209 WeakPolarHBondContact O-CB 3.12Å; L1205-L1209 PolarHBondContact O-N 2.96Å; L1205-I1235 HydrophobicContact CB-CD1 4.22Å; L1205-I1235 HydrophobicContact CD2-CD1 4.38Å; L1205-I1235 WeakPolarHBondContact O-CD1 3.17Å; L1205-F1237 HydrophobicContact CD1-CB 4.36Å; L1205-F1237 HydrophobicContact CD1-CD1 4.18Å; L1205-F1237 HydrophobicContact CD1-CD2 3.38Å; L1205-F1237 VanDerWaalsContact CD1-CD2 3.43Å; L1205-F1237 HydrophobicContact CD1-CE1 4.26Å; L1205-F1237 HydrophobicContact CD1-CE2 3.53Å; L1205-F1237 VanDerWaalsContact CD1-CE2 3.45Å; L1205-F1237 HydrophobicContact CD1-CG 3.72Å; L1205-F1237 HydrophobicContact CD1-CZ 4.03Å
1206	L	86.6	Confident	76.2	Confident	5.4 Å²	5.4	56.9 Å²	56.9	3%	0.028	29%	0.289	C	S	.	.	H	α-helix	trans	-65	-44.5	173.3	-68.7	170.8	0	0	0	110.9	L1159 L1162 I1201 P1202 E1203 K1208 L1209 I1210 M1259	L1159-L1206 HydrophobicContact CD2-CB 4.46Å; L1159-L1206 HydrophobicContact CD2-CD1 3.91Å; L1162-L1206 HydrophobicContact CD1-CD1 4.05Å; I1201-L1206 HydrophobicContact CG2-CG 4.41Å; P1202-L1206 PolarHBondContact O-N 3.34Å; E1203-L1206 PolarHBondContact O-N 3.1Å; E1203-L1206 VanDerWaalsContact O-N 3.12Å; L1206-K1208 VanDerWaalsContact C-N 3.32Å; L1206-K1208 PolarHBondContact O-N 3.04Å; L1206-L1209 PolarHBondContact O-N 3.16Å; L1206-I1210 WeakPolarHBondContact O-CG1 3.4Å; L1206-I1210 PolarHBondContact O-N 2.93Å; L1206-I1210 VanDerWaalsContact O-N 3.1Å; L1206-M1259 HydrophobicContact CD2-CE 4.13Å; L1206-M1259 HydrophobicContact CD2-SD 4.42Å
1207	C	85.8	Confident	73.5	Confident	30.8 Å²	30.8	65.6 Å²	65.6	21%	0.208	33%	0.326	C	S	.	.	H	α-helix	trans	-61.5	-41.5	173.3	-69	0	0	0	0	111.4	I1155 E1203 L1209 I1210 S1211	I1155-C1207 VanDerWaalsContact CG2-SG 3.57Å; E1203-C1207 WeakPolarHBondContact O-CB 3.35Å; E1203-C1207 PolarHBondContact O-N 3.01Å; E1203-C1207 PolarHBondContact O-SG 3.07Å; E1203-C1207 VanDerWaalsContact O-SG 3.36Å; C1207-L1209 VanDerWaalsContact C-N 3.31Å; C1207-L1209 PolarHBondContact O-N 3.19Å; C1207-I1210 PolarHBondContact O-N 3.2Å; C1207-S1211 WeakPolarHBondContact O-CA 3.41Å; C1207-S1211 VanDerWaalsContact O-CB 3.27Å; C1207-S1211 WeakPolarHBondContact O-CB 3.31Å; C1207-S1211 PolarHBondContact O-N 3.03Å; C1207-S1211 PolarHBondContact O-OG 3.11Å
1208	K	84.7	Confident	70.8	Confident	110 Å²	110	70.7 Å²	70.7	48%	0.478	36%	0.362	S	S	.	.	H	α-helix	trans	-67.8	-28.3	176	-177.5	-179.5	176.5	-174.7	0	113.7	E1204 L1205 L1206 Q1233 I1235	E1204-K1208 VanDerWaalsContact O-CB 3.24Å; E1204-K1208 WeakPolarHBondContact O-CB 3.34Å; E1204-K1208 PolarHBondContact O-N 3.01Å; E1204-K1208 VanDerWaalsContact O-N 3.09Å; L1205-K1208 HydrophobicContact CD2-CD 4.3Å; L1205-K1208 PolarHBondContact O-N 2.84Å; L1206-K1208 VanDerWaalsContact C-N 3.32Å; L1206-K1208 PolarHBondContact O-N 3.04Å; K1208-Q1233 PolarHBondContact O-OE1 2.99Å; K1208-I1235 HydrophobicContact CB-CD1 4.22Å; K1208-I1235 HydrophobicContact CD-CD1 4.27Å; K1208-I1235 HydrophobicContact CG-CD1 3.83Å
1209	L	84.9	Confident	68	Low	1.2 Å²	1.2	71.7 Å²	71.7	1%	0.006	38%	0.383	C	S	.	.	H	α-helix	trans	-76.1	-31.2	175.9	175.4	63.3	0	0	0	112.5	L1205 L1206 C1207 Q1233 I1235 M1259 Y1261	L1205-L1209 VanDerWaalsContact O-CB 3.31Å; L1205-L1209 WeakPolarHBondContact O-CB 3.12Å; L1205-L1209 PolarHBondContact O-N 2.96Å; L1206-L1209 PolarHBondContact O-N 3.16Å; C1207-L1209 VanDerWaalsContact C-N 3.31Å; C1207-L1209 PolarHBondContact O-N 3.19Å; L1209-Q1233 VanDerWaalsContact C-OE1 3.31Å; L1209-Q1233 HydrophobicContact CD1-CB 4.41Å; L1209-Q1233 HydrophobicContact CD1-CG 4.26Å; L1209-Q1233 VanDerWaalsContact CD1-O 3.3Å; L1209-Q1233 WeakPolarHBondContact CD1-O 3.26Å; L1209-Q1233 VanDerWaalsContact O-CB 3.29Å; L1209-Q1233 WeakPolarHBondContact O-CB 3.39Å; L1209-Q1233 VanDerWaalsContact O-CD 3.3Å; L1209-Q1233 WeakPolarHBondContact O-CG 3.31Å; L1209-Q1233 PolarHBondContact O-OE1 3.11Å; L1209-Q1233 VanDerWaalsContact O-OE1 3.08Å; L1209-I1235 HydrophobicContact CB-CD1 3.96Å; L1209-I1235 HydrophobicContact CB-CG1 4.34Å; L1209-I1235 HydrophobicContact CD1-CB 4.27Å; L1209-I1235 HydrophobicContact CD1-CD1 4.31Å; L1209-I1235 HydrophobicContact CD1-CG1 4.12Å; L1209-I1235 HydrophobicContact CD1-CG2 4.47Å; L1209-M1259 HydrophobicContact CD1-CB 4.45Å; L1209-M1259 HydrophobicContact CD2-CB 3.73Å; L1209-M1259 HydrophobicContact CD2-CE 4.01Å; L1209-M1259 HydrophobicContact CD2-CG 4.46Å; L1209-M1259 HydrophobicContact CD2-SD 4.28Å; L1209-Y1261 HydrophobicContact CG-CG 4.49Å; L1209-Y1261 WeakPolarHBondContact O-CD1 3.46Å
1210	I	84.4	Confident	65.4	Low	1.4 Å²	1.4	79.7 Å²	79.7	1%	0.007	43%	0.425	C	S	.	.	H	α-helix	trans	-99.4	-39.1	-175.2	-61.8	162.3	0	0	0	111.9	E1151 F1154 I1155 I1158 L1206 C1207 K1212 Q1233 Y1261	E1151-I1210 HydrophobicContact CB-CG2 4Å; E1151-I1210 VanDerWaalsContact CD-O 3.29Å; E1151-I1210 HydrophobicContact CG-CG2 4.17Å; E1151-I1210 VanDerWaalsContact CG-O 3.29Å; E1151-I1210 WeakPolarHBondContact CG-O 3.3Å; F1154-I1210 HydrophobicContact CD1-CD1 3.95Å; F1154-I1210 HydrophobicContact CD1-CG1 4.45Å; F1154-I1210 HydrophobicContact CD1-CG2 4.33Å; F1154-I1210 HydrophobicContact CE1-CD1 4Å; F1154-I1210 HydrophobicContact CE1-CG1 4.5Å; I1155-I1210 HydrophobicContact CD1-CB 3.81Å; I1155-I1210 HydrophobicContact CD1-CG2 3.71Å; I1155-I1210 HydrophobicContact CG1-CB 3.64Å; I1155-I1210 HydrophobicContact CG1-CD1 3.77Å; I1155-I1210 HydrophobicContact CG1-CG1 4.32Å; I1155-I1210 HydrophobicContact CG1-CG2 3.51Å; I1155-I1210 VanDerWaalsContact CG1-CG2 3.46Å; I1158-I1210 HydrophobicContact CG2-CD1 4.41Å; L1206-I1210 WeakPolarHBondContact O-CG1 3.4Å; L1206-I1210 PolarHBondContact O-N 2.93Å; L1206-I1210 VanDerWaalsContact O-N 3.1Å; C1207-I1210 PolarHBondContact O-N 3.2Å; I1210-K1212 PolarHBondContact O-N 3.01Å; I1210-Q1233 PolarHBondContact O-NE2 3.13Å; I1210-Y1261 HydrophobicContact CB-CD1 4.25Å; I1210-Y1261 HydrophobicContact CB-CE1 4.13Å; I1210-Y1261 HydrophobicContact CG1-CD1 3.99Å; I1210-Y1261 HydrophobicContact CG1-CD2 4.25Å; I1210-Y1261 HydrophobicContact CG1-CE1 4.11Å; I1210-Y1261 HydrophobicContact CG1-CE2 4.36Å; I1210-Y1261 HydrophobicContact CG1-CG 4.06Å; I1210-Y1261 HydrophobicContact CG2-CD1 4.32Å; I1210-Y1261 HydrophobicContact CG2-CE1 3.69Å
1211	S	75.1	Confident	63	Low	43 Å²	43	85.3 Å²	85.3	30%	0.301	46%	0.458	S	S	.	.	S	Bend	trans	-93.4	85.3	-176.3	27.8	0	0	0	0	113.7	E1151 I1155 C1207 N1213	E1151-S1211 WeakPolarHBondContact CB-OG 3.23Å; E1151-S1211 VanDerWaalsContact OE2-CA 3.31Å; E1151-S1211 WeakPolarHBondContact OE2-CA 3.39Å; E1151-S1211 PolarHBondContact OE2-OG 3.15Å; I1155-S1211 WeakPolarHBondContact CD1-OG 3.36Å; C1207-S1211 WeakPolarHBondContact O-CA 3.41Å; C1207-S1211 VanDerWaalsContact O-CB 3.27Å; C1207-S1211 WeakPolarHBondContact O-CB 3.31Å; C1207-S1211 PolarHBondContact O-N 3.03Å; C1207-S1211 PolarHBondContact O-OG 3.11Å; S1211-N1213 PolarHBondContact O-N 2.98Å
1212	K	60.3	Low	60.3	Low	109.2 Å²	109.2	94.4 Å²	94.4	48%	0.475	50%	0.5	S	S	.	.			trans	-68.3	71.5	-179.1	-155.2	-176.6	178	-168.1	0	111.4	E1151 I1210 K1214 H1230	E1151-K1212 PolarHBondContact OE2-N 3.4Å; I1210-K1212 PolarHBondContact O-N 3.01Å; K1212-K1214 PolarHBondContact O-N 3.02Å; K1212-H1230 PolarHBondContact NZ-CD2 3.43Å; K1212-H1230 PolarHBondContact NZ-CE1 2.95Å; K1212-H1230 VanDerWaalsContact NZ-CG 3.28Å; K1212-H1230 PolarHBondContact NZ-ND1 2.82Å; K1212-H1230 PolarHBondContact NZ-NE2 2.79Å
1213	N	47.1	Very low	57.8	Low	95.6 Å²	95.6	101 Å²	101	51%	0.511	53%	0.528	S	S	.	.			trans	-62.7	83.7	169.2	-86.7	-31	0	0	0	110.3	R1147 E1151 S1211 S1215 H1230 Q1233	R1147-N1213 VanDerWaalsContact NH1-CG 3.29Å; R1147-N1213 PolarHBondContact NH1-OD1 2.85Å; E1151-N1213 PolarHBondContact OE1-ND2 2.83Å; S1211-N1213 PolarHBondContact O-N 2.98Å; N1213-S1215 VanDerWaalsContact C-N 3.34Å; N1213-S1215 PolarHBondContact O-N 3.18Å; N1213-H1230 PolarHBondContact ND2-O 2.88Å; N1213-Q1233 PolarHBondContact ND2-NE2 2.71Å
1214	K	44.3	Very low	55.4	Low	189.6 Å²	189.6	103.9 Å²	103.9	82%	0.824	55%	0.545	S	S	*	.			trans	-70.8	97.7	162.3	-73.9	-176.1	178.1	-179.9	0	107.8	K1212 L1216	K1212-K1214 PolarHBondContact O-N 3.02Å; K1214-L1216 PolarHBondContact O-N 2.98Å; K1214-L1216 VanDerWaalsContact O-N 3.13Å
1215	S	37.8	Very low	52.8	Low	98.4 Å²	98.4	104.9 Å²	104.9	69%	0.688	55%	0.554	S	S	*	*			trans	-52.6	118.9	169	134.7	0	0	0	0	108.2	N1213 K1217	N1213-S1215 VanDerWaalsContact C-N 3.34Å; N1213-S1215 PolarHBondContact O-N 3.18Å; S1215-K1217 PolarHBondContact O-N 3.03Å; S1215-K1217 VanDerWaalsContact O-N 3.14Å
1216	L	33.3	Very low	50.2	Low	158.4 Å²	158.4	111.7 Å²	111.7	83%	0.829	58%	0.578	S	S	*	*			trans	-65.4	92.5	172.4	-158	77.5	0	0	0	107.4	K1214 S1218	K1214-L1216 PolarHBondContact O-N 2.98Å; K1214-L1216 VanDerWaalsContact O-N 3.13Å; L1216-S1218 VanDerWaalsContact C-N 3.3Å; L1216-S1218 PolarHBondContact O-N 2.92Å
1217	K	32.4	Very low	47.7	Very low	181.6 Å²	181.6	116 Å²	116	79%	0.79	60%	0.6	S	S	*	*			trans	-73.8	87	168.9	-75.8	-168	175.8	-171.5	0	108	S1215 G1219 D1225	S1215-K1217 PolarHBondContact O-N 3.03Å; S1215-K1217 VanDerWaalsContact O-N 3.14Å; K1217-G1219 PolarHBondContact O-N 2.87Å; K1217-D1225 IonicContact NZ-OD2 3.18Å; K1217-D1225 PolarHBondContact NZ-OD2 3.29Å
1218	S	31.9	Very low	45.3	Very low	107.6 Å²	107.6	119.7 Å²	119.7	75%	0.752	62%	0.618	S	S	*	*			trans	-90	120.4	159.3	48.2	0	0	0	0	108.1	L1216	L1216-S1218 VanDerWaalsContact C-N 3.3Å; L1216-S1218 PolarHBondContact O-N 2.92Å
1219	G	32.8	Very low	43.3	Very low	56.2 Å²	56.2	120 Å²	120	58%	0.579	62%	0.621	S	S	*	*	S	Bend	trans	134.2	117.1	179.5	0	0	0	0	0	112.7	K1217 D1221	K1217-G1219 PolarHBondContact O-N 2.87Å; G1219-D1221 VanDerWaalsContact C-N 3.31Å; G1219-D1221 PolarHBondContact O-N 3.05Å; G1219-D1221 VanDerWaalsContact O-N 3.15Å
1220	D	33.5	Very low	41.6	Very low	167.2 Å²	167.2	124 Å²	124	89%	0.894	64%	0.64	S	S	*	*			trans	-0.6	53.3	153.5	-52.6	-36.9	0	0	0	116.1
1221	D	36.2	Very low	40.4	Very low	158.8 Å²	158.8	126 Å²	126	85%	0.849	65%	0.65	S	S	*	*			trans	-121.6	94.7	163.4	-72.9	-48.2	0	0	0	109.1	G1219 E1223	G1219-D1221 VanDerWaalsContact C-N 3.31Å; G1219-D1221 PolarHBondContact O-N 3.05Å; G1219-D1221 VanDerWaalsContact O-N 3.15Å; D1221-E1223 VanDerWaalsContact C-N 3.31Å; D1221-E1223 PolarHBondContact O-N 3.21Å; D1221-E1223 VanDerWaalsContact O-N 3.08Å
1222	E	32.2	Very low	40.1	Very low	191.6 Å²	191.6	126.4 Å²	126.4	90%	0.895	65%	0.648	S	S	*	*			trans	-79.7	106.6	167.1	-68.5	-159.8	160.4	0	0	109.9
1223	E	32.4	Very low	40.8	Very low	184.6 Å²	184.6	122.8 Å²	122.8	86%	0.863	63%	0.632	S	S	*	*			trans	-178	130.9	161	-97.3	167.8	-155	0	0	113	D1221	D1221-E1223 VanDerWaalsContact C-N 3.31Å; D1221-E1223 PolarHBondContact O-N 3.21Å; D1221-E1223 VanDerWaalsContact O-N 3.08Å
1224	D	34.7	Very low	42.3	Very low	127.2 Å²	127.2	120.6 Å²	120.6	68%	0.68	63%	0.625	S	S	*	*			trans	78.1	69.2	163.8	-85.1	-24	0	0	0	119.1	R1226	D1224-R1226 VanDerWaalsContact C-N 3.34Å; D1224-R1226 PolarHBondContact O-N 2.69Å; D1224-R1226 VanDerWaalsContact O-N 3.08Å; D1224-R1226 IonicContact OD1-CZ 2.68Å; D1224-R1226 IonicContact OD1-NE 2.68Å; D1224-R1226 PolarHBondContact OD1-NE 2.88Å; D1224-R1226 IonicContact OD1-NH2 3.11Å; D1224-R1226 PolarHBondContact OD1-NH2 2.81Å
1225	D	32	Very low	44.2	Very low	148 Å²	148	112.7 Å²	112.7	79%	0.791	59%	0.591	S	S	*	*			trans	-95	63.2	168.1	-142.1	6	0	0	0	112.7	K1217	K1217-D1225 IonicContact NZ-OD2 3.18Å; K1217-D1225 PolarHBondContact NZ-OD2 3.29Å
1226	R	32.8	Very low	46.4	Very low	180.2 Å²	180.2	114.1 Å²	114.1	68%	0.68	58%	0.582	S	S	*	*			trans	-132.4	38.9	-177.7	-83.8	-166.3	-74.5	-157.4	-3	115.7	D1224 D1228 K1479	D1224-R1226 VanDerWaalsContact C-N 3.34Å; D1224-R1226 PolarHBondContact O-N 2.69Å; D1224-R1226 VanDerWaalsContact O-N 3.08Å; D1224-R1226 IonicContact OD1-CZ 2.68Å; D1224-R1226 IonicContact OD1-NE 2.68Å; D1224-R1226 PolarHBondContact OD1-NE 2.88Å; D1224-R1226 IonicContact OD1-NH2 3.11Å; D1224-R1226 PolarHBondContact OD1-NH2 2.81Å; R1226-D1228 VanDerWaalsContact C-N 3.27Å; R1226-D1228 PolarHBondContact O-N 3.2Å; R1226-K1479 PolarHBondContact O-NZ 3.26Å; R1226-K1479 VanDerWaalsContact O-NZ 3.11Å
1227	N	33.2	Very low	49.1	Very low	94.6 Å²	94.6	107.7 Å²	107.7	51%	0.506	55%	0.547	S	S	.	.			trans	-123.7	75.9	177.6	-66.7	-44.6	0	0	0	114	E1229 H1230 T1298 K1479	N1227-E1229 PolarHBondContact O-N 3.06Å; N1227-H1230 PolarHBondContact O-CD2 3.17Å; N1227-H1230 VanDerWaalsContact O-CD2 3.29Å; N1227-H1230 PolarHBondContact O-CE1 2.94Å; N1227-H1230 PolarHBondContact O-ND1 3.16Å; N1227-H1230 PolarHBondContact O-NE2 2.84Å; N1227-T1298 WeakPolarHBondContact OD1-CB 3.27Å; N1227-T1298 WeakPolarHBondContact OD1-CG2 3.44Å; N1227-T1298 PolarHBondContact OD1-OG1 2.76Å; N1227-K1479 PolarHBondContact OD1-NZ 2.9Å
1228	D	36.2	Very low	51.7	Low	109.6 Å²	109.6	104.6 Å²	104.6	59%	0.586	53%	0.534	S	S	*	.			trans	-74.1	66.8	179.4	-98.8	-35.7	0	0	0	114.8	R1147 R1226 H1230	R1147-D1228 IonicContact CZ-OD1 2.64Å; R1147-D1228 IonicContact CZ-OD2 3.63Å; R1147-D1228 IonicContact NH1-OD1 2.89Å; R1147-D1228 PolarHBondContact NH1-OD1 2.97Å; R1147-D1228 IonicContact NH1-OD2 3.63Å; R1147-D1228 PolarHBondContact NH1-OD2 2.83Å; R1147-D1228 IonicContact NH2-OD1 3.37Å; R1147-D1228 PolarHBondContact NH2-OD1 3.32Å; R1147-D1228 VanDerWaalsContact NH2-OD1 3.16Å; R1147-D1228 IonicContact NH2-OD2 3.1Å; R1147-D1228 PolarHBondContact NH2-OD2 3.27Å; R1147-D1228 VanDerWaalsContact NH2-OD2 3.08Å; R1226-D1228 VanDerWaalsContact C-N 3.27Å; R1226-D1228 PolarHBondContact O-N 3.2Å; D1228-H1230 VanDerWaalsContact C-N 3.31Å; D1228-H1230 WeakPolarHBondContact CA-ND1 3.18Å; D1228-H1230 PolarHBondContact O-N 3.11Å; D1228-H1230 IonicContact OD1-CD2 2.68Å; D1228-H1230 IonicContact OD1-CE1 3.64Å; D1228-H1230 IonicContact OD1-CG 2.69Å; D1228-H1230 IonicContact OD1-ND1 3.94Å; D1228-H1230 IonicContact OD1-NE2 3.17Å; D1228-H1230 IonicContact OD2-CD2 2.64Å; D1228-H1230 IonicContact OD2-CG 2.66Å
1229	E	40.8	Very low	54.5	Low	115.6 Å²	115.6	99.8 Å²	99.8	54%	0.54	50%	0.5	S	S	.	.			trans	-104.7	39.6	171.8	-72.5	-163.8	157.9	0	0	114.2	N1227 N1231 H1232 K1479 E1480	N1227-E1229 PolarHBondContact O-N 3.06Å; E1229-N1231 VanDerWaalsContact C-N 3.35Å; E1229-N1231 PolarHBondContact O-N 3.01Å; E1229-N1231 VanDerWaalsContact O-N 3.16Å; E1229-H1232 PolarHBondContact O-N 2.76Å; E1229-K1479 HydrophobicContact CG-CB 4.43Å; E1229-K1479 HydrophobicContact CG-CG 4.25Å; E1229-K1479 VanDerWaalsContact OE1-CA 3.25Å; E1229-K1479 WeakPolarHBondContact OE1-CA 2.87Å; E1229-K1479 WeakPolarHBondContact OE1-CB 3.35Å; E1229-K1479 PolarHBondContact OE1-N 3.43Å; E1229-E1480 PolarHBondContact OE1-N 3.28Å
1230	H	49.2	Very low	57.2	Low	85.6 Å²	85.6	99.7 Å²	99.7	40%	0.396	49%	0.486	S	S	.	.			trans	-86.7	25.7	-170.9	-70.4	-39.4	0	0	0	116	K1212 N1213 N1227 D1228 H1232 P1477 G1478	K1212-H1230 PolarHBondContact NZ-CD2 3.43Å; K1212-H1230 PolarHBondContact NZ-CE1 2.95Å; K1212-H1230 VanDerWaalsContact NZ-CG 3.28Å; K1212-H1230 PolarHBondContact NZ-ND1 2.82Å; K1212-H1230 PolarHBondContact NZ-NE2 2.79Å; N1213-H1230 PolarHBondContact ND2-O 2.88Å; N1227-H1230 PolarHBondContact O-CD2 3.17Å; N1227-H1230 VanDerWaalsContact O-CD2 3.29Å; N1227-H1230 PolarHBondContact O-CE1 2.94Å; N1227-H1230 PolarHBondContact O-ND1 3.16Å; N1227-H1230 PolarHBondContact O-NE2 2.84Å; D1228-H1230 VanDerWaalsContact C-N 3.31Å; D1228-H1230 WeakPolarHBondContact CA-ND1 3.18Å; D1228-H1230 PolarHBondContact O-N 3.11Å; D1228-H1230 IonicContact OD1-CD2 2.68Å; D1228-H1230 IonicContact OD1-CE1 3.64Å; D1228-H1230 IonicContact OD1-CG 2.69Å; D1228-H1230 IonicContact OD1-ND1 3.94Å; D1228-H1230 IonicContact OD1-NE2 3.17Å; D1228-H1230 IonicContact OD2-CD2 2.64Å; D1228-H1230 IonicContact OD2-CG 2.66Å; H1230-H1232 PolarHBondContact O-N 3.42Å; H1230-P1477 PolarHBondContact ND1-O 3.33Å; H1230-G1478 WeakPolarHBondContact CE1-CA 3.37Å
1231	N	61.1	Low	59.9	Low	42.4 Å²	42.4	91.8 Å²	91.8	23%	0.227	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	3.8	-171.4	-75.8	13.2	0	0	0	115.5	R1147 E1229 C1262 Y1263	R1147-N1231 PolarHBondContact NE-OD1 3.35Å; R1147-N1231 PolarHBondContact NH2-OD1 3.08Å; E1229-N1231 VanDerWaalsContact C-N 3.35Å; E1229-N1231 PolarHBondContact O-N 3.01Å; E1229-N1231 VanDerWaalsContact O-N 3.16Å; N1231-C1262 VanDerWaalsContact O-CA 3.25Å; N1231-C1262 WeakPolarHBondContact O-CA 3.18Å; N1231-C1262 VanDerWaalsContact O-CB 3.28Å; N1231-C1262 WeakPolarHBondContact O-CB 3.46Å; N1231-Y1263 HydrophobicContact CB-CD1 4.22Å; N1231-Y1263 HydrophobicContact CB-CE1 4.18Å; N1231-Y1263 VanDerWaalsContact CG-CZ 3.44Å; N1231-Y1263 WeakPolarHBondContact ND2-CD2 3.43Å; N1231-Y1263 VanDerWaalsContact ND2-CE2 3.31Å; N1231-Y1263 WeakPolarHBondContact ND2-CE2 3.33Å; N1231-Y1263 VanDerWaalsContact ND2-CZ 3.3Å; N1231-Y1263 PolarHBondContact ND2-O 3.15Å; N1231-Y1263 PolarHBondContact ND2-OH 3.19Å; N1231-Y1263 PolarHBondContact O-N 3.18Å; N1231-Y1263 PolarHBondContact OD1-OH 3.04Å; N1231-Y1263 VanDerWaalsContact OD1-OH 3.12Å
1232	H	67.6	Low	62.3	Low	53 Å²	53	88.8 Å²	88.8	25%	0.245	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	130	175.6	-171.6	70.5	0	0	0	111.5	E1229 H1230 S1234 D1260 Y1261 C1262 I1348 H1350	E1229-H1232 PolarHBondContact O-N 2.76Å; H1230-H1232 PolarHBondContact O-N 3.42Å; H1232-S1234 PolarHBondContact NE2-OG 3.01Å; H1232-D1260 IonicContact CE1-OD2 3.44Å; H1232-Y1261 CarbonylContact C-O 3.51Å; H1232-Y1261 WeakPolarHBondContact CA-O 3.28Å; H1232-Y1261 PolarHBondContact ND1-O 3.12Å; H1232-C1262 HydrophobicContact CB-CB 4.18Å; H1232-C1262 WeakPolarHBondContact ND1-CB 3.34Å; H1232-I1348 WeakPolarHBondContact CD2-CD1 3.45Å; H1232-I1348 WeakPolarHBondContact NE2-CD1 3.26Å; H1232-H1350 AromaticContact NE2-CE1 3.81Å
1233	Q	75.3	Confident	64.8	Low	32.4 Å²	32.4	80 Å²	80	15%	0.151	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	138.9	179.9	-79	166.9	46.5	0	0	109.3	K1208 L1209 I1210 N1213 D1260 Y1261	K1208-Q1233 PolarHBondContact O-OE1 2.99Å; L1209-Q1233 VanDerWaalsContact C-OE1 3.31Å; L1209-Q1233 HydrophobicContact CD1-CB 4.41Å; L1209-Q1233 HydrophobicContact CD1-CG 4.26Å; L1209-Q1233 VanDerWaalsContact CD1-O 3.3Å; L1209-Q1233 WeakPolarHBondContact CD1-O 3.26Å; L1209-Q1233 VanDerWaalsContact O-CB 3.29Å; L1209-Q1233 WeakPolarHBondContact O-CB 3.39Å; L1209-Q1233 VanDerWaalsContact O-CD 3.3Å; L1209-Q1233 WeakPolarHBondContact O-CG 3.31Å; L1209-Q1233 PolarHBondContact O-OE1 3.11Å; L1209-Q1233 VanDerWaalsContact O-OE1 3.08Å; I1210-Q1233 PolarHBondContact O-NE2 3.13Å; N1213-Q1233 PolarHBondContact ND2-NE2 2.71Å; Q1233-D1260 CarbonylContact O-C 3.56Å; Q1233-D1260 VanDerWaalsContact O-CA 3.31Å; Q1233-D1260 WeakPolarHBondContact O-CA 3.28Å; Q1233-Y1261 PolarHBondContact N-O 3.06Å; Q1233-Y1261 PolarHBondContact O-N 3.21Å
1234	S	79.1	Confident	66.9	Low	50.4 Å²	50.4	74.3 Å²	74.3	35%	0.352	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	142.6	174.6	-20.3	0	0	0	0	111.1	H1232 M1259 D1260	H1232-S1234 PolarHBondContact NE2-OG 3.01Å; S1234-M1259 CarbonylContact C-O 3.43Å; S1234-M1259 VanDerWaalsContact CA-O 3.27Å; S1234-M1259 WeakPolarHBondContact CA-O 3.36Å; S1234-M1259 WeakPolarHBondContact CB-O 3.43Å; S1234-D1260 WeakPolarHBondContact OG-CB 3.37Å
1235	I	84.2	Confident	68.7	Low	23 Å²	23	71.5 Å²	71.5	12%	0.118	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	140.5	175.2	51.8	173.8	0	0	0	110.1	L1205 K1208 L1209 F1237 S1258 M1259	L1205-I1235 HydrophobicContact CB-CD1 4.22Å; L1205-I1235 HydrophobicContact CD2-CD1 4.38Å; L1205-I1235 WeakPolarHBondContact O-CD1 3.17Å; K1208-I1235 HydrophobicContact CB-CD1 4.22Å; K1208-I1235 HydrophobicContact CD-CD1 4.27Å; K1208-I1235 HydrophobicContact CG-CD1 3.83Å; L1209-I1235 HydrophobicContact CB-CD1 3.96Å; L1209-I1235 HydrophobicContact CB-CG1 4.34Å; L1209-I1235 HydrophobicContact CD1-CB 4.27Å; L1209-I1235 HydrophobicContact CD1-CD1 4.31Å; L1209-I1235 HydrophobicContact CD1-CG1 4.12Å; L1209-I1235 HydrophobicContact CD1-CG2 4.47Å; I1235-F1237 HydrophobicContact CB-CD1 4.48Å; I1235-F1237 HydrophobicContact CD1-CD1 3.82Å; I1235-F1237 HydrophobicContact CD1-CE1 3.66Å; I1235-F1237 HydrophobicContact CG1-CD1 3.86Å; I1235-F1237 HydrophobicContact CG1-CE1 3.78Å; I1235-F1237 HydrophobicContact CG2-CD1 4.05Å; I1235-S1258 CarbonylContact O-C 3.34Å; I1235-S1258 WeakPolarHBondContact O-CA 3.39Å; I1235-S1258 PolarHBondContact O-OG 3.15Å; I1235-M1259 HydrophobicContact CD1-CE 4.17Å; I1235-M1259 HydrophobicContact CG1-CB 4.29Å; I1235-M1259 PolarHBondContact N-O 3.08Å; I1235-M1259 PolarHBondContact O-N 3.12Å
1236	R	83.7	Confident	70.4	Confident	129 Å²	129	65.4 Å²	65.4	49%	0.487	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	133.2	173.9	-126.1	-171.2	-171.7	-169.4	6.1	109.4	E1019 Q1256 I1257 N1346	E1019-R1236 VanDerWaalsContact CD-NE 3.29Å; E1019-R1236 IonicContact OE1-CZ 3.34Å; E1019-R1236 IonicContact OE1-NE 2.87Å; E1019-R1236 PolarHBondContact OE1-NE 2.92Å; E1019-R1236 IonicContact OE1-NH1 3.38Å; E1019-R1236 PolarHBondContact OE1-NH1 3.01Å; E1019-R1236 IonicContact OE1-NH2 3.76Å; E1019-R1236 PolarHBondContact OE1-NH2 2.76Å; E1019-R1236 IonicContact OE2-CZ 3.41Å; E1019-R1236 IonicContact OE2-NE 2.93Å; E1019-R1236 PolarHBondContact OE2-NE 3.14Å; E1019-R1236 IonicContact OE2-NH1 3.25Å; E1019-R1236 PolarHBondContact OE2-NH1 3.28Å; E1019-R1236 IonicContact OE2-NH2 3.48Å; E1019-R1236 PolarHBondContact OE2-NH2 2.88Å; R1236-Q1256 VanDerWaalsContact NE-NE2 3.16Å; R1236-Q1256 VanDerWaalsContact NH2-NE2 3.15Å; R1236-I1257 CarbonylContact C-O 3.6Å; R1236-I1257 WeakPolarHBondContact CA-O 3.23Å; R1236-N1346 PolarHBondContact NH1-OD1 2.84Å
1237	F	89.1	Confident	71.6	Confident	22.6 Å²	22.6	63.2 Å²	63.2	10%	0.099	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	172.3	-172.7	59.1	-84.8	0	0	0	111.6	I1201 L1205 I1235 I1239 I1257 M1259	I1201-F1237 HydrophobicContact CD1-CE2 4.39Å; I1201-F1237 HydrophobicContact CD1-CZ 4.25Å; I1201-F1237 HydrophobicContact CG1-CE2 4.11Å; I1201-F1237 HydrophobicContact CG1-CZ 4.27Å; I1201-F1237 HydrophobicContact CG2-CE2 4.04Å; I1201-F1237 HydrophobicContact CG2-CZ 3.82Å; L1205-F1237 HydrophobicContact CD1-CB 4.36Å; L1205-F1237 HydrophobicContact CD1-CD1 4.18Å; L1205-F1237 HydrophobicContact CD1-CD2 3.38Å; L1205-F1237 VanDerWaalsContact CD1-CD2 3.43Å; L1205-F1237 HydrophobicContact CD1-CE1 4.26Å; L1205-F1237 HydrophobicContact CD1-CE2 3.53Å; L1205-F1237 VanDerWaalsContact CD1-CE2 3.45Å; L1205-F1237 HydrophobicContact CD1-CG 3.72Å; L1205-F1237 HydrophobicContact CD1-CZ 4.03Å; I1235-F1237 HydrophobicContact CB-CD1 4.48Å; I1235-F1237 HydrophobicContact CD1-CD1 3.82Å; I1235-F1237 HydrophobicContact CD1-CE1 3.66Å; I1235-F1237 HydrophobicContact CG1-CD1 3.86Å; I1235-F1237 HydrophobicContact CG1-CE1 3.78Å; I1235-F1237 HydrophobicContact CG2-CD1 4.05Å; F1237-I1239 HydrophobicContact CD2-CG1 4Å; F1237-I1239 HydrophobicContact CD2-CG2 3.88Å; F1237-I1239 HydrophobicContact CE2-CD1 3.78Å; F1237-I1239 HydrophobicContact CE2-CG1 3.72Å; F1237-I1239 HydrophobicContact CE2-CG2 3.61Å; F1237-I1257 HydrophobicContact CE1-CB 4.37Å; F1237-I1257 HydrophobicContact CE1-CG2 4.24Å; F1237-I1257 HydrophobicContact CE2-CB 4.21Å; F1237-I1257 HydrophobicContact CE2-CD1 4.33Å; F1237-I1257 HydrophobicContact CZ-CB 4.2Å; F1237-I1257 HydrophobicContact CZ-CG2 4.1Å; F1237-I1257 PolarHBondContact N-O 3.01Å; F1237-I1257 PolarHBondContact O-N 2.95Å; F1237-I1257 VanDerWaalsContact O-O 3.11Å; F1237-M1259 HydrophobicContact CE1-CB 4.41Å; F1237-M1259 HydrophobicContact CE1-CE 3.77Å; F1237-M1259 HydrophobicContact CE1-CG 4.07Å; F1237-M1259 HydrophobicContact CE1-SD 4.07Å; F1237-M1259 HydrophobicContact CZ-CE 3.71Å; F1237-M1259 HydrophobicContact CZ-CG 4.24Å; F1237-M1259 HydrophobicContact CZ-SD 3.87Å
1238	F	88.5	Confident	72.9	Confident	116.8 Å²	116.8	63.2 Å²	63.2	51%	0.512	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	143.6	173.6	-62.6	-93.1	0	0	0	109.3	F1022 L1255 Q1256	F1022-F1238 HydrophobicContact CD2-CD1 4.39Å; F1022-F1238 AromaticContact CD2-CE1 3.89Å; F1022-F1238 HydrophobicContact CD2-CE1 4.06Å; F1022-F1238 HydrophobicContact CE2-CD1 4.45Å; F1022-F1238 AromaticContact CE2-CE1 3.73Å; F1022-F1238 HydrophobicContact CE2-CE1 3.73Å; F1022-F1238 HydrophobicContact CZ-CE1 4.44Å; F1238-L1255 CarbonylContact C-O 3.48Å; F1238-L1255 WeakPolarHBondContact CA-O 3.34Å; F1238-Q1256 HydrophobicContact CD1-CB 3.8Å; F1238-Q1256 HydrophobicContact CD1-CG 4.11Å; F1238-Q1256 HydrophobicContact CE1-CB 3.64Å; F1238-Q1256 HydrophobicContact CE1-CG 3.71Å; F1238-Q1256 VanDerWaalsContact CE1-OE1 3.27Å; F1238-Q1256 HydrophobicContact CE2-CG 4.44Å; F1238-Q1256 HydrophobicContact CG-CG 4.46Å; F1238-Q1256 HydrophobicContact CZ-CB 4.43Å; F1238-Q1256 HydrophobicContact CZ-CG 4.01Å
1239	I	89.6	Confident	74.3	Confident	7.2 Å²	7.2	59.7 Å²	59.7	4%	0.037	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	138.4	165.4	51.8	173.6	0	0	0	110	I1180 I1201 F1237 L1241 R1254 L1255 I1257	I1180-I1239 HydrophobicContact CB-CD1 4.04Å; I1180-I1239 HydrophobicContact CD1-CD1 3.73Å; I1180-I1239 HydrophobicContact CG1-CD1 3.88Å; I1180-I1239 HydrophobicContact CG2-CD1 4.36Å; I1201-I1239 HydrophobicContact CB-CD1 4.34Å; I1201-I1239 HydrophobicContact CD1-CD1 4.49Å; I1201-I1239 HydrophobicContact CG1-CD1 4.19Å; I1201-I1239 HydrophobicContact CG1-CG2 4.06Å; F1237-I1239 HydrophobicContact CD2-CG1 4Å; F1237-I1239 HydrophobicContact CD2-CG2 3.88Å; F1237-I1239 HydrophobicContact CE2-CD1 3.78Å; F1237-I1239 HydrophobicContact CE2-CG1 3.72Å; F1237-I1239 HydrophobicContact CE2-CG2 3.61Å; I1239-L1241 HydrophobicContact CD1-CD2 4.17Å; I1239-L1241 HydrophobicContact CG1-CD2 4.12Å; I1239-L1241 PolarHBondContact O-N 3.13Å; I1239-R1254 CarbonylContact O-C 3.52Å; I1239-R1254 VanDerWaalsContact O-CA 3.28Å; I1239-R1254 WeakPolarHBondContact O-CA 3.36Å; I1239-L1255 HydrophobicContact CD1-CB 4.4Å; I1239-L1255 HydrophobicContact CD1-CD2 4.39Å; I1239-L1255 HydrophobicContact CG1-CB 3.86Å; I1239-L1255 PolarHBondContact N-O 3.07Å; I1239-L1255 PolarHBondContact O-N 2.88Å; I1239-I1257 HydrophobicContact CB-CD1 4.46Å; I1239-I1257 HydrophobicContact CD1-CD1 3.52Å; I1239-I1257 VanDerWaalsContact CD1-CD1 3.45Å; I1239-I1257 HydrophobicContact CG1-CD1 3.84Å; I1239-I1257 HydrophobicContact CG1-CG1 4.44Å; I1239-I1257 HydrophobicContact CG2-CD1 4.22Å
1240	D	89.8	Confident	76	Confident	54.4 Å²	54.4	56.7 Å²	56.7	29%	0.291	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	129.9	168.5	-73.9	-32.1	0	0	0	109.2	Y1242 L1251 R1254	D1240-Y1242 HydrophobicContact CB-CE2 3.85Å; D1240-Y1242 WeakPolarHBondContact O-CD2 3.45Å; D1240-Y1242 WeakPolarHBondContact O-CE2 3.29Å; D1240-L1251 HydrophobicContact CB-CD1 3.48Å; D1240-L1251 VanDerWaalsContact CB-CD1 3.46Å; D1240-L1251 HydrophobicContact CB-CG 4.31Å; D1240-L1251 VanDerWaalsContact CG-CD1 3.4Å; D1240-L1251 WeakPolarHBondContact OD1-CD1 3.17Å; D1240-R1254 WeakPolarHBondContact OD1-CG 3.36Å; D1240-R1254 IonicContact OD1-CZ 3.59Å; D1240-R1254 VanDerWaalsContact OD1-CZ 3.26Å; D1240-R1254 IonicContact OD1-NE 2.98Å; D1240-R1254 PolarHBondContact OD1-NE 2.96Å; D1240-R1254 IonicContact OD1-NH2 3.28Å; D1240-R1254 PolarHBondContact OD1-NH2 3.06Å; D1240-R1254 IonicContact OD2-NH2 3.16Å
1241	L	89.4	Confident	77.6	Confident	0.4 Å²	0.4	56.3 Å²	56.3	0%	0.002	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134.5	173.8	-61.1	-178.9	0	0	0	109.1	L1021 L1182 A1197 I1239 L1251 N1252 G1253 L1255	L1021-L1241 HydrophobicContact CD1-CD1 3.52Å; L1021-L1241 VanDerWaalsContact CD1-CD1 3.47Å; L1182-L1241 HydrophobicContact CB-CD1 4.31Å; L1182-L1241 HydrophobicContact CD2-CD1 3.86Å; A1197-L1241 HydrophobicContact CB-CB 3.91Å; I1239-L1241 HydrophobicContact CD1-CD2 4.17Å; I1239-L1241 HydrophobicContact CG1-CD2 4.12Å; I1239-L1241 PolarHBondContact O-N 3.13Å; L1241-L1251 CarbonylContact O-C 3.38Å; L1241-L1251 WeakPolarHBondContact O-CA 3.37Å; L1241-N1252 WeakPolarHBondContact CB-O 3.37Å; L1241-N1252 CarbonylContact O-C 3.51Å; L1241-N1252 PolarHBondContact O-N 2.83Å; L1241-G1253 WeakPolarHBondContact CB-O 3.41Å; L1241-G1253 PolarHBondContact N-O 3.07Å; L1241-L1255 HydrophobicContact CD1-CB 4.2Å; L1241-L1255 HydrophobicContact CD2-CB 4.24Å; L1241-L1255 HydrophobicContact CD2-CD2 4.48Å; L1241-L1255 HydrophobicContact CG-CB 4.26Å
1242	Y	87.6	Confident	78.7	Confident	96.8 Å²	96.8	54.3 Å²	54.3	38%	0.38	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	135.9	-178.5	-62.1	-86	0	0	0	110.7	A1197 K1198 D1240 V1244 G1249 C1250 L1251	A1197-Y1242 CarbonylContact C-O 3.57Å; A1197-Y1242 VanDerWaalsContact CA-O 3.23Å; A1197-Y1242 WeakPolarHBondContact CA-O 3.3Å; A1197-Y1242 WeakPolarHBondContact CB-O 3.33Å; K1198-Y1242 PolarHBondContact N-O 3.14Å; K1198-Y1242 PolarHBondContact O-N 2.99Å; D1240-Y1242 HydrophobicContact CB-CE2 3.85Å; D1240-Y1242 WeakPolarHBondContact O-CD2 3.45Å; D1240-Y1242 WeakPolarHBondContact O-CE2 3.29Å; Y1242-V1244 PolarHBondContact O-N 3.01Å; Y1242-G1249 VanDerWaalsContact CD1-O 3.31Å; Y1242-G1249 WeakPolarHBondContact CD1-O 3.38Å; Y1242-C1250 WeakPolarHBondContact CA-O 3.36Å; Y1242-L1251 HydrophobicContact CD1-CB 4.39Å; Y1242-L1251 HydrophobicContact CE1-CB 4.23Å; Y1242-L1251 HydrophobicContact CE1-CD1 4.36Å
1243	D	84.1	Confident	79.6	Confident	7 Å²	7	51.9 Å²	51.9	4%	0.037	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	138.1	174.7	175.4	51.8	0	0	0	111.1	I1028 P1029 Y1032 N1245 S1246 C1250 N1252	I1028-D1243 HydrophobicContact CG2-CB 4.03Å; I1028-D1243 WeakPolarHBondContact CG2-OD1 2.95Å; P1029-D1243 WeakPolarHBondContact CD-OD1 3.44Å; Y1032-D1243 WeakPolarHBondContact CE2-OD2 3.08Å; D1243-N1245 PolarHBondContact OD1-N 3.07Å; D1243-N1245 PolarHBondContact OD1-ND2 3.03Å; D1243-N1245 WeakPolarHBondContact OD2-CA 3.5Å; D1243-N1245 PolarHBondContact OD2-N 3.07Å; D1243-S1246 WeakPolarHBondContact OD2-CA 3.45Å; D1243-S1246 WeakPolarHBondContact OD2-CB 3.38Å; D1243-S1246 PolarHBondContact OD2-N 2.99Å; D1243-S1246 PolarHBondContact OD2-OG 3.15Å; D1243-C1250 PolarHBondContact N-O 3.02Å; D1243-N1252 HydrophobicContact CB-CB 4.17Å
1244	V	77.1	Confident	80.3	Confident	63.4 Å²	63.4	55.3 Å²	55.3	38%	0.384	30%	0.303	S	S	.	.	S	Bend	trans	-82.5	-26.1	-174.4	-174.1	0	0	0	0	112.2	L1195 K1198 Y1242	L1195-V1244 HydrophobicContact CD2-CB 4.46Å; L1195-V1244 HydrophobicContact CD2-CG1 4.16Å; L1195-V1244 HydrophobicContact CD2-CG2 4.02Å; L1195-V1244 HydrophobicContact CG-CG2 3.92Å; K1198-V1244 HydrophobicContact CB-CG2 4.38Å; K1198-V1244 HydrophobicContact CD-CG2 4.27Å; K1198-V1244 HydrophobicContact CG-CG2 3.83Å; Y1242-V1244 PolarHBondContact O-N 3.01Å
1245	N	72.7	Confident	80.9	Confident	70 Å²	70	53 Å²	53	37%	0.374	29%	0.286	S	S	.	.	S	Bend	trans	-91	-25.7	-177.1	-63.2	-46.4	0	0	0	112.5	Y1032 D1243 S1247	Y1032-N1245 HydrophobicContact CD1-CB 3.99Å; Y1032-N1245 HydrophobicContact CD2-CB 3.28Å; Y1032-N1245 HydrophobicContact CE1-CB 4.18Å; Y1032-N1245 HydrophobicContact CE2-CB 3.5Å; Y1032-N1245 VanDerWaalsContact CE2-CB 3.45Å; Y1032-N1245 HydrophobicContact CG-CB 3.53Å; Y1032-N1245 VanDerWaalsContact CG-CB 3.5Å; D1243-N1245 PolarHBondContact OD1-N 3.07Å; D1243-N1245 PolarHBondContact OD1-ND2 3.03Å; D1243-N1245 WeakPolarHBondContact OD2-CA 3.5Å; D1243-N1245 PolarHBondContact OD2-N 3.07Å; N1245-S1247 PolarHBondContact O-N 3.09Å; N1245-S1247 VanDerWaalsContact O-N 3.1Å
1246	S	66.6	Low	81.2	Confident	19 Å²	19	53.2 Å²	53.2	13%	0.133	29%	0.287	C	S	.	.			trans	-71	104.5	175.2	-83.9	0	0	0	0	112	Y1032 D1243 S1248 G1249	Y1032-S1246 PolarHBondContact OH-OG 3.35Å; D1243-S1246 WeakPolarHBondContact OD2-CA 3.45Å; D1243-S1246 WeakPolarHBondContact OD2-CB 3.38Å; D1243-S1246 PolarHBondContact OD2-N 2.99Å; D1243-S1246 PolarHBondContact OD2-OG 3.15Å; S1246-S1248 PolarHBondContact O-N 3.15Å; S1246-S1248 PolarHBondContact OG-OG 3.01Å; S1246-G1249 PolarHBondContact O-N 3.08Å
1247	S	59.1	Low	81.5	Confident	133.2 Å²	133.2	47.1 Å²	47.1	93%	0.931	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-14.6	171	42	0	0	0	0	114.4	N1245	N1245-S1247 PolarHBondContact O-N 3.09Å; N1245-S1247 VanDerWaalsContact O-N 3.1Å
1248	S	60.3	Low	81.4	Confident	96.4 Å²	96.4	46.6 Å²	46.6	67%	0.674	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-6.9	176.3	61.8	0	0	0	0	114.7	S1246	S1246-S1248 PolarHBondContact O-N 3.15Å; S1246-S1248 PolarHBondContact OG-OG 3.01Å
1249	G	65.7	Low	81.5	Confident	35.8 Å²	35.8	41.1 Å²	41.1	37%	0.369	24%	0.239	S	C	.	.			trans	62.6	47.2	-172	0	0	0	0	0	111.8	Y1242 S1246 L1251	Y1242-G1249 VanDerWaalsContact CD1-O 3.31Å; Y1242-G1249 WeakPolarHBondContact CD1-O 3.38Å; S1246-G1249 PolarHBondContact O-N 3.08Å; G1249-L1251 PolarHBondContact O-N 2.92Å
1250	C	75.9	Confident	81.3	Confident	52.2 Å²	52.2	41.7 Å²	41.7	35%	0.353	24%	0.242	S	C	.	.			trans	-67.7	128.9	-179	-166.4	0	0	0	0	110.5	Y1242 D1243 N1252	Y1242-C1250 WeakPolarHBondContact CA-O 3.36Å; D1243-C1250 PolarHBondContact N-O 3.02Å; C1250-N1252 PolarHBondContact O-N 3.11Å
1251	L	83.3	Confident	81.2	Confident	76.2 Å²	76.2	39.2 Å²	39.2	40%	0.399	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	123.2	171.5	-176.7	87.9	0	0	0	109.1	D1240 L1241 Y1242 G1249	D1240-L1251 HydrophobicContact CB-CD1 3.48Å; D1240-L1251 VanDerWaalsContact CB-CD1 3.46Å; D1240-L1251 HydrophobicContact CB-CG 4.31Å; D1240-L1251 VanDerWaalsContact CG-CD1 3.4Å; D1240-L1251 WeakPolarHBondContact OD1-CD1 3.17Å; L1241-L1251 CarbonylContact O-C 3.38Å; L1241-L1251 WeakPolarHBondContact O-CA 3.37Å; Y1242-L1251 HydrophobicContact CD1-CB 4.39Å; Y1242-L1251 HydrophobicContact CE1-CB 4.23Å; Y1242-L1251 HydrophobicContact CE1-CD1 4.36Å; G1249-L1251 PolarHBondContact O-N 2.92Å
1252	N	84.8	Confident	80.8	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.011	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	77.4	177.6	-172.5	13.3	0	0	0	109.7	F1024 D1025 I1028 P1029 L1241 D1243 C1250	F1024-N1252 WeakPolarHBondContact CD2-O 3.47Å; F1024-N1252 VanDerWaalsContact CD2-OD1 3.32Å; F1024-N1252 WeakPolarHBondContact CD2-OD1 3.32Å; F1024-N1252 WeakPolarHBondContact CE2-ND2 3.27Å; D1025-N1252 PolarHBondContact N-OD1 3.13Å; D1025-N1252 PolarHBondContact O-ND2 3.07Å; D1025-N1252 PolarHBondContact O-OD1 3.16Å; I1028-N1252 HydrophobicContact CD1-CB 4.37Å; P1029-N1252 WeakPolarHBondContact CD-ND2 3.38Å; L1241-N1252 WeakPolarHBondContact CB-O 3.37Å; L1241-N1252 CarbonylContact O-C 3.51Å; L1241-N1252 PolarHBondContact O-N 2.83Å; D1243-N1252 HydrophobicContact CB-CB 4.17Å; C1250-N1252 PolarHBondContact O-N 3.11Å
1253	G	86.6	Confident	80.5	Confident	2.2 Å²	2.2	36 Å²	36	2%	0.023	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	92	171.7	178.1	0	0	0	0	0	115.9	F1022 D1023 L1241	F1022-G1253 CarbonylContact O-C 3.54Å; F1022-G1253 WeakPolarHBondContact O-CA 3.36Å; D1023-G1253 VanDerWaalsContact C-CA 3.45Å; D1023-G1253 VanDerWaalsContact O-CA 3.29Å; D1023-G1253 WeakPolarHBondContact O-CA 3.34Å; D1023-G1253 PolarHBondContact O-N 3.14Å; L1241-G1253 WeakPolarHBondContact CB-O 3.41Å; L1241-G1253 PolarHBondContact N-O 3.07Å
1254	R	89.6	Confident	79.9	Confident	104 Å²	104	39.2 Å²	39.2	39%	0.392	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	136.3	179.2	-74.4	-179.3	162.3	158.5	2.3	110.3	L1021 F1022 I1239 D1240	L1021-R1254 CarbonylContact C-O 3.51Å; L1021-R1254 WeakPolarHBondContact CA-O 3.45Å; F1022-R1254 HydrophobicContact CB-CB 4.36Å; F1022-R1254 PolarHBondContact N-O 2.92Å; F1022-R1254 PolarHBondContact O-N 3.16Å; I1239-R1254 CarbonylContact O-C 3.52Å; I1239-R1254 VanDerWaalsContact O-CA 3.28Å; I1239-R1254 WeakPolarHBondContact O-CA 3.36Å; D1240-R1254 WeakPolarHBondContact OD1-CG 3.36Å; D1240-R1254 IonicContact OD1-CZ 3.59Å; D1240-R1254 VanDerWaalsContact OD1-CZ 3.26Å; D1240-R1254 IonicContact OD1-NE 2.98Å; D1240-R1254 PolarHBondContact OD1-NE 2.96Å; D1240-R1254 IonicContact OD1-NH2 3.28Å; D1240-R1254 PolarHBondContact OD1-NH2 3.06Å; D1240-R1254 IonicContact OD2-NH2 3.16Å
1255	L	90.7	Very high	79.7	Confident	0.6 Å²	0.6	38.9 Å²	38.9	0%	0.003	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	123.1	178.5	-172.4	62.7	0	0	0	109.8	F1018 L1021 V1049 F1095 I1180 F1238 I1239 L1241 I1257	F1018-L1255 HydrophobicContact CD1-CD1 4.48Å; F1018-L1255 HydrophobicContact CD1-CD2 3.63Å; F1018-L1255 HydrophobicContact CD1-CG 4.16Å; F1018-L1255 HydrophobicContact CE1-CD2 3.84Å; L1021-L1255 HydrophobicContact CB-CD1 4.41Å; L1021-L1255 HydrophobicContact CD1-CD1 4.38Å; V1049-L1255 HydrophobicContact CG1-CD2 4.13Å; V1049-L1255 HydrophobicContact CG2-CD1 4.38Å; V1049-L1255 HydrophobicContact CG2-CD2 4.03Å; F1095-L1255 HydrophobicContact CD2-CD1 4.34Å; F1095-L1255 HydrophobicContact CE2-CD1 3.54Å; F1095-L1255 VanDerWaalsContact CE2-CD1 3.49Å; F1095-L1255 HydrophobicContact CZ-CD1 4.21Å; I1180-L1255 HydrophobicContact CG2-CD2 3.9Å; F1238-L1255 CarbonylContact C-O 3.48Å; F1238-L1255 WeakPolarHBondContact CA-O 3.34Å; I1239-L1255 HydrophobicContact CD1-CB 4.4Å; I1239-L1255 HydrophobicContact CD1-CD2 4.39Å; I1239-L1255 HydrophobicContact CG1-CB 3.86Å; I1239-L1255 PolarHBondContact N-O 3.07Å; I1239-L1255 PolarHBondContact O-N 2.88Å; L1241-L1255 HydrophobicContact CD1-CB 4.2Å; L1241-L1255 HydrophobicContact CD2-CB 4.24Å; L1241-L1255 HydrophobicContact CD2-CD2 4.48Å; L1241-L1255 HydrophobicContact CG-CB 4.26Å; L1255-I1257 HydrophobicContact CD2-CD1 4.15Å; L1255-I1257 HydrophobicContact CD2-CG1 4.31Å; L1255-I1257 HydrophobicContact CG-CD1 4.3Å; L1255-I1257 HydrophobicContact CG-CG1 4.06Å
1256	Q	90.8	Very high	79.3	Confident	28 Å²	28	39.8 Å²	39.8	13%	0.131	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	124.9	174.4	-172.6	173.4	-22.3	0	0	110	E1019 Q1020 F1022 R1236 F1238	E1019-Q1256 HydrophobicContact CB-CB 4.38Å; E1019-Q1256 HydrophobicContact CB-CG 4.24Å; E1019-Q1256 PolarHBondContact N-O 3.14Å; E1019-Q1256 VanDerWaalsContact N-O 3.07Å; E1019-Q1256 VanDerWaalsContact OE2-CD 3.3Å; E1019-Q1256 WeakPolarHBondContact OE2-CG 3.46Å; E1019-Q1256 PolarHBondContact OE2-NE2 2.98Å; Q1020-Q1256 HydrophobicContact CB-CB 4.5Å; Q1020-Q1256 WeakPolarHBondContact O-CB 3.44Å; Q1020-Q1256 PolarHBondContact O-N 3.08Å; F1022-Q1256 HydrophobicContact CD2-CB 4.49Å; F1022-Q1256 HydrophobicContact CE2-CB 3.93Å; F1022-Q1256 VanDerWaalsContact CE2-OE1 3.29Å; R1236-Q1256 VanDerWaalsContact NE-NE2 3.16Å; R1236-Q1256 VanDerWaalsContact NH2-NE2 3.15Å; F1238-Q1256 HydrophobicContact CD1-CB 3.8Å; F1238-Q1256 HydrophobicContact CD1-CG 4.11Å; F1238-Q1256 HydrophobicContact CE1-CB 3.64Å; F1238-Q1256 HydrophobicContact CE1-CG 3.71Å; F1238-Q1256 VanDerWaalsContact CE1-OE1 3.27Å; F1238-Q1256 HydrophobicContact CE2-CG 4.44Å; F1238-Q1256 HydrophobicContact CG-CG 4.46Å; F1238-Q1256 HydrophobicContact CZ-CB 4.43Å; F1238-Q1256 HydrophobicContact CZ-CG 4.01Å
1257	I	90.9	Very high	78.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	136.1	-172.9	-54.9	177	0	0	0	109	I1016 T1017 F1018 I1180 I1201 R1236 F1237 I1239 L1255 M1259	I1016-I1257 HydrophobicContact CG2-CG2 4.34Å; T1017-I1257 WeakPolarHBondContact O-CA 3.36Å; T1017-I1257 WeakPolarHBondContact O-CG2 3.21Å; F1018-I1257 HydrophobicContact CD1-CD1 4.19Å; F1018-I1257 HydrophobicContact CD1-CG1 3.99Å; F1018-I1257 HydrophobicContact CE1-CD1 3.87Å; F1018-I1257 HydrophobicContact CE1-CG1 4.18Å; F1018-I1257 HydrophobicContact CE1-CG2 4.48Å; I1180-I1257 HydrophobicContact CD1-CD1 3.57Å; I1180-I1257 HydrophobicContact CG1-CD1 4.47Å; I1201-I1257 HydrophobicContact CD1-CD1 3.86Å; I1201-I1257 HydrophobicContact CG1-CD1 4.21Å; R1236-I1257 CarbonylContact C-O 3.6Å; R1236-I1257 WeakPolarHBondContact CA-O 3.23Å; F1237-I1257 HydrophobicContact CE1-CB 4.37Å; F1237-I1257 HydrophobicContact CE1-CG2 4.24Å; F1237-I1257 HydrophobicContact CE2-CB 4.21Å; F1237-I1257 HydrophobicContact CE2-CD1 4.33Å; F1237-I1257 HydrophobicContact CZ-CB 4.2Å; F1237-I1257 HydrophobicContact CZ-CG2 4.1Å; F1237-I1257 PolarHBondContact N-O 3.01Å; F1237-I1257 PolarHBondContact O-N 2.95Å; F1237-I1257 VanDerWaalsContact O-O 3.11Å; I1239-I1257 HydrophobicContact CB-CD1 4.46Å; I1239-I1257 HydrophobicContact CD1-CD1 3.52Å; I1239-I1257 VanDerWaalsContact CD1-CD1 3.45Å; I1239-I1257 HydrophobicContact CG1-CD1 3.84Å; I1239-I1257 HydrophobicContact CG1-CG1 4.44Å; I1239-I1257 HydrophobicContact CG2-CD1 4.22Å; L1255-I1257 HydrophobicContact CD2-CD1 4.15Å; L1255-I1257 HydrophobicContact CD2-CG1 4.31Å; L1255-I1257 HydrophobicContact CG-CD1 4.3Å; L1255-I1257 HydrophobicContact CG-CG1 4.06Å; I1257-M1259 HydrophobicContact CG2-CG 4Å
1258	S	86.9	Confident	77.7	Confident	12.4 Å²	12.4	44.9 Å²	44.9	9%	0.087	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.3	162.2	167.8	0	0	0	0	109.1	T1017 E1019 I1235 Y1388	T1017-S1258 WeakPolarHBondContact CA-O 3.47Å; T1017-S1258 VanDerWaalsContact CB-O 3.31Å; T1017-S1258 WeakPolarHBondContact CB-O 3.22Å; T1017-S1258 VanDerWaalsContact CB-OG 3.23Å; T1017-S1258 WeakPolarHBondContact CB-OG 3.48Å; T1017-S1258 WeakPolarHBondContact CG2-OG 3.33Å; T1017-S1258 PolarHBondContact N-O 3.23Å; T1017-S1258 PolarHBondContact O-N 3.22Å; T1017-S1258 WeakPolarHBondContact OG1-CB 3.47Å; T1017-S1258 PolarHBondContact OG1-O 2.99Å; T1017-S1258 PolarHBondContact OG1-OG 2.83Å; T1017-S1258 VanDerWaalsContact OG1-OG 3.04Å; E1019-S1258 WeakPolarHBondContact OE1-CB 3.36Å; E1019-S1258 PolarHBondContact OE1-OG 2.82Å; I1235-S1258 CarbonylContact O-C 3.34Å; I1235-S1258 WeakPolarHBondContact O-CA 3.39Å; I1235-S1258 PolarHBondContact O-OG 3.15Å; S1258-Y1388 PolarHBondContact OG-OH 3.28Å
1259	M	89.5	Confident	76.6	Confident	1.4 Å²	1.4	43.4 Å²	43.4	1%	0.007	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	141.7	174.5	-68.4	-176.6	146.5	0	0	110	G1015 I1016 L1178 I1201 L1206 L1209 S1234 I1235 F1237 I1257	G1015-M1259 VanDerWaalsContact O-CA 3.27Å; G1015-M1259 WeakPolarHBondContact O-CA 3.4Å; I1016-M1259 HydrophobicContact CD1-CE 3.81Å; I1016-M1259 HydrophobicContact CG1-CE 3.86Å; I1016-M1259 HydrophobicContact CG1-CG 4.4Å; I1016-M1259 HydrophobicContact CG1-SD 4.31Å; I1016-M1259 HydrophobicContact CG2-CE 4.09Å; I1016-M1259 HydrophobicContact CG2-CG 4.48Å; L1178-M1259 HydrophobicContact CD2-CE 4.05Å; I1201-M1259 HydrophobicContact CD1-CE 3.55Å; I1201-M1259 VanDerWaalsContact CD1-CE 3.45Å; I1201-M1259 HydrophobicContact CD1-SD 4.06Å; I1201-M1259 HydrophobicContact CG1-CE 4.45Å; I1201-M1259 HydrophobicContact CG2-CE 4.22Å; I1201-M1259 HydrophobicContact CG2-SD 4.31Å; L1206-M1259 HydrophobicContact CD2-CE 4.13Å; L1206-M1259 HydrophobicContact CD2-SD 4.42Å; L1209-M1259 HydrophobicContact CD1-CB 4.45Å; L1209-M1259 HydrophobicContact CD2-CB 3.73Å; L1209-M1259 HydrophobicContact CD2-CE 4.01Å; L1209-M1259 HydrophobicContact CD2-CG 4.46Å; L1209-M1259 HydrophobicContact CD2-SD 4.28Å; S1234-M1259 CarbonylContact C-O 3.43Å; S1234-M1259 VanDerWaalsContact CA-O 3.27Å; S1234-M1259 WeakPolarHBondContact CA-O 3.36Å; S1234-M1259 WeakPolarHBondContact CB-O 3.43Å; I1235-M1259 HydrophobicContact CD1-CE 4.17Å; I1235-M1259 HydrophobicContact CG1-CB 4.29Å; I1235-M1259 PolarHBondContact N-O 3.08Å; I1235-M1259 PolarHBondContact O-N 3.12Å; F1237-M1259 HydrophobicContact CE1-CB 4.41Å; F1237-M1259 HydrophobicContact CE1-CE 3.77Å; F1237-M1259 HydrophobicContact CE1-CG 4.07Å; F1237-M1259 HydrophobicContact CE1-SD 4.07Å; F1237-M1259 HydrophobicContact CZ-CE 3.71Å; F1237-M1259 HydrophobicContact CZ-CG 4.24Å; F1237-M1259 HydrophobicContact CZ-SD 3.87Å; I1257-M1259 HydrophobicContact CG2-CG 4Å
1260	D	85.4	Confident	74.9	Confident	20.6 Å²	20.6	46.4 Å²	46.4	11%	0.11	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	148	174.2	65.8	-86.7	0	0	0	111	I1014 G1015 H1232 Q1233 S1234 Y1388	I1014-D1260 CarbonylContact C-O 3.53Å; I1014-D1260 VanDerWaalsContact CA-O 3.29Å; I1014-D1260 WeakPolarHBondContact CA-O 3.38Å; G1015-D1260 WeakPolarHBondContact CA-OD1 3.35Å; G1015-D1260 PolarHBondContact N-O 3.03Å; G1015-D1260 PolarHBondContact N-OD2 2.93Å; G1015-D1260 PolarHBondContact O-N 3.1Å; H1232-D1260 IonicContact CE1-OD2 3.44Å; Q1233-D1260 CarbonylContact O-C 3.56Å; Q1233-D1260 VanDerWaalsContact O-CA 3.31Å; Q1233-D1260 WeakPolarHBondContact O-CA 3.28Å; S1234-D1260 WeakPolarHBondContact OG-CB 3.37Å; D1260-Y1388 WeakPolarHBondContact CB-OH 3.35Å
1261	Y	87.3	Confident	72.7	Confident	2.2 Å²	2.2	48.9 Å²	48.9	1%	0.009	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	136.8	179.9	169.5	-111.2	0	0	0	110	H1012 R1013 I1014 F1154 L1209 I1210 H1232 Q1233 Y1263	H1012-Y1261 HydrophobicContact CB-CE2 4.14Å; H1012-Y1261 PolarHBondContact CE1-OH 3.11Å; H1012-Y1261 AromaticContact ND1-CE2 3.75Å; H1012-Y1261 AromaticContact ND1-CZ 3.79Å; H1012-Y1261 PolarHBondContact ND1-OH 3.05Å; R1013-Y1261 WeakPolarHBondContact O-CA 3.41Å; R1013-Y1261 VanDerWaalsContact O-CD2 3.32Å; R1013-Y1261 WeakPolarHBondContact O-CD2 3.35Å; I1014-Y1261 HydrophobicContact CG1-CD2 3.81Å; I1014-Y1261 HydrophobicContact CG1-CE2 4.49Å; F1154-Y1261 AromaticContact CD1-CE2 3.85Å; F1154-Y1261 HydrophobicContact CD1-CE2 3.85Å; F1154-Y1261 AromaticContact CD1-CZ 4Å; F1154-Y1261 HydrophobicContact CE1-CD2 4.19Å; F1154-Y1261 AromaticContact CE1-CE2 3.51Å; F1154-Y1261 HydrophobicContact CE1-CE2 3.51Å; F1154-Y1261 VanDerWaalsContact CE1-CE2 3.45Å; F1154-Y1261 HydrophobicContact CZ-CE2 4.41Å; L1209-Y1261 HydrophobicContact CG-CG 4.49Å; L1209-Y1261 WeakPolarHBondContact O-CD1 3.46Å; I1210-Y1261 HydrophobicContact CB-CD1 4.25Å; I1210-Y1261 HydrophobicContact CB-CE1 4.13Å; I1210-Y1261 HydrophobicContact CG1-CD1 3.99Å; I1210-Y1261 HydrophobicContact CG1-CD2 4.25Å; I1210-Y1261 HydrophobicContact CG1-CE1 4.11Å; I1210-Y1261 HydrophobicContact CG1-CE2 4.36Å; I1210-Y1261 HydrophobicContact CG1-CG 4.06Å; I1210-Y1261 HydrophobicContact CG2-CD1 4.32Å; I1210-Y1261 HydrophobicContact CG2-CE1 3.69Å; H1232-Y1261 CarbonylContact C-O 3.51Å; H1232-Y1261 WeakPolarHBondContact CA-O 3.28Å; H1232-Y1261 PolarHBondContact ND1-O 3.12Å; Q1233-Y1261 PolarHBondContact N-O 3.06Å; Q1233-Y1261 PolarHBondContact O-N 3.21Å; Y1261-Y1263 AromaticContact CE1-CD1 3.95Å; Y1261-Y1263 HydrophobicContact CE1-CD1 4.04Å; Y1261-Y1263 AromaticContact CZ-CD1 3.91Å; Y1261-Y1263 VanDerWaalsContact OH-CD1 3.25Å; Y1261-Y1263 WeakPolarHBondContact OH-CD1 3.42Å
1262	C	81.9	Confident	70	Confident	20.8 Å²	20.8	54.4 Å²	54.4	14%	0.141	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	164.3	162.6	61.1	0	0	0	0	111.7	H1012 R1013 N1231 H1232	H1012-C1262 CarbonylContact C-O 3.52Å; R1013-C1262 PolarHBondContact N-O 3.18Å; R1013-C1262 PolarHBondContact O-N 3.07Å; R1013-C1262 VanDerWaalsContact O-N 3.08Å; N1231-C1262 VanDerWaalsContact O-CA 3.25Å; N1231-C1262 WeakPolarHBondContact O-CA 3.18Å; N1231-C1262 VanDerWaalsContact O-CB 3.28Å; N1231-C1262 WeakPolarHBondContact O-CB 3.46Å; H1232-C1262 HydrophobicContact CB-CB 4.18Å; H1232-C1262 WeakPolarHBondContact ND1-CB 3.34Å
1263	Y	81.5	Confident	67.3	Low	8.2 Å²	8.2	63.1 Å²	63.1	3%	0.032	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	146.5	173.6	72.8	-89.8	0	0	0	113	V1010 E1011 R1147 I1150 E1151 N1231 Y1261 I1265	V1010-Y1263 HydrophobicContact CG1-CD2 3.73Å; V1010-Y1263 HydrophobicContact CG1-CG 4.23Å; E1011-Y1263 CarbonylContact O-C 3.52Å; E1011-Y1263 VanDerWaalsContact O-CA 3.22Å; E1011-Y1263 WeakPolarHBondContact O-CA 3.23Å; E1011-Y1263 WeakPolarHBondContact O-CB 3.37Å; R1147-Y1263 WeakPolarHBondContact CG-OH 3.43Å; I1150-Y1263 HydrophobicContact CB-CE2 4.43Å; I1150-Y1263 HydrophobicContact CD1-CD2 4.36Å; I1150-Y1263 HydrophobicContact CD1-CE2 3.72Å; I1150-Y1263 HydrophobicContact CG2-CD1 4.39Å; I1150-Y1263 HydrophobicContact CG2-CD2 3.84Å; I1150-Y1263 HydrophobicContact CG2-CE1 4.38Å; I1150-Y1263 HydrophobicContact CG2-CE2 3.9Å; I1150-Y1263 HydrophobicContact CG2-CG 4.1Å; E1151-Y1263 HydrophobicContact CG-CE1 4.47Å; N1231-Y1263 HydrophobicContact CB-CD1 4.22Å; N1231-Y1263 HydrophobicContact CB-CE1 4.18Å; N1231-Y1263 VanDerWaalsContact CG-CZ 3.44Å; N1231-Y1263 WeakPolarHBondContact ND2-CD2 3.43Å; N1231-Y1263 VanDerWaalsContact ND2-CE2 3.31Å; N1231-Y1263 WeakPolarHBondContact ND2-CE2 3.33Å; N1231-Y1263 VanDerWaalsContact ND2-CZ 3.3Å; N1231-Y1263 PolarHBondContact ND2-O 3.15Å; N1231-Y1263 PolarHBondContact ND2-OH 3.19Å; N1231-Y1263 PolarHBondContact O-N 3.18Å; N1231-Y1263 PolarHBondContact OD1-OH 3.04Å; N1231-Y1263 VanDerWaalsContact OD1-OH 3.12Å; Y1261-Y1263 AromaticContact CE1-CD1 3.95Å; Y1261-Y1263 HydrophobicContact CE1-CD1 4.04Å; Y1261-Y1263 AromaticContact CZ-CD1 3.91Å; Y1261-Y1263 VanDerWaalsContact OH-CD1 3.25Å; Y1261-Y1263 WeakPolarHBondContact OH-CD1 3.42Å; Y1263-I1265 HydrophobicContact CD2-CG1 4.47Å; Y1263-I1265 HydrophobicContact CE2-CG1 4.39Å
1264	N	72.1	Confident	64.4	Low	73.6 Å²	73.6	69.3 Å²	69.3	39%	0.394	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	131.7	177.4	-70.1	-21.3	0	0	0	110.1	V1010 E1011 R1013 I1266	V1010-N1264 CarbonylContact C-O 3.47Å; V1010-N1264 WeakPolarHBondContact CA-O 3.33Å; E1011-N1264 PolarHBondContact N-O 2.98Å; E1011-N1264 PolarHBondContact O-N 3.11Å; R1013-N1264 PolarHBondContact NH1-OD1 3.2Å; R1013-N1264 VanDerWaalsContact NH2-CG 3.26Å; R1013-N1264 PolarHBondContact NH2-ND2 3.36Å; R1013-N1264 PolarHBondContact NH2-OD1 2.99Å; N1264-I1266 PolarHBondContact O-N 3.01Å
1265	I	72.6	Confident	61.5	Low	59 Å²	59	71.1 Å²	71.1	30%	0.303	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	114.1	173.3	-56.7	175.7	0	0	0	108	L1008 V1010 I1146 I1150 Y1263 N1267 R1268	L1008-I1265 HydrophobicContact CD1-CD1 4.48Å; L1008-I1265 HydrophobicContact CD1-CG2 4.14Å; L1008-I1265 HydrophobicContact CD2-CG2 3.78Å; V1010-I1265 HydrophobicContact CG2-CG1 4.22Å; I1146-I1265 HydrophobicContact CG2-CD1 4.44Å; I1150-I1265 HydrophobicContact CD1-CD1 3.94Å; I1150-I1265 HydrophobicContact CD1-CG1 4.21Å; Y1263-I1265 HydrophobicContact CD2-CG1 4.47Å; Y1263-I1265 HydrophobicContact CE2-CG1 4.39Å; I1265-N1267 PolarHBondContact O-N 3.43Å; I1265-R1268 HydrophobicContact CG2-CG 4.44Å
1266	I	63.2	Low	58.5	Low	87.6 Å²	87.6	76.6 Å²	76.6	45%	0.449	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-26.1	-174.3	-66.8	-179.8	0	0	0	111.5	T1009 E1011 N1264 R1268	T1009-I1266 HydrophobicContact CG2-CB 4.42Å; T1009-I1266 PolarHBondContact O-N 3.05Å; E1011-I1266 HydrophobicContact CB-CD1 3.61Å; E1011-I1266 HydrophobicContact CB-CG1 4.19Å; N1264-I1266 PolarHBondContact O-N 3.01Å; I1266-R1268 PolarHBondContact O-N 2.86Å
1267	N	52.7	Low	55.6	Low	91.6 Å²	91.6	82.4 Å²	82.4	49%	0.49	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	117	-173.8	-124.3	-18	0	0	0	112.2	L1008 T1009 I1265 S1269	L1008-N1267 WeakPolarHBondContact CD2-O 3.15Å; T1009-N1267 HydrophobicContact CG2-CB 4.38Å; T1009-N1267 PolarHBondContact N-O 3.09Å; T1009-N1267 VanDerWaalsContact OG1-CB 3.27Å; T1009-N1267 WeakPolarHBondContact OG1-CB 3.18Å; T1009-N1267 PolarHBondContact OG1-N 2.99Å; T1009-N1267 VanDerWaalsContact OG1-N 3.13Å; I1265-N1267 PolarHBondContact O-N 3.43Å; N1267-S1269 PolarHBondContact O-N 2.9Å; N1267-S1269 PolarHBondContact OD1-N 3.14Å
1268	R	40.7	Very low	52.5	Low	167.4 Å²	167.4	87.7 Å²	87.7	63%	0.632	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	91.3	159.5	-77.9	-176.4	171.5	-177	-0.6	108.6	L1008 M1143 I1265 I1266 S1270 N1290 Q1292	L1008-R1268 HydrophobicContact CD2-CB 4.26Å; L1008-R1268 HydrophobicContact CD2-CG 3.77Å; M1143-R1268 PolarHBondContact SD-NH2 2.96Å; I1265-R1268 HydrophobicContact CG2-CG 4.44Å; I1266-R1268 PolarHBondContact O-N 2.86Å; R1268-S1270 VanDerWaalsContact C-N 3.33Å; R1268-S1270 PolarHBondContact O-N 3.04Å; R1268-S1270 VanDerWaalsContact O-N 3.14Å; R1268-N1290 PolarHBondContact NH1-O 2.77Å; R1268-Q1292 VanDerWaalsContact N-OE1 3.16Å
1269	S	35.9	Very low	49.7	Very low	66.2 Å²	66.2	96.3 Å²	96.3	46%	0.463	50%	0.499	S	S	.	.			trans	-68.2	101.2	172.7	54.7	0	0	0	0	110	V1006 D1007 N1267 T1271	V1006-S1269 WeakPolarHBondContact CG1-OG 3.3Å; D1007-S1269 PolarHBondContact O-OG 3.02Å; D1007-S1269 VanDerWaalsContact O-OG 3.04Å; N1267-S1269 PolarHBondContact O-N 2.9Å; N1267-S1269 PolarHBondContact OD1-N 3.14Å; S1269-T1271 PolarHBondContact O-N 3.15Å
1270	S	30.3	Very low	46.7	Very low	97.6 Å²	97.6	100.9 Å²	100.9	68%	0.683	53%	0.531	S	S	*	.			trans	-73.7	114.2	178	56.3	0	0	0	0	110.7	R1268 K1272	R1268-S1270 VanDerWaalsContact C-N 3.33Å; R1268-S1270 PolarHBondContact O-N 3.04Å; R1268-S1270 VanDerWaalsContact O-N 3.14Å; S1270-K1272 PolarHBondContact O-N 2.93Å; S1270-K1272 VanDerWaalsContact O-N 3.1Å
1271	T	29.3	Very low	44	Very low	104.8 Å²	104.8	107 Å²	107	64%	0.643	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-57.1	126.2	169.8	44.2	0	0	0	0	111.4	V1006 S1269 F1273	V1006-T1271 HydrophobicContact CG2-CG2 4.29Å; S1269-T1271 PolarHBondContact O-N 3.15Å; T1271-F1273 PolarHBondContact O-N 3.08Å; T1271-F1273 VanDerWaalsContact O-N 3.16Å
1272	K	27.3	Very low	41.1	Very low	192.4 Å²	192.4	113.4 Å²	113.4	84%	0.837	60%	0.602	S	S	*	*			trans	-57.4	119.2	171.3	-64.5	172.7	-179	173.8	0	108.8	S1270 D1274	S1270-K1272 PolarHBondContact O-N 2.93Å; S1270-K1272 VanDerWaalsContact O-N 3.1Å; K1272-D1274 PolarHBondContact O-N 3.28Å
1273	F	27	Very low	38.5	Very low	184.4 Å²	184.4	116.6 Å²	116.6	81%	0.809	63%	0.63	S	S	*	*			trans	-90.3	127.1	164.5	-109.4	-86.5	0	0	0	108.8	T1271 N1275	T1271-F1273 PolarHBondContact O-N 3.08Å; T1271-F1273 VanDerWaalsContact O-N 3.16Å; F1273-N1275 PolarHBondContact O-N 3.32Å; F1273-N1275 VanDerWaalsContact O-N 3.11Å
1274	D	27.4	Very low	35.9	Very low	131.8 Å²	131.8	125 Å²	125	71%	0.705	67%	0.67	S	S	*	*			trans	-69.1	133.5	-179.7	-76.1	-50.4	0	0	0	111.3	K1272 T1276	K1272-D1274 PolarHBondContact O-N 3.28Å; D1274-T1276 PolarHBondContact O-N 3.18Å
1275	N	27.6	Very low	33.9	Very low	142 Å²	142	127.3 Å²	127.3	76%	0.759	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	42.3	-178.4	-78.8	-34.6	0	0	0	113.8	F1273 T1278	F1273-N1275 PolarHBondContact O-N 3.32Å; F1273-N1275 VanDerWaalsContact O-N 3.11Å; N1275-T1278 PolarHBondContact O-OG1 2.83Å
1276	T	28.4	Very low	31.6	Very low	116 Å²	116	130.5 Å²	130.5	71%	0.712	71%	0.711	S	S	*	*			trans	-103.8	4.1	-178.5	51.8	0	0	0	0	114.3	D1274	D1274-T1276 PolarHBondContact O-N 3.18Å
1277	L	29	Very low	29.8	Very low	151 Å²	151	131.9 Å²	131.9	79%	0.791	72%	0.724	S	S	*	*			trans	-118.7	41.4	173.1	-110.7	131.5	0	0	0	114.7	K1279 S1280	L1277-K1279 VanDerWaalsContact C-N 3.33Å; L1277-S1280 PolarHBondContact O-OG 2.83Å
1278	T	27	Very low	28.5	Very low	110.8 Å²	110.8	135.3 Å²	135.3	68%	0.68	74%	0.741	S	S	*	*			trans	-97.6	39.8	172.6	48.1	0	0	0	0	113	N1275 S1280 I1281	N1275-T1278 PolarHBondContact O-OG1 2.83Å; T1278-S1280 VanDerWaalsContact C-N 3.32Å; T1278-S1280 PolarHBondContact O-N 3.24Å; T1278-S1280 VanDerWaalsContact O-N 3.14Å; T1278-I1281 PolarHBondContact O-N 2.86Å
1279	K	26.7	Very low	27.8	Very low	193 Å²	193	136.4 Å²	136.4	84%	0.839	75%	0.751	S	S	*	*			trans	-110.7	32.8	171.3	-81.2	175.3	-179.2	176.5	0	115.1	L1277 I1281 T1282	L1277-K1279 VanDerWaalsContact C-N 3.33Å; K1279-I1281 VanDerWaalsContact C-N 3.33Å; K1279-T1282 PolarHBondContact O-OG1 2.87Å
1280	S	28.2	Very low	27.4	Very low	97 Å²	97	139.2 Å²	139.2	68%	0.678	76%	0.761	S	S	*	*			trans	-131.7	86.2	170.2	47	0	0	0	0	113.5	L1277 T1278	L1277-S1280 PolarHBondContact O-OG 2.83Å; T1278-S1280 VanDerWaalsContact C-N 3.32Å; T1278-S1280 PolarHBondContact O-N 3.24Å; T1278-S1280 VanDerWaalsContact O-N 3.14Å
1281	I	28.3	Very low	27.3	Very low	150.2 Å²	150.2	142.6 Å²	142.6	77%	0.77	76%	0.763	S	S	*	*				-133.9	111.2	129.4	-73.7	168.4	0	0	0	110.9	T1278 K1279 A1283	T1278-I1281 PolarHBondContact O-N 2.86Å; K1279-I1281 VanDerWaalsContact C-N 3.33Å; I1281-A1283 VanDerWaalsContact C-N 3.31Å; I1281-A1283 HydrophobicContact CG2-CB 3.6Å; I1281-A1283 PolarHBondContact O-N 2.94Å
1282	T	26.1	Very low	27.2	Very low	136.6 Å²	136.6	143.7 Å²	143.7	84%	0.838	76%	0.761	S	S	*	*			trans	-72.1	104.5	166.3	49.1	0	0	0	0	113.5	K1279	K1279-T1282 PolarHBondContact O-OG1 2.87Å
1283	A	28	Very low	27.3	Very low	88.4 Å²	88.4	138 Å²	138	73%	0.731	75%	0.745	S	S	*	*	S	Bend	trans	-156.4	122.2	157.8	0	0	0	0	0	112.3	I1281 P1285	I1281-A1283 VanDerWaalsContact C-N 3.31Å; I1281-A1283 HydrophobicContact CG2-CB 3.6Å; I1281-A1283 PolarHBondContact O-N 2.94Å; A1283-P1285 WeakPolarHBondContact O-CD 3.5Å
1284	Q	25.9	Very low	27.5	Very low	184.6 Å²	184.6	134.5 Å²	134.5	86%	0.863	73%	0.733	S	S	*	*			trans	17.8	139.6	169.3	-64.7	177.7	-27.3	0	0	116.6	T1286	Q1284-T1286 VanDerWaalsContact C-N 3.31Å; Q1284-T1286 PolarHBondContact O-N 3.48Å
1285	P	29.7	Very low	27.7	Very low	121.6 Å²	121.6	133 Å²	133	79%	0.79	73%	0.725	S	S	*	*			trans	-107.2	122.3	175.7	33.6	-23	0	0	0	112.7	A1283 T1287	A1283-P1285 WeakPolarHBondContact O-CD 3.5Å; P1285-T1287 PolarHBondContact O-N 3.03Å; P1285-T1287 VanDerWaalsContact O-N 3.11Å
1286	T	25.3	Very low	28	Very low	126.2 Å²	126.2	129.6 Å²	129.6	77%	0.774	71%	0.706	S	S	*	*			trans	-65.6	109.1	165.6	49.2	0	0	0	0	114.1	Q1284 L1288	Q1284-T1286 VanDerWaalsContact C-N 3.31Å; Q1284-T1286 PolarHBondContact O-N 3.48Å; T1286-L1288 PolarHBondContact O-N 3.26Å
1287	T	25.4	Very low	28	Very low	116 Å²	116	127.3 Å²	127.3	71%	0.712	70%	0.695	S	S	*	*			trans	23.9	97.7	147.8	55.2	0	0	0	0	114.5	P1285 F1289	P1285-T1287 PolarHBondContact O-N 3.03Å; P1285-T1287 VanDerWaalsContact O-N 3.11Å; T1287-F1289 WeakPolarHBondContact O-CD2 3.23Å; T1287-F1289 PolarHBondContact O-N 3.16Å; T1287-F1289 VanDerWaalsContact O-N 3.12Å
1288	L	25.1	Very low	28	Very low	162.6 Å²	162.6	124.5 Å²	124.5	85%	0.851	68%	0.684	S	S	*	*			trans	-116.8	97.6	160	-147.8	80.2	0	0	0	111.3	T1286 N1290	T1286-L1288 PolarHBondContact O-N 3.26Å; L1288-N1290 VanDerWaalsContact C-N 3.27Å; L1288-N1290 PolarHBondContact O-N 3.19Å
1289	F	26.1	Very low	28.2	Very low	192.2 Å²	192.2	122.6 Å²	122.6	84%	0.843	68%	0.676	S	S	*	*			trans	-96.3	124.5	176.3	-83.1	-84.5	0	0	0	111.1	T1287 K1291	T1287-F1289 WeakPolarHBondContact O-CD2 3.23Å; T1287-F1289 PolarHBondContact O-N 3.16Å; T1287-F1289 VanDerWaalsContact O-N 3.12Å; F1289-K1291 PolarHBondContact O-N 2.81Å
1290	N	26.7	Very low	28.5	Very low	125 Å²	125	118.5 Å²	118.5	67%	0.668	67%	0.671	S	S	*	*			trans	-84.5	114.4	-176.6	-95.2	-22.6	0	0	0	112.5	R1268 L1288 Q1292	R1268-N1290 PolarHBondContact NH1-O 2.77Å; L1288-N1290 VanDerWaalsContact C-N 3.27Å; L1288-N1290 PolarHBondContact O-N 3.19Å; N1290-Q1292 PolarHBondContact O-N 2.82Å
1291	K	28	Very low	28.7	Very low	168.4 Å²	168.4	121 Å²	121	73%	0.732	68%	0.677	S	S	*	*	S	Bend	trans	33.1	61.7	144.9	-66.8	-175.4	171.6	-174.8	0	117.4	F1289 I1294	F1289-K1291 PolarHBondContact O-N 2.81Å; K1291-I1294 HydrophobicContact CB-CD1 4.25Å; K1291-I1294 HydrophobicContact CD-CD1 4.37Å; K1291-I1294 HydrophobicContact CG-CD1 4Å
1292	Q	28	Very low	28.7	Very low	128.2 Å²	128.2	120.2 Å²	120.2	60%	0.599	67%	0.67	S	S	*	*			trans	-127.6	48.9	152.8	-91.5	-179.3	-19.6	0	0	112.9	R1268 N1290 I1294 P1312 Q1314	R1268-Q1292 VanDerWaalsContact N-OE1 3.16Å; N1290-Q1292 PolarHBondContact O-N 2.82Å; Q1292-I1294 PolarHBondContact O-N 2.85Å; Q1292-P1312 HydrophobicContact CB-CG 4.43Å; Q1292-Q1314 VanDerWaalsContact NE2-NE2 3.18Å
1293	S	29.3	Very low	28.9	Very low	71.2 Å²	71.2	119 Å²	119	50%	0.498	66%	0.664	S	S	.	*			trans	-111.9	113.9	176.9	51	0	0	0	0	111.3	L1295 L1309	S1293-L1295 PolarHBondContact O-N 2.88Å; S1293-L1295 VanDerWaalsContact O-N 3.13Å; S1293-L1309 WeakPolarHBondContact OG-CD2 3.22Å
1294	I	31.9	Very low	29.1	Very low	110.8 Å²	110.8	121 Å²	121	57%	0.568	66%	0.661	S	S	*	*			trans	-102.3	119.8	170	-59.2	173.3	0	0	0	108.5	K1291 Q1292 I1296 L1309 I1310	K1291-I1294 HydrophobicContact CB-CD1 4.25Å; K1291-I1294 HydrophobicContact CD-CD1 4.37Å; K1291-I1294 HydrophobicContact CG-CD1 4Å; Q1292-I1294 PolarHBondContact O-N 2.85Å; I1294-I1296 HydrophobicContact CG2-CD1 4.06Å; I1294-I1296 HydrophobicContact CG2-CG1 3.9Å; I1294-I1296 PolarHBondContact O-N 2.85Å; I1294-L1309 HydrophobicContact CG2-CD1 4.49Å; I1294-L1309 HydrophobicContact CG2-CD2 3.79Å; I1294-L1309 HydrophobicContact CG2-CG 4.3Å; I1294-L1309 WeakPolarHBondContact O-CA 3.37Å; I1294-I1310 PolarHBondContact O-N 2.79Å
1295	L	31.1	Very low	29.7	Very low	100.4 Å²	100.4	118 Å²	118	53%	0.526	65%	0.647	S	S	.	*			trans	-82.8	111.9	-177.7	-83.9	146.7	0	0	0	109.9	S1293 L1309	S1293-L1295 PolarHBondContact O-N 2.88Å; S1293-L1295 VanDerWaalsContact O-N 3.13Å; L1295-L1309 HydrophobicContact CB-CD1 4.24Å; L1295-L1309 HydrophobicContact CD1-CD1 3.78Å; L1295-L1309 HydrophobicContact CG-CD1 3.94Å
1296	I	33.2	Very low	30.4	Very low	70.6 Å²	70.6	115.7 Å²	115.7	36%	0.362	63%	0.628	S	S	.	*			trans	-88.7	110.1	145.8	-57.1	173.9	0	0	0	107.9	I1294 T1298 S1307 I1308 I1310 I1376	I1294-I1296 HydrophobicContact CG2-CD1 4.06Å; I1294-I1296 HydrophobicContact CG2-CG1 3.9Å; I1294-I1296 PolarHBondContact O-N 2.85Å; I1296-T1298 HydrophobicContact CG2-CG2 4.12Å; I1296-T1298 PolarHBondContact O-N 3.23Å; I1296-T1298 VanDerWaalsContact O-N 3.11Å; I1296-S1307 WeakPolarHBondContact O-CA 3.18Å; I1296-S1307 WeakPolarHBondContact O-CB 3.41Å; I1296-I1308 PolarHBondContact N-O 3.33Å; I1296-I1308 PolarHBondContact O-N 3.21Å; I1296-I1310 HydrophobicContact CD1-CD1 3.84Å; I1296-I1376 HydrophobicContact CD1-CD1 3.64Å; I1296-I1376 HydrophobicContact CG1-CD1 3.86Å; I1296-I1376 HydrophobicContact CG2-CD1 3.86Å
1297	S	28.5	Very low	31.7	Very low	69 Å²	69	110.8 Å²	110.8	48%	0.483	60%	0.599	S	S	.	*			trans	-81.6	103.7	172	57.9	0	0	0	0	111	L1373 H1375	S1297-L1373 WeakPolarHBondContact OG-CD2 3.4Å; S1297-H1375 VanDerWaalsContact CB-NE2 3.34Å; S1297-H1375 WeakPolarHBondContact CB-NE2 3.4Å; S1297-H1375 PolarHBondContact OG-CE1 3.05Å; S1297-H1375 PolarHBondContact OG-NE2 3.07Å
1298	T	29.2	Very low	33.5	Very low	91.4 Å²	91.4	106.1 Å²	106.1	56%	0.561	57%	0.569	S	S	*	*			trans	-101.2	95.1	167	46.6	0	0	0	0	110.2	N1227 I1296 S1300	N1227-T1298 WeakPolarHBondContact OD1-CB 3.27Å; N1227-T1298 WeakPolarHBondContact OD1-CG2 3.44Å; N1227-T1298 PolarHBondContact OD1-OG1 2.76Å; I1296-T1298 HydrophobicContact CG2-CG2 4.12Å; I1296-T1298 PolarHBondContact O-N 3.23Å; I1296-T1298 VanDerWaalsContact O-N 3.11Å; T1298-S1300 PolarHBondContact O-N 2.88Å
1299	S	30.9	Very low	35.4	Very low	72.2 Å²	72.2	101.2 Å²	101.2	51%	0.505	54%	0.544	S	S	.	.			trans	-75.5	127	164.4	53	0	0	0	0	111.6	N1301 N1470	S1299-N1301 VanDerWaalsContact C-N 3.29Å; S1299-N1301 PolarHBondContact O-N 3Å; S1299-N1301 VanDerWaalsContact O-N 3.1Å; S1299-N1470 WeakPolarHBondContact CB-OD1 3.45Å; S1299-N1470 PolarHBondContact OG-ND2 2.83Å; S1299-N1470 VanDerWaalsContact OG-ND2 3.15Å; S1299-N1470 PolarHBondContact OG-OD1 3.32Å
1300	S	33.9	Very low	37.5	Very low	105.4 Å²	105.4	93.1 Å²	93.1	74%	0.737	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	30.8	-174.8	53.6	0	0	0	0	113.7	T1298	T1298-S1300 PolarHBondContact O-N 2.88Å
1301	N	31.1	Very low	39.5	Very low	150.6 Å²	150.6	90.4 Å²	90.4	81%	0.805	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149	19	177	-83	-14.3	0	0	0	115.9	S1299	S1299-N1301 VanDerWaalsContact C-N 3.29Å; S1299-N1301 PolarHBondContact O-N 3Å; S1299-N1301 VanDerWaalsContact O-N 3.1Å
1302	Q	28.9	Very low	41.6	Very low	133.8 Å²	133.8	85 Å²	85	63%	0.625	48%	0.477	S	S	*	.	S	Bend	trans	-125.3	141.6	166.9	-71.5	-166.3	-7.5	0	0	111.4	I1304 N1470	Q1302-I1304 PolarHBondContact O-N 3.02Å; Q1302-N1470 PolarHBondContact OE1-ND2 2.9Å
1303	P	29.8	Very low	43.3	Very low	111 Å²	111	80.4 Å²	80.4	72%	0.721	46%	0.459	S	S	*	.			trans	-72.4	110	-172.1	29.2	-34.6	0	0	0	111.9	H1305	P1303-H1305 VanDerWaalsContact C-N 3.27Å; P1303-H1305 PolarHBondContact O-CD2 2.8Å; P1303-H1305 VanDerWaalsContact O-CG 3.29Å; P1303-H1305 PolarHBondContact O-N 3.07Å
1304	I	33.8	Very low	44.7	Very low	130 Å²	130	83.4 Å²	83.4	67%	0.667	47%	0.465	S	S	*	.			trans	-42	73.1	173.2	-53.3	153.7	0	0	0	112.6	Q1302 N1306 Y1415	Q1302-I1304 PolarHBondContact O-N 3.02Å; I1304-N1306 VanDerWaalsContact C-N 3.31Å; I1304-N1306 PolarHBondContact O-N 3.19Å; I1304-N1306 VanDerWaalsContact O-N 3.11Å; I1304-Y1415 HydrophobicContact CG2-CE2 4.44Å
1305	H	38.5	Very low	45.8	Very low	120.8 Å²	120.8	81.8 Å²	81.8	56%	0.559	46%	0.46	S	S	*	.			trans	-79.3	114.6	175.5	-83.3	-87.1	0	0	0	111	P1303 S1307 D1371	P1303-H1305 VanDerWaalsContact C-N 3.27Å; P1303-H1305 PolarHBondContact O-CD2 2.8Å; P1303-H1305 VanDerWaalsContact O-CG 3.29Å; P1303-H1305 PolarHBondContact O-N 3.07Å; H1305-S1307 PolarHBondContact O-N 3.32Å; H1305-D1371 IonicContact CE1-OD1 3.75Å
1306	N	43.8	Very low	46.8	Very low	73 Å²	73	84.8 Å²	84.8	39%	0.39	47%	0.471	S	S	.	.			trans	-30	95.1	174.9	-62.8	-21.2	0	0	0	113.8	I1304 I1308 Y1365	I1304-N1306 VanDerWaalsContact C-N 3.31Å; I1304-N1306 PolarHBondContact O-N 3.19Å; I1304-N1306 VanDerWaalsContact O-N 3.11Å; N1306-I1308 PolarHBondContact O-N 2.92Å; N1306-I1308 VanDerWaalsContact O-N 3.1Å; N1306-Y1365 WeakPolarHBondContact ND2-CB 3.33Å; N1306-Y1365 WeakPolarHBondContact ND2-CD2 3.44Å; N1306-Y1365 WeakPolarHBondContact ND2-CE2 3.5Å
1307	S	53.2	Low	48	Very low	24.8 Å²	24.8	86.3 Å²	86.3	17%	0.173	48%	0.476	C	S	.	.			trans	-66.7	113.5	171.9	21.2	0	0	0	0	111.3	I1296 H1305 L1309 Q1413	I1296-S1307 WeakPolarHBondContact O-CA 3.18Å; I1296-S1307 WeakPolarHBondContact O-CB 3.41Å; H1305-S1307 PolarHBondContact O-N 3.32Å; S1307-L1309 PolarHBondContact O-N 2.99Å; S1307-Q1413 WeakPolarHBondContact O-CB 3.39Å; S1307-Q1413 PolarHBondContact O-N 2.81Å; S1307-Q1413 WeakPolarHBondContact OG-CB 3.34Å; S1307-Q1413 PolarHBondContact OG-OE1 3.2Å; S1307-Q1413 VanDerWaalsContact OG-OE1 3.13Å
1308	I	62.9	Low	50	Low	16.2 Å²	16.2	86.3 Å²	86.3	8%	0.083	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124.4	171.5	-55.9	179.6	0	0	0	108.3	I1296 N1306 I1310 I1359 H1375 I1410 Y1412	I1296-I1308 PolarHBondContact N-O 3.33Å; I1296-I1308 PolarHBondContact O-N 3.21Å; N1306-I1308 PolarHBondContact O-N 2.92Å; N1306-I1308 VanDerWaalsContact O-N 3.1Å; I1308-I1310 HydrophobicContact CG2-CG1 4.14Å; I1308-I1359 HydrophobicContact CD1-CG2 4.17Å; I1308-I1359 HydrophobicContact CG2-CD1 4.45Å; I1308-H1375 HydrophobicContact CD1-CB 3.78Å; I1308-H1375 VanDerWaalsContact CD1-CD2 3.43Å; I1308-H1375 WeakPolarHBondContact CD1-CD2 2.84Å; I1308-I1410 HydrophobicContact CG2-CG2 3.87Å; I1308-Y1412 HydrophobicContact CD1-CD1 4.2Å; I1308-Y1412 HydrophobicContact CD1-CE1 3.8Å; I1308-Y1412 HydrophobicContact CG1-CD1 3.84Å; I1308-Y1412 HydrophobicContact CG1-CE1 3.94Å
1309	L	63.6	Low	52.4	Low	59.6 Å²	59.6	82.3 Å²	82.3	31%	0.312	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.2	175.4	-150.6	132.5	0	0	0	109	S1293 I1294 L1295 S1307 L1311 I1410 A1411	S1293-L1309 WeakPolarHBondContact OG-CD2 3.22Å; I1294-L1309 HydrophobicContact CG2-CD1 4.49Å; I1294-L1309 HydrophobicContact CG2-CD2 3.79Å; I1294-L1309 HydrophobicContact CG2-CG 4.3Å; I1294-L1309 WeakPolarHBondContact O-CA 3.37Å; L1295-L1309 HydrophobicContact CB-CD1 4.24Å; L1295-L1309 HydrophobicContact CD1-CD1 3.78Å; L1295-L1309 HydrophobicContact CG-CD1 3.94Å; S1307-L1309 PolarHBondContact O-N 2.99Å; L1309-L1311 HydrophobicContact CD2-CD1 3.75Å; L1309-L1311 HydrophobicContact CD2-CD2 4.27Å; L1309-L1311 HydrophobicContact CD2-CG 3.88Å; L1309-L1311 VanDerWaalsContact CD2-CG 3.5Å; L1309-L1311 HydrophobicContact CG-CG 4.41Å; L1309-I1410 WeakPolarHBondContact O-CA 3.41Å; L1309-A1411 HydrophobicContact CB-CB 4.27Å; L1309-A1411 HydrophobicContact CD2-CB 4.33Å; L1309-A1411 PolarHBondContact N-O 3.17Å; L1309-A1411 PolarHBondContact O-N 2.97Å
1310	I	70.3	Confident	55	Low	21.8 Å²	21.8	81.3 Å²	81.3	11%	0.112	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	120.1	178.9	-53.7	165.3	0	0	0	107.6	I1294 I1296 I1308 L1357 I1359 H1377 W1408 L1409	I1294-I1310 PolarHBondContact O-N 2.79Å; I1296-I1310 HydrophobicContact CD1-CD1 3.84Å; I1308-I1310 HydrophobicContact CG2-CG1 4.14Å; I1310-L1357 HydrophobicContact CG2-CD2 4.46Å; I1310-I1359 HydrophobicContact CD1-CD1 3.39Å; I1310-I1359 VanDerWaalsContact CD1-CD1 3.42Å; I1310-I1359 HydrophobicContact CG1-CD1 3.81Å; I1310-H1377 HydrophobicContact CD1-CB 3.81Å; I1310-H1377 VanDerWaalsContact CD1-CG 3.42Å; I1310-W1408 HydrophobicContact CG2-CB 4.26Å; I1310-W1408 HydrophobicContact CG2-CG 4.27Å; I1310-L1409 WeakPolarHBondContact CA-O 3.29Å
1311	L	68.5	Low	57.5	Low	68.6 Å²	68.6	76.4 Å²	76.4	36%	0.359	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	122.8	179.4	-69.1	168.9	0	0	0	109.6	L1309 W1408 L1409	L1309-L1311 HydrophobicContact CD2-CD1 3.75Å; L1309-L1311 HydrophobicContact CD2-CD2 4.27Å; L1309-L1311 HydrophobicContact CD2-CG 3.88Å; L1309-L1311 VanDerWaalsContact CD2-CG 3.5Å; L1309-L1311 HydrophobicContact CG-CG 4.41Å; L1311-W1408 CarbonylContact O-C 3.42Å; L1311-W1408 VanDerWaalsContact O-CA 3.32Å; L1311-W1408 WeakPolarHBondContact O-CA 3.41Å; L1311-L1409 HydrophobicContact CB-CB 4.33Å; L1311-L1409 HydrophobicContact CB-CD2 4.49Å; L1311-L1409 HydrophobicContact CD1-CD2 4.12Å; L1311-L1409 PolarHBondContact N-O 2.94Å; L1311-L1409 PolarHBondContact O-N 3.01Å
1312	P	72.1	Confident	60.2	Low	55.8 Å²	55.8	71.5 Å²	71.5	36%	0.362	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	139.1	169.7	29.6	-33.7	0	0	0	109.8	Q1292 Q1314 P1405	Q1292-P1312 HydrophobicContact CB-CG 4.43Å; P1312-Q1314 VanDerWaalsContact C-N 3.3Å; P1312-Q1314 PolarHBondContact O-N 3.32Å; P1312-P1405 HydrophobicContact CB-CB 3.96Å; P1312-P1405 HydrophobicContact CB-CG 3.89Å
1313	S	65.7	Low	63	Low	32.4 Å²	32.4	65.2 Å²	65.2	23%	0.227	34%	0.341	C	S	.	.			trans	-66.1	118.9	177.9	57.6	0	0	0	0	112.3	T1315 T1406 S1407 E1431	S1313-T1315 VanDerWaalsContact C-N 3.27Å; S1313-T1315 PolarHBondContact O-N 2.99Å; S1313-T1315 PolarHBondContact OG-OG1 3.09Å; S1313-T1406 PolarHBondContact OG-OG1 3.02Å; S1313-T1406 VanDerWaalsContact OG-OG1 3.06Å; S1313-S1407 WeakPolarHBondContact CB-O 3.27Å; S1313-S1407 WeakPolarHBondContact CB-OG 3.4Å; S1313-S1407 PolarHBondContact N-O 2.94Å; S1313-S1407 PolarHBondContact OG-N 2.96Å; S1313-S1407 VanDerWaalsContact OG-N 3.13Å; S1313-S1407 PolarHBondContact OG-O 3.11Å; S1313-S1407 VanDerWaalsContact OG-O 3.09Å; S1313-S1407 PolarHBondContact OG-OG 3.19Å; S1313-E1431 WeakPolarHBondContact CB-OE1 3.41Å
1314	Q	58.4	Low	65.7	Low	134 Å²	134	61.1 Å²	61.1	63%	0.626	31%	0.314	S	S	*	.			trans	-100.7	76.5	179.6	-65	-177.8	-9.5	0	0	111.6	Q1292 P1312 Q1316 T1406	Q1292-Q1314 VanDerWaalsContact NE2-NE2 3.18Å; P1312-Q1314 VanDerWaalsContact C-N 3.3Å; P1312-Q1314 PolarHBondContact O-N 3.32Å; Q1314-Q1316 VanDerWaalsContact C-N 3.26Å; Q1314-Q1316 PolarHBondContact O-N 2.85Å; Q1314-T1406 VanDerWaalsContact OE1-CG2 3.31Å; Q1314-T1406 PolarHBondContact OE1-OG1 3.06Å
1315	T	53.6	Low	68.1	Low	75.4 Å²	75.4	55.2 Å²	55.2	46%	0.463	28%	0.284	S	S	.	.			trans	-73.8	117.6	176.9	53.2	0	0	0	0	111.6	S1313 F1317 T1406 P1555	S1313-T1315 VanDerWaalsContact C-N 3.27Å; S1313-T1315 PolarHBondContact O-N 2.99Å; S1313-T1315 PolarHBondContact OG-OG1 3.09Å; T1315-F1317 PolarHBondContact O-N 2.94Å; T1315-F1317 PolarHBondContact OG1-O 2.81Å; T1315-F1317 VanDerWaalsContact OG1-O 3.13Å; T1315-T1406 HydrophobicContact CG2-CG2 4.29Å; T1315-T1406 VanDerWaalsContact CG2-OG1 3.24Å; T1315-T1406 WeakPolarHBondContact CG2-OG1 3.29Å; T1315-T1406 WeakPolarHBondContact OG1-CG2 3.41Å; T1315-T1406 PolarHBondContact OG1-OG1 3.05Å; T1315-P1555 HydrophobicContact CG2-CG 4.24Å
1316	Q	53.3	Low	70.3	Confident	163.4 Å²	163.4	51.6 Å²	51.6	76%	0.764	27%	0.269	S	S	*	.	S	Bend	trans	-82.5	20.4	178.4	-69.2	-179.6	-26	0	0	111.7	Q1314 N1318	Q1314-Q1316 VanDerWaalsContact C-N 3.26Å; Q1314-Q1316 PolarHBondContact O-N 2.85Å; Q1316-N1318 WeakPolarHBondContact CB-OD1 3.43Å; Q1316-N1318 PolarHBondContact O-N 2.91Å
1317	F	57.7	Low	72	Confident	103.6 Å²	103.6	48.2 Å²	48.2	45%	0.454	25%	0.251	S	S	.	.			trans	-97.3	100.3	-177	-58.5	-83.6	0	0	0	110.2	T1315 H1319 Q1403 L1404 T1406 L1550	T1315-F1317 PolarHBondContact O-N 2.94Å; T1315-F1317 PolarHBondContact OG1-O 2.81Å; T1315-F1317 VanDerWaalsContact OG1-O 3.13Å; F1317-H1319 VanDerWaalsContact C-N 3.3Å; F1317-H1319 PolarHBondContact O-CE1 2.77Å; F1317-H1319 VanDerWaalsContact O-CE1 3.3Å; F1317-H1319 PolarHBondContact O-N 3.03Å; F1317-H1319 PolarHBondContact O-ND1 3.15Å; F1317-Q1403 HydrophobicContact CB-CB 3.87Å; F1317-Q1403 HydrophobicContact CG-CB 4.47Å; F1317-L1404 CarbonylContact C-O 3.55Å; F1317-L1404 WeakPolarHBondContact CA-O 3.29Å; F1317-T1406 HydrophobicContact CB-CG2 4.32Å; F1317-T1406 VanDerWaalsContact O-CG2 3.29Å; F1317-T1406 WeakPolarHBondContact O-CG2 3.33Å; F1317-L1550 HydrophobicContact CD1-CD1 4.13Å
1318	N	71.3	Confident	73.3	Confident	69.4 Å²	69.4	47.5 Å²	47.5	37%	0.371	25%	0.245	S	C	.	.			trans	-93.1	96.9	176	-67.8	-21	0	0	0	111.4	Q1316 Q1403 L1404 T1406	Q1316-N1318 WeakPolarHBondContact CB-OD1 3.43Å; Q1316-N1318 PolarHBondContact O-N 2.91Å; N1318-Q1403 HydrophobicContact CB-CG 3.43Å; N1318-Q1403 VanDerWaalsContact CB-CG 3.43Å; N1318-Q1403 PolarHBondContact ND2-NE2 3.4Å; N1318-Q1403 VanDerWaalsContact ND2-NE2 3.13Å; N1318-L1404 CarbonylContact C-O 3.51Å; N1318-L1404 WeakPolarHBondContact CA-O 3.36Å; N1318-L1404 WeakPolarHBondContact CB-O 3.34Å; N1318-L1404 PolarHBondContact N-O 3.12Å; N1318-T1406 HydrophobicContact CB-CG2 4.5Å
1319	H	80	Confident	74.1	Confident	7.4 Å²	7.4	47.3 Å²	47.3	3%	0.034	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	124.5	-176.6	-55.9	93.8	0	0	0	110.4	F1317 Q1403 L1404 P1405 T1406 L1434 L1545 I1551	F1317-H1319 VanDerWaalsContact C-N 3.3Å; F1317-H1319 PolarHBondContact O-CE1 2.77Å; F1317-H1319 VanDerWaalsContact O-CE1 3.3Å; F1317-H1319 PolarHBondContact O-N 3.03Å; F1317-H1319 PolarHBondContact O-ND1 3.15Å; H1319-Q1403 CarbonylContact O-C 3.08Å; H1319-Q1403 WeakPolarHBondContact O-CA 3.4Å; H1319-L1404 HydrophobicContact CB-CB 4.49Å; H1319-L1404 PolarHBondContact N-O 3.31Å; H1319-L1404 PolarHBondContact O-N 3.03Å; H1319-P1405 PolarHBondContact ND1-O 3.34Å; H1319-T1406 VanDerWaalsContact CE1-CG2 3.47Å; H1319-T1406 WeakPolarHBondContact CE1-CG2 3.45Å; H1319-L1434 HydrophobicContact CB-CD2 3.72Å; H1319-L1434 WeakPolarHBondContact ND1-CD2 3.41Å; H1319-L1545 HydrophobicContact CB-CD1 4.28Å; H1319-I1551 HydrophobicContact CB-CD1 4.15Å; H1319-I1551 HydrophobicContact CB-CG1 4.31Å; H1319-I1551 VanDerWaalsContact CD2-CG1 3.42Å; H1319-I1551 WeakPolarHBondContact CD2-CG1 3.33Å; H1319-I1551 VanDerWaalsContact NE2-CA 3.33Å; H1319-I1551 WeakPolarHBondContact NE2-CA 3.45Å; H1319-I1551 PolarHBondContact NE2-N 3.17Å
1320	H	84.4	Confident	74.4	Confident	50.6 Å²	50.6	44.8 Å²	44.8	23%	0.234	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	115.9	177.1	-178.6	-102.6	0	0	0	111.3	D1401 I1402 Q1403 T1546	H1320-D1401 IonicContact CE1-OD1 3.44Å; H1320-D1401 WeakPolarHBondContact NE2-CB 3.12Å; H1320-D1401 IonicContact NE2-OD1 3.07Å; H1320-I1402 CarbonylContact C-O 3.56Å; H1320-I1402 VanDerWaalsContact CA-O 3.28Å; H1320-I1402 WeakPolarHBondContact CA-O 3.32Å; H1320-I1402 PolarHBondContact CD2-O 3.05Å; H1320-Q1403 HydrophobicContact CB-CG 4.43Å; H1320-T1546 HydrophobicContact CB-CG2 3.95Å; H1320-T1546 WeakPolarHBondContact CB-OG1 3.38Å; H1320-T1546 PolarHBondContact N-OG1 2.71Å; H1320-T1546 WeakPolarHBondContact ND1-CG2 3.41Å; H1320-T1546 PolarHBondContact O-N 2.97Å; H1320-T1546 VanDerWaalsContact O-N 3.08Å; H1320-T1546 PolarHBondContact O-OG1 2.92Å
1321	I	86.6	Confident	74.3	Confident	2.2 Å²	2.2	44.6 Å²	44.6	1%	0.011	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.5	174.8	-59.5	-176.4	0	0	0	108.7	I1323 I1402 L1404 I1438 L1494 R1544 L1545	I1321-I1323 HydrophobicContact CG2-CD1 4.29Å; I1321-I1323 HydrophobicContact CG2-CG1 4.07Å; I1321-I1402 PolarHBondContact N-O 2.95Å; I1321-I1402 PolarHBondContact O-N 2.93Å; I1321-L1404 HydrophobicContact CD1-CD1 3.7Å; I1321-L1404 HydrophobicContact CG1-CD1 4.33Å; I1321-I1438 HydrophobicContact CD1-CD1 4.38Å; I1321-L1494 HydrophobicContact CG2-CD1 4.13Å; I1321-R1544 WeakPolarHBondContact CA-O 3.19Å; I1321-L1545 HydrophobicContact CG1-CD1 3.94Å
1322	Q	87.7	Confident	73.9	Confident	46.8 Å²	46.8	45.9 Å²	45.9	22%	0.219	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.6	176.3	170.6	173.3	2.5	0	0	109.4	C1324 K1399 D1401 M1543 R1544	Q1322-C1324 PolarHBondContact NE2-SG 3.03Å; Q1322-C1324 VanDerWaalsContact NE2-SG 3.39Å; Q1322-K1399 VanDerWaalsContact CD-CE 3.42Å; Q1322-K1399 HydrophobicContact CG-CD 4.36Å; Q1322-K1399 HydrophobicContact CG-CG 4.39Å; Q1322-K1399 VanDerWaalsContact NE2-CD 3.31Å; Q1322-K1399 VanDerWaalsContact NE2-CE 3.26Å; Q1322-K1399 VanDerWaalsContact OE1-CE 3.28Å; Q1322-D1401 WeakPolarHBondContact CB-OD1 3.27Å; Q1322-D1401 VanDerWaalsContact CG-OD1 3.23Å; Q1322-D1401 WeakPolarHBondContact CG-OD1 3.38Å; Q1322-M1543 CarbonylContact O-C 3.53Å; Q1322-M1543 VanDerWaalsContact O-CA 3.32Å; Q1322-M1543 WeakPolarHBondContact O-CA 3.37Å; Q1322-R1544 HydrophobicContact CB-CB 4.49Å; Q1322-R1544 PolarHBondContact N-O 2.97Å; Q1322-R1544 PolarHBondContact O-N 2.88Å
1323	I	88.1	Confident	73	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	128.3	176	-58.6	167.4	0	0	0	108.6	I1321 L1353 K1399 L1400 Y1460 L1491 L1541 M1543	I1321-I1323 HydrophobicContact CG2-CD1 4.29Å; I1321-I1323 HydrophobicContact CG2-CG1 4.07Å; I1323-L1353 HydrophobicContact CB-CD2 4.26Å; I1323-L1353 HydrophobicContact CG2-CD1 4.26Å; I1323-L1353 HydrophobicContact CG2-CD2 3.56Å; I1323-K1399 CarbonylContact O-C 3.52Å; I1323-K1399 WeakPolarHBondContact O-CA 3.21Å; I1323-L1400 HydrophobicContact CB-CB 4.33Å; I1323-L1400 HydrophobicContact CD1-CD2 4.46Å; I1323-L1400 PolarHBondContact N-O 2.92Å; I1323-L1400 PolarHBondContact O-N 2.98Å; I1323-Y1460 HydrophobicContact CD1-CD1 3.53Å; I1323-Y1460 HydrophobicContact CD1-CD2 4.09Å; I1323-Y1460 HydrophobicContact CD1-CE1 3.22Å; I1323-Y1460 HydrophobicContact CD1-CE2 3.79Å; I1323-Y1460 HydrophobicContact CD1-CG 3.96Å; I1323-Y1460 HydrophobicContact CG2-CD2 4.42Å; I1323-Y1460 HydrophobicContact CG2-CE2 4.16Å; I1323-L1491 HydrophobicContact CD1-CD2 4.28Å; I1323-L1541 HydrophobicContact CG2-CD2 4.46Å; I1323-M1543 HydrophobicContact CB-CG 4.49Å; I1323-M1543 HydrophobicContact CD1-CE 3.97Å; I1323-M1543 HydrophobicContact CG1-CB 4.35Å; I1323-M1543 HydrophobicContact CG1-CE 4.09Å; I1323-M1543 HydrophobicContact CG1-CG 4.08Å; I1323-M1543 HydrophobicContact CG1-SD 4.49Å; I1323-M1543 HydrophobicContact CG2-CE 3.87Å; I1323-M1543 HydrophobicContact CG2-CG 4.2Å
1324	C	86.9	Confident	72.3	Confident	24.8 Å²	24.8	48.1 Å²	48.1	17%	0.168	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	130.8	178.8	-57.3	0	0	0	0	110	Q1322 N1326 L1541 S1542	Q1322-C1324 PolarHBondContact NE2-SG 3.03Å; Q1322-C1324 VanDerWaalsContact NE2-SG 3.39Å; C1324-N1326 VanDerWaalsContact CB-OD1 3.24Å; C1324-N1326 WeakPolarHBondContact CB-OD1 3.28Å; C1324-N1326 PolarHBondContact O-N 2.87Å; C1324-N1326 PolarHBondContact O-OD1 2.81Å; C1324-L1541 VanDerWaalsContact O-CA 3.31Å; C1324-L1541 WeakPolarHBondContact O-CA 3.32Å; C1324-S1542 PolarHBondContact N-O 3.07Å; C1324-S1542 PolarHBondContact O-N 3.03Å
1325	L	84.5	Confident	71.9	Confident	6 Å²	6	43.1 Å²	43.1	3%	0.031	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	106.2	170.1	175.5	70.9	0	0	0	109.1	I1328 A1351 L1353 L1396 C1398 I1539 L1541	L1325-I1328 HydrophobicContact CD1-CG1 4.25Å; L1325-I1328 HydrophobicContact CD2-CD1 4.39Å; L1325-A1351 HydrophobicContact CD2-CB 3.57Å; L1325-A1351 VanDerWaalsContact CD2-CB 3.43Å; L1325-L1353 HydrophobicContact CB-CD1 4.09Å; L1325-L1353 HydrophobicContact CB-CD2 4.12Å; L1325-L1353 HydrophobicContact CD1-CD1 4.42Å; L1325-L1353 HydrophobicContact CD1-CD2 4.46Å; L1325-L1353 HydrophobicContact CD2-CD1 4.35Å; L1325-L1353 HydrophobicContact CD2-CD2 4.18Å; L1325-L1353 HydrophobicContact CG-CD2 4.49Å; L1325-L1396 HydrophobicContact CD1-CD1 4.27Å; L1325-L1396 HydrophobicContact CD2-CB 4.21Å; L1325-L1396 HydrophobicContact CD2-CD1 3.76Å; L1325-L1396 HydrophobicContact CD2-CG 4.38Å; L1325-L1396 HydrophobicContact CG-CB 4.38Å; L1325-L1396 HydrophobicContact CG-CD1 3.73Å; L1325-C1398 HydrophobicContact CB-CB 4.06Å; L1325-C1398 WeakPolarHBondContact CB-O 3.49Å; L1325-C1398 HydrophobicContact CD2-CB 4.01Å; L1325-C1398 HydrophobicContact CG-CB 4.42Å; L1325-C1398 PolarHBondContact N-O 2.95Å; L1325-C1398 VanDerWaalsContact N-O 3.1Å; L1325-I1539 HydrophobicContact CD1-CB 3.98Å; L1325-I1539 HydrophobicContact CD1-CG2 4.38Å; L1325-L1541 HydrophobicContact CB-CD2 3.96Å; L1325-L1541 HydrophobicContact CD1-CD2 3.62Å; L1325-L1541 HydrophobicContact CG-CD2 4.41Å
1326	N	83.4	Confident	71.4	Confident	46.8 Å²	46.8	44.8 Å²	44.8	25%	0.25	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-12	-169.5	-58.4	-24.4	0	0	0	113.1	C1324 M1394 S1504 Q1540 S1542	C1324-N1326 VanDerWaalsContact CB-OD1 3.24Å; C1324-N1326 WeakPolarHBondContact CB-OD1 3.28Å; C1324-N1326 PolarHBondContact O-N 2.87Å; C1324-N1326 PolarHBondContact O-OD1 2.81Å; N1326-M1394 CarbonylContact C-O 3.55Å; N1326-M1394 CarbonylContact O-C 3.44Å; N1326-M1394 VanDerWaalsContact O-C 3.31Å; N1326-M1394 VanDerWaalsContact O-CA 3.3Å; N1326-M1394 WeakPolarHBondContact O-CA 3.38Å; N1326-M1394 WeakPolarHBondContact O-CE 3.42Å; N1326-S1504 PolarHBondContact ND2-OG 2.93Å; N1326-Q1540 HydrophobicContact CB-CB 4.37Å; N1326-Q1540 PolarHBondContact N-O 3.12Å; N1326-S1542 VanDerWaalsContact ND2-CB 3.3Å; N1326-S1542 WeakPolarHBondContact ND2-CB 3.36Å; N1326-S1542 PolarHBondContact ND2-N 2.99Å; N1326-S1542 VanDerWaalsContact ND2-N 3.17Å; N1326-S1542 PolarHBondContact ND2-OG 3.03Å
1327	G	80.1	Confident	71.1	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175	168.4	175	0	0	0	0	0	114.9	T1393 I1539 Q1540	G1327-T1393 CarbonylContact C-O 3.55Å; G1327-T1393 WeakPolarHBondContact CA-O 3.28Å; G1327-I1539 CarbonylContact O-C 3.54Å; G1327-I1539 WeakPolarHBondContact O-CA 3.3Å; G1327-Q1540 PolarHBondContact N-O 3.15Å; G1327-Q1540 PolarHBondContact O-N 2.8Å
1328	I	80.3	Confident	70.2	Confident	10.6 Å²	10.6	42.9 Å²	42.9	5%	0.054	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	143.1	175.9	-71.4	169.3	0	0	0	108.4	L1325 M1331 A1351 I1387 Y1392 T1393 M1394 L1396 A1538 I1539	L1325-I1328 HydrophobicContact CD1-CG1 4.25Å; L1325-I1328 HydrophobicContact CD2-CD1 4.39Å; I1328-M1331 HydrophobicContact CD1-SD 4.29Å; I1328-M1331 HydrophobicContact CG2-CB 4.49Å; I1328-M1331 HydrophobicContact CG2-CG 3.84Å; I1328-M1331 HydrophobicContact CG2-SD 3.63Å; I1328-M1331 VanDerWaalsContact CG2-SD 3.54Å; I1328-M1331 WeakPolarHBondContact CG2-SD 3.48Å; I1328-A1351 HydrophobicContact CD1-CB 3.92Å; I1328-A1351 VanDerWaalsContact CD1-CB 3.48Å; I1328-I1387 HydrophobicContact CD1-CD1 3.72Å; I1328-I1387 VanDerWaalsContact CD1-CD1 3.47Å; I1328-I1387 HydrophobicContact CD1-CG1 4.47Å; I1328-Y1392 CarbonylContact O-C 3.57Å; I1328-Y1392 VanDerWaalsContact O-CA 3.3Å; I1328-Y1392 WeakPolarHBondContact O-CA 3.23Å; I1328-Y1392 WeakPolarHBondContact O-CB 3.43Å; I1328-Y1392 WeakPolarHBondContact O-CD2 3.4Å; I1328-T1393 PolarHBondContact N-O 3.07Å; I1328-T1393 PolarHBondContact O-N 3.08Å; I1328-T1393 VanDerWaalsContact O-N 3.15Å; I1328-M1394 WeakPolarHBondContact O-CE 3.07Å; I1328-L1396 HydrophobicContact CB-CD1 4.29Å; I1328-L1396 HydrophobicContact CD1-CD1 3.7Å; I1328-L1396 VanDerWaalsContact CD1-CD1 3.48Å; I1328-L1396 HydrophobicContact CD1-CD2 3.98Å; I1328-L1396 HydrophobicContact CD1-CG 4.42Å; I1328-L1396 HydrophobicContact CG1-CD1 3.67Å; I1328-A1538 WeakPolarHBondContact CA-O 3.21Å; I1328-I1539 HydrophobicContact CD1-CG2 4.29Å; I1328-I1539 HydrophobicContact CG1-CB 4.42Å; I1328-I1539 HydrophobicContact CG1-CG2 3.91Å
1329	S	78.7	Confident	68.5	Low	11.8 Å²	11.8	44.6 Å²	44.6	8%	0.083	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	153.1	177.2	-165.8	0	0	0	0	111.9	S758 M1331 H1391 G1537 A1538 R1840 N1842 T1843 F1846	S758-S1329 PolarHBondContact O-OG 3.1Å; S758-S1329 VanDerWaalsContact O-OG 3.09Å; S758-S1329 PolarHBondContact OG-OG 3.3Å; S1329-M1331 PolarHBondContact O-N 2.74Å; S1329-M1331 VanDerWaalsContact O-N 3.1Å; S1329-H1391 VanDerWaalsContact CA-O 3.25Å; S1329-H1391 WeakPolarHBondContact CA-O 3.32Å; S1329-H1391 PolarHBondContact OG-O 2.91Å; S1329-G1537 CarbonylContact O-C 3.55Å; S1329-G1537 VanDerWaalsContact O-CA 3.27Å; S1329-G1537 WeakPolarHBondContact O-CA 3.42Å; S1329-A1538 PolarHBondContact N-O 3.28Å; S1329-A1538 PolarHBondContact O-N 3.09Å; S1329-R1840 PolarHBondContact OG-O 3.33Å; S1329-N1842 PolarHBondContact OG-N 3.11Å; S1329-T1843 PolarHBondContact OG-N 2.88Å; S1329-T1843 VanDerWaalsContact OG-N 3.13Å; S1329-T1843 PolarHBondContact OG-O 3.15Å; S1329-T1843 VanDerWaalsContact OG-O 3.04Å; S1329-T1843 PolarHBondContact OG-OG1 2.98Å; S1329-T1843 VanDerWaalsContact OG-OG1 3.1Å; S1329-F1846 WeakPolarHBondContact O-CE2 3.22Å
1330	G	71.5	Confident	66.4	Low	8.4 Å²	8.4	51.3 Å²	51.3	9%	0.087	26%	0.261	C	S	.	.			trans	78.1	13.9	166.6	0	0	0	0	0	117	K1332 H1391 S1536 T1843 A1844	G1330-K1332 VanDerWaalsContact C-N 3.35Å; G1330-K1332 PolarHBondContact O-N 3.05Å; G1330-K1332 VanDerWaalsContact O-N 3.11Å; G1330-H1391 PolarHBondContact N-O 3.15Å; G1330-H1391 VanDerWaalsContact N-O 3.1Å; G1330-S1536 VanDerWaalsContact O-O 3.09Å; G1330-T1843 VanDerWaalsContact CA-O 3.29Å; G1330-T1843 WeakPolarHBondContact CA-O 3.47Å; G1330-T1843 PolarHBondContact N-O 3.09Å; G1330-A1844 CarbonylContact C-O 3.5Å; G1330-A1844 VanDerWaalsContact C-O 3.3Å; G1330-A1844 WeakPolarHBondContact CA-O 3.35Å
1331	M	68	Low	64.1	Low	16.6 Å²	16.6	54 Å²	54	8%	0.082	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	9	-174.4	-74.1	-168.3	73.8	0	0	114.7	I1328 S1329 F1333 S1334 I1335 F1349 T1390 I1484 L1509 S1536	I1328-M1331 HydrophobicContact CD1-SD 4.29Å; I1328-M1331 HydrophobicContact CG2-CB 4.49Å; I1328-M1331 HydrophobicContact CG2-CG 3.84Å; I1328-M1331 HydrophobicContact CG2-SD 3.63Å; I1328-M1331 VanDerWaalsContact CG2-SD 3.54Å; I1328-M1331 WeakPolarHBondContact CG2-SD 3.48Å; S1329-M1331 PolarHBondContact O-N 2.74Å; S1329-M1331 VanDerWaalsContact O-N 3.1Å; M1331-F1333 VanDerWaalsContact C-N 3.3Å; M1331-F1333 PolarHBondContact O-N 3.18Å; M1331-F1333 VanDerWaalsContact O-N 3.17Å; M1331-S1334 WeakPolarHBondContact O-CB 3.49Å; M1331-S1334 PolarHBondContact O-N 3.15Å; M1331-S1334 PolarHBondContact O-OG 3.25Å; M1331-I1335 HydrophobicContact CB-CD1 4.25Å; M1331-I1335 WeakPolarHBondContact O-CD1 3.17Å; M1331-I1335 WeakPolarHBondContact O-CG1 3.3Å; M1331-I1335 PolarHBondContact O-N 2.77Å; M1331-F1349 HydrophobicContact CE-CB 4.44Å; M1331-F1349 HydrophobicContact CE-CD1 4.03Å; M1331-F1349 HydrophobicContact CE-CG 4.35Å; M1331-T1390 HydrophobicContact CB-CG2 4.4Å; M1331-T1390 WeakPolarHBondContact CB-O 3.47Å; M1331-T1390 PolarHBondContact N-O 3.13Å; M1331-T1390 VanDerWaalsContact N-O 3.08Å; M1331-T1390 HydrophobicContact SD-CG2 4.42Å; M1331-I1484 HydrophobicContact CE-CB 4.28Å; M1331-I1484 HydrophobicContact CE-CG2 3.59Å; M1331-L1509 HydrophobicContact CG-CD1 4.36Å; M1331-L1509 HydrophobicContact SD-CD1 4.2Å; M1331-S1536 WeakPolarHBondContact CA-O 3.27Å
1332	K	60.2	Low	61.7	Low	96.2 Å²	96.2	61.6 Å²	61.6	42%	0.418	31%	0.313	S	S	.	.	H	α-helix	trans	-59.5	-43.3	-172	-170.1	175.8	-177.5	176	0	113.1	G1330 S1334 I1335 M1336 A1844	G1330-K1332 VanDerWaalsContact C-N 3.35Å; G1330-K1332 PolarHBondContact O-N 3.05Å; G1330-K1332 VanDerWaalsContact O-N 3.11Å; K1332-S1334 VanDerWaalsContact C-N 3.3Å; K1332-S1334 PolarHBondContact O-N 3.06Å; K1332-I1335 PolarHBondContact O-N 3.17Å; K1332-I1335 VanDerWaalsContact O-N 3.1Å; K1332-M1336 HydrophobicContact CD-SD 4.3Å; K1332-M1336 VanDerWaalsContact CE-SD 3.54Å; K1332-M1336 HydrophobicContact CG-CG 4.31Å; K1332-M1336 HydrophobicContact CG-SD 4.12Å; K1332-M1336 WeakPolarHBondContact O-CG 3.3Å; K1332-M1336 PolarHBondContact O-N 3.32Å; K1332-M1336 VanDerWaalsContact O-N 3.16Å; K1332-A1844 WeakPolarHBondContact CB-O 3.48Å; K1332-A1844 HydrophobicContact CD-CB 4.26Å; K1332-A1844 PolarHBondContact N-O 2.93Å
1333	F	53.5	Low	59.2	Low	111.4 Å²	111.4	63 Å²	63	49%	0.489	33%	0.328	S	S	.	.	H	α-helix	trans	-67.9	-16.4	179.7	-105.7	-72.6	0	0	0	113	M1331 I1335 M1336 H1391 K1534 N1845	M1331-F1333 VanDerWaalsContact C-N 3.3Å; M1331-F1333 PolarHBondContact O-N 3.18Å; M1331-F1333 VanDerWaalsContact O-N 3.17Å; F1333-I1335 VanDerWaalsContact C-N 3.31Å; F1333-I1335 PolarHBondContact O-N 3.08Å; F1333-I1335 VanDerWaalsContact O-N 3.15Å; F1333-M1336 HydrophobicContact CB-CB 4.39Å; F1333-M1336 HydrophobicContact CB-CG 4.05Å; F1333-M1336 HydrophobicContact CB-SD 4.27Å; F1333-M1336 HydrophobicContact CD1-CG 4.09Å; F1333-M1336 HydrophobicContact CD1-SD 4.1Å; F1333-M1336 HydrophobicContact CG-CG 4.36Å; F1333-M1336 HydrophobicContact CG-SD 4.19Å; F1333-M1336 PolarHBondContact O-N 2.95Å; F1333-H1391 AromaticContact CE2-CE1 3.42Å; F1333-H1391 VanDerWaalsContact CE2-CE1 3.42Å; F1333-H1391 WeakPolarHBondContact CE2-CE1 3.43Å; F1333-H1391 AromaticContact CE2-NE2 3.75Å; F1333-H1391 AromaticContact CZ-CE1 3.52Å; F1333-K1534 HydrophobicContact CE1-CD 4.49Å; F1333-N1845 WeakPolarHBondContact CD2-ND2 3.07Å; F1333-N1845 WeakPolarHBondContact CD2-OD1 3.18Å; F1333-N1845 WeakPolarHBondContact CE2-ND2 2.99Å
1334	S	51	Low	57.1	Low	23.4 Å²	23.4	66.9 Å²	66.9	16%	0.164	34%	0.343	C	S	.	.	H	α-helix	trans	-70.5	-24.1	176.6	-46.9	0	0	0	0	112.6	M1331 K1332 S1536	M1331-S1334 WeakPolarHBondContact O-CB 3.49Å; M1331-S1334 PolarHBondContact O-N 3.15Å; M1331-S1334 PolarHBondContact O-OG 3.25Å; K1332-S1334 VanDerWaalsContact C-N 3.3Å; K1332-S1334 PolarHBondContact O-N 3.06Å; S1334-S1536 WeakPolarHBondContact CB-OG 3.36Å; S1334-S1536 VanDerWaalsContact OG-CA 3.3Å; S1334-S1536 WeakPolarHBondContact OG-CA 3.29Å; S1334-S1536 WeakPolarHBondContact OG-CB 3.36Å; S1334-S1536 PolarHBondContact OG-O 3.31Å; S1334-S1536 PolarHBondContact OG-OG 3.19Å
1335	I	49.4	Very low	54.9	Low	28 Å²	28	71 Å²	71	14%	0.144	37%	0.368	C	S	.	.	H	α-helix	trans	-85.7	-34.5	-175.8	-61.4	164.4	0	0	0	111.1	M1331 K1332 F1333 K1337 Y1344 F1349 T1390 I1484	M1331-I1335 HydrophobicContact CB-CD1 4.25Å; M1331-I1335 WeakPolarHBondContact O-CD1 3.17Å; M1331-I1335 WeakPolarHBondContact O-CG1 3.3Å; M1331-I1335 PolarHBondContact O-N 2.77Å; K1332-I1335 PolarHBondContact O-N 3.17Å; K1332-I1335 VanDerWaalsContact O-N 3.1Å; F1333-I1335 VanDerWaalsContact C-N 3.31Å; F1333-I1335 PolarHBondContact O-N 3.08Å; F1333-I1335 VanDerWaalsContact O-N 3.15Å; I1335-K1337 PolarHBondContact O-N 3.21Å; I1335-K1337 VanDerWaalsContact O-N 3.14Å; I1335-Y1344 HydrophobicContact CG2-CD1 3.97Å; I1335-Y1344 HydrophobicContact CG2-CE1 4.02Å; I1335-Y1344 HydrophobicContact CG2-CG 4.1Å; I1335-Y1344 WeakPolarHBondContact O-CE1 2.92Å; I1335-Y1344 PolarHBondContact O-OH 2.78Å; I1335-Y1344 VanDerWaalsContact O-OH 3.13Å; I1335-F1349 HydrophobicContact CD1-CD1 4.4Å; I1335-F1349 HydrophobicContact CD1-CE1 3.87Å; I1335-F1349 HydrophobicContact CD1-CE2 4.2Å; I1335-F1349 HydrophobicContact CD1-CZ 3.62Å; I1335-F1349 HydrophobicContact CG1-CE1 3.97Å; I1335-F1349 HydrophobicContact CG1-CZ 4.02Å; I1335-F1349 HydrophobicContact CG2-CE1 4.25Å; I1335-F1349 HydrophobicContact CG2-CZ 4.04Å; I1335-T1390 HydrophobicContact CD1-CG2 3.64Å; I1335-T1390 WeakPolarHBondContact CD1-O 3.47Å; I1335-I1484 HydrophobicContact CG1-CG2 4.39Å
1336	M	43.7	Very low	53.1	Low	111.4 Å²	111.4	76.8 Å²	76.8	55%	0.549	40%	0.398	S	S	.	.			trans	-77.6	29.2	-176.6	-81	-172.2	91.7	0	0	114.1	K1332 F1333 H1338	K1332-M1336 HydrophobicContact CD-SD 4.3Å; K1332-M1336 VanDerWaalsContact CE-SD 3.54Å; K1332-M1336 HydrophobicContact CG-CG 4.31Å; K1332-M1336 HydrophobicContact CG-SD 4.12Å; K1332-M1336 WeakPolarHBondContact O-CG 3.3Å; K1332-M1336 PolarHBondContact O-N 3.32Å; K1332-M1336 VanDerWaalsContact O-N 3.16Å; F1333-M1336 HydrophobicContact CB-CB 4.39Å; F1333-M1336 HydrophobicContact CB-CG 4.05Å; F1333-M1336 HydrophobicContact CB-SD 4.27Å; F1333-M1336 HydrophobicContact CD1-CG 4.09Å; F1333-M1336 HydrophobicContact CD1-SD 4.1Å; F1333-M1336 HydrophobicContact CG-CG 4.36Å; F1333-M1336 HydrophobicContact CG-SD 4.19Å; F1333-M1336 PolarHBondContact O-N 2.95Å; M1336-H1338 VanDerWaalsContact C-N 3.27Å; M1336-H1338 PolarHBondContact O-N 3.03Å; M1336-H1338 VanDerWaalsContact O-N 3.14Å
1337	K	45.5	Very low	51.5	Low	113.2 Å²	113.2	79.7 Å²	79.7	49%	0.492	41%	0.406	S	S	.	.	S	Bend	trans	-61.9	-20.9	177.8	-82.1	-171.2	173.7	-172.5	0	113.8	I1335 P1339 F1512	I1335-K1337 PolarHBondContact O-N 3.21Å; I1335-K1337 VanDerWaalsContact O-N 3.14Å; K1337-P1339 VanDerWaalsContact C-CD 3.45Å; K1337-P1339 WeakPolarHBondContact O-CD 3.37Å; K1337-F1512 PolarHBondContact NZ-O 2.89Å
1338	H	38.9	Very low	50.6	Low	114.2 Å²	114.2	82.6 Å²	82.6	53%	0.529	42%	0.421	S	S	.	.			trans	-119	101.8	171.4	-59	-63.3	0	0	0	110.4	M1336 N1340 E1341 Y1344	M1336-H1338 VanDerWaalsContact C-N 3.27Å; M1336-H1338 PolarHBondContact O-N 3.03Å; M1336-H1338 VanDerWaalsContact O-N 3.14Å; H1338-N1340 VanDerWaalsContact C-N 3.27Å; H1338-N1340 PolarHBondContact O-N 3.11Å; H1338-N1340 VanDerWaalsContact O-N 3.11Å; H1338-E1341 PolarHBondContact O-N 2.93Å; H1338-Y1344 VanDerWaalsContact C-OH 3.29Å; H1338-Y1344 WeakPolarHBondContact CA-OH 3.39Å; H1338-Y1344 HydrophobicContact CB-CE2 4.03Å; H1338-Y1344 WeakPolarHBondContact CB-OH 3.39Å; H1338-Y1344 PolarHBondContact CD2-OH 3.23Å; H1338-Y1344 VanDerWaalsContact CD2-OH 3.32Å; H1338-Y1344 PolarHBondContact N-OH 2.7Å; H1338-Y1344 WeakPolarHBondContact O-CE2 3.47Å; H1338-Y1344 PolarHBondContact O-OH 2.73Å
1339	P	35.9	Very low	49.9	Very low	103.8 Å²	103.8	83.2 Å²	83.2	67%	0.674	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-11.3	-176.4	27.1	-34.6	0	0	0	114.3	K1337	K1337-P1339 VanDerWaalsContact C-CD 3.45Å; K1337-P1339 WeakPolarHBondContact O-CD 3.37Å
1340	N	36.1	Very low	49.4	Very low	149.8 Å²	149.8	84.4 Å²	84.4	80%	0.801	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-6.1	-171.3	-67.5	-4.4	0	0	0	114.7	H1338 I1342	H1338-N1340 VanDerWaalsContact C-N 3.27Å; H1338-N1340 PolarHBondContact O-N 3.11Å; H1338-N1340 VanDerWaalsContact O-N 3.11Å; N1340-I1342 PolarHBondContact O-N 3.23Å
1341	E	35.6	Very low	49.4	Very low	106.6 Å²	106.6	84.3 Å²	84.3	50%	0.498	43%	0.426	S	S	.	.			trans	-101.3	100.3	177.8	-73	-170.9	159	0	0	111.1	H1338 S1343 Y1344 R1347	H1338-E1341 PolarHBondContact O-N 2.93Å; E1341-S1343 PolarHBondContact O-N 3.03Å; E1341-Y1344 HydrophobicContact CB-CD2 4.35Å; E1341-Y1344 HydrophobicContact CB-CE2 4.07Å; E1341-Y1344 VanDerWaalsContact O-CD2 3.29Å; E1341-Y1344 WeakPolarHBondContact O-CD2 3.24Å; E1341-Y1344 WeakPolarHBondContact O-CE2 3.24Å; E1341-Y1344 PolarHBondContact OE2-OH 3.49Å; E1341-R1347 IonicContact OE2-CZ 3.16Å; E1341-R1347 IonicContact OE2-NH2 3.76Å; E1341-R1347 PolarHBondContact OE2-NH2 2.92Å
1342	I	36.2	Very low	49.6	Very low	162 Å²	162	85.8 Å²	85.8	83%	0.831	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-72.9	8.3	179.3	-60.3	168	0	0	0	111.7	N1340 Y1344	N1340-I1342 PolarHBondContact O-N 3.23Å; I1342-Y1344 HydrophobicContact CG2-CE2 4.06Å; I1342-Y1344 PolarHBondContact O-N 3.23Å
1343	S	35.9	Very low	50.4	Low	75.6 Å²	75.6	81.3 Å²	81.3	53%	0.529	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-89.9	25.7	-174.9	52.1	0	0	0	0	114.7	E1341 T1345 N1346	E1341-S1343 PolarHBondContact O-N 3.03Å; S1343-T1345 VanDerWaalsContact C-N 3.27Å; S1343-T1345 PolarHBondContact O-N 3.13Å; S1343-N1346 PolarHBondContact O-N 3.05Å
1344	Y	43.6	Very low	51.5	Low	85 Å²	85	76.2 Å²	76.2	33%	0.333	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-68.4	1.4	-178.6	-77.4	-78.9	0	0	0	114.9	I1335 H1338 E1341 I1342 N1346 R1347	I1335-Y1344 HydrophobicContact CG2-CD1 3.97Å; I1335-Y1344 HydrophobicContact CG2-CE1 4.02Å; I1335-Y1344 HydrophobicContact CG2-CG 4.1Å; I1335-Y1344 WeakPolarHBondContact O-CE1 2.92Å; I1335-Y1344 PolarHBondContact O-OH 2.78Å; I1335-Y1344 VanDerWaalsContact O-OH 3.13Å; H1338-Y1344 VanDerWaalsContact C-OH 3.29Å; H1338-Y1344 WeakPolarHBondContact CA-OH 3.39Å; H1338-Y1344 HydrophobicContact CB-CE2 4.03Å; H1338-Y1344 WeakPolarHBondContact CB-OH 3.39Å; H1338-Y1344 PolarHBondContact CD2-OH 3.23Å; H1338-Y1344 VanDerWaalsContact CD2-OH 3.32Å; H1338-Y1344 PolarHBondContact N-OH 2.7Å; H1338-Y1344 WeakPolarHBondContact O-CE2 3.47Å; H1338-Y1344 PolarHBondContact O-OH 2.73Å; E1341-Y1344 HydrophobicContact CB-CD2 4.35Å; E1341-Y1344 HydrophobicContact CB-CE2 4.07Å; E1341-Y1344 VanDerWaalsContact O-CD2 3.29Å; E1341-Y1344 WeakPolarHBondContact O-CD2 3.24Å; E1341-Y1344 WeakPolarHBondContact O-CE2 3.24Å; E1341-Y1344 PolarHBondContact OE2-OH 3.49Å; I1342-Y1344 HydrophobicContact CG2-CE2 4.06Å; I1342-Y1344 PolarHBondContact O-N 3.23Å; Y1344-N1346 PolarHBondContact O-N 2.98Å; Y1344-N1346 VanDerWaalsContact O-N 3.12Å; Y1344-R1347 PolarHBondContact O-N 3.28Å
1345	T	41.8	Very low	52.9	Low	111.2 Å²	111.2	75.2 Å²	75.2	68%	0.682	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-69.6	2.6	-176.6	53.7	0	0	0	0	114.1	S1343 R1347	S1343-T1345 VanDerWaalsContact C-N 3.27Å; S1343-T1345 PolarHBondContact O-N 3.13Å; T1345-R1347 PolarHBondContact O-N 2.72Å
1346	N	45.1	Very low	54.1	Low	126.8 Å²	126.8	74.1 Å²	74.1	68%	0.678	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-107.1	17	-176.5	-89.7	-3.9	0	0	0	114.8	R1236 S1343 Y1344 I1348	R1236-N1346 PolarHBondContact NH1-OD1 2.84Å; S1343-N1346 PolarHBondContact O-N 3.05Å; Y1344-N1346 PolarHBondContact O-N 2.98Å; Y1344-N1346 VanDerWaalsContact O-N 3.12Å; N1346-I1348 PolarHBondContact O-N 2.7Å
1347	R	51.4	Low	55.8	Low	108.2 Å²	108.2	68.8 Å²	68.8	41%	0.408	35%	0.35	S	S	.	.			trans	-81.1	131.9	175.4	-66.6	-165.4	-177.4	-162	1.5	110.7	E1341 Y1344 T1345 F1349	E1341-R1347 IonicContact OE2-CZ 3.16Å; E1341-R1347 IonicContact OE2-NH2 3.76Å; E1341-R1347 PolarHBondContact OE2-NH2 2.92Å; Y1344-R1347 PolarHBondContact O-N 3.28Å; T1345-R1347 PolarHBondContact O-N 2.72Å; R1347-F1349 HydrophobicContact CB-CE2 4.2Å; R1347-F1349 HydrophobicContact CB-CZ 4.21Å; R1347-F1349 WeakPolarHBondContact O-CD2 3.43Å; R1347-F1349 VanDerWaalsContact O-CE2 3.28Å; R1347-F1349 WeakPolarHBondContact O-CE2 3.29Å
1348	I	59.8	Low	57.1	Low	60.2 Å²	60.2	63.6 Å²	63.6	31%	0.309	33%	0.327	S	S	.	.			trans	-96.9	127.8	178.2	-59.1	176.6	0	0	0	108.2	H1232 N1346 H1350 P1386 Y1388	H1232-I1348 WeakPolarHBondContact CD2-CD1 3.45Å; H1232-I1348 WeakPolarHBondContact NE2-CD1 3.26Å; N1346-I1348 PolarHBondContact O-N 2.7Å; I1348-H1350 WeakPolarHBondContact CG2-NE2 3.46Å; I1348-P1386 HydrophobicContact CG2-CB 3.57Å; I1348-P1386 HydrophobicContact CG2-CG 4.28Å; I1348-Y1388 HydrophobicContact CD1-CD1 4.27Å; I1348-Y1388 HydrophobicContact CD1-CE1 3.97Å; I1348-Y1388 HydrophobicContact CG1-CD1 4.14Å; I1348-Y1388 HydrophobicContact CG1-CE1 3.95Å; I1348-Y1388 HydrophobicContact CG2-CE1 4.23Å
1349	F	65.4	Low	58.6	Low	22.4 Å²	22.4	58.2 Å²	58.2	10%	0.098	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-102.2	145.3	177.1	-56.3	-89.1	0	0	0	110.1	M1331 I1335 R1347 I1387 T1390 E1464 I1484	M1331-F1349 HydrophobicContact CE-CB 4.44Å; M1331-F1349 HydrophobicContact CE-CD1 4.03Å; M1331-F1349 HydrophobicContact CE-CG 4.35Å; I1335-F1349 HydrophobicContact CD1-CD1 4.4Å; I1335-F1349 HydrophobicContact CD1-CE1 3.87Å; I1335-F1349 HydrophobicContact CD1-CE2 4.2Å; I1335-F1349 HydrophobicContact CD1-CZ 3.62Å; I1335-F1349 HydrophobicContact CG1-CE1 3.97Å; I1335-F1349 HydrophobicContact CG1-CZ 4.02Å; I1335-F1349 HydrophobicContact CG2-CE1 4.25Å; I1335-F1349 HydrophobicContact CG2-CZ 4.04Å; R1347-F1349 HydrophobicContact CB-CE2 4.2Å; R1347-F1349 HydrophobicContact CB-CZ 4.21Å; R1347-F1349 WeakPolarHBondContact O-CD2 3.43Å; R1347-F1349 VanDerWaalsContact O-CE2 3.28Å; R1347-F1349 WeakPolarHBondContact O-CE2 3.29Å; F1349-I1387 HydrophobicContact CB-CB 4.08Å; F1349-I1387 HydrophobicContact CB-CG2 4.36Å; F1349-I1387 WeakPolarHBondContact CD2-O 3.36Å; F1349-I1387 PolarHBondContact N-O 3.04Å; F1349-I1387 VanDerWaalsContact N-O 3.1Å; F1349-I1387 VanDerWaalsContact O-CB 3.32Å; F1349-I1387 WeakPolarHBondContact O-CB 3.3Å; F1349-I1387 WeakPolarHBondContact O-CG1 3.36Å; F1349-I1387 PolarHBondContact O-N 3.11Å; F1349-T1390 HydrophobicContact CB-CG2 4.42Å; F1349-T1390 HydrophobicContact CD1-CG2 4.3Å; F1349-T1390 HydrophobicContact CD2-CG2 4Å; F1349-T1390 HydrophobicContact CE2-CG2 3.74Å; F1349-T1390 HydrophobicContact CG-CG2 4.17Å; F1349-T1390 HydrophobicContact CZ-CG2 4.05Å; F1349-E1464 WeakPolarHBondContact CA-OE1 3.33Å; F1349-E1464 WeakPolarHBondContact CB-OE1 3.32Å; F1349-I1484 HydrophobicContact CD1-CD1 3.71Å; F1349-I1484 VanDerWaalsContact CD1-CD1 3.49Å; F1349-I1484 HydrophobicContact CE1-CD1 3.66Å
1350	H	68.4	Low	60	Low	39 Å²	39	54.2 Å²	54.2	18%	0.181	28%	0.276	C	S	.	.			trans	-133.3	128.7	174.4	-72.8	-90.2	0	0	0	110.2	H1232 I1348 R1352 I1383 S1384 P1386 E1464	H1232-H1350 AromaticContact NE2-CE1 3.81Å; I1348-H1350 WeakPolarHBondContact CG2-NE2 3.46Å; H1350-R1352 PolarHBondContact O-N 3.15Å; H1350-I1383 HydrophobicContact CB-CD1 3.93Å; H1350-I1383 HydrophobicContact CB-CG1 3.99Å; H1350-S1384 PolarHBondContact ND1-O 3.19Å; H1350-S1384 VanDerWaalsContact ND1-O 3.1Å; H1350-P1386 VanDerWaalsContact CE1-CA 3.45Å; H1350-P1386 WeakPolarHBondContact CE1-CA 3.47Å; H1350-E1464 VanDerWaalsContact C-CD 3.44Å; H1350-E1464 PolarHBondContact N-OE1 2.93Å; H1350-E1464 WeakPolarHBondContact O-CG 3.4Å
1351	A	73	Confident	61.2	Low	6 Å²	6	49.8 Å²	49.8	5%	0.05	25%	0.253	C	S	.	.			trans	-88.8	128.1	168.7	0	0	0	0	0	109.9	L1325 I1328 I1383 S1384 I1387	L1325-A1351 HydrophobicContact CD2-CB 3.57Å; L1325-A1351 VanDerWaalsContact CD2-CB 3.43Å; I1328-A1351 HydrophobicContact CD1-CB 3.92Å; I1328-A1351 VanDerWaalsContact CD1-CB 3.48Å; A1351-I1383 CarbonylContact O-C 3.56Å; A1351-I1383 WeakPolarHBondContact O-CA 3.27Å; A1351-S1384 WeakPolarHBondContact CA-OG 2.99Å; A1351-S1384 WeakPolarHBondContact CB-OG 3.38Å; A1351-S1384 PolarHBondContact N-OG 2.95Å; A1351-S1384 VanDerWaalsContact N-OG 3.08Å; A1351-S1384 WeakPolarHBondContact O-CB 3.11Å; A1351-S1384 PolarHBondContact O-N 3.02Å; A1351-S1384 PolarHBondContact O-OG 3Å; A1351-I1387 HydrophobicContact CB-CD1 4.23Å
1352	R	71.1	Confident	62.2	Low	48.4 Å²	48.4	46.1 Å²	46.1	18%	0.183	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	144	172	-70.6	-176.3	177.5	-157.6	-3.5	111	H1350 H1354 T1382 I1383 N1462 E1464 P1477	H1350-R1352 PolarHBondContact O-N 3.15Å; R1352-H1354 VanDerWaalsContact CB-NE2 3.35Å; R1352-H1354 WeakPolarHBondContact CB-NE2 3.38Å; R1352-H1354 WeakPolarHBondContact CD-NE2 3.45Å; R1352-T1382 CarbonylContact C-O 3.59Å; R1352-T1382 VanDerWaalsContact CA-O 3.27Å; R1352-T1382 WeakPolarHBondContact CA-O 3.22Å; R1352-I1383 HydrophobicContact CG-CB 4.06Å; R1352-I1383 HydrophobicContact CG-CD1 4.21Å; R1352-I1383 HydrophobicContact CG-CG1 3.8Å; R1352-I1383 VanDerWaalsContact NE-CD1 3.34Å; R1352-N1462 PolarHBondContact N-OD1 2.88Å; R1352-N1462 VanDerWaalsContact O-CA 3.27Å; R1352-N1462 WeakPolarHBondContact O-CA 3.34Å; R1352-N1462 WeakPolarHBondContact O-CB 3.42Å; R1352-N1462 VanDerWaalsContact O-CG 3.32Å; R1352-N1462 PolarHBondContact O-ND2 3.35Å; R1352-N1462 PolarHBondContact O-OD1 2.85Å; R1352-E1464 WeakPolarHBondContact CD-OE1 3.33Å; R1352-E1464 IonicContact CZ-OE1 3.38Å; R1352-E1464 IonicContact NE-OE1 3.85Å; R1352-E1464 PolarHBondContact NE-OE1 3.42Å; R1352-E1464 VanDerWaalsContact NE-OE1 3.15Å; R1352-E1464 IonicContact NH1-OE1 2.9Å; R1352-E1464 PolarHBondContact NH1-OE1 2.88Å; R1352-E1464 IonicContact NH2-OE1 3.72Å; R1352-P1477 VanDerWaalsContact CZ-CB 3.41Å; R1352-P1477 VanDerWaalsContact NH1-CB 3.29Å; R1352-P1477 VanDerWaalsContact NH1-CD 3.3Å; R1352-P1477 VanDerWaalsContact NH2-CG 3.28Å
1353	L	77.4	Confident	63	Low	1.4 Å²	1.4	46 Å²	46	1%	0.007	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	126.9	172.5	-55.4	165.1	0	0	0	108.1	I1323 L1325 S1381 T1382 C1398 L1400 Y1460 N1462 L1541	I1323-L1353 HydrophobicContact CB-CD2 4.26Å; I1323-L1353 HydrophobicContact CG2-CD1 4.26Å; I1323-L1353 HydrophobicContact CG2-CD2 3.56Å; L1325-L1353 HydrophobicContact CB-CD1 4.09Å; L1325-L1353 HydrophobicContact CB-CD2 4.12Å; L1325-L1353 HydrophobicContact CD1-CD1 4.42Å; L1325-L1353 HydrophobicContact CD1-CD2 4.46Å; L1325-L1353 HydrophobicContact CD2-CD1 4.35Å; L1325-L1353 HydrophobicContact CD2-CD2 4.18Å; L1325-L1353 HydrophobicContact CG-CD2 4.49Å; L1353-S1381 CarbonylContact O-C 3.54Å; L1353-S1381 WeakPolarHBondContact O-CA 3.26Å; L1353-S1381 WeakPolarHBondContact O-CB 3.32Å; L1353-S1381 PolarHBondContact O-OG 3.19Å; L1353-T1382 HydrophobicContact CB-CG2 3.83Å; L1353-T1382 HydrophobicContact CD1-CG2 3.85Å; L1353-T1382 HydrophobicContact CG-CG2 4Å; L1353-T1382 PolarHBondContact N-O 3.05Å; L1353-T1382 PolarHBondContact O-N 3.12Å; L1353-C1398 HydrophobicContact CD1-CB 4.39Å; L1353-C1398 VanDerWaalsContact CD1-SG 3.55Å; L1353-C1398 WeakPolarHBondContact CD1-SG 3.24Å; L1353-L1400 HydrophobicContact CB-CB 4.29Å; L1353-L1400 HydrophobicContact CB-CD2 3.88Å; L1353-L1400 HydrophobicContact CD1-CB 4.08Å; L1353-L1400 HydrophobicContact CD2-CB 3.98Å; L1353-L1400 HydrophobicContact CD2-CD2 4.23Å; L1353-Y1460 HydrophobicContact CB-CE2 3.94Å; L1353-Y1460 VanDerWaalsContact CB-OH 3.32Å; L1353-Y1460 WeakPolarHBondContact CB-OH 3.03Å; L1353-Y1460 WeakPolarHBondContact CD1-OH 3.41Å; L1353-Y1460 HydrophobicContact CD2-CE1 4.35Å; L1353-Y1460 HydrophobicContact CD2-CE2 3.77Å; L1353-Y1460 WeakPolarHBondContact CD2-OH 3.37Å; L1353-Y1460 HydrophobicContact CG-CE2 4.33Å; L1353-Y1460 WeakPolarHBondContact CG-OH 3.47Å; L1353-N1462 WeakPolarHBondContact CD2-ND2 3.35Å; L1353-N1462 WeakPolarHBondContact CD2-OD1 3.28Å; L1353-L1541 HydrophobicContact CD2-CD2 4.34Å
1354	H	76.4	Confident	63.5	Low	3 Å²	3	48.9 Å²	48.9	1%	0.014	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.3	178.2	-60.7	-90.9	0	0	0	110.8	R1352 L1356 L1378 S1381 Y1460 T1461 F1463 I1475	R1352-H1354 VanDerWaalsContact CB-NE2 3.35Å; R1352-H1354 WeakPolarHBondContact CB-NE2 3.38Å; R1352-H1354 WeakPolarHBondContact CD-NE2 3.45Å; H1354-L1356 HydrophobicContact CB-CD2 4.17Å; H1354-L1356 HydrophobicContact CB-CG 4.24Å; H1354-L1378 HydrophobicContact CB-CD1 4.03Å; H1354-S1381 PolarHBondContact CE1-OG 3.07Å; H1354-S1381 VanDerWaalsContact CE1-OG 3.27Å; H1354-S1381 PolarHBondContact ND1-OG 3.14Å; H1354-S1381 VanDerWaalsContact ND1-OG 3.14Å; H1354-Y1460 VanDerWaalsContact O-CA 3.31Å; H1354-Y1460 WeakPolarHBondContact O-CA 3.23Å; H1354-Y1460 WeakPolarHBondContact O-CD1 3.42Å; H1354-Y1460 VanDerWaalsContact O-CD2 3.29Å; H1354-Y1460 WeakPolarHBondContact O-CD2 3.38Å; H1354-T1461 WeakPolarHBondContact CB-O 3.2Å; H1354-T1461 PolarHBondContact CD2-O 3.21Å; H1354-T1461 PolarHBondContact N-O 3.18Å; H1354-T1461 PolarHBondContact O-N 2.98Å; H1354-F1463 HydrophobicContact CB-CE2 4.46Å; H1354-F1463 AromaticContact CD2-CD2 3.6Å; H1354-F1463 AromaticContact CD2-CE2 3.87Å; H1354-F1463 AromaticContact NE2-CD2 3.69Å; H1354-F1463 AromaticContact NE2-CE2 3.92Å; H1354-I1475 WeakPolarHBondContact CE1-CG2 3.32Å; H1354-I1475 WeakPolarHBondContact ND1-CG2 3.42Å
1355	C	80.1	Confident	63.6	Low	3.8 Å²	3.8	50.1 Å²	50.1	3%	0.026	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.4	167.2	-177.6	0	0	0	0	109.1	I1379 K1380 L1400 I1402 Y1460	C1355-I1379 HydrophobicContact CB-CB 4.39Å; C1355-I1379 PolarHBondContact O-N 3.1Å; C1355-K1380 PolarHBondContact N-O 3.12Å; C1355-L1400 HydrophobicContact CB-CD2 4.35Å; C1355-I1402 HydrophobicContact CB-CD1 3.37Å; C1355-I1402 VanDerWaalsContact CB-CD1 3.44Å; C1355-I1402 HydrophobicContact CB-CG1 4.45Å; C1355-I1402 VanDerWaalsContact SG-CD1 3.54Å; C1355-Y1460 HydrophobicContact CB-CD1 4.08Å; C1355-Y1460 HydrophobicContact CB-CE1 3.41Å; C1355-Y1460 VanDerWaalsContact CB-CE1 3.41Å; C1355-Y1460 PolarHBondContact SG-OH 2.62Å; C1355-Y1460 VanDerWaalsContact SG-OH 3.32Å
1356	L	75.8	Confident	63.5	Low	3.6 Å²	3.6	47.9 Å²	47.9	2%	0.019	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	131.3	-173.8	-55.3	-180	0	0	0	110.7	H1354 L1358 I1376 H1377 L1378 L1458 Q1459 T1461 F1463 I1475	H1354-L1356 HydrophobicContact CB-CD2 4.17Å; H1354-L1356 HydrophobicContact CB-CG 4.24Å; L1356-L1358 HydrophobicContact CB-CD2 4.18Å; L1356-L1358 HydrophobicContact CD1-CD2 4.33Å; L1356-I1376 HydrophobicContact CB-CG2 4.36Å; L1356-I1376 HydrophobicContact CD1-CG2 4.14Å; L1356-I1376 HydrophobicContact CD2-CG2 3.98Å; L1356-I1376 HydrophobicContact CG-CG2 4.38Å; L1356-H1377 CarbonylContact C-O 3.58Å; L1356-H1377 WeakPolarHBondContact CA-O 3.41Å; L1356-L1378 HydrophobicContact CD2-CB 4.08Å; L1356-L1378 HydrophobicContact CD2-CD1 3.59Å; L1356-L1378 HydrophobicContact CD2-CG 4.43Å; L1356-L1458 CarbonylContact O-C 3.4Å; L1356-L1458 WeakPolarHBondContact O-CA 3.33Å; L1356-L1458 WeakPolarHBondContact O-CD1 3.31Å; L1356-Q1459 PolarHBondContact N-O 2.97Å; L1356-Q1459 PolarHBondContact O-N 2.94Å; L1356-T1461 HydrophobicContact CD1-CG2 4.11Å; L1356-T1461 VanDerWaalsContact CD1-OG1 3.25Å; L1356-T1461 WeakPolarHBondContact CD1-OG1 3.42Å; L1356-F1463 HydrophobicContact CD1-CD2 3.69Å; L1356-F1463 HydrophobicContact CD1-CE2 3.73Å; L1356-F1463 HydrophobicContact CD1-CZ 4.47Å; L1356-I1475 HydrophobicContact CD1-CD1 4.29Å; L1356-I1475 HydrophobicContact CD2-CD1 4.41Å
1357	L	78.1	Confident	63.3	Low	1 Å²	1	51 Å²	51	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.2	162.8	179.5	66.6	0	0	0	108.2	I1310 I1359 H1377 I1379 W1408 A1437 P1456 L1458	I1310-L1357 HydrophobicContact CG2-CD2 4.46Å; L1357-I1359 HydrophobicContact CD2-CD1 4.22Å; L1357-I1359 HydrophobicContact CD2-CG1 4.38Å; L1357-I1359 HydrophobicContact CG-CD1 4.34Å; L1357-I1359 HydrophobicContact CG-CG1 4.13Å; L1357-H1377 HydrophobicContact CB-CB 4.31Å; L1357-H1377 PolarHBondContact N-O 3.17Å; L1357-H1377 PolarHBondContact O-N 3.18Å; L1357-I1379 HydrophobicContact CB-CD1 3.97Å; L1357-I1379 HydrophobicContact CB-CG1 4.37Å; L1357-W1408 HydrophobicContact CD1-CE3 4.42Å; L1357-W1408 HydrophobicContact CD1-CZ3 4.37Å; L1357-W1408 HydrophobicContact CD2-CD2 3.94Å; L1357-W1408 HydrophobicContact CD2-CE3 4.25Å; L1357-W1408 HydrophobicContact CD2-CG 4.12Å; L1357-A1437 HydrophobicContact CD1-CB 4.42Å; L1357-P1456 HydrophobicContact CD1-CB 4.49Å; L1357-L1458 HydrophobicContact CB-CD1 4.32Å; L1357-L1458 HydrophobicContact CD1-CD1 4.29Å
1358	L	72.5	Confident	62.7	Low	2.6 Å²	2.6	48 Å²	48	1%	0.014	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	129.1	176.8	-59.9	171.5	0	0	0	109	L1356 Y1374 H1375 I1376 I1453 P1456 C1457 Q1459	L1356-L1358 HydrophobicContact CB-CD2 4.18Å; L1356-L1358 HydrophobicContact CD1-CD2 4.33Å; L1358-Y1374 HydrophobicContact CB-CD1 4.47Å; L1358-Y1374 HydrophobicContact CB-CD2 4.32Å; L1358-Y1374 HydrophobicContact CD1-CE2 4.37Å; L1358-Y1374 HydrophobicContact CD2-CD2 4.11Å; L1358-Y1374 HydrophobicContact CD2-CE2 4.06Å; L1358-Y1374 HydrophobicContact CD2-CG 4.25Å; L1358-H1375 WeakPolarHBondContact CA-O 3.38Å; L1358-I1376 HydrophobicContact CD1-CG1 4.19Å; L1358-I1376 HydrophobicContact CD2-CB 4.27Å; L1358-I1376 HydrophobicContact CD2-CD1 4.36Å; L1358-I1376 HydrophobicContact CD2-CG1 3.76Å; L1358-I1376 HydrophobicContact CD2-CG2 3.99Å; L1358-I1376 HydrophobicContact CG-CG1 3.72Å; L1358-I1453 HydrophobicContact CB-CD1 4.11Å; L1358-I1453 HydrophobicContact CD1-CD1 3.55Å; L1358-I1453 VanDerWaalsContact CD1-CD1 3.41Å; L1358-I1453 HydrophobicContact CG-CD1 4.39Å; L1358-P1456 CarbonylContact O-C 3.44Å; L1358-P1456 WeakPolarHBondContact O-CA 3.24Å; L1358-P1456 VanDerWaalsContact O-CB 3.27Å; L1358-P1456 WeakPolarHBondContact O-CB 3.38Å; L1358-C1457 PolarHBondContact N-O 3.22Å; L1358-C1457 PolarHBondContact O-N 3.24Å; L1358-Q1459 HydrophobicContact CD1-CB 4.22Å; L1358-Q1459 VanDerWaalsContact CD1-CD 3.41Å; L1358-Q1459 HydrophobicContact CD1-CG 4.12Å; L1358-Q1459 VanDerWaalsContact CD1-OE1 3.29Å; L1358-Q1459 HydrophobicContact CG-CB 4.48Å
1359	I	71.2	Confident	61.9	Low	0.8 Å²	0.8	50.4 Å²	50.4	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	120.3	-172	-63.2	173.2	0	0	0	108.8	I1308 I1310 L1357 N1361 Y1374 H1375 H1377 I1410 Y1412 P1456	I1308-I1359 HydrophobicContact CD1-CG2 4.17Å; I1308-I1359 HydrophobicContact CG2-CD1 4.45Å; I1310-I1359 HydrophobicContact CD1-CD1 3.39Å; I1310-I1359 VanDerWaalsContact CD1-CD1 3.42Å; I1310-I1359 HydrophobicContact CG1-CD1 3.81Å; L1357-I1359 HydrophobicContact CD2-CD1 4.22Å; L1357-I1359 HydrophobicContact CD2-CG1 4.38Å; L1357-I1359 HydrophobicContact CG-CD1 4.34Å; L1357-I1359 HydrophobicContact CG-CG1 4.13Å; I1359-N1361 PolarHBondContact O-N 2.75Å; I1359-Y1374 CarbonylContact O-C 3.54Å; I1359-Y1374 VanDerWaalsContact O-CA 3.29Å; I1359-Y1374 WeakPolarHBondContact O-CA 3.38Å; I1359-Y1374 VanDerWaalsContact O-CB 3.3Å; I1359-Y1374 WeakPolarHBondContact O-CB 3.41Å; I1359-H1375 HydrophobicContact CB-CB 4.31Å; I1359-H1375 HydrophobicContact CG2-CB 4.39Å; I1359-H1375 PolarHBondContact N-O 3.23Å; I1359-H1375 PolarHBondContact O-N 3.13Å; I1359-H1377 HydrophobicContact CD1-CB 4.27Å; I1359-I1410 HydrophobicContact CB-CD1 4.25Å; I1359-I1410 HydrophobicContact CD1-CD1 3.74Å; I1359-I1410 HydrophobicContact CD1-CG1 4.18Å; I1359-I1410 HydrophobicContact CD1-CG2 4.48Å; I1359-I1410 HydrophobicContact CG1-CD1 3.86Å; I1359-I1410 HydrophobicContact CG2-CD1 4.07Å; I1359-I1410 HydrophobicContact CG2-CG2 4.13Å; I1359-Y1412 VanDerWaalsContact CG2-OH 3.24Å; I1359-Y1412 WeakPolarHBondContact CG2-OH 3.29Å; I1359-P1456 HydrophobicContact CG1-CB 4.42Å
1360	P	65.5	Low	60.6	Low	19.8 Å²	19.8	55.9 Å²	55.9	13%	0.129	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	141.6	178.4	20.8	-24.8	0	0	0	111.1	Y1374 Y1412 I1453 I1454 P1456	P1360-Y1374 HydrophobicContact CB-CD1 4.21Å; P1360-Y1374 HydrophobicContact CB-CE1 3.96Å; P1360-Y1374 HydrophobicContact CG-CD1 4.23Å; P1360-Y1374 HydrophobicContact CG-CE1 3.92Å; P1360-Y1412 PolarHBondContact O-OH 3.07Å; P1360-I1453 WeakPolarHBondContact CB-O 3.39Å; P1360-I1454 WeakPolarHBondContact CG-O 3.42Å; P1360-P1456 HydrophobicContact CG-CG 4.4Å
1361	N	61.3	Low	59.2	Low	59 Å²	59	58.1 Å²	58.1	32%	0.316	29%	0.289	S	S	.	.			trans	-71.2	149.3	174.3	-89.1	-11.9	0	0	0	111.4	I1359 K1363 D1371 E1372 L1373 Y1374 H1375	I1359-N1361 PolarHBondContact O-N 2.75Å; N1361-K1363 PolarHBondContact O-N 3.07Å; N1361-K1363 VanDerWaalsContact O-N 3.14Å; N1361-D1371 PolarHBondContact ND2-O 3.05Å; N1361-E1372 VanDerWaalsContact CG-O 3.29Å; N1361-E1372 PolarHBondContact ND2-O 3.01Å; N1361-L1373 WeakPolarHBondContact CB-O 3.39Å; N1361-L1373 PolarHBondContact N-O 3.12Å; N1361-L1373 PolarHBondContact ND2-O 2.77Å; N1361-Y1374 WeakPolarHBondContact OD1-CA 3.28Å; N1361-H1375 PolarHBondContact OD1-CE1 2.62Å; N1361-H1375 VanDerWaalsContact OD1-CE1 3.24Å; N1361-H1375 PolarHBondContact OD1-ND1 3.32Å
1362	D	56.8	Low	57.9	Low	28.8 Å²	28.8	62.3 Å²	62.3	15%	0.154	31%	0.308	C	S	.	.			trans	-66.5	116	177.2	-170.5	-19	0	0	0	110.2	R1364 Y1365 Y1412	D1362-R1364 PolarHBondContact O-N 3.09Å; D1362-R1364 WeakPolarHBondContact OD1-CB 3.4Å; D1362-R1364 WeakPolarHBondContact OD1-CG 3.4Å; D1362-R1364 IonicContact OD1-CZ 3.46Å; D1362-R1364 PolarHBondContact OD1-N 3.12Å; D1362-R1364 VanDerWaalsContact OD1-N 3.13Å; D1362-R1364 IonicContact OD1-NE 3.35Å; D1362-R1364 PolarHBondContact OD1-NE 3.07Å; D1362-R1364 VanDerWaalsContact OD1-NE 3.16Å; D1362-R1364 IonicContact OD1-NH2 3.43Å; D1362-R1364 IonicContact OD2-CZ 3.22Å; D1362-R1364 VanDerWaalsContact OD2-CZ 3.32Å; D1362-R1364 IonicContact OD2-NE 2.89Å; D1362-R1364 PolarHBondContact OD2-NE 3.23Å; D1362-R1364 VanDerWaalsContact OD2-NE 3.12Å; D1362-R1364 IonicContact OD2-NH2 2.92Å; D1362-R1364 PolarHBondContact OD2-NH2 3.05Å; D1362-Y1365 HydrophobicContact CB-CD2 4.23Å; D1362-Y1365 HydrophobicContact CB-CE2 4.46Å; D1362-Y1365 PolarHBondContact O-N 3.14Å; D1362-Y1365 VanDerWaalsContact O-N 3.1Å; D1362-Y1412 HydrophobicContact CB-CD1 4.28Å; D1362-Y1412 HydrophobicContact CB-CD2 4.21Å; D1362-Y1412 HydrophobicContact CB-CE1 4.35Å; D1362-Y1412 HydrophobicContact CB-CE2 4.24Å; D1362-Y1412 HydrophobicContact CB-CG 4.21Å
1363	K	52.5	Low	57.1	Low	159.2 Å²	159.2	64 Å²	64	69%	0.692	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-10.6	-176	-62.8	-175	177.6	-176.1	0	114.4	N1361 Y1365 E1372	N1361-K1363 PolarHBondContact O-N 3.07Å; N1361-K1363 VanDerWaalsContact O-N 3.14Å; K1363-Y1365 VanDerWaalsContact C-N 3.33Å; K1363-Y1365 PolarHBondContact O-N 3.04Å; K1363-E1372 IonicContact NZ-OE1 3.1Å
1364	R	47.1	Very low	56.3	Low	137.4 Å²	137.4	66.5 Å²	66.5	52%	0.518	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-12	-178.7	-69.2	176.9	-89.7	-173.6	-3.8	114.7	D1362 R1427 N1428	D1362-R1364 PolarHBondContact O-N 3.09Å; D1362-R1364 WeakPolarHBondContact OD1-CB 3.4Å; D1362-R1364 WeakPolarHBondContact OD1-CG 3.4Å; D1362-R1364 IonicContact OD1-CZ 3.46Å; D1362-R1364 PolarHBondContact OD1-N 3.12Å; D1362-R1364 VanDerWaalsContact OD1-N 3.13Å; D1362-R1364 IonicContact OD1-NE 3.35Å; D1362-R1364 PolarHBondContact OD1-NE 3.07Å; D1362-R1364 VanDerWaalsContact OD1-NE 3.16Å; D1362-R1364 IonicContact OD1-NH2 3.43Å; D1362-R1364 IonicContact OD2-CZ 3.22Å; D1362-R1364 VanDerWaalsContact OD2-CZ 3.32Å; D1362-R1364 IonicContact OD2-NE 2.89Å; D1362-R1364 PolarHBondContact OD2-NE 3.23Å; D1362-R1364 VanDerWaalsContact OD2-NE 3.12Å; D1362-R1364 IonicContact OD2-NH2 2.92Å; D1362-R1364 PolarHBondContact OD2-NH2 3.05Å; R1364-R1427 PolarHBondContact NH2-O 2.96Å; R1364-N1428 VanDerWaalsContact CZ-OD1 3.29Å; R1364-N1428 PolarHBondContact NH1-OD1 3.1Å; R1364-N1428 PolarHBondContact NH2-OD1 2.91Å
1365	Y	45	Very low	55.6	Low	110.2 Å²	110.2	68.6 Å²	68.6	43%	0.432	34%	0.34	S	S	.	.	S	Bend	trans	-122.2	-6.8	-171.7	-62.8	-77	0	0	0	115.5	N1306 D1362 K1363 H1367 Q1414	N1306-Y1365 WeakPolarHBondContact ND2-CB 3.33Å; N1306-Y1365 WeakPolarHBondContact ND2-CD2 3.44Å; N1306-Y1365 WeakPolarHBondContact ND2-CE2 3.5Å; D1362-Y1365 HydrophobicContact CB-CD2 4.23Å; D1362-Y1365 HydrophobicContact CB-CE2 4.46Å; D1362-Y1365 PolarHBondContact O-N 3.14Å; D1362-Y1365 VanDerWaalsContact O-N 3.1Å; K1363-Y1365 VanDerWaalsContact C-N 3.33Å; K1363-Y1365 PolarHBondContact O-N 3.04Å; Y1365-H1367 PolarHBondContact O-N 3.14Å; Y1365-Q1414 WeakPolarHBondContact OH-CG 3.42Å; Y1365-Q1414 PolarHBondContact OH-NE2 2.95Å
1366	S	38.9	Very low	54.9	Low	64.4 Å²	64.4	69.9 Å²	69.9	45%	0.45	35%	0.346	S	S	.	.			trans	-89.4	93.7	176.6	72	0	0	0	0	111.2	S1368 D1371	S1366-S1368 VanDerWaalsContact C-N 3.34Å; S1366-S1368 PolarHBondContact O-N 2.92Å; S1366-S1368 PolarHBondContact OG-O 3.48Å; S1366-D1371 PolarHBondContact OG-OD2 3.05Å
1367	H	41.2	Very low	54.6	Low	191 Å²	191	72.4 Å²	72.4	88%	0.884	36%	0.357	S	S	*	.			trans	-86.4	-4.2	169.6	-77.5	-58.9	0	0	0	113.3	Y1365	Y1365-H1367 PolarHBondContact O-N 3.14Å
1368	S	40	Very low	54.3	Low	46.6 Å²	46.6	74.7 Å²	74.7	33%	0.326	37%	0.369	S	S	.	.	S	Bend	trans	-109.2	128.6	171.7	176.4	0	0	0	0	110	S1366 M1370 D1371	S1366-S1368 VanDerWaalsContact C-N 3.34Å; S1366-S1368 PolarHBondContact O-N 2.92Å; S1366-S1368 PolarHBondContact OG-O 3.48Å; S1368-M1370 PolarHBondContact O-N 3.06Å; S1368-M1370 VanDerWaalsContact O-N 3.15Å; S1368-M1370 WeakPolarHBondContact OG-CB 3.46Å; S1368-M1370 WeakPolarHBondContact OG-CG 3.01Å; S1368-M1370 PolarHBondContact OG-N 2.79Å; S1368-D1371 VanDerWaalsContact CB-OD1 3.3Å; S1368-D1371 WeakPolarHBondContact CB-OD1 3.34Å; S1368-D1371 VanDerWaalsContact CB-OD2 3.31Å; S1368-D1371 WeakPolarHBondContact CB-OD2 3.31Å; S1368-D1371 PolarHBondContact N-OD2 2.89Å; S1368-D1371 WeakPolarHBondContact O-CB 3.42Å; S1368-D1371 PolarHBondContact O-N 3.09Å; S1368-D1371 VanDerWaalsContact O-N 3.11Å; S1368-D1371 VanDerWaalsContact O-OD2 3.1Å; S1368-D1371 PolarHBondContact OG-OD1 3.49Å; S1368-D1371 PolarHBondContact OG-OD2 2.86Å
1369	P	42.3	Very low	54.4	Low	110.6 Å²	110.6	76.9 Å²	76.9	72%	0.718	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	2.1	176.4	20.6	-22.5	0	0	0	113.9
1370	M	37	Very low	54.6	Low	137.6 Å²	137.6	81.3 Å²	81.3	68%	0.678	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-13.8	-176.3	-65.9	-66.3	-84.8	0	0	113.7	S1368 E1372 P1898 L1900	S1368-M1370 PolarHBondContact O-N 3.06Å; S1368-M1370 VanDerWaalsContact O-N 3.15Å; S1368-M1370 WeakPolarHBondContact OG-CB 3.46Å; S1368-M1370 WeakPolarHBondContact OG-CG 3.01Å; S1368-M1370 PolarHBondContact OG-N 2.79Å; M1370-E1372 PolarHBondContact O-N 3.01Å; M1370-E1372 VanDerWaalsContact O-N 3.08Å; M1370-P1898 HydrophobicContact CE-CB 3.89Å; M1370-P1898 HydrophobicContact CE-CG 3.82Å; M1370-P1898 HydrophobicContact SD-CB 3.71Å; M1370-P1898 HydrophobicContact SD-CG 3.58Å; M1370-P1898 VanDerWaalsContact SD-CG 3.58Å; M1370-L1900 HydrophobicContact CE-CD1 3.9Å; M1370-L1900 HydrophobicContact SD-CD1 4.25Å
1371	D	39.4	Very low	55	Low	85.8 Å²	85.8	82.5 Å²	82.5	46%	0.459	41%	0.408	S	S	.	.	S	Bend	trans	-84.3	96.8	-179.6	-65.3	-40.2	0	0	0	111.1	H1305 N1361 S1366 S1368 L1373	H1305-D1371 IonicContact CE1-OD1 3.75Å; N1361-D1371 PolarHBondContact ND2-O 3.05Å; S1366-D1371 PolarHBondContact OG-OD2 3.05Å; S1368-D1371 VanDerWaalsContact CB-OD1 3.3Å; S1368-D1371 WeakPolarHBondContact CB-OD1 3.34Å; S1368-D1371 VanDerWaalsContact CB-OD2 3.31Å; S1368-D1371 WeakPolarHBondContact CB-OD2 3.31Å; S1368-D1371 PolarHBondContact N-OD2 2.89Å; S1368-D1371 WeakPolarHBondContact O-CB 3.42Å; S1368-D1371 PolarHBondContact O-N 3.09Å; S1368-D1371 VanDerWaalsContact O-N 3.11Å; S1368-D1371 VanDerWaalsContact O-OD2 3.1Å; S1368-D1371 PolarHBondContact OG-OD1 3.49Å; S1368-D1371 PolarHBondContact OG-OD2 2.86Å; D1371-L1373 HydrophobicContact CB-CD1 4.44Å; D1371-L1373 HydrophobicContact CB-CG 4.4Å; D1371-L1373 PolarHBondContact O-N 3.06Å; D1371-L1373 VanDerWaalsContact O-N 3.11Å
1372	E	47.2	Very low	55.4	Low	92.6 Å²	92.6	81 Å²	81	43%	0.433	40%	0.402	S	S	.	.			trans	-36.5	84.5	173.2	-65.4	-171.1	164.3	0	0	113	N1361 K1363 M1370 Y1374 P1452 I1471	N1361-E1372 VanDerWaalsContact CG-O 3.29Å; N1361-E1372 PolarHBondContact ND2-O 3.01Å; K1363-E1372 IonicContact NZ-OE1 3.1Å; M1370-E1372 PolarHBondContact O-N 3.01Å; M1370-E1372 VanDerWaalsContact O-N 3.08Å; E1372-Y1374 HydrophobicContact CB-CD2 4.43Å; E1372-Y1374 HydrophobicContact CB-CE2 3.88Å; E1372-Y1374 WeakPolarHBondContact O-CD2 3.33Å; E1372-Y1374 PolarHBondContact O-N 3.09Å; E1372-Y1374 VanDerWaalsContact O-N 3.12Å; E1372-Y1374 PolarHBondContact OE2-OH 2.81Å; E1372-P1452 HydrophobicContact CB-CB 4.33Å; E1372-I1471 HydrophobicContact CG-CD1 4.08Å; E1372-I1471 HydrophobicContact CG-CG1 3.96Å
1373	L	52.8	Low	56.2	Low	85.8 Å²	85.8	82 Å²	82	45%	0.449	41%	0.406	S	S	.	.	S	Bend	trans	-70.8	19.1	-177.9	-69.5	167.6	0	0	0	112.4	S1297 N1361 D1371 P1452 I1471	S1297-L1373 WeakPolarHBondContact OG-CD2 3.4Å; N1361-L1373 WeakPolarHBondContact CB-O 3.39Å; N1361-L1373 PolarHBondContact N-O 3.12Å; N1361-L1373 PolarHBondContact ND2-O 2.77Å; D1371-L1373 HydrophobicContact CB-CD1 4.44Å; D1371-L1373 HydrophobicContact CB-CG 4.4Å; D1371-L1373 PolarHBondContact O-N 3.06Å; D1371-L1373 VanDerWaalsContact O-N 3.11Å; L1373-P1452 HydrophobicContact CB-CB 4.08Å; L1373-P1452 HydrophobicContact CD1-CB 4.16Å; L1373-P1452 HydrophobicContact CD1-CG 4.39Å; L1373-P1452 HydrophobicContact CD2-CB 3.84Å; L1373-P1452 HydrophobicContact CD2-CG 4.25Å; L1373-P1452 HydrophobicContact CG-CB 4.11Å; L1373-I1471 HydrophobicContact CD1-CD1 4.27Å
1374	Y	60.1	Low	57	Low	53.8 Å²	53.8	74.7 Å²	74.7	21%	0.211	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.5	177	40.2	-90.7	0	0	0	111.4	L1358 I1359 P1360 N1361 E1372 I1376 Q1448 I1453	L1358-Y1374 HydrophobicContact CB-CD1 4.47Å; L1358-Y1374 HydrophobicContact CB-CD2 4.32Å; L1358-Y1374 HydrophobicContact CD1-CE2 4.37Å; L1358-Y1374 HydrophobicContact CD2-CD2 4.11Å; L1358-Y1374 HydrophobicContact CD2-CE2 4.06Å; L1358-Y1374 HydrophobicContact CD2-CG 4.25Å; I1359-Y1374 CarbonylContact O-C 3.54Å; I1359-Y1374 VanDerWaalsContact O-CA 3.29Å; I1359-Y1374 WeakPolarHBondContact O-CA 3.38Å; I1359-Y1374 VanDerWaalsContact O-CB 3.3Å; I1359-Y1374 WeakPolarHBondContact O-CB 3.41Å; P1360-Y1374 HydrophobicContact CB-CD1 4.21Å; P1360-Y1374 HydrophobicContact CB-CE1 3.96Å; P1360-Y1374 HydrophobicContact CG-CD1 4.23Å; P1360-Y1374 HydrophobicContact CG-CE1 3.92Å; N1361-Y1374 WeakPolarHBondContact OD1-CA 3.28Å; E1372-Y1374 HydrophobicContact CB-CD2 4.43Å; E1372-Y1374 HydrophobicContact CB-CE2 3.88Å; E1372-Y1374 WeakPolarHBondContact O-CD2 3.33Å; E1372-Y1374 PolarHBondContact O-N 3.09Å; E1372-Y1374 VanDerWaalsContact O-N 3.12Å; E1372-Y1374 PolarHBondContact OE2-OH 2.81Å; Y1374-I1376 HydrophobicContact CD2-CD1 4.49Å; Y1374-I1376 HydrophobicContact CD2-CG1 3.91Å; Y1374-I1376 HydrophobicContact CE2-CD1 3.91Å; Y1374-I1376 HydrophobicContact CE2-CG1 3.76Å; Y1374-Q1448 HydrophobicContact CE1-CG 4.1Å; Y1374-Q1448 VanDerWaalsContact CZ-NE2 3.28Å; Y1374-Q1448 PolarHBondContact OH-NE2 2.93Å; Y1374-I1453 HydrophobicContact CD1-CB 4.31Å; Y1374-I1453 HydrophobicContact CD1-CD1 3.84Å; Y1374-I1453 HydrophobicContact CD1-CG1 4.12Å; Y1374-I1453 HydrophobicContact CD2-CD1 4.15Å; Y1374-I1453 HydrophobicContact CE1-CD1 4.02Å; Y1374-I1453 HydrophobicContact CE1-CG1 4.35Å; Y1374-I1453 HydrophobicContact CE2-CD1 4.31Å; Y1374-I1453 HydrophobicContact CG-CB 4.34Å; Y1374-I1453 HydrophobicContact CG-CD1 3.93Å; Y1374-I1453 HydrophobicContact CG-CG1 4.36Å
1375	H	63.1	Low	57.8	Low	46.2 Å²	46.2	70.2 Å²	70.2	21%	0.214	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	138.1	170.9	-146.8	70.6	0	0	0	110.8	S1297 I1308 L1358 I1359 N1361	S1297-H1375 VanDerWaalsContact CB-NE2 3.34Å; S1297-H1375 WeakPolarHBondContact CB-NE2 3.4Å; S1297-H1375 PolarHBondContact OG-CE1 3.05Å; S1297-H1375 PolarHBondContact OG-NE2 3.07Å; I1308-H1375 HydrophobicContact CD1-CB 3.78Å; I1308-H1375 VanDerWaalsContact CD1-CD2 3.43Å; I1308-H1375 WeakPolarHBondContact CD1-CD2 2.84Å; L1358-H1375 WeakPolarHBondContact CA-O 3.38Å; I1359-H1375 HydrophobicContact CB-CB 4.31Å; I1359-H1375 HydrophobicContact CG2-CB 4.39Å; I1359-H1375 PolarHBondContact N-O 3.23Å; I1359-H1375 PolarHBondContact O-N 3.13Å; N1361-H1375 PolarHBondContact OD1-CE1 2.62Å; N1361-H1375 VanDerWaalsContact OD1-CE1 3.24Å; N1361-H1375 PolarHBondContact OD1-ND1 3.32Å
1376	I	65.9	Low	58.7	Low	31.4 Å²	31.4	66.2 Å²	66.2	16%	0.161	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121.1	178.7	-57.1	178.1	0	0	0	109.7	I1296 L1356 L1358 Y1374 F1463 I1471 N1472 I1475	I1296-I1376 HydrophobicContact CD1-CD1 3.64Å; I1296-I1376 HydrophobicContact CG1-CD1 3.86Å; I1296-I1376 HydrophobicContact CG2-CD1 3.86Å; L1356-I1376 HydrophobicContact CB-CG2 4.36Å; L1356-I1376 HydrophobicContact CD1-CG2 4.14Å; L1356-I1376 HydrophobicContact CD2-CG2 3.98Å; L1356-I1376 HydrophobicContact CG-CG2 4.38Å; L1358-I1376 HydrophobicContact CD1-CG1 4.19Å; L1358-I1376 HydrophobicContact CD2-CB 4.27Å; L1358-I1376 HydrophobicContact CD2-CD1 4.36Å; L1358-I1376 HydrophobicContact CD2-CG1 3.76Å; L1358-I1376 HydrophobicContact CD2-CG2 3.99Å; L1358-I1376 HydrophobicContact CG-CG1 3.72Å; Y1374-I1376 HydrophobicContact CD2-CD1 4.49Å; Y1374-I1376 HydrophobicContact CD2-CG1 3.91Å; Y1374-I1376 HydrophobicContact CE2-CD1 3.91Å; Y1374-I1376 HydrophobicContact CE2-CG1 3.76Å; I1376-F1463 HydrophobicContact CD1-CE2 4.47Å; I1376-I1471 HydrophobicContact CD1-CG2 3.72Å; I1376-N1472 WeakPolarHBondContact CD1-ND2 3.4Å; I1376-I1475 HydrophobicContact CD1-CD1 4.18Å; I1376-I1475 HydrophobicContact CG2-CD1 4.25Å
1377	H	69.5	Low	59.8	Low	56.2 Å²	56.2	63.4 Å²	63.4	26%	0.26	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	112.2	172.7	-178.3	58.8	0	0	0	110.7	I1310 L1356 L1357 I1359 I1379	I1310-H1377 HydrophobicContact CD1-CB 3.81Å; I1310-H1377 VanDerWaalsContact CD1-CG 3.42Å; L1356-H1377 CarbonylContact C-O 3.58Å; L1356-H1377 WeakPolarHBondContact CA-O 3.41Å; L1357-H1377 HydrophobicContact CB-CB 4.31Å; L1357-H1377 PolarHBondContact N-O 3.17Å; L1357-H1377 PolarHBondContact O-N 3.18Å; I1359-H1377 HydrophobicContact CD1-CB 4.27Å; H1377-I1379 PolarHBondContact O-N 3.12Å
1378	L	71.6	Confident	60.7	Low	48.6 Å²	48.6	57.9 Å²	57.9	25%	0.254	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	111.8	175.1	176	64	0	0	0	109.9	H1354 L1356 K1380 I1474 I1475	H1354-L1378 HydrophobicContact CB-CD1 4.03Å; L1356-L1378 HydrophobicContact CD2-CB 4.08Å; L1356-L1378 HydrophobicContact CD2-CD1 3.59Å; L1356-L1378 HydrophobicContact CD2-CG 4.43Å; L1378-K1380 WeakPolarHBondContact CD1-O 3.39Å; L1378-I1474 HydrophobicContact CB-CG2 4.03Å; L1378-I1474 HydrophobicContact CD2-CG2 4.27Å; L1378-I1475 HydrophobicContact CD2-CG2 4.35Å
1379	I	74.3	Confident	61.7	Low	48.6 Å²	48.6	58.6 Å²	58.6	25%	0.249	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	-48.5	178.4	-64	166.7	0	0	0	110.5	C1355 L1357 H1377 I1402 L1404 W1408 L1458	C1355-I1379 HydrophobicContact CB-CB 4.39Å; C1355-I1379 PolarHBondContact O-N 3.1Å; L1357-I1379 HydrophobicContact CB-CD1 3.97Å; L1357-I1379 HydrophobicContact CB-CG1 4.37Å; H1377-I1379 PolarHBondContact O-N 3.12Å; I1379-I1402 HydrophobicContact CG2-CG2 4.03Å; I1379-L1404 HydrophobicContact CD1-CD2 4.01Å; I1379-L1404 HydrophobicContact CG2-CD2 3.85Å; I1379-W1408 HydrophobicContact CD1-CH2 4.24Å; I1379-W1408 HydrophobicContact CD1-CZ2 3.79Å; I1379-L1458 HydrophobicContact CD1-CD1 3.63Å
1380	K	75.8	Confident	62.3	Low	94.4 Å²	94.4	54.8 Å²	54.8	41%	0.41	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	149.6	179.6	-162.8	169.7	-177.4	173.6	0	111	C1355 L1378 L1400 D1401 I1402	C1355-K1380 PolarHBondContact N-O 3.12Å; L1378-K1380 WeakPolarHBondContact CD1-O 3.39Å; K1380-L1400 HydrophobicContact CB-CD1 4.1Å; K1380-L1400 HydrophobicContact CD-CD1 3.97Å; K1380-L1400 HydrophobicContact CG-CD1 3.78Å; K1380-D1401 VanDerWaalsContact CD-O 3.26Å; K1380-D1401 WeakPolarHBondContact CD-O 3.33Å; K1380-D1401 VanDerWaalsContact CE-O 3.24Å; K1380-D1401 WeakPolarHBondContact CE-O 3.37Å; K1380-D1401 PolarHBondContact NZ-O 3.03Å; K1380-I1402 HydrophobicContact CB-CD1 4.34Å; K1380-I1402 HydrophobicContact CB-CG1 4.07Å; K1380-I1402 HydrophobicContact CB-CG2 4.42Å; K1380-I1402 HydrophobicContact CD-CG1 4.17Å; K1380-I1402 HydrophobicContact CG-CG1 4.42Å
1381	S	73.8	Confident	63.3	Low	43.6 Å²	43.6	51.7 Å²	51.7	31%	0.305	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	153.9	172	-174.4	0	0	0	0	110.8	L1353 H1354	L1353-S1381 CarbonylContact O-C 3.54Å; L1353-S1381 WeakPolarHBondContact O-CA 3.26Å; L1353-S1381 WeakPolarHBondContact O-CB 3.32Å; L1353-S1381 PolarHBondContact O-OG 3.19Å; H1354-S1381 PolarHBondContact CE1-OG 3.07Å; H1354-S1381 VanDerWaalsContact CE1-OG 3.27Å; H1354-S1381 PolarHBondContact ND1-OG 3.14Å; H1354-S1381 VanDerWaalsContact ND1-OG 3.14Å
1382	T	69.4	Low	64.3	Low	29 Å²	29	51.5 Å²	51.5	18%	0.178	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	162.1	165.1	-178.7	0	0	0	0	110	R1352 L1353 K1399 L1400	R1352-T1382 CarbonylContact C-O 3.59Å; R1352-T1382 VanDerWaalsContact CA-O 3.27Å; R1352-T1382 WeakPolarHBondContact CA-O 3.22Å; L1353-T1382 HydrophobicContact CB-CG2 3.83Å; L1353-T1382 HydrophobicContact CD1-CG2 3.85Å; L1353-T1382 HydrophobicContact CG-CG2 4Å; L1353-T1382 PolarHBondContact N-O 3.05Å; L1353-T1382 PolarHBondContact O-N 3.12Å; T1382-K1399 WeakPolarHBondContact CB-O 3.37Å; T1382-K1399 WeakPolarHBondContact CG2-O 3.28Å; T1382-K1399 PolarHBondContact OG1-O 3.15Å; T1382-L1400 HydrophobicContact CG2-CB 3.72Å; T1382-L1400 HydrophobicContact CG2-CD1 4.03Å; T1382-L1400 HydrophobicContact CG2-CG 4.37Å
1383	I	72.3	Confident	65	Low	49.4 Å²	49.4	48 Å²	48	25%	0.253	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.3	-177.3	-169.2	172	0	0	0	109.8	H1350 A1351 R1352	H1350-I1383 HydrophobicContact CB-CD1 3.93Å; H1350-I1383 HydrophobicContact CB-CG1 3.99Å; A1351-I1383 CarbonylContact O-C 3.56Å; A1351-I1383 WeakPolarHBondContact O-CA 3.27Å; R1352-I1383 HydrophobicContact CG-CB 4.06Å; R1352-I1383 HydrophobicContact CG-CD1 4.21Å; R1352-I1383 HydrophobicContact CG-CG1 3.8Å; R1352-I1383 VanDerWaalsContact NE-CD1 3.34Å
1384	S	69.7	Low	65.3	Low	6 Å²	6	47.9 Å²	47.9	4%	0.042	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-74.9	164.1	173.1	68.7	0	0	0	0	112.4	H1350 A1351 C1398	H1350-S1384 PolarHBondContact ND1-O 3.19Å; H1350-S1384 VanDerWaalsContact ND1-O 3.1Å; A1351-S1384 WeakPolarHBondContact CA-OG 2.99Å; A1351-S1384 WeakPolarHBondContact CB-OG 3.38Å; A1351-S1384 PolarHBondContact N-OG 2.95Å; A1351-S1384 VanDerWaalsContact N-OG 3.08Å; A1351-S1384 WeakPolarHBondContact O-CB 3.11Å; A1351-S1384 PolarHBondContact O-N 3.02Å; A1351-S1384 PolarHBondContact O-OG 3Å; S1384-C1398 PolarHBondContact N-SG 2.95Å; S1384-C1398 VanDerWaalsContact N-SG 3.44Å
1385	S	64.2	Low	65.3	Low	42.2 Å²	42.2	49.8 Å²	49.8	30%	0.295	25%	0.25	S	S	.	.	P	Polyproline II helix	trans	-53.6	156.2	159.2	50.7	0	0	0	0	111.5	I1387 E1395 L1396	S1385-I1387 WeakPolarHBondContact O-CG1 3.47Å; S1385-I1387 PolarHBondContact O-N 3.15Å; S1385-E1395 PolarHBondContact OG-O 3.26Å; S1385-L1396 PolarHBondContact N-O 3.13Å; S1385-L1396 VanDerWaalsContact N-O 3.09Å; S1385-L1396 VanDerWaalsContact OG-C 3.32Å; S1385-L1396 VanDerWaalsContact OG-CA 3.32Å; S1385-L1396 WeakPolarHBondContact OG-CA 3.47Å; S1385-L1396 PolarHBondContact OG-O 2.87Å
1386	P	63.7	Low	65.5	Low	26.2 Å²	26.2	47.6 Å²	47.6	17%	0.17	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-49.6	124.3	168.4	-21.6	25.6	0	0	0	112.6	Y1122 I1348 H1350 Y1388	Y1122-P1386 PolarHBondContact OH-O 3.15Å; I1348-P1386 HydrophobicContact CG2-CB 3.57Å; I1348-P1386 HydrophobicContact CG2-CG 4.28Å; H1350-P1386 VanDerWaalsContact CE1-CA 3.45Å; H1350-P1386 WeakPolarHBondContact CE1-CA 3.47Å; P1386-Y1388 HydrophobicContact CB-CD1 4.48Å; P1386-Y1388 HydrophobicContact CB-CD2 4.47Å; P1386-Y1388 HydrophobicContact CB-CE1 4.23Å; P1386-Y1388 HydrophobicContact CB-CE2 3.87Å; P1386-Y1388 WeakPolarHBondContact CB-OH 3.28Å; P1386-Y1388 HydrophobicContact CG-CE2 3.78Å
1387	I	63.6	Low	65.4	Low	5 Å²	5	52.6 Å²	52.6	3%	0.026	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-100.1	111.9	177.5	-52.9	168.1	0	0	0	107.9	I1328 F1349 A1351 S1385 N1389 T1390 T1393 L1396	I1328-I1387 HydrophobicContact CD1-CD1 3.72Å; I1328-I1387 VanDerWaalsContact CD1-CD1 3.47Å; I1328-I1387 HydrophobicContact CD1-CG1 4.47Å; F1349-I1387 HydrophobicContact CB-CB 4.08Å; F1349-I1387 HydrophobicContact CB-CG2 4.36Å; F1349-I1387 WeakPolarHBondContact CD2-O 3.36Å; F1349-I1387 PolarHBondContact N-O 3.04Å; F1349-I1387 VanDerWaalsContact N-O 3.1Å; F1349-I1387 VanDerWaalsContact O-CB 3.32Å; F1349-I1387 WeakPolarHBondContact O-CB 3.3Å; F1349-I1387 WeakPolarHBondContact O-CG1 3.36Å; F1349-I1387 PolarHBondContact O-N 3.11Å; A1351-I1387 HydrophobicContact CB-CD1 4.23Å; S1385-I1387 WeakPolarHBondContact O-CG1 3.47Å; S1385-I1387 PolarHBondContact O-N 3.15Å; I1387-N1389 VanDerWaalsContact C-N 3.34Å; I1387-T1390 HydrophobicContact CG2-CG2 4.19Å; I1387-T1393 HydrophobicContact CB-CG2 4.5Å; I1387-T1393 HydrophobicContact CG1-CG2 4.39Å; I1387-T1393 HydrophobicContact CG2-CG2 4.03Å; I1387-T1393 WeakPolarHBondContact CG2-OG1 2.77Å; I1387-L1396 HydrophobicContact CD1-CD1 4.37Å; I1387-L1396 HydrophobicContact CD1-CD2 3.54Å; I1387-L1396 VanDerWaalsContact CD1-CD2 3.45Å; I1387-L1396 HydrophobicContact CG1-CD2 3.57Å; I1387-L1396 VanDerWaalsContact CG1-CD2 3.42Å
1388	Y	59.9	Low	65.7	Low	76.6 Å²	76.6	50.2 Å²	50.2	30%	0.3	26%	0.256	S	S	.	.			trans	-95.1	-23.5	179.7	-56.7	-73.6	0	0	0	113.2	E1019 Y1122 S1258 D1260 I1348 P1386	E1019-Y1388 PolarHBondContact OE1-OH 2.86Å; Y1122-Y1388 AromaticContact CD1-CD2 3.74Å; Y1122-Y1388 HydrophobicContact CD1-CD2 3.74Å; Y1122-Y1388 AromaticContact CD1-CE2 4Å; Y1122-Y1388 HydrophobicContact CD1-CE2 4.13Å; Y1122-Y1388 HydrophobicContact CD2-CE2 4.45Å; Y1122-Y1388 AromaticContact CE1-CD2 3.46Å; Y1122-Y1388 HydrophobicContact CE1-CD2 3.46Å; Y1122-Y1388 AromaticContact CE1-CE2 3.79Å; Y1122-Y1388 HydrophobicContact CE1-CE2 4.01Å; Y1122-Y1388 HydrophobicContact CE1-CG 4.42Å; Y1122-Y1388 HydrophobicContact CE2-CD2 4.46Å; Y1122-Y1388 HydrophobicContact CE2-CE2 4.32Å; Y1122-Y1388 HydrophobicContact CG-CD2 4.41Å; Y1122-Y1388 HydrophobicContact CG-CE2 4.36Å; Y1122-Y1388 AromaticContact CZ-CD2 3.88Å; Y1122-Y1388 AromaticContact CZ-CE2 3.93Å; S1258-Y1388 PolarHBondContact OG-OH 3.28Å; D1260-Y1388 WeakPolarHBondContact CB-OH 3.35Å; I1348-Y1388 HydrophobicContact CD1-CD1 4.27Å; I1348-Y1388 HydrophobicContact CD1-CE1 3.97Å; I1348-Y1388 HydrophobicContact CG1-CD1 4.14Å; I1348-Y1388 HydrophobicContact CG1-CE1 3.95Å; I1348-Y1388 HydrophobicContact CG2-CE1 4.23Å; P1386-Y1388 HydrophobicContact CB-CD1 4.48Å; P1386-Y1388 HydrophobicContact CB-CD2 4.47Å; P1386-Y1388 HydrophobicContact CB-CE1 4.23Å; P1386-Y1388 HydrophobicContact CB-CE2 3.87Å; P1386-Y1388 WeakPolarHBondContact CB-OH 3.28Å; P1386-Y1388 HydrophobicContact CG-CE2 3.78Å
1389	N	59.5	Low	66.2	Low	60.4 Å²	60.4	52.1 Å²	52.1	32%	0.323	26%	0.263	S	S	.	.			trans	-108.1	111.2	179.7	-170.3	-5.9	0	0	0	111.7	I1387 H1391 Y1392 T1393	I1387-N1389 VanDerWaalsContact C-N 3.34Å; N1389-H1391 VanDerWaalsContact C-N 3.3Å; N1389-H1391 PolarHBondContact O-N 2.91Å; N1389-H1391 WeakPolarHBondContact OD1-CB 3.35Å; N1389-H1391 PolarHBondContact OD1-N 3.14Å; N1389-H1391 VanDerWaalsContact OD1-N 3.1Å; N1389-H1391 PolarHBondContact OD1-ND1 3.12Å; N1389-H1391 VanDerWaalsContact OD1-ND1 3.15Å; N1389-Y1392 WeakPolarHBondContact CB-O 3.29Å; N1389-Y1392 VanDerWaalsContact CG-O 3.3Å; N1389-Y1392 PolarHBondContact ND2-O 3.08Å; N1389-Y1392 VanDerWaalsContact ND2-O 3.08Å; N1389-Y1392 PolarHBondContact O-N 3.39Å; N1389-T1393 PolarHBondContact O-OG1 2.95Å
1390	T	56.4	Low	66.6	Low	32.2 Å²	32.2	49.8 Å²	49.8	20%	0.198	25%	0.251	C	S	.	.	S	Bend	trans	-74.4	-11.4	-178.7	57.1	0	0	0	0	114.4	M1331 I1335 F1349 I1387	M1331-T1390 HydrophobicContact CB-CG2 4.4Å; M1331-T1390 WeakPolarHBondContact CB-O 3.47Å; M1331-T1390 PolarHBondContact N-O 3.13Å; M1331-T1390 VanDerWaalsContact N-O 3.08Å; M1331-T1390 HydrophobicContact SD-CG2 4.42Å; I1335-T1390 HydrophobicContact CD1-CG2 3.64Å; I1335-T1390 WeakPolarHBondContact CD1-O 3.47Å; F1349-T1390 HydrophobicContact CB-CG2 4.42Å; F1349-T1390 HydrophobicContact CD1-CG2 4.3Å; F1349-T1390 HydrophobicContact CD2-CG2 4Å; F1349-T1390 HydrophobicContact CE2-CG2 3.74Å; F1349-T1390 HydrophobicContact CG-CG2 4.17Å; F1349-T1390 HydrophobicContact CZ-CG2 4.05Å; I1387-T1390 HydrophobicContact CG2-CG2 4.19Å
1391	H	58.1	Low	67	Low	72 Å²	72	47.6 Å²	47.6	33%	0.333	24%	0.244	S	C	.	.	S	Bend	trans	-85.2	-44.1	-179.1	-60.9	84.8	0	0	0	112	S1329 G1330 F1333 N1389 T1843 A1844	S1329-H1391 VanDerWaalsContact CA-O 3.25Å; S1329-H1391 WeakPolarHBondContact CA-O 3.32Å; S1329-H1391 PolarHBondContact OG-O 2.91Å; G1330-H1391 PolarHBondContact N-O 3.15Å; G1330-H1391 VanDerWaalsContact N-O 3.1Å; F1333-H1391 AromaticContact CE2-CE1 3.42Å; F1333-H1391 VanDerWaalsContact CE2-CE1 3.42Å; F1333-H1391 WeakPolarHBondContact CE2-CE1 3.43Å; F1333-H1391 AromaticContact CE2-NE2 3.75Å; F1333-H1391 AromaticContact CZ-CE1 3.52Å; N1389-H1391 VanDerWaalsContact C-N 3.3Å; N1389-H1391 PolarHBondContact O-N 2.91Å; N1389-H1391 WeakPolarHBondContact OD1-CB 3.35Å; N1389-H1391 PolarHBondContact OD1-N 3.14Å; N1389-H1391 VanDerWaalsContact OD1-N 3.1Å; N1389-H1391 PolarHBondContact OD1-ND1 3.12Å; N1389-H1391 VanDerWaalsContact OD1-ND1 3.15Å; H1391-T1843 VanDerWaalsContact O-O 3.08Å; H1391-A1844 HydrophobicContact CB-CB 4.21Å
1392	Y	59.9	Low	67.5	Low	81.2 Å²	81.2	45.8 Å²	45.8	32%	0.318	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	129.7	-174.6	180	-95.9	0	0	0	112.3	K756 I1328 N1389 M1394 W1506 A1841 N1842	K756-Y1392 PolarHBondContact NZ-OH 2.91Å; I1328-Y1392 CarbonylContact O-C 3.57Å; I1328-Y1392 VanDerWaalsContact O-CA 3.3Å; I1328-Y1392 WeakPolarHBondContact O-CA 3.23Å; I1328-Y1392 WeakPolarHBondContact O-CB 3.43Å; I1328-Y1392 WeakPolarHBondContact O-CD2 3.4Å; N1389-Y1392 WeakPolarHBondContact CB-O 3.29Å; N1389-Y1392 VanDerWaalsContact CG-O 3.3Å; N1389-Y1392 PolarHBondContact ND2-O 3.08Å; N1389-Y1392 VanDerWaalsContact ND2-O 3.08Å; N1389-Y1392 PolarHBondContact O-N 3.39Å; Y1392-M1394 HydrophobicContact CD1-CG 4.29Å; Y1392-M1394 HydrophobicContact CD2-CE 4.5Å; Y1392-M1394 HydrophobicContact CE1-CG 3.64Å; Y1392-M1394 VanDerWaalsContact CE1-CG 3.4Å; Y1392-M1394 HydrophobicContact CE1-SD 3.74Å; Y1392-M1394 HydrophobicContact CE2-CE 3.66Å; Y1392-M1394 HydrophobicContact CE2-CG 3.65Å; Y1392-M1394 HydrophobicContact CE2-SD 3.71Å; Y1392-M1394 PolarHBondContact O-N 2.84Å; Y1392-M1394 WeakPolarHBondContact OH-CG 3.38Å; Y1392-M1394 PolarHBondContact OH-SD 3.1Å; Y1392-W1506 HydrophobicContact CD2-CH2 4.43Å; Y1392-W1506 AromaticContact CE2-CH2 3.75Å; Y1392-W1506 HydrophobicContact CE2-CH2 3.75Å; Y1392-W1506 AromaticContact CE2-CZ2 3.69Å; Y1392-W1506 HydrophobicContact CE2-CZ2 3.87Å; Y1392-A1841 HydrophobicContact CE2-CB 4.23Å; Y1392-N1842 HydrophobicContact CD1-CB 4.5Å; Y1392-N1842 HydrophobicContact CD2-CB 3.98Å; Y1392-N1842 HydrophobicContact CE2-CB 4.06Å; Y1392-N1842 WeakPolarHBondContact CE2-OD1 3.36Å; Y1392-N1842 HydrophobicContact CG-CB 4.34Å; Y1392-N1842 PolarHBondContact OH-OD1 2.86Å
1393	T	60.6	Low	68.2	Low	19.8 Å²	19.8	50.4 Å²	50.4	12%	0.121	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	122.9	173.9	-46.6	0	0	0	0	109.9	G1327 I1328 I1387 N1389 L1396	G1327-T1393 CarbonylContact C-O 3.55Å; G1327-T1393 WeakPolarHBondContact CA-O 3.28Å; I1328-T1393 PolarHBondContact N-O 3.07Å; I1328-T1393 PolarHBondContact O-N 3.08Å; I1328-T1393 VanDerWaalsContact O-N 3.15Å; I1387-T1393 HydrophobicContact CB-CG2 4.5Å; I1387-T1393 HydrophobicContact CG1-CG2 4.39Å; I1387-T1393 HydrophobicContact CG2-CG2 4.03Å; I1387-T1393 WeakPolarHBondContact CG2-OG1 2.77Å; N1389-T1393 PolarHBondContact O-OG1 2.95Å; T1393-L1396 HydrophobicContact CG2-CD2 3.63Å; T1393-L1396 HydrophobicContact CG2-CG 4.11Å
1394	M	60.4	Low	68.8	Low	84 Å²	84	48.1 Å²	48.1	41%	0.414	24%	0.238	S	C	.	.	S	Bend	trans	-98.9	-26.5	173.8	-68.3	-119.7	80.7	0	0	113.4	K1103 N1326 I1328 Y1392 L1396 W1506	K1103-M1394 HydrophobicContact CD-SD 4.31Å; N1326-M1394 CarbonylContact C-O 3.55Å; N1326-M1394 CarbonylContact O-C 3.44Å; N1326-M1394 VanDerWaalsContact O-C 3.31Å; N1326-M1394 VanDerWaalsContact O-CA 3.3Å; N1326-M1394 WeakPolarHBondContact O-CA 3.38Å; N1326-M1394 WeakPolarHBondContact O-CE 3.42Å; I1328-M1394 WeakPolarHBondContact O-CE 3.07Å; Y1392-M1394 HydrophobicContact CD1-CG 4.29Å; Y1392-M1394 HydrophobicContact CD2-CE 4.5Å; Y1392-M1394 HydrophobicContact CE1-CG 3.64Å; Y1392-M1394 VanDerWaalsContact CE1-CG 3.4Å; Y1392-M1394 HydrophobicContact CE1-SD 3.74Å; Y1392-M1394 HydrophobicContact CE2-CE 3.66Å; Y1392-M1394 HydrophobicContact CE2-CG 3.65Å; Y1392-M1394 HydrophobicContact CE2-SD 3.71Å; Y1392-M1394 PolarHBondContact O-N 2.84Å; Y1392-M1394 WeakPolarHBondContact OH-CG 3.38Å; Y1392-M1394 PolarHBondContact OH-SD 3.1Å; M1394-L1396 PolarHBondContact O-N 3.3Å; M1394-W1506 HydrophobicContact CE-CH2 4.04Å; M1394-W1506 HydrophobicContact CE-CZ2 4.46Å; M1394-W1506 HydrophobicContact SD-CH2 4.35Å
1395	E	60.5	Low	69.4	Low	92.4 Å²	92.4	48.2 Å²	48.2	43%	0.432	24%	0.239	S	C	.	.			trans	-101.4	76.8	-174.2	-64.9	-170.6	-170.4	0	0	111.3	S1097 N1099 S1385 N1397	S1097-E1395 WeakPolarHBondContact CB-OE1 3.25Å; S1097-E1395 VanDerWaalsContact CB-OE2 3.3Å; S1097-E1395 WeakPolarHBondContact CB-OE2 3.4Å; S1097-E1395 PolarHBondContact OG-OE1 2.96Å; S1097-E1395 PolarHBondContact OG-OE2 3.33Å; N1099-E1395 VanDerWaalsContact CB-OE1 3.23Å; N1099-E1395 WeakPolarHBondContact CB-OE1 3.39Å; N1099-E1395 WeakPolarHBondContact CB-OE2 3.12Å; N1099-E1395 PolarHBondContact ND2-OE2 3.33Å; N1099-E1395 VanDerWaalsContact ND2-OE2 3.1Å; S1385-E1395 PolarHBondContact OG-O 3.26Å; E1395-N1397 VanDerWaalsContact C-N 3.28Å
1396	L	65.6	Low	70.1	Confident	1.4 Å²	1.4	47 Å²	47	1%	0.007	23%	0.23	C	C	.	.			trans	-92.6	-14.2	-177.6	-64.7	166.3	0	0	0	112.7	L1325 I1328 S1385 I1387 T1393 M1394 C1398	L1325-L1396 HydrophobicContact CD1-CD1 4.27Å; L1325-L1396 HydrophobicContact CD2-CB 4.21Å; L1325-L1396 HydrophobicContact CD2-CD1 3.76Å; L1325-L1396 HydrophobicContact CD2-CG 4.38Å; L1325-L1396 HydrophobicContact CG-CB 4.38Å; L1325-L1396 HydrophobicContact CG-CD1 3.73Å; I1328-L1396 HydrophobicContact CB-CD1 4.29Å; I1328-L1396 HydrophobicContact CD1-CD1 3.7Å; I1328-L1396 VanDerWaalsContact CD1-CD1 3.48Å; I1328-L1396 HydrophobicContact CD1-CD2 3.98Å; I1328-L1396 HydrophobicContact CD1-CG 4.42Å; I1328-L1396 HydrophobicContact CG1-CD1 3.67Å; S1385-L1396 PolarHBondContact N-O 3.13Å; S1385-L1396 VanDerWaalsContact N-O 3.09Å; S1385-L1396 VanDerWaalsContact OG-C 3.32Å; S1385-L1396 VanDerWaalsContact OG-CA 3.32Å; S1385-L1396 WeakPolarHBondContact OG-CA 3.47Å; S1385-L1396 PolarHBondContact OG-O 2.87Å; I1387-L1396 HydrophobicContact CD1-CD1 4.37Å; I1387-L1396 HydrophobicContact CD1-CD2 3.54Å; I1387-L1396 VanDerWaalsContact CD1-CD2 3.45Å; I1387-L1396 HydrophobicContact CG1-CD2 3.57Å; I1387-L1396 VanDerWaalsContact CG1-CD2 3.42Å; T1393-L1396 HydrophobicContact CG2-CD2 3.63Å; T1393-L1396 HydrophobicContact CG2-CG 4.11Å; M1394-L1396 PolarHBondContact O-N 3.3Å; L1396-C1398 HydrophobicContact CB-CB 4.39Å; L1396-C1398 WeakPolarHBondContact O-CB 3.18Å; L1396-C1398 PolarHBondContact O-N 3.02Å
1397	N	64.9	Low	70.9	Confident	135.8 Å²	135.8	46.1 Å²	46.1	73%	0.726	22%	0.224	S	C	*	.			trans	44.1	28.9	-179.3	-68.2	-19.5	0	0	0	114.4	E1395 K1399	E1395-N1397 VanDerWaalsContact C-N 3.28Å; N1397-K1399 PolarHBondContact O-N 3.18Å
1398	C	74.9	Confident	71.7	Confident	4.4 Å²	4.4	46.4 Å²	46.4	3%	0.03	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	105	-172.3	-174.6	0	0	0	0	109.6	L1325 L1353 S1384 L1396	L1325-C1398 HydrophobicContact CB-CB 4.06Å; L1325-C1398 WeakPolarHBondContact CB-O 3.49Å; L1325-C1398 HydrophobicContact CD2-CB 4.01Å; L1325-C1398 HydrophobicContact CG-CB 4.42Å; L1325-C1398 PolarHBondContact N-O 2.95Å; L1325-C1398 VanDerWaalsContact N-O 3.1Å; L1353-C1398 HydrophobicContact CD1-CB 4.39Å; L1353-C1398 VanDerWaalsContact CD1-SG 3.55Å; L1353-C1398 WeakPolarHBondContact CD1-SG 3.24Å; S1384-C1398 PolarHBondContact N-SG 2.95Å; S1384-C1398 VanDerWaalsContact N-SG 3.44Å; L1396-C1398 HydrophobicContact CB-CB 4.39Å; L1396-C1398 WeakPolarHBondContact O-CB 3.18Å; L1396-C1398 PolarHBondContact O-N 3.02Å
1399	K	82.5	Confident	72.5	Confident	90 Å²	90	45.6 Å²	45.6	39%	0.391	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	131.6	-177.3	-170.8	-174	179.6	-150.7	0	110.3	Q1322 I1323 T1382 N1397 D1401	Q1322-K1399 VanDerWaalsContact CD-CE 3.42Å; Q1322-K1399 HydrophobicContact CG-CD 4.36Å; Q1322-K1399 HydrophobicContact CG-CG 4.39Å; Q1322-K1399 VanDerWaalsContact NE2-CD 3.31Å; Q1322-K1399 VanDerWaalsContact NE2-CE 3.26Å; Q1322-K1399 VanDerWaalsContact OE1-CE 3.28Å; I1323-K1399 CarbonylContact O-C 3.52Å; I1323-K1399 WeakPolarHBondContact O-CA 3.21Å; T1382-K1399 WeakPolarHBondContact CB-O 3.37Å; T1382-K1399 WeakPolarHBondContact CG2-O 3.28Å; T1382-K1399 PolarHBondContact OG1-O 3.15Å; N1397-K1399 PolarHBondContact O-N 3.18Å; K1399-D1401 WeakPolarHBondContact CD-OD2 3.41Å; K1399-D1401 VanDerWaalsContact CE-CG 3.5Å; K1399-D1401 WeakPolarHBondContact CE-OD1 3.25Å; K1399-D1401 VanDerWaalsContact CE-OD2 3.3Å; K1399-D1401 WeakPolarHBondContact CE-OD2 3.35Å; K1399-D1401 VanDerWaalsContact NZ-CG 3.27Å; K1399-D1401 IonicContact NZ-OD1 3.57Å; K1399-D1401 PolarHBondContact NZ-OD1 3.29Å; K1399-D1401 VanDerWaalsContact NZ-OD1 3.07Å; K1399-D1401 IonicContact NZ-OD2 3.2Å; K1399-D1401 PolarHBondContact NZ-OD2 2.98Å
1400	L	82.4	Confident	73.2	Confident	0.6 Å²	0.6	42.7 Å²	42.7	0%	0.003	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	97.3	175.9	-178.6	59.4	0	0	0	109.1	I1323 L1353 C1355 K1380 T1382 I1402 Y1460	I1323-L1400 HydrophobicContact CB-CB 4.33Å; I1323-L1400 HydrophobicContact CD1-CD2 4.46Å; I1323-L1400 PolarHBondContact N-O 2.92Å; I1323-L1400 PolarHBondContact O-N 2.98Å; L1353-L1400 HydrophobicContact CB-CB 4.29Å; L1353-L1400 HydrophobicContact CB-CD2 3.88Å; L1353-L1400 HydrophobicContact CD1-CB 4.08Å; L1353-L1400 HydrophobicContact CD2-CB 3.98Å; L1353-L1400 HydrophobicContact CD2-CD2 4.23Å; C1355-L1400 HydrophobicContact CB-CD2 4.35Å; K1380-L1400 HydrophobicContact CB-CD1 4.1Å; K1380-L1400 HydrophobicContact CD-CD1 3.97Å; K1380-L1400 HydrophobicContact CG-CD1 3.78Å; T1382-L1400 HydrophobicContact CG2-CB 3.72Å; T1382-L1400 HydrophobicContact CG2-CD1 4.03Å; T1382-L1400 HydrophobicContact CG2-CG 4.37Å; L1400-I1402 HydrophobicContact CD1-CD1 4.23Å; L1400-I1402 HydrophobicContact CD1-CG1 4.01Å; L1400-I1402 HydrophobicContact CD2-CD1 3.83Å; L1400-I1402 HydrophobicContact CD2-CG1 4.36Å; L1400-I1402 HydrophobicContact CG-CD1 3.72Å; L1400-I1402 HydrophobicContact CG-CG1 3.79Å; L1400-Y1460 HydrophobicContact CD2-CD1 4.14Å; L1400-Y1460 HydrophobicContact CD2-CE1 3.74Å; L1400-Y1460 HydrophobicContact CD2-CE2 4.05Å
1401	D	84.7	Confident	73.7	Confident	47 Å²	47	41.9 Å²	41.9	25%	0.251	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124.1	171.9	-75.5	-27.1	0	0	0	110	H1320 Q1322 K1380 K1399	H1320-D1401 IonicContact CE1-OD1 3.44Å; H1320-D1401 WeakPolarHBondContact NE2-CB 3.12Å; H1320-D1401 IonicContact NE2-OD1 3.07Å; Q1322-D1401 WeakPolarHBondContact CB-OD1 3.27Å; Q1322-D1401 VanDerWaalsContact CG-OD1 3.23Å; Q1322-D1401 WeakPolarHBondContact CG-OD1 3.38Å; K1380-D1401 VanDerWaalsContact CD-O 3.26Å; K1380-D1401 WeakPolarHBondContact CD-O 3.33Å; K1380-D1401 VanDerWaalsContact CE-O 3.24Å; K1380-D1401 WeakPolarHBondContact CE-O 3.37Å; K1380-D1401 PolarHBondContact NZ-O 3.03Å; K1399-D1401 WeakPolarHBondContact CD-OD2 3.41Å; K1399-D1401 VanDerWaalsContact CE-CG 3.5Å; K1399-D1401 WeakPolarHBondContact CE-OD1 3.25Å; K1399-D1401 VanDerWaalsContact CE-OD2 3.3Å; K1399-D1401 WeakPolarHBondContact CE-OD2 3.35Å; K1399-D1401 VanDerWaalsContact NZ-CG 3.27Å; K1399-D1401 IonicContact NZ-OD1 3.57Å; K1399-D1401 PolarHBondContact NZ-OD1 3.29Å; K1399-D1401 VanDerWaalsContact NZ-OD1 3.07Å; K1399-D1401 IonicContact NZ-OD2 3.2Å; K1399-D1401 PolarHBondContact NZ-OD2 2.98Å
1402	I	84.7	Confident	74	Confident	5.4 Å²	5.4	39.8 Å²	39.8	3%	0.028	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	130.4	-176	-45.3	165.5	0	0	0	109.7	H1320 I1321 C1355 I1379 K1380 L1400 L1404 Y1460	H1320-I1402 CarbonylContact C-O 3.56Å; H1320-I1402 VanDerWaalsContact CA-O 3.28Å; H1320-I1402 WeakPolarHBondContact CA-O 3.32Å; H1320-I1402 PolarHBondContact CD2-O 3.05Å; I1321-I1402 PolarHBondContact N-O 2.95Å; I1321-I1402 PolarHBondContact O-N 2.93Å; C1355-I1402 HydrophobicContact CB-CD1 3.37Å; C1355-I1402 VanDerWaalsContact CB-CD1 3.44Å; C1355-I1402 HydrophobicContact CB-CG1 4.45Å; C1355-I1402 VanDerWaalsContact SG-CD1 3.54Å; I1379-I1402 HydrophobicContact CG2-CG2 4.03Å; K1380-I1402 HydrophobicContact CB-CD1 4.34Å; K1380-I1402 HydrophobicContact CB-CG1 4.07Å; K1380-I1402 HydrophobicContact CB-CG2 4.42Å; K1380-I1402 HydrophobicContact CD-CG1 4.17Å; K1380-I1402 HydrophobicContact CG-CG1 4.42Å; L1400-I1402 HydrophobicContact CD1-CD1 4.23Å; L1400-I1402 HydrophobicContact CD1-CG1 4.01Å; L1400-I1402 HydrophobicContact CD2-CD1 3.83Å; L1400-I1402 HydrophobicContact CD2-CG1 4.36Å; L1400-I1402 HydrophobicContact CG-CD1 3.72Å; L1400-I1402 HydrophobicContact CG-CG1 3.79Å; I1402-L1404 HydrophobicContact CB-CG 4.47Å; I1402-L1404 HydrophobicContact CG2-CD1 4.5Å; I1402-L1404 HydrophobicContact CG2-CD2 3.53Å; I1402-L1404 VanDerWaalsContact CG2-CD2 3.47Å; I1402-L1404 HydrophobicContact CG2-CG 3.82Å; I1402-Y1460 HydrophobicContact CD1-CE1 3.8Å; I1402-Y1460 WeakPolarHBondContact CD1-OH 3.27Å
1403	Q	83.9	Confident	73.8	Confident	126.2 Å²	126.2	40.5 Å²	40.5	59%	0.59	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	116.3	169.3	-134.9	177.1	-2.3	0	0	108.6	F1317 N1318 H1319 H1320	F1317-Q1403 HydrophobicContact CB-CB 3.87Å; F1317-Q1403 HydrophobicContact CG-CB 4.47Å; N1318-Q1403 HydrophobicContact CB-CG 3.43Å; N1318-Q1403 VanDerWaalsContact CB-CG 3.43Å; N1318-Q1403 PolarHBondContact ND2-NE2 3.4Å; N1318-Q1403 VanDerWaalsContact ND2-NE2 3.13Å; H1319-Q1403 CarbonylContact O-C 3.08Å; H1319-Q1403 WeakPolarHBondContact O-CA 3.4Å; H1320-Q1403 HydrophobicContact CB-CG 4.43Å
1404	L	84.8	Confident	73.2	Confident	1.4 Å²	1.4	43.6 Å²	43.6	1%	0.007	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	144.2	-174.8	-63.7	175.6	0	0	0	111	F1317 N1318 H1319 I1321 I1379 I1402 W1408 L1434 L1458	F1317-L1404 CarbonylContact C-O 3.55Å; F1317-L1404 WeakPolarHBondContact CA-O 3.29Å; N1318-L1404 CarbonylContact C-O 3.51Å; N1318-L1404 WeakPolarHBondContact CA-O 3.36Å; N1318-L1404 WeakPolarHBondContact CB-O 3.34Å; N1318-L1404 PolarHBondContact N-O 3.12Å; H1319-L1404 HydrophobicContact CB-CB 4.49Å; H1319-L1404 PolarHBondContact N-O 3.31Å; H1319-L1404 PolarHBondContact O-N 3.03Å; I1321-L1404 HydrophobicContact CD1-CD1 3.7Å; I1321-L1404 HydrophobicContact CG1-CD1 4.33Å; I1379-L1404 HydrophobicContact CD1-CD2 4.01Å; I1379-L1404 HydrophobicContact CG2-CD2 3.85Å; I1402-L1404 HydrophobicContact CB-CG 4.47Å; I1402-L1404 HydrophobicContact CG2-CD1 4.5Å; I1402-L1404 HydrophobicContact CG2-CD2 3.53Å; I1402-L1404 VanDerWaalsContact CG2-CD2 3.47Å; I1402-L1404 HydrophobicContact CG2-CG 3.82Å; L1404-W1408 HydrophobicContact CD2-CH2 4.32Å; L1404-W1408 HydrophobicContact CD2-CZ2 4.06Å; L1404-L1434 HydrophobicContact CB-CD1 4.26Å; L1404-L1434 HydrophobicContact CB-CD2 3.94Å; L1404-L1434 HydrophobicContact CD1-CD1 3.66Å; L1404-L1434 HydrophobicContact CD1-CD2 4.28Å; L1404-L1458 HydrophobicContact CD1-CD2 3.92Å
1405	P	81.9	Confident	72.2	Confident	9 Å²	9	47.5 Å²	47.5	6%	0.058	23%	0.226	C	C	.	.			trans	-70	167.6	173.4	32.8	-36.5	0	0	0	111.2	P1312 H1319 S1407 W1408	P1312-P1405 HydrophobicContact CB-CB 3.96Å; P1312-P1405 HydrophobicContact CB-CG 3.89Å; H1319-P1405 PolarHBondContact ND1-O 3.34Å; P1405-S1407 VanDerWaalsContact C-N 3.32Å; P1405-S1407 WeakPolarHBondContact CB-O 3.38Å; P1405-S1407 WeakPolarHBondContact CG-O 3.49Å; P1405-S1407 PolarHBondContact O-N 2.94Å; P1405-W1408 HydrophobicContact CG-CD2 4.11Å; P1405-W1408 HydrophobicContact CG-CG 4.4Å; P1405-W1408 HydrophobicContact CG-CZ2 3.91Å
1406	T	79.2	Confident	71.2	Confident	16.4 Å²	16.4	48.4 Å²	48.4	10%	0.101	23%	0.234	C	C	.	.	S	Bend	trans	-65.8	-33	171.4	46.7	0	0	0	0	112.6	S1313 Q1314 T1315 F1317 N1318 H1319 T1433 L1434	S1313-T1406 PolarHBondContact OG-OG1 3.02Å; S1313-T1406 VanDerWaalsContact OG-OG1 3.06Å; Q1314-T1406 VanDerWaalsContact OE1-CG2 3.31Å; Q1314-T1406 PolarHBondContact OE1-OG1 3.06Å; T1315-T1406 HydrophobicContact CG2-CG2 4.29Å; T1315-T1406 VanDerWaalsContact CG2-OG1 3.24Å; T1315-T1406 WeakPolarHBondContact CG2-OG1 3.29Å; T1315-T1406 WeakPolarHBondContact OG1-CG2 3.41Å; T1315-T1406 PolarHBondContact OG1-OG1 3.05Å; F1317-T1406 HydrophobicContact CB-CG2 4.32Å; F1317-T1406 VanDerWaalsContact O-CG2 3.29Å; F1317-T1406 WeakPolarHBondContact O-CG2 3.33Å; N1318-T1406 HydrophobicContact CB-CG2 4.5Å; H1319-T1406 VanDerWaalsContact CE1-CG2 3.47Å; H1319-T1406 WeakPolarHBondContact CE1-CG2 3.45Å; T1406-T1433 CarbonylContact O-C 3.57Å; T1406-T1433 WeakPolarHBondContact O-CA 3.33Å; T1406-L1434 PolarHBondContact O-N 2.93Å
1407	S	79.7	Confident	69.8	Low	6.4 Å²	6.4	55.8 Å²	55.8	5%	0.045	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	162.9	-179.4	51.4	0	0	0	0	112.5	S1313 P1405 E1431 I1432	S1313-S1407 WeakPolarHBondContact CB-O 3.27Å; S1313-S1407 WeakPolarHBondContact CB-OG 3.4Å; S1313-S1407 PolarHBondContact N-O 2.94Å; S1313-S1407 PolarHBondContact OG-N 2.96Å; S1313-S1407 VanDerWaalsContact OG-N 3.13Å; S1313-S1407 PolarHBondContact OG-O 3.11Å; S1313-S1407 VanDerWaalsContact OG-O 3.09Å; S1313-S1407 PolarHBondContact OG-OG 3.19Å; P1405-S1407 VanDerWaalsContact C-N 3.32Å; P1405-S1407 WeakPolarHBondContact CB-O 3.38Å; P1405-S1407 WeakPolarHBondContact CG-O 3.49Å; P1405-S1407 PolarHBondContact O-N 2.94Å; S1407-E1431 VanDerWaalsContact CB-OE1 3.25Å; S1407-E1431 WeakPolarHBondContact CB-OE1 3.38Å; S1407-E1431 PolarHBondContact OG-OE1 3.12Å; S1407-I1432 CarbonylContact C-O 3.52Å; S1407-I1432 WeakPolarHBondContact CA-O 3.35Å; S1407-I1432 VanDerWaalsContact CB-O 3.24Å; S1407-I1432 WeakPolarHBondContact CB-O 3.29Å
1408	W	80.8	Confident	68.3	Low	11.2 Å²	11.2	57.4 Å²	57.4	4%	0.042	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	132	171.6	-64.8	-86.8	0	0	0	110.3	I1310 L1311 L1357 I1379 L1404 P1405 E1431 I1432 L1434 A1437 L1458	I1310-W1408 HydrophobicContact CG2-CB 4.26Å; I1310-W1408 HydrophobicContact CG2-CG 4.27Å; L1311-W1408 CarbonylContact O-C 3.42Å; L1311-W1408 VanDerWaalsContact O-CA 3.32Å; L1311-W1408 WeakPolarHBondContact O-CA 3.41Å; L1357-W1408 HydrophobicContact CD1-CE3 4.42Å; L1357-W1408 HydrophobicContact CD1-CZ3 4.37Å; L1357-W1408 HydrophobicContact CD2-CD2 3.94Å; L1357-W1408 HydrophobicContact CD2-CE3 4.25Å; L1357-W1408 HydrophobicContact CD2-CG 4.12Å; I1379-W1408 HydrophobicContact CD1-CH2 4.24Å; I1379-W1408 HydrophobicContact CD1-CZ2 3.79Å; L1404-W1408 HydrophobicContact CD2-CH2 4.32Å; L1404-W1408 HydrophobicContact CD2-CZ2 4.06Å; P1405-W1408 HydrophobicContact CG-CD2 4.11Å; P1405-W1408 HydrophobicContact CG-CG 4.4Å; P1405-W1408 HydrophobicContact CG-CZ2 3.91Å; W1408-E1431 CarbonylContact O-C 3.52Å; W1408-E1431 WeakPolarHBondContact O-CA 3.31Å; W1408-I1432 HydrophobicContact CB-CG2 4.19Å; W1408-I1432 HydrophobicContact CE3-CG2 4.36Å; W1408-I1432 PolarHBondContact N-O 3.13Å; W1408-I1432 PolarHBondContact O-N 2.92Å; W1408-L1434 HydrophobicContact CH2-CD1 3.73Å; W1408-L1434 HydrophobicContact CZ3-CB 4.41Å; W1408-L1434 HydrophobicContact CZ3-CD1 3.92Å; W1408-A1437 HydrophobicContact CZ3-CB 4.25Å; W1408-L1458 HydrophobicContact CH2-CD1 4.2Å; W1408-L1458 HydrophobicContact CZ2-CD1 4.44Å; W1408-L1458 HydrophobicContact CZ3-CD1 4.27Å
1409	L	76.8	Confident	66.2	Low	60.8 Å²	60.8	62.6 Å²	62.6	32%	0.318	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	120.3	166.6	-175	99.1	0	0	0	108.7	I1310 L1311 A1411 N1429 E1431	I1310-L1409 WeakPolarHBondContact CA-O 3.29Å; L1311-L1409 HydrophobicContact CB-CB 4.33Å; L1311-L1409 HydrophobicContact CB-CD2 4.49Å; L1311-L1409 HydrophobicContact CD1-CD2 4.12Å; L1311-L1409 PolarHBondContact N-O 2.94Å; L1311-L1409 PolarHBondContact O-N 3.01Å; L1409-A1411 HydrophobicContact CD2-CB 4.43Å; L1409-N1429 HydrophobicContact CD1-CB 4.33Å; L1409-N1429 HydrophobicContact CD2-CB 4.38Å; L1409-E1431 HydrophobicContact CD1-CB 4.43Å
1410	I	74.1	Confident	63.7	Low	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.2	179.6	-60.6	173.6	0	0	0	108.2	I1308 L1309 I1359 Y1412 N1429 Y1430 I1432 P1456	I1308-I1410 HydrophobicContact CG2-CG2 3.87Å; L1309-I1410 WeakPolarHBondContact O-CA 3.41Å; I1359-I1410 HydrophobicContact CB-CD1 4.25Å; I1359-I1410 HydrophobicContact CD1-CD1 3.74Å; I1359-I1410 HydrophobicContact CD1-CG1 4.18Å; I1359-I1410 HydrophobicContact CD1-CG2 4.48Å; I1359-I1410 HydrophobicContact CG1-CD1 3.86Å; I1359-I1410 HydrophobicContact CG2-CD1 4.07Å; I1359-I1410 HydrophobicContact CG2-CG2 4.13Å; I1410-Y1412 HydrophobicContact CG2-CE2 4.05Å; I1410-N1429 VanDerWaalsContact O-CA 3.27Å; I1410-N1429 WeakPolarHBondContact O-CA 3.36Å; I1410-Y1430 HydrophobicContact CB-CD1 4.13Å; I1410-Y1430 HydrophobicContact CB-CD2 4.4Å; I1410-Y1430 HydrophobicContact CB-CE1 3.65Å; I1410-Y1430 HydrophobicContact CB-CE2 4.16Å; I1410-Y1430 HydrophobicContact CD1-CE1 4.37Å; I1410-Y1430 HydrophobicContact CD1-CE2 3.84Å; I1410-Y1430 HydrophobicContact CG1-CE2 4.42Å; I1410-Y1430 HydrophobicContact CG2-CD1 4.38Å; I1410-Y1430 HydrophobicContact CG2-CE1 3.79Å; I1410-Y1430 HydrophobicContact CG2-CE2 4.3Å; I1410-Y1430 PolarHBondContact N-O 3.13Å; I1410-Y1430 WeakPolarHBondContact O-CD1 3.02Å; I1410-Y1430 PolarHBondContact O-N 2.99Å; I1410-I1432 HydrophobicContact CD1-CD1 3.14Å; I1410-I1432 HydrophobicContact CD1-CG2 3.79Å; I1410-I1432 HydrophobicContact CG1-CD1 3.66Å; I1410-P1456 HydrophobicContact CD1-CB 4.41Å; I1410-P1456 HydrophobicContact CD1-CG 4.13Å
1411	A	68.2	Low	61.3	Low	13.6 Å²	13.6	72.5 Å²	72.5	11%	0.112	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	128.9	-179.9	0	0	0	0	0	111	L1309 L1409 N1429	L1309-A1411 HydrophobicContact CB-CB 4.27Å; L1309-A1411 HydrophobicContact CD2-CB 4.33Å; L1309-A1411 PolarHBondContact N-O 3.17Å; L1309-A1411 PolarHBondContact O-N 2.97Å; L1409-A1411 HydrophobicContact CD2-CB 4.43Å; A1411-N1429 HydrophobicContact CB-CB 4.42Å; A1411-N1429 VanDerWaalsContact CB-OD1 3.26Å; A1411-N1429 WeakPolarHBondContact CB-OD1 3.3Å
1412	Y	64.5	Low	58.8	Low	29.4 Å²	29.4	77.3 Å²	77.3	12%	0.115	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	119.9	174.4	-57	-88.4	0	0	0	110	I1308 I1359 P1360 D1362 I1410 Q1414 N1428 Y1430	I1308-Y1412 HydrophobicContact CD1-CD1 4.2Å; I1308-Y1412 HydrophobicContact CD1-CE1 3.8Å; I1308-Y1412 HydrophobicContact CG1-CD1 3.84Å; I1308-Y1412 HydrophobicContact CG1-CE1 3.94Å; I1359-Y1412 VanDerWaalsContact CG2-OH 3.24Å; I1359-Y1412 WeakPolarHBondContact CG2-OH 3.29Å; P1360-Y1412 PolarHBondContact O-OH 3.07Å; D1362-Y1412 HydrophobicContact CB-CD1 4.28Å; D1362-Y1412 HydrophobicContact CB-CD2 4.21Å; D1362-Y1412 HydrophobicContact CB-CE1 4.35Å; D1362-Y1412 HydrophobicContact CB-CE2 4.24Å; D1362-Y1412 HydrophobicContact CB-CG 4.21Å; I1410-Y1412 HydrophobicContact CG2-CE2 4.05Å; Y1412-Q1414 PolarHBondContact O-N 3.04Å; Y1412-N1428 WeakPolarHBondContact CD2-O 3.3Å; Y1412-N1428 PolarHBondContact N-O 3.04Å; Y1412-Y1430 HydrophobicContact CD2-CE1 4.33Å; Y1412-Y1430 HydrophobicContact CE2-CD1 4.23Å; Y1412-Y1430 AromaticContact CE2-CE1 3.54Å; Y1412-Y1430 HydrophobicContact CE2-CE1 3.54Å; Y1412-Y1430 VanDerWaalsContact CE2-CE1 3.5Å; Y1412-Y1430 AromaticContact CZ-CE1 3.81Å; Y1412-Y1430 VanDerWaalsContact OH-CE1 3.29Å; Y1412-Y1430 WeakPolarHBondContact OH-CE1 3.36Å; Y1412-Y1430 PolarHBondContact OH-OH 3.09Å; Y1412-Y1430 VanDerWaalsContact OH-OH 3.09Å
1413	Q	55.3	Low	56.4	Low	94.8 Å²	94.8	84 Å²	84	44%	0.443	43%	0.429	S	S	.	.			trans	-72.9	127.6	176.7	-134.7	177.8	-7.5	0	0	110.9	S1307	S1307-Q1413 WeakPolarHBondContact O-CB 3.39Å; S1307-Q1413 PolarHBondContact O-N 2.81Å; S1307-Q1413 WeakPolarHBondContact OG-CB 3.34Å; S1307-Q1413 PolarHBondContact OG-OE1 3.2Å; S1307-Q1413 VanDerWaalsContact OG-OE1 3.13Å
1414	Q	48.2	Very low	53.9	Low	84.4 Å²	84.4	84.4 Å²	84.4	39%	0.394	44%	0.435	S	S	.	.			trans	-99.7	116.1	178.8	-137.2	179	-3.7	0	0	111.1	Y1365 Y1412 N1416 N1428	Y1365-Q1414 WeakPolarHBondContact OH-CG 3.42Å; Y1365-Q1414 PolarHBondContact OH-NE2 2.95Å; Y1412-Q1414 PolarHBondContact O-N 3.04Å; Q1414-N1416 VanDerWaalsContact C-N 3.28Å; Q1414-N1416 VanDerWaalsContact NE2-CG 3.3Å; Q1414-N1416 PolarHBondContact NE2-ND2 3.32Å; Q1414-N1416 VanDerWaalsContact NE2-ND2 3.15Å; Q1414-N1416 PolarHBondContact NE2-OD1 2.8Å; Q1414-N1416 PolarHBondContact O-N 3.09Å; Q1414-N1428 WeakPolarHBondContact CG-ND2 3.25Å; Q1414-N1428 PolarHBondContact NE2-ND2 3.31Å; Q1414-N1428 PolarHBondContact OE1-ND2 2.96Å
1415	Y	39.4	Very low	51.5	Low	167.8 Å²	167.8	91.6 Å²	91.6	66%	0.658	47%	0.469	S	S	*	.			trans	-87.3	86.6	166.5	-100.7	-84.4	0	0	0	110.4	I1304 N1417	I1304-Y1415 HydrophobicContact CG2-CE2 4.44Å; Y1415-N1417 PolarHBondContact O-N 2.77Å
1416	N	37.7	Very low	49.6	Very low	109.4 Å²	109.4	98.1 Å²	98.1	59%	0.585	50%	0.503	S	S	*	.			trans	-92.5	103.7	165.9	-84.6	-6.1	0	0	0	109.8	Q1414 Q1418	Q1414-N1416 VanDerWaalsContact C-N 3.28Å; Q1414-N1416 VanDerWaalsContact NE2-CG 3.3Å; Q1414-N1416 PolarHBondContact NE2-ND2 3.32Å; Q1414-N1416 VanDerWaalsContact NE2-ND2 3.15Å; Q1414-N1416 PolarHBondContact NE2-OD1 2.8Å; Q1414-N1416 PolarHBondContact O-N 3.09Å; N1416-Q1418 PolarHBondContact O-N 2.99Å; N1416-Q1418 VanDerWaalsContact O-N 3.12Å
1417	N	36.2	Very low	48	Very low	157 Å²	157	108 Å²	108	84%	0.84	54%	0.539	S	S	*	.			trans	-73.1	37.5	168.7	-87.6	-11.7	0	0	0	112.8	Y1415	Y1415-N1417 PolarHBondContact O-N 2.77Å
1418	Q	33.6	Very low	46.8	Very low	170.2 Å²	170.2	108.7 Å²	108.7	80%	0.795	54%	0.542	S	S	*	.			trans	-137.6	102.1	171.3	-88	-179	-0.4	0	0	109.9	N1416 N1420	N1416-Q1418 PolarHBondContact O-N 2.99Å; N1416-Q1418 VanDerWaalsContact O-N 3.12Å; Q1418-N1420 VanDerWaalsContact C-N 3.28Å; Q1418-N1420 PolarHBondContact O-N 2.98Å
1419	S	31.8	Very low	45.8	Very low	114 Å²	114	112.3 Å²	112.3	80%	0.797	56%	0.562	S	S	*	*			trans	-67.8	85.3	169.2	52.1	0	0	0	0	110.1
1420	N	29.8	Very low	45.5	Very low	143.8 Å²	143.8	112.7 Å²	112.7	77%	0.769	56%	0.56	S	S	*	*			trans	-177.5	84.9	156.1	-86	-27.5	0	0	0	109.7	Q1418	Q1418-N1420 VanDerWaalsContact C-N 3.28Å; Q1418-N1420 PolarHBondContact O-N 2.98Å
1421	L	31.9	Very low	45.5	Very low	153.4 Å²	153.4	115.6 Å²	115.6	80%	0.803	57%	0.574	S	S	*	*			trans	-159.4	99.1	155.7	-95.2	155.6	0	0	0	108.9	N1423	L1421-N1423 VanDerWaalsContact C-N 3.29Å; L1421-N1423 PolarHBondContact O-N 3.19Å
1422	I	33.1	Very low	46	Very low	148.8 Å²	148.8	115 Å²	115	76%	0.763	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	58.8	164.9	-68.4	164.1	0	0	0	108.6
1423	N	32.8	Very low	46.9	Very low	145 Å²	145	114 Å²	114	78%	0.775	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-160.4	8	171.7	-87.1	-3.4	0	0	0	117.1	L1421 Q1425	L1421-N1423 VanDerWaalsContact C-N 3.29Å; L1421-N1423 PolarHBondContact O-N 3.19Å; N1423-Q1425 VanDerWaalsContact C-N 3.3Å; N1423-Q1425 PolarHBondContact O-N 2.78Å
1424	N	31.8	Very low	48.3	Very low	134.8 Å²	134.8	109.6 Å²	109.6	72%	0.721	55%	0.545	S	S	*	.			trans	-104.5	42.6	179.8	-88.2	-17.4	0	0	0	114.2	N1426	N1424-N1426 VanDerWaalsContact C-N 3.27Å; N1424-N1426 PolarHBondContact O-N 3.11Å
1425	Q	35.3	Very low	50.1	Low	153 Å²	153	105.7 Å²	105.7	72%	0.715	53%	0.527	S	S	*	.			trans	-69.4	79.4	178.2	-68.3	-145.8	-11.4	0	0	113.1	N1423 R1427	N1423-Q1425 VanDerWaalsContact C-N 3.3Å; N1423-Q1425 PolarHBondContact O-N 2.78Å; Q1425-R1427 VanDerWaalsContact C-N 3.31Å; Q1425-R1427 PolarHBondContact O-N 3.14Å
1426	N	41.2	Very low	52.2	Low	145.4 Å²	145.4	98.1 Å²	98.1	78%	0.778	50%	0.497	S	S	*	.	S	Bend	trans	69.9	20.2	168.2	-65.3	-3.8	0	0	0	118.3	N1424 N1428	N1424-N1426 VanDerWaalsContact C-N 3.27Å; N1424-N1426 PolarHBondContact O-N 3.11Å; N1426-N1428 VanDerWaalsContact C-N 3.31Å; N1426-N1428 PolarHBondContact O-N 3.1Å
1427	R	45.8	Very low	54.4	Low	224.6 Å²	224.6	92.9 Å²	92.9	85%	0.848	47%	0.47	S	S	*	.	S	Bend	trans	-95.7	1.6	-174.9	-81.3	-165.5	179.6	-170.2	1.2	117.4	R1364 Q1425	R1364-R1427 PolarHBondContact NH2-O 2.96Å; Q1425-R1427 VanDerWaalsContact C-N 3.31Å; Q1425-R1427 PolarHBondContact O-N 3.14Å
1428	N	53.9	Low	56.8	Low	21.6 Å²	21.6	85.5 Å²	85.5	12%	0.116	43%	0.43	C	S	.	.	S	Bend	trans	-112.2	4.6	-171.9	-64.5	-1.7	0	0	0	114.8	R1364 Y1412 Q1414 N1426	R1364-N1428 VanDerWaalsContact CZ-OD1 3.29Å; R1364-N1428 PolarHBondContact NH1-OD1 3.1Å; R1364-N1428 PolarHBondContact NH2-OD1 2.91Å; Y1412-N1428 WeakPolarHBondContact CD2-O 3.3Å; Y1412-N1428 PolarHBondContact N-O 3.04Å; Q1414-N1428 WeakPolarHBondContact CG-ND2 3.25Å; Q1414-N1428 PolarHBondContact NE2-ND2 3.31Å; Q1414-N1428 PolarHBondContact OE1-ND2 2.96Å; N1426-N1428 VanDerWaalsContact C-N 3.31Å; N1426-N1428 PolarHBondContact O-N 3.1Å
1429	N	60.9	Low	59.3	Low	87.2 Å²	87.2	77.4 Å²	77.4	47%	0.466	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132.4	178.8	-60.2	4.3	0	0	0	109.2	L1409 I1410 A1411 H1575	L1409-N1429 HydrophobicContact CD1-CB 4.33Å; L1409-N1429 HydrophobicContact CD2-CB 4.38Å; I1410-N1429 VanDerWaalsContact O-CA 3.27Å; I1410-N1429 WeakPolarHBondContact O-CA 3.36Å; A1411-N1429 HydrophobicContact CB-CB 4.42Å; A1411-N1429 VanDerWaalsContact CB-OD1 3.26Å; A1411-N1429 WeakPolarHBondContact CB-OD1 3.3Å; N1429-H1575 PolarHBondContact O-CE1 2.98Å
1430	Y	69.4	Low	61.6	Low	68.4 Å²	68.4	72 Å²	72	27%	0.268	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	149.7	171.6	67.7	-84.2	0	0	0	110.5	I1410 Y1412 I1432 P1456	I1410-Y1430 HydrophobicContact CB-CD1 4.13Å; I1410-Y1430 HydrophobicContact CB-CD2 4.4Å; I1410-Y1430 HydrophobicContact CB-CE1 3.65Å; I1410-Y1430 HydrophobicContact CB-CE2 4.16Å; I1410-Y1430 HydrophobicContact CD1-CE1 4.37Å; I1410-Y1430 HydrophobicContact CD1-CE2 3.84Å; I1410-Y1430 HydrophobicContact CG1-CE2 4.42Å; I1410-Y1430 HydrophobicContact CG2-CD1 4.38Å; I1410-Y1430 HydrophobicContact CG2-CE1 3.79Å; I1410-Y1430 HydrophobicContact CG2-CE2 4.3Å; I1410-Y1430 PolarHBondContact N-O 3.13Å; I1410-Y1430 WeakPolarHBondContact O-CD1 3.02Å; I1410-Y1430 PolarHBondContact O-N 2.99Å; Y1412-Y1430 HydrophobicContact CD2-CE1 4.33Å; Y1412-Y1430 HydrophobicContact CE2-CD1 4.23Å; Y1412-Y1430 AromaticContact CE2-CE1 3.54Å; Y1412-Y1430 HydrophobicContact CE2-CE1 3.54Å; Y1412-Y1430 VanDerWaalsContact CE2-CE1 3.5Å; Y1412-Y1430 AromaticContact CZ-CE1 3.81Å; Y1412-Y1430 VanDerWaalsContact OH-CE1 3.29Å; Y1412-Y1430 WeakPolarHBondContact OH-CE1 3.36Å; Y1412-Y1430 PolarHBondContact OH-OH 3.09Å; Y1412-Y1430 VanDerWaalsContact OH-OH 3.09Å; Y1430-I1432 HydrophobicContact CD2-CD1 4.14Å; Y1430-I1432 HydrophobicContact CD2-CG1 3.73Å; Y1430-I1432 HydrophobicContact CE2-CD1 3.51Å; Y1430-I1432 HydrophobicContact CE2-CG1 3.53Å; Y1430-P1456 HydrophobicContact CE2-CG 3.69Å; Y1430-P1456 VanDerWaalsContact CE2-CG 3.45Å; Y1430-P1456 WeakPolarHBondContact OH-CG 3.21Å
1431	E	73.6	Confident	63.8	Low	60.8 Å²	60.8	65.3 Å²	65.3	28%	0.284	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.8	178	-174.3	175.3	-166.1	0	0	108.8	S1313 S1407 W1408 L1409 N1557	S1313-E1431 WeakPolarHBondContact CB-OE1 3.41Å; S1407-E1431 VanDerWaalsContact CB-OE1 3.25Å; S1407-E1431 WeakPolarHBondContact CB-OE1 3.38Å; S1407-E1431 PolarHBondContact OG-OE1 3.12Å; W1408-E1431 CarbonylContact O-C 3.52Å; W1408-E1431 WeakPolarHBondContact O-CA 3.31Å; L1409-E1431 HydrophobicContact CD1-CB 4.43Å; E1431-N1557 PolarHBondContact OE1-ND2 3.1Å
1432	I	79.2	Confident	66	Low	1 Å²	1	58 Å²	58	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130.7	171.5	-161.2	167.2	0	0	0	109.4	S1407 W1408 I1410 Y1430 E1436 A1437 P1456	S1407-I1432 CarbonylContact C-O 3.52Å; S1407-I1432 WeakPolarHBondContact CA-O 3.35Å; S1407-I1432 VanDerWaalsContact CB-O 3.24Å; S1407-I1432 WeakPolarHBondContact CB-O 3.29Å; W1408-I1432 HydrophobicContact CB-CG2 4.19Å; W1408-I1432 HydrophobicContact CE3-CG2 4.36Å; W1408-I1432 PolarHBondContact N-O 3.13Å; W1408-I1432 PolarHBondContact O-N 2.92Å; I1410-I1432 HydrophobicContact CD1-CD1 3.14Å; I1410-I1432 HydrophobicContact CD1-CG2 3.79Å; I1410-I1432 HydrophobicContact CG1-CD1 3.66Å; Y1430-I1432 HydrophobicContact CD2-CD1 4.14Å; Y1430-I1432 HydrophobicContact CD2-CG1 3.73Å; Y1430-I1432 HydrophobicContact CE2-CD1 3.51Å; Y1430-I1432 HydrophobicContact CE2-CG1 3.53Å; I1432-E1436 HydrophobicContact CD1-CB 4.42Å; I1432-E1436 HydrophobicContact CD1-CG 4.14Å; I1432-E1436 HydrophobicContact CG1-CB 4.04Å; I1432-E1436 HydrophobicContact CG1-CG 4.1Å; I1432-E1436 HydrophobicContact CG2-CG 4.47Å; I1432-A1437 HydrophobicContact CD1-CB 3.81Å; I1432-A1437 HydrophobicContact CG1-CB 4.28Å; I1432-A1437 HydrophobicContact CG2-CB 4.18Å; I1432-P1456 HydrophobicContact CB-CG 4.31Å; I1432-P1456 HydrophobicContact CD1-CB 3.56Å; I1432-P1456 HydrophobicContact CD1-CG 3.57Å; I1432-P1456 VanDerWaalsContact CD1-O 3.26Å; I1432-P1456 WeakPolarHBondContact CD1-O 3.31Å; I1432-P1456 HydrophobicContact CG1-CB 4.22Å; I1432-P1456 HydrophobicContact CG1-CG 3.9Å; I1432-P1456 HydrophobicContact CG2-CB 4.37Å; I1432-P1456 HydrophobicContact CG2-CG 4.04Å
1433	T	83	Confident	67.8	Low	9.2 Å²	9.2	51.7 Å²	51.7	6%	0.056	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	152.2	177.8	69	0	0	0	0	110.9	T1406 L1435 E1436 A1437 V1554 I1579	T1406-T1433 CarbonylContact O-C 3.57Å; T1406-T1433 WeakPolarHBondContact O-CA 3.33Å; T1433-L1435 PolarHBondContact O-N 2.94Å; T1433-E1436 PolarHBondContact O-N 3.08Å; T1433-E1436 VanDerWaalsContact O-N 3.15Å; T1433-E1436 VanDerWaalsContact OG1-CB 3.26Å; T1433-E1436 WeakPolarHBondContact OG1-CB 3.21Å; T1433-E1436 PolarHBondContact OG1-N 2.94Å; T1433-E1436 VanDerWaalsContact OG1-N 3.11Å; T1433-A1437 WeakPolarHBondContact O-CB 3.34Å; T1433-A1437 PolarHBondContact O-N 3.11Å; T1433-V1554 HydrophobicContact CG2-CG1 3.65Å; T1433-V1554 VanDerWaalsContact CG2-CG1 3.46Å; T1433-V1554 HydrophobicContact CG2-CG2 4.45Å; T1433-I1579 HydrophobicContact CG2-CD1 4.1Å; T1433-I1579 WeakPolarHBondContact OG1-CD1 3.39Å
1434	L	85.9	Confident	69.5	Low	1.4 Å²	1.4	45.3 Å²	45.3	1%	0.007	21%	0.213	C	C	.	.	H	α-helix	trans	-57.3	-39.8	176	177.7	61.7	0	0	0	111.5	H1319 L1404 T1406 W1408 A1437 I1438 L1458 I1551	H1319-L1434 HydrophobicContact CB-CD2 3.72Å; H1319-L1434 WeakPolarHBondContact ND1-CD2 3.41Å; L1404-L1434 HydrophobicContact CB-CD1 4.26Å; L1404-L1434 HydrophobicContact CB-CD2 3.94Å; L1404-L1434 HydrophobicContact CD1-CD1 3.66Å; L1404-L1434 HydrophobicContact CD1-CD2 4.28Å; T1406-L1434 PolarHBondContact O-N 2.93Å; W1408-L1434 HydrophobicContact CH2-CD1 3.73Å; W1408-L1434 HydrophobicContact CZ3-CB 4.41Å; W1408-L1434 HydrophobicContact CZ3-CD1 3.92Å; L1434-A1437 PolarHBondContact O-N 2.93Å; L1434-I1438 HydrophobicContact CD1-CD1 3.97Å; L1434-I1438 HydrophobicContact CD1-CG1 4.25Å; L1434-I1438 HydrophobicContact CG-CD1 3.96Å; L1434-I1438 VanDerWaalsContact O-CG1 3.32Å; L1434-I1438 WeakPolarHBondContact O-CG1 3.41Å; L1434-I1438 PolarHBondContact O-N 3.06Å; L1434-L1458 HydrophobicContact CD1-CD2 4Å; L1434-I1551 HydrophobicContact CD2-CD1 3.66Å; L1434-I1551 HydrophobicContact CD2-CG1 4.18Å; L1434-I1551 HydrophobicContact CG-CD1 4.12Å; L1434-I1551 HydrophobicContact CG-CG1 4.43Å
1435	L	85.3	Confident	71	Confident	2.6 Å²	2.6	39.5 Å²	39.5	1%	0.014	18%	0.182	C	C	.	.	H	α-helix	trans	-59.5	-48.7	175.5	-177	67.3	0	0	0	111.6	T1433 A1437 I1438 L1439 I1495 I1551 V1554 I1579 L1583 A1604 F1605	T1433-L1435 PolarHBondContact O-N 2.94Å; L1435-A1437 VanDerWaalsContact C-N 3.31Å; L1435-A1437 PolarHBondContact O-N 2.82Å; L1435-I1438 PolarHBondContact O-N 3.34Å; L1435-L1439 HydrophobicContact CD1-CD1 4.02Å; L1435-L1439 HydrophobicContact CD1-CG 3.98Å; L1435-L1439 HydrophobicContact CG-CD1 4.36Å; L1435-L1439 WeakPolarHBondContact O-CG 3.28Å; L1435-L1439 PolarHBondContact O-N 3.13Å; L1435-L1439 VanDerWaalsContact O-N 3.1Å; L1435-I1495 HydrophobicContact CD1-CD1 3.61Å; L1435-I1495 HydrophobicContact CD1-CG1 4.06Å; L1435-I1495 HydrophobicContact CD1-CG2 3.8Å; L1435-I1551 HydrophobicContact CB-CG2 4.36Å; L1435-I1551 HydrophobicContact CD1-CG2 4.04Å; L1435-V1554 HydrophobicContact CB-CG2 4.39Å; L1435-V1554 HydrophobicContact CD2-CG2 4.11Å; L1435-I1579 HydrophobicContact CD2-CD1 4.21Å; L1435-I1579 HydrophobicContact CG-CD1 4.49Å; L1435-L1583 HydrophobicContact CD2-CD2 4.19Å; L1435-A1604 HydrophobicContact CD2-CB 3.92Å; L1435-F1605 HydrophobicContact CD1-CE2 4.5Å; L1435-F1605 HydrophobicContact CD1-CZ 3.94Å; L1435-F1605 HydrophobicContact CD2-CE2 3.39Å; L1435-F1605 HydrophobicContact CD2-CZ 3.57Å; L1435-F1605 HydrophobicContact CG-CZ 4.4Å
1436	E	84.1	Confident	72	Confident	8.6 Å²	8.6	34.6 Å²	34.6	4%	0.04	16%	0.159	C	C	.	.	H	α-helix	trans	-62.2	-43.8	176.5	-177.2	179.8	174.8	0	0	111.5	I1432 T1433 I1438 L1439 N1440 S1578 I1579 C1582	I1432-E1436 HydrophobicContact CD1-CB 4.42Å; I1432-E1436 HydrophobicContact CD1-CG 4.14Å; I1432-E1436 HydrophobicContact CG1-CB 4.04Å; I1432-E1436 HydrophobicContact CG1-CG 4.1Å; I1432-E1436 HydrophobicContact CG2-CG 4.47Å; T1433-E1436 PolarHBondContact O-N 3.08Å; T1433-E1436 VanDerWaalsContact O-N 3.15Å; T1433-E1436 VanDerWaalsContact OG1-CB 3.26Å; T1433-E1436 WeakPolarHBondContact OG1-CB 3.21Å; T1433-E1436 PolarHBondContact OG1-N 2.94Å; T1433-E1436 VanDerWaalsContact OG1-N 3.11Å; E1436-I1438 VanDerWaalsContact C-N 3.32Å; E1436-I1438 PolarHBondContact O-N 3.04Å; E1436-L1439 PolarHBondContact O-N 3.05Å; E1436-N1440 VanDerWaalsContact CG-ND2 3.29Å; E1436-N1440 WeakPolarHBondContact CG-ND2 3.21Å; E1436-N1440 VanDerWaalsContact O-CB 3.27Å; E1436-N1440 WeakPolarHBondContact O-CB 3.33Å; E1436-N1440 PolarHBondContact O-N 3.18Å; E1436-N1440 PolarHBondContact O-ND2 2.93Å; E1436-N1440 PolarHBondContact OE1-ND2 3.1Å; E1436-S1578 VanDerWaalsContact OE1-CB 3.29Å; E1436-S1578 WeakPolarHBondContact OE1-CB 3.39Å; E1436-S1578 WeakPolarHBondContact OE2-CB 3.38Å; E1436-S1578 PolarHBondContact OE2-OG 2.91Å; E1436-I1579 HydrophobicContact CB-CD1 3.95Å; E1436-I1579 HydrophobicContact CG-CD1 4.31Å; E1436-I1579 PolarHBondContact OE2-N 3.3Å; E1436-C1582 HydrophobicContact CG-CB 4.07Å
1437	A	84.6	Confident	72.5	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.4	-39.7	179.7	0	0	0	0	0	112.5	L1357 W1408 I1432 T1433 L1434 L1435 G1441 C1457 L1458	L1357-A1437 HydrophobicContact CD1-CB 4.42Å; W1408-A1437 HydrophobicContact CZ3-CB 4.25Å; I1432-A1437 HydrophobicContact CD1-CB 3.81Å; I1432-A1437 HydrophobicContact CG1-CB 4.28Å; I1432-A1437 HydrophobicContact CG2-CB 4.18Å; T1433-A1437 WeakPolarHBondContact O-CB 3.34Å; T1433-A1437 PolarHBondContact O-N 3.11Å; L1434-A1437 PolarHBondContact O-N 2.93Å; L1435-A1437 VanDerWaalsContact C-N 3.31Å; L1435-A1437 PolarHBondContact O-N 2.82Å; A1437-G1441 PolarHBondContact O-N 2.93Å; A1437-G1441 VanDerWaalsContact O-N 3.11Å; A1437-C1457 CarbonylContact O-C 3.51Å; A1437-C1457 VanDerWaalsContact O-CA 3.28Å; A1437-C1457 WeakPolarHBondContact O-CA 3.43Å; A1437-L1458 HydrophobicContact CB-CB 4.16Å; A1437-L1458 PolarHBondContact O-N 3Å
1438	I	86.5	Confident	72.6	Confident	1.8 Å²	1.8	19.3 Å²	19.3	1%	0.009	9%	0.093	C	C	.	.	H	α-helix	trans	-68.8	-46	177.5	-69.9	167.6	0	0	0	111.3	I1321 L1434 L1435 E1436 G1441 D1442 L1458 L1491 I1495 I1551	I1321-I1438 HydrophobicContact CD1-CD1 4.38Å; L1434-I1438 HydrophobicContact CD1-CD1 3.97Å; L1434-I1438 HydrophobicContact CD1-CG1 4.25Å; L1434-I1438 HydrophobicContact CG-CD1 3.96Å; L1434-I1438 VanDerWaalsContact O-CG1 3.32Å; L1434-I1438 WeakPolarHBondContact O-CG1 3.41Å; L1434-I1438 PolarHBondContact O-N 3.06Å; L1435-I1438 PolarHBondContact O-N 3.34Å; E1436-I1438 VanDerWaalsContact C-N 3.32Å; E1436-I1438 PolarHBondContact O-N 3.04Å; I1438-G1441 WeakPolarHBondContact O-CA 3.33Å; I1438-G1441 PolarHBondContact O-N 3.08Å; I1438-G1441 VanDerWaalsContact O-N 3.13Å; I1438-D1442 PolarHBondContact O-N 3.33Å; I1438-L1458 HydrophobicContact CG1-CB 4.4Å; I1438-L1458 HydrophobicContact CG1-CD2 4.06Å; I1438-L1491 HydrophobicContact CB-CB 4.3Å; I1438-L1491 HydrophobicContact CG1-CB 4.31Å; I1438-L1491 HydrophobicContact CG1-CD1 4.01Å; I1438-L1491 VanDerWaalsContact CG2-C 3.44Å; I1438-L1491 HydrophobicContact CG2-CB 3.76Å; I1438-L1491 WeakPolarHBondContact CG2-O 3.47Å; I1438-I1495 HydrophobicContact CB-CD1 3.74Å; I1438-I1495 HydrophobicContact CD1-CD1 4.21Å; I1438-I1495 HydrophobicContact CG2-CD1 3.33Å; I1438-I1495 HydrophobicContact CG2-CG1 4.14Å; I1438-I1551 HydrophobicContact CD1-CD1 3.97Å
1439	L	84.6	Confident	72.3	Confident	0.2 Å²	0.2	20.9 Å²	20.9	0%	0.001	10%	0.098	C	C	.	.	H	α-helix	trans	-65.6	-42	179.6	-71.7	176.8	0	0	0	111.9	L1435 E1436 G1441 D1442 Q1443 I1495 F1496 L1583 W1586 I1588	L1435-L1439 HydrophobicContact CD1-CD1 4.02Å; L1435-L1439 HydrophobicContact CD1-CG 3.98Å; L1435-L1439 HydrophobicContact CG-CD1 4.36Å; L1435-L1439 WeakPolarHBondContact O-CG 3.28Å; L1435-L1439 PolarHBondContact O-N 3.13Å; L1435-L1439 VanDerWaalsContact O-N 3.1Å; E1436-L1439 PolarHBondContact O-N 3.05Å; L1439-G1441 VanDerWaalsContact C-N 3.27Å; L1439-G1441 PolarHBondContact O-N 3.04Å; L1439-D1442 PolarHBondContact O-N 3.1Å; L1439-Q1443 PolarHBondContact O-N 2.98Å; L1439-Q1443 VanDerWaalsContact O-N 3.16Å; L1439-I1495 HydrophobicContact CD2-CD1 4.19Å; L1439-I1495 HydrophobicContact CG-CD1 4.16Å; L1439-F1496 HydrophobicContact CD2-CE1 4.25Å; L1439-F1496 HydrophobicContact CD2-CE2 4.35Å; L1439-F1496 HydrophobicContact CD2-CZ 3.76Å; L1439-L1583 HydrophobicContact CD1-CD2 4.2Å; L1439-W1586 HydrophobicContact CD2-CD2 4.25Å; L1439-W1586 HydrophobicContact CD2-CG 4.42Å; L1439-W1586 VanDerWaalsContact O-CZ2 3.25Å; L1439-W1586 WeakPolarHBondContact O-CZ2 3.31Å; L1439-W1586 PolarHBondContact O-NE1 3Å; L1439-I1588 HydrophobicContact CD1-CD1 3.92Å; L1439-I1588 HydrophobicContact CD2-CD1 4.4Å
1440	N	81.4	Confident	71.4	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.5	-32.8	172.2	-69.7	-21.2	0	0	0	111.4	E1436 D1442 Q1443 Y1444 K1455 P1456 C1457 C1582	E1436-N1440 VanDerWaalsContact CG-ND2 3.29Å; E1436-N1440 WeakPolarHBondContact CG-ND2 3.21Å; E1436-N1440 VanDerWaalsContact O-CB 3.27Å; E1436-N1440 WeakPolarHBondContact O-CB 3.33Å; E1436-N1440 PolarHBondContact O-N 3.18Å; E1436-N1440 PolarHBondContact O-ND2 2.93Å; E1436-N1440 PolarHBondContact OE1-ND2 3.1Å; N1440-D1442 VanDerWaalsContact C-N 3.35Å; N1440-D1442 PolarHBondContact O-N 3.09Å; N1440-Q1443 WeakPolarHBondContact O-CB 3.39Å; N1440-Q1443 PolarHBondContact O-N 3.26Å; N1440-Y1444 HydrophobicContact CB-CD2 4.15Å; N1440-Y1444 HydrophobicContact CB-CE2 4.12Å; N1440-Y1444 WeakPolarHBondContact O-CD2 3.39Å; N1440-Y1444 PolarHBondContact O-N 3.07Å; N1440-K1455 VanDerWaalsContact ND2-CB 3.28Å; N1440-K1455 WeakPolarHBondContact ND2-CB 3.36Å; N1440-K1455 WeakPolarHBondContact OD1-CD 3.45Å; N1440-K1455 PolarHBondContact OD1-NZ 2.89Å; N1440-P1456 VanDerWaalsContact CB-O 3.29Å; N1440-P1456 WeakPolarHBondContact CB-O 3.37Å; N1440-P1456 PolarHBondContact ND2-O 3.11Å; N1440-P1456 VanDerWaalsContact ND2-O 3.1Å; N1440-C1457 HydrophobicContact CB-CB 3.81Å; N1440-C1582 PolarHBondContact OD1-SG 3.06Å
1441	G	76.6	Confident	70.2	Confident	2.6 Å²	2.6	24.2 Å²	24.2	3%	0.027	10%	0.103	C	C	.	.	H	α-helix	trans	-59.4	-45.1	178.9	0	0	0	0	0	113.3	A1437 I1438 L1439 Y1444 Q1445 Q1459	A1437-G1441 PolarHBondContact O-N 2.93Å; A1437-G1441 VanDerWaalsContact O-N 3.11Å; I1438-G1441 WeakPolarHBondContact O-CA 3.33Å; I1438-G1441 PolarHBondContact O-N 3.08Å; I1438-G1441 VanDerWaalsContact O-N 3.13Å; L1439-G1441 VanDerWaalsContact C-N 3.27Å; L1439-G1441 PolarHBondContact O-N 3.04Å; G1441-Y1444 PolarHBondContact O-N 3.43Å; G1441-Q1445 WeakPolarHBondContact O-CB 3.43Å; G1441-Q1445 PolarHBondContact O-N 3.32Å; G1441-Q1445 VanDerWaalsContact O-N 3.11Å; G1441-Q1459 PolarHBondContact O-NE2 3.09Å
1442	D	76.9	Confident	68.8	Low	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-66.3	-41.5	175.5	-170.8	-4.6	0	0	0	111.6	I1438 L1439 N1440 Y1444 Q1445 P1490 S1492 W1586 H1786 R1791	I1438-D1442 PolarHBondContact O-N 3.33Å; L1439-D1442 PolarHBondContact O-N 3.1Å; N1440-D1442 VanDerWaalsContact C-N 3.35Å; N1440-D1442 PolarHBondContact O-N 3.09Å; D1442-Y1444 VanDerWaalsContact C-N 3.33Å; D1442-Y1444 PolarHBondContact O-N 3.28Å; D1442-Q1445 PolarHBondContact O-N 2.98Å; D1442-P1490 HydrophobicContact CB-CB 4.23Å; D1442-S1492 WeakPolarHBondContact CB-OG 3.44Å; D1442-S1492 VanDerWaalsContact CG-OG 3.29Å; D1442-S1492 WeakPolarHBondContact OD2-CB 3.21Å; D1442-S1492 PolarHBondContact OD2-OG 3.21Å; D1442-W1586 HydrophobicContact CB-CH2 3.99Å; D1442-W1586 HydrophobicContact CB-CZ2 4.06Å; D1442-W1586 VanDerWaalsContact CG-CH2 3.46Å; D1442-W1586 WeakPolarHBondContact OD2-CH2 3.28Å; D1442-H1786 IonicContact OD1-CE1 2.65Å; D1442-H1786 IonicContact OD2-CE1 3.33Å; D1442-H1786 PolarHBondContact OD2-CE1 2.77Å; D1442-H1786 VanDerWaalsContact OD2-CE1 3.29Å; D1442-H1786 IonicContact OD2-NE2 3.14Å; D1442-R1791 PolarHBondContact O-NE 2.94Å; D1442-R1791 PolarHBondContact O-NH1 3.35Å; D1442-R1791 PolarHBondContact O-NH2 3.24Å; D1442-R1791 VanDerWaalsContact O-NH2 3.16Å; D1442-R1791 IonicContact OD1-CZ 3.3Å; D1442-R1791 VanDerWaalsContact OD1-CZ 3.25Å; D1442-R1791 IonicContact OD1-NE 2.9Å; D1442-R1791 PolarHBondContact OD1-NE 3.35Å; D1442-R1791 IonicContact OD1-NH2 3.22Å; D1442-R1791 PolarHBondContact OD1-NH2 3.14Å; D1442-R1791 IonicContact OD2-NE 3.6Å; D1442-R1791 IonicContact OD2-NH2 2.71Å
1443	Q	71.7	Confident	67.5	Low	17.8 Å²	17.8	24.4 Å²	24.4	8%	0.083	11%	0.109	C	C	.	.	H	α-helix	trans	-60.2	-48.5	176.2	-174.9	179.6	0.3	0	0	112	L1439 N1440 Q1445 M1446 E1447 W1586 P1792	L1439-Q1443 PolarHBondContact O-N 2.98Å; L1439-Q1443 VanDerWaalsContact O-N 3.16Å; N1440-Q1443 WeakPolarHBondContact O-CB 3.39Å; N1440-Q1443 PolarHBondContact O-N 3.26Å; Q1443-Q1445 VanDerWaalsContact C-N 3.27Å; Q1443-Q1445 PolarHBondContact O-N 3.49Å; Q1443-M1446 PolarHBondContact O-N 3.27Å; Q1443-E1447 WeakPolarHBondContact CG-OE1 3.27Å; Q1443-E1447 PolarHBondContact NE2-OE1 3.34Å; Q1443-E1447 PolarHBondContact O-N 2.79Å; Q1443-W1586 HydrophobicContact CB-CZ2 4.34Å; Q1443-P1792 HydrophobicContact CG-CG 4.42Å
1444	Y	67.5	Low	66	Low	10.2 Å²	10.2	28 Å²	28	4%	0.04	13%	0.128	C	C	.	.	H	α-helix	trans	-80.9	-12	-175.8	-69.3	-64.6	0	0	0	114.4	N1440 G1441 D1442 M1446 E1447 Q1448 I1453 I1454 K1455 C1457	N1440-Y1444 HydrophobicContact CB-CD2 4.15Å; N1440-Y1444 HydrophobicContact CB-CE2 4.12Å; N1440-Y1444 WeakPolarHBondContact O-CD2 3.39Å; N1440-Y1444 PolarHBondContact O-N 3.07Å; G1441-Y1444 PolarHBondContact O-N 3.43Å; D1442-Y1444 VanDerWaalsContact C-N 3.33Å; D1442-Y1444 PolarHBondContact O-N 3.28Å; Y1444-M1446 VanDerWaalsContact C-N 3.3Å; Y1444-M1446 PolarHBondContact O-N 3Å; Y1444-M1446 VanDerWaalsContact O-N 3.14Å; Y1444-E1447 HydrophobicContact CD1-CB 4.31Å; Y1444-E1447 CarbonylContact O-C 3.59Å; Y1444-E1447 PolarHBondContact O-N 3.34Å; Y1444-E1447 VanDerWaalsContact O-N 3.08Å; Y1444-Q1448 WeakPolarHBondContact O-CB 3.42Å; Y1444-Q1448 WeakPolarHBondContact O-CG 3.49Å; Y1444-Q1448 PolarHBondContact O-N 3.08Å; Y1444-Q1448 VanDerWaalsContact O-N 3.12Å; Y1444-Q1448 PolarHBondContact O-OE1 2.67Å; Y1444-I1453 HydrophobicContact CD2-CG2 4.23Å; Y1444-I1453 HydrophobicContact CE2-CG2 4.38Å; Y1444-I1453 HydrophobicContact CG-CG1 4.48Å; Y1444-I1453 HydrophobicContact CG-CG2 4.37Å; Y1444-I1454 HydrophobicContact CE1-CB 4.37Å; Y1444-I1454 HydrophobicContact CE1-CG1 4.43Å; Y1444-I1454 PolarHBondContact OH-N 2.82Å; Y1444-K1455 HydrophobicContact CE2-CB 3.91Å; Y1444-K1455 HydrophobicContact CE2-CD 4.32Å; Y1444-K1455 HydrophobicContact CE2-CG 4.2Å; Y1444-K1455 VanDerWaalsContact CE2-O 3.26Å; Y1444-K1455 WeakPolarHBondContact CE2-O 3.08Å; Y1444-K1455 WeakPolarHBondContact OH-CG 3.34Å; Y1444-K1455 PolarHBondContact OH-N 3.04Å; Y1444-C1457 HydrophobicContact CD2-CB 4.2Å
1445	Q	64.4	Low	64.5	Low	13.4 Å²	13.4	30.3 Å²	30.3	6%	0.063	14%	0.138	C	C	.	.	H	α-helix	trans	-58.1	-34.5	178.4	-176	169.4	-4.7	0	0	112.8	G1441 D1442 Q1443 R1488 P1490 P1810 S1811	G1441-Q1445 WeakPolarHBondContact O-CB 3.43Å; G1441-Q1445 PolarHBondContact O-N 3.32Å; G1441-Q1445 VanDerWaalsContact O-N 3.11Å; D1442-Q1445 PolarHBondContact O-N 2.98Å; Q1443-Q1445 VanDerWaalsContact C-N 3.27Å; Q1443-Q1445 PolarHBondContact O-N 3.49Å; Q1445-R1488 HydrophobicContact CG-CB 4.35Å; Q1445-R1488 VanDerWaalsContact NE2-C 3.29Å; Q1445-R1488 PolarHBondContact NE2-O 3.19Å; Q1445-P1490 VanDerWaalsContact OE1-CB 3.25Å; Q1445-P1490 VanDerWaalsContact OE1-CG 3.29Å; Q1445-P1490 VanDerWaalsContact OE1-N 3.09Å; Q1445-P1810 WeakPolarHBondContact CG-O 3.42Å; Q1445-P1810 PolarHBondContact NE2-O 3.12Å; Q1445-S1811 PolarHBondContact NE2-O 2.93Å; Q1445-S1811 VanDerWaalsContact NE2-O 3.12Å
1446	M	54.6	Low	62.8	Low	49 Å²	49	30.5 Å²	30.5	24%	0.241	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-24.6	174.1	-70	-150.2	102.8	0	0	113.9	Q1443 Y1444 R1450 R1791 D1809 G1812 R1814 W1890 N1891	Q1443-M1446 PolarHBondContact O-N 3.27Å; Y1444-M1446 VanDerWaalsContact C-N 3.3Å; Y1444-M1446 PolarHBondContact O-N 3Å; Y1444-M1446 VanDerWaalsContact O-N 3.14Å; M1446-R1450 PolarHBondContact O-NH1 3.19Å; M1446-R1791 PolarHBondContact SD-NH1 3.13Å; M1446-D1809 WeakPolarHBondContact CE-O 3.16Å; M1446-G1812 WeakPolarHBondContact CE-O 3.3Å; M1446-G1812 WeakPolarHBondContact SD-CA 3.49Å; M1446-R1814 PolarHBondContact SD-NH2 3.05Å; M1446-W1890 HydrophobicContact CE-CE3 4.33Å; M1446-N1891 HydrophobicContact CE-CB 3.97Å
1447	E	52.8	Low	61.6	Low	31.8 Å²	31.8	30.1 Å²	30.1	15%	0.149	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-21.9	-172.6	-67.3	-160	167.6	0	0	114.2	Q1443 Y1444 Y1449 R1450 R1451 V1794	Q1443-E1447 WeakPolarHBondContact CG-OE1 3.27Å; Q1443-E1447 PolarHBondContact NE2-OE1 3.34Å; Q1443-E1447 PolarHBondContact O-N 2.79Å; Y1444-E1447 HydrophobicContact CD1-CB 4.31Å; Y1444-E1447 CarbonylContact O-C 3.59Å; Y1444-E1447 PolarHBondContact O-N 3.34Å; Y1444-E1447 VanDerWaalsContact O-N 3.08Å; E1447-Y1449 PolarHBondContact O-N 3.19Å; E1447-Y1449 VanDerWaalsContact O-N 3.1Å; E1447-R1450 CarbonylContact O-C 3.54Å; E1447-R1450 WeakPolarHBondContact O-CA 3.28Å; E1447-R1450 PolarHBondContact O-N 3.03Å; E1447-R1451 PolarHBondContact O-N 3.14Å; E1447-R1451 VanDerWaalsContact O-O 3.14Å; E1447-R1451 IonicContact OE1-CZ 3.79Å; E1447-R1451 IonicContact OE1-NH1 3.24Å; E1447-R1451 PolarHBondContact OE1-NH1 3.23Å; E1447-R1451 WeakPolarHBondContact OE2-CD 3.1Å; E1447-R1451 IonicContact OE2-CZ 3.15Å; E1447-R1451 IonicContact OE2-NE 3.32Å; E1447-R1451 IonicContact OE2-NH1 3.15Å; E1447-R1451 PolarHBondContact OE2-NH1 3.13Å; E1447-V1794 VanDerWaalsContact OE1-CG2 3.25Å; E1447-V1794 WeakPolarHBondContact OE1-CG2 3.46Å
1448	Q	47.7	Very low	60	Low	16.8 Å²	16.8	30.2 Å²	30.2	8%	0.079	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-23.6	-175.9	-159.7	172.6	1.9	0	0	114.3	Y1374 Y1444 R1450 R1451 I1453 R1488	Y1374-Q1448 HydrophobicContact CE1-CG 4.1Å; Y1374-Q1448 VanDerWaalsContact CZ-NE2 3.28Å; Y1374-Q1448 PolarHBondContact OH-NE2 2.93Å; Y1444-Q1448 WeakPolarHBondContact O-CB 3.42Å; Y1444-Q1448 WeakPolarHBondContact O-CG 3.49Å; Y1444-Q1448 PolarHBondContact O-N 3.08Å; Y1444-Q1448 VanDerWaalsContact O-N 3.12Å; Y1444-Q1448 PolarHBondContact O-OE1 2.67Å; Q1448-R1450 VanDerWaalsContact C-N 3.29Å; Q1448-R1451 CarbonylContact C-O 3.5Å; Q1448-I1453 HydrophobicContact CB-CD1 4.29Å; Q1448-I1453 HydrophobicContact CB-CG1 4.26Å; Q1448-I1453 HydrophobicContact CG-CD1 4.11Å; Q1448-I1453 HydrophobicContact CG-CG1 4.23Å; Q1448-R1488 VanDerWaalsContact CD-NH1 3.3Å; Q1448-R1488 VanDerWaalsContact OE1-CZ 3.29Å
1449	Y	48.5	Very low	58.4	Low	55.6 Å²	55.6	30.4 Å²	30.4	22%	0.218	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-7	175.7	-61.1	-65.8	0	0	0	114.3	E1447 E1464 R1488 F1512 W1890 L1892 Y1895	E1447-Y1449 PolarHBondContact O-N 3.19Å; E1447-Y1449 VanDerWaalsContact O-N 3.1Å; Y1449-E1464 PolarHBondContact OH-OE2 3.03Å; Y1449-R1488 VanDerWaalsContact CZ-NH1 3.29Å; Y1449-R1488 VanDerWaalsContact OH-CZ 3.25Å; Y1449-R1488 PolarHBondContact OH-NE 3.13Å; Y1449-R1488 PolarHBondContact OH-NH1 3.15Å; Y1449-R1488 VanDerWaalsContact OH-NH1 3.1Å; Y1449-R1488 PolarHBondContact OH-NH2 3.1Å; Y1449-F1512 HydrophobicContact CD1-CE1 4.43Å; Y1449-F1512 AromaticContact CE1-CE1 3.61Å; Y1449-F1512 HydrophobicContact CE1-CE1 3.61Å; Y1449-F1512 AromaticContact CE1-CZ 3.65Å; Y1449-F1512 HydrophobicContact CE1-CZ 3.65Å; Y1449-W1890 HydrophobicContact CD2-CB 4.32Å; Y1449-W1890 AromaticContact CD2-CD2 3.74Å; Y1449-W1890 HydrophobicContact CD2-CD2 3.74Å; Y1449-W1890 AromaticContact CD2-CE3 3.71Å; Y1449-W1890 HydrophobicContact CD2-CE3 3.71Å; Y1449-W1890 VanDerWaalsContact CD2-CE3 3.47Å; Y1449-W1890 HydrophobicContact CD2-CG 4.11Å; Y1449-W1890 AromaticContact CD2-CZ3 3.97Å; Y1449-W1890 HydrophobicContact CD2-CZ3 4.23Å; Y1449-W1890 HydrophobicContact CE2-CB 3.84Å; Y1449-W1890 AromaticContact CE2-CD2 3.48Å; Y1449-W1890 HydrophobicContact CE2-CD2 3.87Å; Y1449-W1890 VanDerWaalsContact CE2-CD2 3.48Å; Y1449-W1890 AromaticContact CE2-CE2 3.8Å; Y1449-W1890 AromaticContact CE2-CE3 3.18Å; Y1449-W1890 HydrophobicContact CE2-CE3 3.46Å; Y1449-W1890 AromaticContact CE2-CG 3.97Å; Y1449-W1890 HydrophobicContact CE2-CG 4.07Å; Y1449-W1890 AromaticContact CE2-CH2 3.78Å; Y1449-W1890 HydrophobicContact CE2-CH2 4.14Å; Y1449-W1890 AromaticContact CE2-CZ2 3.97Å; Y1449-W1890 HydrophobicContact CE2-CZ2 3.97Å; Y1449-W1890 AromaticContact CE2-CZ3 3.37Å; Y1449-W1890 HydrophobicContact CE2-CZ3 3.37Å; Y1449-W1890 VanDerWaalsContact CE2-CZ3 3.42Å; Y1449-W1890 AromaticContact CZ-CE3 3.67Å; Y1449-W1890 AromaticContact CZ-CZ3 3.58Å; Y1449-W1890 WeakPolarHBondContact OH-CZ3 3.3Å; Y1449-L1892 HydrophobicContact CD1-CD2 3.41Å; Y1449-L1892 VanDerWaalsContact CD1-CD2 3.43Å; Y1449-L1892 HydrophobicContact CE1-CD2 3.76Å; Y1449-L1892 HydrophobicContact CG-CD2 3.95Å; Y1449-L1892 VanDerWaalsContact O-CD2 3.22Å; Y1449-L1892 WeakPolarHBondContact O-CD2 3.41Å; Y1449-Y1895 HydrophobicContact CD1-CE2 4.32Å
1450	R	41.4	Very low	56.8	Low	123 Å²	123	30.5 Å²	30.5	46%	0.464	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-26.4	179.4	-67.9	-175.7	177.2	148.8	5.8	113.4	M1446 E1447 Q1448 N1891	M1446-R1450 PolarHBondContact O-NH1 3.19Å; E1447-R1450 CarbonylContact O-C 3.54Å; E1447-R1450 WeakPolarHBondContact O-CA 3.28Å; E1447-R1450 PolarHBondContact O-N 3.03Å; Q1448-R1450 VanDerWaalsContact C-N 3.29Å; R1450-N1891 WeakPolarHBondContact CG-O 3.19Å; R1450-N1891 VanDerWaalsContact CZ-O 3.27Å; R1450-N1891 VanDerWaalsContact CZ-OD1 3.22Å; R1450-N1891 PolarHBondContact NE-O 3.05Å; R1450-N1891 PolarHBondContact NE-OD1 3.38Å; R1450-N1891 PolarHBondContact NH2-ND2 3.2Å; R1450-N1891 VanDerWaalsContact NH2-ND2 3.12Å; R1450-N1891 PolarHBondContact NH2-O 2.84Å; R1450-N1891 PolarHBondContact NH2-OD1 3.23Å
1451	R	43.5	Very low	55.2	Low	101.8 Å²	101.8	30.8 Å²	30.8	38%	0.384	14%	0.14	S	C	.	.	S	Bend	trans	-148.3	150	-172.1	-65.2	-175.8	-179.4	157.5	-3.3	110.6	E1447 Q1448 I1453 V1794	E1447-R1451 PolarHBondContact O-N 3.14Å; E1447-R1451 VanDerWaalsContact O-O 3.14Å; E1447-R1451 IonicContact OE1-CZ 3.79Å; E1447-R1451 IonicContact OE1-NH1 3.24Å; E1447-R1451 PolarHBondContact OE1-NH1 3.23Å; E1447-R1451 WeakPolarHBondContact OE2-CD 3.1Å; E1447-R1451 IonicContact OE2-CZ 3.15Å; E1447-R1451 IonicContact OE2-NE 3.32Å; E1447-R1451 IonicContact OE2-NH1 3.15Å; E1447-R1451 PolarHBondContact OE2-NH1 3.13Å; Q1448-R1451 CarbonylContact C-O 3.5Å; R1451-I1453 PolarHBondContact O-N 3.5Å; R1451-V1794 VanDerWaalsContact NH1-CG1 3.33Å; R1451-V1794 PolarHBondContact NH2-O 2.88Å
1452	P	45.2	Very low	53.8	Low	59.8 Å²	59.8	31.3 Å²	31.3	39%	0.388	14%	0.143	S	C	.	.			trans	-58.8	147.8	168	14.3	-19.4	0	0	0	111	E1372 L1373 I1454	E1372-P1452 HydrophobicContact CB-CB 4.33Å; L1373-P1452 HydrophobicContact CB-CB 4.08Å; L1373-P1452 HydrophobicContact CD1-CB 4.16Å; L1373-P1452 HydrophobicContact CD1-CG 4.39Å; L1373-P1452 HydrophobicContact CD2-CB 3.84Å; L1373-P1452 HydrophobicContact CD2-CG 4.25Å; L1373-P1452 HydrophobicContact CG-CB 4.11Å; P1452-I1454 VanDerWaalsContact O-CG1 3.28Å; P1452-I1454 WeakPolarHBondContact O-CG1 3.36Å; P1452-I1454 PolarHBondContact O-N 3.03Å
1453	I	50.8	Low	52	Low	5.8 Å²	5.8	33 Å²	33	3%	0.03	15%	0.15	C	C	.	.			trans	-66.2	125.6	170.5	-61.7	177.6	0	0	0	107.8	L1358 P1360 Y1374 Y1444 Q1448 R1451 K1455	L1358-I1453 HydrophobicContact CB-CD1 4.11Å; L1358-I1453 HydrophobicContact CD1-CD1 3.55Å; L1358-I1453 VanDerWaalsContact CD1-CD1 3.41Å; L1358-I1453 HydrophobicContact CG-CD1 4.39Å; P1360-I1453 WeakPolarHBondContact CB-O 3.39Å; Y1374-I1453 HydrophobicContact CD1-CB 4.31Å; Y1374-I1453 HydrophobicContact CD1-CD1 3.84Å; Y1374-I1453 HydrophobicContact CD1-CG1 4.12Å; Y1374-I1453 HydrophobicContact CD2-CD1 4.15Å; Y1374-I1453 HydrophobicContact CE1-CD1 4.02Å; Y1374-I1453 HydrophobicContact CE1-CG1 4.35Å; Y1374-I1453 HydrophobicContact CE2-CD1 4.31Å; Y1374-I1453 HydrophobicContact CG-CB 4.34Å; Y1374-I1453 HydrophobicContact CG-CD1 3.93Å; Y1374-I1453 HydrophobicContact CG-CG1 4.36Å; Y1444-I1453 HydrophobicContact CD2-CG2 4.23Å; Y1444-I1453 HydrophobicContact CE2-CG2 4.38Å; Y1444-I1453 HydrophobicContact CG-CG1 4.48Å; Y1444-I1453 HydrophobicContact CG-CG2 4.37Å; Q1448-I1453 HydrophobicContact CB-CD1 4.29Å; Q1448-I1453 HydrophobicContact CB-CG1 4.26Å; Q1448-I1453 HydrophobicContact CG-CD1 4.11Å; Q1448-I1453 HydrophobicContact CG-CG1 4.23Å; R1451-I1453 PolarHBondContact O-N 3.5Å; I1453-K1455 WeakPolarHBondContact CG2-O 3.28Å
1454	I	51.3	Low	50.5	Low	86.6 Å²	86.6	33.8 Å²	33.8	44%	0.444	15%	0.154	S	C	.	.			trans	-107.8	-26.9	-174.4	-49.9	177.1	0	0	0	112.3	P1360 Y1444 P1452	P1360-I1454 WeakPolarHBondContact CG-O 3.42Å; Y1444-I1454 HydrophobicContact CE1-CB 4.37Å; Y1444-I1454 HydrophobicContact CE1-CG1 4.43Å; Y1444-I1454 PolarHBondContact OH-N 2.82Å; P1452-I1454 VanDerWaalsContact O-CG1 3.28Å; P1452-I1454 WeakPolarHBondContact O-CG1 3.36Å; P1452-I1454 PolarHBondContact O-N 3.03Å
1455	K	55.9	Low	48.9	Very low	49.4 Å²	49.4	37.1 Å²	37.1	22%	0.215	17%	0.169	C	C	.	.	S	Bend	trans	-119.9	147.3	172.9	-52.6	172.3	-178.6	174.2	0	108.8	N1440 Y1444 I1453 D1585	N1440-K1455 VanDerWaalsContact ND2-CB 3.28Å; N1440-K1455 WeakPolarHBondContact ND2-CB 3.36Å; N1440-K1455 WeakPolarHBondContact OD1-CD 3.45Å; N1440-K1455 PolarHBondContact OD1-NZ 2.89Å; Y1444-K1455 HydrophobicContact CE2-CB 3.91Å; Y1444-K1455 HydrophobicContact CE2-CD 4.32Å; Y1444-K1455 HydrophobicContact CE2-CG 4.2Å; Y1444-K1455 VanDerWaalsContact CE2-O 3.26Å; Y1444-K1455 WeakPolarHBondContact CE2-O 3.08Å; Y1444-K1455 WeakPolarHBondContact OH-CG 3.34Å; Y1444-K1455 PolarHBondContact OH-N 3.04Å; I1453-K1455 WeakPolarHBondContact CG2-O 3.28Å; K1455-D1585 IonicContact NZ-OD2 3.28Å; K1455-D1585 PolarHBondContact NZ-OD2 3.05Å
1456	P	49.8	Very low	47.3	Very low	7 Å²	7	41.1 Å²	41.1	5%	0.045	19%	0.188	C	C	.	.			trans	-64.9	147.7	177.5	2.3	4.5	0	0	0	111.7	L1357 L1358 I1359 P1360 I1410 Y1430 I1432 N1440	L1357-P1456 HydrophobicContact CD1-CB 4.49Å; L1358-P1456 CarbonylContact O-C 3.44Å; L1358-P1456 WeakPolarHBondContact O-CA 3.24Å; L1358-P1456 VanDerWaalsContact O-CB 3.27Å; L1358-P1456 WeakPolarHBondContact O-CB 3.38Å; I1359-P1456 HydrophobicContact CG1-CB 4.42Å; P1360-P1456 HydrophobicContact CG-CG 4.4Å; I1410-P1456 HydrophobicContact CD1-CB 4.41Å; I1410-P1456 HydrophobicContact CD1-CG 4.13Å; Y1430-P1456 HydrophobicContact CE2-CG 3.69Å; Y1430-P1456 VanDerWaalsContact CE2-CG 3.45Å; Y1430-P1456 WeakPolarHBondContact OH-CG 3.21Å; I1432-P1456 HydrophobicContact CB-CG 4.31Å; I1432-P1456 HydrophobicContact CD1-CB 3.56Å; I1432-P1456 HydrophobicContact CD1-CG 3.57Å; I1432-P1456 VanDerWaalsContact CD1-O 3.26Å; I1432-P1456 WeakPolarHBondContact CD1-O 3.31Å; I1432-P1456 HydrophobicContact CG1-CB 4.22Å; I1432-P1456 HydrophobicContact CG1-CG 3.9Å; I1432-P1456 HydrophobicContact CG2-CB 4.37Å; I1432-P1456 HydrophobicContact CG2-CG 4.04Å; N1440-P1456 VanDerWaalsContact CB-O 3.29Å; N1440-P1456 WeakPolarHBondContact CB-O 3.37Å; N1440-P1456 PolarHBondContact ND2-O 3.11Å; N1440-P1456 VanDerWaalsContact ND2-O 3.1Å
1457	C	57.3	Low	46.1	Very low	0.2 Å²	0.2	42.9 Å²	42.9	0%	0.001	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	152	-177.3	63.8	0	0	0	0	113.6	L1358 A1437 N1440 Y1444	L1358-C1457 PolarHBondContact N-O 3.22Å; L1358-C1457 PolarHBondContact O-N 3.24Å; A1437-C1457 CarbonylContact O-C 3.51Å; A1437-C1457 VanDerWaalsContact O-CA 3.28Å; A1437-C1457 WeakPolarHBondContact O-CA 3.43Å; N1440-C1457 HydrophobicContact CB-CB 3.81Å; Y1444-C1457 HydrophobicContact CD2-CB 4.2Å
1458	L	51.5	Low	45	Very low	2.2 Å²	2.2	47.9 Å²	47.9	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	121.1	174.6	-162.1	75	0	0	0	108.7	L1356 L1357 I1379 L1404 W1408 L1434 A1437 I1438 L1491	L1356-L1458 CarbonylContact O-C 3.4Å; L1356-L1458 WeakPolarHBondContact O-CA 3.33Å; L1356-L1458 WeakPolarHBondContact O-CD1 3.31Å; L1357-L1458 HydrophobicContact CB-CD1 4.32Å; L1357-L1458 HydrophobicContact CD1-CD1 4.29Å; I1379-L1458 HydrophobicContact CD1-CD1 3.63Å; L1404-L1458 HydrophobicContact CD1-CD2 3.92Å; W1408-L1458 HydrophobicContact CH2-CD1 4.2Å; W1408-L1458 HydrophobicContact CZ2-CD1 4.44Å; W1408-L1458 HydrophobicContact CZ3-CD1 4.27Å; L1434-L1458 HydrophobicContact CD1-CD2 4Å; A1437-L1458 HydrophobicContact CB-CB 4.16Å; A1437-L1458 PolarHBondContact O-N 3Å; I1438-L1458 HydrophobicContact CG1-CB 4.4Å; I1438-L1458 HydrophobicContact CG1-CD2 4.06Å; L1458-L1491 HydrophobicContact CB-CD1 4.06Å; L1458-L1491 HydrophobicContact CD2-CD1 3.69Å; L1458-L1491 HydrophobicContact CG-CD1 4.1Å
1459	Q	52.7	Low	44.2	Very low	4.8 Å²	4.8	55.4 Å²	55.4	2%	0.022	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	146.3	-179.9	-132.2	178.7	32.6	0	0	111.3	L1356 L1358 G1441 T1461 R1488	L1356-Q1459 PolarHBondContact N-O 2.97Å; L1356-Q1459 PolarHBondContact O-N 2.94Å; L1358-Q1459 HydrophobicContact CD1-CB 4.22Å; L1358-Q1459 VanDerWaalsContact CD1-CD 3.41Å; L1358-Q1459 HydrophobicContact CD1-CG 4.12Å; L1358-Q1459 VanDerWaalsContact CD1-OE1 3.29Å; L1358-Q1459 HydrophobicContact CG-CB 4.48Å; G1441-Q1459 PolarHBondContact O-NE2 3.09Å; Q1459-T1461 HydrophobicContact CG-CG2 4.29Å; Q1459-R1488 HydrophobicContact CG-CG 4.31Å; Q1459-R1488 VanDerWaalsContact OE1-CD 3.27Å
1460	Y	51.5	Low	43.6	Very low	3.6 Å²	3.6	58.2 Å²	58.2	1%	0.014	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	135.9	169.6	-154.2	-89.6	0	0	0	109.9	I1323 L1353 H1354 C1355 L1400 I1402 N1462 R1488 V1489 L1491 I1539 L1541 M1543	I1323-Y1460 HydrophobicContact CD1-CD1 3.53Å; I1323-Y1460 HydrophobicContact CD1-CD2 4.09Å; I1323-Y1460 HydrophobicContact CD1-CE1 3.22Å; I1323-Y1460 HydrophobicContact CD1-CE2 3.79Å; I1323-Y1460 HydrophobicContact CD1-CG 3.96Å; I1323-Y1460 HydrophobicContact CG2-CD2 4.42Å; I1323-Y1460 HydrophobicContact CG2-CE2 4.16Å; L1353-Y1460 HydrophobicContact CB-CE2 3.94Å; L1353-Y1460 VanDerWaalsContact CB-OH 3.32Å; L1353-Y1460 WeakPolarHBondContact CB-OH 3.03Å; L1353-Y1460 WeakPolarHBondContact CD1-OH 3.41Å; L1353-Y1460 HydrophobicContact CD2-CE1 4.35Å; L1353-Y1460 HydrophobicContact CD2-CE2 3.77Å; L1353-Y1460 WeakPolarHBondContact CD2-OH 3.37Å; L1353-Y1460 HydrophobicContact CG-CE2 4.33Å; L1353-Y1460 WeakPolarHBondContact CG-OH 3.47Å; H1354-Y1460 VanDerWaalsContact O-CA 3.31Å; H1354-Y1460 WeakPolarHBondContact O-CA 3.23Å; H1354-Y1460 WeakPolarHBondContact O-CD1 3.42Å; H1354-Y1460 VanDerWaalsContact O-CD2 3.29Å; H1354-Y1460 WeakPolarHBondContact O-CD2 3.38Å; C1355-Y1460 HydrophobicContact CB-CD1 4.08Å; C1355-Y1460 HydrophobicContact CB-CE1 3.41Å; C1355-Y1460 VanDerWaalsContact CB-CE1 3.41Å; C1355-Y1460 PolarHBondContact SG-OH 2.62Å; C1355-Y1460 VanDerWaalsContact SG-OH 3.32Å; L1400-Y1460 HydrophobicContact CD2-CD1 4.14Å; L1400-Y1460 HydrophobicContact CD2-CE1 3.74Å; L1400-Y1460 HydrophobicContact CD2-CE2 4.05Å; I1402-Y1460 HydrophobicContact CD1-CE1 3.8Å; I1402-Y1460 WeakPolarHBondContact CD1-OH 3.27Å; Y1460-N1462 WeakPolarHBondContact CE1-OD1 3.45Å; Y1460-N1462 VanDerWaalsContact CZ-OD1 3.28Å; Y1460-N1462 PolarHBondContact OH-OD1 2.86Å; Y1460-R1488 VanDerWaalsContact O-CA 3.27Å; Y1460-R1488 WeakPolarHBondContact O-CA 3.33Å; Y1460-R1488 WeakPolarHBondContact O-CG 3.49Å; Y1460-V1489 HydrophobicContact CD1-CB 3.81Å; Y1460-V1489 HydrophobicContact CD1-CG2 3.55Å; Y1460-V1489 VanDerWaalsContact CD1-CG2 3.42Å; Y1460-V1489 HydrophobicContact CE1-CB 4.31Å; Y1460-V1489 HydrophobicContact CE1-CG2 3.84Å; Y1460-V1489 HydrophobicContact CG-CB 4.25Å; Y1460-V1489 HydrophobicContact CG-CG2 4.27Å; Y1460-V1489 PolarHBondContact O-N 3.21Å; Y1460-L1491 HydrophobicContact CD2-CD1 3.58Å; Y1460-L1491 HydrophobicContact CD2-CD2 3.55Å; Y1460-L1491 HydrophobicContact CD2-CG 3.73Å; Y1460-L1491 HydrophobicContact CE2-CD1 3.45Å; Y1460-L1491 VanDerWaalsContact CE2-CD1 3.45Å; Y1460-L1491 HydrophobicContact CE2-CD2 3.36Å; Y1460-L1491 HydrophobicContact CE2-CG 3.83Å; Y1460-I1539 HydrophobicContact CE1-CD1 4.2Å; Y1460-L1541 HydrophobicContact CD1-CD1 4.42Å; Y1460-L1541 HydrophobicContact CE1-CD1 3.98Å; Y1460-L1541 HydrophobicContact CE2-CD1 4.43Å; Y1460-L1541 WeakPolarHBondContact OH-CD1 3.44Å; Y1460-M1543 HydrophobicContact CG-CE 4.42Å
1461	T	48.5	Very low	43.5	Very low	4.8 Å²	4.8	56.5 Å²	56.5	3%	0.029	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	143.1	177.4	56.7	0	0	0	0	112	H1354 L1356 Q1459 F1463 C1487 R1488	H1354-T1461 WeakPolarHBondContact CB-O 3.2Å; H1354-T1461 PolarHBondContact CD2-O 3.21Å; H1354-T1461 PolarHBondContact N-O 3.18Å; H1354-T1461 PolarHBondContact O-N 2.98Å; L1356-T1461 HydrophobicContact CD1-CG2 4.11Å; L1356-T1461 VanDerWaalsContact CD1-OG1 3.25Å; L1356-T1461 WeakPolarHBondContact CD1-OG1 3.42Å; Q1459-T1461 HydrophobicContact CG-CG2 4.29Å; T1461-F1463 HydrophobicContact CG2-CD2 4.15Å; T1461-F1463 HydrophobicContact CG2-CE1 4.43Å; T1461-F1463 HydrophobicContact CG2-CE2 4.17Å; T1461-F1463 HydrophobicContact CG2-CG 4.38Å; T1461-F1463 HydrophobicContact CG2-CZ 4.04Å; T1461-F1463 WeakPolarHBondContact OG1-CB 3.37Å; T1461-F1463 WeakPolarHBondContact OG1-CD2 3.34Å; T1461-F1463 VanDerWaalsContact OG1-CE2 3.28Å; T1461-F1463 WeakPolarHBondContact OG1-CE2 3.32Å; T1461-F1463 WeakPolarHBondContact OG1-CZ 3.44Å; T1461-C1487 VanDerWaalsContact CA-O 3.27Å; T1461-C1487 WeakPolarHBondContact CA-O 3.21Å; T1461-R1488 HydrophobicContact CG2-CG 3.81Å
1462	N	46.5	Very low	43.3	Very low	14 Å²	14	53.7 Å²	53.7	8%	0.075	28%	0.279	C	S	.	.			trans	-98.9	143.8	151.3	-85.6	15.2	0	0	0	107.4	R1352 L1353 Y1460 E1464 S1485 S1486 C1487 I1539	R1352-N1462 PolarHBondContact N-OD1 2.88Å; R1352-N1462 VanDerWaalsContact O-CA 3.27Å; R1352-N1462 WeakPolarHBondContact O-CA 3.34Å; R1352-N1462 WeakPolarHBondContact O-CB 3.42Å; R1352-N1462 VanDerWaalsContact O-CG 3.32Å; R1352-N1462 PolarHBondContact O-ND2 3.35Å; R1352-N1462 PolarHBondContact O-OD1 2.85Å; L1353-N1462 WeakPolarHBondContact CD2-ND2 3.35Å; L1353-N1462 WeakPolarHBondContact CD2-OD1 3.28Å; Y1460-N1462 WeakPolarHBondContact CE1-OD1 3.45Å; Y1460-N1462 VanDerWaalsContact CZ-OD1 3.28Å; Y1460-N1462 PolarHBondContact OH-OD1 2.86Å; N1462-E1464 PolarHBondContact ND2-OE2 3.11Å; N1462-S1485 PolarHBondContact ND2-O 3.38Å; N1462-S1486 CarbonylContact O-C 3.51Å; N1462-S1486 WeakPolarHBondContact O-CA 3.37Å; N1462-S1486 WeakPolarHBondContact O-CB 3.3Å; N1462-S1486 PolarHBondContact O-OG 2.8Å; N1462-C1487 PolarHBondContact N-O 3.27Å; N1462-C1487 VanDerWaalsContact N-O 3.12Å; N1462-C1487 PolarHBondContact O-N 3.32Å; N1462-C1487 VanDerWaalsContact O-N 3.09Å; N1462-I1539 WeakPolarHBondContact ND2-CD1 3.18Å
1463	F	39.9	Very low	43.2	Very low	35.6 Å²	35.6	54.2 Å²	54.2	16%	0.156	28%	0.284	C	S	.	.			trans	-114.9	148.2	-163.8	-106	-71.5	0	0	0	114	H1354 L1356 I1376 T1461 I1475 L1483 S1485 S1486	H1354-F1463 HydrophobicContact CB-CE2 4.46Å; H1354-F1463 AromaticContact CD2-CD2 3.6Å; H1354-F1463 AromaticContact CD2-CE2 3.87Å; H1354-F1463 AromaticContact NE2-CD2 3.69Å; H1354-F1463 AromaticContact NE2-CE2 3.92Å; L1356-F1463 HydrophobicContact CD1-CD2 3.69Å; L1356-F1463 HydrophobicContact CD1-CE2 3.73Å; L1356-F1463 HydrophobicContact CD1-CZ 4.47Å; I1376-F1463 HydrophobicContact CD1-CE2 4.47Å; T1461-F1463 HydrophobicContact CG2-CD2 4.15Å; T1461-F1463 HydrophobicContact CG2-CE1 4.43Å; T1461-F1463 HydrophobicContact CG2-CE2 4.17Å; T1461-F1463 HydrophobicContact CG2-CG 4.38Å; T1461-F1463 HydrophobicContact CG2-CZ 4.04Å; T1461-F1463 WeakPolarHBondContact OG1-CB 3.37Å; T1461-F1463 WeakPolarHBondContact OG1-CD2 3.34Å; T1461-F1463 VanDerWaalsContact OG1-CE2 3.28Å; T1461-F1463 WeakPolarHBondContact OG1-CE2 3.32Å; T1461-F1463 WeakPolarHBondContact OG1-CZ 3.44Å; F1463-I1475 HydrophobicContact CB-CG2 3.89Å; F1463-I1475 HydrophobicContact CD2-CB 4.23Å; F1463-I1475 HydrophobicContact CD2-CD1 3.85Å; F1463-I1475 VanDerWaalsContact CD2-CD1 3.43Å; F1463-I1475 HydrophobicContact CD2-CG2 3.77Å; F1463-I1475 VanDerWaalsContact CD2-CG2 3.4Å; F1463-I1475 HydrophobicContact CE1-CB 3.83Å; F1463-I1475 HydrophobicContact CE1-CD1 3.87Å; F1463-I1475 HydrophobicContact CE1-CG1 4.32Å; F1463-I1475 HydrophobicContact CE1-CG2 4.2Å; F1463-I1475 HydrophobicContact CE2-CB 3.9Å; F1463-I1475 HydrophobicContact CE2-CD1 3.66Å; F1463-I1475 VanDerWaalsContact CE2-CD1 3.41Å; F1463-I1475 HydrophobicContact CE2-CG1 4.19Å; F1463-I1475 HydrophobicContact CE2-CG2 3.38Å; F1463-I1475 HydrophobicContact CG-CD1 4.42Å; F1463-I1475 HydrophobicContact CG-CG2 4.1Å; F1463-I1475 HydrophobicContact CZ-CB 3.81Å; F1463-I1475 VanDerWaalsContact CZ-CB 3.44Å; F1463-I1475 HydrophobicContact CZ-CD1 3.92Å; F1463-I1475 VanDerWaalsContact CZ-CD1 3.49Å; F1463-I1475 HydrophobicContact CZ-CG1 4.23Å; F1463-I1475 HydrophobicContact CZ-CG2 3.82Å; F1463-L1483 HydrophobicContact CB-CB 3.89Å; F1463-L1483 HydrophobicContact CB-CD1 4.22Å; F1463-L1483 HydrophobicContact CB-CD2 4.08Å; F1463-L1483 HydrophobicContact CB-CG 4.23Å; F1463-L1483 HydrophobicContact CD1-CD1 3.69Å; F1463-L1483 HydrophobicContact CD1-CD2 3.7Å; F1463-L1483 HydrophobicContact CD1-CG 4.13Å; F1463-L1483 HydrophobicContact CE1-CD2 4.18Å; F1463-L1483 HydrophobicContact CG-CD1 4.43Å; F1463-L1483 HydrophobicContact CG-CD2 3.93Å; F1463-L1483 WeakPolarHBondContact O-CD1 3.25Å; F1463-L1483 WeakPolarHBondContact O-CD2 3.21Å; F1463-L1483 WeakPolarHBondContact O-CG 3.12Å; F1463-S1485 WeakPolarHBondContact CA-O 3.27Å; F1463-S1486 WeakPolarHBondContact CE1-OG 3.26Å; F1463-S1486 WeakPolarHBondContact O-CB 3.32Å; F1463-S1486 PolarHBondContact O-OG 3.09Å
1464	E	38.9	Very low	43	Very low	34.4 Å²	34.4	58.6 Å²	58.6	16%	0.161	31%	0.306	C	S	.	.			trans	-152.2	0	170.6	-108.1	179.1	150.3	0	0	110.8	F1349 H1350 R1352 Y1449 N1462 Q1466 P1477 Y1481 Q1482 L1483 I1484 S1485 S1486 R1488 F1512	F1349-E1464 WeakPolarHBondContact CA-OE1 3.33Å; F1349-E1464 WeakPolarHBondContact CB-OE1 3.32Å; H1350-E1464 VanDerWaalsContact C-CD 3.44Å; H1350-E1464 PolarHBondContact N-OE1 2.93Å; H1350-E1464 WeakPolarHBondContact O-CG 3.4Å; R1352-E1464 WeakPolarHBondContact CD-OE1 3.33Å; R1352-E1464 IonicContact CZ-OE1 3.38Å; R1352-E1464 IonicContact NE-OE1 3.85Å; R1352-E1464 PolarHBondContact NE-OE1 3.42Å; R1352-E1464 VanDerWaalsContact NE-OE1 3.15Å; R1352-E1464 IonicContact NH1-OE1 2.9Å; R1352-E1464 PolarHBondContact NH1-OE1 2.88Å; R1352-E1464 IonicContact NH2-OE1 3.72Å; Y1449-E1464 PolarHBondContact OH-OE2 3.03Å; N1462-E1464 PolarHBondContact ND2-OE2 3.11Å; E1464-Q1466 VanDerWaalsContact C-N 3.35Å; E1464-Q1466 PolarHBondContact O-N 2.98Å; E1464-P1477 VanDerWaalsContact CD-CG 3.49Å; E1464-P1477 HydrophobicContact CG-CG 4.28Å; E1464-P1477 WeakPolarHBondContact OE1-CD 3.04Å; E1464-P1477 WeakPolarHBondContact OE1-CG 3.36Å; E1464-Y1481 WeakPolarHBondContact OE2-CB 3.4Å; E1464-Q1482 CarbonylContact C-O 3.49Å; E1464-Q1482 WeakPolarHBondContact CA-O 3.36Å; E1464-Q1482 PolarHBondContact N-O 2.64Å; E1464-Q1482 CarbonylContact O-C 3.5Å; E1464-L1483 HydrophobicContact CB-CB 3.88Å; E1464-L1483 HydrophobicContact CG-CB 4.32Å; E1464-L1483 HydrophobicContact CG-CD1 4.24Å; E1464-L1483 VanDerWaalsContact N-CD1 3.29Å; E1464-L1483 WeakPolarHBondContact O-CA 3.49Å; E1464-L1483 WeakPolarHBondContact O-CB 3.13Å; E1464-L1483 PolarHBondContact O-N 2.99Å; E1464-L1483 VanDerWaalsContact OE1-CA 3.31Å; E1464-L1483 WeakPolarHBondContact OE1-CA 3.29Å; E1464-I1484 VanDerWaalsContact CD-N 3.3Å; E1464-I1484 WeakPolarHBondContact O-CA 3.28Å; E1464-I1484 WeakPolarHBondContact O-CB 3.44Å; E1464-I1484 WeakPolarHBondContact O-CG1 3.5Å; E1464-I1484 PolarHBondContact O-N 3.01Å; E1464-I1484 PolarHBondContact OE1-N 3.37Å; E1464-S1485 VanDerWaalsContact CD-N 3.33Å; E1464-S1485 PolarHBondContact O-N 2.96Å; E1464-S1485 PolarHBondContact OE2-N 3.46Å; E1464-S1486 PolarHBondContact O-OG 3.26Å; E1464-R1488 IonicContact OE2-NH2 3.92Å; E1464-R1488 PolarHBondContact OE2-NH2 2.86Å; E1464-F1512 HydrophobicContact CB-CD2 4.46Å; E1464-F1512 HydrophobicContact CB-CE2 4.19Å; E1464-F1512 HydrophobicContact CB-CZ 4.39Å; E1464-F1512 VanDerWaalsContact CD-CD2 3.43Å; E1464-F1512 HydrophobicContact CG-CD2 3.84Å; E1464-F1512 VanDerWaalsContact CG-CD2 3.48Å; E1464-F1512 HydrophobicContact CG-CE1 4.31Å; E1464-F1512 HydrophobicContact CG-CE2 3.78Å; E1464-F1512 HydrophobicContact CG-CG 3.94Å; E1464-F1512 HydrophobicContact CG-CZ 4.1Å; E1464-F1512 WeakPolarHBondContact OE1-CD1 3.32Å; E1464-F1512 WeakPolarHBondContact OE1-CD2 3.26Å; E1464-F1512 VanDerWaalsContact OE1-CE1 3.26Å; E1464-F1512 WeakPolarHBondContact OE1-CE1 3.3Å; E1464-F1512 WeakPolarHBondContact OE1-CG 3.23Å; E1464-F1512 VanDerWaalsContact OE2-CZ 3.3Å; E1464-F1512 WeakPolarHBondContact OE2-CZ 3.06Å
1465	Q	33.7	Very low	43	Very low	78.8 Å²	78.8	55.1 Å²	55.1	37%	0.368	29%	0.289	S	S	.	.				0	114.3	0	-170	161.7	-5.7	0	0	114.2	S1467 N1472 Q1482 L1483 I1484 F1512 W1531	Q1465-S1467 PolarHBondContact O-N 3.22Å; Q1465-N1472 PolarHBondContact O-ND2 3.31Å; Q1465-Q1482 VanDerWaalsContact CA-C 3.47Å; Q1465-Q1482 HydrophobicContact CB-CB 4.31Å; Q1465-Q1482 HydrophobicContact CB-CG 4.42Å; Q1465-Q1482 HydrophobicContact CG-CG 4.39Å; Q1465-Q1482 PolarHBondContact N-O 3.46Å; Q1465-L1483 CarbonylContact C-O 3.58Å; Q1465-L1483 VanDerWaalsContact CA-C 3.43Å; Q1465-L1483 VanDerWaalsContact CA-CB 3.42Å; Q1465-L1483 VanDerWaalsContact CA-N 3.26Å; Q1465-L1483 HydrophobicContact CB-CB 4.04Å; Q1465-L1483 HydrophobicContact CB-CD2 4.16Å; Q1465-L1483 CarbonylContact O-C 3.54Å; Q1465-I1484 HydrophobicContact CB-CB 3.77Å; Q1465-I1484 HydrophobicContact CB-CD1 4.46Å; Q1465-I1484 HydrophobicContact CB-CG1 3.14Å; Q1465-I1484 HydrophobicContact CG-CG1 4.17Å; Q1465-I1484 WeakPolarHBondContact O-CA 3.31Å; Q1465-I1484 PolarHBondContact O-N 3.05Å; Q1465-F1512 PolarHBondContact NE2-O 3Å; Q1465-F1512 PolarHBondContact OE1-O 3.45Å; Q1465-W1531 VanDerWaalsContact CD-CH2 3.43Å; Q1465-W1531 HydrophobicContact CG-CH2 4.39Å
1466	Q	31.4	Very low	42.9	Very low	98.8 Å²	98.8	55.5 Å²	55.5	46%	0.462	29%	0.293	S	S	.	.			trans	-103.8	133.2	165.1	-133.1	-172.7	-4.7	0	0	110.1	E1464 N1468 Q1482 L1483 W1531	E1464-Q1466 VanDerWaalsContact C-N 3.35Å; E1464-Q1466 PolarHBondContact O-N 2.98Å; Q1466-N1468 VanDerWaalsContact C-N 3.3Å; Q1466-N1468 PolarHBondContact O-N 3.41Å; Q1466-Q1482 WeakPolarHBondContact O-CG 3.22Å; Q1466-L1483 WeakPolarHBondContact CB-O 3.41Å; Q1466-W1531 HydrophobicContact CG-CH2 4.44Å; Q1466-W1531 HydrophobicContact CG-CZ2 3.47Å; Q1466-W1531 VanDerWaalsContact CG-CZ2 3.47Å
1467	S	28.9	Very low	43	Very low	85.4 Å²	85.4	57 Å²	57	60%	0.597	30%	0.303	S	S	*	.			trans	-111	125.9	164.6	52.1	0	0	0	0	111.4	Q1465 E1469 W1531	Q1465-S1467 PolarHBondContact O-N 3.22Å; S1467-E1469 PolarHBondContact O-N 3.36Å; S1467-W1531 WeakPolarHBondContact OG-CH2 3.07Å
1468	N	29.8	Very low	42.5	Very low	137 Å²	137	58 Å²	58	73%	0.733	31%	0.313	S	S	*	.			trans	-176.2	114.9	161.5	-80.2	-16.2	0	0	0	113.4	Q1466 N1470 N1472	Q1466-N1468 VanDerWaalsContact C-N 3.3Å; Q1466-N1468 PolarHBondContact O-N 3.41Å; N1468-N1470 VanDerWaalsContact C-N 3.27Å; N1468-N1470 PolarHBondContact O-N 2.98Å; N1468-N1472 PolarHBondContact O-ND2 2.9Å
1469	E	31.9	Very low	42.5	Very low	174.2 Å²	174.2	66.6 Å²	66.6	81%	0.814	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	31.5	-169	-61.6	-164.7	146.4	0	0	116.5	S1467 I1471	S1467-E1469 PolarHBondContact O-N 3.36Å; E1469-I1471 PolarHBondContact O-N 3.14Å
1470	N	35.2	Very low	42.5	Very low	115.2 Å²	115.2	74.2 Å²	74.2	62%	0.616	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-18.7	171.3	-69.4	-21.9	0	0	0	118.7	S1299 Q1302 N1468 N1472	S1299-N1470 WeakPolarHBondContact CB-OD1 3.45Å; S1299-N1470 PolarHBondContact OG-ND2 2.83Å; S1299-N1470 VanDerWaalsContact OG-ND2 3.15Å; S1299-N1470 PolarHBondContact OG-OD1 3.32Å; Q1302-N1470 PolarHBondContact OE1-ND2 2.9Å; N1468-N1470 VanDerWaalsContact C-N 3.27Å; N1468-N1470 PolarHBondContact O-N 2.98Å; N1470-N1472 VanDerWaalsContact C-N 3.3Å; N1470-N1472 PolarHBondContact O-N 3.35Å
1471	I	38.8	Very low	42.7	Very low	87 Å²	87	78 Å²	78	45%	0.446	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-11.4	-177.4	-58.9	177.8	0	0	0	112	E1372 L1373 I1376 E1469 S1473	E1372-I1471 HydrophobicContact CG-CD1 4.08Å; E1372-I1471 HydrophobicContact CG-CG1 3.96Å; L1373-I1471 HydrophobicContact CD1-CD1 4.27Å; I1376-I1471 HydrophobicContact CD1-CG2 3.72Å; E1469-I1471 PolarHBondContact O-N 3.14Å; I1471-S1473 VanDerWaalsContact C-N 3.32Å; I1471-S1473 PolarHBondContact O-N 3.24Å
1472	N	40.8	Very low	43.3	Very low	42.4 Å²	42.4	83.2 Å²	83.2	23%	0.227	43%	0.425	C	S	.	.			trans	-82.9	17.3	-171.5	-72.2	-10.2	0	0	0	115.9	I1376 Q1465 N1468 N1470 I1474 I1475 N1476	I1376-N1472 WeakPolarHBondContact CD1-ND2 3.4Å; Q1465-N1472 PolarHBondContact O-ND2 3.31Å; N1468-N1472 PolarHBondContact O-ND2 2.9Å; N1470-N1472 VanDerWaalsContact C-N 3.3Å; N1470-N1472 PolarHBondContact O-N 3.35Å; N1472-I1474 VanDerWaalsContact C-N 3.28Å; N1472-I1474 PolarHBondContact O-N 3.24Å; N1472-I1474 VanDerWaalsContact O-N 3.14Å; N1472-I1475 PolarHBondContact O-N 3.08Å; N1472-I1475 VanDerWaalsContact O-N 3.08Å; N1472-N1476 VanDerWaalsContact O-CB 3.24Å; N1472-N1476 WeakPolarHBondContact O-CB 3.41Å; N1472-N1476 PolarHBondContact O-N 3.19Å; N1472-N1476 VanDerWaalsContact O-N 3.07Å
1473	S	42.1	Very low	44.1	Very low	70 Å²	70	84.3 Å²	84.3	49%	0.49	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-29.4	-178.1	54.7	0	0	0	0	114.2	I1471 I1475 N1476	I1471-S1473 VanDerWaalsContact C-N 3.32Å; I1471-S1473 PolarHBondContact O-N 3.24Å; S1473-I1475 VanDerWaalsContact C-N 3.31Å; S1473-I1475 PolarHBondContact O-N 2.95Å; S1473-I1475 VanDerWaalsContact O-N 3.15Å; S1473-N1476 PolarHBondContact O-N 2.9Å
1474	I	46.3	Very low	45.3	Very low	99 Å²	99	84.4 Å²	84.4	51%	0.508	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-28.3	179.7	-59.2	172.4	0	0	0	112.4	L1378 N1472	L1378-I1474 HydrophobicContact CB-CG2 4.03Å; L1378-I1474 HydrophobicContact CD2-CG2 4.27Å; N1472-I1474 VanDerWaalsContact C-N 3.28Å; N1472-I1474 PolarHBondContact O-N 3.24Å; N1472-I1474 VanDerWaalsContact O-N 3.14Å
1475	I	52.2	Low	46.8	Very low	13.8 Å²	13.8	83.2 Å²	83.2	7%	0.071	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-25.5	-171.3	-49.1	176.2	0	0	0	112	H1354 L1356 I1376 L1378 F1463 N1472 S1473 P1477	H1354-I1475 WeakPolarHBondContact CE1-CG2 3.32Å; H1354-I1475 WeakPolarHBondContact ND1-CG2 3.42Å; L1356-I1475 HydrophobicContact CD1-CD1 4.29Å; L1356-I1475 HydrophobicContact CD2-CD1 4.41Å; I1376-I1475 HydrophobicContact CD1-CD1 4.18Å; I1376-I1475 HydrophobicContact CG2-CD1 4.25Å; L1378-I1475 HydrophobicContact CD2-CG2 4.35Å; F1463-I1475 HydrophobicContact CB-CG2 3.89Å; F1463-I1475 HydrophobicContact CD2-CB 4.23Å; F1463-I1475 HydrophobicContact CD2-CD1 3.85Å; F1463-I1475 VanDerWaalsContact CD2-CD1 3.43Å; F1463-I1475 HydrophobicContact CD2-CG2 3.77Å; F1463-I1475 VanDerWaalsContact CD2-CG2 3.4Å; F1463-I1475 HydrophobicContact CE1-CB 3.83Å; F1463-I1475 HydrophobicContact CE1-CD1 3.87Å; F1463-I1475 HydrophobicContact CE1-CG1 4.32Å; F1463-I1475 HydrophobicContact CE1-CG2 4.2Å; F1463-I1475 HydrophobicContact CE2-CB 3.9Å; F1463-I1475 HydrophobicContact CE2-CD1 3.66Å; F1463-I1475 VanDerWaalsContact CE2-CD1 3.41Å; F1463-I1475 HydrophobicContact CE2-CG1 4.19Å; F1463-I1475 HydrophobicContact CE2-CG2 3.38Å; F1463-I1475 HydrophobicContact CG-CD1 4.42Å; F1463-I1475 HydrophobicContact CG-CG2 4.1Å; F1463-I1475 HydrophobicContact CZ-CB 3.81Å; F1463-I1475 VanDerWaalsContact CZ-CB 3.44Å; F1463-I1475 HydrophobicContact CZ-CD1 3.92Å; F1463-I1475 VanDerWaalsContact CZ-CD1 3.49Å; F1463-I1475 HydrophobicContact CZ-CG1 4.23Å; F1463-I1475 HydrophobicContact CZ-CG2 3.82Å; N1472-I1475 PolarHBondContact O-N 3.08Å; N1472-I1475 VanDerWaalsContact O-N 3.08Å; S1473-I1475 VanDerWaalsContact C-N 3.31Å; S1473-I1475 PolarHBondContact O-N 2.95Å; S1473-I1475 VanDerWaalsContact O-N 3.15Å; I1475-P1477 VanDerWaalsContact O-CD 3.24Å; I1475-P1477 WeakPolarHBondContact O-CD 3.19Å
1476	N	52.6	Low	48.6	Very low	58 Å²	58	79.6 Å²	79.6	31%	0.31	41%	0.411	S	S	.	.			trans	-73.1	120.8	178.2	-170.8	-4.4	0	0	0	110.5	N1472 S1473 G1478	N1472-N1476 VanDerWaalsContact O-CB 3.24Å; N1472-N1476 WeakPolarHBondContact O-CB 3.41Å; N1472-N1476 PolarHBondContact O-N 3.19Å; N1472-N1476 VanDerWaalsContact O-N 3.07Å; S1473-N1476 PolarHBondContact O-N 2.9Å; N1476-G1478 PolarHBondContact ND2-O 2.85Å; N1476-G1478 PolarHBondContact O-N 3.07Å; N1476-G1478 VanDerWaalsContact O-N 3.15Å; N1476-G1478 PolarHBondContact OD1-N 3.39Å; N1476-G1478 VanDerWaalsContact OD1-N 3.15Å; N1476-G1478 PolarHBondContact OD1-O 3.25Å; N1476-G1478 VanDerWaalsContact OD1-O 3.09Å
1477	P	51.9	Low	50.7	Low	38.8 Å²	38.8	75.1 Å²	75.1	25%	0.252	39%	0.39	S	S	.	.			trans	-64.6	-11.3	-179.6	7.3	-10.5	0	0	0	116	H1230 R1352 E1464 I1475 Y1481	H1230-P1477 PolarHBondContact ND1-O 3.33Å; R1352-P1477 VanDerWaalsContact CZ-CB 3.41Å; R1352-P1477 VanDerWaalsContact NH1-CB 3.29Å; R1352-P1477 VanDerWaalsContact NH1-CD 3.3Å; R1352-P1477 VanDerWaalsContact NH2-CG 3.28Å; E1464-P1477 VanDerWaalsContact CD-CG 3.49Å; E1464-P1477 HydrophobicContact CG-CG 4.28Å; E1464-P1477 WeakPolarHBondContact OE1-CD 3.04Å; E1464-P1477 WeakPolarHBondContact OE1-CG 3.36Å; I1475-P1477 VanDerWaalsContact O-CD 3.24Å; I1475-P1477 WeakPolarHBondContact O-CD 3.19Å; P1477-Y1481 HydrophobicContact CB-CD1 4.11Å; P1477-Y1481 HydrophobicContact CB-CD2 3.73Å; P1477-Y1481 VanDerWaalsContact CB-CD2 3.47Å; P1477-Y1481 HydrophobicContact CB-CE2 4.06Å; P1477-Y1481 HydrophobicContact CB-CG 3.89Å; P1477-Y1481 VanDerWaalsContact CB-CG 3.45Å; P1477-Y1481 HydrophobicContact CG-CD1 4.25Å; P1477-Y1481 HydrophobicContact CG-CD2 3.88Å; P1477-Y1481 VanDerWaalsContact CG-CD2 3.47Å; P1477-Y1481 HydrophobicContact CG-CE2 4.09Å; P1477-Y1481 HydrophobicContact CG-CG 3.79Å; P1477-Y1481 VanDerWaalsContact CG-CG 3.49Å; P1477-Y1481 WeakPolarHBondContact O-CD2 3.2Å
1478	G	47.5	Very low	52.8	Low	21.2 Å²	21.2	72.2 Å²	72.2	22%	0.219	37%	0.366	C	S	.	.			trans	134.9	167.4	-175.1	0	0	0	0	0	111.7	H1230 N1476 E1480 Y1481	H1230-G1478 WeakPolarHBondContact CE1-CA 3.37Å; N1476-G1478 PolarHBondContact ND2-O 2.85Å; N1476-G1478 PolarHBondContact O-N 3.07Å; N1476-G1478 VanDerWaalsContact O-N 3.15Å; N1476-G1478 PolarHBondContact OD1-N 3.39Å; N1476-G1478 VanDerWaalsContact OD1-N 3.15Å; N1476-G1478 PolarHBondContact OD1-O 3.25Å; N1476-G1478 VanDerWaalsContact OD1-O 3.09Å; G1478-E1480 VanDerWaalsContact C-N 3.28Å; G1478-E1480 PolarHBondContact O-N 3.21Å; G1478-E1480 VanDerWaalsContact O-N 3.1Å; G1478-Y1481 CarbonylContact O-C 3.6Å; G1478-Y1481 VanDerWaalsContact O-C 3.24Å; G1478-Y1481 WeakPolarHBondContact O-CA 3.37Å; G1478-Y1481 PolarHBondContact O-N 3.14Å
1479	K	52.5	Low	55.2	Low	181.6 Å²	181.6	65.8 Å²	65.8	79%	0.79	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-19.4	-177.2	-63.2	-176.4	178.2	-178.4	0	114.3	R1226 N1227 E1229 Y1481	R1226-K1479 PolarHBondContact O-NZ 3.26Å; R1226-K1479 VanDerWaalsContact O-NZ 3.11Å; N1227-K1479 PolarHBondContact OD1-NZ 2.9Å; E1229-K1479 HydrophobicContact CG-CB 4.43Å; E1229-K1479 HydrophobicContact CG-CG 4.25Å; E1229-K1479 VanDerWaalsContact OE1-CA 3.25Å; E1229-K1479 WeakPolarHBondContact OE1-CA 2.87Å; E1229-K1479 WeakPolarHBondContact OE1-CB 3.35Å; E1229-K1479 PolarHBondContact OE1-N 3.43Å; K1479-Y1481 VanDerWaalsContact C-N 3.34Å; K1479-Y1481 PolarHBondContact O-N 3.33Å
1480	E	51.7	Low	57.4	Low	165 Å²	165	57.8 Å²	57.8	77%	0.771	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-14.8	179.1	-45.6	-170.8	176	0	0	113.6	E1229 G1478 Q1482	E1229-E1480 PolarHBondContact OE1-N 3.28Å; G1478-E1480 VanDerWaalsContact C-N 3.28Å; G1478-E1480 PolarHBondContact O-N 3.21Å; G1478-E1480 VanDerWaalsContact O-N 3.1Å; E1480-Q1482 PolarHBondContact O-N 3.15Å
1481	Y	56	Low	59.7	Low	83 Å²	83	52.6 Å²	52.6	33%	0.325	27%	0.268	S	S	.	.			trans	-106.1	132.3	-179.2	-65.3	-92.8	0	0	0	110.7	E1464 P1477 G1478 K1479	E1464-Y1481 WeakPolarHBondContact OE2-CB 3.4Å; P1477-Y1481 HydrophobicContact CB-CD1 4.11Å; P1477-Y1481 HydrophobicContact CB-CD2 3.73Å; P1477-Y1481 VanDerWaalsContact CB-CD2 3.47Å; P1477-Y1481 HydrophobicContact CB-CE2 4.06Å; P1477-Y1481 HydrophobicContact CB-CG 3.89Å; P1477-Y1481 VanDerWaalsContact CB-CG 3.45Å; P1477-Y1481 HydrophobicContact CG-CD1 4.25Å; P1477-Y1481 HydrophobicContact CG-CD2 3.88Å; P1477-Y1481 VanDerWaalsContact CG-CD2 3.47Å; P1477-Y1481 HydrophobicContact CG-CE2 4.09Å; P1477-Y1481 HydrophobicContact CG-CG 3.79Å; P1477-Y1481 VanDerWaalsContact CG-CG 3.49Å; P1477-Y1481 WeakPolarHBondContact O-CD2 3.2Å; G1478-Y1481 CarbonylContact O-C 3.6Å; G1478-Y1481 VanDerWaalsContact O-C 3.24Å; G1478-Y1481 WeakPolarHBondContact O-CA 3.37Å; G1478-Y1481 PolarHBondContact O-N 3.14Å; K1479-Y1481 VanDerWaalsContact C-N 3.34Å; K1479-Y1481 PolarHBondContact O-N 3.33Å
1482	Q	60.8	Low	61.9	Low	114 Å²	114	48.4 Å²	48.4	53%	0.533	25%	0.246	S	C	.	.			trans	-113.4	134.4	-176.8	-163.8	-178.7	13.2	0	0	110.6	E1464 Q1465 Q1466 E1480 I1484	E1464-Q1482 CarbonylContact C-O 3.49Å; E1464-Q1482 WeakPolarHBondContact CA-O 3.36Å; E1464-Q1482 PolarHBondContact N-O 2.64Å; E1464-Q1482 CarbonylContact O-C 3.5Å; Q1465-Q1482 VanDerWaalsContact CA-C 3.47Å; Q1465-Q1482 HydrophobicContact CB-CB 4.31Å; Q1465-Q1482 HydrophobicContact CB-CG 4.42Å; Q1465-Q1482 HydrophobicContact CG-CG 4.39Å; Q1465-Q1482 PolarHBondContact N-O 3.46Å; Q1466-Q1482 WeakPolarHBondContact O-CG 3.22Å; E1480-Q1482 PolarHBondContact O-N 3.15Å; Q1482-I1484 PolarHBondContact O-N 2.96Å
1483	L	63.3	Low	63.8	Low	36.8 Å²	36.8	46.7 Å²	46.7	19%	0.193	24%	0.238	C	C	.	.			trans	-79.2	108.8	174.7	-180	59.8	0	0	0	114.2	F1463 E1464 Q1465 Q1466 S1485 F1512	F1463-L1483 HydrophobicContact CB-CB 3.89Å; F1463-L1483 HydrophobicContact CB-CD1 4.22Å; F1463-L1483 HydrophobicContact CB-CD2 4.08Å; F1463-L1483 HydrophobicContact CB-CG 4.23Å; F1463-L1483 HydrophobicContact CD1-CD1 3.69Å; F1463-L1483 HydrophobicContact CD1-CD2 3.7Å; F1463-L1483 HydrophobicContact CD1-CG 4.13Å; F1463-L1483 HydrophobicContact CE1-CD2 4.18Å; F1463-L1483 HydrophobicContact CG-CD1 4.43Å; F1463-L1483 HydrophobicContact CG-CD2 3.93Å; F1463-L1483 WeakPolarHBondContact O-CD1 3.25Å; F1463-L1483 WeakPolarHBondContact O-CD2 3.21Å; F1463-L1483 WeakPolarHBondContact O-CG 3.12Å; E1464-L1483 HydrophobicContact CB-CB 3.88Å; E1464-L1483 HydrophobicContact CG-CB 4.32Å; E1464-L1483 HydrophobicContact CG-CD1 4.24Å; E1464-L1483 VanDerWaalsContact N-CD1 3.29Å; E1464-L1483 WeakPolarHBondContact O-CA 3.49Å; E1464-L1483 WeakPolarHBondContact O-CB 3.13Å; E1464-L1483 PolarHBondContact O-N 2.99Å; E1464-L1483 VanDerWaalsContact OE1-CA 3.31Å; E1464-L1483 WeakPolarHBondContact OE1-CA 3.29Å; Q1465-L1483 CarbonylContact C-O 3.58Å; Q1465-L1483 VanDerWaalsContact CA-C 3.43Å; Q1465-L1483 VanDerWaalsContact CA-CB 3.42Å; Q1465-L1483 VanDerWaalsContact CA-N 3.26Å; Q1465-L1483 HydrophobicContact CB-CB 4.04Å; Q1465-L1483 HydrophobicContact CB-CD2 4.16Å; Q1465-L1483 CarbonylContact O-C 3.54Å; Q1466-L1483 WeakPolarHBondContact CB-O 3.41Å; L1483-S1485 VanDerWaalsContact CD1-C 3.46Å; L1483-S1485 WeakPolarHBondContact CD1-O 3.46Å; L1483-F1512 HydrophobicContact CD1-CD2 4.06Å; L1483-F1512 HydrophobicContact CD1-CE2 4.16Å; L1483-F1512 HydrophobicContact CD2-CD2 4.29Å
1484	I	65	Low	65.9	Low	37 Å²	37	43.4 Å²	43.4	19%	0.19	22%	0.215	C	C	.	.			trans	-90.2	-53.1	-179.5	-57.6	163.2	0	0	0	109.8	M1331 I1335 F1349 E1464 Q1465 Q1482 S1511 F1512	M1331-I1484 HydrophobicContact CE-CB 4.28Å; M1331-I1484 HydrophobicContact CE-CG2 3.59Å; I1335-I1484 HydrophobicContact CG1-CG2 4.39Å; F1349-I1484 HydrophobicContact CD1-CD1 3.71Å; F1349-I1484 VanDerWaalsContact CD1-CD1 3.49Å; F1349-I1484 HydrophobicContact CE1-CD1 3.66Å; E1464-I1484 VanDerWaalsContact CD-N 3.3Å; E1464-I1484 WeakPolarHBondContact O-CA 3.28Å; E1464-I1484 WeakPolarHBondContact O-CB 3.44Å; E1464-I1484 WeakPolarHBondContact O-CG1 3.5Å; E1464-I1484 PolarHBondContact O-N 3.01Å; E1464-I1484 PolarHBondContact OE1-N 3.37Å; Q1465-I1484 HydrophobicContact CB-CB 3.77Å; Q1465-I1484 HydrophobicContact CB-CD1 4.46Å; Q1465-I1484 HydrophobicContact CB-CG1 3.14Å; Q1465-I1484 HydrophobicContact CG-CG1 4.17Å; Q1465-I1484 WeakPolarHBondContact O-CA 3.31Å; Q1465-I1484 PolarHBondContact O-N 3.05Å; Q1482-I1484 PolarHBondContact O-N 2.96Å; I1484-S1511 CarbonylContact O-C 2.84Å; I1484-S1511 WeakPolarHBondContact O-CA 3.41Å; I1484-S1511 VanDerWaalsContact O-CB 3.25Å; I1484-S1511 WeakPolarHBondContact O-CB 3.36Å; I1484-F1512 WeakPolarHBondContact O-CD2 3.3Å; I1484-F1512 PolarHBondContact O-N 2.84Å
1485	S	70.1	Confident	67.8	Low	9.6 Å²	9.6	38.8 Å²	38.8	7%	0.067	19%	0.191	C	C	.	.			trans	-153.9	150.1	-171.1	65.1	0	0	0	0	114.1	N1462 F1463 E1464 L1483 T1510 S1536	N1462-S1485 PolarHBondContact ND2-O 3.38Å; F1463-S1485 WeakPolarHBondContact CA-O 3.27Å; E1464-S1485 VanDerWaalsContact CD-N 3.33Å; E1464-S1485 PolarHBondContact O-N 2.96Å; E1464-S1485 PolarHBondContact OE2-N 3.46Å; L1483-S1485 VanDerWaalsContact CD1-C 3.46Å; L1483-S1485 WeakPolarHBondContact CD1-O 3.46Å; S1485-T1510 CarbonylContact C-O 3.54Å; S1485-T1510 WeakPolarHBondContact CA-O 3.3Å; S1485-T1510 WeakPolarHBondContact CB-O 3.4Å; S1485-S1536 WeakPolarHBondContact CB-OG 3.35Å; S1485-S1536 PolarHBondContact OG-OG 3.42Å
1486	S	72.6	Confident	69.2	Low	3.8 Å²	3.8	38.3 Å²	38.3	3%	0.027	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-130.8	154.3	-174.7	92.7	0	0	0	0	112.4	N1462 F1463 E1464 L1509 T1510 F1512 W1890	N1462-S1486 CarbonylContact O-C 3.51Å; N1462-S1486 WeakPolarHBondContact O-CA 3.37Å; N1462-S1486 WeakPolarHBondContact O-CB 3.3Å; N1462-S1486 PolarHBondContact O-OG 2.8Å; F1463-S1486 WeakPolarHBondContact CE1-OG 3.26Å; F1463-S1486 WeakPolarHBondContact O-CB 3.32Å; F1463-S1486 PolarHBondContact O-OG 3.09Å; E1464-S1486 PolarHBondContact O-OG 3.26Å; S1486-L1509 CarbonylContact O-C 3.55Å; S1486-L1509 VanDerWaalsContact O-CA 3.27Å; S1486-L1509 WeakPolarHBondContact O-CA 3.23Å; S1486-T1510 PolarHBondContact N-O 2.97Å; S1486-T1510 PolarHBondContact O-N 3.07Å; S1486-T1510 PolarHBondContact O-OG1 3.08Å; S1486-T1510 VanDerWaalsContact O-OG1 3.1Å; S1486-T1510 PolarHBondContact OG-O 3.06Å; S1486-T1510 VanDerWaalsContact OG-O 3.09Å; S1486-F1512 WeakPolarHBondContact OG-CE2 3.2Å; S1486-W1890 WeakPolarHBondContact OG-CH2 3.31Å
1487	C	74.7	Confident	70.6	Confident	3.4 Å²	3.4	35.8 Å²	35.8	2%	0.023	18%	0.176	C	C	.	.			trans	-136.3	145.8	171.9	178.6	0	0	0	0	108.7	T1461 N1462 Y1507 P1508 L1509 I1539	T1461-C1487 VanDerWaalsContact CA-O 3.27Å; T1461-C1487 WeakPolarHBondContact CA-O 3.21Å; N1462-C1487 PolarHBondContact N-O 3.27Å; N1462-C1487 VanDerWaalsContact N-O 3.12Å; N1462-C1487 PolarHBondContact O-N 3.32Å; N1462-C1487 VanDerWaalsContact O-N 3.09Å; C1487-Y1507 VanDerWaalsContact SG-CB 3.56Å; C1487-Y1507 WeakPolarHBondContact SG-CB 3.38Å; C1487-P1508 WeakPolarHBondContact CA-O 3.32Å; C1487-P1508 VanDerWaalsContact CB-O 3.29Å; C1487-P1508 WeakPolarHBondContact CB-O 3.28Å; C1487-P1508 PolarHBondContact SG-O 3.14Å; C1487-P1508 VanDerWaalsContact SG-O 3.32Å; C1487-L1509 HydrophobicContact CB-CD2 3.94Å; C1487-L1509 HydrophobicContact CB-CG 4.47Å; C1487-I1539 HydrophobicContact CB-CD1 3.97Å; C1487-I1539 HydrophobicContact CB-CG1 4.34Å
1488	R	73.3	Confident	71.7	Confident	24.6 Å²	24.6	35.6 Å²	35.6	9%	0.093	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	137.5	170.3	-74.5	178.8	175.6	135.4	5.3	109.9	Q1445 Q1448 Y1449 Q1459 Y1460 T1461 E1464 W1890	Q1445-R1488 HydrophobicContact CG-CB 4.35Å; Q1445-R1488 VanDerWaalsContact NE2-C 3.29Å; Q1445-R1488 PolarHBondContact NE2-O 3.19Å; Q1448-R1488 VanDerWaalsContact CD-NH1 3.3Å; Q1448-R1488 VanDerWaalsContact OE1-CZ 3.29Å; Y1449-R1488 VanDerWaalsContact CZ-NH1 3.29Å; Y1449-R1488 VanDerWaalsContact OH-CZ 3.25Å; Y1449-R1488 PolarHBondContact OH-NE 3.13Å; Y1449-R1488 PolarHBondContact OH-NH1 3.15Å; Y1449-R1488 VanDerWaalsContact OH-NH1 3.1Å; Y1449-R1488 PolarHBondContact OH-NH2 3.1Å; Q1459-R1488 HydrophobicContact CG-CG 4.31Å; Q1459-R1488 VanDerWaalsContact OE1-CD 3.27Å; Y1460-R1488 VanDerWaalsContact O-CA 3.27Å; Y1460-R1488 WeakPolarHBondContact O-CA 3.33Å; Y1460-R1488 WeakPolarHBondContact O-CG 3.49Å; T1461-R1488 HydrophobicContact CG2-CG 3.81Å; E1464-R1488 IonicContact OE2-NH2 3.92Å; E1464-R1488 PolarHBondContact OE2-NH2 2.86Å; R1488-W1890 HydrophobicContact CB-CH2 4.03Å; R1488-W1890 HydrophobicContact CB-CZ2 4.09Å; R1488-W1890 HydrophobicContact CG-CH2 3.68Å; R1488-W1890 HydrophobicContact CG-CZ2 4.23Å; R1488-W1890 HydrophobicContact CG-CZ3 4.48Å
1489	V	79.3	Confident	73.1	Confident	2.6 Å²	2.6	40.8 Å²	40.8	2%	0.016	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	122.3	-172.8	-173.9	0	0	0	0	110.4	Y1460 Y1507 L1541 M1543	Y1460-V1489 HydrophobicContact CD1-CB 3.81Å; Y1460-V1489 HydrophobicContact CD1-CG2 3.55Å; Y1460-V1489 VanDerWaalsContact CD1-CG2 3.42Å; Y1460-V1489 HydrophobicContact CE1-CB 4.31Å; Y1460-V1489 HydrophobicContact CE1-CG2 3.84Å; Y1460-V1489 HydrophobicContact CG-CB 4.25Å; Y1460-V1489 HydrophobicContact CG-CG2 4.27Å; Y1460-V1489 PolarHBondContact O-N 3.21Å; V1489-Y1507 HydrophobicContact CB-CD1 4.4Å; V1489-Y1507 HydrophobicContact CB-CE1 4.38Å; V1489-Y1507 HydrophobicContact CG1-CD1 4.11Å; V1489-Y1507 HydrophobicContact CG1-CD2 4.46Å; V1489-Y1507 HydrophobicContact CG1-CE1 3.64Å; V1489-Y1507 VanDerWaalsContact CG1-CE1 3.47Å; V1489-Y1507 HydrophobicContact CG1-CE2 4.17Å; V1489-Y1507 HydrophobicContact CG1-CG 4.45Å; V1489-Y1507 VanDerWaalsContact CG1-CZ 3.47Å; V1489-Y1507 HydrophobicContact CG2-CD1 4.05Å; V1489-Y1507 HydrophobicContact CG2-CD2 4.19Å; V1489-Y1507 HydrophobicContact CG2-CE1 4.27Å; V1489-Y1507 HydrophobicContact CG2-CG 4.08Å; V1489-L1541 HydrophobicContact CB-CD1 4.46Å; V1489-L1541 HydrophobicContact CG1-CD1 4.3Å; V1489-L1541 HydrophobicContact CG2-CD1 3.6Å; V1489-M1543 HydrophobicContact CB-CE 4.1Å; V1489-M1543 HydrophobicContact CG1-CE 3.53Å; V1489-M1543 VanDerWaalsContact CG1-CE 3.45Å; V1489-M1543 HydrophobicContact CG1-SD 4Å
1490	P	79.1	Confident	74.5	Confident	7.6 Å²	7.6	32.1 Å²	32.1	5%	0.049	16%	0.156	C	C	.	.			trans	-75.5	135	177.6	30.6	-33	0	0	0	110.2	D1442 Q1445 P1810	D1442-P1490 HydrophobicContact CB-CB 4.23Å; Q1445-P1490 VanDerWaalsContact OE1-CB 3.25Å; Q1445-P1490 VanDerWaalsContact OE1-CG 3.29Å; Q1445-P1490 VanDerWaalsContact OE1-N 3.09Å; P1490-P1810 HydrophobicContact CG-CB 4.07Å; P1490-P1810 HydrophobicContact CG-CG 4.21Å
1491	L	84.2	Confident	76	Confident	4.4 Å²	4.4	28 Å²	28	2%	0.023	14%	0.139	C	C	.	.			trans	-94.1	-7.7	179.4	-65.2	174.6	0	0	0	113.2	I1323 I1438 L1458 Y1460 A1493 L1494 M1543	I1323-L1491 HydrophobicContact CD1-CD2 4.28Å; I1438-L1491 HydrophobicContact CB-CB 4.3Å; I1438-L1491 HydrophobicContact CG1-CB 4.31Å; I1438-L1491 HydrophobicContact CG1-CD1 4.01Å; I1438-L1491 VanDerWaalsContact CG2-C 3.44Å; I1438-L1491 HydrophobicContact CG2-CB 3.76Å; I1438-L1491 WeakPolarHBondContact CG2-O 3.47Å; L1458-L1491 HydrophobicContact CB-CD1 4.06Å; L1458-L1491 HydrophobicContact CD2-CD1 3.69Å; L1458-L1491 HydrophobicContact CG-CD1 4.1Å; Y1460-L1491 HydrophobicContact CD2-CD1 3.58Å; Y1460-L1491 HydrophobicContact CD2-CD2 3.55Å; Y1460-L1491 HydrophobicContact CD2-CG 3.73Å; Y1460-L1491 HydrophobicContact CE2-CD1 3.45Å; Y1460-L1491 VanDerWaalsContact CE2-CD1 3.45Å; Y1460-L1491 HydrophobicContact CE2-CD2 3.36Å; Y1460-L1491 HydrophobicContact CE2-CG 3.83Å; L1491-A1493 VanDerWaalsContact C-N 3.25Å; L1491-A1493 PolarHBondContact O-N 3.1Å; L1491-A1493 VanDerWaalsContact O-N 3.14Å; L1491-L1494 HydrophobicContact CB-CD1 4.41Å; L1491-L1494 HydrophobicContact CD2-CD1 4.19Å; L1491-L1494 VanDerWaalsContact O-CB 3.29Å; L1491-L1494 WeakPolarHBondContact O-CB 3.37Å; L1491-L1494 PolarHBondContact O-N 3.04Å; L1491-L1494 VanDerWaalsContact O-N 3.13Å; L1491-M1543 HydrophobicContact CD2-CE 3.66Å; L1491-M1543 VanDerWaalsContact CD2-CE 3.45Å; L1491-M1543 HydrophobicContact CD2-SD 3.62Å; L1491-M1543 VanDerWaalsContact CD2-SD 3.55Å; L1491-M1543 WeakPolarHBondContact CD2-SD 3.5Å
1492	S	83.8	Confident	77.3	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-34.5	-177.5	57.1	0	0	0	0	113.5	D1442 L1494 I1495 F1496	D1442-S1492 WeakPolarHBondContact CB-OG 3.44Å; D1442-S1492 VanDerWaalsContact CG-OG 3.29Å; D1442-S1492 WeakPolarHBondContact OD2-CB 3.21Å; D1442-S1492 PolarHBondContact OD2-OG 3.21Å; S1492-L1494 PolarHBondContact O-N 3.02Å; S1492-L1494 VanDerWaalsContact O-N 3.16Å; S1492-I1495 WeakPolarHBondContact O-CA 3.04Å; S1492-I1495 WeakPolarHBondContact O-CB 3.37Å; S1492-I1495 PolarHBondContact O-N 3.21Å; S1492-F1496 VanDerWaalsContact CB-CE2 3.49Å; S1492-F1496 VanDerWaalsContact O-CD2 3.26Å; S1492-F1496 WeakPolarHBondContact O-CD2 3.35Å; S1492-F1496 WeakPolarHBondContact O-CG 3.37Å; S1492-F1496 PolarHBondContact O-N 3.02Å
1493	A	81.8	Confident	78.3	Confident	5.8 Å²	5.8	22.3 Å²	22.3	5%	0.048	12%	0.122	C	C	.	.	H	α-helix	trans	-58.4	-27.1	177	0	0	0	0	0	113.6	L1491 I1495 F1496 S1497 L1502 Y1785	L1491-A1493 VanDerWaalsContact C-N 3.25Å; L1491-A1493 PolarHBondContact O-N 3.1Å; L1491-A1493 VanDerWaalsContact O-N 3.14Å; A1493-I1495 VanDerWaalsContact C-N 3.28Å; A1493-I1495 PolarHBondContact O-N 3.12Å; A1493-F1496 PolarHBondContact O-N 3.16Å; A1493-S1497 VanDerWaalsContact O-CB 3.29Å; A1493-S1497 WeakPolarHBondContact O-CB 3.44Å; A1493-S1497 PolarHBondContact O-N 3.24Å; A1493-S1497 VanDerWaalsContact O-N 3.08Å; A1493-L1502 HydrophobicContact CB-CD1 3.57Å; A1493-L1502 HydrophobicContact CB-CD2 4.32Å; A1493-Y1785 HydrophobicContact CB-CD1 4.37Å; A1493-Y1785 HydrophobicContact CB-CE1 3.66Å
1494	L	85.2	Confident	79.3	Confident	2.2 Å²	2.2	22.8 Å²	22.8	1%	0.012	13%	0.128	C	C	.	.	H	α-helix	trans	-68.8	-25.3	173.8	-67.1	172.9	0	0	0	112.9	I1321 L1491 S1492 G1500 L1502 M1543 L1545	I1321-L1494 HydrophobicContact CG2-CD1 4.13Å; L1491-L1494 HydrophobicContact CB-CD1 4.41Å; L1491-L1494 HydrophobicContact CD2-CD1 4.19Å; L1491-L1494 VanDerWaalsContact O-CB 3.29Å; L1491-L1494 WeakPolarHBondContact O-CB 3.37Å; L1491-L1494 PolarHBondContact O-N 3.04Å; L1491-L1494 VanDerWaalsContact O-N 3.13Å; S1492-L1494 PolarHBondContact O-N 3.02Å; S1492-L1494 VanDerWaalsContact O-N 3.16Å; L1494-G1500 VanDerWaalsContact CD2-O 3.29Å; L1494-G1500 WeakPolarHBondContact CD2-O 3.41Å; L1494-G1500 WeakPolarHBondContact O-CA 3.41Å; L1494-L1502 HydrophobicContact CD2-CB 4.17Å; L1494-M1543 HydrophobicContact CD1-CB 4.25Å; L1494-M1543 HydrophobicContact CD1-CE 4.45Å; L1494-M1543 HydrophobicContact CD2-CB 3.87Å; L1494-M1543 HydrophobicContact CG-CB 4.35Å; L1494-L1545 HydrophobicContact CB-CB 4.44Å; L1494-L1545 HydrophobicContact CD2-CB 4.46Å
1495	I	85.4	Confident	80.2	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-84.9	-40.4	177.3	-58.6	168.8	0	0	0	110.1	L1435 I1438 L1439 S1492 A1493 S1497 I1551 K1552 F1605	L1435-I1495 HydrophobicContact CD1-CD1 3.61Å; L1435-I1495 HydrophobicContact CD1-CG1 4.06Å; L1435-I1495 HydrophobicContact CD1-CG2 3.8Å; I1438-I1495 HydrophobicContact CB-CD1 3.74Å; I1438-I1495 HydrophobicContact CD1-CD1 4.21Å; I1438-I1495 HydrophobicContact CG2-CD1 3.33Å; I1438-I1495 HydrophobicContact CG2-CG1 4.14Å; L1439-I1495 HydrophobicContact CD2-CD1 4.19Å; L1439-I1495 HydrophobicContact CG-CD1 4.16Å; S1492-I1495 WeakPolarHBondContact O-CA 3.04Å; S1492-I1495 WeakPolarHBondContact O-CB 3.37Å; S1492-I1495 PolarHBondContact O-N 3.21Å; A1493-I1495 VanDerWaalsContact C-N 3.28Å; A1493-I1495 PolarHBondContact O-N 3.12Å; I1495-S1497 VanDerWaalsContact C-N 3.33Å; I1495-S1497 PolarHBondContact O-N 3.42Å; I1495-I1551 HydrophobicContact CD1-CG2 4.06Å; I1495-I1551 HydrophobicContact CG1-CG2 4.41Å; I1495-K1552 HydrophobicContact CG2-CG 4.41Å; I1495-K1552 WeakPolarHBondContact O-CE 3.39Å; I1495-K1552 PolarHBondContact O-NZ 3.03Å; I1495-F1605 HydrophobicContact CG2-CD2 4.3Å; I1495-F1605 HydrophobicContact CG2-CE2 3.34Å; I1495-F1605 HydrophobicContact CG2-CZ 3.53Å; I1495-F1605 VanDerWaalsContact CG2-CZ 3.48Å
1496	F	83.3	Confident	81	Confident	3.8 Å²	3.8	23.8 Å²	23.8	2%	0.017	13%	0.128	C	C	.	.	H	α-helix	trans	-74.5	-26.5	-178.4	-58.5	-49.4	0	0	0	113.3	L1439 S1492 A1493 W1586 I1588 F1605 Y1785 Y1789	L1439-F1496 HydrophobicContact CD2-CE1 4.25Å; L1439-F1496 HydrophobicContact CD2-CE2 4.35Å; L1439-F1496 HydrophobicContact CD2-CZ 3.76Å; S1492-F1496 VanDerWaalsContact CB-CE2 3.49Å; S1492-F1496 VanDerWaalsContact O-CD2 3.26Å; S1492-F1496 WeakPolarHBondContact O-CD2 3.35Å; S1492-F1496 WeakPolarHBondContact O-CG 3.37Å; S1492-F1496 PolarHBondContact O-N 3.02Å; A1493-F1496 PolarHBondContact O-N 3.16Å; F1496-W1586 HydrophobicContact CE2-CE3 4.33Å; F1496-W1586 HydrophobicContact CE2-CZ3 4.18Å; F1496-W1586 HydrophobicContact CZ-CD2 4.48Å; F1496-W1586 AromaticContact CZ-CE3 3.88Å; F1496-W1586 HydrophobicContact CZ-CE3 3.88Å; F1496-W1586 AromaticContact CZ-CZ3 3.91Å; F1496-W1586 HydrophobicContact CZ-CZ3 3.91Å; F1496-I1588 HydrophobicContact CE1-CD1 4.25Å; F1496-F1605 AromaticContact CD1-CE1 3.92Å; F1496-F1605 HydrophobicContact CD1-CE1 3.92Å; F1496-F1605 AromaticContact CD1-CZ 3.99Å; F1496-F1605 HydrophobicContact CD1-CZ 4Å; F1496-F1605 HydrophobicContact CE1-CE1 4.08Å; F1496-F1605 AromaticContact CE1-CZ 3.92Å; F1496-F1605 HydrophobicContact CE1-CZ 3.96Å; F1496-Y1785 HydrophobicContact CB-CD2 4.29Å; F1496-Y1785 HydrophobicContact CB-CG 4.32Å; F1496-Y1785 AromaticContact CD2-CD2 3.33Å; F1496-Y1785 HydrophobicContact CD2-CD2 3.33Å; F1496-Y1785 AromaticContact CD2-CE2 3.57Å; F1496-Y1785 HydrophobicContact CD2-CE2 3.57Å; F1496-Y1785 VanDerWaalsContact CD2-CE2 3.47Å; F1496-Y1785 AromaticContact CD2-CG 3.93Å; F1496-Y1785 HydrophobicContact CD2-CG 4.1Å; F1496-Y1785 AromaticContact CE2-CD2 3.87Å; F1496-Y1785 HydrophobicContact CE2-CD2 3.87Å; F1496-Y1785 AromaticContact CE2-CE2 3.87Å; F1496-Y1785 HydrophobicContact CE2-CE2 3.87Å; F1496-Y1785 AromaticContact CG-CD2 3.97Å; F1496-Y1785 HydrophobicContact CG-CD2 4.12Å; F1496-Y1785 HydrophobicContact CG-CG 4.5Å; F1496-Y1789 HydrophobicContact CB-CD2 4.17Å; F1496-Y1789 HydrophobicContact CB-CE2 4.15Å; F1496-Y1789 HydrophobicContact CD1-CD1 4.3Å; F1496-Y1789 AromaticContact CD1-CD2 3.35Å; F1496-Y1789 HydrophobicContact CD1-CD2 3.35Å; F1496-Y1789 VanDerWaalsContact CD1-CD2 3.48Å; F1496-Y1789 HydrophobicContact CD1-CE1 4.31Å; F1496-Y1789 AromaticContact CD1-CE2 3.65Å; F1496-Y1789 HydrophobicContact CD1-CE2 3.65Å; F1496-Y1789 AromaticContact CD1-CG 3.73Å; F1496-Y1789 HydrophobicContact CD1-CG 3.73Å; F1496-Y1789 HydrophobicContact CD2-CD2 4.15Å; F1496-Y1789 AromaticContact CE1-CD1 3.72Å; F1496-Y1789 HydrophobicContact CE1-CD1 4.06Å; F1496-Y1789 AromaticContact CE1-CD2 3.72Å; F1496-Y1789 HydrophobicContact CE1-CD2 3.72Å; F1496-Y1789 HydrophobicContact CE1-CE1 4.26Å; F1496-Y1789 HydrophobicContact CE1-CE2 4.33Å; F1496-Y1789 AromaticContact CE1-CG 3.57Å; F1496-Y1789 HydrophobicContact CE1-CG 3.57Å; F1496-Y1789 VanDerWaalsContact CE1-CG 3.47Å; F1496-Y1789 HydrophobicContact CE2-CD2 4.42Å; F1496-Y1789 AromaticContact CG-CD2 3.71Å; F1496-Y1789 HydrophobicContact CG-CD2 3.71Å; F1496-Y1789 AromaticContact CG-CE2 3.95Å; F1496-Y1789 HydrophobicContact CG-CE2 4.09Å; F1496-Y1789 HydrophobicContact CG-CG 4.33Å; F1496-Y1789 HydrophobicContact CZ-CD2 4.34Å; F1496-Y1789 AromaticContact CZ-CG 3.99Å; F1496-Y1789 HydrophobicContact CZ-CG 4.11Å
1497	S	81.5	Confident	81.5	Confident	6 Å²	6	24.7 Å²	24.7	4%	0.042	13%	0.131	C	C	.	.	S	Bend	trans	-64.4	135.1	168.8	175.3	0	0	0	0	110.9	A1493 I1495 H1499 G1500 N1501 E1722	A1493-S1497 VanDerWaalsContact O-CB 3.29Å; A1493-S1497 WeakPolarHBondContact O-CB 3.44Å; A1493-S1497 PolarHBondContact O-N 3.24Å; A1493-S1497 VanDerWaalsContact O-N 3.08Å; I1495-S1497 VanDerWaalsContact C-N 3.33Å; I1495-S1497 PolarHBondContact O-N 3.42Å; S1497-H1499 VanDerWaalsContact C-N 3.32Å; S1497-H1499 PolarHBondContact O-N 3.22Å; S1497-H1499 PolarHBondContact OG-N 3.02Å; S1497-G1500 PolarHBondContact O-N 3.28Å; S1497-G1500 PolarHBondContact OG-N 2.96Å; S1497-G1500 VanDerWaalsContact OG-N 3.1Å; S1497-N1501 PolarHBondContact OG-N 3.22Å; S1497-N1501 PolarHBondContact OG-O 3.17Å; S1497-E1722 VanDerWaalsContact CB-OE2 3.25Å; S1497-E1722 WeakPolarHBondContact CB-OE2 3.13Å; S1497-E1722 PolarHBondContact OG-OE1 3Å; S1497-E1722 PolarHBondContact OG-OE2 3.23Å
1498	S	74.7	Confident	81.9	Confident	35 Å²	35	25.2 Å²	25.2	25%	0.245	14%	0.135	C	C	.	.	S	Bend	trans	-68	-33.7	175.1	77.4	0	0	0	0	111.5	E1722	S1498-E1722 WeakPolarHBondContact CA-OE1 3.27Å; S1498-E1722 VanDerWaalsContact CB-OE1 3.29Å; S1498-E1722 WeakPolarHBondContact CB-OE1 3.45Å; S1498-E1722 PolarHBondContact N-OE1 3.23Å; S1498-E1722 VanDerWaalsContact N-OE1 3.1Å; S1498-E1722 PolarHBondContact OG-OE1 3.14Å
1499	H	77.2	Confident	82.2	Confident	128.8 Å²	128.8	24.3 Å²	24.3	60%	0.596	13%	0.132	S	C	*	.	S	Bend	trans	-92.8	-2.8	-179.4	-60.2	-53.2	0	0	0	114.3	S1497 N1501 E1722	S1497-H1499 VanDerWaalsContact C-N 3.32Å; S1497-H1499 PolarHBondContact O-N 3.22Å; S1497-H1499 PolarHBondContact OG-N 3.02Å; H1499-N1501 HydrophobicContact CB-CB 4.44Å; H1499-N1501 PolarHBondContact O-N 2.99Å; H1499-E1722 IonicContact CD2-OE1 3.41Å; H1499-E1722 PolarHBondContact CD2-OE1 2.99Å; H1499-E1722 VanDerWaalsContact CD2-OE1 3.31Å; H1499-E1722 IonicContact CD2-OE2 2.94Å; H1499-E1722 PolarHBondContact CD2-OE2 3.42Å; H1499-E1722 IonicContact CG-OE1 2.69Å; H1499-E1722 PolarHBondContact N-OE1 2.88Å; H1499-E1722 VanDerWaalsContact N-OE1 3.13Å; H1499-E1722 IonicContact NE2-OE1 3.65Å
1500	G	81	Confident	81.9	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.	S	Bend	trans	63.1	23	-177.2	0	0	0	0	0	114	L1494 S1497 R1544 L1545	L1494-G1500 VanDerWaalsContact CD2-O 3.29Å; L1494-G1500 WeakPolarHBondContact CD2-O 3.41Å; L1494-G1500 WeakPolarHBondContact O-CA 3.41Å; S1497-G1500 PolarHBondContact O-N 3.28Å; S1497-G1500 PolarHBondContact OG-N 2.96Å; S1497-G1500 VanDerWaalsContact OG-N 3.1Å; G1500-R1544 CarbonylContact O-C 3.59Å; G1500-R1544 WeakPolarHBondContact O-CA 3.33Å; G1500-L1545 PolarHBondContact O-N 3.13Å
1501	N	84.2	Confident	81.4	Confident	79.6 Å²	79.6	24.5 Å²	24.5	43%	0.426	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.4	-172.5	-158.9	24.3	0	0	0	110.6	S1497 H1499 M1543 R1544	S1497-N1501 PolarHBondContact OG-N 3.22Å; S1497-N1501 PolarHBondContact OG-O 3.17Å; H1499-N1501 HydrophobicContact CB-CB 4.44Å; H1499-N1501 PolarHBondContact O-N 2.99Å; N1501-M1543 PolarHBondContact OD1-O 2.85Å; N1501-R1544 VanDerWaalsContact OD1-CD 3.27Å; N1501-R1544 WeakPolarHBondContact OD1-CD 3.4Å; N1501-R1544 WeakPolarHBondContact OD1-CG 3.26Å; N1501-R1544 PolarHBondContact OD1-NE 3.25Å
1502	L	82.1	Confident	80.4	Confident	6.8 Å²	6.8	25.7 Å²	25.7	4%	0.036	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	113.4	174.5	-156.8	72.7	0	0	0	109.2	A1493 L1494 R1505 Y1507 M1543	A1493-L1502 HydrophobicContact CB-CD1 3.57Å; A1493-L1502 HydrophobicContact CB-CD2 4.32Å; L1494-L1502 HydrophobicContact CD2-CB 4.17Å; L1502-R1505 VanDerWaalsContact CD1-CZ 3.47Å; L1502-R1505 VanDerWaalsContact CD1-NH1 3.32Å; L1502-Y1507 VanDerWaalsContact CD2-OH 3.3Å; L1502-Y1507 WeakPolarHBondContact CD2-OH 3.39Å; L1502-M1543 HydrophobicContact CB-CB 4.03Å; L1502-M1543 WeakPolarHBondContact CB-O 3.15Å; L1502-M1543 HydrophobicContact CD2-CB 4.42Å; L1502-M1543 HydrophobicContact CD2-CG 4.39Å; L1502-M1543 HydrophobicContact CD2-SD 4.03Å; L1502-M1543 PolarHBondContact N-O 3.1Å; L1502-M1543 PolarHBondContact O-N 3.09Å; L1502-M1543 VanDerWaalsContact O-N 3.14Å
1503	P	82.4	Confident	79.1	Confident	69.8 Å²	69.8	28.4 Å²	28.4	45%	0.453	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	166.4	177.9	28	-34.8	0	0	0	111.4	R1505	P1503-R1505 WeakPolarHBondContact O-CG 3.31Å; P1503-R1505 PolarHBondContact O-N 3.17Å; P1503-R1505 VanDerWaalsContact O-N 3.14Å
1504	S	84.5	Confident	77.7	Confident	47.2 Å²	47.2	29.8 Å²	29.8	33%	0.33	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	110.4	-175.8	-162	0	0	0	0	112.1	N1326 Q1540 L1541	N1326-S1504 PolarHBondContact ND2-OG 2.93Å; S1504-Q1540 PolarHBondContact O-NE2 3.06Å; S1504-Q1540 VanDerWaalsContact OG-CG 3.25Å; S1504-Q1540 WeakPolarHBondContact OG-CG 3.33Å; S1504-Q1540 PolarHBondContact OG-NE2 2.93Å; S1504-Q1540 VanDerWaalsContact OG-NE2 3.07Å; S1504-L1541 CarbonylContact C-O 3.55Å; S1504-L1541 VanDerWaalsContact CA-O 3.29Å; S1504-L1541 WeakPolarHBondContact CA-O 3.35Å
1505	R	83.4	Confident	76.1	Confident	23.8 Å²	23.8	31.6 Å²	31.6	9%	0.09	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	151	-176.6	-72.3	175.3	-174.5	175.3	5	111.6	L1502 P1503 Y1507 Q1540 L1541 E1722 T1724	L1502-R1505 VanDerWaalsContact CD1-CZ 3.47Å; L1502-R1505 VanDerWaalsContact CD1-NH1 3.32Å; P1503-R1505 WeakPolarHBondContact O-CG 3.31Å; P1503-R1505 PolarHBondContact O-N 3.17Å; P1503-R1505 VanDerWaalsContact O-N 3.14Å; R1505-Y1507 HydrophobicContact CB-CE2 4.03Å; R1505-Y1507 VanDerWaalsContact O-CD2 3.32Å; R1505-Y1507 WeakPolarHBondContact O-CD2 3.34Å; R1505-Y1507 WeakPolarHBondContact O-CE2 3.27Å; R1505-Q1540 CarbonylContact O-C 3.53Å; R1505-Q1540 VanDerWaalsContact O-CA 3.3Å; R1505-Q1540 WeakPolarHBondContact O-CA 3.31Å; R1505-L1541 PolarHBondContact N-O 3.03Å; R1505-L1541 PolarHBondContact O-N 3.23Å; R1505-E1722 PolarHBondContact NH2-O 2.9Å; R1505-T1724 VanDerWaalsContact NH2-CG2 3.31Å; R1505-T1724 PolarHBondContact NH2-OG1 2.67Å
1506	W	86.5	Confident	74.2	Confident	44.2 Å²	44.2	33.9 Å²	33.9	17%	0.167	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	135.5	175.8	-70.7	100.8	0	0	0	111.2	Y1392 M1394 A1538 I1539 Q1540 Y1839 A1841	Y1392-W1506 HydrophobicContact CD2-CH2 4.43Å; Y1392-W1506 AromaticContact CE2-CH2 3.75Å; Y1392-W1506 HydrophobicContact CE2-CH2 3.75Å; Y1392-W1506 AromaticContact CE2-CZ2 3.69Å; Y1392-W1506 HydrophobicContact CE2-CZ2 3.87Å; M1394-W1506 HydrophobicContact CE-CH2 4.04Å; M1394-W1506 HydrophobicContact CE-CZ2 4.46Å; M1394-W1506 HydrophobicContact SD-CH2 4.35Å; W1506-A1538 HydrophobicContact CE3-CB 3.67Å; W1506-A1538 HydrophobicContact CZ3-CB 4.22Å; W1506-A1538 WeakPolarHBondContact CZ3-O 3.33Å; W1506-I1539 CarbonylContact C-O 3.43Å; W1506-I1539 WeakPolarHBondContact CA-O 3.3Å; W1506-I1539 VanDerWaalsContact CE3-C 3.44Å; W1506-Q1540 HydrophobicContact CD2-CB 3.95Å; W1506-Q1540 HydrophobicContact CD2-CG 3.95Å; W1506-Q1540 HydrophobicContact CE3-CB 3.85Å; W1506-Q1540 HydrophobicContact CE3-CG 4.36Å; W1506-Q1540 HydrophobicContact CG-CG 4.28Å; W1506-Q1540 HydrophobicContact CH2-CB 3.92Å; W1506-Q1540 HydrophobicContact CZ2-CB 4.02Å; W1506-Q1540 HydrophobicContact CZ2-CG 4.16Å; W1506-Q1540 HydrophobicContact CZ3-CB 3.84Å; W1506-Y1839 HydrophobicContact CB-CD1 3.8Å; W1506-Y1839 HydrophobicContact CB-CD2 3.62Å; W1506-Y1839 HydrophobicContact CB-CE1 4.13Å; W1506-Y1839 HydrophobicContact CB-CE2 3.96Å; W1506-Y1839 HydrophobicContact CB-CG 3.51Å; W1506-Y1839 VanDerWaalsContact CB-CG 3.48Å; W1506-Y1839 HydrophobicContact CG-CD1 4.34Å; W1506-Y1839 HydrophobicContact CG-CD2 4.38Å; W1506-Y1839 AromaticContact CG-CG 3.95Å; W1506-Y1839 HydrophobicContact CG-CG 3.95Å; W1506-A1841 HydrophobicContact CZ2-CB 4.23Å
1507	Y	84.9	Confident	72.4	Confident	22.2 Å²	22.2	40.1 Å²	40.1	9%	0.087	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	141.2	175.2	-64.6	-88.8	0	0	0	109.7	C1487 V1489 L1502 R1505 A1538 I1539 L1541	C1487-Y1507 VanDerWaalsContact SG-CB 3.56Å; C1487-Y1507 WeakPolarHBondContact SG-CB 3.38Å; V1489-Y1507 HydrophobicContact CB-CD1 4.4Å; V1489-Y1507 HydrophobicContact CB-CE1 4.38Å; V1489-Y1507 HydrophobicContact CG1-CD1 4.11Å; V1489-Y1507 HydrophobicContact CG1-CD2 4.46Å; V1489-Y1507 HydrophobicContact CG1-CE1 3.64Å; V1489-Y1507 VanDerWaalsContact CG1-CE1 3.47Å; V1489-Y1507 HydrophobicContact CG1-CE2 4.17Å; V1489-Y1507 HydrophobicContact CG1-CG 4.45Å; V1489-Y1507 VanDerWaalsContact CG1-CZ 3.47Å; V1489-Y1507 HydrophobicContact CG2-CD1 4.05Å; V1489-Y1507 HydrophobicContact CG2-CD2 4.19Å; V1489-Y1507 HydrophobicContact CG2-CE1 4.27Å; V1489-Y1507 HydrophobicContact CG2-CG 4.08Å; L1502-Y1507 VanDerWaalsContact CD2-OH 3.3Å; L1502-Y1507 WeakPolarHBondContact CD2-OH 3.39Å; R1505-Y1507 HydrophobicContact CB-CE2 4.03Å; R1505-Y1507 VanDerWaalsContact O-CD2 3.32Å; R1505-Y1507 WeakPolarHBondContact O-CD2 3.34Å; R1505-Y1507 WeakPolarHBondContact O-CE2 3.27Å; Y1507-A1538 CarbonylContact O-C 3.57Å; Y1507-A1538 VanDerWaalsContact O-CA 3.27Å; Y1507-A1538 WeakPolarHBondContact O-CA 3.3Å; Y1507-A1538 WeakPolarHBondContact O-CB 3.17Å; Y1507-I1539 PolarHBondContact N-O 3.09Å; Y1507-I1539 PolarHBondContact O-N 3.09Å; Y1507-L1541 HydrophobicContact CD2-CB 4.04Å; Y1507-L1541 HydrophobicContact CD2-CD1 3.96Å; Y1507-L1541 HydrophobicContact CD2-CG 4.11Å; Y1507-L1541 HydrophobicContact CE2-CB 3.95Å; Y1507-L1541 HydrophobicContact CE2-CD1 4.29Å; Y1507-L1541 HydrophobicContact CE2-CG 4.45Å; Y1507-L1541 HydrophobicContact CG-CD1 4.47Å
1508	P	82.7	Confident	70.6	Confident	14.8 Å²	14.8	47.1 Å²	47.1	10%	0.096	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	137.6	-172.2	31.6	-32.3	0	0	0	111.9	C1487 F1535 S1811 I1813 P1837 Y1839	C1487-P1508 WeakPolarHBondContact CA-O 3.32Å; C1487-P1508 VanDerWaalsContact CB-O 3.29Å; C1487-P1508 WeakPolarHBondContact CB-O 3.28Å; C1487-P1508 PolarHBondContact SG-O 3.14Å; C1487-P1508 VanDerWaalsContact SG-O 3.32Å; P1508-F1535 HydrophobicContact CB-CD1 3.74Å; P1508-F1535 HydrophobicContact CB-CD2 3.81Å; P1508-F1535 HydrophobicContact CB-CE1 3.69Å; P1508-F1535 HydrophobicContact CB-CE2 3.49Å; P1508-F1535 VanDerWaalsContact CB-CE2 3.44Å; P1508-F1535 HydrophobicContact CG-CE1 4.18Å; P1508-S1811 VanDerWaalsContact CD-CB 3.46Å; P1508-S1811 WeakPolarHBondContact CD-OG 3.15Å; P1508-S1811 VanDerWaalsContact CG-OG 3.27Å; P1508-S1811 WeakPolarHBondContact CG-OG 3.44Å; P1508-I1813 HydrophobicContact CB-CD1 3.28Å; P1508-I1813 HydrophobicContact CB-CG1 4.27Å; P1508-I1813 HydrophobicContact CG-CD1 3.66Å; P1508-I1813 HydrophobicContact CG-CG1 3.68Å; P1508-P1837 HydrophobicContact CB-CG 4.2Å; P1508-P1837 HydrophobicContact CG-CG 4.09Å; P1508-Y1839 HydrophobicContact CB-CE1 4.4Å; P1508-Y1839 WeakPolarHBondContact CB-OH 3.29Å; P1508-Y1839 VanDerWaalsContact CD-OH 3.27Å; P1508-Y1839 WeakPolarHBondContact CD-OH 3.25Å; P1508-Y1839 WeakPolarHBondContact CG-OH 3.42Å
1509	L	79	Confident	69.1	Low	5.4 Å²	5.4	51.3 Å²	51.3	3%	0.028	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	131.1	167.4	-71.1	168.4	0	0	0	109.5	M1331 S1486 C1487 F1535 S1536 G1537 I1539	M1331-L1509 HydrophobicContact CG-CD1 4.36Å; M1331-L1509 HydrophobicContact SD-CD1 4.2Å; S1486-L1509 CarbonylContact O-C 3.55Å; S1486-L1509 VanDerWaalsContact O-CA 3.27Å; S1486-L1509 WeakPolarHBondContact O-CA 3.23Å; C1487-L1509 HydrophobicContact CB-CD2 3.94Å; C1487-L1509 HydrophobicContact CB-CG 4.47Å; L1509-F1535 WeakPolarHBondContact O-CA 3.44Å; L1509-F1535 WeakPolarHBondContact O-CD2 3.24Å; L1509-S1536 WeakPolarHBondContact O-CB 3.35Å; L1509-S1536 PolarHBondContact O-N 2.96Å; L1509-S1536 PolarHBondContact O-OG 3.4Å; L1509-G1537 WeakPolarHBondContact CB-O 3.13Å; L1509-G1537 PolarHBondContact N-O 2.91Å; L1509-G1537 PolarHBondContact O-N 2.93Å; L1509-I1539 HydrophobicContact CD1-CG2 3.73Å; L1509-I1539 HydrophobicContact CD2-CG2 3.92Å; L1509-I1539 HydrophobicContact CG-CG2 3.86Å
1510	T	73.8	Confident	67.1	Low	4.6 Å²	4.6	48.2 Å²	48.2	3%	0.028	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.7	174.9	53.7	0	0	0	0	110.5	S1485 S1486 F1512 K1534 F1535 S1536 I1813 W1890	S1485-T1510 CarbonylContact C-O 3.54Å; S1485-T1510 WeakPolarHBondContact CA-O 3.3Å; S1485-T1510 WeakPolarHBondContact CB-O 3.4Å; S1486-T1510 PolarHBondContact N-O 2.97Å; S1486-T1510 PolarHBondContact O-N 3.07Å; S1486-T1510 PolarHBondContact O-OG1 3.08Å; S1486-T1510 VanDerWaalsContact O-OG1 3.1Å; S1486-T1510 PolarHBondContact OG-O 3.06Å; S1486-T1510 VanDerWaalsContact OG-O 3.09Å; T1510-F1512 WeakPolarHBondContact O-CE2 3.19Å; T1510-K1534 CarbonylContact C-O 3.53Å; T1510-K1534 VanDerWaalsContact CA-O 3.29Å; T1510-K1534 WeakPolarHBondContact CA-O 3.37Å; T1510-F1535 HydrophobicContact CG2-CD1 4.08Å; T1510-F1535 HydrophobicContact CG2-CE1 4.08Å; T1510-S1536 PolarHBondContact N-OG 3.33Å; T1510-I1813 HydrophobicContact CG2-CD1 3.63Å; T1510-I1813 HydrophobicContact CG2-CG1 4.32Å; T1510-W1890 HydrophobicContact CG2-CD2 4.21Å; T1510-W1890 HydrophobicContact CG2-CG 4.38Å
1511	S	68.8	Low	65.1	Low	8.6 Å²	8.6	57.4 Å²	57.4	6%	0.06	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	144.9	168.7	57.9	0	0	0	0	110.5	I1484 S1533 K1534 S1536	I1484-S1511 CarbonylContact O-C 2.84Å; I1484-S1511 WeakPolarHBondContact O-CA 3.41Å; I1484-S1511 VanDerWaalsContact O-CB 3.25Å; I1484-S1511 WeakPolarHBondContact O-CB 3.36Å; S1511-S1533 CarbonylContact O-C 3.52Å; S1511-S1533 WeakPolarHBondContact O-CA 3.39Å; S1511-S1533 VanDerWaalsContact O-CB 3.26Å; S1511-S1533 WeakPolarHBondContact O-CB 3.46Å; S1511-K1534 PolarHBondContact N-O 3.14Å; S1511-K1534 PolarHBondContact O-N 3.12Å; S1511-K1534 PolarHBondContact OG-O 3.09Å; S1511-S1536 VanDerWaalsContact CB-OG 3.24Å; S1511-S1536 WeakPolarHBondContact CB-OG 3.37Å; S1511-S1536 PolarHBondContact N-OG 3.1Å; S1511-S1536 PolarHBondContact OG-OG 3.04Å
1512	F	62.6	Low	63	Low	29.4 Å²	29.4	64.6 Å²	64.6	13%	0.129	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	133.4	176.4	-57.2	-79.8	0	0	0	109.9	K1337 Y1449 E1464 Q1465 L1483 I1484 S1486 T1510 W1531 Q1532 W1890 L1892	K1337-F1512 PolarHBondContact NZ-O 2.89Å; Y1449-F1512 HydrophobicContact CD1-CE1 4.43Å; Y1449-F1512 AromaticContact CE1-CE1 3.61Å; Y1449-F1512 HydrophobicContact CE1-CE1 3.61Å; Y1449-F1512 AromaticContact CE1-CZ 3.65Å; Y1449-F1512 HydrophobicContact CE1-CZ 3.65Å; E1464-F1512 HydrophobicContact CB-CD2 4.46Å; E1464-F1512 HydrophobicContact CB-CE2 4.19Å; E1464-F1512 HydrophobicContact CB-CZ 4.39Å; E1464-F1512 VanDerWaalsContact CD-CD2 3.43Å; E1464-F1512 HydrophobicContact CG-CD2 3.84Å; E1464-F1512 VanDerWaalsContact CG-CD2 3.48Å; E1464-F1512 HydrophobicContact CG-CE1 4.31Å; E1464-F1512 HydrophobicContact CG-CE2 3.78Å; E1464-F1512 HydrophobicContact CG-CG 3.94Å; E1464-F1512 HydrophobicContact CG-CZ 4.1Å; E1464-F1512 WeakPolarHBondContact OE1-CD1 3.32Å; E1464-F1512 WeakPolarHBondContact OE1-CD2 3.26Å; E1464-F1512 VanDerWaalsContact OE1-CE1 3.26Å; E1464-F1512 WeakPolarHBondContact OE1-CE1 3.3Å; E1464-F1512 WeakPolarHBondContact OE1-CG 3.23Å; E1464-F1512 VanDerWaalsContact OE2-CZ 3.3Å; E1464-F1512 WeakPolarHBondContact OE2-CZ 3.06Å; Q1465-F1512 PolarHBondContact NE2-O 3Å; Q1465-F1512 PolarHBondContact OE1-O 3.45Å; L1483-F1512 HydrophobicContact CD1-CD2 4.06Å; L1483-F1512 HydrophobicContact CD1-CE2 4.16Å; L1483-F1512 HydrophobicContact CD2-CD2 4.29Å; I1484-F1512 WeakPolarHBondContact O-CD2 3.3Å; I1484-F1512 PolarHBondContact O-N 2.84Å; S1486-F1512 WeakPolarHBondContact OG-CE2 3.2Å; T1510-F1512 WeakPolarHBondContact O-CE2 3.19Å; F1512-W1531 HydrophobicContact CB-CE3 3.97Å; F1512-W1531 HydrophobicContact CB-CZ3 4.11Å; F1512-Q1532 CarbonylContact C-O 3.53Å; F1512-Q1532 WeakPolarHBondContact CA-O 3.1Å; F1512-W1890 AromaticContact CE1-CD1 3.95Å; F1512-W1890 AromaticContact CE1-CE2 3.91Å; F1512-W1890 HydrophobicContact CE1-CE3 4.04Å; F1512-W1890 HydrophobicContact CE1-CZ2 4.24Å; F1512-W1890 HydrophobicContact CE1-CZ3 4.38Å; F1512-W1890 AromaticContact CE1-NE1 3.17Å; F1512-W1890 AromaticContact CZ-CE3 3.76Å; F1512-W1890 HydrophobicContact CZ-CE3 3.76Å; F1512-W1890 AromaticContact CZ-CZ2 3.89Å; F1512-W1890 HydrophobicContact CZ-CZ2 3.89Å; F1512-W1890 AromaticContact CZ-CZ3 3.74Å; F1512-W1890 HydrophobicContact CZ-CZ3 3.74Å; F1512-W1890 AromaticContact CZ-NE1 3.72Å; F1512-L1892 HydrophobicContact CD1-CD1 3.94Å; F1512-L1892 HydrophobicContact CE1-CD1 4.18Å
1513	I	56.6	Low	60.7	Low	56.8 Å²	56.8	67.9 Å²	67.9	29%	0.291	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	127.9	179.6	-57.6	168.6	0	0	0	107	V1515 W1531 Q1532 K1534	I1513-V1515 PolarHBondContact O-N 3.24Å; I1513-W1531 WeakPolarHBondContact O-CA 3.49Å; I1513-Q1532 PolarHBondContact N-O 3.4Å; I1513-Q1532 PolarHBondContact O-N 3.08Å; I1513-Q1532 VanDerWaalsContact O-N 3.14Å; I1513-K1534 HydrophobicContact CD1-CB 4.27Å; I1513-K1534 HydrophobicContact CD1-CD 3.98Å
1514	N	52.5	Low	58.6	Low	36.6 Å²	36.6	71.9 Å²	71.9	20%	0.196	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	120.9	165.5	-170.8	17.8	0	0	0	107.7	D1516 D1517 I1529 W1531	N1514-D1516 VanDerWaalsContact C-N 3.33Å; N1514-D1516 PolarHBondContact ND2-OD2 3.15Å; N1514-D1516 VanDerWaalsContact ND2-OD2 3.12Å; N1514-D1516 PolarHBondContact O-N 3.35Å; N1514-D1516 PolarHBondContact OD1-N 2.83Å; N1514-D1516 PolarHBondContact OD1-OD2 2.98Å; N1514-D1517 PolarHBondContact ND2-OD1 3.26Å; N1514-I1529 VanDerWaalsContact OD1-CG2 3.27Å; N1514-I1529 WeakPolarHBondContact OD1-CG2 3.33Å; N1514-W1531 HydrophobicContact CB-CE3 4.44Å; N1514-W1531 HydrophobicContact CB-CH2 4.23Å; N1514-W1531 HydrophobicContact CB-CZ3 4.32Å
1515	V	51.4	Low	56.3	Low	39.2 Å²	39.2	77 Å²	77	24%	0.238	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-73	-22.2	-175.4	177.1	0	0	0	0	111.7	I1513 D1517 D1518 I1519 S1530 Q1532	I1513-V1515 PolarHBondContact O-N 3.24Å; V1515-D1517 VanDerWaalsContact C-N 3.3Å; V1515-D1517 PolarHBondContact O-N 3.23Å; V1515-D1517 VanDerWaalsContact O-N 3.15Å; V1515-D1518 PolarHBondContact O-N 3.25Å; V1515-I1519 HydrophobicContact CG1-CD1 4.1Å; V1515-I1519 HydrophobicContact CG1-CG1 4.34Å; V1515-S1530 WeakPolarHBondContact CB-O 3.29Å; V1515-S1530 WeakPolarHBondContact CB-OG 3.37Å; V1515-S1530 WeakPolarHBondContact CG2-O 3.36Å; V1515-S1530 PolarHBondContact N-O 2.8Å; V1515-S1530 VanDerWaalsContact N-O 3.12Å; V1515-Q1532 HydrophobicContact CG2-CB 4.18Å; V1515-Q1532 HydrophobicContact CG2-CG 3.65Å
1516	D	46.2	Very low	54.1	Low	49.6 Å²	49.6	83.6 Å²	83.6	27%	0.265	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-71.1	-19.9	-173.2	-60.9	-13.6	0	0	0	113.5	N1514 D1518 I1519 S1527 I1529 S1530	N1514-D1516 VanDerWaalsContact C-N 3.33Å; N1514-D1516 PolarHBondContact ND2-OD2 3.15Å; N1514-D1516 VanDerWaalsContact ND2-OD2 3.12Å; N1514-D1516 PolarHBondContact O-N 3.35Å; N1514-D1516 PolarHBondContact OD1-N 2.83Å; N1514-D1516 PolarHBondContact OD1-OD2 2.98Å; D1516-D1518 VanDerWaalsContact C-N 3.29Å; D1516-D1518 PolarHBondContact O-N 3.2Å; D1516-I1519 PolarHBondContact O-N 3.11Å; D1516-I1519 VanDerWaalsContact O-N 3.16Å; D1516-S1527 VanDerWaalsContact OD2-CB 3.28Å; D1516-S1527 WeakPolarHBondContact OD2-CB 3.36Å; D1516-S1527 PolarHBondContact OD2-OG 2.9Å; D1516-I1529 WeakPolarHBondContact OD2-CA 3.35Å; D1516-S1530 PolarHBondContact OD1-N 2.96Å; D1516-S1530 PolarHBondContact OD1-OG 3.18Å; D1516-S1530 VanDerWaalsContact OD1-OG 3.14Å
1517	D	45.4	Very low	51.6	Low	132.8 Å²	132.8	85.6 Å²	85.6	71%	0.71	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-66.7	-26.9	-179.7	-72	-26.5	0	0	0	113.1	N1514 V1515	N1514-D1517 PolarHBondContact ND2-OD1 3.26Å; V1515-D1517 VanDerWaalsContact C-N 3.3Å; V1515-D1517 PolarHBondContact O-N 3.23Å; V1515-D1517 VanDerWaalsContact O-N 3.15Å
1518	D	43.7	Very low	49.5	Very low	154 Å²	154	90.3 Å²	90.3	82%	0.824	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-87.1	-12.6	179.4	-79.5	-29.1	0	0	0	113.3	V1515 D1516 G1520	V1515-D1518 PolarHBondContact O-N 3.25Å; D1516-D1518 VanDerWaalsContact C-N 3.29Å; D1516-D1518 PolarHBondContact O-N 3.2Å; D1518-G1520 PolarHBondContact O-N 2.93Å
1519	I	41.7	Very low	47.4	Very low	123.6 Å²	123.6	94 Å²	94	63%	0.634	51%	0.514	S	S	*	.	S	Bend	trans	-102.3	44.2	-177.6	-47.7	178.6	0	0	0	110.4	V1515 D1516 K1521	V1515-I1519 HydrophobicContact CG1-CD1 4.1Å; V1515-I1519 HydrophobicContact CG1-CG1 4.34Å; D1516-I1519 PolarHBondContact O-N 3.11Å; D1516-I1519 VanDerWaalsContact O-N 3.16Å; I1519-K1521 PolarHBondContact O-N 3.35Å
1520	G	36.4	Very low	45.8	Very low	62.2 Å²	62.2	96.2 Å²	96.2	64%	0.641	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	99.4	177.9	0	0	0	0	0	114.1	D1518 Y1522	D1518-G1520 PolarHBondContact O-N 2.93Å; G1520-Y1522 PolarHBondContact O-N 3.25Å; G1520-Y1522 VanDerWaalsContact O-N 3.11Å
1521	K	38.1	Very low	44.6	Very low	194.8 Å²	194.8	100.3 Å²	100.3	85%	0.847	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	155	21.3	153	-92.9	167.2	-173.4	173.5	0	118.7	I1519	I1519-K1521 PolarHBondContact O-N 3.35Å
1522	Y	40.7	Very low	43.9	Very low	229.8 Å²	229.8	103.2 Å²	103.2	90%	0.901	56%	0.558	S	S	*	*			trans	-130.1	112.9	163.1	-80.1	-80.2	0	0	0	110.1	G1520 D1524	G1520-Y1522 PolarHBondContact O-N 3.25Å; G1520-Y1522 VanDerWaalsContact O-N 3.11Å; Y1522-D1524 PolarHBondContact O-N 3.08Å
1523	G	34.6	Very low	44	Very low	75.6 Å²	75.6	102.7 Å²	102.7	78%	0.779	56%	0.558	S	S	*	*			trans	-73.8	123.2	173.3	0	0	0	0	0	112.2	D1525	G1523-D1525 PolarHBondContact O-N 3.46Å
1524	D	37	Very low	44.6	Very low	154.6 Å²	154.6	102.7 Å²	102.7	83%	0.827	56%	0.556	S	S	*	*			trans	-137.2	124.3	151.7	-102.2	-29.6	0	0	0	108	Y1522 N1526	Y1522-D1524 PolarHBondContact O-N 3.08Å; D1524-N1526 VanDerWaalsContact C-N 3.31Å; D1524-N1526 PolarHBondContact O-N 3.24Å
1525	D	36.4	Very low	45.7	Very low	155.4 Å²	155.4	102.6 Å²	102.6	83%	0.831	55%	0.554	S	S	*	*	S	Bend	trans	-83.2	97.6	-174	-70.6	-40.4	0	0	0	113.2	G1523 S1527	G1523-D1525 PolarHBondContact O-N 3.46Å; D1525-S1527 PolarHBondContact O-N 3.37Å
1526	N	37.2	Very low	46.7	Very low	160.4 Å²	160.4	101 Å²	101	86%	0.858	54%	0.544	S	S	*	.			trans	129.3	35.1	170.3	-75.4	-51.1	0	0	0	117.2	D1524 L1528	D1524-N1526 VanDerWaalsContact C-N 3.31Å; D1524-N1526 PolarHBondContact O-N 3.24Å; N1526-L1528 PolarHBondContact O-N 3.24Å
1527	S	34.8	Very low	48.3	Very low	86.8 Å²	86.8	98.8 Å²	98.8	61%	0.607	53%	0.534	S	S	*	.			trans	-69.9	119.3	175.9	60.5	0	0	0	0	111.5	D1516 D1525 I1529	D1516-S1527 VanDerWaalsContact OD2-CB 3.28Å; D1516-S1527 WeakPolarHBondContact OD2-CB 3.36Å; D1516-S1527 PolarHBondContact OD2-OG 2.9Å; D1525-S1527 PolarHBondContact O-N 3.37Å; S1527-I1529 PolarHBondContact O-N 2.89Å; S1527-I1529 VanDerWaalsContact O-N 3.11Å
1528	L	39.2	Very low	50.2	Low	121.4 Å²	121.4	92.7 Å²	92.7	64%	0.636	50%	0.502	S	S	*	.			trans	-63.5	110.3	173.2	-94.7	113.1	0	0	0	109.4	N1526 S1530 V1897	N1526-L1528 PolarHBondContact O-N 3.24Å; L1528-S1530 WeakPolarHBondContact O-CA 3.34Å; L1528-S1530 WeakPolarHBondContact O-CB 3.23Å; L1528-S1530 PolarHBondContact O-N 3.19Å; L1528-V1897 HydrophobicContact CD2-CG2 4.46Å
1529	I	40.4	Very low	52.2	Low	91.6 Å²	91.6	85.5 Å²	85.5	47%	0.47	46%	0.463	S	S	.	.			trans	-50.4	104.7	177.8	-55.8	171.4	0	0	0	109.6	N1514 D1516 S1527 W1531	N1514-I1529 VanDerWaalsContact OD1-CG2 3.27Å; N1514-I1529 WeakPolarHBondContact OD1-CG2 3.33Å; D1516-I1529 WeakPolarHBondContact OD2-CA 3.35Å; S1527-I1529 PolarHBondContact O-N 2.89Å; S1527-I1529 VanDerWaalsContact O-N 3.11Å; I1529-W1531 VanDerWaalsContact C-N 3.32Å; I1529-W1531 HydrophobicContact CG2-CD2 4.41Å; I1529-W1531 HydrophobicContact CG2-CG 4.42Å; I1529-W1531 HydrophobicContact CG2-CZ2 4.21Å; I1529-W1531 PolarHBondContact O-N 3.21Å; I1529-W1531 VanDerWaalsContact O-N 3.16Å
1530	S	44.1	Very low	54.4	Low	51.4 Å²	51.4	81.2 Å²	81.2	36%	0.359	44%	0.44	S	S	.	.			trans	-96.8	94.4	-175.3	68.5	0	0	0	0	110.4	V1515 D1516 L1528 Q1532	V1515-S1530 WeakPolarHBondContact CB-O 3.29Å; V1515-S1530 WeakPolarHBondContact CB-OG 3.37Å; V1515-S1530 WeakPolarHBondContact CG2-O 3.36Å; V1515-S1530 PolarHBondContact N-O 2.8Å; V1515-S1530 VanDerWaalsContact N-O 3.12Å; D1516-S1530 PolarHBondContact OD1-N 2.96Å; D1516-S1530 PolarHBondContact OD1-OG 3.18Å; D1516-S1530 VanDerWaalsContact OD1-OG 3.14Å; L1528-S1530 WeakPolarHBondContact O-CA 3.34Å; L1528-S1530 WeakPolarHBondContact O-CB 3.23Å; L1528-S1530 PolarHBondContact O-N 3.19Å; S1530-Q1532 PolarHBondContact O-N 3.21Å; S1530-Q1532 VanDerWaalsContact O-N 3.15Å
1531	W	48.4	Very low	56.9	Low	90.8 Å²	90.8	78.3 Å²	78.3	34%	0.344	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	126.2	174.8	-67.8	91.1	0	0	0	110.5	Q1465 Q1466 S1467 F1512 I1513 N1514 I1529 L1892	Q1465-W1531 VanDerWaalsContact CD-CH2 3.43Å; Q1465-W1531 HydrophobicContact CG-CH2 4.39Å; Q1466-W1531 HydrophobicContact CG-CH2 4.44Å; Q1466-W1531 HydrophobicContact CG-CZ2 3.47Å; Q1466-W1531 VanDerWaalsContact CG-CZ2 3.47Å; S1467-W1531 WeakPolarHBondContact OG-CH2 3.07Å; F1512-W1531 HydrophobicContact CB-CE3 3.97Å; F1512-W1531 HydrophobicContact CB-CZ3 4.11Å; I1513-W1531 WeakPolarHBondContact O-CA 3.49Å; N1514-W1531 HydrophobicContact CB-CE3 4.44Å; N1514-W1531 HydrophobicContact CB-CH2 4.23Å; N1514-W1531 HydrophobicContact CB-CZ3 4.32Å; I1529-W1531 VanDerWaalsContact C-N 3.32Å; I1529-W1531 HydrophobicContact CG2-CD2 4.41Å; I1529-W1531 HydrophobicContact CG2-CG 4.42Å; I1529-W1531 HydrophobicContact CG2-CZ2 4.21Å; I1529-W1531 PolarHBondContact O-N 3.21Å; I1529-W1531 VanDerWaalsContact O-N 3.16Å; W1531-L1892 HydrophobicContact CB-CD1 3.9Å; W1531-L1892 VanDerWaalsContact O-CD1 3.27Å; W1531-L1892 WeakPolarHBondContact O-CD1 3.11Å
1532	Q	55.6	Low	59.3	Low	70.8 Å²	70.8	70.3 Å²	70.3	33%	0.331	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	134.4	166	-83.7	-174.6	28.3	0	0	109.3	F1512 I1513 V1515 S1530 K1534 W1816 N1818 H1887	F1512-Q1532 CarbonylContact C-O 3.53Å; F1512-Q1532 WeakPolarHBondContact CA-O 3.1Å; I1513-Q1532 PolarHBondContact N-O 3.4Å; I1513-Q1532 PolarHBondContact O-N 3.08Å; I1513-Q1532 VanDerWaalsContact O-N 3.14Å; V1515-Q1532 HydrophobicContact CG2-CB 4.18Å; V1515-Q1532 HydrophobicContact CG2-CG 3.65Å; S1530-Q1532 PolarHBondContact O-N 3.21Å; S1530-Q1532 VanDerWaalsContact O-N 3.15Å; Q1532-K1534 VanDerWaalsContact OE1-CE 3.31Å; Q1532-W1816 HydrophobicContact CG-CH2 4.25Å; Q1532-N1818 PolarHBondContact OE1-ND2 2.68Å; Q1532-N1818 PolarHBondContact OE1-OD1 3.35Å; Q1532-H1887 PolarHBondContact NE2-ND1 2.89Å; Q1532-H1887 VanDerWaalsContact NE2-ND1 3.19Å
1533	S	64.2	Low	61.7	Low	18.4 Å²	18.4	59.5 Å²	59.5	13%	0.129	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	135.9	169	68.2	0	0	0	0	110.5	S1511 W1816 L1888 W1890	S1511-S1533 CarbonylContact O-C 3.52Å; S1511-S1533 WeakPolarHBondContact O-CA 3.39Å; S1511-S1533 VanDerWaalsContact O-CB 3.26Å; S1511-S1533 WeakPolarHBondContact O-CB 3.46Å; S1533-W1816 VanDerWaalsContact O-CH2 3.29Å; S1533-W1816 WeakPolarHBondContact O-CH2 2.95Å; S1533-W1816 WeakPolarHBondContact O-CZ2 3.15Å; S1533-L1888 PolarHBondContact N-O 2.91Å; S1533-L1888 WeakPolarHBondContact O-CB 3.21Å; S1533-L1888 VanDerWaalsContact OG-C 3.23Å; S1533-L1888 PolarHBondContact OG-O 2.78Å; S1533-W1890 WeakPolarHBondContact OG-CA 3.42Å; S1533-W1890 WeakPolarHBondContact OG-CB 3.1Å; S1533-W1890 PolarHBondContact OG-N 2.98Å; S1533-W1890 PolarHBondContact OG-O 3.09Å
1534	K	68.2	Low	64.3	Low	56.8 Å²	56.8	62.4 Å²	62.4	25%	0.247	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	139.7	179.5	-159.1	179.3	177.3	171.2	0	110.8	F1333 T1510 S1511 I1513 Q1532 S1536 D1848 L1888	F1333-K1534 HydrophobicContact CE1-CD 4.49Å; T1510-K1534 CarbonylContact C-O 3.53Å; T1510-K1534 VanDerWaalsContact CA-O 3.29Å; T1510-K1534 WeakPolarHBondContact CA-O 3.37Å; S1511-K1534 PolarHBondContact N-O 3.14Å; S1511-K1534 PolarHBondContact O-N 3.12Å; S1511-K1534 PolarHBondContact OG-O 3.09Å; I1513-K1534 HydrophobicContact CD1-CB 4.27Å; I1513-K1534 HydrophobicContact CD1-CD 3.98Å; Q1532-K1534 VanDerWaalsContact OE1-CE 3.31Å; K1534-S1536 PolarHBondContact O-N 3.28Å; K1534-S1536 PolarHBondContact O-OG 3.05Å; K1534-D1848 WeakPolarHBondContact CE-OD1 3.38Å; K1534-D1848 WeakPolarHBondContact CE-OD2 3.48Å; K1534-D1848 IonicContact NZ-OD1 2.67Å; K1534-D1848 IonicContact NZ-OD2 2.77Å; K1534-D1848 PolarHBondContact NZ-OD2 3.29Å; K1534-L1888 CarbonylContact C-O 3.57Å; K1534-L1888 WeakPolarHBondContact CA-O 3.26Å
1535	F	76.1	Confident	66.7	Low	35.4 Å²	35.4	55.2 Å²	55.2	16%	0.155	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	126.7	171.8	-139.3	-100.8	0	0	0	110.7	P1508 L1509 T1510 G1537 I1813 P1837 Y1839 F1846 D1848 W1850 L1888	P1508-F1535 HydrophobicContact CB-CD1 3.74Å; P1508-F1535 HydrophobicContact CB-CD2 3.81Å; P1508-F1535 HydrophobicContact CB-CE1 3.69Å; P1508-F1535 HydrophobicContact CB-CE2 3.49Å; P1508-F1535 VanDerWaalsContact CB-CE2 3.44Å; P1508-F1535 HydrophobicContact CG-CE1 4.18Å; L1509-F1535 WeakPolarHBondContact O-CA 3.44Å; L1509-F1535 WeakPolarHBondContact O-CD2 3.24Å; T1510-F1535 HydrophobicContact CG2-CD1 4.08Å; T1510-F1535 HydrophobicContact CG2-CE1 4.08Å; F1535-G1537 WeakPolarHBondContact CE2-O 3.45Å; F1535-I1813 HydrophobicContact CD1-CD1 4.41Å; F1535-I1813 HydrophobicContact CD2-CD1 4.13Å; F1535-I1813 HydrophobicContact CE1-CD1 3.39Å; F1535-I1813 HydrophobicContact CZ-CB 4.48Å; F1535-I1813 HydrophobicContact CZ-CD1 3.81Å; F1535-I1813 HydrophobicContact CZ-CG2 3.91Å; F1535-P1837 HydrophobicContact CD1-CB 4.48Å; F1535-P1837 HydrophobicContact CD1-CG 4.26Å; F1535-P1837 HydrophobicContact CE1-CB 4.26Å; F1535-P1837 HydrophobicContact CE1-CG 3.52Å; F1535-P1837 HydrophobicContact CE2-CB 4.38Å; F1535-P1837 HydrophobicContact CE2-CG 4.45Å; F1535-P1837 HydrophobicContact CZ-CB 4.12Å; F1535-P1837 HydrophobicContact CZ-CG 3.65Å; F1535-Y1839 HydrophobicContact CE2-CE1 4.37Å; F1535-Y1839 HydrophobicContact CZ-CE1 4.23Å; F1535-F1846 HydrophobicContact CE1-CB 3.75Å; F1535-F1846 AromaticContact CE1-CD2 3.89Å; F1535-F1846 HydrophobicContact CE1-CD2 3.89Å; F1535-F1846 HydrophobicContact CE1-CG 4.13Å; F1535-F1846 HydrophobicContact CZ-CB 4.24Å; F1535-F1846 AromaticContact CZ-CD2 3.71Å; F1535-F1846 HydrophobicContact CZ-CD2 3.71Å; F1535-F1846 HydrophobicContact CZ-CE2 4.37Å; F1535-F1846 HydrophobicContact CZ-CG 4.27Å; F1535-D1848 WeakPolarHBondContact CA-OD1 3.38Å; F1535-D1848 WeakPolarHBondContact CB-OD1 3.5Å; F1535-D1848 PolarHBondContact N-OD1 2.96Å; F1535-W1850 HydrophobicContact CE2-CB 4.48Å; F1535-L1888 HydrophobicContact CB-CB 3.59Å; F1535-L1888 HydrophobicContact CB-CD1 4.17Å; F1535-L1888 WeakPolarHBondContact CB-O 3.26Å; F1535-L1888 HydrophobicContact CD1-CD1 3.85Å; F1535-L1888 HydrophobicContact CD2-CD1 3.49Å; F1535-L1888 VanDerWaalsContact CD2-CD1 3.49Å; F1535-L1888 HydrophobicContact CE1-CD1 4.36Å; F1535-L1888 HydrophobicContact CE2-CD1 3.38Å; F1535-L1888 HydrophobicContact CE2-CD2 3.72Å; F1535-L1888 HydrophobicContact CE2-CG 4.2Å; F1535-L1888 HydrophobicContact CG-CB 4.26Å; F1535-L1888 HydrophobicContact CG-CD1 4.16Å; F1535-L1888 HydrophobicContact CZ-CD1 4.37Å; F1535-L1888 HydrophobicContact CZ-CD2 4.21Å; F1535-L1888 PolarHBondContact N-O 2.86Å
1536	S	71.5	Confident	68.7	Low	4.8 Å²	4.8	50.2 Å²	50.2	3%	0.034	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	-9.9	-162.9	-113.8	0	0	0	0	114	G1330 M1331 S1334 S1485 L1509 T1510 S1511 K1534	G1330-S1536 VanDerWaalsContact O-O 3.09Å; M1331-S1536 WeakPolarHBondContact CA-O 3.27Å; S1334-S1536 WeakPolarHBondContact CB-OG 3.36Å; S1334-S1536 VanDerWaalsContact OG-CA 3.3Å; S1334-S1536 WeakPolarHBondContact OG-CA 3.29Å; S1334-S1536 WeakPolarHBondContact OG-CB 3.36Å; S1334-S1536 PolarHBondContact OG-O 3.31Å; S1334-S1536 PolarHBondContact OG-OG 3.19Å; S1485-S1536 WeakPolarHBondContact CB-OG 3.35Å; S1485-S1536 PolarHBondContact OG-OG 3.42Å; L1509-S1536 WeakPolarHBondContact O-CB 3.35Å; L1509-S1536 PolarHBondContact O-N 2.96Å; L1509-S1536 PolarHBondContact O-OG 3.4Å; T1510-S1536 PolarHBondContact N-OG 3.33Å; S1511-S1536 VanDerWaalsContact CB-OG 3.24Å; S1511-S1536 WeakPolarHBondContact CB-OG 3.37Å; S1511-S1536 PolarHBondContact N-OG 3.1Å; S1511-S1536 PolarHBondContact OG-OG 3.04Å; K1534-S1536 PolarHBondContact O-N 3.28Å; K1534-S1536 PolarHBondContact O-OG 3.05Å
1537	G	80	Confident	70.7	Confident	4.2 Å²	4.2	46.7 Å²	46.7	4%	0.043	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.3	-168.1	-175.1	0	0	0	0	0	110.7	S1329 L1509 F1535	S1329-G1537 CarbonylContact O-C 3.55Å; S1329-G1537 VanDerWaalsContact O-CA 3.27Å; S1329-G1537 WeakPolarHBondContact O-CA 3.42Å; L1509-G1537 WeakPolarHBondContact CB-O 3.13Å; L1509-G1537 PolarHBondContact N-O 2.91Å; L1509-G1537 PolarHBondContact O-N 2.93Å; F1535-G1537 WeakPolarHBondContact CE2-O 3.45Å
1538	A	85.6	Confident	72.7	Confident	4.8 Å²	4.8	43.1 Å²	43.1	4%	0.04	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	150.5	176.2	0	0	0	0	0	111.5	I1328 S1329 W1506 Y1507 Y1839 F1846	I1328-A1538 WeakPolarHBondContact CA-O 3.21Å; S1329-A1538 PolarHBondContact N-O 3.28Å; S1329-A1538 PolarHBondContact O-N 3.09Å; W1506-A1538 HydrophobicContact CE3-CB 3.67Å; W1506-A1538 HydrophobicContact CZ3-CB 4.22Å; W1506-A1538 WeakPolarHBondContact CZ3-O 3.33Å; Y1507-A1538 CarbonylContact O-C 3.57Å; Y1507-A1538 VanDerWaalsContact O-CA 3.27Å; Y1507-A1538 WeakPolarHBondContact O-CA 3.3Å; Y1507-A1538 WeakPolarHBondContact O-CB 3.17Å; A1538-Y1839 HydrophobicContact CB-CD1 3.52Å; A1538-Y1839 VanDerWaalsContact CB-CD1 3.45Å; A1538-Y1839 HydrophobicContact CB-CE1 3.6Å; A1538-F1846 HydrophobicContact CB-CE2 3.7Å; A1538-F1846 HydrophobicContact CB-CZ 4.03Å
1539	I	85.7	Confident	74.6	Confident	2.6 Å²	2.6	42.8 Å²	42.8	1%	0.013	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	144.8	171.8	62.1	178.5	0	0	0	110.1	L1325 G1327 I1328 Y1460 N1462 C1487 W1506 Y1507 L1509 L1541	L1325-I1539 HydrophobicContact CD1-CB 3.98Å; L1325-I1539 HydrophobicContact CD1-CG2 4.38Å; G1327-I1539 CarbonylContact O-C 3.54Å; G1327-I1539 WeakPolarHBondContact O-CA 3.3Å; I1328-I1539 HydrophobicContact CD1-CG2 4.29Å; I1328-I1539 HydrophobicContact CG1-CB 4.42Å; I1328-I1539 HydrophobicContact CG1-CG2 3.91Å; Y1460-I1539 HydrophobicContact CE1-CD1 4.2Å; N1462-I1539 WeakPolarHBondContact ND2-CD1 3.18Å; C1487-I1539 HydrophobicContact CB-CD1 3.97Å; C1487-I1539 HydrophobicContact CB-CG1 4.34Å; W1506-I1539 CarbonylContact C-O 3.43Å; W1506-I1539 WeakPolarHBondContact CA-O 3.3Å; W1506-I1539 VanDerWaalsContact CE3-C 3.44Å; Y1507-I1539 PolarHBondContact N-O 3.09Å; Y1507-I1539 PolarHBondContact O-N 3.09Å; L1509-I1539 HydrophobicContact CD1-CG2 3.73Å; L1509-I1539 HydrophobicContact CD2-CG2 3.92Å; L1509-I1539 HydrophobicContact CG-CG2 3.86Å; I1539-L1541 HydrophobicContact CD1-CD1 3.88Å; I1539-L1541 HydrophobicContact CD1-CD2 4.22Å; I1539-L1541 HydrophobicContact CD1-CG 4.07Å; I1539-L1541 HydrophobicContact CG1-CD1 4.4Å; I1539-L1541 HydrophobicContact CG1-CG 4.22Å
1540	Q	88.8	Confident	76.4	Confident	32 Å²	32	41.8 Å²	41.8	15%	0.15	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	121.5	174	-151.5	-172.2	6.3	0	0	109.5	N1326 G1327 S1504 R1505 W1506	N1326-Q1540 HydrophobicContact CB-CB 4.37Å; N1326-Q1540 PolarHBondContact N-O 3.12Å; G1327-Q1540 PolarHBondContact N-O 3.15Å; G1327-Q1540 PolarHBondContact O-N 2.8Å; S1504-Q1540 PolarHBondContact O-NE2 3.06Å; S1504-Q1540 VanDerWaalsContact OG-CG 3.25Å; S1504-Q1540 WeakPolarHBondContact OG-CG 3.33Å; S1504-Q1540 PolarHBondContact OG-NE2 2.93Å; S1504-Q1540 VanDerWaalsContact OG-NE2 3.07Å; R1505-Q1540 CarbonylContact O-C 3.53Å; R1505-Q1540 VanDerWaalsContact O-CA 3.3Å; R1505-Q1540 WeakPolarHBondContact O-CA 3.31Å; W1506-Q1540 HydrophobicContact CD2-CB 3.95Å; W1506-Q1540 HydrophobicContact CD2-CG 3.95Å; W1506-Q1540 HydrophobicContact CE3-CB 3.85Å; W1506-Q1540 HydrophobicContact CE3-CG 4.36Å; W1506-Q1540 HydrophobicContact CG-CG 4.28Å; W1506-Q1540 HydrophobicContact CH2-CB 3.92Å; W1506-Q1540 HydrophobicContact CZ2-CB 4.02Å; W1506-Q1540 HydrophobicContact CZ2-CG 4.16Å; W1506-Q1540 HydrophobicContact CZ3-CB 3.84Å
1541	L	88.6	Confident	78	Confident	1.2 Å²	1.2	39.6 Å²	39.6	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	143.7	-178.6	-59.8	176.2	0	0	0	110.9	I1323 C1324 L1325 L1353 Y1460 V1489 S1504 R1505 Y1507 I1539 M1543	I1323-L1541 HydrophobicContact CG2-CD2 4.46Å; C1324-L1541 VanDerWaalsContact O-CA 3.31Å; C1324-L1541 WeakPolarHBondContact O-CA 3.32Å; L1325-L1541 HydrophobicContact CB-CD2 3.96Å; L1325-L1541 HydrophobicContact CD1-CD2 3.62Å; L1325-L1541 HydrophobicContact CG-CD2 4.41Å; L1353-L1541 HydrophobicContact CD2-CD2 4.34Å; Y1460-L1541 HydrophobicContact CD1-CD1 4.42Å; Y1460-L1541 HydrophobicContact CE1-CD1 3.98Å; Y1460-L1541 HydrophobicContact CE2-CD1 4.43Å; Y1460-L1541 WeakPolarHBondContact OH-CD1 3.44Å; V1489-L1541 HydrophobicContact CB-CD1 4.46Å; V1489-L1541 HydrophobicContact CG1-CD1 4.3Å; V1489-L1541 HydrophobicContact CG2-CD1 3.6Å; S1504-L1541 CarbonylContact C-O 3.55Å; S1504-L1541 VanDerWaalsContact CA-O 3.29Å; S1504-L1541 WeakPolarHBondContact CA-O 3.35Å; R1505-L1541 PolarHBondContact N-O 3.03Å; R1505-L1541 PolarHBondContact O-N 3.23Å; Y1507-L1541 HydrophobicContact CD2-CB 4.04Å; Y1507-L1541 HydrophobicContact CD2-CD1 3.96Å; Y1507-L1541 HydrophobicContact CD2-CG 4.11Å; Y1507-L1541 HydrophobicContact CE2-CB 3.95Å; Y1507-L1541 HydrophobicContact CE2-CD1 4.29Å; Y1507-L1541 HydrophobicContact CE2-CG 4.45Å; Y1507-L1541 HydrophobicContact CG-CD1 4.47Å; I1539-L1541 HydrophobicContact CD1-CD1 3.88Å; I1539-L1541 HydrophobicContact CD1-CD2 4.22Å; I1539-L1541 HydrophobicContact CD1-CG 4.07Å; I1539-L1541 HydrophobicContact CG1-CD1 4.4Å; I1539-L1541 HydrophobicContact CG1-CG 4.22Å; L1541-M1543 HydrophobicContact CB-CE 4.43Å; L1541-M1543 HydrophobicContact CD1-CE 4.12Å
1542	S	88.2	Confident	79.5	Confident	28.2 Å²	28.2	36.1 Å²	36.1	20%	0.197	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	146.3	161.6	58.2	0	0	0	0	109.9	C1324 N1326	C1324-S1542 PolarHBondContact N-O 3.07Å; C1324-S1542 PolarHBondContact O-N 3.03Å; N1326-S1542 VanDerWaalsContact ND2-CB 3.3Å; N1326-S1542 WeakPolarHBondContact ND2-CB 3.36Å; N1326-S1542 PolarHBondContact ND2-N 2.99Å; N1326-S1542 VanDerWaalsContact ND2-N 3.17Å; N1326-S1542 PolarHBondContact ND2-OG 3.03Å
1543	M	90	Very high	80.5	Confident	2.8 Å²	2.8	35.8 Å²	35.8	1%	0.014	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	141.8	-172.9	-54	179.2	138.1	0	0	110.1	Q1322 I1323 Y1460 V1489 L1491 L1494 N1501 L1502 L1541	Q1322-M1543 CarbonylContact O-C 3.53Å; Q1322-M1543 VanDerWaalsContact O-CA 3.32Å; Q1322-M1543 WeakPolarHBondContact O-CA 3.37Å; I1323-M1543 HydrophobicContact CB-CG 4.49Å; I1323-M1543 HydrophobicContact CD1-CE 3.97Å; I1323-M1543 HydrophobicContact CG1-CB 4.35Å; I1323-M1543 HydrophobicContact CG1-CE 4.09Å; I1323-M1543 HydrophobicContact CG1-CG 4.08Å; I1323-M1543 HydrophobicContact CG1-SD 4.49Å; I1323-M1543 HydrophobicContact CG2-CE 3.87Å; I1323-M1543 HydrophobicContact CG2-CG 4.2Å; Y1460-M1543 HydrophobicContact CG-CE 4.42Å; V1489-M1543 HydrophobicContact CB-CE 4.1Å; V1489-M1543 HydrophobicContact CG1-CE 3.53Å; V1489-M1543 VanDerWaalsContact CG1-CE 3.45Å; V1489-M1543 HydrophobicContact CG1-SD 4Å; L1491-M1543 HydrophobicContact CD2-CE 3.66Å; L1491-M1543 VanDerWaalsContact CD2-CE 3.45Å; L1491-M1543 HydrophobicContact CD2-SD 3.62Å; L1491-M1543 VanDerWaalsContact CD2-SD 3.55Å; L1491-M1543 WeakPolarHBondContact CD2-SD 3.5Å; L1494-M1543 HydrophobicContact CD1-CB 4.25Å; L1494-M1543 HydrophobicContact CD1-CE 4.45Å; L1494-M1543 HydrophobicContact CD2-CB 3.87Å; L1494-M1543 HydrophobicContact CG-CB 4.35Å; N1501-M1543 PolarHBondContact OD1-O 2.85Å; L1502-M1543 HydrophobicContact CB-CB 4.03Å; L1502-M1543 WeakPolarHBondContact CB-O 3.15Å; L1502-M1543 HydrophobicContact CD2-CB 4.42Å; L1502-M1543 HydrophobicContact CD2-CG 4.39Å; L1502-M1543 HydrophobicContact CD2-SD 4.03Å; L1502-M1543 PolarHBondContact N-O 3.1Å; L1502-M1543 PolarHBondContact O-N 3.09Å; L1502-M1543 VanDerWaalsContact O-N 3.14Å; L1541-M1543 HydrophobicContact CB-CE 4.43Å; L1541-M1543 HydrophobicContact CD1-CE 4.12Å
1544	R	89.4	Confident	80.9	Confident	136 Å²	136	35.6 Å²	35.6	51%	0.513	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	133.3	178.2	-178.9	173.9	166.5	171.7	0.5	110.9	I1321 Q1322 G1500 N1501	I1321-R1544 WeakPolarHBondContact CA-O 3.19Å; Q1322-R1544 HydrophobicContact CB-CB 4.49Å; Q1322-R1544 PolarHBondContact N-O 2.97Å; Q1322-R1544 PolarHBondContact O-N 2.88Å; G1500-R1544 CarbonylContact O-C 3.59Å; G1500-R1544 WeakPolarHBondContact O-CA 3.33Å; N1501-R1544 VanDerWaalsContact OD1-CD 3.27Å; N1501-R1544 WeakPolarHBondContact OD1-CD 3.4Å; N1501-R1544 WeakPolarHBondContact OD1-CG 3.26Å; N1501-R1544 PolarHBondContact OD1-NE 3.25Å
1545	L	87.6	Confident	80.8	Confident	3.4 Å²	3.4	34.5 Å²	34.5	2%	0.018	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	127.7	166.4	174.4	60.8	0	0	0	108.3	H1319 I1321 L1494 G1500 P1548 I1551	H1319-L1545 HydrophobicContact CB-CD1 4.28Å; I1321-L1545 HydrophobicContact CG1-CD1 3.94Å; L1494-L1545 HydrophobicContact CB-CB 4.44Å; L1494-L1545 HydrophobicContact CD2-CB 4.46Å; G1500-L1545 PolarHBondContact O-N 3.13Å; L1545-P1548 HydrophobicContact CD2-CB 4.13Å; L1545-P1548 HydrophobicContact CG-CB 4.36Å; L1545-I1551 HydrophobicContact CD1-CD1 3.95Å; L1545-I1551 HydrophobicContact CD1-CG1 4.22Å; L1545-I1551 HydrophobicContact CD2-CB 4.15Å; L1545-I1551 HydrophobicContact CD2-CD1 3.77Å; L1545-I1551 HydrophobicContact CD2-CG1 4.21Å; L1545-I1551 HydrophobicContact CD2-CG2 3.72Å; L1545-I1551 HydrophobicContact CG-CD1 4.18Å
1546	T	78.4	Confident	80.1	Confident	51.4 Å²	51.4	33.5 Å²	33.5	32%	0.315	17%	0.172	S	C	.	.	S	Bend	trans	-69.4	-42	175.7	51.3	0	0	0	0	111.3	H1320 P1548	H1320-T1546 HydrophobicContact CB-CG2 3.95Å; H1320-T1546 WeakPolarHBondContact CB-OG1 3.38Å; H1320-T1546 PolarHBondContact N-OG1 2.71Å; H1320-T1546 WeakPolarHBondContact ND1-CG2 3.41Å; H1320-T1546 PolarHBondContact O-N 2.97Å; H1320-T1546 VanDerWaalsContact O-N 3.08Å; H1320-T1546 PolarHBondContact O-OG1 2.92Å; T1546-P1548 VanDerWaalsContact C-CD 3.47Å; T1546-P1548 WeakPolarHBondContact O-CD 3.34Å
1547	D	78.9	Confident	79.2	Confident	85 Å²	85	37.4 Å²	37.4	46%	0.455	19%	0.193	S	C	.	.			trans	-115.1	70	-178.1	-57.7	-50	0	0	0	112.6	H1549 L1550 I1551	D1547-H1549 PolarHBondContact O-N 3.14Å; D1547-H1549 VanDerWaalsContact O-N 3.08Å; D1547-L1550 HydrophobicContact CB-CB 4.16Å; D1547-L1550 HydrophobicContact CB-CD1 3.79Å; D1547-L1550 HydrophobicContact CB-CG 4.01Å; D1547-L1550 WeakPolarHBondContact O-CB 3.28Å; D1547-L1550 PolarHBondContact O-N 2.94Å; D1547-I1551 PolarHBondContact O-N 3.07Å
1548	P	78.3	Confident	77.6	Confident	11.6 Å²	11.6	41.9 Å²	41.9	8%	0.075	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.8	-176.5	26.9	-36.5	0	0	0	114.2	L1545 T1546 L1550 I1551 K1552	L1545-P1548 HydrophobicContact CD2-CB 4.13Å; L1545-P1548 HydrophobicContact CG-CB 4.36Å; T1546-P1548 VanDerWaalsContact C-CD 3.47Å; T1546-P1548 WeakPolarHBondContact O-CD 3.34Å; P1548-L1550 VanDerWaalsContact C-N 3.29Å; P1548-L1550 PolarHBondContact O-N 3.23Å; P1548-I1551 WeakPolarHBondContact O-CG2 3.34Å; P1548-I1551 PolarHBondContact O-N 3.38Å; P1548-K1552 WeakPolarHBondContact O-CD 3.17Å; P1548-K1552 WeakPolarHBondContact O-CE 3.47Å; P1548-K1552 WeakPolarHBondContact O-CG 3.46Å; P1548-K1552 PolarHBondContact O-N 3.05Å
1549	H	78.1	Confident	75.2	Confident	116 Å²	116	45.9 Å²	45.9	54%	0.537	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-32.6	175.9	-58.8	-65	0	0	0	112.6	D1547 K1552 I1553	D1547-H1549 PolarHBondContact O-N 3.14Å; D1547-H1549 VanDerWaalsContact O-N 3.08Å; H1549-K1552 PolarHBondContact O-N 3.01Å; H1549-I1553 WeakPolarHBondContact O-CG1 3.16Å; H1549-I1553 PolarHBondContact O-N 3.34Å
1550	L	77.6	Confident	72.6	Confident	70 Å²	70	51.3 Å²	51.3	37%	0.366	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-70.5	-37.7	-179.5	-66.1	-179.2	0	0	0	111.8	F1317 D1547 P1548 K1552 I1553	F1317-L1550 HydrophobicContact CD1-CD1 4.13Å; D1547-L1550 HydrophobicContact CB-CB 4.16Å; D1547-L1550 HydrophobicContact CB-CD1 3.79Å; D1547-L1550 HydrophobicContact CB-CG 4.01Å; D1547-L1550 WeakPolarHBondContact O-CB 3.28Å; D1547-L1550 PolarHBondContact O-N 2.94Å; P1548-L1550 VanDerWaalsContact C-N 3.29Å; P1548-L1550 PolarHBondContact O-N 3.23Å; L1550-K1552 PolarHBondContact O-N 3.15Å; L1550-K1552 VanDerWaalsContact O-N 3.12Å; L1550-I1553 PolarHBondContact O-N 3.17Å; L1550-I1553 VanDerWaalsContact O-N 3.15Å; L1550-I1553 VanDerWaalsContact O-O 3.12Å
1551	I	79.6	Confident	69.9	Low	4.6 Å²	4.6	54.6 Å²	54.6	2%	0.024	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-62.6	-25.8	176.2	-123.6	-179.9	0	0	0	112.7	H1319 L1434 L1435 I1438 I1495 L1545 D1547 P1548 I1553	H1319-I1551 HydrophobicContact CB-CD1 4.15Å; H1319-I1551 HydrophobicContact CB-CG1 4.31Å; H1319-I1551 VanDerWaalsContact CD2-CG1 3.42Å; H1319-I1551 WeakPolarHBondContact CD2-CG1 3.33Å; H1319-I1551 VanDerWaalsContact NE2-CA 3.33Å; H1319-I1551 WeakPolarHBondContact NE2-CA 3.45Å; H1319-I1551 PolarHBondContact NE2-N 3.17Å; L1434-I1551 HydrophobicContact CD2-CD1 3.66Å; L1434-I1551 HydrophobicContact CD2-CG1 4.18Å; L1434-I1551 HydrophobicContact CG-CD1 4.12Å; L1434-I1551 HydrophobicContact CG-CG1 4.43Å; L1435-I1551 HydrophobicContact CB-CG2 4.36Å; L1435-I1551 HydrophobicContact CD1-CG2 4.04Å; I1438-I1551 HydrophobicContact CD1-CD1 3.97Å; I1495-I1551 HydrophobicContact CD1-CG2 4.06Å; I1495-I1551 HydrophobicContact CG1-CG2 4.41Å; L1545-I1551 HydrophobicContact CD1-CD1 3.95Å; L1545-I1551 HydrophobicContact CD1-CG1 4.22Å; L1545-I1551 HydrophobicContact CD2-CB 4.15Å; L1545-I1551 HydrophobicContact CD2-CD1 3.77Å; L1545-I1551 HydrophobicContact CD2-CG1 4.21Å; L1545-I1551 HydrophobicContact CD2-CG2 3.72Å; L1545-I1551 HydrophobicContact CG-CD1 4.18Å; D1547-I1551 PolarHBondContact O-N 3.07Å; P1548-I1551 WeakPolarHBondContact O-CG2 3.34Å; P1548-I1551 PolarHBondContact O-N 3.38Å; I1551-I1553 VanDerWaalsContact C-N 3.3Å; I1551-I1553 PolarHBondContact O-N 3.12Å
1552	K	79	Confident	67.2	Low	18.4 Å²	18.4	59.9 Å²	59.9	8%	0.08	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-81.6	-6.8	179.4	-64.7	177.6	178.1	-174.7	0	112.7	I1495 P1548 H1549 L1550 A1604 F1605 E1608	I1495-K1552 HydrophobicContact CG2-CG 4.41Å; I1495-K1552 WeakPolarHBondContact O-CE 3.39Å; I1495-K1552 PolarHBondContact O-NZ 3.03Å; P1548-K1552 WeakPolarHBondContact O-CD 3.17Å; P1548-K1552 WeakPolarHBondContact O-CE 3.47Å; P1548-K1552 WeakPolarHBondContact O-CG 3.46Å; P1548-K1552 PolarHBondContact O-N 3.05Å; H1549-K1552 PolarHBondContact O-N 3.01Å; L1550-K1552 PolarHBondContact O-N 3.15Å; L1550-K1552 VanDerWaalsContact O-N 3.12Å; K1552-A1604 PolarHBondContact O-N 2.97Å; K1552-F1605 HydrophobicContact CB-CB 4.02Å; K1552-F1605 HydrophobicContact CB-CD1 4.36Å; K1552-F1605 HydrophobicContact CB-CD2 4.26Å; K1552-F1605 HydrophobicContact CB-CG 3.9Å; K1552-F1605 HydrophobicContact CD-CB 4.2Å; K1552-F1605 HydrophobicContact CD-CD1 4.06Å; K1552-F1605 HydrophobicContact CD-CD2 3.71Å; K1552-F1605 HydrophobicContact CD-CE2 4.43Å; K1552-F1605 HydrophobicContact CD-CG 4.22Å; K1552-F1605 HydrophobicContact CG-CB 4.39Å; K1552-F1605 HydrophobicContact CG-CD1 3.92Å; K1552-F1605 HydrophobicContact CG-CD2 3.91Å; K1552-F1605 HydrophobicContact CG-CE1 4.25Å; K1552-F1605 HydrophobicContact CG-CE2 4.29Å; K1552-F1605 HydrophobicContact CG-CG 3.98Å; K1552-F1605 VanDerWaalsContact O-CD2 3.23Å; K1552-F1605 WeakPolarHBondContact O-CD2 3.39Å; K1552-F1605 PolarHBondContact O-N 2.83Å; K1552-F1605 VanDerWaalsContact O-N 3.08Å; K1552-E1608 IonicContact NZ-OE1 2.72Å; K1552-E1608 PolarHBondContact NZ-OE1 3.43Å; K1552-E1608 IonicContact NZ-OE2 3.75Å
1553	I	75.6	Confident	64.6	Low	65.2 Å²	65.2	65.2 Å²	65.2	33%	0.334	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	110.1	177.2	-59	168.9	0	0	0	108.6	H1549 L1550 I1551 P1555 L1595 I1602 V1603	H1549-I1553 WeakPolarHBondContact O-CG1 3.16Å; H1549-I1553 PolarHBondContact O-N 3.34Å; L1550-I1553 PolarHBondContact O-N 3.17Å; L1550-I1553 VanDerWaalsContact O-N 3.15Å; L1550-I1553 VanDerWaalsContact O-O 3.12Å; I1551-I1553 VanDerWaalsContact C-N 3.3Å; I1551-I1553 PolarHBondContact O-N 3.12Å; I1553-P1555 WeakPolarHBondContact O-CD 3.02Å; I1553-L1595 HydrophobicContact CG2-CD1 4.44Å; I1553-I1602 HydrophobicContact CG2-CG2 3.77Å; I1553-V1603 HydrophobicContact CG1-CG1 4.23Å; I1553-V1603 HydrophobicContact CG1-CG2 4.4Å
1554	V	73.3	Confident	61.9	Low	12.8 Å²	12.8	71.9 Å²	71.9	8%	0.078	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	111.7	-179.1	177.8	0	0	0	0	110.3	T1433 L1435 C1556 I1579 S1601 I1602 V1603	T1433-V1554 HydrophobicContact CG2-CG1 3.65Å; T1433-V1554 VanDerWaalsContact CG2-CG1 3.46Å; T1433-V1554 HydrophobicContact CG2-CG2 4.45Å; L1435-V1554 HydrophobicContact CB-CG2 4.39Å; L1435-V1554 HydrophobicContact CD2-CG2 4.11Å; V1554-C1556 PolarHBondContact O-N 2.95Å; V1554-I1579 HydrophobicContact CB-CD1 3.83Å; V1554-I1579 HydrophobicContact CG1-CD1 3.74Å; V1554-I1579 HydrophobicContact CG2-CD1 3.56Å; V1554-I1579 VanDerWaalsContact CG2-CD1 3.5Å; V1554-S1601 CarbonylContact O-C 3.47Å; V1554-S1601 VanDerWaalsContact O-CA 3.24Å; V1554-S1601 WeakPolarHBondContact O-CA 3.27Å; V1554-S1601 WeakPolarHBondContact O-CB 3.21Å; V1554-I1602 HydrophobicContact CB-CB 4.32Å; V1554-I1602 PolarHBondContact N-O 2.94Å; V1554-I1602 PolarHBondContact O-N 3.12Å; V1554-V1603 PolarHBondContact N-O 2.94Å; V1554-V1603 PolarHBondContact O-N 2.88Å
1555	P	66	Low	59.4	Low	34.2 Å²	34.2	72.1 Å²	72.1	22%	0.222	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	130.3	173.3	26.7	-31.5	0	0	0	110.5	T1315 I1553	T1315-P1555 HydrophobicContact CG2-CG 4.24Å; I1553-P1555 WeakPolarHBondContact O-CD 3.02Å
1556	C	61.4	Low	57	Low	15.2 Å²	15.2	79.1 Å²	79.1	10%	0.103	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	101.2	176	-67.6	0	0	0	0	109.7	V1554 N1558 L1559 N1600 S1601 I1602 V1603	V1554-C1556 PolarHBondContact O-N 2.95Å; C1556-N1558 VanDerWaalsContact C-N 3.32Å; C1556-N1558 PolarHBondContact O-N 3.02Å; C1556-N1558 VanDerWaalsContact O-N 3.12Å; C1556-L1559 HydrophobicContact CB-CD1 4.04Å; C1556-N1600 WeakPolarHBondContact CA-O 3.22Å; C1556-N1600 HydrophobicContact CB-CB 4.22Å; C1556-N1600 VanDerWaalsContact CB-O 3.31Å; C1556-N1600 WeakPolarHBondContact CB-O 3.29Å; C1556-N1600 PolarHBondContact N-O 3.05Å; C1556-S1601 CarbonylContact C-O 3.49Å; C1556-S1601 WeakPolarHBondContact CA-O 3.23Å; C1556-S1601 WeakPolarHBondContact CB-O 3.26Å; C1556-S1601 PolarHBondContact N-O 2.97Å; C1556-S1601 PolarHBondContact O-N 3.17Å; C1556-S1601 PolarHBondContact O-OG 3.06Å; C1556-I1602 VanDerWaalsContact SG-CD1 3.59Å; C1556-I1602 WeakPolarHBondContact SG-CD1 3.27Å; C1556-V1603 HydrophobicContact CB-CG2 4.39Å; C1556-V1603 WeakPolarHBondContact SG-CG2 3.28Å
1557	N	53.7	Low	55	Low	86 Å²	86	83.3 Å²	83.3	46%	0.46	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	50.8	178.2	-69.8	-24	0	0	0	111.7	E1431 L1559 Q1599	E1431-N1557 PolarHBondContact OE1-ND2 3.1Å; N1557-L1559 VanDerWaalsContact C-N 3.3Å; N1557-L1559 PolarHBondContact O-N 2.89Å; N1557-L1559 VanDerWaalsContact O-N 3.15Å; N1557-Q1599 PolarHBondContact OD1-NE2 3.29Å
1558	N	45.4	Very low	53	Low	99 Å²	99	87.2 Å²	87.2	53%	0.529	48%	0.475	S	S	.	.			trans	-106	61	179	-74.4	-25.9	0	0	0	112.4	C1556 T1560 S1576 N1600 S1601	C1556-N1558 VanDerWaalsContact C-N 3.32Å; C1556-N1558 PolarHBondContact O-N 3.02Å; C1556-N1558 VanDerWaalsContact O-N 3.12Å; N1558-T1560 VanDerWaalsContact C-N 3.32Å; N1558-T1560 HydrophobicContact CB-CG2 4.48Å; N1558-T1560 PolarHBondContact O-N 3.11Å; N1558-T1560 VanDerWaalsContact O-N 3.08Å; N1558-S1576 PolarHBondContact OD1-OG 2.81Å; N1558-S1576 VanDerWaalsContact OD1-OG 3.13Å; N1558-N1600 PolarHBondContact ND2-ND2 2.86Å; N1558-N1600 VanDerWaalsContact ND2-ND2 3.12Å; N1558-N1600 PolarHBondContact OD1-ND2 2.84Å; N1558-S1601 PolarHBondContact ND2-OG 3.28Å
1559	L	35.3	Very low	51	Low	88.6 Å²	88.6	94.1 Å²	94.1	46%	0.464	51%	0.511	S	S	.	.			trans	-85.1	78.7	172.6	-127.8	103.9	0	0	0	110.7	C1556 N1557 T1561 I1574 N1600	C1556-L1559 HydrophobicContact CB-CD1 4.04Å; N1557-L1559 VanDerWaalsContact C-N 3.3Å; N1557-L1559 PolarHBondContact O-N 2.89Å; N1557-L1559 VanDerWaalsContact O-N 3.15Å; L1559-T1561 HydrophobicContact CD2-CG2 4.32Å; L1559-T1561 HydrophobicContact CG-CG2 4.48Å; L1559-T1561 PolarHBondContact O-N 3.15Å; L1559-T1561 VanDerWaalsContact O-N 3.13Å; L1559-I1574 HydrophobicContact CD1-CG2 4.04Å; L1559-I1574 HydrophobicContact CD2-CB 4.42Å; L1559-I1574 HydrophobicContact CD2-CG1 4.2Å; L1559-I1574 HydrophobicContact CD2-CG2 4.06Å; L1559-I1574 HydrophobicContact CG-CG2 4.04Å; L1559-N1600 WeakPolarHBondContact CB-ND2 3.4Å; L1559-N1600 HydrophobicContact CD1-CB 3.88Å
1560	T	31.7	Very low	48.8	Very low	116.4 Å²	116.4	92.3 Å²	92.3	71%	0.714	52%	0.516	S	S	*	.			trans	-84.9	88.1	168.2	48.2	0	0	0	0	109.7	N1558 T1562	N1558-T1560 VanDerWaalsContact C-N 3.32Å; N1558-T1560 HydrophobicContact CB-CG2 4.48Å; N1558-T1560 PolarHBondContact O-N 3.11Å; N1558-T1560 VanDerWaalsContact O-N 3.08Å; T1560-T1562 VanDerWaalsContact C-N 3.34Å; T1560-T1562 PolarHBondContact O-N 3.03Å; T1560-T1562 VanDerWaalsContact O-N 3.08Å
1561	T	32.7	Very low	46.5	Very low	99.6 Å²	99.6	96.8 Å²	96.8	61%	0.611	54%	0.538	S	S	*	.			trans	-69.7	104.3	162.7	50.1	0	0	0	0	108.3	L1559 I1563 I1574	L1559-T1561 HydrophobicContact CD2-CG2 4.32Å; L1559-T1561 HydrophobicContact CG-CG2 4.48Å; L1559-T1561 PolarHBondContact O-N 3.15Å; L1559-T1561 VanDerWaalsContact O-N 3.13Å; T1561-I1563 VanDerWaalsContact C-N 3.27Å; T1561-I1563 PolarHBondContact O-N 2.92Å; T1561-I1574 HydrophobicContact CG2-CD1 3.95Å; T1561-I1574 HydrophobicContact CG2-CG1 4.19Å
1562	T	31	Very low	44.3	Very low	114.4 Å²	114.4	102.9 Å²	102.9	70%	0.702	57%	0.57	S	S	*	*			trans	-57	121.6	169.4	45	0	0	0	0	110.3	T1560 D1564	T1560-T1562 VanDerWaalsContact C-N 3.34Å; T1560-T1562 PolarHBondContact O-N 3.03Å; T1560-T1562 VanDerWaalsContact O-N 3.08Å; T1562-D1564 PolarHBondContact O-N 2.91Å
1563	I	32.7	Very low	42.1	Very low	138.2 Å²	138.2	108.5 Å²	108.5	71%	0.709	60%	0.601	S	S	*	*			trans	-67.6	84.7	171.2	-55.6	168	0	0	0	109.3	T1561 N1565	T1561-I1563 VanDerWaalsContact C-N 3.27Å; T1561-I1563 PolarHBondContact O-N 2.92Å; I1563-N1565 VanDerWaalsContact C-N 3.31Å; I1563-N1565 HydrophobicContact CG2-CB 4.01Å; I1563-N1565 WeakPolarHBondContact CG2-OD1 3.26Å; I1563-N1565 PolarHBondContact O-N 2.99Å; I1563-N1565 VanDerWaalsContact O-N 3.08Å
1564	D	34.9	Very low	40.3	Very low	143 Å²	143	108.9 Å²	108.9	77%	0.765	60%	0.603	S	S	*	*			trans	-89.1	107	148	-86.8	-22.5	0	0	0	108.6	T1562 N1566	T1562-D1564 PolarHBondContact O-N 2.91Å; D1564-N1566 PolarHBondContact O-N 3.02Å
1565	N	35.9	Very low	38.9	Very low	141.6 Å²	141.6	113.8 Å²	113.8	76%	0.757	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	56.4	-173.9	-101.3	-18.9	0	0	0	114.1	I1563	I1563-N1565 VanDerWaalsContact C-N 3.31Å; I1563-N1565 HydrophobicContact CG2-CB 4.01Å; I1563-N1565 WeakPolarHBondContact CG2-OD1 3.26Å; I1563-N1565 PolarHBondContact O-N 2.99Å; I1563-N1565 VanDerWaalsContact O-N 3.08Å
1566	N	37.7	Very low	38.3	Very low	149.6 Å²	149.6	113.8 Å²	113.8	80%	0.8	63%	0.625	S	S	*	*			trans	-163.7	35.7	-178.3	-89.1	-17.6	0	0	0	115.3	D1564	D1564-N1566 PolarHBondContact O-N 3.02Å
1567	N	36.7	Very low	38.3	Very low	140.6 Å²	140.6	117 Å²	117	75%	0.752	65%	0.646	S	S	*	*			trans	-155.6	105.7	159.8	-89.3	-40.7	0	0	0	111.1	N1569 A1570	N1567-N1569 PolarHBondContact O-N 3.02Å; N1567-N1569 VanDerWaalsContact O-N 3.08Å; N1567-A1570 PolarHBondContact O-N 2.97Å
1568	N	36.9	Very low	39.2	Very low	166.2 Å²	166.2	114.8 Å²	114.8	89%	0.889	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	30.4	-179.2	-69.4	-16.4	0	0	0	114.1
1569	N	36.4	Very low	40.8	Very low	157.4 Å²	157.4	110.2 Å²	110.2	84%	0.842	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	12.3	173.3	-72.6	-11	0	0	0	113.1	N1567 M1571	N1567-N1569 PolarHBondContact O-N 3.02Å; N1567-N1569 VanDerWaalsContact O-N 3.08Å; N1569-M1571 VanDerWaalsContact C-N 3.32Å; N1569-M1571 PolarHBondContact O-N 3.11Å
1570	A	31.3	Very low	42.7	Very low	78 Å²	78	106.8 Å²	106.8	65%	0.645	60%	0.595	S	S	*	*			trans	-82.9	54.2	179.9	0	0	0	0	0	112.8	N1567 N1572	N1567-A1570 PolarHBondContact O-N 2.97Å; A1570-N1572 PolarHBondContact O-N 3.1Å; A1570-N1572 VanDerWaalsContact O-N 3.13Å
1571	M	30.2	Very low	44.9	Very low	164.6 Å²	164.6	104.9 Å²	104.9	81%	0.811	58%	0.58	S	S	*	*			trans	-69.8	104.5	169.5	-150.1	114.6	136.1	0	0	109.3	N1569 N1573	N1569-M1571 VanDerWaalsContact C-N 3.32Å; N1569-M1571 PolarHBondContact O-N 3.11Å; M1571-N1573 PolarHBondContact O-N 3.38Å
1572	N	33.1	Very low	47.2	Very low	132 Å²	132	100.2 Å²	100.2	71%	0.706	55%	0.551	S	S	*	*			trans	-75.7	63.4	179.8	-66.4	-27.1	0	0	0	114.1	A1570 I1574	A1570-N1572 PolarHBondContact O-N 3.1Å; A1570-N1572 VanDerWaalsContact O-N 3.13Å; N1572-I1574 VanDerWaalsContact C-N 3.32Å; N1572-I1574 HydrophobicContact CB-CG1 4.43Å; N1572-I1574 PolarHBondContact O-N 2.94Å
1573	N	33.1	Very low	49.6	Very low	136.6 Å²	136.6	94.8 Å²	94.8	73%	0.73	52%	0.518	S	S	*	.			trans	-91.9	71.5	-179.8	-74.7	-15.6	0	0	0	111.8	M1571 H1575	M1571-N1573 PolarHBondContact O-N 3.38Å; N1573-H1575 PolarHBondContact O-CD2 3.12Å; N1573-H1575 VanDerWaalsContact O-CD2 3.31Å; N1573-H1575 PolarHBondContact O-N 3.03Å
1574	I	37.8	Very low	51.9	Low	72 Å²	72	95.7 Å²	95.7	37%	0.369	51%	0.513	S	S	.	.			trans	-92.9	92.7	-178.9	-61.6	175.2	0	0	0	110.6	L1559 T1561 N1572 S1576 I1580 V1592	L1559-I1574 HydrophobicContact CD1-CG2 4.04Å; L1559-I1574 HydrophobicContact CD2-CB 4.42Å; L1559-I1574 HydrophobicContact CD2-CG1 4.2Å; L1559-I1574 HydrophobicContact CD2-CG2 4.06Å; L1559-I1574 HydrophobicContact CG-CG2 4.04Å; T1561-I1574 HydrophobicContact CG2-CD1 3.95Å; T1561-I1574 HydrophobicContact CG2-CG1 4.19Å; N1572-I1574 VanDerWaalsContact C-N 3.32Å; N1572-I1574 HydrophobicContact CB-CG1 4.43Å; N1572-I1574 PolarHBondContact O-N 2.94Å; I1574-S1576 VanDerWaalsContact C-N 3.33Å; I1574-S1576 PolarHBondContact O-N 3.23Å; I1574-S1576 VanDerWaalsContact O-N 3.14Å; I1574-I1580 HydrophobicContact CB-CD1 4.36Å; I1574-I1580 HydrophobicContact CG2-CD1 3.93Å; I1574-V1592 HydrophobicContact CD1-CB 4.47Å; I1574-V1592 HydrophobicContact CD1-CG1 4.19Å; I1574-V1592 HydrophobicContact CD1-CG2 4.19Å
1575	H	43.2	Very low	53.9	Low	117.6 Å²	117.6	92.2 Å²	92.2	54%	0.544	49%	0.494	S	S	.	.	S	Bend	trans	-78.1	54.3	173.5	-70.9	-65.6	0	0	0	115.9	N1429 N1573 P1577 I1580	N1429-H1575 PolarHBondContact O-CE1 2.98Å; N1573-H1575 PolarHBondContact O-CD2 3.12Å; N1573-H1575 VanDerWaalsContact O-CD2 3.31Å; N1573-H1575 PolarHBondContact O-N 3.03Å; H1575-P1577 WeakPolarHBondContact O-CD 3.33Å; H1575-P1577 WeakPolarHBondContact O-CG 3.42Å; H1575-P1577 VanDerWaalsContact O-N 3.15Å; H1575-I1580 HydrophobicContact CB-CD1 3.73Å
1576	S	53.4	Low	56	Low	32.6 Å²	32.6	85.5 Å²	85.5	23%	0.228	46%	0.458	C	S	.	.			trans	-104.3	70.7	161.3	-159.8	0	0	0	0	111.5	N1558 I1574 S1578	N1558-S1576 PolarHBondContact OD1-OG 2.81Å; N1558-S1576 VanDerWaalsContact OD1-OG 3.13Å; I1574-S1576 VanDerWaalsContact C-N 3.33Å; I1574-S1576 PolarHBondContact O-N 3.23Å; I1574-S1576 VanDerWaalsContact O-N 3.14Å; S1576-S1578 VanDerWaalsContact C-N 3.32Å; S1576-S1578 PolarHBondContact O-N 3.19Å; S1576-S1578 PolarHBondContact OG-OG 2.87Å
1577	P	61.7	Low	57.8	Low	82.4 Å²	82.4	83.6 Å²	83.6	54%	0.535	45%	0.448	S	S	.	.	H	α-helix	trans	-75.1	-24.1	-170.1	19.7	-22	0	0	0	113.8	H1575 N1581	H1575-P1577 WeakPolarHBondContact O-CD 3.33Å; H1575-P1577 WeakPolarHBondContact O-CG 3.42Å; H1575-P1577 VanDerWaalsContact O-N 3.15Å; P1577-N1581 WeakPolarHBondContact O-CB 3.25Å; P1577-N1581 VanDerWaalsContact O-CG 3.23Å; P1577-N1581 PolarHBondContact O-N 2.99Å; P1577-N1581 VanDerWaalsContact O-N 3.09Å; P1577-N1581 PolarHBondContact O-ND2 3.15Å; P1577-N1581 VanDerWaalsContact O-ND2 3.15Å; P1577-N1581 PolarHBondContact O-OD1 3.14Å
1578	S	72.7	Confident	59.9	Low	40.4 Å²	40.4	77.3 Å²	77.3	28%	0.283	41%	0.414	S	S	.	.	H	α-helix	trans	-68.4	-52.4	-170.6	67.3	0	0	0	0	112.4	E1436 S1576 I1580 N1581 C1582	E1436-S1578 VanDerWaalsContact OE1-CB 3.29Å; E1436-S1578 WeakPolarHBondContact OE1-CB 3.39Å; E1436-S1578 WeakPolarHBondContact OE2-CB 3.38Å; E1436-S1578 PolarHBondContact OE2-OG 2.91Å; S1576-S1578 VanDerWaalsContact C-N 3.32Å; S1576-S1578 PolarHBondContact O-N 3.19Å; S1576-S1578 PolarHBondContact OG-OG 2.87Å; S1578-I1580 PolarHBondContact O-N 3.28Å; S1578-N1581 PolarHBondContact O-N 3.1Å; S1578-C1582 VanDerWaalsContact O-CB 3.25Å; S1578-C1582 WeakPolarHBondContact O-CB 3.37Å; S1578-C1582 PolarHBondContact O-N 3.24Å
1579	I	77.4	Confident	61.8	Low	2.4 Å²	2.4	74.3 Å²	74.3	1%	0.012	40%	0.398	C	S	.	.	H	α-helix	trans	-67.1	-40.4	179.7	-171.9	161.1	0	0	0	112.1	T1433 L1435 E1436 V1554 N1581 C1582 L1583 I1602	T1433-I1579 HydrophobicContact CG2-CD1 4.1Å; T1433-I1579 WeakPolarHBondContact OG1-CD1 3.39Å; L1435-I1579 HydrophobicContact CD2-CD1 4.21Å; L1435-I1579 HydrophobicContact CG-CD1 4.49Å; E1436-I1579 HydrophobicContact CB-CD1 3.95Å; E1436-I1579 HydrophobicContact CG-CD1 4.31Å; E1436-I1579 PolarHBondContact OE2-N 3.3Å; V1554-I1579 HydrophobicContact CB-CD1 3.83Å; V1554-I1579 HydrophobicContact CG1-CD1 3.74Å; V1554-I1579 HydrophobicContact CG2-CD1 3.56Å; V1554-I1579 VanDerWaalsContact CG2-CD1 3.5Å; I1579-N1581 VanDerWaalsContact C-N 3.3Å; I1579-N1581 PolarHBondContact O-N 3.05Å; I1579-C1582 WeakPolarHBondContact O-CB 3.44Å; I1579-C1582 PolarHBondContact O-N 3.17Å; I1579-C1582 VanDerWaalsContact O-N 3.15Å; I1579-L1583 HydrophobicContact CD1-CD1 4.08Å; I1579-L1583 HydrophobicContact CD1-CD2 4.36Å; I1579-L1583 HydrophobicContact CD1-CG 3.92Å; I1579-L1583 HydrophobicContact CG1-CD1 4.17Å; I1579-L1583 HydrophobicContact CG1-CG 4.3Å; I1579-L1583 WeakPolarHBondContact O-CG 3.35Å; I1579-L1583 PolarHBondContact O-N 2.94Å; I1579-I1602 HydrophobicContact CG2-CD1 3.78Å
1580	I	77.1	Confident	63.9	Low	18.2 Å²	18.2	69 Å²	69	9%	0.093	37%	0.367	C	S	.	.	H	α-helix	trans	-62.2	-42	177.3	-69.8	177.4	0	0	0	110.2	I1574 H1575 S1578 L1583 R1584 F1590 I1602	I1574-I1580 HydrophobicContact CB-CD1 4.36Å; I1574-I1580 HydrophobicContact CG2-CD1 3.93Å; H1575-I1580 HydrophobicContact CB-CD1 3.73Å; S1578-I1580 PolarHBondContact O-N 3.28Å; I1580-L1583 PolarHBondContact O-N 3.14Å; I1580-R1584 WeakPolarHBondContact O-CB 3.29Å; I1580-R1584 WeakPolarHBondContact O-CD 3.25Å; I1580-R1584 VanDerWaalsContact O-CG 3.25Å; I1580-R1584 WeakPolarHBondContact O-CG 3.37Å; I1580-R1584 PolarHBondContact O-N 3.24Å; I1580-R1584 VanDerWaalsContact O-N 3.14Å; I1580-F1590 HydrophobicContact CB-CZ 4.44Å; I1580-F1590 HydrophobicContact CG1-CE2 4.26Å; I1580-F1590 HydrophobicContact CG1-CZ 4.37Å; I1580-F1590 HydrophobicContact CG2-CE1 4.41Å; I1580-F1590 HydrophobicContact CG2-CE2 4.39Å; I1580-F1590 HydrophobicContact CG2-CZ 3.83Å; I1580-I1602 HydrophobicContact CD1-CD1 4.06Å; I1580-I1602 HydrophobicContact CG1-CD1 3.69Å
1581	N	78.2	Confident	65.9	Low	75 Å²	75	68.7 Å²	68.7	40%	0.401	36%	0.355	S	S	.	.	H	α-helix	trans	-67.7	-42.1	175	-68.8	-16.1	0	0	0	111.2	P1577 S1578 I1579 L1583 R1584 D1585	P1577-N1581 WeakPolarHBondContact O-CB 3.25Å; P1577-N1581 VanDerWaalsContact O-CG 3.23Å; P1577-N1581 PolarHBondContact O-N 2.99Å; P1577-N1581 VanDerWaalsContact O-N 3.09Å; P1577-N1581 PolarHBondContact O-ND2 3.15Å; P1577-N1581 VanDerWaalsContact O-ND2 3.15Å; P1577-N1581 PolarHBondContact O-OD1 3.14Å; S1578-N1581 PolarHBondContact O-N 3.1Å; I1579-N1581 VanDerWaalsContact C-N 3.3Å; I1579-N1581 PolarHBondContact O-N 3.05Å; N1581-L1583 VanDerWaalsContact C-N 3.34Å; N1581-L1583 PolarHBondContact O-N 2.82Å; N1581-R1584 CarbonylContact O-C 3.5Å; N1581-R1584 WeakPolarHBondContact O-CB 3.17Å; N1581-R1584 PolarHBondContact O-N 2.91Å; N1581-R1584 VanDerWaalsContact O-N 3.08Å; N1581-D1585 WeakPolarHBondContact O-CB 3.34Å; N1581-D1585 PolarHBondContact O-N 3.2Å
1582	C	80.4	Confident	68	Low	0.6 Å²	0.6	64 Å²	64	0%	0.004	34%	0.335	C	S	.	.	H	α-helix	trans	-58.2	-46.7	175.4	-173.8	0	0	0	0	112.1	E1436 N1440 S1578 I1579 R1584 D1585 W1586	E1436-C1582 HydrophobicContact CG-CB 4.07Å; N1440-C1582 PolarHBondContact OD1-SG 3.06Å; S1578-C1582 VanDerWaalsContact O-CB 3.25Å; S1578-C1582 WeakPolarHBondContact O-CB 3.37Å; S1578-C1582 PolarHBondContact O-N 3.24Å; I1579-C1582 WeakPolarHBondContact O-CB 3.44Å; I1579-C1582 PolarHBondContact O-N 3.17Å; I1579-C1582 VanDerWaalsContact O-N 3.15Å; C1582-R1584 VanDerWaalsContact C-N 3.33Å; C1582-R1584 PolarHBondContact O-N 3.1Å; C1582-D1585 WeakPolarHBondContact O-CB 3.38Å; C1582-D1585 PolarHBondContact O-N 3.25Å; C1582-W1586 VanDerWaalsContact O-CD1 3.28Å; C1582-W1586 PolarHBondContact O-N 3.11Å; C1582-W1586 VanDerWaalsContact O-N 3.14Å
1583	L	81.8	Confident	69.7	Low	0.8 Å²	0.8	60.9 Å²	60.9	0%	0.004	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-37.8	177.2	-67.2	173.8	0	0	0	112	L1435 L1439 I1579 I1580 N1581 W1586 N1587 I1588 F1590 I1602 V1603 A1604 F1605	L1435-L1583 HydrophobicContact CD2-CD2 4.19Å; L1439-L1583 HydrophobicContact CD1-CD2 4.2Å; I1579-L1583 HydrophobicContact CD1-CD1 4.08Å; I1579-L1583 HydrophobicContact CD1-CD2 4.36Å; I1579-L1583 HydrophobicContact CD1-CG 3.92Å; I1579-L1583 HydrophobicContact CG1-CD1 4.17Å; I1579-L1583 HydrophobicContact CG1-CG 4.3Å; I1579-L1583 WeakPolarHBondContact O-CG 3.35Å; I1579-L1583 PolarHBondContact O-N 2.94Å; I1580-L1583 PolarHBondContact O-N 3.14Å; N1581-L1583 VanDerWaalsContact C-N 3.34Å; N1581-L1583 PolarHBondContact O-N 2.82Å; L1583-W1586 CarbonylContact O-C 3.55Å; L1583-W1586 PolarHBondContact O-N 3.02Å; L1583-N1587 PolarHBondContact O-N 2.93Å; L1583-N1587 VanDerWaalsContact O-N 3.14Å; L1583-I1588 HydrophobicContact CB-CB 4.41Å; L1583-I1588 HydrophobicContact CD2-CB 4.1Å; L1583-I1588 HydrophobicContact CD2-CD1 3.9Å; L1583-I1588 HydrophobicContact CD2-CG2 4.01Å; L1583-I1588 PolarHBondContact O-N 2.89Å; L1583-F1590 HydrophobicContact CB-CD1 3.86Å; L1583-F1590 HydrophobicContact CB-CE1 4.16Å; L1583-F1590 HydrophobicContact CD1-CB 4.03Å; L1583-F1590 HydrophobicContact CD1-CD1 3.94Å; L1583-F1590 HydrophobicContact CD1-CE1 4.25Å; L1583-F1590 HydrophobicContact CD1-CG 3.98Å; L1583-F1590 HydrophobicContact CG-CD1 4.36Å; L1583-I1602 HydrophobicContact CD1-CG2 3.93Å; L1583-V1603 HydrophobicContact CD1-CG1 3.7Å; L1583-A1604 HydrophobicContact CD1-CB 4.09Å; L1583-A1604 HydrophobicContact CD2-CB 3.96Å; L1583-F1605 HydrophobicContact CD1-CE2 4.4Å; L1583-F1605 HydrophobicContact CD2-CE1 4.41Å; L1583-F1605 HydrophobicContact CD2-CE2 3.82Å; L1583-F1605 HydrophobicContact CD2-CZ 3.52Å
1584	R	79.2	Confident	71.2	Confident	158.6 Å²	158.6	62.4 Å²	62.4	60%	0.598	32%	0.316	S	S	*	.	H	α-helix	trans	-67.8	-41.2	173.9	-73.5	172.1	176.5	175.6	-1.3	112.8	I1580 N1581 C1582 W1586 N1587 F1590	I1580-R1584 WeakPolarHBondContact O-CB 3.29Å; I1580-R1584 WeakPolarHBondContact O-CD 3.25Å; I1580-R1584 VanDerWaalsContact O-CG 3.25Å; I1580-R1584 WeakPolarHBondContact O-CG 3.37Å; I1580-R1584 PolarHBondContact O-N 3.24Å; I1580-R1584 VanDerWaalsContact O-N 3.14Å; N1581-R1584 CarbonylContact O-C 3.5Å; N1581-R1584 WeakPolarHBondContact O-CB 3.17Å; N1581-R1584 PolarHBondContact O-N 2.91Å; N1581-R1584 VanDerWaalsContact O-N 3.08Å; C1582-R1584 VanDerWaalsContact C-N 3.33Å; C1582-R1584 PolarHBondContact O-N 3.1Å; R1584-W1586 PolarHBondContact O-N 2.97Å; R1584-N1587 PolarHBondContact O-N 3.23Å; R1584-F1590 HydrophobicContact CG-CE1 4.15Å; R1584-F1590 HydrophobicContact CG-CZ 4.46Å
1585	D	78.6	Confident	72.3	Confident	69 Å²	69	62 Å²	62	37%	0.369	32%	0.315	S	S	.	.	H	α-helix	trans	-56.9	-37.4	176.3	-67.6	-19	0	0	0	110.1	K1455 N1581 C1582 P1792	K1455-D1585 IonicContact NZ-OD2 3.28Å; K1455-D1585 PolarHBondContact NZ-OD2 3.05Å; N1581-D1585 WeakPolarHBondContact O-CB 3.34Å; N1581-D1585 PolarHBondContact O-N 3.2Å; C1582-D1585 WeakPolarHBondContact O-CB 3.38Å; C1582-D1585 PolarHBondContact O-N 3.25Å; D1585-P1792 HydrophobicContact CB-CB 4.03Å; D1585-P1792 HydrophobicContact CB-CG 3.95Å; D1585-P1792 VanDerWaalsContact O-CB 3.27Å; D1585-P1792 WeakPolarHBondContact O-CB 3.29Å; D1585-P1792 WeakPolarHBondContact O-CG 3.15Å
1586	W	78.7	Confident	73.1	Confident	0.8 Å²	0.8	66.4 Å²	66.4	0%	0.003	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	4	177.2	-78.2	90.4	0	0	0	115	L1439 D1442 Q1443 F1496 C1582 L1583 R1584 I1588 R1791 P1792	L1439-W1586 HydrophobicContact CD2-CD2 4.25Å; L1439-W1586 HydrophobicContact CD2-CG 4.42Å; L1439-W1586 VanDerWaalsContact O-CZ2 3.25Å; L1439-W1586 WeakPolarHBondContact O-CZ2 3.31Å; L1439-W1586 PolarHBondContact O-NE1 3Å; D1442-W1586 HydrophobicContact CB-CH2 3.99Å; D1442-W1586 HydrophobicContact CB-CZ2 4.06Å; D1442-W1586 VanDerWaalsContact CG-CH2 3.46Å; D1442-W1586 WeakPolarHBondContact OD2-CH2 3.28Å; Q1443-W1586 HydrophobicContact CB-CZ2 4.34Å; F1496-W1586 HydrophobicContact CE2-CE3 4.33Å; F1496-W1586 HydrophobicContact CE2-CZ3 4.18Å; F1496-W1586 HydrophobicContact CZ-CD2 4.48Å; F1496-W1586 AromaticContact CZ-CE3 3.88Å; F1496-W1586 HydrophobicContact CZ-CE3 3.88Å; F1496-W1586 AromaticContact CZ-CZ3 3.91Å; F1496-W1586 HydrophobicContact CZ-CZ3 3.91Å; C1582-W1586 VanDerWaalsContact O-CD1 3.28Å; C1582-W1586 PolarHBondContact O-N 3.11Å; C1582-W1586 VanDerWaalsContact O-N 3.14Å; L1583-W1586 CarbonylContact O-C 3.55Å; L1583-W1586 PolarHBondContact O-N 3.02Å; R1584-W1586 PolarHBondContact O-N 2.97Å; W1586-I1588 HydrophobicContact CB-CD1 3.61Å; W1586-I1588 HydrophobicContact CB-CG1 3.86Å; W1586-I1588 HydrophobicContact CG-CD1 4.32Å; W1586-I1588 PolarHBondContact O-N 3.05Å; W1586-I1588 VanDerWaalsContact O-N 3.15Å; W1586-R1791 HydrophobicContact CH2-CB 4.25Å; W1586-R1791 HydrophobicContact CH2-CG 3.98Å; W1586-R1791 HydrophobicContact CZ2-CG 4.35Å; W1586-R1791 HydrophobicContact CZ3-CB 4.25Å; W1586-R1791 HydrophobicContact CZ3-CG 4.2Å; W1586-P1792 HydrophobicContact CD2-CG 4.18Å; W1586-P1792 HydrophobicContact CG-CG 4.15Å; W1586-P1792 HydrophobicContact CZ2-CG 4.48Å
1587	N	76.9	Confident	73.4	Confident	109.4 Å²	109.4	69.6 Å²	69.6	59%	0.585	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	32.7	-175.5	-147.9	28.7	0	0	0	114.5	L1583 R1584 Y1619	L1583-N1587 PolarHBondContact O-N 2.93Å; L1583-N1587 VanDerWaalsContact O-N 3.14Å; R1584-N1587 PolarHBondContact O-N 3.23Å; N1587-Y1619 PolarHBondContact ND2-OH 3.36Å; N1587-Y1619 VanDerWaalsContact ND2-OH 3.14Å
1588	I	80.8	Confident	73.2	Confident	8.4 Å²	8.4	68.3 Å²	68.3	4%	0.043	35%	0.351	C	S	.	.			trans	-86.5	128.8	179.7	-62.7	164	0	0	0	109.8	L1439 F1496 L1583 W1586 F1590 A1604 F1605 Y1789	L1439-I1588 HydrophobicContact CD1-CD1 3.92Å; L1439-I1588 HydrophobicContact CD2-CD1 4.4Å; F1496-I1588 HydrophobicContact CE1-CD1 4.25Å; L1583-I1588 HydrophobicContact CB-CB 4.41Å; L1583-I1588 HydrophobicContact CD2-CB 4.1Å; L1583-I1588 HydrophobicContact CD2-CD1 3.9Å; L1583-I1588 HydrophobicContact CD2-CG2 4.01Å; L1583-I1588 PolarHBondContact O-N 2.89Å; W1586-I1588 HydrophobicContact CB-CD1 3.61Å; W1586-I1588 HydrophobicContact CB-CG1 3.86Å; W1586-I1588 HydrophobicContact CG-CD1 4.32Å; W1586-I1588 PolarHBondContact O-N 3.05Å; W1586-I1588 VanDerWaalsContact O-N 3.15Å; I1588-F1590 VanDerWaalsContact O-CD1 3.32Å; I1588-F1590 WeakPolarHBondContact O-CD1 3.34Å; I1588-A1604 HydrophobicContact CG2-CB 4.42Å; I1588-F1605 HydrophobicContact CB-CE1 4.48Å; I1588-F1605 HydrophobicContact CB-CZ 4.5Å; I1588-F1605 HydrophobicContact CD1-CE1 4.08Å; I1588-F1605 HydrophobicContact CD1-CE2 4.35Å; I1588-F1605 HydrophobicContact CD1-CZ 3.79Å; I1588-F1605 HydrophobicContact CG1-CE1 3.94Å; I1588-F1605 HydrophobicContact CG1-CZ 4.01Å; I1588-F1605 HydrophobicContact CG2-CD1 3.85Å; I1588-F1605 HydrophobicContact CG2-CD2 4.19Å; I1588-F1605 HydrophobicContact CG2-CE1 3.7Å; I1588-F1605 HydrophobicContact CG2-CE2 4.05Å; I1588-F1605 HydrophobicContact CG2-CG 4.1Å; I1588-F1605 HydrophobicContact CG2-CZ 3.92Å; I1588-Y1789 HydrophobicContact CG1-CD1 4.29Å; I1588-Y1789 HydrophobicContact CG1-CE1 4.23Å
1589	L	76.4	Confident	72.6	Confident	103.4 Å²	103.4	70.7 Å²	70.7	54%	0.541	36%	0.358	S	S	.	.			trans	-72.5	134.5	172.6	-69.8	167.1	0	0	0	111.2	F1605 L1611 E1618	L1589-F1605 PolarHBondContact O-N 2.99Å; L1589-L1611 HydrophobicContact CD1-CD1 4.17Å; L1589-L1611 HydrophobicContact CD1-CD2 4.33Å; L1589-E1618 HydrophobicContact CD1-CG 4.15Å
1590	F	79.5	Confident	72	Confident	45.2 Å²	45.2	72.6 Å²	72.6	20%	0.198	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	149.5	177.7	64.4	-89.2	0	0	0	111.7	I1580 L1583 R1584 I1588 V1592 I1602 V1603 A1604	I1580-F1590 HydrophobicContact CB-CZ 4.44Å; I1580-F1590 HydrophobicContact CG1-CE2 4.26Å; I1580-F1590 HydrophobicContact CG1-CZ 4.37Å; I1580-F1590 HydrophobicContact CG2-CE1 4.41Å; I1580-F1590 HydrophobicContact CG2-CE2 4.39Å; I1580-F1590 HydrophobicContact CG2-CZ 3.83Å; L1583-F1590 HydrophobicContact CB-CD1 3.86Å; L1583-F1590 HydrophobicContact CB-CE1 4.16Å; L1583-F1590 HydrophobicContact CD1-CB 4.03Å; L1583-F1590 HydrophobicContact CD1-CD1 3.94Å; L1583-F1590 HydrophobicContact CD1-CE1 4.25Å; L1583-F1590 HydrophobicContact CD1-CG 3.98Å; L1583-F1590 HydrophobicContact CG-CD1 4.36Å; R1584-F1590 HydrophobicContact CG-CE1 4.15Å; R1584-F1590 HydrophobicContact CG-CZ 4.46Å; I1588-F1590 VanDerWaalsContact O-CD1 3.32Å; I1588-F1590 WeakPolarHBondContact O-CD1 3.34Å; F1590-V1592 HydrophobicContact CD2-CG2 3.97Å; F1590-V1592 HydrophobicContact CE2-CG2 3.88Å; F1590-I1602 HydrophobicContact CB-CG2 3.96Å; F1590-I1602 HydrophobicContact CD2-CG2 3.89Å; F1590-I1602 HydrophobicContact CG-CG2 4.16Å; F1590-V1603 VanDerWaalsContact CA-O 3.27Å; F1590-V1603 WeakPolarHBondContact CA-O 3.21Å; F1590-V1603 HydrophobicContact CB-CG1 3.96Å; F1590-V1603 HydrophobicContact CD2-CG1 3.88Å; F1590-V1603 HydrophobicContact CG-CG1 4.04Å; F1590-A1604 WeakPolarHBondContact CA-O 3.49Å
1591	N	74.2	Confident	71.3	Confident	72.6 Å²	72.6	72.2 Å²	72.2	39%	0.388	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	150.9	171	-75	-8.3	0	0	0	110.5	E1593 I1602 V1603 A1604 K1606	N1591-E1593 HydrophobicContact CB-CG 4.09Å; N1591-E1593 WeakPolarHBondContact CB-OE1 3.26Å; N1591-E1593 PolarHBondContact ND2-OE1 3.01Å; N1591-I1602 CarbonylContact O-C 3.54Å; N1591-I1602 WeakPolarHBondContact O-CA 3.39Å; N1591-V1603 PolarHBondContact N-O 3Å; N1591-V1603 VanDerWaalsContact N-O 3.07Å; N1591-V1603 WeakPolarHBondContact O-CA 2.97Å; N1591-V1603 PolarHBondContact O-N 2.8Å; N1591-A1604 PolarHBondContact N-O 2.83Å; N1591-A1604 PolarHBondContact O-N 2.93Å; N1591-K1606 HydrophobicContact CB-CD 4.44Å; N1591-K1606 WeakPolarHBondContact OD1-CE 3.39Å
1592	V	73	Confident	70.7	Confident	67 Å²	67	69.4 Å²	69.4	41%	0.406	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	112.3	168.1	-175.6	0	0	0	0	108.1	I1574 F1590 N1600 S1601 I1602 V1603	I1574-V1592 HydrophobicContact CD1-CB 4.47Å; I1574-V1592 HydrophobicContact CD1-CG1 4.19Å; I1574-V1592 HydrophobicContact CD1-CG2 4.19Å; F1590-V1592 HydrophobicContact CD2-CG2 3.97Å; F1590-V1592 HydrophobicContact CE2-CG2 3.88Å; V1592-N1600 HydrophobicContact CG1-CB 4.35Å; V1592-S1601 CarbonylContact C-O 3.58Å; V1592-S1601 WeakPolarHBondContact CA-O 3.12Å; V1592-I1602 WeakPolarHBondContact CA-O 3.33Å; V1592-I1602 HydrophobicContact CG2-CG1 4.24Å; V1592-V1603 HydrophobicContact CG2-CG2 4.38Å
1593	E	69.6	Low	70.1	Confident	66 Å²	66	70.3 Å²	70.3	31%	0.308	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	150.4	-176	-71.9	172.4	-165.7	0	0	110.7	N1591 N1600 S1601 I1602 V1603 K1606	N1591-E1593 HydrophobicContact CB-CG 4.09Å; N1591-E1593 WeakPolarHBondContact CB-OE1 3.26Å; N1591-E1593 PolarHBondContact ND2-OE1 3.01Å; E1593-N1600 CarbonylContact O-C 3.56Å; E1593-N1600 VanDerWaalsContact O-CA 3.31Å; E1593-N1600 WeakPolarHBondContact O-CA 3.27Å; E1593-S1601 PolarHBondContact N-O 2.95Å; E1593-S1601 CarbonylContact O-C 3.57Å; E1593-S1601 VanDerWaalsContact O-CA 3.24Å; E1593-S1601 WeakPolarHBondContact O-CA 3.19Å; E1593-S1601 PolarHBondContact O-N 2.89Å; E1593-S1601 PolarHBondContact O-OG 3.06Å; E1593-I1602 PolarHBondContact N-O 3.09Å; E1593-I1602 PolarHBondContact O-N 3.34Å; E1593-V1603 HydrophobicContact CB-CG2 4.46Å; E1593-K1606 VanDerWaalsContact OE1-CD 3.31Å; E1593-K1606 WeakPolarHBondContact OE1-CD 3.43Å; E1593-K1606 VanDerWaalsContact OE1-CE 3.27Å; E1593-K1606 WeakPolarHBondContact OE1-CE 3.33Å; E1593-K1606 IonicContact OE1-NZ 3.22Å; E1593-K1606 PolarHBondContact OE1-NZ 3.1Å; E1593-K1606 IonicContact OE2-NZ 2.77Å; E1593-K1606 PolarHBondContact OE2-NZ 3.3Å
1594	K	65.1	Low	69.3	Low	167.2 Å²	167.2	70.5 Å²	70.5	73%	0.727	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	117.9	170.7	-90.8	179.3	179.8	-177.1	0	108.5	G1598 Q1599 N1600	K1594-G1598 WeakPolarHBondContact CE-O 3.44Å; K1594-Q1599 CarbonylContact C-O 3.16Å; K1594-Q1599 WeakPolarHBondContact CA-O 3.41Å; K1594-N1600 VanDerWaalsContact CE-OD1 3.25Å; K1594-N1600 WeakPolarHBondContact CE-OD1 3.27Å; K1594-N1600 VanDerWaalsContact CG-OD1 3.23Å; K1594-N1600 WeakPolarHBondContact CG-OD1 3.31Å
1595	L	60.8	Low	68.8	Low	63.8 Å²	63.8	63.9 Å²	63.9	33%	0.334	34%	0.335	S	S	.	.			trans	-66.6	156.7	170.4	-70.4	165.6	0	0	0	109.9	I1553 N1597 G1598 Q1599 N1600 S1601 I1602	I1553-L1595 HydrophobicContact CG2-CD1 4.44Å; L1595-N1597 VanDerWaalsContact CB-OD1 3.25Å; L1595-N1597 WeakPolarHBondContact CB-OD1 3.06Å; L1595-N1597 PolarHBondContact O-N 2.92Å; L1595-N1597 VanDerWaalsContact O-N 3.1Å; L1595-G1598 WeakPolarHBondContact O-CA 3.42Å; L1595-G1598 PolarHBondContact O-N 3.04Å; L1595-Q1599 WeakPolarHBondContact CB-O 3.38Å; L1595-Q1599 HydrophobicContact CD1-CB 4.49Å; L1595-Q1599 PolarHBondContact N-O 2.99Å; L1595-N1600 HydrophobicContact CD1-CB 3.65Å; L1595-N1600 PolarHBondContact N-O 2.89Å; L1595-S1601 VanDerWaalsContact CG-OG 3.31Å; L1595-S1601 WeakPolarHBondContact CG-OG 3.46Å; L1595-I1602 HydrophobicContact CD1-CD1 3.96Å; L1595-I1602 HydrophobicContact CD1-CG1 4.04Å; L1595-I1602 HydrophobicContact CD2-CD1 4.33Å; L1595-I1602 HydrophobicContact CG-CD1 4.22Å; L1595-I1602 HydrophobicContact CG-CG1 4.49Å
1596	E	59.5	Low	67.9	Low	209.6 Å²	209.6	65.1 Å²	65.1	98%	0.979	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.7	-179.9	-63.6	-178.1	162.1	0	0	113	G1598	E1596-G1598 PolarHBondContact O-N 3.13Å
1597	N	59.1	Low	67	Low	101.2 Å²	101.2	68.2 Å²	68.2	54%	0.541	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	1.3	175	55	16.2	0	0	0	114.1	L1595 Q1599	L1595-N1597 VanDerWaalsContact CB-OD1 3.25Å; L1595-N1597 WeakPolarHBondContact CB-OD1 3.06Å; L1595-N1597 PolarHBondContact O-N 2.92Å; L1595-N1597 VanDerWaalsContact O-N 3.1Å; N1597-Q1599 VanDerWaalsContact C-N 3.28Å; N1597-Q1599 PolarHBondContact ND2-OE1 3.14Å; N1597-Q1599 VanDerWaalsContact ND2-OE1 3.1Å; N1597-Q1599 PolarHBondContact O-N 3.11Å; N1597-Q1599 VanDerWaalsContact OD1-CB 3.27Å; N1597-Q1599 WeakPolarHBondContact OD1-CB 3.28Å; N1597-Q1599 WeakPolarHBondContact OD1-CG 3.33Å; N1597-Q1599 PolarHBondContact OD1-N 3.36Å
1598	G	59	Low	66.5	Low	54 Å²	54	64.4 Å²	64.4	56%	0.557	33%	0.332	S	S	*	.	S	Bend	trans	78.6	-4.9	179.1	0	0	0	0	0	115.5	K1594 L1595 E1596	K1594-G1598 WeakPolarHBondContact CE-O 3.44Å; L1595-G1598 WeakPolarHBondContact O-CA 3.42Å; L1595-G1598 PolarHBondContact O-N 3.04Å; E1596-G1598 PolarHBondContact O-N 3.13Å
1599	Q	60.2	Low	65.5	Low	92.2 Å²	92.2	69.4 Å²	69.4	43%	0.431	35%	0.354	S	S	.	.			trans	-82.7	140.8	178.4	-63.2	178.8	-23.3	0	0	111.4	N1557 K1594 L1595 N1597	N1557-Q1599 PolarHBondContact OD1-NE2 3.29Å; K1594-Q1599 CarbonylContact C-O 3.16Å; K1594-Q1599 WeakPolarHBondContact CA-O 3.41Å; L1595-Q1599 WeakPolarHBondContact CB-O 3.38Å; L1595-Q1599 HydrophobicContact CD1-CB 4.49Å; L1595-Q1599 PolarHBondContact N-O 2.99Å; N1597-Q1599 VanDerWaalsContact C-N 3.28Å; N1597-Q1599 PolarHBondContact ND2-OE1 3.14Å; N1597-Q1599 VanDerWaalsContact ND2-OE1 3.1Å; N1597-Q1599 PolarHBondContact O-N 3.11Å; N1597-Q1599 VanDerWaalsContact OD1-CB 3.27Å; N1597-Q1599 WeakPolarHBondContact OD1-CB 3.28Å; N1597-Q1599 WeakPolarHBondContact OD1-CG 3.33Å; N1597-Q1599 PolarHBondContact OD1-N 3.36Å
1600	N	64.6	Low	65.1	Low	41 Å²	41	69.8 Å²	69.8	22%	0.219	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	137.6	173.2	-65.9	-17.1	0	0	0	109.5	C1556 N1558 L1559 V1592 E1593 K1594 L1595	C1556-N1600 WeakPolarHBondContact CA-O 3.22Å; C1556-N1600 HydrophobicContact CB-CB 4.22Å; C1556-N1600 VanDerWaalsContact CB-O 3.31Å; C1556-N1600 WeakPolarHBondContact CB-O 3.29Å; C1556-N1600 PolarHBondContact N-O 3.05Å; N1558-N1600 PolarHBondContact ND2-ND2 2.86Å; N1558-N1600 VanDerWaalsContact ND2-ND2 3.12Å; N1558-N1600 PolarHBondContact OD1-ND2 2.84Å; L1559-N1600 WeakPolarHBondContact CB-ND2 3.4Å; L1559-N1600 HydrophobicContact CD1-CB 3.88Å; V1592-N1600 HydrophobicContact CG1-CB 4.35Å; E1593-N1600 CarbonylContact O-C 3.56Å; E1593-N1600 VanDerWaalsContact O-CA 3.31Å; E1593-N1600 WeakPolarHBondContact O-CA 3.27Å; K1594-N1600 VanDerWaalsContact CE-OD1 3.25Å; K1594-N1600 WeakPolarHBondContact CE-OD1 3.27Å; K1594-N1600 VanDerWaalsContact CG-OD1 3.23Å; K1594-N1600 WeakPolarHBondContact CG-OD1 3.31Å; L1595-N1600 HydrophobicContact CD1-CB 3.65Å; L1595-N1600 PolarHBondContact N-O 2.89Å
1601	S	62.6	Low	64.8	Low	10 Å²	10	69.6 Å²	69.6	7%	0.07	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	142.1	171.2	70.7	0	0	0	0	110.5	V1554 C1556 N1558 V1592 E1593 L1595 V1603	V1554-S1601 CarbonylContact O-C 3.47Å; V1554-S1601 VanDerWaalsContact O-CA 3.24Å; V1554-S1601 WeakPolarHBondContact O-CA 3.27Å; V1554-S1601 WeakPolarHBondContact O-CB 3.21Å; C1556-S1601 CarbonylContact C-O 3.49Å; C1556-S1601 WeakPolarHBondContact CA-O 3.23Å; C1556-S1601 WeakPolarHBondContact CB-O 3.26Å; C1556-S1601 PolarHBondContact N-O 2.97Å; C1556-S1601 PolarHBondContact O-N 3.17Å; C1556-S1601 PolarHBondContact O-OG 3.06Å; N1558-S1601 PolarHBondContact ND2-OG 3.28Å; V1592-S1601 CarbonylContact C-O 3.58Å; V1592-S1601 WeakPolarHBondContact CA-O 3.12Å; E1593-S1601 PolarHBondContact N-O 2.95Å; E1593-S1601 CarbonylContact O-C 3.57Å; E1593-S1601 VanDerWaalsContact O-CA 3.24Å; E1593-S1601 WeakPolarHBondContact O-CA 3.19Å; E1593-S1601 PolarHBondContact O-N 2.89Å; E1593-S1601 PolarHBondContact O-OG 3.06Å; L1595-S1601 VanDerWaalsContact CG-OG 3.31Å; L1595-S1601 WeakPolarHBondContact CG-OG 3.46Å; S1601-V1603 PolarHBondContact O-N 2.9Å
1602	I	65.3	Low	65.3	Low	17.2 Å²	17.2	66.3 Å²	66.3	9%	0.088	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	120.1	169.1	-63.7	168.1	0	0	0	107.3	I1553 V1554 C1556 I1579 I1580 L1583 F1590 N1591 V1592 E1593 L1595 A1604	I1553-I1602 HydrophobicContact CG2-CG2 3.77Å; V1554-I1602 HydrophobicContact CB-CB 4.32Å; V1554-I1602 PolarHBondContact N-O 2.94Å; V1554-I1602 PolarHBondContact O-N 3.12Å; C1556-I1602 VanDerWaalsContact SG-CD1 3.59Å; C1556-I1602 WeakPolarHBondContact SG-CD1 3.27Å; I1579-I1602 HydrophobicContact CG2-CD1 3.78Å; I1580-I1602 HydrophobicContact CD1-CD1 4.06Å; I1580-I1602 HydrophobicContact CG1-CD1 3.69Å; L1583-I1602 HydrophobicContact CD1-CG2 3.93Å; F1590-I1602 HydrophobicContact CB-CG2 3.96Å; F1590-I1602 HydrophobicContact CD2-CG2 3.89Å; F1590-I1602 HydrophobicContact CG-CG2 4.16Å; N1591-I1602 CarbonylContact O-C 3.54Å; N1591-I1602 WeakPolarHBondContact O-CA 3.39Å; V1592-I1602 WeakPolarHBondContact CA-O 3.33Å; V1592-I1602 HydrophobicContact CG2-CG1 4.24Å; E1593-I1602 PolarHBondContact N-O 3.09Å; E1593-I1602 PolarHBondContact O-N 3.34Å; L1595-I1602 HydrophobicContact CD1-CD1 3.96Å; L1595-I1602 HydrophobicContact CD1-CG1 4.04Å; L1595-I1602 HydrophobicContact CD2-CD1 4.33Å; L1595-I1602 HydrophobicContact CG-CD1 4.22Å; L1595-I1602 HydrophobicContact CG-CG1 4.49Å; I1602-A1604 VanDerWaalsContact C-N 3.33Å; I1602-A1604 HydrophobicContact CG2-CB 4.21Å; I1602-A1604 PolarHBondContact O-N 2.93Å
1603	V	66.4	Low	65.7	Low	18.8 Å²	18.8	69.7 Å²	69.7	11%	0.114	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	101.1	170.8	-175.3	0	0	0	0	107.7	I1553 V1554 C1556 L1583 F1590 N1591 V1592 E1593 S1601 K1606	I1553-V1603 HydrophobicContact CG1-CG1 4.23Å; I1553-V1603 HydrophobicContact CG1-CG2 4.4Å; V1554-V1603 PolarHBondContact N-O 2.94Å; V1554-V1603 PolarHBondContact O-N 2.88Å; C1556-V1603 HydrophobicContact CB-CG2 4.39Å; C1556-V1603 WeakPolarHBondContact SG-CG2 3.28Å; L1583-V1603 HydrophobicContact CD1-CG1 3.7Å; F1590-V1603 VanDerWaalsContact CA-O 3.27Å; F1590-V1603 WeakPolarHBondContact CA-O 3.21Å; F1590-V1603 HydrophobicContact CB-CG1 3.96Å; F1590-V1603 HydrophobicContact CD2-CG1 3.88Å; F1590-V1603 HydrophobicContact CG-CG1 4.04Å; N1591-V1603 PolarHBondContact N-O 3Å; N1591-V1603 VanDerWaalsContact N-O 3.07Å; N1591-V1603 WeakPolarHBondContact O-CA 2.97Å; N1591-V1603 PolarHBondContact O-N 2.8Å; V1592-V1603 HydrophobicContact CG2-CG2 4.38Å; E1593-V1603 HydrophobicContact CB-CG2 4.46Å; S1601-V1603 PolarHBondContact O-N 2.9Å; V1603-K1606 HydrophobicContact CB-CB 4.41Å; V1603-K1606 HydrophobicContact CB-CD 4.28Å; V1603-K1606 HydrophobicContact CG1-CB 4.05Å; V1603-K1606 HydrophobicContact CG1-CD 4.1Å; V1603-K1606 HydrophobicContact CG1-CG 4.31Å
1604	A	66.1	Low	66.4	Low	5.4 Å²	5.4	72 Å²	72	5%	0.045	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	144.1	172.8	0	0	0	0	0	110.8	L1435 K1552 L1583 I1588 F1590 N1591 I1602 K1606	L1435-A1604 HydrophobicContact CD2-CB 3.92Å; K1552-A1604 PolarHBondContact O-N 2.97Å; L1583-A1604 HydrophobicContact CD1-CB 4.09Å; L1583-A1604 HydrophobicContact CD2-CB 3.96Å; I1588-A1604 HydrophobicContact CG2-CB 4.42Å; F1590-A1604 WeakPolarHBondContact CA-O 3.49Å; N1591-A1604 PolarHBondContact N-O 2.83Å; N1591-A1604 PolarHBondContact O-N 2.93Å; I1602-A1604 VanDerWaalsContact C-N 3.33Å; I1602-A1604 HydrophobicContact CG2-CB 4.21Å; I1602-A1604 PolarHBondContact O-N 2.93Å; A1604-K1606 WeakPolarHBondContact O-CB 3.31Å; A1604-K1606 PolarHBondContact O-N 3.12Å
1605	F	68.3	Low	67.3	Low	20 Å²	20	65.3 Å²	65.3	9%	0.088	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	39.6	34.5	172.1	-59.4	-95.4	0	0	0	113.8	L1435 I1495 F1496 K1552 L1583 I1588 L1589 N1607 E1608 Y1789	L1435-F1605 HydrophobicContact CD1-CE2 4.5Å; L1435-F1605 HydrophobicContact CD1-CZ 3.94Å; L1435-F1605 HydrophobicContact CD2-CE2 3.39Å; L1435-F1605 HydrophobicContact CD2-CZ 3.57Å; L1435-F1605 HydrophobicContact CG-CZ 4.4Å; I1495-F1605 HydrophobicContact CG2-CD2 4.3Å; I1495-F1605 HydrophobicContact CG2-CE2 3.34Å; I1495-F1605 HydrophobicContact CG2-CZ 3.53Å; I1495-F1605 VanDerWaalsContact CG2-CZ 3.48Å; F1496-F1605 AromaticContact CD1-CE1 3.92Å; F1496-F1605 HydrophobicContact CD1-CE1 3.92Å; F1496-F1605 AromaticContact CD1-CZ 3.99Å; F1496-F1605 HydrophobicContact CD1-CZ 4Å; F1496-F1605 HydrophobicContact CE1-CE1 4.08Å; F1496-F1605 AromaticContact CE1-CZ 3.92Å; F1496-F1605 HydrophobicContact CE1-CZ 3.96Å; K1552-F1605 HydrophobicContact CB-CB 4.02Å; K1552-F1605 HydrophobicContact CB-CD1 4.36Å; K1552-F1605 HydrophobicContact CB-CD2 4.26Å; K1552-F1605 HydrophobicContact CB-CG 3.9Å; K1552-F1605 HydrophobicContact CD-CB 4.2Å; K1552-F1605 HydrophobicContact CD-CD1 4.06Å; K1552-F1605 HydrophobicContact CD-CD2 3.71Å; K1552-F1605 HydrophobicContact CD-CE2 4.43Å; K1552-F1605 HydrophobicContact CD-CG 4.22Å; K1552-F1605 HydrophobicContact CG-CB 4.39Å; K1552-F1605 HydrophobicContact CG-CD1 3.92Å; K1552-F1605 HydrophobicContact CG-CD2 3.91Å; K1552-F1605 HydrophobicContact CG-CE1 4.25Å; K1552-F1605 HydrophobicContact CG-CE2 4.29Å; K1552-F1605 HydrophobicContact CG-CG 3.98Å; K1552-F1605 VanDerWaalsContact O-CD2 3.23Å; K1552-F1605 WeakPolarHBondContact O-CD2 3.39Å; K1552-F1605 PolarHBondContact O-N 2.83Å; K1552-F1605 VanDerWaalsContact O-N 3.08Å; L1583-F1605 HydrophobicContact CD1-CE2 4.4Å; L1583-F1605 HydrophobicContact CD2-CE1 4.41Å; L1583-F1605 HydrophobicContact CD2-CE2 3.82Å; L1583-F1605 HydrophobicContact CD2-CZ 3.52Å; I1588-F1605 HydrophobicContact CB-CE1 4.48Å; I1588-F1605 HydrophobicContact CB-CZ 4.5Å; I1588-F1605 HydrophobicContact CD1-CE1 4.08Å; I1588-F1605 HydrophobicContact CD1-CE2 4.35Å; I1588-F1605 HydrophobicContact CD1-CZ 3.79Å; I1588-F1605 HydrophobicContact CG1-CE1 3.94Å; I1588-F1605 HydrophobicContact CG1-CZ 4.01Å; I1588-F1605 HydrophobicContact CG2-CD1 3.85Å; I1588-F1605 HydrophobicContact CG2-CD2 4.19Å; I1588-F1605 HydrophobicContact CG2-CE1 3.7Å; I1588-F1605 HydrophobicContact CG2-CE2 4.05Å; I1588-F1605 HydrophobicContact CG2-CG 4.1Å; I1588-F1605 HydrophobicContact CG2-CZ 3.92Å; L1589-F1605 PolarHBondContact O-N 2.99Å; F1605-N1607 PolarHBondContact O-N 2.89Å; F1605-E1608 HydrophobicContact CB-CG 3.95Å; F1605-E1608 HydrophobicContact CD1-CG 4.35Å; F1605-E1608 VanDerWaalsContact CD1-OE1 3.23Å; F1605-E1608 WeakPolarHBondContact CD1-OE1 3.43Å; F1605-E1608 WeakPolarHBondContact CD1-OE2 3.08Å; F1605-E1608 WeakPolarHBondContact O-CG 3.35Å; F1605-Y1789 HydrophobicContact CD1-CE1 4.38Å; F1605-Y1789 HydrophobicContact CE1-CD1 4.49Å; F1605-Y1789 AromaticContact CE1-CE1 3.98Å; F1605-Y1789 HydrophobicContact CE1-CE1 4.07Å
1606	K	60.6	Low	68.5	Low	93.2 Å²	93.2	65 Å²	65	41%	0.405	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	137.7	177	-135.3	175.2	178.1	-178.6	0	110.2	N1591 E1593 V1603 A1604 E1608	N1591-K1606 HydrophobicContact CB-CD 4.44Å; N1591-K1606 WeakPolarHBondContact OD1-CE 3.39Å; E1593-K1606 VanDerWaalsContact OE1-CD 3.31Å; E1593-K1606 WeakPolarHBondContact OE1-CD 3.43Å; E1593-K1606 VanDerWaalsContact OE1-CE 3.27Å; E1593-K1606 WeakPolarHBondContact OE1-CE 3.33Å; E1593-K1606 IonicContact OE1-NZ 3.22Å; E1593-K1606 PolarHBondContact OE1-NZ 3.1Å; E1593-K1606 IonicContact OE2-NZ 2.77Å; E1593-K1606 PolarHBondContact OE2-NZ 3.3Å; V1603-K1606 HydrophobicContact CB-CB 4.41Å; V1603-K1606 HydrophobicContact CB-CD 4.28Å; V1603-K1606 HydrophobicContact CG1-CB 4.05Å; V1603-K1606 HydrophobicContact CG1-CD 4.1Å; V1603-K1606 HydrophobicContact CG1-CG 4.31Å; A1604-K1606 WeakPolarHBondContact O-CB 3.31Å; A1604-K1606 PolarHBondContact O-N 3.12Å; K1606-E1608 VanDerWaalsContact C-N 3.27Å; K1606-E1608 PolarHBondContact O-N 3.12Å; K1606-E1608 VanDerWaalsContact O-N 3.1Å
1607	N	59.2	Low	69.6	Low	67 Å²	67	55.6 Å²	55.6	36%	0.358	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	22.8	29.8	-177.4	-75	9.9	0	0	0	113.3	F1605 F1609 E1610 L1611	F1605-N1607 PolarHBondContact O-N 2.89Å; N1607-F1609 HydrophobicContact CB-CD2 4.49Å; N1607-F1609 PolarHBondContact O-N 3.13Å; N1607-E1610 HydrophobicContact CB-CB 4.33Å; N1607-E1610 HydrophobicContact CB-CG 4.27Å; N1607-E1610 WeakPolarHBondContact CB-OE2 3.32Å; N1607-E1610 VanDerWaalsContact CG-OE2 3.28Å; N1607-E1610 PolarHBondContact ND2-OE2 3.02Å; N1607-E1610 VanDerWaalsContact ND2-OE2 3.14Å; N1607-E1610 WeakPolarHBondContact O-CA 3.26Å; N1607-E1610 VanDerWaalsContact O-CB 3.29Å; N1607-E1610 WeakPolarHBondContact O-CB 3.23Å; N1607-E1610 PolarHBondContact O-N 2.97Å; N1607-E1610 VanDerWaalsContact O-N 3.07Å; N1607-L1611 PolarHBondContact O-N 3.13Å
1608	E	65.1	Low	70.4	Confident	29.8 Å²	29.8	54.6 Å²	54.6	14%	0.139	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-28.7	177.4	-78.6	-155.8	153.1	0	0	113.6	K1552 F1605 K1606 E1610 L1611 R1717 Y1789	K1552-E1608 IonicContact NZ-OE1 2.72Å; K1552-E1608 PolarHBondContact NZ-OE1 3.43Å; K1552-E1608 IonicContact NZ-OE2 3.75Å; F1605-E1608 HydrophobicContact CB-CG 3.95Å; F1605-E1608 HydrophobicContact CD1-CG 4.35Å; F1605-E1608 VanDerWaalsContact CD1-OE1 3.23Å; F1605-E1608 WeakPolarHBondContact CD1-OE1 3.43Å; F1605-E1608 WeakPolarHBondContact CD1-OE2 3.08Å; F1605-E1608 WeakPolarHBondContact O-CG 3.35Å; K1606-E1608 VanDerWaalsContact C-N 3.27Å; K1606-E1608 PolarHBondContact O-N 3.12Å; K1606-E1608 VanDerWaalsContact O-N 3.1Å; E1608-E1610 PolarHBondContact O-N 3.17Å; E1608-L1611 HydrophobicContact CB-CD1 4.31Å; E1608-L1611 HydrophobicContact CG-CD1 4.21Å; E1608-L1611 PolarHBondContact O-N 3.04Å; E1608-R1717 VanDerWaalsContact CB-NH1 3.34Å; E1608-R1717 PolarHBondContact O-NH1 3.38Å; E1608-R1717 IonicContact OE1-CZ 3.17Å; E1608-R1717 IonicContact OE1-NH1 3.21Å; E1608-R1717 IonicContact OE1-NH2 2.95Å; E1608-R1717 PolarHBondContact OE1-NH2 3.07Å; E1608-R1717 IonicContact OE2-CZ 2.69Å; E1608-R1717 IonicContact OE2-NH1 2.95Å; E1608-R1717 PolarHBondContact OE2-NH1 3.1Å; E1608-R1717 IonicContact OE2-NH2 2.87Å; E1608-Y1789 PolarHBondContact OE1-OH 3.19Å; E1608-Y1789 PolarHBondContact OE2-OH 3.24Å
1609	F	61.3	Low	71.3	Confident	112.4 Å²	112.4	58.1 Å²	58.1	49%	0.493	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.2	172.5	-21.7	-83.2	0	0	0	113.4	N1607 K1613	N1607-F1609 HydrophobicContact CB-CD2 4.49Å; N1607-F1609 PolarHBondContact O-N 3.13Å; F1609-K1613 VanDerWaalsContact O-CD 3.27Å; F1609-K1613 WeakPolarHBondContact O-CD 3.45Å; F1609-K1613 WeakPolarHBondContact O-CE 3.3Å; F1609-K1613 WeakPolarHBondContact O-CG 3.24Å; F1609-K1613 PolarHBondContact O-NZ 3.13Å
1610	E	67.1	Low	72.3	Confident	112.6 Å²	112.6	55.1 Å²	55.1	53%	0.526	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-21.4	177.4	-58.9	-173.7	158.9	0	0	112.9	N1607 E1608 W1612 K1613	N1607-E1610 HydrophobicContact CB-CB 4.33Å; N1607-E1610 HydrophobicContact CB-CG 4.27Å; N1607-E1610 WeakPolarHBondContact CB-OE2 3.32Å; N1607-E1610 VanDerWaalsContact CG-OE2 3.28Å; N1607-E1610 PolarHBondContact ND2-OE2 3.02Å; N1607-E1610 VanDerWaalsContact ND2-OE2 3.14Å; N1607-E1610 WeakPolarHBondContact O-CA 3.26Å; N1607-E1610 VanDerWaalsContact O-CB 3.29Å; N1607-E1610 WeakPolarHBondContact O-CB 3.23Å; N1607-E1610 PolarHBondContact O-N 2.97Å; N1607-E1610 VanDerWaalsContact O-N 3.07Å; E1608-E1610 PolarHBondContact O-N 3.17Å; E1610-W1612 PolarHBondContact O-N 2.97Å; E1610-K1613 WeakPolarHBondContact O-CB 3.32Å; E1610-K1613 PolarHBondContact O-N 2.89Å
1611	L	74.1	Confident	73.3	Confident	40.4 Å²	40.4	53.7 Å²	53.7	21%	0.212	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	135.1	179.2	-67.5	171.8	0	0	0	110.7	L1589 N1607 E1608 K1613 E1618 R1717	L1589-L1611 HydrophobicContact CD1-CD1 4.17Å; L1589-L1611 HydrophobicContact CD1-CD2 4.33Å; N1607-L1611 PolarHBondContact O-N 3.13Å; E1608-L1611 HydrophobicContact CB-CD1 4.31Å; E1608-L1611 HydrophobicContact CG-CD1 4.21Å; E1608-L1611 PolarHBondContact O-N 3.04Å; L1611-K1613 PolarHBondContact O-N 2.96Å; L1611-K1613 VanDerWaalsContact O-N 3.11Å; L1611-E1618 HydrophobicContact CD2-CG 4.39Å; L1611-R1717 VanDerWaalsContact CD1-CZ 3.47Å; L1611-R1717 VanDerWaalsContact CD1-NH2 3.31Å
1612	W	84.5	Confident	74.5	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.015	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	7.9	179.4	-53.5	12.6	0	0	0	114.6	E1610 D1614 G1615 L1616 D1617 E1618 K1624 V1712 S1713 A1714 L1716 R1717 L1720 L1788	E1610-W1612 PolarHBondContact O-N 2.97Å; W1612-D1614 VanDerWaalsContact C-N 3.31Å; W1612-D1614 PolarHBondContact O-N 2.87Å; W1612-G1615 PolarHBondContact O-N 3.05Å; W1612-L1616 WeakPolarHBondContact CA-O 3.28Å; W1612-D1617 HydrophobicContact CZ2-CB 4.39Å; W1612-E1618 VanDerWaalsContact NE1-CD 3.32Å; W1612-E1618 PolarHBondContact NE1-OE1 3.08Å; W1612-E1618 PolarHBondContact NE1-OE2 3.25Å; W1612-E1618 VanDerWaalsContact NE1-OE2 3.12Å; W1612-K1624 HydrophobicContact CH2-CD 4.42Å; W1612-K1624 VanDerWaalsContact CH2-CE 3.49Å; W1612-K1624 HydrophobicContact CH2-CG 4.38Å; W1612-K1624 VanDerWaalsContact CZ2-CE 3.48Å; W1612-K1624 HydrophobicContact CZ3-CG 4.4Å; W1612-V1712 HydrophobicContact CB-CG1 3.52Å; W1612-V1712 VanDerWaalsContact CB-CG1 3.49Å; W1612-V1712 HydrophobicContact CD2-CG1 3.65Å; W1612-V1712 HydrophobicContact CE3-CG1 3.85Å; W1612-V1712 HydrophobicContact CG-CG1 3.5Å; W1612-V1712 VanDerWaalsContact CG-CG1 3.47Å; W1612-S1713 CarbonylContact O-C 3.55Å; W1612-S1713 VanDerWaalsContact O-C 3.3Å; W1612-S1713 VanDerWaalsContact O-CA 3.24Å; W1612-S1713 WeakPolarHBondContact O-CA 3.4Å; W1612-A1714 PolarHBondContact O-N 2.86Å; W1612-A1714 VanDerWaalsContact O-N 3.1Å; W1612-L1716 HydrophobicContact CE3-CB 4.44Å; W1612-L1716 HydrophobicContact CE3-CD2 4.47Å; W1612-L1716 HydrophobicContact CE3-CG 4.49Å; W1612-L1716 HydrophobicContact CZ3-CB 4.32Å; W1612-L1716 HydrophobicContact CZ3-CD2 3.96Å; W1612-L1716 HydrophobicContact CZ3-CG 3.94Å; W1612-R1717 HydrophobicContact CB-CB 4.46Å; W1612-R1717 HydrophobicContact CD2-CB 3.87Å; W1612-R1717 HydrophobicContact CD2-CG 4.01Å; W1612-R1717 HydrophobicContact CE3-CB 3.56Å; W1612-R1717 HydrophobicContact CE3-CG 4.08Å; W1612-R1717 HydrophobicContact CG-CB 4.33Å; W1612-R1717 HydrophobicContact CG-CG 4.41Å; W1612-R1717 HydrophobicContact CH2-CG 4.39Å; W1612-R1717 HydrophobicContact CZ2-CG 4.38Å; W1612-R1717 HydrophobicContact CZ3-CB 3.98Å; W1612-R1717 HydrophobicContact CZ3-CG 4.33Å; W1612-L1720 HydrophobicContact CH2-CD1 3.82Å; W1612-L1720 HydrophobicContact CZ3-CD1 3.96Å; W1612-L1788 HydrophobicContact CH2-CD2 3.53Å; W1612-L1788 VanDerWaalsContact CH2-CD2 3.49Å; W1612-L1788 HydrophobicContact CZ2-CD2 3.74Å; W1612-L1788 HydrophobicContact CZ3-CD2 4.45Å
1613	K	81.4	Confident	75.6	Confident	137.4 Å²	137.4	59.7 Å²	59.7	60%	0.597	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-28.3	174.1	-84.1	-168.8	171.4	147	0	113.7	F1609 E1610 L1611 G1615 A1714	F1609-K1613 VanDerWaalsContact O-CD 3.27Å; F1609-K1613 WeakPolarHBondContact O-CD 3.45Å; F1609-K1613 WeakPolarHBondContact O-CE 3.3Å; F1609-K1613 WeakPolarHBondContact O-CG 3.24Å; F1609-K1613 PolarHBondContact O-NZ 3.13Å; E1610-K1613 WeakPolarHBondContact O-CB 3.32Å; E1610-K1613 PolarHBondContact O-N 2.89Å; L1611-K1613 PolarHBondContact O-N 2.96Å; L1611-K1613 VanDerWaalsContact O-N 3.11Å; K1613-G1615 VanDerWaalsContact C-N 3.3Å; K1613-G1615 PolarHBondContact O-N 3.15Å; K1613-A1714 HydrophobicContact CG-CB 3.91Å
1614	D	83.4	Confident	76.7	Confident	115.2 Å²	115.2	59.1 Å²	59.1	62%	0.616	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	0.9	178	63.5	-18.7	0	0	0	113.2	W1612 L1616	W1612-D1614 VanDerWaalsContact C-N 3.31Å; W1612-D1614 PolarHBondContact O-N 2.87Å; D1614-L1616 VanDerWaalsContact C-N 3.31Å; D1614-L1616 PolarHBondContact OD1-N 3.3Å; D1614-L1616 VanDerWaalsContact OD1-N 3.09Å
1615	G	85.1	Confident	77.6	Confident	26 Å²	26	59.5 Å²	59.5	27%	0.268	29%	0.29	S	S	.	.	S	Bend	trans	78.2	15.2	-175.3	0	0	0	0	0	113.9	W1612 K1613 V1712	W1612-G1615 PolarHBondContact O-N 3.05Å; K1613-G1615 VanDerWaalsContact C-N 3.3Å; K1613-G1615 PolarHBondContact O-N 3.15Å; G1615-V1712 WeakPolarHBondContact CA-O 3.34Å
1616	L	84.9	Confident	78.7	Confident	58.4 Å²	58.4	58.7 Å²	58.7	31%	0.306	29%	0.287	S	S	.	.			trans	-124.6	141.9	178.1	-64.1	172.7	0	0	0	111.4	W1612 D1614 C1621 Q1622 V1712	W1612-L1616 WeakPolarHBondContact CA-O 3.28Å; D1614-L1616 VanDerWaalsContact C-N 3.31Å; D1614-L1616 PolarHBondContact OD1-N 3.3Å; D1614-L1616 VanDerWaalsContact OD1-N 3.09Å; L1616-C1621 WeakPolarHBondContact CA-O 3.29Å; L1616-Q1622 HydrophobicContact CD2-CB 4.46Å; L1616-Q1622 HydrophobicContact CD2-CG 3.45Å; L1616-Q1622 VanDerWaalsContact CD2-CG 3.43Å; L1616-V1712 VanDerWaalsContact C-CG1 3.49Å
1617	D	82.9	Confident	80	Confident	11 Å²	11	54.8 Å²	54.8	6%	0.059	27%	0.271	C	S	.	.			trans	-82.9	179.9	173.3	78.8	-4.4	0	0	0	112.2	W1612 Y1619 G1620 C1621 K1624 V1712	W1612-D1617 HydrophobicContact CZ2-CB 4.39Å; D1617-Y1619 PolarHBondContact O-N 3.02Å; D1617-Y1619 VanDerWaalsContact OD1-C 3.28Å; D1617-Y1619 VanDerWaalsContact OD1-CA 3.29Å; D1617-Y1619 WeakPolarHBondContact OD1-CA 3.22Å; D1617-Y1619 WeakPolarHBondContact OD1-CB 3.3Å; D1617-Y1619 PolarHBondContact OD1-N 2.91Å; D1617-G1620 PolarHBondContact O-N 3.04Å; D1617-G1620 PolarHBondContact OD1-N 3.06Å; D1617-C1621 VanDerWaalsContact CG-CB 3.49Å; D1617-C1621 PolarHBondContact N-O 3.17Å; D1617-C1621 VanDerWaalsContact OD1-CB 3.32Å; D1617-C1621 WeakPolarHBondContact OD1-CB 3.42Å; D1617-C1621 PolarHBondContact OD1-N 2.99Å; D1617-C1621 VanDerWaalsContact OD2-CB 3.3Å; D1617-C1621 WeakPolarHBondContact OD2-CB 3.36Å; D1617-K1624 VanDerWaalsContact OD2-CE 3.31Å; D1617-K1624 WeakPolarHBondContact OD2-CE 3.33Å; D1617-K1624 IonicContact OD2-NZ 3.47Å; D1617-K1624 PolarHBondContact OD2-NZ 3.11Å; D1617-V1712 HydrophobicContact CB-CG1 4.28Å; D1617-V1712 HydrophobicContact CB-CG2 4.18Å
1618	E	76	Confident	81.4	Confident	79.6 Å²	79.6	51.6 Å²	51.6	37%	0.372	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-14.7	178.9	-56.4	82.5	-170.1	0	0	113.6	L1589 L1611 W1612 R1717	L1589-E1618 HydrophobicContact CD1-CG 4.15Å; L1611-E1618 HydrophobicContact CD2-CG 4.39Å; W1612-E1618 VanDerWaalsContact NE1-CD 3.32Å; W1612-E1618 PolarHBondContact NE1-OE1 3.08Å; W1612-E1618 PolarHBondContact NE1-OE2 3.25Å; W1612-E1618 VanDerWaalsContact NE1-OE2 3.12Å; E1618-R1717 IonicContact OE1-NE 3.48Å; E1618-R1717 PolarHBondContact OE1-NE 2.99Å; E1618-R1717 IonicContact OE1-NH2 3.22Å
1619	Y	78	Confident	82.5	Confident	129.2 Å²	129.2	51.7 Å²	51.7	51%	0.507	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	6.1	-178.8	-54.4	-74.5	0	0	0	113	N1587 D1617 C1621	N1587-Y1619 PolarHBondContact ND2-OH 3.36Å; N1587-Y1619 VanDerWaalsContact ND2-OH 3.14Å; D1617-Y1619 PolarHBondContact O-N 3.02Å; D1617-Y1619 VanDerWaalsContact OD1-C 3.28Å; D1617-Y1619 VanDerWaalsContact OD1-CA 3.29Å; D1617-Y1619 WeakPolarHBondContact OD1-CA 3.22Å; D1617-Y1619 WeakPolarHBondContact OD1-CB 3.3Å; D1617-Y1619 PolarHBondContact OD1-N 2.91Å; Y1619-C1621 VanDerWaalsContact C-N 3.35Å
1620	G	81.2	Confident	83.8	Confident	27.6 Å²	27.6	46.3 Å²	46.3	29%	0.285	23%	0.23	S	C	.	.	S	Bend	trans	71.3	27.9	-178.3	0	0	0	0	0	114.3	D1617 K1861	D1617-G1620 PolarHBondContact O-N 3.04Å; D1617-G1620 PolarHBondContact OD1-N 3.06Å; G1620-K1861 WeakPolarHBondContact O-CE 3.42Å
1621	C	85.5	Confident	84.6	Confident	13.4 Å²	13.4	41.7 Å²	41.7	9%	0.091	21%	0.208	C	C	.	.			trans	-87.6	143.1	169.7	-59.7	0	0	0	0	110.6	L1616 D1617 Y1619 G1859 S1860	L1616-C1621 WeakPolarHBondContact CA-O 3.29Å; D1617-C1621 VanDerWaalsContact CG-CB 3.49Å; D1617-C1621 PolarHBondContact N-O 3.17Å; D1617-C1621 VanDerWaalsContact OD1-CB 3.32Å; D1617-C1621 WeakPolarHBondContact OD1-CB 3.42Å; D1617-C1621 PolarHBondContact OD1-N 2.99Å; D1617-C1621 VanDerWaalsContact OD2-CB 3.3Å; D1617-C1621 WeakPolarHBondContact OD2-CB 3.36Å; Y1619-C1621 VanDerWaalsContact C-N 3.35Å; C1621-G1859 VanDerWaalsContact SG-C 3.56Å; C1621-S1860 CarbonylContact C-O 3.55Å; C1621-S1860 WeakPolarHBondContact CA-O 3.25Å; C1621-S1860 VanDerWaalsContact CB-O 3.27Å; C1621-S1860 WeakPolarHBondContact CB-O 3.34Å
1622	Q	88.1	Confident	85.1	Confident	97.4 Å²	97.4	39.9 Å²	39.9	46%	0.455	20%	0.199	S	C	.	.	S	Bend	trans	-95.3	-17.9	-179.7	-71.7	178.3	-14.1	0	0	113	L1616 P1711 V1712 S1860 K1861	L1616-Q1622 HydrophobicContact CD2-CB 4.46Å; L1616-Q1622 HydrophobicContact CD2-CG 3.45Å; L1616-Q1622 VanDerWaalsContact CD2-CG 3.43Å; Q1622-P1711 WeakPolarHBondContact O-CA 3.23Å; Q1622-V1712 PolarHBondContact O-N 3.07Å; Q1622-S1860 PolarHBondContact N-O 2.94Å; Q1622-K1861 PolarHBondContact OE1-O 3.23Å; Q1622-K1861 VanDerWaalsContact OE1-O 3.12Å
1623	Y	88.2	Confident	85.3	Confident	55 Å²	55	39.7 Å²	39.7	22%	0.216	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	146	-177.3	-59.1	-95.5	0	0	0	110.4	V1709 I1710 P1711 G1859 S1860 T1862 E1863	Y1623-V1709 HydrophobicContact CD1-CG1 4.17Å; Y1623-V1709 HydrophobicContact CG-CG1 4.48Å; Y1623-I1710 WeakPolarHBondContact CA-O 3.31Å; Y1623-P1711 HydrophobicContact CD1-CB 4.22Å; Y1623-P1711 HydrophobicContact CE1-CB 4.2Å; Y1623-G1859 WeakPolarHBondContact O-CA 3.49Å; Y1623-S1860 PolarHBondContact N-O 2.85Å; Y1623-S1860 PolarHBondContact O-N 3Å; Y1623-T1862 VanDerWaalsContact CD2-C 3.46Å; Y1623-E1863 HydrophobicContact CD1-CB 4.17Å; Y1623-E1863 HydrophobicContact CD1-CG 4.37Å; Y1623-E1863 HydrophobicContact CD2-CB 4.46Å; Y1623-E1863 VanDerWaalsContact CD2-N 3.3Å; Y1623-E1863 HydrophobicContact CE1-CB 3.8Å; Y1623-E1863 HydrophobicContact CE1-CG 4.07Å; Y1623-E1863 HydrophobicContact CE2-CB 4.19Å; Y1623-E1863 VanDerWaalsContact CE2-N 3.32Å; Y1623-E1863 HydrophobicContact CG-CB 4.46Å
1624	K	88.8	Confident	85.5	Confident	6.4 Å²	6.4	34 Å²	34	3%	0.028	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	127.9	166.6	-62.1	-62.2	-168.7	173	0	109	W1612 D1617 F1626 I1710 V1712 L1716 M1857 T1858	W1612-K1624 HydrophobicContact CH2-CD 4.42Å; W1612-K1624 VanDerWaalsContact CH2-CE 3.49Å; W1612-K1624 HydrophobicContact CH2-CG 4.38Å; W1612-K1624 VanDerWaalsContact CZ2-CE 3.48Å; W1612-K1624 HydrophobicContact CZ3-CG 4.4Å; D1617-K1624 VanDerWaalsContact OD2-CE 3.31Å; D1617-K1624 WeakPolarHBondContact OD2-CE 3.33Å; D1617-K1624 IonicContact OD2-NZ 3.47Å; D1617-K1624 PolarHBondContact OD2-NZ 3.11Å; K1624-F1626 HydrophobicContact CB-CD2 4.38Å; K1624-F1626 HydrophobicContact CB-CE2 3.6Å; K1624-F1626 HydrophobicContact CB-CZ 3.92Å; K1624-F1626 HydrophobicContact CG-CZ 4.46Å; K1624-I1710 PolarHBondContact N-O 3.2Å; K1624-I1710 PolarHBondContact O-N 2.86Å; K1624-V1712 HydrophobicContact CD-CG2 4.26Å; K1624-V1712 HydrophobicContact CG-CG2 3.89Å; K1624-L1716 HydrophobicContact CB-CD2 4.1Å; K1624-L1716 HydrophobicContact CG-CD2 3.94Å; K1624-M1857 HydrophobicContact CB-CG 4.34Å; K1624-M1857 HydrophobicContact CB-SD 4.48Å; K1624-M1857 HydrophobicContact CD-CG 4.29Å; K1624-M1857 HydrophobicContact CD-SD 4.1Å; K1624-M1857 HydrophobicContact CG-SD 4.32Å; K1624-T1858 CarbonylContact C-O 3.56Å; K1624-T1858 WeakPolarHBondContact CA-O 3.28Å
1625	H	87	Confident	85.7	Confident	14.2 Å²	14.2	28.6 Å²	28.6	7%	0.066	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	124.1	171.7	-63.5	-118.2	0	0	0	108.7	F1708 V1709 M1857 T1858 S1860 E1863 C1865 L1866	H1625-F1708 CarbonylContact C-O 3.56Å; H1625-F1708 WeakPolarHBondContact CA-O 3.38Å; H1625-V1709 VanDerWaalsContact CD2-CG1 3.47Å; H1625-V1709 WeakPolarHBondContact CD2-CG1 3.39Å; H1625-V1709 VanDerWaalsContact CD2-CG2 3.46Å; H1625-V1709 WeakPolarHBondContact CD2-CG2 3.17Å; H1625-V1709 WeakPolarHBondContact ND1-CG2 3.35Å; H1625-M1857 CarbonylContact O-C 3.54Å; H1625-M1857 WeakPolarHBondContact O-CA 3.25Å; H1625-T1858 WeakPolarHBondContact CB-OG1 3.21Å; H1625-T1858 PolarHBondContact N-O 3.21Å; H1625-T1858 PolarHBondContact O-N 3.04Å; H1625-S1860 WeakPolarHBondContact CD2-CB 3.44Å; H1625-S1860 PolarHBondContact CD2-OG 2.93Å; H1625-S1860 WeakPolarHBondContact CE1-CB 3.47Å; H1625-S1860 PolarHBondContact CE1-OG 3.07Å; H1625-S1860 WeakPolarHBondContact NE2-CB 3.19Å; H1625-S1860 PolarHBondContact NE2-OG 3.04Å; H1625-E1863 PolarHBondContact CE1-O 3.19Å; H1625-E1863 VanDerWaalsContact CE1-O 3.26Å; H1625-C1865 VanDerWaalsContact CE1-CB 3.43Å; H1625-C1865 WeakPolarHBondContact CE1-CB 3.25Å; H1625-C1865 WeakPolarHBondContact NE2-CB 3.26Å; H1625-L1866 VanDerWaalsContact ND1-CD1 3.28Å; H1625-L1866 WeakPolarHBondContact ND1-CD1 3.49Å; H1625-L1866 WeakPolarHBondContact ND1-CG 3.06Å
1626	F	89.6	Confident	85.5	Confident	1.6 Å²	1.6	27.6 Å²	27.6	1%	0.007	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	128.4	175.7	-61	-92.2	0	0	0	109.7	K1624 F1672 E1707 F1708 I1710 L1716 L1720 L1787 E1856 M1857	K1624-F1626 HydrophobicContact CB-CD2 4.38Å; K1624-F1626 HydrophobicContact CB-CE2 3.6Å; K1624-F1626 HydrophobicContact CB-CZ 3.92Å; K1624-F1626 HydrophobicContact CG-CZ 4.46Å; F1626-F1672 HydrophobicContact CB-CE1 4.36Å; F1626-F1672 HydrophobicContact CB-CZ 3.89Å; F1626-F1672 HydrophobicContact CD1-CZ 4.12Å; F1626-F1672 HydrophobicContact CD2-CE1 4.18Å; F1626-F1672 AromaticContact CD2-CZ 3.93Å; F1626-F1672 HydrophobicContact CD2-CZ 3.98Å; F1626-F1672 HydrophobicContact CE2-CZ 4.49Å; F1626-F1672 HydrophobicContact CG-CE1 4.3Å; F1626-F1672 AromaticContact CG-CZ 3.73Å; F1626-F1672 HydrophobicContact CG-CZ 3.73Å; F1626-E1707 CarbonylContact O-C 3.5Å; F1626-E1707 VanDerWaalsContact O-CA 3.3Å; F1626-E1707 WeakPolarHBondContact O-CA 3.42Å; F1626-F1708 HydrophobicContact CB-CB 4.35Å; F1626-F1708 HydrophobicContact CB-CD2 4.47Å; F1626-F1708 PolarHBondContact N-O 3.17Å; F1626-F1708 PolarHBondContact O-N 3.05Å; F1626-I1710 HydrophobicContact CD2-CD1 4.35Å; F1626-I1710 HydrophobicContact CD2-CG1 4.44Å; F1626-I1710 HydrophobicContact CE2-CB 4.39Å; F1626-I1710 HydrophobicContact CE2-CD1 4.18Å; F1626-I1710 HydrophobicContact CE2-CG1 4.38Å; F1626-L1716 HydrophobicContact CE2-CD1 4.23Å; F1626-L1716 HydrophobicContact CE2-CD2 4.27Å; F1626-L1716 HydrophobicContact CZ-CD1 4.15Å; F1626-L1716 HydrophobicContact CZ-CD2 4.36Å; F1626-L1716 HydrophobicContact CZ-CG 4.46Å; F1626-L1720 HydrophobicContact CE1-CD1 4.39Å; F1626-L1720 HydrophobicContact CE1-CD2 3.79Å; F1626-L1720 HydrophobicContact CZ-CD1 4.1Å; F1626-L1720 HydrophobicContact CZ-CD2 4.02Å; F1626-L1720 HydrophobicContact CZ-CG 4.5Å; F1626-L1787 HydrophobicContact CD1-CD1 4.25Å; F1626-L1787 HydrophobicContact CE1-CD1 4.06Å; F1626-E1856 CarbonylContact C-O 3.42Å; F1626-E1856 VanDerWaalsContact CA-O 3.28Å; F1626-E1856 WeakPolarHBondContact CA-O 3.42Å; F1626-M1857 HydrophobicContact CD1-CB 3.97Å; F1626-M1857 HydrophobicContact CD1-CG 3.97Å; F1626-M1857 HydrophobicContact CD1-SD 4.49Å; F1626-M1857 HydrophobicContact CE1-CB 3.91Å; F1626-M1857 HydrophobicContact CE1-CG 3.54Å; F1626-M1857 VanDerWaalsContact CE1-CG 3.45Å; F1626-M1857 HydrophobicContact CE1-SD 3.57Å; F1626-M1857 VanDerWaalsContact CE1-SD 3.53Å; F1626-M1857 HydrophobicContact CZ-CG 3.92Å; F1626-M1857 HydrophobicContact CZ-SD 3.74Å
1627	T	88	Confident	85.2	Confident	11.2 Å²	11.2	25.9 Å²	25.9	7%	0.069	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	116	174.2	-51.5	0	0	0	0	109.1	Y1629 Y1705 K1706 E1707 I1855 E1856	T1627-Y1629 HydrophobicContact CG2-CD1 4.48Å; T1627-Y1629 HydrophobicContact CG2-CD2 4.09Å; T1627-Y1629 HydrophobicContact CG2-CE1 3.96Å; T1627-Y1629 HydrophobicContact CG2-CE2 3.46Å; T1627-Y1629 VanDerWaalsContact CG2-CE2 3.44Å; T1627-Y1629 VanDerWaalsContact CG2-CZ 3.42Å; T1627-Y1629 WeakPolarHBondContact CG2-OH 3.49Å; T1627-Y1705 HydrophobicContact CG2-CD2 4.13Å; T1627-K1706 WeakPolarHBondContact CA-O 3.42Å; T1627-E1707 HydrophobicContact CG2-CG 4.02Å; T1627-I1855 WeakPolarHBondContact O-CA 3.2Å; T1627-E1856 PolarHBondContact N-O 3.05Å; T1627-E1856 PolarHBondContact O-N 3.05Å
1628	I	89.9	Confident	84.7	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	114.7	179.1	-56.4	-175.4	0	0	0	108.1	L1630 F1670 F1672 Y1705 K1706 F1708 L1725 F1727 V1853 H1854 I1855	I1628-L1630 HydrophobicContact CG2-CD2 4.46Å; I1628-F1670 HydrophobicContact CD1-CD2 4.41Å; I1628-F1670 HydrophobicContact CD1-CE2 3.74Å; I1628-F1670 HydrophobicContact CD1-CZ 4.12Å; I1628-F1672 HydrophobicContact CD1-CD2 4.04Å; I1628-F1672 HydrophobicContact CD1-CE2 4.07Å; I1628-Y1705 CarbonylContact O-C 3.52Å; I1628-Y1705 WeakPolarHBondContact O-CA 3.4Å; I1628-K1706 PolarHBondContact N-O 3.22Å; I1628-K1706 PolarHBondContact O-N 3Å; I1628-F1708 HydrophobicContact CD1-CD2 4.27Å; I1628-F1708 HydrophobicContact CD1-CE2 3.75Å; I1628-F1708 HydrophobicContact CG1-CD2 4.47Å; I1628-F1708 HydrophobicContact CG1-CE2 4.16Å; I1628-L1725 HydrophobicContact CD1-CD1 4.01Å; I1628-L1725 HydrophobicContact CD1-CD2 3.79Å; I1628-F1727 HydrophobicContact CD1-CZ 4.35Å; I1628-F1727 HydrophobicContact CG2-CE1 3.88Å; I1628-F1727 HydrophobicContact CG2-CZ 3.8Å; I1628-V1853 HydrophobicContact CG2-CG1 4Å; I1628-H1854 CarbonylContact C-O 3.54Å; I1628-H1854 WeakPolarHBondContact CA-O 3.11Å; I1628-I1855 HydrophobicContact CG1-CD1 4.46Å; I1628-I1855 HydrophobicContact CG1-CG1 4.37Å; I1628-I1855 HydrophobicContact CG1-CG2 4.36Å; I1628-I1855 HydrophobicContact CG2-CG1 4.39Å
1629	Y	87.3	Confident	84.4	Confident	32 Å²	32	25.4 Å²	25.4	13%	0.125	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	123.3	176.7	-54.8	-97.7	0	0	0	110	T1627 Y1705 V1853 H1854 E1856 M1876	T1627-Y1629 HydrophobicContact CG2-CD1 4.48Å; T1627-Y1629 HydrophobicContact CG2-CD2 4.09Å; T1627-Y1629 HydrophobicContact CG2-CE1 3.96Å; T1627-Y1629 HydrophobicContact CG2-CE2 3.46Å; T1627-Y1629 VanDerWaalsContact CG2-CE2 3.44Å; T1627-Y1629 VanDerWaalsContact CG2-CZ 3.42Å; T1627-Y1629 WeakPolarHBondContact CG2-OH 3.49Å; Y1629-Y1705 HydrophobicContact CE1-CG 4.47Å; Y1629-V1853 WeakPolarHBondContact O-CA 3.32Å; Y1629-H1854 HydrophobicContact CD2-CB 4.33Å; Y1629-H1854 AromaticContact CD2-ND1 3.24Å; Y1629-H1854 VanDerWaalsContact CD2-ND1 3.32Å; Y1629-H1854 WeakPolarHBondContact CD2-ND1 3.21Å; Y1629-H1854 AromaticContact CE2-ND1 3.62Å; Y1629-H1854 AromaticContact CG-ND1 3.89Å; Y1629-H1854 PolarHBondContact N-O 2.94Å; Y1629-H1854 PolarHBondContact O-N 3.18Å; Y1629-E1856 HydrophobicContact CE2-CB 4.43Å; Y1629-E1856 VanDerWaalsContact CE2-CD 3.5Å; Y1629-E1856 HydrophobicContact CE2-CG 3.95Å; Y1629-E1856 VanDerWaalsContact CE2-OE2 3.23Å; Y1629-E1856 WeakPolarHBondContact CE2-OE2 3.23Å; Y1629-E1856 PolarHBondContact OH-OE2 3.16Å; Y1629-M1876 HydrophobicContact CD1-CE 3.7Å; Y1629-M1876 HydrophobicContact CD1-SD 4.11Å; Y1629-M1876 HydrophobicContact CE1-CE 4.15Å; Y1629-M1876 HydrophobicContact CE1-SD 4.45Å
1630	L	88.6	Confident	84	Confident	0.6 Å²	0.6	21 Å²	21	0%	0.003	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	103.4	173	-61.7	177.7	0	0	0	108	I1628 V1668 F1670 F1702 K1703 E1704 F1727 I1851 V1853	I1628-L1630 HydrophobicContact CG2-CD2 4.46Å; L1630-V1668 HydrophobicContact CD1-CB 4.22Å; L1630-V1668 HydrophobicContact CD1-CG1 4.44Å; L1630-V1668 HydrophobicContact CD1-CG2 4.39Å; L1630-V1668 HydrophobicContact CD2-CG1 4.38Å; L1630-F1670 HydrophobicContact CD1-CE1 4.47Å; L1630-F1702 HydrophobicContact CB-CB 4.05Å; L1630-F1702 HydrophobicContact CB-CG 4.44Å; L1630-F1702 VanDerWaalsContact O-CB 3.27Å; L1630-F1702 WeakPolarHBondContact O-CB 3.29Å; L1630-K1703 PolarHBondContact O-N 2.86Å; L1630-K1703 VanDerWaalsContact O-N 3.14Å; L1630-E1704 PolarHBondContact N-O 3.03Å; L1630-E1704 PolarHBondContact O-N 2.79Å; L1630-E1704 VanDerWaalsContact O-N 3.15Å; L1630-F1727 HydrophobicContact CD2-CD1 4.06Å; L1630-F1727 HydrophobicContact CD2-CE1 3.94Å; L1630-I1851 HydrophobicContact CD2-CD1 4.46Å; L1630-V1853 HydrophobicContact CD2-CG1 4.32Å; L1630-V1853 HydrophobicContact CD2-CG2 3.99Å
1631	N	83.5	Confident	83.5	Confident	15.2 Å²	15.2	20 Å²	20	8%	0.081	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-65.1	-171.3	-64.4	-30.4	0	0	0	111.5	F1702 K1703 L1833 A1852 M1876 L1879	N1631-F1702 PolarHBondContact O-N 3.03Å; N1631-K1703 PolarHBondContact O-N 3.03Å; N1631-L1833 HydrophobicContact CB-CD1 4.18Å; N1631-L1833 HydrophobicContact CB-CD2 4.44Å; N1631-A1852 HydrophobicContact CB-CB 4.28Å; N1631-A1852 PolarHBondContact N-O 2.97Å; N1631-A1852 VanDerWaalsContact N-O 3.12Å; N1631-M1876 VanDerWaalsContact OD1-CE 3.26Å; N1631-M1876 WeakPolarHBondContact OD1-CE 3.4Å; N1631-L1879 HydrophobicContact CB-CD1 3.89Å; N1631-L1879 VanDerWaalsContact CG-CD1 3.43Å; N1631-L1879 WeakPolarHBondContact OD1-CD1 3.16Å
1632	F	86	Confident	82.5	Confident	3 Å²	3	20.3 Å²	20.3	1%	0.013	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	156.4	-172.9	-54.8	-81.5	0	0	0	111.3	I1699 V1700 E1701 L1833 W1850 A1852 L1879 L1881 P1882	F1632-I1699 HydrophobicContact CB-CG2 4.42Å; F1632-I1699 HydrophobicContact CD1-CG2 4.13Å; F1632-V1700 CarbonylContact C-O 3.5Å; F1632-V1700 VanDerWaalsContact CA-O 3.25Å; F1632-V1700 WeakPolarHBondContact CA-O 3.35Å; F1632-E1701 HydrophobicContact CD1-CB 3.91Å; F1632-E1701 HydrophobicContact CD1-CG 3.89Å; F1632-E1701 HydrophobicContact CE1-CB 4.02Å; F1632-E1701 HydrophobicContact CE1-CG 3.6Å; F1632-E1701 VanDerWaalsContact CE1-OE1 3.27Å; F1632-E1701 WeakPolarHBondContact CE1-OE1 3.39Å; F1632-E1701 HydrophobicContact CZ-CG 4.39Å; F1632-E1701 WeakPolarHBondContact CZ-OE1 3.26Å; F1632-L1833 HydrophobicContact CB-CD2 4.47Å; F1632-L1833 HydrophobicContact CD2-CD1 4.24Å; F1632-L1833 HydrophobicContact CD2-CD2 3.84Å; F1632-L1833 HydrophobicContact CE2-CD1 3.97Å; F1632-L1833 HydrophobicContact CE2-CD2 4.29Å; F1632-L1833 HydrophobicContact CG-CD2 4.39Å; F1632-W1850 HydrophobicContact CB-CH2 4.44Å; F1632-W1850 HydrophobicContact CB-CZ3 4.15Å; F1632-A1852 HydrophobicContact CB-CB 4.29Å; F1632-A1852 HydrophobicContact CD2-CB 4.42Å; F1632-A1852 PolarHBondContact O-N 3.15Å; F1632-L1879 HydrophobicContact CE2-CB 3.95Å; F1632-L1879 HydrophobicContact CE2-CD1 4.15Å; F1632-L1879 HydrophobicContact CE2-CG 4.45Å; F1632-L1879 HydrophobicContact CZ-CB 4.04Å; F1632-L1879 HydrophobicContact CZ-CD1 4.49Å; F1632-L1881 HydrophobicContact CD1-CD1 4.26Å; F1632-L1881 HydrophobicContact CE1-CD1 3.9Å; F1632-L1881 HydrophobicContact CZ-CD1 4.31Å; F1632-P1882 HydrophobicContact CB-CG 4.25Å; F1632-P1882 HydrophobicContact CD1-CG 3.87Å; F1632-P1882 HydrophobicContact CD2-CG 3.99Å; F1632-P1882 HydrophobicContact CE1-CG 4.11Å; F1632-P1882 HydrophobicContact CE2-CG 4.23Å; F1632-P1882 HydrophobicContact CG-CG 3.82Å; F1632-P1882 HydrophobicContact CZ-CG 4.04Å
1633	A	87.7	Confident	81.1	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	142.3	161.3	0	0	0	0	0	110.7	L1635 I1699 V1700 F1702 W1850 I1851	A1633-L1635 HydrophobicContact CB-CD1 4.17Å; A1633-L1635 HydrophobicContact CB-CD2 4.13Å; A1633-L1635 HydrophobicContact CB-CG 4.04Å; A1633-I1699 CarbonylContact O-C 3.49Å; A1633-I1699 WeakPolarHBondContact O-CA 3.35Å; A1633-V1700 PolarHBondContact N-O 3.18Å; A1633-V1700 PolarHBondContact O-N 2.91Å; A1633-F1702 HydrophobicContact CB-CE2 3.75Å; A1633-W1850 CarbonylContact C-O 3.55Å; A1633-W1850 VanDerWaalsContact CA-O 3.27Å; A1633-W1850 WeakPolarHBondContact CA-O 3.28Å; A1633-I1851 HydrophobicContact CB-CB 4.38Å; A1633-I1851 HydrophobicContact CB-CG1 4.25Å
1634	Y	86.3	Confident	79.3	Confident	18 Å²	18	20.6 Å²	20.6	7%	0.071	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	118.8	171.5	-168.7	-104	0	0	0	108.3	S1697 T1698 I1699 W1815 Y1847 D1848 S1849 W1850	Y1634-S1697 VanDerWaalsContact CE1-CB 3.47Å; Y1634-S1697 WeakPolarHBondContact CE1-OG 3.26Å; Y1634-S1697 WeakPolarHBondContact OH-CB 3.46Å; Y1634-S1697 PolarHBondContact OH-OG 2.98Å; Y1634-T1698 WeakPolarHBondContact CA-O 3.33Å; Y1634-T1698 WeakPolarHBondContact CD2-O 3.35Å; Y1634-I1699 HydrophobicContact CD2-CD1 4.33Å; Y1634-I1699 HydrophobicContact CD2-CG1 3.56Å; Y1634-I1699 VanDerWaalsContact CD2-CG1 3.45Å; Y1634-I1699 HydrophobicContact CE2-CD1 4.43Å; Y1634-I1699 HydrophobicContact CE2-CG1 4.08Å; Y1634-W1815 HydrophobicContact CD2-CH2 4.26Å; Y1634-W1815 HydrophobicContact CE1-CH2 4.42Å; Y1634-W1815 AromaticContact CE2-CH2 3.92Å; Y1634-W1815 HydrophobicContact CE2-CH2 4.11Å; Y1634-W1815 HydrophobicContact CE2-CZ2 4.5Å; Y1634-Y1847 WeakPolarHBondContact CE1-O 3.17Å; Y1634-D1848 VanDerWaalsContact CD1-O 3.27Å; Y1634-D1848 WeakPolarHBondContact CD1-O 3.37Å; Y1634-D1848 HydrophobicContact CE1-CB 4.25Å; Y1634-S1849 CarbonylContact O-C 3.6Å; Y1634-S1849 WeakPolarHBondContact O-CA 3.22Å; Y1634-S1849 WeakPolarHBondContact O-CB 3.19Å; Y1634-S1849 PolarHBondContact O-OG 3.48Å; Y1634-W1850 VanDerWaalsContact CB-NE1 3.29Å; Y1634-W1850 AromaticContact CD1-NE1 3.95Å; Y1634-W1850 HydrophobicContact CD2-CZ2 4.2Å; Y1634-W1850 AromaticContact CG-CE2 3.89Å; Y1634-W1850 HydrophobicContact CG-CZ2 4.22Å; Y1634-W1850 AromaticContact CG-NE1 3.62Å; Y1634-W1850 PolarHBondContact N-O 3.08Å; Y1634-W1850 PolarHBondContact O-N 3.18Å; Y1634-W1850 VanDerWaalsContact O-N 3.12Å
1635	L	86.8	Confident	77.2	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	155.2	-167.9	-57.7	175.9	0	0	0	111.1	A1633 T1666 S1697 T1698 V1700 V1729 I1777 L1838	A1633-L1635 HydrophobicContact CB-CD1 4.17Å; A1633-L1635 HydrophobicContact CB-CD2 4.13Å; A1633-L1635 HydrophobicContact CB-CG 4.04Å; L1635-T1666 HydrophobicContact CD1-CG2 3.61Å; L1635-T1666 VanDerWaalsContact CD1-CG2 3.43Å; L1635-S1697 CarbonylContact O-C 3.54Å; L1635-S1697 VanDerWaalsContact O-CA 3.28Å; L1635-S1697 WeakPolarHBondContact O-CA 3.39Å; L1635-S1697 WeakPolarHBondContact O-CB 3.44Å; L1635-T1698 PolarHBondContact N-O 2.97Å; L1635-T1698 PolarHBondContact O-N 3.06Å; L1635-V1700 HydrophobicContact CD1-CB 4.42Å; L1635-V1700 HydrophobicContact CD1-CG2 3.9Å; L1635-V1700 HydrophobicContact CG-CG2 4.37Å; L1635-V1729 HydrophobicContact CD1-CG1 4.1Å; L1635-V1729 HydrophobicContact CD2-CB 4.5Å; L1635-V1729 HydrophobicContact CD2-CG1 4.02Å; L1635-I1777 HydrophobicContact CB-CD1 4.48Å; L1635-I1777 HydrophobicContact CD1-CD1 4.05Å; L1635-I1777 HydrophobicContact CD2-CD1 4.01Å; L1635-I1777 HydrophobicContact CD2-CG2 4.31Å; L1635-I1777 HydrophobicContact CG-CD1 4.3Å; L1635-L1838 HydrophobicContact CD2-CD1 3.65Å
1636	P	81.9	Confident	75	Confident	5.2 Å²	5.2	27.9 Å²	27.9	3%	0.034	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	148.9	177.9	-11.9	27.2	0	0	0	111.3	Q1640 L1641 Y1847 S1849	P1636-Q1640 HydrophobicContact CB-CB 4.34Å; P1636-L1641 HydrophobicContact CB-CD2 4.13Å; P1636-L1641 HydrophobicContact CB-CG 4.17Å; P1636-L1641 HydrophobicContact CG-CD2 4.05Å; P1636-L1641 HydrophobicContact CG-CG 4.46Å; P1636-L1641 VanDerWaalsContact O-CD1 3.23Å; P1636-L1641 WeakPolarHBondContact O-CD1 3.2Å; P1636-Y1847 HydrophobicContact CB-CD2 3.95Å; P1636-Y1847 HydrophobicContact CB-CE2 4.3Å; P1636-Y1847 HydrophobicContact CB-CG 4.09Å; P1636-Y1847 HydrophobicContact CG-CD2 3.78Å; P1636-Y1847 HydrophobicContact CG-CE2 4.48Å; P1636-Y1847 HydrophobicContact CG-CG 4.16Å; P1636-S1849 WeakPolarHBondContact CD-OG 3.24Å
1637	K	77.2	Confident	72.6	Confident	23.6 Å²	23.6	33.8 Å²	33.8	10%	0.103	18%	0.175	C	C	.	.			trans	-62.2	152.8	174.6	-76.3	-177.9	176.8	-169.9	0	111.7	K1639 Q1640 L1641 D1688 S1693 R1695 Q1696 T1698	K1637-K1639 VanDerWaalsContact C-N 3.28Å; K1637-K1639 PolarHBondContact O-N 2.94Å; K1637-K1639 VanDerWaalsContact O-N 3.08Å; K1637-Q1640 HydrophobicContact CB-CG 4.43Å; K1637-Q1640 WeakPolarHBondContact O-CA 3.27Å; K1637-Q1640 WeakPolarHBondContact O-CB 3.4Å; K1637-Q1640 PolarHBondContact O-N 2.9Å; K1637-Q1640 VanDerWaalsContact O-N 3.07Å; K1637-L1641 PolarHBondContact O-N 2.99Å; K1637-L1641 VanDerWaalsContact O-N 3.12Å; K1637-D1688 WeakPolarHBondContact CB-OD2 3.46Å; K1637-D1688 HydrophobicContact CD-CB 4.17Å; K1637-D1688 WeakPolarHBondContact CD-OD1 3.35Å; K1637-D1688 WeakPolarHBondContact CD-OD2 3.49Å; K1637-D1688 WeakPolarHBondContact CE-OD1 3.38Å; K1637-D1688 WeakPolarHBondContact CE-OD2 3.32Å; K1637-D1688 WeakPolarHBondContact CG-OD2 3.4Å; K1637-D1688 IonicContact NZ-OD1 3.17Å; K1637-D1688 PolarHBondContact NZ-OD1 3.11Å; K1637-D1688 IonicContact NZ-OD2 3Å; K1637-D1688 PolarHBondContact NZ-OD2 3.14Å; K1637-S1693 PolarHBondContact NZ-O 3Å; K1637-S1693 PolarHBondContact NZ-OG 3.21Å; K1637-S1693 VanDerWaalsContact NZ-OG 3.12Å; K1637-R1695 VanDerWaalsContact CD-O 3.26Å; K1637-R1695 WeakPolarHBondContact CD-O 3.22Å; K1637-R1695 WeakPolarHBondContact CE-O 3.18Å; K1637-R1695 PolarHBondContact NZ-O 2.9Å; K1637-Q1696 WeakPolarHBondContact CB-O 3.26Å; K1637-Q1696 VanDerWaalsContact CG-O 3.3Å; K1637-Q1696 WeakPolarHBondContact CG-O 3.26Å; K1637-Q1696 PolarHBondContact N-O 3.12Å; K1637-T1698 HydrophobicContact CD-CG2 4.43Å; K1637-T1698 HydrophobicContact CG-CG2 3.82Å; K1637-T1698 WeakPolarHBondContact CG-OG1 3.34Å
1638	I	73.9	Confident	70.2	Confident	9.4 Å²	9.4	40.9 Å²	40.9	5%	0.048	21%	0.205	C	C	.	.	H	α-helix	trans	-53.9	-41.7	-178.3	-69.5	167.8	0	0	0	112.1	Q1640 L1641 L1642 A1664 L1685 N1687 W1733	I1638-Q1640 VanDerWaalsContact C-N 3.28Å; I1638-Q1640 PolarHBondContact O-N 2.9Å; I1638-L1641 WeakPolarHBondContact O-CB 3.45Å; I1638-L1641 PolarHBondContact O-N 3.1Å; I1638-L1641 VanDerWaalsContact O-N 3.12Å; I1638-L1642 HydrophobicContact CG2-CD1 3.88Å; I1638-L1642 HydrophobicContact CG2-CG 4.33Å; I1638-L1642 WeakPolarHBondContact O-CG 3.3Å; I1638-L1642 PolarHBondContact O-N 3.07Å; I1638-A1664 HydrophobicContact CD1-CB 3.76Å; I1638-A1664 HydrophobicContact CG1-CB 4.1Å; I1638-L1685 HydrophobicContact CD1-CB 4.07Å; I1638-L1685 HydrophobicContact CD1-CD2 4.13Å; I1638-L1685 HydrophobicContact CD1-CG 4.07Å; I1638-L1685 VanDerWaalsContact CD1-O 3.27Å; I1638-L1685 WeakPolarHBondContact CD1-O 3.42Å; I1638-L1685 HydrophobicContact CG1-CB 4.31Å; I1638-L1685 HydrophobicContact CG1-CD2 3.56Å; I1638-L1685 HydrophobicContact CG1-CG 4Å; I1638-N1687 VanDerWaalsContact CD1-OD1 3.23Å; I1638-N1687 WeakPolarHBondContact CD1-OD1 3.36Å; I1638-W1733 HydrophobicContact CG2-CH2 4.23Å; I1638-W1733 HydrophobicContact CG2-CZ3 3.9Å
1639	K	69.5	Low	67.8	Low	69.6 Å²	69.6	47.3 Å²	47.3	30%	0.303	24%	0.24	S	C	.	.	H	α-helix	trans	-56.8	-39.9	176.8	-63.2	-176.1	175.2	171.2	0	112.4	K1637 L1641 L1642 N1643 E1659 D1688 D1689	K1637-K1639 VanDerWaalsContact C-N 3.28Å; K1637-K1639 PolarHBondContact O-N 2.94Å; K1637-K1639 VanDerWaalsContact O-N 3.08Å; K1639-L1641 VanDerWaalsContact C-N 3.33Å; K1639-L1641 PolarHBondContact O-N 3.17Å; K1639-L1642 PolarHBondContact O-N 3.14Å; K1639-N1643 PolarHBondContact O-N 2.99Å; K1639-N1643 VanDerWaalsContact O-N 3.16Å; K1639-N1643 PolarHBondContact O-ND2 3.04Å; K1639-N1643 VanDerWaalsContact O-ND2 3.11Å; K1639-N1643 PolarHBondContact O-OD1 3.01Å; K1639-E1659 WeakPolarHBondContact CD-OE2 3.22Å; K1639-E1659 VanDerWaalsContact CE-CD 3.5Å; K1639-E1659 WeakPolarHBondContact CE-OE1 3.24Å; K1639-E1659 WeakPolarHBondContact CE-OE2 3.41Å; K1639-E1659 WeakPolarHBondContact CG-OE1 3.41Å; K1639-E1659 IonicContact NZ-OE2 2.9Å; K1639-E1659 PolarHBondContact NZ-OE2 2.83Å; K1639-D1688 HydrophobicContact CD-CB 3.75Å; K1639-D1688 WeakPolarHBondContact CD-OD2 3.48Å; K1639-D1688 VanDerWaalsContact CE-CB 3.43Å; K1639-D1688 HydrophobicContact CG-CB 4.26Å; K1639-D1688 WeakPolarHBondContact CG-OD2 3.45Å; K1639-D1688 PolarHBondContact NZ-O 3.11Å; K1639-D1689 WeakPolarHBondContact CE-OD1 3.31Å; K1639-D1689 IonicContact NZ-OD1 2.77Å; K1639-D1689 PolarHBondContact NZ-OD1 2.66Å
1640	Q	69.5	Low	65.3	Low	36.8 Å²	36.8	51.2 Å²	51.2	17%	0.172	26%	0.262	C	S	.	.	H	α-helix	trans	-72.3	-38.1	176.9	-58.1	-127.8	-23	0	0	112.1	P1636 K1637 I1638 L1642 N1643 D1644 Q1696 Y1847	P1636-Q1640 HydrophobicContact CB-CB 4.34Å; K1637-Q1640 HydrophobicContact CB-CG 4.43Å; K1637-Q1640 WeakPolarHBondContact O-CA 3.27Å; K1637-Q1640 WeakPolarHBondContact O-CB 3.4Å; K1637-Q1640 PolarHBondContact O-N 2.9Å; K1637-Q1640 VanDerWaalsContact O-N 3.07Å; I1638-Q1640 VanDerWaalsContact C-N 3.28Å; I1638-Q1640 PolarHBondContact O-N 2.9Å; Q1640-L1642 VanDerWaalsContact C-N 3.28Å; Q1640-L1642 PolarHBondContact O-N 2.86Å; Q1640-N1643 PolarHBondContact O-N 2.87Å; Q1640-N1643 PolarHBondContact OE1-ND2 3.38Å; Q1640-D1644 PolarHBondContact O-N 3.2Å; Q1640-Q1696 HydrophobicContact CG-CB 4.08Å; Q1640-Q1696 HydrophobicContact CG-CG 4.45Å; Q1640-Q1696 PolarHBondContact OE1-O 3.14Å; Q1640-Y1847 HydrophobicContact CB-CE1 4.4Å; Q1640-Y1847 HydrophobicContact CB-CE2 4.24Å; Q1640-Y1847 VanDerWaalsContact OE1-CE1 3.3Å; Q1640-Y1847 PolarHBondContact OE1-OH 2.84Å
1641	L	70.2	Confident	62.9	Low	8 Å²	8	56.3 Å²	56.3	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-66.7	-28.8	177.7	-66.6	168.1	0	0	0	112.9	P1636 K1637 I1638 K1639 L1685 I1731 W1733 R1775 I1777	P1636-L1641 HydrophobicContact CB-CD2 4.13Å; P1636-L1641 HydrophobicContact CB-CG 4.17Å; P1636-L1641 HydrophobicContact CG-CD2 4.05Å; P1636-L1641 HydrophobicContact CG-CG 4.46Å; P1636-L1641 VanDerWaalsContact O-CD1 3.23Å; P1636-L1641 WeakPolarHBondContact O-CD1 3.2Å; K1637-L1641 PolarHBondContact O-N 2.99Å; K1637-L1641 VanDerWaalsContact O-N 3.12Å; I1638-L1641 WeakPolarHBondContact O-CB 3.45Å; I1638-L1641 PolarHBondContact O-N 3.1Å; I1638-L1641 VanDerWaalsContact O-N 3.12Å; K1639-L1641 VanDerWaalsContact C-N 3.33Å; K1639-L1641 PolarHBondContact O-N 3.17Å; L1641-L1685 HydrophobicContact CD1-CD2 4.22Å; L1641-I1731 HydrophobicContact CD1-CD1 3.39Å; L1641-I1731 VanDerWaalsContact CD1-CD1 3.44Å; L1641-I1731 HydrophobicContact CD1-CG2 4.49Å; L1641-I1731 HydrophobicContact CD2-CD1 4.17Å; L1641-I1731 HydrophobicContact CG-CD1 4.32Å; L1641-W1733 HydrophobicContact CB-CH2 4.11Å; L1641-W1733 HydrophobicContact CB-CZ2 4.35Å; L1641-R1775 VanDerWaalsContact O-CZ 3.24Å; L1641-R1775 PolarHBondContact O-NH1 3.08Å; L1641-R1775 PolarHBondContact O-NH2 3.18Å; L1641-I1777 HydrophobicContact CD1-CD1 4.34Å; L1641-I1777 HydrophobicContact CD2-CG1 4.44Å
1642	L	65.2	Low	60.6	Low	19.2 Å²	19.2	62.1 Å²	62.1	10%	0.101	33%	0.326	C	S	.	.	H	α-helix	trans	-80.6	-34.1	175.9	-68.8	171.5	0	0	0	112.7	I1638 K1639 Q1640 D1644 T1645 I1646 I1658 E1659 W1733 P1772	I1638-L1642 HydrophobicContact CG2-CD1 3.88Å; I1638-L1642 HydrophobicContact CG2-CG 4.33Å; I1638-L1642 WeakPolarHBondContact O-CG 3.3Å; I1638-L1642 PolarHBondContact O-N 3.07Å; K1639-L1642 PolarHBondContact O-N 3.14Å; Q1640-L1642 VanDerWaalsContact C-N 3.28Å; Q1640-L1642 PolarHBondContact O-N 2.86Å; L1642-D1644 VanDerWaalsContact C-N 3.31Å; L1642-D1644 PolarHBondContact O-N 3.08Å; L1642-D1644 VanDerWaalsContact O-N 3.16Å; L1642-T1645 PolarHBondContact O-N 3.19Å; L1642-T1645 VanDerWaalsContact O-N 3.16Å; L1642-T1645 PolarHBondContact O-OG1 3.1Å; L1642-I1646 HydrophobicContact CB-CD1 4.19Å; L1642-I1658 HydrophobicContact CD1-CG2 4.22Å; L1642-I1658 HydrophobicContact CD2-CG2 4.34Å; L1642-E1659 HydrophobicContact CD1-CG 4.41Å; L1642-W1733 HydrophobicContact CD1-CZ3 4.28Å; L1642-W1733 HydrophobicContact CD2-CE3 4.3Å; L1642-W1733 HydrophobicContact CD2-CH2 3.68Å; L1642-W1733 HydrophobicContact CD2-CZ2 4.24Å; L1642-W1733 HydrophobicContact CD2-CZ3 3.88Å; L1642-W1733 HydrophobicContact CG-CH2 3.89Å; L1642-W1733 HydrophobicContact CG-CZ3 4.17Å; L1642-P1772 HydrophobicContact CD2-CG 4.26Å
1643	N	58.3	Low	58.5	Low	67.4 Å²	67.4	66 Å²	66	36%	0.36	35%	0.352	S	S	.	.	H	α-helix	trans	-61.4	-31.7	-176.4	-76.3	-18.9	0	0	0	114.3	K1639 Q1640 T1645 I1646 F1648 R1654	K1639-N1643 PolarHBondContact O-N 2.99Å; K1639-N1643 VanDerWaalsContact O-N 3.16Å; K1639-N1643 PolarHBondContact O-ND2 3.04Å; K1639-N1643 VanDerWaalsContact O-ND2 3.11Å; K1639-N1643 PolarHBondContact O-OD1 3.01Å; Q1640-N1643 PolarHBondContact O-N 2.87Å; Q1640-N1643 PolarHBondContact OE1-ND2 3.38Å; N1643-T1645 PolarHBondContact O-N 3.03Å; N1643-T1645 VanDerWaalsContact O-N 3.13Å; N1643-I1646 PolarHBondContact O-N 2.95Å; N1643-F1648 HydrophobicContact CB-CE2 4.23Å; N1643-F1648 HydrophobicContact CB-CZ 4.32Å; N1643-F1648 WeakPolarHBondContact OD1-CZ 3.49Å; N1643-R1654 PolarHBondContact OD1-NH2 2.79Å
1644	D	50.6	Low	55.9	Low	92.2 Å²	92.2	74.7 Å²	74.7	49%	0.493	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-16.5	177.8	-71.6	-23.9	0	0	0	114	Q1640 L1642 R1775 Y1847	Q1640-D1644 PolarHBondContact O-N 3.2Å; L1642-D1644 VanDerWaalsContact C-N 3.31Å; L1642-D1644 PolarHBondContact O-N 3.08Å; L1642-D1644 VanDerWaalsContact O-N 3.16Å; D1644-R1775 IonicContact OD2-CZ 3.01Å; D1644-R1775 VanDerWaalsContact OD2-CZ 3.29Å; D1644-R1775 IonicContact OD2-NH1 3.51Å; D1644-R1775 PolarHBondContact OD2-NH1 2.98Å; D1644-R1775 IonicContact OD2-NH2 3.05Å; D1644-R1775 PolarHBondContact OD2-NH2 3.2Å; D1644-Y1847 PolarHBondContact OD1-OH 3.49Å
1645	T	44.7	Very low	53.4	Low	101 Å²	101	78.7 Å²	78.7	62%	0.62	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-8.1	-174.4	11	0	0	0	0	114	L1642 N1643 D1647 R1775	L1642-T1645 PolarHBondContact O-N 3.19Å; L1642-T1645 VanDerWaalsContact O-N 3.16Å; L1642-T1645 PolarHBondContact O-OG1 3.1Å; N1643-T1645 PolarHBondContact O-N 3.03Å; N1643-T1645 VanDerWaalsContact O-N 3.13Å; T1645-D1647 PolarHBondContact O-N 3.31Å; T1645-R1775 PolarHBondContact OG1-NH2 2.66Å
1646	I	40.1	Very low	51.2	Low	71 Å²	71	87.6 Å²	87.6	36%	0.364	44%	0.442	S	S	.	.	S	Bend	trans	-103.8	102.5	-173.5	-56.3	173.6	0	0	0	108.5	L1642 N1643 F1648 P1653 R1654 I1658	L1642-I1646 HydrophobicContact CB-CD1 4.19Å; N1643-I1646 PolarHBondContact O-N 2.95Å; I1646-F1648 VanDerWaalsContact O-CD2 3.26Å; I1646-F1648 WeakPolarHBondContact O-CD2 3.42Å; I1646-F1648 WeakPolarHBondContact O-CE2 3.45Å; I1646-F1648 PolarHBondContact O-N 3.03Å; I1646-F1648 VanDerWaalsContact O-N 3.13Å; I1646-P1653 HydrophobicContact CG1-CB 4.42Å; I1646-R1654 HydrophobicContact CD1-CB 4.18Å; I1646-I1658 HydrophobicContact CD1-CD1 4.13Å
1647	D	38.5	Very low	49.4	Very low	126 Å²	126	90.8 Å²	90.8	67%	0.674	46%	0.462	S	S	*	.			trans	-55.9	110.2	169.8	-117	-19.7	0	0	0	109.6	K1113 T1645 N1649 N1650	K1113-D1647 IonicContact NZ-OD2 3.4Å; K1113-D1647 PolarHBondContact NZ-OD2 3.25Å; T1645-D1647 PolarHBondContact O-N 3.31Å; D1647-N1649 PolarHBondContact O-N 3.12Å; D1647-N1649 PolarHBondContact OD1-ND2 3.35Å; D1647-N1650 PolarHBondContact O-N 3.4Å
1648	F	37.5	Very low	48	Very low	160.2 Å²	160.2	92.9 Å²	92.9	70%	0.703	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	0.4	-172.2	-79.9	-86.3	0	0	0	114.9	N1643 I1646 N1650	N1643-F1648 HydrophobicContact CB-CE2 4.23Å; N1643-F1648 HydrophobicContact CB-CZ 4.32Å; N1643-F1648 WeakPolarHBondContact OD1-CZ 3.49Å; I1646-F1648 VanDerWaalsContact O-CD2 3.26Å; I1646-F1648 WeakPolarHBondContact O-CD2 3.42Å; I1646-F1648 WeakPolarHBondContact O-CE2 3.45Å; I1646-F1648 PolarHBondContact O-N 3.03Å; I1646-F1648 VanDerWaalsContact O-N 3.13Å; F1648-N1650 VanDerWaalsContact C-N 3.32Å; F1648-N1650 PolarHBondContact O-N 3.28Å
1649	N	39.5	Very low	46.9	Very low	135.4 Å²	135.4	96 Å²	96	72%	0.724	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-1.1	-177.8	-70.5	-19.1	0	0	0	114.3	D1647 P1651	D1647-N1649 PolarHBondContact O-N 3.12Å; D1647-N1649 PolarHBondContact OD1-ND2 3.35Å; N1649-P1651 WeakPolarHBondContact O-CD 3.4Å
1650	N	36.5	Very low	46	Very low	113 Å²	113	97.5 Å²	97.5	60%	0.604	50%	0.499	S	S	*	.			trans	-118.6	105.5	174.3	-118.4	-19.5	0	0	0	111	D1647 F1648 L1652 P1653	D1647-N1650 PolarHBondContact O-N 3.4Å; F1648-N1650 VanDerWaalsContact C-N 3.32Å; F1648-N1650 PolarHBondContact O-N 3.28Å; N1650-L1652 VanDerWaalsContact C-N 3.3Å; N1650-L1652 PolarHBondContact O-N 3.05Å; N1650-L1652 VanDerWaalsContact O-N 3.08Å; N1650-P1653 WeakPolarHBondContact O-CD 3.35Å
1651	P	36.8	Very low	45.4	Very low	107.8 Å²	107.8	98.6 Å²	98.6	70%	0.7	51%	0.506	S	S	*	.			trans	-79.1	21	-178	32.3	-34.5	0	0	0	113	N1649 R1654 N1655	N1649-P1651 WeakPolarHBondContact O-CD 3.4Å; P1651-R1654 PolarHBondContact O-N 2.63Å; P1651-R1654 VanDerWaalsContact O-N 3.1Å; P1651-N1655 PolarHBondContact O-N 3.4Å
1652	L	36.6	Very low	45.2	Very low	136.8 Å²	136.8	98.9 Å²	98.9	72%	0.716	51%	0.507	S	S	*	.	S	Bend	trans	-92.1	103.4	178.3	-71.6	167.1	0	0	0	111.4	N1650 R1654 N1655 Y1656	N1650-L1652 VanDerWaalsContact C-N 3.3Å; N1650-L1652 PolarHBondContact O-N 3.05Å; N1650-L1652 VanDerWaalsContact O-N 3.08Å; L1652-R1654 VanDerWaalsContact C-N 3.32Å; L1652-R1654 PolarHBondContact O-N 3.01Å; L1652-N1655 PolarHBondContact O-N 2.81Å; L1652-Y1656 HydrophobicContact CB-CD2 4.28Å; L1652-Y1656 HydrophobicContact CB-CE2 4.44Å; L1652-Y1656 VanDerWaalsContact O-CD2 3.28Å; L1652-Y1656 WeakPolarHBondContact O-CD2 3.24Å; L1652-Y1656 PolarHBondContact O-N 2.79Å
1653	P	40.6	Very low	45.6	Very low	86 Å²	86	101.1 Å²	101.1	56%	0.558	52%	0.516	S	S	*	.			trans	-86.9	82.5	-174.7	19.8	-14.8	0	0	0	112.8	I1646 N1650 N1655 T1657	I1646-P1653 HydrophobicContact CG1-CB 4.42Å; N1650-P1653 WeakPolarHBondContact O-CD 3.35Å; P1653-N1655 PolarHBondContact O-N 2.83Å; P1653-N1655 VanDerWaalsContact O-N 3.14Å; P1653-T1657 VanDerWaalsContact C-CG2 3.45Å; P1653-T1657 HydrophobicContact CB-CG2 3.33Å; P1653-T1657 WeakPolarHBondContact O-CB 3.29Å; P1653-T1657 WeakPolarHBondContact O-CG2 3.44Å; P1653-T1657 PolarHBondContact O-N 2.95Å; P1653-T1657 PolarHBondContact O-OG1 3.38Å
1654	R	33.5	Very low	46.7	Very low	182.6 Å²	182.6	97.9 Å²	97.9	69%	0.689	50%	0.499	S	S	*	.			trans	-67.2	2.9	176.7	-150.6	175.4	-139.3	168.6	1.1	113.1	N1643 I1646 P1651 L1652 I1658	N1643-R1654 PolarHBondContact OD1-NH2 2.79Å; I1646-R1654 HydrophobicContact CD1-CB 4.18Å; P1651-R1654 PolarHBondContact O-N 2.63Å; P1651-R1654 VanDerWaalsContact O-N 3.1Å; L1652-R1654 VanDerWaalsContact C-N 3.32Å; L1652-R1654 PolarHBondContact O-N 3.01Å; R1654-I1658 HydrophobicContact CG-CD1 3.95Å; R1654-I1658 WeakPolarHBondContact O-CD1 3.26Å; R1654-I1658 VanDerWaalsContact O-CG1 3.3Å; R1654-I1658 WeakPolarHBondContact O-CG1 3.24Å; R1654-I1658 PolarHBondContact O-N 2.77Å
1655	N	34.8	Very low	48.4	Very low	101.2 Å²	101.2	96.5 Å²	96.5	54%	0.541	49%	0.487	S	S	.	.	S	Bend	trans	-126.2	31.1	-177.4	-73.6	13	0	0	0	115.2	P1651 L1652 P1653 T1657 I1658 E1659	P1651-N1655 PolarHBondContact O-N 3.4Å; L1652-N1655 PolarHBondContact O-N 2.81Å; P1653-N1655 PolarHBondContact O-N 2.83Å; P1653-N1655 VanDerWaalsContact O-N 3.14Å; N1655-T1657 PolarHBondContact O-N 3.24Å; N1655-T1657 PolarHBondContact O-OG1 3.21Å; N1655-I1658 PolarHBondContact O-N 2.99Å; N1655-E1659 WeakPolarHBondContact CB-OE1 3.18Å; N1655-E1659 PolarHBondContact ND2-OE1 2.73Å; N1655-E1659 VanDerWaalsContact O-CB 3.31Å; N1655-E1659 WeakPolarHBondContact O-CB 3.27Å; N1655-E1659 WeakPolarHBondContact O-CG 3.1Å; N1655-E1659 PolarHBondContact O-N 3.14Å
1656	Y	38.9	Very low	50.5	Low	186.2 Å²	186.2	91.7 Å²	91.7	73%	0.73	46%	0.458	S	S	*	.	S	Bend	trans	-176.4	0.7	167.4	-74.8	-74.4	0	0	0	119	L1652 N1660	L1652-Y1656 HydrophobicContact CB-CD2 4.28Å; L1652-Y1656 HydrophobicContact CB-CE2 4.44Å; L1652-Y1656 VanDerWaalsContact O-CD2 3.28Å; L1652-Y1656 WeakPolarHBondContact O-CD2 3.24Å; L1652-Y1656 PolarHBondContact O-N 2.79Å; Y1656-N1660 WeakPolarHBondContact O-CB 3.41Å; Y1656-N1660 PolarHBondContact O-N 2.64Å; Y1656-N1660 PolarHBondContact O-ND2 3.41Å; Y1656-N1660 VanDerWaalsContact O-ND2 3.13Å
1657	T	44.7	Very low	53	Low	73.8 Å²	73.8	89.1 Å²	89.1	45%	0.453	44%	0.444	S	S	.	.	H	α-helix	trans	-116.2	3.5	-166.6	46.9	0	0	0	0	116.6	P1653 N1655 E1659 N1661	P1653-T1657 VanDerWaalsContact C-CG2 3.45Å; P1653-T1657 HydrophobicContact CB-CG2 3.33Å; P1653-T1657 WeakPolarHBondContact O-CB 3.29Å; P1653-T1657 WeakPolarHBondContact O-CG2 3.44Å; P1653-T1657 PolarHBondContact O-N 2.95Å; P1653-T1657 PolarHBondContact O-OG1 3.38Å; N1655-T1657 PolarHBondContact O-N 3.24Å; N1655-T1657 PolarHBondContact O-OG1 3.21Å; T1657-E1659 VanDerWaalsContact C-N 3.26Å; T1657-E1659 PolarHBondContact O-N 3.37Å; T1657-N1661 WeakPolarHBondContact O-CB 3.36Å; T1657-N1661 PolarHBondContact O-ND2 3.07Å; T1657-N1661 VanDerWaalsContact O-ND2 3.09Å
1658	I	48.3	Very low	55.5	Low	67.2 Å²	67.2	83.1 Å²	83.1	35%	0.345	41%	0.412	S	S	.	.	S	Bend	trans	-93.9	-38.4	174.1	-59.7	175	0	0	0	112.3	L1642 I1646 R1654 N1655 N1660 N1661 F1662	L1642-I1658 HydrophobicContact CD1-CG2 4.22Å; L1642-I1658 HydrophobicContact CD2-CG2 4.34Å; I1646-I1658 HydrophobicContact CD1-CD1 4.13Å; R1654-I1658 HydrophobicContact CG-CD1 3.95Å; R1654-I1658 WeakPolarHBondContact O-CD1 3.26Å; R1654-I1658 VanDerWaalsContact O-CG1 3.3Å; R1654-I1658 WeakPolarHBondContact O-CG1 3.24Å; R1654-I1658 PolarHBondContact O-N 2.77Å; N1655-I1658 PolarHBondContact O-N 2.99Å; I1658-N1660 VanDerWaalsContact C-N 3.29Å; I1658-N1660 PolarHBondContact O-N 2.96Å; I1658-N1661 PolarHBondContact O-N 2.9Å; I1658-F1662 HydrophobicContact CG2-CD2 3.92Å; I1658-F1662 HydrophobicContact CG2-CE2 4.19Å; I1658-F1662 WeakPolarHBondContact O-CD2 3.31Å; I1658-F1662 PolarHBondContact O-N 3.38Å
1659	E	49.6	Very low	58.1	Low	74.6 Å²	74.6	79.2 Å²	79.2	35%	0.349	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-29.6	-175.3	-64.1	-179.8	169.6	0	0	113.2	K1639 L1642 N1655 T1657 N1661 N1687	K1639-E1659 WeakPolarHBondContact CD-OE2 3.22Å; K1639-E1659 VanDerWaalsContact CE-CD 3.5Å; K1639-E1659 WeakPolarHBondContact CE-OE1 3.24Å; K1639-E1659 WeakPolarHBondContact CE-OE2 3.41Å; K1639-E1659 WeakPolarHBondContact CG-OE1 3.41Å; K1639-E1659 IonicContact NZ-OE2 2.9Å; K1639-E1659 PolarHBondContact NZ-OE2 2.83Å; L1642-E1659 HydrophobicContact CD1-CG 4.41Å; N1655-E1659 WeakPolarHBondContact CB-OE1 3.18Å; N1655-E1659 PolarHBondContact ND2-OE1 2.73Å; N1655-E1659 VanDerWaalsContact O-CB 3.31Å; N1655-E1659 WeakPolarHBondContact O-CB 3.27Å; N1655-E1659 WeakPolarHBondContact O-CG 3.1Å; N1655-E1659 PolarHBondContact O-N 3.14Å; T1657-E1659 VanDerWaalsContact C-N 3.26Å; T1657-E1659 PolarHBondContact O-N 3.37Å; E1659-N1661 PolarHBondContact O-N 2.89Å; E1659-N1687 PolarHBondContact O-ND2 3.06Å; E1659-N1687 VanDerWaalsContact O-ND2 3.11Å
1660	N	50.6	Low	60.6	Low	101.2 Å²	101.2	73 Å²	73	54%	0.541	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	3.5	-179.2	-70	6.2	0	0	0	113.3	Y1656 I1658 F1662	Y1656-N1660 WeakPolarHBondContact O-CB 3.41Å; Y1656-N1660 PolarHBondContact O-N 2.64Å; Y1656-N1660 PolarHBondContact O-ND2 3.41Å; Y1656-N1660 VanDerWaalsContact O-ND2 3.13Å; I1658-N1660 VanDerWaalsContact C-N 3.29Å; I1658-N1660 PolarHBondContact O-N 2.96Å; N1660-F1662 HydrophobicContact CB-CD2 3.85Å; N1660-F1662 HydrophobicContact CB-CE2 3.56Å; N1660-F1662 HydrophobicContact CB-CZ 3.98Å; N1660-F1662 PolarHBondContact O-N 2.77Å
1661	N	57.9	Low	63.2	Low	59.8 Å²	59.8	73.5 Å²	73.5	32%	0.32	36%	0.358	S	S	.	.	S	Bend	trans	-91.8	-4.6	-172.4	-69	-13.6	0	0	0	114.2	T1657 I1658 E1659 K1663 E1736 N1737	T1657-N1661 WeakPolarHBondContact O-CB 3.36Å; T1657-N1661 PolarHBondContact O-ND2 3.07Å; T1657-N1661 VanDerWaalsContact O-ND2 3.09Å; I1658-N1661 PolarHBondContact O-N 2.9Å; E1659-N1661 PolarHBondContact O-N 2.89Å; N1661-K1663 PolarHBondContact O-N 3.25Å; N1661-K1663 VanDerWaalsContact O-N 3.16Å; N1661-E1736 PolarHBondContact O-N 2.9Å; N1661-N1737 PolarHBondContact OD1-ND2 3.14Å
1662	F	66.6	Low	65.5	Low	14 Å²	14	68.6 Å²	68.6	6%	0.061	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.7	-177.6	-58.7	-65.2	0	0	0	111.6	I1658 N1660 W1733 T1734 D1735 H1769 V1771 P1772	I1658-F1662 HydrophobicContact CG2-CD2 3.92Å; I1658-F1662 HydrophobicContact CG2-CE2 4.19Å; I1658-F1662 WeakPolarHBondContact O-CD2 3.31Å; I1658-F1662 PolarHBondContact O-N 3.38Å; N1660-F1662 HydrophobicContact CB-CD2 3.85Å; N1660-F1662 HydrophobicContact CB-CE2 3.56Å; N1660-F1662 HydrophobicContact CB-CZ 3.98Å; N1660-F1662 PolarHBondContact O-N 2.77Å; F1662-W1733 HydrophobicContact CB-CB 4.43Å; F1662-W1733 HydrophobicContact CB-CE3 4.26Å; F1662-T1734 CarbonylContact C-O 3.52Å; F1662-T1734 VanDerWaalsContact CA-O 3.29Å; F1662-T1734 WeakPolarHBondContact CA-O 3.38Å; F1662-D1735 HydrophobicContact CD1-CB 4.11Å; F1662-D1735 HydrophobicContact CE1-CB 4.02Å; F1662-H1769 HydrophobicContact CE2-CB 4.46Å; F1662-H1769 HydrophobicContact CZ-CB 4.2Å; F1662-V1771 HydrophobicContact CD1-CG2 4.29Å; F1662-V1771 HydrophobicContact CE1-CB 4.38Å; F1662-V1771 HydrophobicContact CE1-CG2 3.98Å; F1662-P1772 HydrophobicContact CD2-CG 4.39Å; F1662-P1772 HydrophobicContact CE2-CG 4.29Å
1663	K	73.8	Confident	67.5	Low	66 Å²	66	63.5 Å²	63.5	29%	0.287	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	133.7	167.1	-75.4	-171	175.2	157.9	0	109.9	N1661 Y1665 F1684 W1733 T1734 E1736	N1661-K1663 PolarHBondContact O-N 3.25Å; N1661-K1663 VanDerWaalsContact O-N 3.16Å; K1663-Y1665 HydrophobicContact CB-CD2 4.47Å; K1663-Y1665 HydrophobicContact CB-CE2 3.94Å; K1663-F1684 HydrophobicContact CB-CD2 4.26Å; K1663-F1684 HydrophobicContact CB-CE2 3.73Å; K1663-F1684 HydrophobicContact CD-CD2 4.3Å; K1663-F1684 HydrophobicContact CD-CE2 3.81Å; K1663-F1684 HydrophobicContact CD-CZ 4.26Å; K1663-F1684 HydrophobicContact CG-CD2 4.48Å; K1663-F1684 HydrophobicContact CG-CE2 3.66Å; K1663-F1684 VanDerWaalsContact CG-CE2 3.48Å; K1663-F1684 HydrophobicContact CG-CZ 4.26Å; K1663-W1733 CarbonylContact O-C 3.5Å; K1663-W1733 WeakPolarHBondContact O-CA 3.23Å; K1663-T1734 VanDerWaalsContact CB-OG1 3.27Å; K1663-T1734 WeakPolarHBondContact CB-OG1 3.2Å; K1663-T1734 PolarHBondContact N-O 3.17Å; K1663-T1734 PolarHBondContact O-N 3.16Å; K1663-T1734 PolarHBondContact O-OG1 3.03Å; K1663-E1736 HydrophobicContact CD-CG 4.11Å; K1663-E1736 WeakPolarHBondContact CD-OE1 3.27Å; K1663-E1736 WeakPolarHBondContact CD-OE2 3.42Å; K1663-E1736 VanDerWaalsContact CE-CD 3.44Å; K1663-E1736 VanDerWaalsContact CE-OE1 3.31Å; K1663-E1736 WeakPolarHBondContact CE-OE1 3.28Å; K1663-E1736 WeakPolarHBondContact CE-OE2 3.35Å; K1663-E1736 HydrophobicContact CG-CG 4.08Å; K1663-E1736 WeakPolarHBondContact CG-OE1 3.29Å; K1663-E1736 IonicContact NZ-OE1 3.08Å; K1663-E1736 PolarHBondContact NZ-OE1 3Å; K1663-E1736 IonicContact NZ-OE2 3.38Å; K1663-E1736 PolarHBondContact NZ-OE2 3.02Å
1664	A	81.3	Confident	69.3	Low	0.4 Å²	0.4	66.4 Å²	66.4	0%	0.003	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136.2	177.6	0	0	0	0	0	110.8	I1638 F1684 L1685 I1731 I1732 W1733	I1638-A1664 HydrophobicContact CD1-CB 3.76Å; I1638-A1664 HydrophobicContact CG1-CB 4.1Å; A1664-F1684 WeakPolarHBondContact O-CD2 3.21Å; A1664-L1685 HydrophobicContact CB-CB 4.23Å; A1664-L1685 HydrophobicContact CB-CD1 3.78Å; A1664-L1685 PolarHBondContact O-N 3.05Å; A1664-I1731 HydrophobicContact CB-CD1 3.83Å; A1664-I1731 HydrophobicContact CB-CG1 4.13Å; A1664-I1731 HydrophobicContact CB-CG2 4.02Å; A1664-I1732 CarbonylContact C-O 3.52Å; A1664-I1732 WeakPolarHBondContact CA-O 3.31Å; A1664-W1733 HydrophobicContact CB-CD2 4.41Å; A1664-W1733 HydrophobicContact CB-CE3 3.78Å; A1664-W1733 HydrophobicContact CB-CG 4.47Å; A1664-W1733 HydrophobicContact CB-CH2 4.37Å; A1664-W1733 HydrophobicContact CB-CZ3 3.73Å
1665	Y	85.8	Confident	71.7	Confident	62.8 Å²	62.8	62.2 Å²	62.2	25%	0.246	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	135.5	176.6	-66.3	-94.1	0	0	0	110.1	K1663 L1682 I1683 F1684 I1731 I1732 T1734	K1663-Y1665 HydrophobicContact CB-CD2 4.47Å; K1663-Y1665 HydrophobicContact CB-CE2 3.94Å; Y1665-L1682 HydrophobicContact CD1-CB 4.38Å; Y1665-I1683 CarbonylContact C-O 3.54Å; Y1665-I1683 VanDerWaalsContact CA-O 3.27Å; Y1665-I1683 WeakPolarHBondContact CA-O 3.27Å; Y1665-F1684 HydrophobicContact CD1-CB 4.17Å; Y1665-F1684 HydrophobicContact CD1-CD2 4.42Å; Y1665-F1684 HydrophobicContact CE1-CB 3.94Å; Y1665-F1684 HydrophobicContact CE1-CD2 4.23Å; Y1665-F1684 HydrophobicContact CE1-CG 4.47Å; Y1665-I1731 CarbonylContact O-C 3.52Å; Y1665-I1731 VanDerWaalsContact O-CA 3.27Å; Y1665-I1731 WeakPolarHBondContact O-CA 3.27Å; Y1665-I1732 PolarHBondContact N-O 2.93Å; Y1665-I1732 PolarHBondContact O-N 3.12Å; Y1665-T1734 HydrophobicContact CD2-CG2 4.07Å; Y1665-T1734 HydrophobicContact CE2-CG2 4.03Å; Y1665-T1734 WeakPolarHBondContact CE2-OG1 3.27Å
1666	T	89.1	Confident	74	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	142.8	177.7	-57	0	0	0	0	110.8	L1635 L1682 I1683 L1685 F1702 V1729 W1730 I1731 I1777	L1635-T1666 HydrophobicContact CD1-CG2 3.61Å; L1635-T1666 VanDerWaalsContact CD1-CG2 3.43Å; T1666-L1682 WeakPolarHBondContact O-CA 3.41Å; T1666-I1683 PolarHBondContact N-O 2.92Å; T1666-I1683 PolarHBondContact O-N 3.07Å; T1666-L1685 VanDerWaalsContact CB-CD1 3.43Å; T1666-L1685 VanDerWaalsContact OG1-CD1 3.26Å; T1666-L1685 WeakPolarHBondContact OG1-CD1 3.15Å; T1666-L1685 VanDerWaalsContact OG1-CG 3.28Å; T1666-L1685 WeakPolarHBondContact OG1-CG 3.08Å; T1666-F1702 HydrophobicContact CG2-CZ 4.11Å; T1666-V1729 HydrophobicContact CG2-CG1 3.52Å; T1666-V1729 VanDerWaalsContact CG2-CG1 3.44Å; T1666-W1730 CarbonylContact C-O 3.51Å; T1666-W1730 VanDerWaalsContact CA-O 3.27Å; T1666-W1730 WeakPolarHBondContact CA-O 3.38Å; T1666-W1730 WeakPolarHBondContact CG2-O 3.3Å; T1666-I1731 HydrophobicContact CG2-CG1 4.49Å; T1666-I1777 HydrophobicContact CG2-CD1 4.46Å
1667	F	91.2	Very high	76.3	Confident	16.6 Å²	16.6	52.7 Å²	52.7	7%	0.073	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	161	167.7	69.4	-77	0	0	0	111.5	R1669 M1679 S1680 L1682 W1730 I1732	F1667-R1669 HydrophobicContact CD2-CB 4.49Å; F1667-R1669 HydrophobicContact CE2-CB 4.16Å; F1667-M1679 HydrophobicContact CD2-CB 4.41Å; F1667-M1679 HydrophobicContact CD2-CG 4.42Å; F1667-M1679 HydrophobicContact CD2-SD 4.24Å; F1667-M1679 HydrophobicContact CE2-CG 4.39Å; F1667-M1679 HydrophobicContact CE2-SD 3.85Å; F1667-S1680 WeakPolarHBondContact CA-OG 3.29Å; F1667-L1682 HydrophobicContact CB-CD1 4.36Å; F1667-L1682 HydrophobicContact CB-CD2 4.01Å; F1667-L1682 HydrophobicContact CB-CG 4.38Å; F1667-L1682 HydrophobicContact CD1-CD2 3.75Å; F1667-L1682 HydrophobicContact CG-CD2 4.17Å; F1667-W1730 HydrophobicContact CD1-CB 3.92Å; F1667-W1730 HydrophobicContact CD2-CB 4.44Å; F1667-W1730 HydrophobicContact CE1-CB 3.36Å; F1667-W1730 VanDerWaalsContact CE1-CB 3.49Å; F1667-W1730 HydrophobicContact CE1-CG 4.27Å; F1667-W1730 HydrophobicContact CE2-CB 4.09Å; F1667-W1730 HydrophobicContact CE2-CG 4.3Å; F1667-W1730 HydrophobicContact CG-CB 4.43Å; F1667-W1730 HydrophobicContact CZ-CB 3.47Å; F1667-W1730 VanDerWaalsContact CZ-CB 3.41Å; F1667-W1730 HydrophobicContact CZ-CD2 4.45Å; F1667-W1730 AromaticContact CZ-CG 3.84Å; F1667-W1730 HydrophobicContact CZ-CG 3.9Å; F1667-W1730 PolarHBondContact N-O 3.11Å; F1667-W1730 PolarHBondContact O-N 2.99Å; F1667-I1732 HydrophobicContact CD1-CD1 3.89Å; F1667-I1732 HydrophobicContact CD1-CG1 4.36Å; F1667-I1732 HydrophobicContact CE1-CD1 3.4Å; F1667-I1732 VanDerWaalsContact CE1-CD1 3.47Å; F1667-I1732 HydrophobicContact CE1-CG1 3.8Å; F1667-I1732 HydrophobicContact CE1-CG2 3.94Å; F1667-I1732 HydrophobicContact CZ-CD1 4.3Å
1668	V	92.3	Very high	78.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.4	173.8	-175.1	0	0	0	0	108.9	L1630 M1679 S1680 F1702 F1727 Q1728 V1729 I1851	L1630-V1668 HydrophobicContact CD1-CB 4.22Å; L1630-V1668 HydrophobicContact CD1-CG1 4.44Å; L1630-V1668 HydrophobicContact CD1-CG2 4.39Å; L1630-V1668 HydrophobicContact CD2-CG1 4.38Å; V1668-M1679 CarbonylContact O-C 3.58Å; V1668-M1679 VanDerWaalsContact O-CA 3.28Å; V1668-M1679 WeakPolarHBondContact O-CA 3.21Å; V1668-S1680 PolarHBondContact N-OG 2.89Å; V1668-S1680 PolarHBondContact O-N 2.93Å; V1668-F1702 HydrophobicContact CG2-CD1 4.2Å; V1668-F1702 HydrophobicContact CG2-CD2 4.45Å; V1668-F1702 HydrophobicContact CG2-CE1 3.65Å; V1668-F1702 HydrophobicContact CG2-CE2 4.08Å; V1668-F1702 HydrophobicContact CG2-CZ 3.58Å; V1668-F1702 VanDerWaalsContact CG2-CZ 3.49Å; V1668-F1727 HydrophobicContact CG1-CB 4.14Å; V1668-F1727 HydrophobicContact CG1-CD1 3.87Å; V1668-F1727 HydrophobicContact CG1-CG 4.48Å; V1668-Q1728 CarbonylContact C-O 3.54Å; V1668-Q1728 WeakPolarHBondContact CA-O 3.35Å; V1668-V1729 HydrophobicContact CG2-CG2 4.4Å; V1668-I1851 HydrophobicContact CG1-CD1 4.04Å; V1668-I1851 HydrophobicContact CG2-CD1 3.77Å
1669	R	92.2	Very high	80.3	Confident	78.2 Å²	78.2	51.4 Å²	51.4	30%	0.295	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134.9	174.3	-177.4	-171.9	175.9	-168.1	2.5	109.6	F1667 T1677 Q1678 M1679 Q1728	F1667-R1669 HydrophobicContact CD2-CB 4.49Å; F1667-R1669 HydrophobicContact CE2-CB 4.16Å; R1669-T1677 HydrophobicContact CG-CG2 3.7Å; R1669-T1677 VanDerWaalsContact NE-CG2 3.27Å; R1669-T1677 PolarHBondContact NH2-OG1 3.01Å; R1669-Q1678 WeakPolarHBondContact CA-O 3.32Å; R1669-M1679 HydrophobicContact CB-CG 4.42Å; R1669-M1679 HydrophobicContact CG-CG 4.39Å; R1669-Q1728 HydrophobicContact CB-CB 4.43Å; R1669-Q1728 PolarHBondContact N-O 3.17Å; R1669-Q1728 PolarHBondContact O-N 2.98Å
1670	F	92.3	Very high	82.1	Confident	4.6 Å²	4.6	48.3 Å²	48.3	2%	0.02	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	166.4	171.3	65.5	-86.4	0	0	0	110.8	I1628 L1630 F1672 T1677 Q1678 K1706 F1708 L1725 E1726 F1727	I1628-F1670 HydrophobicContact CD1-CD2 4.41Å; I1628-F1670 HydrophobicContact CD1-CE2 3.74Å; I1628-F1670 HydrophobicContact CD1-CZ 4.12Å; L1630-F1670 HydrophobicContact CD1-CE1 4.47Å; F1670-F1672 HydrophobicContact CD2-CB 4.47Å; F1670-F1672 HydrophobicContact CE2-CB 4.28Å; F1670-T1677 WeakPolarHBondContact O-CA 3.42Å; F1670-Q1678 HydrophobicContact CD1-CB 4.18Å; F1670-Q1678 HydrophobicContact CD2-CB 4.08Å; F1670-Q1678 HydrophobicContact CD2-CG 4.46Å; F1670-Q1678 HydrophobicContact CE1-CB 3.8Å; F1670-Q1678 HydrophobicContact CE2-CB 3.69Å; F1670-Q1678 HydrophobicContact CE2-CG 4.04Å; F1670-Q1678 HydrophobicContact CG-CB 4.32Å; F1670-Q1678 HydrophobicContact CZ-CB 3.55Å; F1670-Q1678 VanDerWaalsContact CZ-CB 3.44Å; F1670-Q1678 HydrophobicContact CZ-CG 4.2Å; F1670-Q1678 PolarHBondContact N-O 2.95Å; F1670-Q1678 PolarHBondContact O-N 3.19Å; F1670-Q1678 VanDerWaalsContact O-O 3.13Å; F1670-K1706 HydrophobicContact CE1-CG 4.27Å; F1670-K1706 HydrophobicContact CZ-CB 4.18Å; F1670-K1706 HydrophobicContact CZ-CG 3.92Å; F1670-F1708 AromaticContact CE2-CE2 3.97Å; F1670-F1708 HydrophobicContact CE2-CE2 3.98Å; F1670-F1708 AromaticContact CE2-CZ 3.82Å; F1670-F1708 HydrophobicContact CE2-CZ 3.82Å; F1670-F1708 HydrophobicContact CZ-CE2 4.16Å; F1670-F1708 AromaticContact CZ-CZ 3.94Å; F1670-F1708 HydrophobicContact CZ-CZ 3.94Å; F1670-L1725 HydrophobicContact CB-CD2 3.88Å; F1670-L1725 HydrophobicContact CD2-CD1 4.39Å; F1670-L1725 HydrophobicContact CD2-CD2 3.88Å; F1670-L1725 HydrophobicContact CG-CD2 4.14Å; F1670-E1726 VanDerWaalsContact CA-O 3.32Å; F1670-E1726 WeakPolarHBondContact CA-O 3.24Å; F1670-E1726 VanDerWaalsContact CB-O 3.27Å; F1670-E1726 WeakPolarHBondContact CB-O 3.26Å; F1670-F1727 HydrophobicContact CB-CD1 3.81Å; F1670-F1727 HydrophobicContact CB-CE1 3.96Å; F1670-F1727 HydrophobicContact CB-CG 4.33Å; F1670-F1727 AromaticContact CD1-CD1 3.87Å; F1670-F1727 HydrophobicContact CD1-CD1 3.87Å; F1670-F1727 AromaticContact CD1-CE1 3.64Å; F1670-F1727 HydrophobicContact CD1-CE1 3.64Å; F1670-F1727 HydrophobicContact CD2-CE1 4.26Å; F1670-F1727 HydrophobicContact CD2-CZ 4.46Å; F1670-F1727 HydrophobicContact CE1-CE1 4.13Å; F1670-F1727 AromaticContact CG-CD1 3.96Å; F1670-F1727 HydrophobicContact CG-CD1 3.98Å; F1670-F1727 AromaticContact CG-CE1 3.7Å; F1670-F1727 HydrophobicContact CG-CE1 3.7Å; F1670-F1727 HydrophobicContact CG-CZ 4.38Å; F1670-F1727 HydrophobicContact CZ-CE1 4.49Å
1671	Q	89.2	Confident	83.7	Confident	124.4 Å²	124.4	48.2 Å²	48.2	58%	0.581	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.9	175.4	179.1	169.8	-11.8	0	0	109.9	G1676 L1725	Q1671-G1676 WeakPolarHBondContact CA-O 3.36Å; Q1671-G1676 WeakPolarHBondContact CG-O 3.4Å; Q1671-L1725 WeakPolarHBondContact O-CD1 3.33Å; Q1671-L1725 WeakPolarHBondContact O-CD2 3.32Å
1672	F	85.5	Confident	85	Confident	4.4 Å²	4.4	49.1 Å²	49.1	2%	0.019	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	144.3	178.4	-154.5	-105.7	0	0	0	110	F1626 I1628 F1670 N1674 Y1675 G1676 F1708 I1710 L1725	F1626-F1672 HydrophobicContact CB-CE1 4.36Å; F1626-F1672 HydrophobicContact CB-CZ 3.89Å; F1626-F1672 HydrophobicContact CD1-CZ 4.12Å; F1626-F1672 HydrophobicContact CD2-CE1 4.18Å; F1626-F1672 AromaticContact CD2-CZ 3.93Å; F1626-F1672 HydrophobicContact CD2-CZ 3.98Å; F1626-F1672 HydrophobicContact CE2-CZ 4.49Å; F1626-F1672 HydrophobicContact CG-CE1 4.3Å; F1626-F1672 AromaticContact CG-CZ 3.73Å; F1626-F1672 HydrophobicContact CG-CZ 3.73Å; I1628-F1672 HydrophobicContact CD1-CD2 4.04Å; I1628-F1672 HydrophobicContact CD1-CE2 4.07Å; F1670-F1672 HydrophobicContact CD2-CB 4.47Å; F1670-F1672 HydrophobicContact CE2-CB 4.28Å; F1672-N1674 PolarHBondContact O-N 3.18Å; F1672-Y1675 AromaticContact CD1-CD2 3.98Å; F1672-Y1675 HydrophobicContact CD1-CD2 4.1Å; F1672-Y1675 PolarHBondContact O-N 3.16Å; F1672-G1676 PolarHBondContact N-O 2.89Å; F1672-G1676 VanDerWaalsContact N-O 3.1Å; F1672-G1676 PolarHBondContact O-N 3.01Å; F1672-G1676 VanDerWaalsContact O-N 3.12Å; F1672-F1708 HydrophobicContact CB-CE1 4.35Å; F1672-F1708 HydrophobicContact CB-CE2 4.45Å; F1672-F1708 HydrophobicContact CB-CZ 4.29Å; F1672-F1708 HydrophobicContact CD1-CB 3.8Å; F1672-F1708 AromaticContact CD1-CD1 3.85Å; F1672-F1708 HydrophobicContact CD1-CD1 3.85Å; F1672-F1708 AromaticContact CD1-CD2 3.67Å; F1672-F1708 HydrophobicContact CD1-CD2 3.67Å; F1672-F1708 HydrophobicContact CD1-CE1 4.36Å; F1672-F1708 HydrophobicContact CD1-CE2 4.22Å; F1672-F1708 AromaticContact CD1-CG 3.46Å; F1672-F1708 HydrophobicContact CD1-CG 3.46Å; F1672-F1708 VanDerWaalsContact CD1-CG 3.42Å; F1672-F1708 HydrophobicContact CD1-CZ 4.46Å; F1672-F1708 HydrophobicContact CD2-CD2 4.39Å; F1672-F1708 HydrophobicContact CD2-CE2 4.42Å; F1672-F1708 HydrophobicContact CE1-CB 3.52Å; F1672-F1708 VanDerWaalsContact CE1-CB 3.46Å; F1672-F1708 HydrophobicContact CE1-CD1 4.42Å; F1672-F1708 AromaticContact CE1-CD2 3.75Å; F1672-F1708 HydrophobicContact CE1-CD2 3.75Å; F1672-F1708 AromaticContact CE1-CG 3.64Å; F1672-F1708 HydrophobicContact CE1-CG 3.64Å; F1672-F1708 HydrophobicContact CE2-CD2 4.44Å; F1672-F1708 HydrophobicContact CG-CD1 4.45Å; F1672-F1708 HydrophobicContact CG-CD2 4.04Å; F1672-F1708 HydrophobicContact CG-CE1 4.47Å; F1672-F1708 HydrophobicContact CG-CE2 4.16Å; F1672-F1708 HydrophobicContact CG-CG 4.2Å; F1672-F1708 HydrophobicContact CG-CZ 4.41Å; F1672-F1708 HydrophobicContact CZ-CB 4.44Å; F1672-F1708 HydrophobicContact CZ-CD2 4.2Å; F1672-F1708 HydrophobicContact CZ-CG 4.47Å; F1672-I1710 HydrophobicContact CD1-CD1 4.27Å; F1672-I1710 HydrophobicContact CE1-CD1 3.63Å; F1672-I1710 HydrophobicContact CZ-CD1 4.43Å; F1672-L1725 HydrophobicContact CD2-CD1 3.92Å; F1672-L1725 VanDerWaalsContact CD2-CD1 3.44Å; F1672-L1725 HydrophobicContact CD2-CD2 3.84Å; F1672-L1725 HydrophobicContact CD2-CG 4.46Å; F1672-L1725 HydrophobicContact CE2-CD1 3.87Å; F1672-L1725 HydrophobicContact CE2-CD2 4.25Å
1673	P	79	Confident	85.8	Confident	29 Å²	29	50 Å²	50	19%	0.188	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	139.4	-178.3	-26.1	33.6	0	0	0	112.1	Y1675 I1710 F1719	P1673-Y1675 VanDerWaalsContact O-CD2 3.25Å; P1673-Y1675 WeakPolarHBondContact O-CD2 3.36Å; P1673-Y1675 PolarHBondContact O-N 3.09Å; P1673-I1710 HydrophobicContact CB-CD1 4.3Å; P1673-F1719 VanDerWaalsContact CD-CZ 3.47Å; P1673-F1719 HydrophobicContact CG-CD1 3.58Å; P1673-F1719 VanDerWaalsContact CG-CD1 3.48Å; P1673-F1719 HydrophobicContact CG-CD2 3.86Å; P1673-F1719 HydrophobicContact CG-CE1 3.19Å; P1673-F1719 HydrophobicContact CG-CE2 3.51Å; P1673-F1719 VanDerWaalsContact CG-CE2 3.45Å; P1673-F1719 HydrophobicContact CG-CG 3.91Å; P1673-F1719 HydrophobicContact CG-CZ 3.17Å
1674	N	79.5	Confident	86.2	Confident	146.8 Å²	146.8	50.9 Å²	50.9	79%	0.785	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	-10.7	178.6	-53.8	-18.3	0	0	0	116.2	F1672	F1672-N1674 PolarHBondContact O-N 3.18Å
1675	Y	82.7	Confident	86	Confident	94.4 Å²	94.4	50.9 Å²	50.9	37%	0.37	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	0.7	179.9	-67.6	-82.6	0	0	0	113.7	F1672 P1673 Q1678 F1708 V1709 I1710	F1672-Y1675 AromaticContact CD1-CD2 3.98Å; F1672-Y1675 HydrophobicContact CD1-CD2 4.1Å; F1672-Y1675 PolarHBondContact O-N 3.16Å; P1673-Y1675 VanDerWaalsContact O-CD2 3.25Å; P1673-Y1675 WeakPolarHBondContact O-CD2 3.36Å; P1673-Y1675 PolarHBondContact O-N 3.09Å; Y1675-Q1678 PolarHBondContact O-NE2 3Å; Y1675-F1708 AromaticContact CD1-CD1 3.93Å; Y1675-F1708 HydrophobicContact CD1-CD1 3.96Å; Y1675-F1708 HydrophobicContact CD1-CE1 4.4Å; Y1675-F1708 HydrophobicContact CD2-CB 4.09Å; Y1675-F1708 AromaticContact CD2-CD1 3.46Å; Y1675-F1708 HydrophobicContact CD2-CD1 3.46Å; Y1675-F1708 VanDerWaalsContact CD2-CD1 3.45Å; Y1675-F1708 HydrophobicContact CD2-CE1 4.31Å; Y1675-F1708 HydrophobicContact CD2-CG 4.13Å; Y1675-F1708 HydrophobicContact CE1-CD1 4.3Å; Y1675-F1708 HydrophobicContact CE2-CB 3.76Å; Y1675-F1708 AromaticContact CE2-CD1 3.85Å; Y1675-F1708 HydrophobicContact CE2-CD1 3.85Å; Y1675-F1708 HydrophobicContact CE2-CG 4.27Å; Y1675-F1708 AromaticContact CG-CD1 3.51Å; Y1675-F1708 HydrophobicContact CG-CD1 3.51Å; Y1675-F1708 VanDerWaalsContact CG-CD1 3.48Å; Y1675-F1708 AromaticContact CG-CE1 3.96Å; Y1675-F1708 HydrophobicContact CG-CE1 3.99Å; Y1675-V1709 PolarHBondContact OH-N 3.02Å; Y1675-V1709 VanDerWaalsContact OH-N 3.11Å; Y1675-V1709 PolarHBondContact OH-O 2.9Å; Y1675-V1709 VanDerWaalsContact OH-O 3.07Å; Y1675-I1710 HydrophobicContact CE2-CD1 4.48Å; Y1675-I1710 HydrophobicContact CE2-CG1 4.11Å
1676	G	83.7	Confident	85.2	Confident	33.4 Å²	33.4	51.1 Å²	51.1	34%	0.344	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	65.5	-151.9	174.7	0	0	0	0	0	113.8	Q1671 F1672	Q1671-G1676 WeakPolarHBondContact CA-O 3.36Å; Q1671-G1676 WeakPolarHBondContact CG-O 3.4Å; F1672-G1676 PolarHBondContact N-O 2.89Å; F1672-G1676 VanDerWaalsContact N-O 3.1Å; F1672-G1676 PolarHBondContact O-N 3.01Å; F1672-G1676 VanDerWaalsContact O-N 3.12Å
1677	T	87.4	Confident	83.9	Confident	56 Å²	56	53.5 Å²	53.5	34%	0.344	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	126.7	175.9	-70	0	0	0	0	110.4	R1669 F1670 M1679	R1669-T1677 HydrophobicContact CG-CG2 3.7Å; R1669-T1677 VanDerWaalsContact NE-CG2 3.27Å; R1669-T1677 PolarHBondContact NH2-OG1 3.01Å; F1670-T1677 WeakPolarHBondContact O-CA 3.42Å; T1677-M1679 HydrophobicContact CG2-CG 4.38Å
1678	Q	89	Confident	82.3	Confident	44.6 Å²	44.6	54.8 Å²	54.8	21%	0.208	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	146.2	175	-63.8	-65.6	-40.4	0	0	109.7	R1669 F1670 Y1675 F1708	R1669-Q1678 WeakPolarHBondContact CA-O 3.32Å; F1670-Q1678 HydrophobicContact CD1-CB 4.18Å; F1670-Q1678 HydrophobicContact CD2-CB 4.08Å; F1670-Q1678 HydrophobicContact CD2-CG 4.46Å; F1670-Q1678 HydrophobicContact CE1-CB 3.8Å; F1670-Q1678 HydrophobicContact CE2-CB 3.69Å; F1670-Q1678 HydrophobicContact CE2-CG 4.04Å; F1670-Q1678 HydrophobicContact CG-CB 4.32Å; F1670-Q1678 HydrophobicContact CZ-CB 3.55Å; F1670-Q1678 VanDerWaalsContact CZ-CB 3.44Å; F1670-Q1678 HydrophobicContact CZ-CG 4.2Å; F1670-Q1678 PolarHBondContact N-O 2.95Å; F1670-Q1678 PolarHBondContact O-N 3.19Å; F1670-Q1678 VanDerWaalsContact O-O 3.13Å; Y1675-Q1678 PolarHBondContact O-NE2 3Å; Q1678-F1708 HydrophobicContact CG-CE1 3.93Å; Q1678-F1708 HydrophobicContact CG-CZ 3.84Å
1679	M	87.7	Confident	80.3	Confident	67.4 Å²	67.4	60.2 Å²	60.2	33%	0.332	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	145.7	179	-59.9	-170.2	-59	0	0	110.8	F1667 V1668 R1669 T1677 K1706 E1932 L2146	F1667-M1679 HydrophobicContact CD2-CB 4.41Å; F1667-M1679 HydrophobicContact CD2-CG 4.42Å; F1667-M1679 HydrophobicContact CD2-SD 4.24Å; F1667-M1679 HydrophobicContact CE2-CG 4.39Å; F1667-M1679 HydrophobicContact CE2-SD 3.85Å; V1668-M1679 CarbonylContact O-C 3.58Å; V1668-M1679 VanDerWaalsContact O-CA 3.28Å; V1668-M1679 WeakPolarHBondContact O-CA 3.21Å; R1669-M1679 HydrophobicContact CB-CG 4.42Å; R1669-M1679 HydrophobicContact CG-CG 4.39Å; T1677-M1679 HydrophobicContact CG2-CG 4.38Å; M1679-K1706 WeakPolarHBondContact O-CE 3.37Å; M1679-K1706 PolarHBondContact O-NZ 3.05Å; M1679-K1706 VanDerWaalsContact O-NZ 3.08Å; M1679-E1932 WeakPolarHBondContact CE-OE2 3.28Å; M1679-L2146 HydrophobicContact CE-CD2 3.37Å; M1679-L2146 HydrophobicContact SD-CD2 4.04Å
1680	S	88.4	Confident	78.4	Confident	10.8 Å²	10.8	61.9 Å²	61.9	8%	0.076	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-75.3	171	167.6	76.4	0	0	0	0	111.6	F1667 V1668 F1702 E1704	F1667-S1680 WeakPolarHBondContact CA-OG 3.29Å; V1668-S1680 PolarHBondContact N-OG 2.89Å; V1668-S1680 PolarHBondContact O-N 2.93Å; S1680-F1702 WeakPolarHBondContact OG-CD1 3.44Å; S1680-F1702 WeakPolarHBondContact OG-CE1 3.2Å; S1680-E1704 WeakPolarHBondContact CA-OE2 3.32Å; S1680-E1704 VanDerWaalsContact CB-OE2 3.27Å; S1680-E1704 WeakPolarHBondContact CB-OE2 3.26Å
1681	Q	83.5	Confident	76.3	Confident	98.2 Å²	98.2	70.2 Å²	70.2	46%	0.459	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-59	151.3	162.9	-49.1	-179.5	8.7	0	0	111.2	I1683 F1702 E1704 N2148	Q1681-I1683 HydrophobicContact CG-CG1 4.25Å; Q1681-F1702 PolarHBondContact NE2-O 2.89Å; Q1681-E1704 PolarHBondContact N-OE2 2.86Å; Q1681-N2148 WeakPolarHBondContact CG-ND2 3.46Å; Q1681-N2148 PolarHBondContact NE2-ND2 2.85Å; Q1681-N2148 PolarHBondContact OE1-ND2 2.8Å
1682	L	84.7	Confident	74.3	Confident	78.4 Å²	78.4	70.1 Å²	70.1	41%	0.41	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-80.9	125.4	172.8	-78.7	147.4	0	0	0	109.6	Y1665 T1666 F1667 I1732	Y1665-L1682 HydrophobicContact CD1-CB 4.38Å; T1666-L1682 WeakPolarHBondContact O-CA 3.41Å; F1667-L1682 HydrophobicContact CB-CD1 4.36Å; F1667-L1682 HydrophobicContact CB-CD2 4.01Å; F1667-L1682 HydrophobicContact CB-CG 4.38Å; F1667-L1682 HydrophobicContact CD1-CD2 3.75Å; F1667-L1682 HydrophobicContact CG-CD2 4.17Å; L1682-I1732 HydrophobicContact CD1-CD1 3.98Å; L1682-I1732 HydrophobicContact CD2-CD1 3.8Å; L1682-I1732 VanDerWaalsContact CD2-CD1 3.5Å; L1682-I1732 HydrophobicContact CD2-CG1 3.98Å; L1682-I1732 HydrophobicContact CG-CD1 4.33Å
1683	I	84.4	Confident	72.6	Confident	34.4 Å²	34.4	72.1 Å²	72.1	18%	0.176	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	130.5	-177.9	-56.8	162.9	0	0	0	109.4	Y1665 T1666 Q1681 L1685 V1700 E1701 F1702	Y1665-I1683 CarbonylContact C-O 3.54Å; Y1665-I1683 VanDerWaalsContact CA-O 3.27Å; Y1665-I1683 WeakPolarHBondContact CA-O 3.27Å; T1666-I1683 PolarHBondContact N-O 2.92Å; T1666-I1683 PolarHBondContact O-N 3.07Å; Q1681-I1683 HydrophobicContact CG-CG1 4.25Å; I1683-L1685 PolarHBondContact O-N 3.08Å; I1683-V1700 HydrophobicContact CB-CG1 3.98Å; I1683-V1700 HydrophobicContact CD1-CG1 4.18Å; I1683-V1700 HydrophobicContact CG2-CG1 3.65Å; I1683-E1701 WeakPolarHBondContact CD1-O 3.35Å; I1683-F1702 VanDerWaalsContact CD1-CA 3.46Å; I1683-F1702 HydrophobicContact CD1-CB 4.03Å; I1683-F1702 HydrophobicContact CD1-CD1 3.18Å; I1683-F1702 HydrophobicContact CD1-CD2 4.23Å; I1683-F1702 HydrophobicContact CD1-CE1 3.55Å; I1683-F1702 VanDerWaalsContact CD1-CE1 3.43Å; I1683-F1702 HydrophobicContact CD1-CE2 4.33Å; I1683-F1702 HydrophobicContact CD1-CG 3.61Å; I1683-F1702 VanDerWaalsContact CD1-CG 3.41Å; I1683-F1702 HydrophobicContact CD1-CZ 4.09Å; I1683-F1702 HydrophobicContact CG1-CD1 4.09Å; I1683-F1702 HydrophobicContact CG1-CE1 4.09Å
1684	F	80.6	Confident	71.3	Confident	83.6 Å²	83.6	78.9 Å²	78.9	37%	0.367	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	131.3	178	177.9	-113.1	0	0	0	110.9	K1663 A1664 Y1665 P1686	K1663-F1684 HydrophobicContact CB-CD2 4.26Å; K1663-F1684 HydrophobicContact CB-CE2 3.73Å; K1663-F1684 HydrophobicContact CD-CD2 4.3Å; K1663-F1684 HydrophobicContact CD-CE2 3.81Å; K1663-F1684 HydrophobicContact CD-CZ 4.26Å; K1663-F1684 HydrophobicContact CG-CD2 4.48Å; K1663-F1684 HydrophobicContact CG-CE2 3.66Å; K1663-F1684 VanDerWaalsContact CG-CE2 3.48Å; K1663-F1684 HydrophobicContact CG-CZ 4.26Å; A1664-F1684 WeakPolarHBondContact O-CD2 3.21Å; Y1665-F1684 HydrophobicContact CD1-CB 4.17Å; Y1665-F1684 HydrophobicContact CD1-CD2 4.42Å; Y1665-F1684 HydrophobicContact CE1-CB 3.94Å; Y1665-F1684 HydrophobicContact CE1-CD2 4.23Å; Y1665-F1684 HydrophobicContact CE1-CG 4.47Å; F1684-P1686 HydrophobicContact CE1-CB 4.16Å; F1684-P1686 WeakPolarHBondContact O-CD 3.27Å
1685	L	78	Confident	70.3	Confident	1 Å²	1	76.4 Å²	76.4	1%	0.005	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	118.7	172	-138.9	81.6	0	0	0	108.3	I1638 L1641 A1664 T1666 I1683 N1687 T1698 V1700 I1731	I1638-L1685 HydrophobicContact CD1-CB 4.07Å; I1638-L1685 HydrophobicContact CD1-CD2 4.13Å; I1638-L1685 HydrophobicContact CD1-CG 4.07Å; I1638-L1685 VanDerWaalsContact CD1-O 3.27Å; I1638-L1685 WeakPolarHBondContact CD1-O 3.42Å; I1638-L1685 HydrophobicContact CG1-CB 4.31Å; I1638-L1685 HydrophobicContact CG1-CD2 3.56Å; I1638-L1685 HydrophobicContact CG1-CG 4Å; L1641-L1685 HydrophobicContact CD1-CD2 4.22Å; A1664-L1685 HydrophobicContact CB-CB 4.23Å; A1664-L1685 HydrophobicContact CB-CD1 3.78Å; A1664-L1685 PolarHBondContact O-N 3.05Å; T1666-L1685 VanDerWaalsContact CB-CD1 3.43Å; T1666-L1685 VanDerWaalsContact OG1-CD1 3.26Å; T1666-L1685 WeakPolarHBondContact OG1-CD1 3.15Å; T1666-L1685 VanDerWaalsContact OG1-CG 3.28Å; T1666-L1685 WeakPolarHBondContact OG1-CG 3.08Å; I1683-L1685 PolarHBondContact O-N 3.08Å; L1685-N1687 PolarHBondContact O-N 2.89Å; L1685-T1698 HydrophobicContact CD1-CG2 3.6Å; L1685-V1700 HydrophobicContact CD1-CG2 3.65Å; L1685-V1700 VanDerWaalsContact CD1-CG2 3.47Å; L1685-V1700 HydrophobicContact CD2-CG2 3.58Å; L1685-V1700 HydrophobicContact CG-CG2 4.09Å; L1685-I1731 HydrophobicContact CD1-CD1 3.74Å; L1685-I1731 HydrophobicContact CD1-CG1 4.02Å; L1685-I1731 HydrophobicContact CD1-CG2 4.18Å; L1685-I1731 HydrophobicContact CD2-CD1 3.94Å
1686	P	68.5	Low	69.4	Low	66.4 Å²	66.4	75.8 Å²	75.8	43%	0.431	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-62.4	139.9	-179.7	-4.9	8.3	0	0	0	112.7	F1684 D1688	F1684-P1686 HydrophobicContact CE1-CB 4.16Å; F1684-P1686 WeakPolarHBondContact O-CD 3.27Å; P1686-D1688 PolarHBondContact O-N 2.92Å
1687	N	62	Low	68.8	Low	51.6 Å²	51.6	74.7 Å²	74.7	28%	0.276	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-78.2	130.2	167.5	-79	-8.3	0	0	0	109.5	I1638 E1659 L1685 D1689	I1638-N1687 VanDerWaalsContact CD1-OD1 3.23Å; I1638-N1687 WeakPolarHBondContact CD1-OD1 3.36Å; E1659-N1687 PolarHBondContact O-ND2 3.06Å; E1659-N1687 VanDerWaalsContact O-ND2 3.11Å; L1685-N1687 PolarHBondContact O-N 2.89Å; N1687-D1689 VanDerWaalsContact C-N 3.32Å; N1687-D1689 PolarHBondContact O-N 2.98Å
1688	D	57.7	Low	68.2	Low	43.6 Å²	43.6	73.1 Å²	73.1	23%	0.233	38%	0.379	C	S	.	.			trans	-76.3	82.8	176.7	-85.7	-29.6	0	0	0	111.6	K1637 K1639 P1686 D1690	K1637-D1688 WeakPolarHBondContact CB-OD2 3.46Å; K1637-D1688 HydrophobicContact CD-CB 4.17Å; K1637-D1688 WeakPolarHBondContact CD-OD1 3.35Å; K1637-D1688 WeakPolarHBondContact CD-OD2 3.49Å; K1637-D1688 WeakPolarHBondContact CE-OD1 3.38Å; K1637-D1688 WeakPolarHBondContact CE-OD2 3.32Å; K1637-D1688 WeakPolarHBondContact CG-OD2 3.4Å; K1637-D1688 IonicContact NZ-OD1 3.17Å; K1637-D1688 PolarHBondContact NZ-OD1 3.11Å; K1637-D1688 IonicContact NZ-OD2 3Å; K1637-D1688 PolarHBondContact NZ-OD2 3.14Å; K1639-D1688 HydrophobicContact CD-CB 3.75Å; K1639-D1688 WeakPolarHBondContact CD-OD2 3.48Å; K1639-D1688 VanDerWaalsContact CE-CB 3.43Å; K1639-D1688 HydrophobicContact CG-CB 4.26Å; K1639-D1688 WeakPolarHBondContact CG-OD2 3.45Å; K1639-D1688 PolarHBondContact NZ-O 3.11Å; P1686-D1688 PolarHBondContact O-N 2.92Å; D1688-D1690 VanDerWaalsContact C-N 3.25Å; D1688-D1690 PolarHBondContact O-N 3.12Å
1689	D	51.6	Low	67.9	Low	112.4 Å²	112.4	72.6 Å²	72.6	60%	0.601	38%	0.377	S	S	*	.			trans	-83.1	-7.7	169.7	-69.5	-33.5	0	0	0	112.9	K1639 N1687 H1691	K1639-D1689 WeakPolarHBondContact CE-OD1 3.31Å; K1639-D1689 IonicContact NZ-OD1 2.77Å; K1639-D1689 PolarHBondContact NZ-OD1 2.66Å; N1687-D1689 VanDerWaalsContact C-N 3.32Å; N1687-D1689 PolarHBondContact O-N 2.98Å; D1689-H1691 VanDerWaalsContact C-N 3.32Å; D1689-H1691 PolarHBondContact O-CD2 3.08Å; D1689-H1691 PolarHBondContact O-N 3.11Å
1690	D	50.4	Low	67.7	Low	113.8 Å²	113.8	69.7 Å²	69.7	61%	0.609	36%	0.363	S	S	*	.			trans	-81.8	95.5	177.7	-91.9	-19.7	0	0	0	112	D1688 T1692 S1693	D1688-D1690 VanDerWaalsContact C-N 3.25Å; D1688-D1690 PolarHBondContact O-N 3.12Å; D1690-T1692 PolarHBondContact O-N 2.99Å; D1690-T1692 PolarHBondContact OD1-OG1 2.85Å; D1690-T1692 VanDerWaalsContact OD1-OG1 3.11Å; D1690-S1693 PolarHBondContact O-N 3.04Å; D1690-S1693 VanDerWaalsContact O-N 3.13Å; D1690-S1693 PolarHBondContact O-OG 3.34Å
1691	H	49	Very low	67.5	Low	180.4 Å²	180.4	72.2 Å²	72.2	84%	0.835	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	4.2	170.2	-72.8	-71.5	0	0	0	114.7	D1689 S1693	D1689-H1691 VanDerWaalsContact C-N 3.32Å; D1689-H1691 PolarHBondContact O-CD2 3.08Å; D1689-H1691 PolarHBondContact O-N 3.11Å; H1691-S1693 VanDerWaalsContact C-N 3.33Å
1692	T	47.7	Very low	67.5	Low	122.2 Å²	122.2	67.9 Å²	67.9	75%	0.75	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-6.3	-171.4	55.9	0	0	0	0	114	D1690	D1690-T1692 PolarHBondContact O-N 2.99Å; D1690-T1692 PolarHBondContact OD1-OG1 2.85Å; D1690-T1692 VanDerWaalsContact OD1-OG1 3.11Å
1693	S	49.2	Very low	67.3	Low	46.2 Å²	46.2	70 Å²	70	32%	0.323	36%	0.359	S	S	.	.			trans	-126.9	112.1	180	67.6	0	0	0	0	113.8	K1637 D1690 H1691 R1695	K1637-S1693 PolarHBondContact NZ-O 3Å; K1637-S1693 PolarHBondContact NZ-OG 3.21Å; K1637-S1693 VanDerWaalsContact NZ-OG 3.12Å; D1690-S1693 PolarHBondContact O-N 3.04Å; D1690-S1693 VanDerWaalsContact O-N 3.13Å; D1690-S1693 PolarHBondContact O-OG 3.34Å; H1691-S1693 VanDerWaalsContact C-N 3.33Å; S1693-R1695 PolarHBondContact O-N 3.19Å; S1693-R1695 VanDerWaalsContact O-N 3.14Å
1694	D	52.1	Low	67.3	Low	171.4 Å²	171.4	69.4 Å²	69.4	92%	0.917	36%	0.356	S	S	*	.			trans	-65.6	1.5	172.5	-96.6	-24.4	0	0	0	114	Q1696	D1694-Q1696 PolarHBondContact O-N 2.94Å
1695	R	57.9	Low	67.5	Low	93.8 Å²	93.8	71.3 Å²	71.3	35%	0.354	36%	0.362	S	S	.	.			trans	-70.2	132.9	-178.5	-66.1	-173.6	-178.8	-163.8	-0.2	110.5	K1637 S1693 S1697 I1884 D1885	K1637-R1695 VanDerWaalsContact CD-O 3.26Å; K1637-R1695 WeakPolarHBondContact CD-O 3.22Å; K1637-R1695 WeakPolarHBondContact CE-O 3.18Å; K1637-R1695 PolarHBondContact NZ-O 2.9Å; S1693-R1695 PolarHBondContact O-N 3.19Å; S1693-R1695 VanDerWaalsContact O-N 3.14Å; R1695-S1697 VanDerWaalsContact C-N 3.32Å; R1695-S1697 PolarHBondContact O-N 2.86Å; R1695-I1884 PolarHBondContact NH1-O 2.94Å; R1695-I1884 VanDerWaalsContact NH1-O 3.13Å; R1695-D1885 IonicContact CZ-OD1 3.2Å; R1695-D1885 VanDerWaalsContact CZ-OD1 3.22Å; R1695-D1885 IonicContact NE-OD1 3.34Å; R1695-D1885 PolarHBondContact NE-OD1 2.91Å; R1695-D1885 VanDerWaalsContact NH1-CA 3.35Å; R1695-D1885 PolarHBondContact NH1-O 3.12Å; R1695-D1885 IonicContact NH1-OD1 2.94Å; R1695-D1885 PolarHBondContact NH1-OD1 3.43Å; R1695-D1885 VanDerWaalsContact NH2-CG 3.33Å; R1695-D1885 PolarHBondContact NH2-O 2.78Å; R1695-D1885 IonicContact NH2-OD1 3.25Å; R1695-D1885 PolarHBondContact NH2-OD1 2.78Å; R1695-D1885 IonicContact NH2-OD2 2.74Å; R1695-D1885 PolarHBondContact NH2-OD2 2.94Å
1696	Q	63.2	Low	67.9	Low	82.8 Å²	82.8	73.4 Å²	73.4	39%	0.387	37%	0.371	S	S	.	.			trans	-86.9	-8.2	-175.3	-67.5	-171.4	1	0	0	114	K1637 Q1640 D1694 Y1847	K1637-Q1696 WeakPolarHBondContact CB-O 3.26Å; K1637-Q1696 VanDerWaalsContact CG-O 3.3Å; K1637-Q1696 WeakPolarHBondContact CG-O 3.26Å; K1637-Q1696 PolarHBondContact N-O 3.12Å; Q1640-Q1696 HydrophobicContact CG-CB 4.08Å; Q1640-Q1696 HydrophobicContact CG-CG 4.45Å; Q1640-Q1696 PolarHBondContact OE1-O 3.14Å; D1694-Q1696 PolarHBondContact O-N 2.94Å; Q1696-Y1847 HydrophobicContact CB-CD1 4.01Å; Q1696-Y1847 HydrophobicContact CB-CE1 4.24Å; Q1696-Y1847 VanDerWaalsContact OE1-CD1 3.27Å
1697	S	71.4	Confident	68.8	Low	9.8 Å²	9.8	74.6 Å²	74.6	7%	0.069	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	159.1	-168.1	-5.7	0	0	0	0	112	Y1634 L1635 R1695 Y1847	Y1634-S1697 VanDerWaalsContact CE1-CB 3.47Å; Y1634-S1697 WeakPolarHBondContact CE1-OG 3.26Å; Y1634-S1697 WeakPolarHBondContact OH-CB 3.46Å; Y1634-S1697 PolarHBondContact OH-OG 2.98Å; L1635-S1697 CarbonylContact O-C 3.54Å; L1635-S1697 VanDerWaalsContact O-CA 3.28Å; L1635-S1697 WeakPolarHBondContact O-CA 3.39Å; L1635-S1697 WeakPolarHBondContact O-CB 3.44Å; R1695-S1697 VanDerWaalsContact C-N 3.32Å; R1695-S1697 PolarHBondContact O-N 2.86Å; S1697-Y1847 WeakPolarHBondContact OG-CB 3.47Å; S1697-Y1847 PolarHBondContact OG-O 2.77Å; S1697-Y1847 VanDerWaalsContact OG-O 3.08Å
1698	T	76.3	Confident	70.1	Confident	21.6 Å²	21.6	72.4 Å²	72.4	13%	0.133	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	149.2	-175.6	45.9	0	0	0	0	111.3	Y1634 L1635 K1637 L1685	Y1634-T1698 WeakPolarHBondContact CA-O 3.33Å; Y1634-T1698 WeakPolarHBondContact CD2-O 3.35Å; L1635-T1698 PolarHBondContact N-O 2.97Å; L1635-T1698 PolarHBondContact O-N 3.06Å; K1637-T1698 HydrophobicContact CD-CG2 4.43Å; K1637-T1698 HydrophobicContact CG-CG2 3.82Å; K1637-T1698 WeakPolarHBondContact CG-OG1 3.34Å; L1685-T1698 HydrophobicContact CD1-CG2 3.6Å
1699	I	80.8	Confident	71.6	Confident	34.8 Å²	34.8	71.8 Å²	71.8	18%	0.178	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	125.8	173.5	-64.5	166.5	0	0	0	109.1	F1632 A1633 Y1634 W1815 P1882 I1884	F1632-I1699 HydrophobicContact CB-CG2 4.42Å; F1632-I1699 HydrophobicContact CD1-CG2 4.13Å; A1633-I1699 CarbonylContact O-C 3.49Å; A1633-I1699 WeakPolarHBondContact O-CA 3.35Å; Y1634-I1699 HydrophobicContact CD2-CD1 4.33Å; Y1634-I1699 HydrophobicContact CD2-CG1 3.56Å; Y1634-I1699 VanDerWaalsContact CD2-CG1 3.45Å; Y1634-I1699 HydrophobicContact CE2-CD1 4.43Å; Y1634-I1699 HydrophobicContact CE2-CG1 4.08Å; I1699-W1815 HydrophobicContact CD1-CZ2 4.15Å; I1699-P1882 HydrophobicContact CD1-CB 4.11Å; I1699-P1882 HydrophobicContact CD1-CG 4.2Å; I1699-P1882 WeakPolarHBondContact CD1-O 3.28Å; I1699-P1882 HydrophobicContact CG2-CG 4.07Å; I1699-I1884 HydrophobicContact CD1-CB 4.42Å; I1699-I1884 HydrophobicContact CD1-CG1 4.09Å; I1699-I1884 HydrophobicContact CD1-CG2 4.38Å; I1699-I1884 HydrophobicContact CG1-CG1 4.19Å
1700	V	83.6	Confident	73.4	Confident	6 Å²	6	66.8 Å²	66.8	4%	0.036	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	132.1	171	-179	0	0	0	0	108.8	F1632 A1633 L1635 I1683 L1685 F1702	F1632-V1700 CarbonylContact C-O 3.5Å; F1632-V1700 VanDerWaalsContact CA-O 3.25Å; F1632-V1700 WeakPolarHBondContact CA-O 3.35Å; A1633-V1700 PolarHBondContact N-O 3.18Å; A1633-V1700 PolarHBondContact O-N 2.91Å; L1635-V1700 HydrophobicContact CD1-CB 4.42Å; L1635-V1700 HydrophobicContact CD1-CG2 3.9Å; L1635-V1700 HydrophobicContact CG-CG2 4.37Å; I1683-V1700 HydrophobicContact CB-CG1 3.98Å; I1683-V1700 HydrophobicContact CD1-CG1 4.18Å; I1683-V1700 HydrophobicContact CG2-CG1 3.65Å; L1685-V1700 HydrophobicContact CD1-CG2 3.65Å; L1685-V1700 VanDerWaalsContact CD1-CG2 3.47Å; L1685-V1700 HydrophobicContact CD2-CG2 3.58Å; L1685-V1700 HydrophobicContact CG-CG2 4.09Å; V1700-F1702 HydrophobicContact CB-CE2 4.24Å; V1700-F1702 HydrophobicContact CG1-CD2 4.25Å; V1700-F1702 HydrophobicContact CG1-CE2 3.95Å; V1700-F1702 HydrophobicContact CG1-CZ 4.12Å
1701	E	84.8	Confident	75.3	Confident	63.4 Å²	63.4	64.8 Å²	64.8	30%	0.296	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	120.3	179.9	-179.2	173.8	-129.6	0	0	110.5	F1632 I1683 K1703 L1881	F1632-E1701 HydrophobicContact CD1-CB 3.91Å; F1632-E1701 HydrophobicContact CD1-CG 3.89Å; F1632-E1701 HydrophobicContact CE1-CB 4.02Å; F1632-E1701 HydrophobicContact CE1-CG 3.6Å; F1632-E1701 VanDerWaalsContact CE1-OE1 3.27Å; F1632-E1701 WeakPolarHBondContact CE1-OE1 3.39Å; F1632-E1701 HydrophobicContact CZ-CG 4.39Å; F1632-E1701 WeakPolarHBondContact CZ-OE1 3.26Å; I1683-E1701 WeakPolarHBondContact CD1-O 3.35Å; E1701-K1703 HydrophobicContact CG-CB 4.4Å; E1701-K1703 HydrophobicContact CG-CD 3.83Å; E1701-K1703 HydrophobicContact CG-CG 3.72Å; E1701-K1703 VanDerWaalsContact OE1-CD 3.29Å; E1701-K1703 WeakPolarHBondContact OE1-CD 3.41Å; E1701-K1703 WeakPolarHBondContact OE1-CE 3.41Å; E1701-K1703 IonicContact OE1-NZ 2.74Å; E1701-K1703 PolarHBondContact OE1-NZ 3.06Å; E1701-K1703 WeakPolarHBondContact OE2-CD 3.44Å; E1701-K1703 WeakPolarHBondContact OE2-CE 3.41Å; E1701-K1703 IonicContact OE2-NZ 3.48Å; E1701-K1703 PolarHBondContact OE2-NZ 3.06Å; E1701-L1881 VanDerWaalsContact OE1-CD1 3.27Å; E1701-L1881 WeakPolarHBondContact OE1-CD1 3.25Å
1702	F	84	Confident	77.2	Confident	9 Å²	9	56.5 Å²	56.5	4%	0.039	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-43.9	-179.3	-70.7	-92.2	0	0	0	113.2	L1630 N1631 A1633 T1666 V1668 S1680 Q1681 I1683 V1700 E1704	L1630-F1702 HydrophobicContact CB-CB 4.05Å; L1630-F1702 HydrophobicContact CB-CG 4.44Å; L1630-F1702 VanDerWaalsContact O-CB 3.27Å; L1630-F1702 WeakPolarHBondContact O-CB 3.29Å; N1631-F1702 PolarHBondContact O-N 3.03Å; A1633-F1702 HydrophobicContact CB-CE2 3.75Å; T1666-F1702 HydrophobicContact CG2-CZ 4.11Å; V1668-F1702 HydrophobicContact CG2-CD1 4.2Å; V1668-F1702 HydrophobicContact CG2-CD2 4.45Å; V1668-F1702 HydrophobicContact CG2-CE1 3.65Å; V1668-F1702 HydrophobicContact CG2-CE2 4.08Å; V1668-F1702 HydrophobicContact CG2-CZ 3.58Å; V1668-F1702 VanDerWaalsContact CG2-CZ 3.49Å; S1680-F1702 WeakPolarHBondContact OG-CD1 3.44Å; S1680-F1702 WeakPolarHBondContact OG-CE1 3.2Å; Q1681-F1702 PolarHBondContact NE2-O 2.89Å; I1683-F1702 VanDerWaalsContact CD1-CA 3.46Å; I1683-F1702 HydrophobicContact CD1-CB 4.03Å; I1683-F1702 HydrophobicContact CD1-CD1 3.18Å; I1683-F1702 HydrophobicContact CD1-CD2 4.23Å; I1683-F1702 HydrophobicContact CD1-CE1 3.55Å; I1683-F1702 VanDerWaalsContact CD1-CE1 3.43Å; I1683-F1702 HydrophobicContact CD1-CE2 4.33Å; I1683-F1702 HydrophobicContact CD1-CG 3.61Å; I1683-F1702 VanDerWaalsContact CD1-CG 3.41Å; I1683-F1702 HydrophobicContact CD1-CZ 4.09Å; I1683-F1702 HydrophobicContact CG1-CD1 4.09Å; I1683-F1702 HydrophobicContact CG1-CE1 4.09Å; V1700-F1702 HydrophobicContact CB-CE2 4.24Å; V1700-F1702 HydrophobicContact CG1-CD2 4.25Å; V1700-F1702 HydrophobicContact CG1-CE2 3.95Å; V1700-F1702 HydrophobicContact CG1-CZ 4.12Å; F1702-E1704 PolarHBondContact O-N 3.14Å; F1702-E1704 VanDerWaalsContact O-N 3.09Å
1703	K	80.5	Confident	79.2	Confident	121.2 Å²	121.2	52.3 Å²	52.3	53%	0.527	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48	34.3	-178.7	-83.6	172.7	166.1	147.1	0	113.9	L1630 N1631 E1701 M1876	L1630-K1703 PolarHBondContact O-N 2.86Å; L1630-K1703 VanDerWaalsContact O-N 3.14Å; N1631-K1703 PolarHBondContact O-N 3.03Å; E1701-K1703 HydrophobicContact CG-CB 4.4Å; E1701-K1703 HydrophobicContact CG-CD 3.83Å; E1701-K1703 HydrophobicContact CG-CG 3.72Å; E1701-K1703 VanDerWaalsContact OE1-CD 3.29Å; E1701-K1703 WeakPolarHBondContact OE1-CD 3.41Å; E1701-K1703 WeakPolarHBondContact OE1-CE 3.41Å; E1701-K1703 IonicContact OE1-NZ 2.74Å; E1701-K1703 PolarHBondContact OE1-NZ 3.06Å; E1701-K1703 WeakPolarHBondContact OE2-CD 3.44Å; E1701-K1703 WeakPolarHBondContact OE2-CE 3.41Å; E1701-K1703 IonicContact OE2-NZ 3.48Å; E1701-K1703 PolarHBondContact OE2-NZ 3.06Å; K1703-M1876 HydrophobicContact CG-SD 4.1Å
1704	E	83.5	Confident	81	Confident	22.8 Å²	22.8	51.3 Å²	51.3	11%	0.107	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	153.2	-178.2	-172.7	175.4	-177.3	0	0	110.7	L1630 S1680 Q1681 F1702 K1706	L1630-E1704 PolarHBondContact N-O 3.03Å; L1630-E1704 PolarHBondContact O-N 2.79Å; L1630-E1704 VanDerWaalsContact O-N 3.15Å; S1680-E1704 WeakPolarHBondContact CA-OE2 3.32Å; S1680-E1704 VanDerWaalsContact CB-OE2 3.27Å; S1680-E1704 WeakPolarHBondContact CB-OE2 3.26Å; Q1681-E1704 PolarHBondContact N-OE2 2.86Å; F1702-E1704 PolarHBondContact O-N 3.14Å; F1702-E1704 VanDerWaalsContact O-N 3.09Å; E1704-K1706 WeakPolarHBondContact OE1-CE 3.33Å; E1704-K1706 IonicContact OE1-NZ 3.12Å; E1704-K1706 PolarHBondContact OE1-NZ 3.02Å
1705	Y	85.1	Confident	82.7	Confident	124 Å²	124	50.6 Å²	50.6	49%	0.486	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	153	168.2	69.7	-80.5	0	0	0	111.1	T1627 I1628 Y1629 E1707 M1876	T1627-Y1705 HydrophobicContact CG2-CD2 4.13Å; I1628-Y1705 CarbonylContact O-C 3.52Å; I1628-Y1705 WeakPolarHBondContact O-CA 3.4Å; Y1629-Y1705 HydrophobicContact CE1-CG 4.47Å; Y1705-E1707 HydrophobicContact CD2-CG 3.83Å; Y1705-E1707 HydrophobicContact CE2-CG 3.86Å; Y1705-E1707 WeakPolarHBondContact CE2-OE1 3.26Å; Y1705-M1876 HydrophobicContact CD1-CE 3.97Å; Y1705-M1876 HydrophobicContact CG-CE 4.45Å
1706	K	87.5	Confident	84.2	Confident	45 Å²	45	46.6 Å²	46.6	20%	0.196	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	135.4	172.4	-59.8	-63.4	-164.9	-165.9	0	109.2	T1627 I1628 F1670 M1679 E1704 F1708	T1627-K1706 WeakPolarHBondContact CA-O 3.42Å; I1628-K1706 PolarHBondContact N-O 3.22Å; I1628-K1706 PolarHBondContact O-N 3Å; F1670-K1706 HydrophobicContact CE1-CG 4.27Å; F1670-K1706 HydrophobicContact CZ-CB 4.18Å; F1670-K1706 HydrophobicContact CZ-CG 3.92Å; M1679-K1706 WeakPolarHBondContact O-CE 3.37Å; M1679-K1706 PolarHBondContact O-NZ 3.05Å; M1679-K1706 VanDerWaalsContact O-NZ 3.08Å; E1704-K1706 WeakPolarHBondContact OE1-CE 3.33Å; E1704-K1706 IonicContact OE1-NZ 3.12Å; E1704-K1706 PolarHBondContact OE1-NZ 3.02Å; K1706-F1708 HydrophobicContact CB-CE2 3.68Å; K1706-F1708 HydrophobicContact CB-CZ 3.67Å; K1706-F1708 HydrophobicContact CG-CZ 4.43Å
1707	E	86.9	Confident	85.3	Confident	89.8 Å²	89.8	43.3 Å²	43.3	42%	0.42	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	139	178.6	-66	-176.7	159.1	0	0	110.8	F1626 T1627 Y1705 L1866	F1626-E1707 CarbonylContact O-C 3.5Å; F1626-E1707 VanDerWaalsContact O-CA 3.3Å; F1626-E1707 WeakPolarHBondContact O-CA 3.42Å; T1627-E1707 HydrophobicContact CG2-CG 4.02Å; Y1705-E1707 HydrophobicContact CD2-CG 3.83Å; Y1705-E1707 HydrophobicContact CE2-CG 3.86Å; Y1705-E1707 WeakPolarHBondContact CE2-OE1 3.26Å; E1707-L1866 WeakPolarHBondContact OE2-CD2 3.37Å
1708	F	89.1	Confident	85.9	Confident	6.4 Å²	6.4	46.6 Å²	46.6	3%	0.028	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	137	178.4	-52.3	-76.8	0	0	0	109.7	H1625 F1626 I1628 F1670 F1672 Y1675 Q1678 K1706	H1625-F1708 CarbonylContact C-O 3.56Å; H1625-F1708 WeakPolarHBondContact CA-O 3.38Å; F1626-F1708 HydrophobicContact CB-CB 4.35Å; F1626-F1708 HydrophobicContact CB-CD2 4.47Å; F1626-F1708 PolarHBondContact N-O 3.17Å; F1626-F1708 PolarHBondContact O-N 3.05Å; I1628-F1708 HydrophobicContact CD1-CD2 4.27Å; I1628-F1708 HydrophobicContact CD1-CE2 3.75Å; I1628-F1708 HydrophobicContact CG1-CD2 4.47Å; I1628-F1708 HydrophobicContact CG1-CE2 4.16Å; F1670-F1708 AromaticContact CE2-CE2 3.97Å; F1670-F1708 HydrophobicContact CE2-CE2 3.98Å; F1670-F1708 AromaticContact CE2-CZ 3.82Å; F1670-F1708 HydrophobicContact CE2-CZ 3.82Å; F1670-F1708 HydrophobicContact CZ-CE2 4.16Å; F1670-F1708 AromaticContact CZ-CZ 3.94Å; F1670-F1708 HydrophobicContact CZ-CZ 3.94Å; F1672-F1708 HydrophobicContact CB-CE1 4.35Å; F1672-F1708 HydrophobicContact CB-CE2 4.45Å; F1672-F1708 HydrophobicContact CB-CZ 4.29Å; F1672-F1708 HydrophobicContact CD1-CB 3.8Å; F1672-F1708 AromaticContact CD1-CD1 3.85Å; F1672-F1708 HydrophobicContact CD1-CD1 3.85Å; F1672-F1708 AromaticContact CD1-CD2 3.67Å; F1672-F1708 HydrophobicContact CD1-CD2 3.67Å; F1672-F1708 HydrophobicContact CD1-CE1 4.36Å; F1672-F1708 HydrophobicContact CD1-CE2 4.22Å; F1672-F1708 AromaticContact CD1-CG 3.46Å; F1672-F1708 HydrophobicContact CD1-CG 3.46Å; F1672-F1708 VanDerWaalsContact CD1-CG 3.42Å; F1672-F1708 HydrophobicContact CD1-CZ 4.46Å; F1672-F1708 HydrophobicContact CD2-CD2 4.39Å; F1672-F1708 HydrophobicContact CD2-CE2 4.42Å; F1672-F1708 HydrophobicContact CE1-CB 3.52Å; F1672-F1708 VanDerWaalsContact CE1-CB 3.46Å; F1672-F1708 HydrophobicContact CE1-CD1 4.42Å; F1672-F1708 AromaticContact CE1-CD2 3.75Å; F1672-F1708 HydrophobicContact CE1-CD2 3.75Å; F1672-F1708 AromaticContact CE1-CG 3.64Å; F1672-F1708 HydrophobicContact CE1-CG 3.64Å; F1672-F1708 HydrophobicContact CE2-CD2 4.44Å; F1672-F1708 HydrophobicContact CG-CD1 4.45Å; F1672-F1708 HydrophobicContact CG-CD2 4.04Å; F1672-F1708 HydrophobicContact CG-CE1 4.47Å; F1672-F1708 HydrophobicContact CG-CE2 4.16Å; F1672-F1708 HydrophobicContact CG-CG 4.2Å; F1672-F1708 HydrophobicContact CG-CZ 4.41Å; F1672-F1708 HydrophobicContact CZ-CB 4.44Å; F1672-F1708 HydrophobicContact CZ-CD2 4.2Å; F1672-F1708 HydrophobicContact CZ-CG 4.47Å; Y1675-F1708 AromaticContact CD1-CD1 3.93Å; Y1675-F1708 HydrophobicContact CD1-CD1 3.96Å; Y1675-F1708 HydrophobicContact CD1-CE1 4.4Å; Y1675-F1708 HydrophobicContact CD2-CB 4.09Å; Y1675-F1708 AromaticContact CD2-CD1 3.46Å; Y1675-F1708 HydrophobicContact CD2-CD1 3.46Å; Y1675-F1708 VanDerWaalsContact CD2-CD1 3.45Å; Y1675-F1708 HydrophobicContact CD2-CE1 4.31Å; Y1675-F1708 HydrophobicContact CD2-CG 4.13Å; Y1675-F1708 HydrophobicContact CE1-CD1 4.3Å; Y1675-F1708 HydrophobicContact CE2-CB 3.76Å; Y1675-F1708 AromaticContact CE2-CD1 3.85Å; Y1675-F1708 HydrophobicContact CE2-CD1 3.85Å; Y1675-F1708 HydrophobicContact CE2-CG 4.27Å; Y1675-F1708 AromaticContact CG-CD1 3.51Å; Y1675-F1708 HydrophobicContact CG-CD1 3.51Å; Y1675-F1708 VanDerWaalsContact CG-CD1 3.48Å; Y1675-F1708 AromaticContact CG-CE1 3.96Å; Y1675-F1708 HydrophobicContact CG-CE1 3.99Å; Q1678-F1708 HydrophobicContact CG-CE1 3.93Å; Q1678-F1708 HydrophobicContact CG-CZ 3.84Å; K1706-F1708 HydrophobicContact CB-CE2 3.68Å; K1706-F1708 HydrophobicContact CB-CZ 3.67Å; K1706-F1708 HydrophobicContact CG-CZ 4.43Å
1709	V	88.6	Confident	86.4	Confident	31.2 Å²	31.2	48.4 Å²	48.4	19%	0.189	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	113.2	179.8	-172.6	0	0	0	0	108.2	Y1623 H1625 Y1675 E1863 L1866	Y1623-V1709 HydrophobicContact CD1-CG1 4.17Å; Y1623-V1709 HydrophobicContact CG-CG1 4.48Å; H1625-V1709 VanDerWaalsContact CD2-CG1 3.47Å; H1625-V1709 WeakPolarHBondContact CD2-CG1 3.39Å; H1625-V1709 VanDerWaalsContact CD2-CG2 3.46Å; H1625-V1709 WeakPolarHBondContact CD2-CG2 3.17Å; H1625-V1709 WeakPolarHBondContact ND1-CG2 3.35Å; Y1675-V1709 PolarHBondContact OH-N 3.02Å; Y1675-V1709 VanDerWaalsContact OH-N 3.11Å; Y1675-V1709 PolarHBondContact OH-O 2.9Å; Y1675-V1709 VanDerWaalsContact OH-O 3.07Å; V1709-E1863 HydrophobicContact CG1-CG 4.22Å; V1709-L1866 HydrophobicContact CG2-CD1 4.31Å
1710	I	89.4	Confident	86.8	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.036	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.1	-177.4	-53	-179	0	0	0	108.8	Y1623 K1624 F1626 F1672 P1673 Y1675 L1716	Y1623-I1710 WeakPolarHBondContact CA-O 3.31Å; K1624-I1710 PolarHBondContact N-O 3.2Å; K1624-I1710 PolarHBondContact O-N 2.86Å; F1626-I1710 HydrophobicContact CD2-CD1 4.35Å; F1626-I1710 HydrophobicContact CD2-CG1 4.44Å; F1626-I1710 HydrophobicContact CE2-CB 4.39Å; F1626-I1710 HydrophobicContact CE2-CD1 4.18Å; F1626-I1710 HydrophobicContact CE2-CG1 4.38Å; F1672-I1710 HydrophobicContact CD1-CD1 4.27Å; F1672-I1710 HydrophobicContact CE1-CD1 3.63Å; F1672-I1710 HydrophobicContact CZ-CD1 4.43Å; P1673-I1710 HydrophobicContact CB-CD1 4.3Å; Y1675-I1710 HydrophobicContact CE2-CD1 4.48Å; Y1675-I1710 HydrophobicContact CE2-CG1 4.11Å; I1710-L1716 HydrophobicContact CB-CD1 4.42Å; I1710-L1716 HydrophobicContact CB-CD2 4.06Å; I1710-L1716 HydrophobicContact CD1-CD1 4.03Å; I1710-L1716 HydrophobicContact CG2-CD1 4.08Å; I1710-L1716 HydrophobicContact CG2-CD2 3.91Å; I1710-L1716 HydrophobicContact CG2-CG 4.4Å
1711	P	90.3	Very high	86.8	Confident	72.2 Å²	72.2	47.2 Å²	47.2	47%	0.469	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	143.7	171.7	26.4	-34.8	0	0	0	110.4	Q1622 Y1623 S1713	Q1622-P1711 WeakPolarHBondContact O-CA 3.23Å; Y1623-P1711 HydrophobicContact CD1-CB 4.22Å; Y1623-P1711 HydrophobicContact CE1-CB 4.2Å; P1711-S1713 PolarHBondContact O-N 2.98Å
1712	V	89.8	Confident	86.6	Confident	6.8 Å²	6.8	47.5 Å²	47.5	4%	0.041	24%	0.235	C	C	.	.			trans	-65.7	125.8	176.2	171.9	0	0	0	0	108.9	W1612 G1615 L1616 D1617 Q1622 K1624	W1612-V1712 HydrophobicContact CB-CG1 3.52Å; W1612-V1712 VanDerWaalsContact CB-CG1 3.49Å; W1612-V1712 HydrophobicContact CD2-CG1 3.65Å; W1612-V1712 HydrophobicContact CE3-CG1 3.85Å; W1612-V1712 HydrophobicContact CG-CG1 3.5Å; W1612-V1712 VanDerWaalsContact CG-CG1 3.47Å; G1615-V1712 WeakPolarHBondContact CA-O 3.34Å; L1616-V1712 VanDerWaalsContact C-CG1 3.49Å; D1617-V1712 HydrophobicContact CB-CG1 4.28Å; D1617-V1712 HydrophobicContact CB-CG2 4.18Å; Q1622-V1712 PolarHBondContact O-N 3.07Å; K1624-V1712 HydrophobicContact CD-CG2 4.26Å; K1624-V1712 HydrophobicContact CG-CG2 3.89Å
1713	S	90	Very high	86.6	Confident	33.6 Å²	33.6	48.2 Å²	48.2	24%	0.235	24%	0.242	C	C	.	.			trans	-151.2	158.2	176.4	73.3	0	0	0	0	110.8	W1612 P1711 E1715 L1716 R1717	W1612-S1713 CarbonylContact O-C 3.55Å; W1612-S1713 VanDerWaalsContact O-C 3.3Å; W1612-S1713 VanDerWaalsContact O-CA 3.24Å; W1612-S1713 WeakPolarHBondContact O-CA 3.4Å; P1711-S1713 PolarHBondContact O-N 2.98Å; S1713-E1715 PolarHBondContact O-N 2.94Å; S1713-E1715 WeakPolarHBondContact OG-CB 3.46Å; S1713-E1715 PolarHBondContact OG-N 3.01Å; S1713-L1716 PolarHBondContact O-N 3.05Å; S1713-L1716 VanDerWaalsContact O-N 3.13Å; S1713-L1716 PolarHBondContact OG-N 3.2Å; S1713-L1716 VanDerWaalsContact OG-N 3.11Å; S1713-R1717 PolarHBondContact O-N 3.01Å; S1713-R1717 VanDerWaalsContact O-N 3.12Å
1714	A	87	Confident	86.9	Confident	25.6 Å²	25.6	44.2 Å²	44.2	21%	0.212	23%	0.228	C	C	.	.	H	α-helix	trans	-58.6	-31.1	172	0	0	0	0	0	112.3	W1612 K1613 R1717 N1718	W1612-A1714 PolarHBondContact O-N 2.86Å; W1612-A1714 VanDerWaalsContact O-N 3.1Å; K1613-A1714 HydrophobicContact CG-CB 3.91Å; A1714-R1717 PolarHBondContact O-N 3.19Å; A1714-N1718 WeakPolarHBondContact O-CB 3.37Å; A1714-N1718 VanDerWaalsContact O-CG 3.28Å; A1714-N1718 PolarHBondContact O-N 3.08Å; A1714-N1718 PolarHBondContact O-ND2 2.96Å
1715	E	87.4	Confident	87.2	Confident	156.8 Å²	156.8	43.3 Å²	43.3	73%	0.733	22%	0.223	S	C	*	.	H	α-helix	trans	-64.7	-44.6	175.1	-61.6	172.8	174.6	0	0	111.7	S1713 R1717 N1718 F1719	S1713-E1715 PolarHBondContact O-N 2.94Å; S1713-E1715 WeakPolarHBondContact OG-CB 3.46Å; S1713-E1715 PolarHBondContact OG-N 3.01Å; E1715-R1717 VanDerWaalsContact C-N 3.31Å; E1715-R1717 PolarHBondContact O-N 3.25Å; E1715-N1718 PolarHBondContact O-N 3.1Å; E1715-F1719 WeakPolarHBondContact O-CB 3.22Å; E1715-F1719 PolarHBondContact O-N 3.19Å
1716	L	89.2	Confident	87.5	Confident	8.2 Å²	8.2	41.7 Å²	41.7	4%	0.043	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-40.9	175	-179.9	62.4	0	0	0	111	W1612 K1624 F1626 I1710 S1713 F1719 L1720	W1612-L1716 HydrophobicContact CE3-CB 4.44Å; W1612-L1716 HydrophobicContact CE3-CD2 4.47Å; W1612-L1716 HydrophobicContact CE3-CG 4.49Å; W1612-L1716 HydrophobicContact CZ3-CB 4.32Å; W1612-L1716 HydrophobicContact CZ3-CD2 3.96Å; W1612-L1716 HydrophobicContact CZ3-CG 3.94Å; K1624-L1716 HydrophobicContact CB-CD2 4.1Å; K1624-L1716 HydrophobicContact CG-CD2 3.94Å; F1626-L1716 HydrophobicContact CE2-CD1 4.23Å; F1626-L1716 HydrophobicContact CE2-CD2 4.27Å; F1626-L1716 HydrophobicContact CZ-CD1 4.15Å; F1626-L1716 HydrophobicContact CZ-CD2 4.36Å; F1626-L1716 HydrophobicContact CZ-CG 4.46Å; I1710-L1716 HydrophobicContact CB-CD1 4.42Å; I1710-L1716 HydrophobicContact CB-CD2 4.06Å; I1710-L1716 HydrophobicContact CD1-CD1 4.03Å; I1710-L1716 HydrophobicContact CG2-CD1 4.08Å; I1710-L1716 HydrophobicContact CG2-CD2 3.91Å; I1710-L1716 HydrophobicContact CG2-CG 4.4Å; S1713-L1716 PolarHBondContact O-N 3.05Å; S1713-L1716 VanDerWaalsContact O-N 3.13Å; S1713-L1716 PolarHBondContact OG-N 3.2Å; S1713-L1716 VanDerWaalsContact OG-N 3.11Å; L1716-F1719 WeakPolarHBondContact O-CB 3.39Å; L1716-F1719 PolarHBondContact O-N 3.01Å; L1716-L1720 HydrophobicContact CD1-CD1 4.41Å; L1716-L1720 HydrophobicContact CD1-CG 4.34Å; L1716-L1720 HydrophobicContact CG-CD1 4.24Å; L1716-L1720 HydrophobicContact CG-CG 4.5Å; L1716-L1720 VanDerWaalsContact O-CG 3.29Å; L1716-L1720 WeakPolarHBondContact O-CG 3.3Å; L1716-L1720 PolarHBondContact O-N 3.23Å
1717	R	86.7	Confident	87.8	Confident	13.2 Å²	13.2	39.6 Å²	39.6	5%	0.05	21%	0.211	C	C	.	.	H	α-helix	trans	-62.7	-46.7	177.8	-159.8	173.7	-177.5	-84.3	-12.1	111.5	E1608 L1611 W1612 E1618 S1713 A1714 E1715 F1719 L1720 A1721 L1788 Y1789	E1608-R1717 VanDerWaalsContact CB-NH1 3.34Å; E1608-R1717 PolarHBondContact O-NH1 3.38Å; E1608-R1717 IonicContact OE1-CZ 3.17Å; E1608-R1717 IonicContact OE1-NH1 3.21Å; E1608-R1717 IonicContact OE1-NH2 2.95Å; E1608-R1717 PolarHBondContact OE1-NH2 3.07Å; E1608-R1717 IonicContact OE2-CZ 2.69Å; E1608-R1717 IonicContact OE2-NH1 2.95Å; E1608-R1717 PolarHBondContact OE2-NH1 3.1Å; E1608-R1717 IonicContact OE2-NH2 2.87Å; L1611-R1717 VanDerWaalsContact CD1-CZ 3.47Å; L1611-R1717 VanDerWaalsContact CD1-NH2 3.31Å; W1612-R1717 HydrophobicContact CB-CB 4.46Å; W1612-R1717 HydrophobicContact CD2-CB 3.87Å; W1612-R1717 HydrophobicContact CD2-CG 4.01Å; W1612-R1717 HydrophobicContact CE3-CB 3.56Å; W1612-R1717 HydrophobicContact CE3-CG 4.08Å; W1612-R1717 HydrophobicContact CG-CB 4.33Å; W1612-R1717 HydrophobicContact CG-CG 4.41Å; W1612-R1717 HydrophobicContact CH2-CG 4.39Å; W1612-R1717 HydrophobicContact CZ2-CG 4.38Å; W1612-R1717 HydrophobicContact CZ3-CB 3.98Å; W1612-R1717 HydrophobicContact CZ3-CG 4.33Å; E1618-R1717 IonicContact OE1-NE 3.48Å; E1618-R1717 PolarHBondContact OE1-NE 2.99Å; E1618-R1717 IonicContact OE1-NH2 3.22Å; S1713-R1717 PolarHBondContact O-N 3.01Å; S1713-R1717 VanDerWaalsContact O-N 3.12Å; A1714-R1717 PolarHBondContact O-N 3.19Å; E1715-R1717 VanDerWaalsContact C-N 3.31Å; E1715-R1717 PolarHBondContact O-N 3.25Å; R1717-F1719 VanDerWaalsContact C-N 3.34Å; R1717-F1719 PolarHBondContact O-N 2.98Å; R1717-L1720 PolarHBondContact O-N 3.05Å; R1717-A1721 WeakPolarHBondContact O-CB 3.31Å; R1717-A1721 PolarHBondContact O-N 3Å; R1717-L1788 HydrophobicContact CG-CD1 4.23Å; R1717-L1788 HydrophobicContact CG-CD2 4.31Å; R1717-Y1789 PolarHBondContact NH1-OH 3.36Å; R1717-Y1789 PolarHBondContact NH2-OH 3.27Å
1718	N	84.2	Confident	88.1	Confident	79.2 Å²	79.2	37.4 Å²	37.4	42%	0.424	20%	0.201	S	C	.	.	H	α-helix	trans	-62.8	-42.5	176.2	-69.9	-13.9	0	0	0	111.6	A1714 E1715 L1720 A1721 E1722	A1714-N1718 WeakPolarHBondContact O-CB 3.37Å; A1714-N1718 VanDerWaalsContact O-CG 3.28Å; A1714-N1718 PolarHBondContact O-N 3.08Å; A1714-N1718 PolarHBondContact O-ND2 2.96Å; E1715-N1718 PolarHBondContact O-N 3.1Å; N1718-L1720 PolarHBondContact O-N 3.1Å; N1718-A1721 PolarHBondContact O-N 3.17Å; N1718-E1722 PolarHBondContact O-N 3.21Å; N1718-E1722 VanDerWaalsContact O-N 3.09Å
1719	F	86.9	Confident	88.2	Confident	60 Å²	60	37.1 Å²	37.1	26%	0.263	20%	0.2	S	C	.	.	H	α-helix	trans	-57.7	-48.9	174.5	174.4	-96.5	0	0	0	111.3	P1673 E1715 L1716 R1717 A1721 E1722 S1723 L1725 L1784	P1673-F1719 VanDerWaalsContact CD-CZ 3.47Å; P1673-F1719 HydrophobicContact CG-CD1 3.58Å; P1673-F1719 VanDerWaalsContact CG-CD1 3.48Å; P1673-F1719 HydrophobicContact CG-CD2 3.86Å; P1673-F1719 HydrophobicContact CG-CE1 3.19Å; P1673-F1719 HydrophobicContact CG-CE2 3.51Å; P1673-F1719 VanDerWaalsContact CG-CE2 3.45Å; P1673-F1719 HydrophobicContact CG-CG 3.91Å; P1673-F1719 HydrophobicContact CG-CZ 3.17Å; E1715-F1719 WeakPolarHBondContact O-CB 3.22Å; E1715-F1719 PolarHBondContact O-N 3.19Å; L1716-F1719 WeakPolarHBondContact O-CB 3.39Å; L1716-F1719 PolarHBondContact O-N 3.01Å; R1717-F1719 VanDerWaalsContact C-N 3.34Å; R1717-F1719 PolarHBondContact O-N 2.98Å; F1719-A1721 VanDerWaalsContact C-N 3.32Å; F1719-A1721 PolarHBondContact O-N 3.01Å; F1719-E1722 PolarHBondContact O-N 2.98Å; F1719-S1723 WeakPolarHBondContact CD2-OG 3.27Å; F1719-S1723 WeakPolarHBondContact CE1-OG 3.39Å; F1719-S1723 VanDerWaalsContact CE2-CB 3.43Å; F1719-S1723 VanDerWaalsContact CE2-OG 3.27Å; F1719-S1723 WeakPolarHBondContact CE2-OG 3.37Å; F1719-S1723 VanDerWaalsContact CZ-OG 3.22Å; F1719-S1723 WeakPolarHBondContact CZ-OG 3.33Å; F1719-S1723 WeakPolarHBondContact O-CA 3.48Å; F1719-S1723 WeakPolarHBondContact O-CB 3.25Å; F1719-S1723 PolarHBondContact O-N 3.08Å; F1719-S1723 PolarHBondContact O-OG 3.14Å; F1719-L1725 HydrophobicContact CZ-CD2 4.44Å; F1719-L1784 HydrophobicContact CD1-CD1 4.2Å; F1719-L1784 HydrophobicContact CE1-CD1 3.36Å; F1719-L1784 VanDerWaalsContact CE1-CD1 3.41Å; F1719-L1784 HydrophobicContact CZ-CD1 3.88Å
1720	L	87.8	Confident	88.3	Confident	0.4 Å²	0.4	38.4 Å²	38.4	0%	0.002	20%	0.201	C	C	.	.	H	α-helix	trans	-63.6	-35.8	178.5	-68.2	172	0	0	0	112.6	W1612 F1626 L1716 R1717 N1718 L1784 Y1785 L1787 L1788 M1857	W1612-L1720 HydrophobicContact CH2-CD1 3.82Å; W1612-L1720 HydrophobicContact CZ3-CD1 3.96Å; F1626-L1720 HydrophobicContact CE1-CD1 4.39Å; F1626-L1720 HydrophobicContact CE1-CD2 3.79Å; F1626-L1720 HydrophobicContact CZ-CD1 4.1Å; F1626-L1720 HydrophobicContact CZ-CD2 4.02Å; F1626-L1720 HydrophobicContact CZ-CG 4.5Å; L1716-L1720 HydrophobicContact CD1-CD1 4.41Å; L1716-L1720 HydrophobicContact CD1-CG 4.34Å; L1716-L1720 HydrophobicContact CG-CD1 4.24Å; L1716-L1720 HydrophobicContact CG-CG 4.5Å; L1716-L1720 VanDerWaalsContact O-CG 3.29Å; L1716-L1720 WeakPolarHBondContact O-CG 3.3Å; L1716-L1720 PolarHBondContact O-N 3.23Å; R1717-L1720 PolarHBondContact O-N 3.05Å; N1718-L1720 PolarHBondContact O-N 3.1Å; L1720-L1784 HydrophobicContact CD2-CB 4.03Å; L1720-L1784 HydrophobicContact CD2-CD1 4.04Å; L1720-L1784 CarbonylContact O-C 3.54Å; L1720-L1784 WeakPolarHBondContact O-CB 3.11Å; L1720-Y1785 VanDerWaalsContact O-CA 3.24Å; L1720-Y1785 WeakPolarHBondContact O-CA 3.43Å; L1720-Y1785 PolarHBondContact O-N 3.02Å; L1720-L1787 HydrophobicContact CD2-CD1 4.21Å; L1720-L1788 HydrophobicContact CB-CD1 3.78Å; L1720-L1788 HydrophobicContact CB-CD2 4.18Å; L1720-L1788 HydrophobicContact CB-CG 3.82Å; L1720-L1788 HydrophobicContact CD1-CD2 3.76Å; L1720-L1788 HydrophobicContact CD1-CG 4.25Å; L1720-L1788 HydrophobicContact CG-CD2 4.5Å; L1720-M1857 HydrophobicContact CD1-SD 3.93Å
1721	A	83.2	Confident	88.2	Confident	14.4 Å²	14.4	38 Å²	38	12%	0.119	20%	0.199	C	C	.	.	H	α-helix	trans	-70.8	-38.8	-179.7	0	0	0	0	0	113.4	R1717 N1718 F1719 L1788	R1717-A1721 WeakPolarHBondContact O-CB 3.31Å; R1717-A1721 PolarHBondContact O-N 3Å; N1718-A1721 PolarHBondContact O-N 3.17Å; F1719-A1721 VanDerWaalsContact C-N 3.32Å; F1719-A1721 PolarHBondContact O-N 3.01Å; A1721-L1788 HydrophobicContact CB-CD1 4Å
1722	E	81.3	Confident	88	Confident	70 Å²	70	36 Å²	36	33%	0.327	18%	0.184	S	C	.	.	H	α-helix	trans	-105.3	-25.6	-170.2	-59.3	-150.9	163.2	0	0	114.3	S1497 S1498 H1499 R1505 N1718 F1719	S1497-E1722 VanDerWaalsContact CB-OE2 3.25Å; S1497-E1722 WeakPolarHBondContact CB-OE2 3.13Å; S1497-E1722 PolarHBondContact OG-OE1 3Å; S1497-E1722 PolarHBondContact OG-OE2 3.23Å; S1498-E1722 WeakPolarHBondContact CA-OE1 3.27Å; S1498-E1722 VanDerWaalsContact CB-OE1 3.29Å; S1498-E1722 WeakPolarHBondContact CB-OE1 3.45Å; S1498-E1722 PolarHBondContact N-OE1 3.23Å; S1498-E1722 VanDerWaalsContact N-OE1 3.1Å; S1498-E1722 PolarHBondContact OG-OE1 3.14Å; H1499-E1722 IonicContact CD2-OE1 3.41Å; H1499-E1722 PolarHBondContact CD2-OE1 2.99Å; H1499-E1722 VanDerWaalsContact CD2-OE1 3.31Å; H1499-E1722 IonicContact CD2-OE2 2.94Å; H1499-E1722 PolarHBondContact CD2-OE2 3.42Å; H1499-E1722 IonicContact CG-OE1 2.69Å; H1499-E1722 PolarHBondContact N-OE1 2.88Å; H1499-E1722 VanDerWaalsContact N-OE1 3.13Å; H1499-E1722 IonicContact NE2-OE1 3.65Å; R1505-E1722 PolarHBondContact NH2-O 2.9Å; N1718-E1722 PolarHBondContact O-N 3.21Å; N1718-E1722 VanDerWaalsContact O-N 3.09Å; F1719-E1722 PolarHBondContact O-N 2.98Å
1723	S	84.4	Confident	87.4	Confident	24.2 Å²	24.2	36.4 Å²	36.4	17%	0.169	19%	0.185	C	C	.	.			trans	-86.8	162.1	-170.8	62.4	0	0	0	0	114.6	F1719 L1784	F1719-S1723 WeakPolarHBondContact CD2-OG 3.27Å; F1719-S1723 WeakPolarHBondContact CE1-OG 3.39Å; F1719-S1723 VanDerWaalsContact CE2-CB 3.43Å; F1719-S1723 VanDerWaalsContact CE2-OG 3.27Å; F1719-S1723 WeakPolarHBondContact CE2-OG 3.37Å; F1719-S1723 VanDerWaalsContact CZ-OG 3.22Å; F1719-S1723 WeakPolarHBondContact CZ-OG 3.33Å; F1719-S1723 WeakPolarHBondContact O-CA 3.48Å; F1719-S1723 WeakPolarHBondContact O-CB 3.25Å; F1719-S1723 PolarHBondContact O-N 3.08Å; F1719-S1723 PolarHBondContact O-OG 3.14Å; S1723-L1784 PolarHBondContact O-N 3.08Å; S1723-L1784 WeakPolarHBondContact OG-CD1 3.33Å
1724	T	87.5	Confident	86.6	Confident	38.4 Å²	38.4	36.6 Å²	36.6	24%	0.236	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	139.6	167.8	39.4	0	0	0	0	108.9	R1505 I1782 P1783	R1505-T1724 VanDerWaalsContact NH2-CG2 3.31Å; R1505-T1724 PolarHBondContact NH2-OG1 2.67Å; T1724-I1782 CarbonylContact C-O 3.48Å; T1724-I1782 VanDerWaalsContact CA-O 3.27Å; T1724-I1782 WeakPolarHBondContact CA-O 3.37Å; T1724-P1783 HydrophobicContact CG2-CB 4.14Å; T1724-P1783 HydrophobicContact CG2-CG 4.16Å
1725	L	89.5	Confident	85.6	Confident	3 Å²	3	37.3 Å²	37.3	2%	0.016	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	129.6	167.6	-101.1	156.7	0	0	0	109.7	I1628 F1670 Q1671 F1672 F1719 F1727 T1781 I1782 L1784 I1855	I1628-L1725 HydrophobicContact CD1-CD1 4.01Å; I1628-L1725 HydrophobicContact CD1-CD2 3.79Å; F1670-L1725 HydrophobicContact CB-CD2 3.88Å; F1670-L1725 HydrophobicContact CD2-CD1 4.39Å; F1670-L1725 HydrophobicContact CD2-CD2 3.88Å; F1670-L1725 HydrophobicContact CG-CD2 4.14Å; Q1671-L1725 WeakPolarHBondContact O-CD1 3.33Å; Q1671-L1725 WeakPolarHBondContact O-CD2 3.32Å; F1672-L1725 HydrophobicContact CD2-CD1 3.92Å; F1672-L1725 VanDerWaalsContact CD2-CD1 3.44Å; F1672-L1725 HydrophobicContact CD2-CD2 3.84Å; F1672-L1725 HydrophobicContact CD2-CG 4.46Å; F1672-L1725 HydrophobicContact CE2-CD1 3.87Å; F1672-L1725 HydrophobicContact CE2-CD2 4.25Å; F1719-L1725 HydrophobicContact CZ-CD2 4.44Å; L1725-F1727 HydrophobicContact CB-CD2 4.25Å; L1725-F1727 HydrophobicContact CB-CE2 3.85Å; L1725-F1727 HydrophobicContact CB-CZ 4.31Å; L1725-F1727 HydrophobicContact CD1-CE2 4.08Å; L1725-F1727 HydrophobicContact CD1-CZ 4.07Å; L1725-F1727 HydrophobicContact CD2-CD1 4.46Å; L1725-F1727 HydrophobicContact CD2-CD2 4.16Å; L1725-F1727 HydrophobicContact CD2-CE1 4.2Å; L1725-F1727 HydrophobicContact CD2-CE2 3.31Å; L1725-F1727 HydrophobicContact CD2-CG 4.42Å; L1725-F1727 HydrophobicContact CD2-CZ 3.35Å; L1725-F1727 HydrophobicContact CG-CD2 4.24Å; L1725-F1727 HydrophobicContact CG-CE2 4.19Å; L1725-F1727 HydrophobicContact CG-CZ 3.95Å; L1725-T1781 WeakPolarHBondContact O-CA 3.39Å; L1725-I1782 PolarHBondContact N-O 3.06Å; L1725-I1782 PolarHBondContact O-N 2.96Å; L1725-L1784 HydrophobicContact CB-CD1 4.42Å; L1725-L1784 HydrophobicContact CB-CD2 4.06Å; L1725-L1784 HydrophobicContact CB-CG 4.36Å; L1725-L1784 HydrophobicContact CD1-CD1 4.36Å; L1725-L1784 HydrophobicContact CD1-CD2 3.91Å; L1725-L1784 HydrophobicContact CD2-CD1 4.28Å; L1725-L1784 HydrophobicContact CG-CD1 3.96Å; L1725-L1784 HydrophobicContact CG-CD2 3.89Å; L1725-L1784 HydrophobicContact CG-CG 4.16Å; L1725-I1855 HydrophobicContact CD1-CD1 3.86Å; L1725-I1855 HydrophobicContact CD2-CD1 4.15Å
1726	E	91.6	Very high	84.2	Confident	90.2 Å²	90.2	33.9 Å²	33.9	42%	0.421	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	116.7	176.1	-59.1	-163.7	165	0	0	110.2	F1670 T1779 A1780 T1781	F1670-E1726 VanDerWaalsContact CA-O 3.32Å; F1670-E1726 WeakPolarHBondContact CA-O 3.24Å; F1670-E1726 VanDerWaalsContact CB-O 3.27Å; F1670-E1726 WeakPolarHBondContact CB-O 3.26Å; E1726-T1779 HydrophobicContact CB-CG2 3.9Å; E1726-T1779 HydrophobicContact CG-CG2 4.24Å; E1726-A1780 WeakPolarHBondContact CA-O 3.4Å; E1726-T1781 HydrophobicContact CG-CG2 4.21Å
1727	F	93	Very high	82.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	106.9	173.4	-68.5	-90.9	0	0	0	109	I1628 L1630 V1668 F1670 L1725 T1779 A1780 I1782 I1851 V1853 I1855	I1628-F1727 HydrophobicContact CD1-CZ 4.35Å; I1628-F1727 HydrophobicContact CG2-CE1 3.88Å; I1628-F1727 HydrophobicContact CG2-CZ 3.8Å; L1630-F1727 HydrophobicContact CD2-CD1 4.06Å; L1630-F1727 HydrophobicContact CD2-CE1 3.94Å; V1668-F1727 HydrophobicContact CG1-CB 4.14Å; V1668-F1727 HydrophobicContact CG1-CD1 3.87Å; V1668-F1727 HydrophobicContact CG1-CG 4.48Å; F1670-F1727 HydrophobicContact CB-CD1 3.81Å; F1670-F1727 HydrophobicContact CB-CE1 3.96Å; F1670-F1727 HydrophobicContact CB-CG 4.33Å; F1670-F1727 AromaticContact CD1-CD1 3.87Å; F1670-F1727 HydrophobicContact CD1-CD1 3.87Å; F1670-F1727 AromaticContact CD1-CE1 3.64Å; F1670-F1727 HydrophobicContact CD1-CE1 3.64Å; F1670-F1727 HydrophobicContact CD2-CE1 4.26Å; F1670-F1727 HydrophobicContact CD2-CZ 4.46Å; F1670-F1727 HydrophobicContact CE1-CE1 4.13Å; F1670-F1727 AromaticContact CG-CD1 3.96Å; F1670-F1727 HydrophobicContact CG-CD1 3.98Å; F1670-F1727 AromaticContact CG-CE1 3.7Å; F1670-F1727 HydrophobicContact CG-CE1 3.7Å; F1670-F1727 HydrophobicContact CG-CZ 4.38Å; F1670-F1727 HydrophobicContact CZ-CE1 4.49Å; L1725-F1727 HydrophobicContact CB-CD2 4.25Å; L1725-F1727 HydrophobicContact CB-CE2 3.85Å; L1725-F1727 HydrophobicContact CB-CZ 4.31Å; L1725-F1727 HydrophobicContact CD1-CE2 4.08Å; L1725-F1727 HydrophobicContact CD1-CZ 4.07Å; L1725-F1727 HydrophobicContact CD2-CD1 4.46Å; L1725-F1727 HydrophobicContact CD2-CD2 4.16Å; L1725-F1727 HydrophobicContact CD2-CE1 4.2Å; L1725-F1727 HydrophobicContact CD2-CE2 3.31Å; L1725-F1727 HydrophobicContact CD2-CG 4.42Å; L1725-F1727 HydrophobicContact CD2-CZ 3.35Å; L1725-F1727 HydrophobicContact CG-CD2 4.24Å; L1725-F1727 HydrophobicContact CG-CE2 4.19Å; L1725-F1727 HydrophobicContact CG-CZ 3.95Å; F1727-T1779 CarbonylContact O-C 3.54Å; F1727-T1779 VanDerWaalsContact O-CA 3.27Å; F1727-T1779 WeakPolarHBondContact O-CA 3.22Å; F1727-A1780 HydrophobicContact CB-CB 4.48Å; F1727-A1780 PolarHBondContact N-O 3.12Å; F1727-A1780 PolarHBondContact O-N 3.13Å; F1727-I1782 HydrophobicContact CD2-CD1 3.78Å; F1727-I1782 HydrophobicContact CD2-CG1 4.13Å; F1727-I1782 HydrophobicContact CE2-CD1 3.63Å; F1727-I1782 HydrophobicContact CE2-CG1 4.2Å; F1727-I1851 HydrophobicContact CB-CD1 4.46Å; F1727-V1853 HydrophobicContact CD1-CG2 4.47Å; F1727-V1853 HydrophobicContact CD2-CG2 4.46Å; F1727-V1853 HydrophobicContact CE1-CG1 4.15Å; F1727-V1853 HydrophobicContact CE2-CG1 4.1Å; F1727-V1853 HydrophobicContact CE2-CG2 4.49Å; F1727-V1853 HydrophobicContact CG-CG2 4.41Å; F1727-V1853 HydrophobicContact CZ-CG1 3.77Å; F1727-V1853 HydrophobicContact CZ-CG2 4.5Å; F1727-I1855 HydrophobicContact CE2-CD1 4.27Å; F1727-I1855 HydrophobicContact CZ-CD1 4.31Å
1728	Q	93.4	Very high	80.6	Confident	45.2 Å²	45.2	42.2 Å²	42.2	21%	0.211	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.5	178.5	-59.8	177.8	-4.7	0	0	109.8	V1668 R1669 W1730 T1779	V1668-Q1728 CarbonylContact C-O 3.54Å; V1668-Q1728 WeakPolarHBondContact CA-O 3.35Å; R1669-Q1728 HydrophobicContact CB-CB 4.43Å; R1669-Q1728 PolarHBondContact N-O 3.17Å; R1669-Q1728 PolarHBondContact O-N 2.98Å; Q1728-W1730 VanDerWaalsContact OE1-NE1 3.11Å; Q1728-T1779 HydrophobicContact CG-CG2 4.07Å
1729	V	92.1	Very high	78.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	126.8	175	-171	0	0	0	0	109.4	L1635 T1666 V1668 H1776 I1777 G1778 L1838 I1851	L1635-V1729 HydrophobicContact CD1-CG1 4.1Å; L1635-V1729 HydrophobicContact CD2-CB 4.5Å; L1635-V1729 HydrophobicContact CD2-CG1 4.02Å; T1666-V1729 HydrophobicContact CG2-CG1 3.52Å; T1666-V1729 VanDerWaalsContact CG2-CG1 3.44Å; V1668-V1729 HydrophobicContact CG2-CG2 4.4Å; V1729-H1776 PolarHBondContact O-CD2 3.08Å; V1729-H1776 VanDerWaalsContact O-CD2 3.29Å; V1729-I1777 HydrophobicContact CB-CB 4.46Å; V1729-I1777 HydrophobicContact CB-CD1 4.41Å; V1729-I1777 HydrophobicContact CG1-CB 4.47Å; V1729-I1777 HydrophobicContact CG1-CD1 3.95Å; V1729-I1777 HydrophobicContact CG1-CG1 4.47Å; V1729-I1777 PolarHBondContact O-N 2.97Å; V1729-G1778 PolarHBondContact N-O 3.02Å; V1729-L1838 HydrophobicContact CB-CD1 4.33Å; V1729-L1838 HydrophobicContact CB-CD2 4.48Å; V1729-L1838 HydrophobicContact CG2-CD1 3.86Å; V1729-L1838 HydrophobicContact CG2-CD2 3.69Å; V1729-L1838 HydrophobicContact CG2-CG 4.44Å; V1729-I1851 HydrophobicContact CG2-CD1 4.25Å
1730	W	90.5	Very high	76.7	Confident	57.2 Å²	57.2	49.4 Å²	49.4	22%	0.217	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	146.6	-174.4	-74.1	85	0	0	0	111.2	T1666 F1667 Q1728 P1774 R1775 H1776	T1666-W1730 CarbonylContact C-O 3.51Å; T1666-W1730 VanDerWaalsContact CA-O 3.27Å; T1666-W1730 WeakPolarHBondContact CA-O 3.38Å; T1666-W1730 WeakPolarHBondContact CG2-O 3.3Å; F1667-W1730 HydrophobicContact CD1-CB 3.92Å; F1667-W1730 HydrophobicContact CD2-CB 4.44Å; F1667-W1730 HydrophobicContact CE1-CB 3.36Å; F1667-W1730 VanDerWaalsContact CE1-CB 3.49Å; F1667-W1730 HydrophobicContact CE1-CG 4.27Å; F1667-W1730 HydrophobicContact CE2-CB 4.09Å; F1667-W1730 HydrophobicContact CE2-CG 4.3Å; F1667-W1730 HydrophobicContact CG-CB 4.43Å; F1667-W1730 HydrophobicContact CZ-CB 3.47Å; F1667-W1730 VanDerWaalsContact CZ-CB 3.41Å; F1667-W1730 HydrophobicContact CZ-CD2 4.45Å; F1667-W1730 AromaticContact CZ-CG 3.84Å; F1667-W1730 HydrophobicContact CZ-CG 3.9Å; F1667-W1730 PolarHBondContact N-O 3.11Å; F1667-W1730 PolarHBondContact O-N 2.99Å; Q1728-W1730 VanDerWaalsContact OE1-NE1 3.11Å; W1730-P1774 HydrophobicContact CE3-CB 4.31Å; W1730-P1774 HydrophobicContact CZ3-CB 4.41Å; W1730-R1775 CarbonylContact C-O 3.53Å; W1730-R1775 WeakPolarHBondContact CA-O 3.29Å; W1730-R1775 VanDerWaalsContact CE3-C 3.45Å; W1730-H1776 AromaticContact CD1-CD2 3.98Å; W1730-H1776 HydrophobicContact CD2-CB 4.03Å; W1730-H1776 AromaticContact CE2-CD2 3.86Å; W1730-H1776 HydrophobicContact CE3-CB 3.96Å; W1730-H1776 HydrophobicContact CH2-CB 3.81Å; W1730-H1776 HydrophobicContact CZ2-CB 3.87Å; W1730-H1776 HydrophobicContact CZ3-CB 3.86Å; W1730-H1776 AromaticContact NE1-CD2 3.78Å
1731	I	87.1	Confident	74.5	Confident	0.2 Å²	0.2	55.7 Å²	55.7	0%	0.001	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.6	171.3	-101	173.2	0	0	0	110	L1641 A1664 Y1665 T1666 L1685 W1733 P1774 R1775 I1777	L1641-I1731 HydrophobicContact CD1-CD1 3.39Å; L1641-I1731 VanDerWaalsContact CD1-CD1 3.44Å; L1641-I1731 HydrophobicContact CD1-CG2 4.49Å; L1641-I1731 HydrophobicContact CD2-CD1 4.17Å; L1641-I1731 HydrophobicContact CG-CD1 4.32Å; A1664-I1731 HydrophobicContact CB-CD1 3.83Å; A1664-I1731 HydrophobicContact CB-CG1 4.13Å; A1664-I1731 HydrophobicContact CB-CG2 4.02Å; Y1665-I1731 CarbonylContact O-C 3.52Å; Y1665-I1731 VanDerWaalsContact O-CA 3.27Å; Y1665-I1731 WeakPolarHBondContact O-CA 3.27Å; T1666-I1731 HydrophobicContact CG2-CG1 4.49Å; L1685-I1731 HydrophobicContact CD1-CD1 3.74Å; L1685-I1731 HydrophobicContact CD1-CG1 4.02Å; L1685-I1731 HydrophobicContact CD1-CG2 4.18Å; L1685-I1731 HydrophobicContact CD2-CD1 3.94Å; I1731-W1733 HydrophobicContact CB-CH2 4.41Å; I1731-W1733 HydrophobicContact CD1-CH2 4.26Å; I1731-W1733 HydrophobicContact CD1-CZ2 4.01Å; I1731-W1733 HydrophobicContact CG1-CH2 4.24Å; I1731-W1733 HydrophobicContact CG1-CZ2 4.33Å; I1731-W1733 HydrophobicContact CG2-CD2 4.24Å; I1731-W1733 HydrophobicContact CG2-CE3 4.17Å; I1731-W1733 HydrophobicContact CG2-CH2 3.68Å; I1731-W1733 HydrophobicContact CG2-CZ2 4.05Å; I1731-W1733 HydrophobicContact CG2-CZ3 3.98Å; I1731-P1774 CarbonylContact O-C 3.51Å; I1731-P1774 VanDerWaalsContact O-CA 3.26Å; I1731-P1774 WeakPolarHBondContact O-CA 3.37Å; I1731-R1775 HydrophobicContact CG2-CB 3.8Å; I1731-R1775 WeakPolarHBondContact CG2-O 3.37Å; I1731-R1775 PolarHBondContact N-O 3.18Å; I1731-R1775 PolarHBondContact O-N 3.09Å; I1731-I1777 HydrophobicContact CB-CD1 4.09Å; I1731-I1777 HydrophobicContact CB-CG1 4.39Å; I1731-I1777 HydrophobicContact CD1-CD1 3.5Å; I1731-I1777 VanDerWaalsContact CD1-CD1 3.46Å; I1731-I1777 HydrophobicContact CD1-CG1 3.78Å; I1731-I1777 HydrophobicContact CG1-CD1 3.53Å; I1731-I1777 HydrophobicContact CG1-CG1 3.81Å; I1731-I1777 HydrophobicContact CG2-CD1 4.29Å; I1731-I1777 HydrophobicContact CG2-CG1 4.13Å
1732	I	84.7	Confident	72.5	Confident	28.4 Å²	28.4	62 Å²	62	15%	0.146	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	149.9	169.5	21.1	170	0	0	0	109.2	A1664 Y1665 F1667 L1682 P1774 L2146	A1664-I1732 CarbonylContact C-O 3.52Å; A1664-I1732 WeakPolarHBondContact CA-O 3.31Å; Y1665-I1732 PolarHBondContact N-O 2.93Å; Y1665-I1732 PolarHBondContact O-N 3.12Å; F1667-I1732 HydrophobicContact CD1-CD1 3.89Å; F1667-I1732 HydrophobicContact CD1-CG1 4.36Å; F1667-I1732 HydrophobicContact CE1-CD1 3.4Å; F1667-I1732 VanDerWaalsContact CE1-CD1 3.47Å; F1667-I1732 HydrophobicContact CE1-CG1 3.8Å; F1667-I1732 HydrophobicContact CE1-CG2 3.94Å; F1667-I1732 HydrophobicContact CZ-CD1 4.3Å; L1682-I1732 HydrophobicContact CD1-CD1 3.98Å; L1682-I1732 HydrophobicContact CD2-CD1 3.8Å; L1682-I1732 VanDerWaalsContact CD2-CD1 3.5Å; L1682-I1732 HydrophobicContact CD2-CG1 3.98Å; L1682-I1732 HydrophobicContact CG-CD1 4.33Å; I1732-P1774 HydrophobicContact CG1-CB 4.09Å; I1732-P1774 HydrophobicContact CG1-CG 4.26Å; I1732-P1774 HydrophobicContact CG2-CB 3.92Å; I1732-P1774 HydrophobicContact CG2-CG 3.96Å; I1732-L2146 HydrophobicContact CD1-CD1 4.41Å
1733	W	78.7	Confident	70.8	Confident	17 Å²	17	66.5 Å²	66.5	6%	0.064	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	146.7	179.2	-58.1	94	0	0	0	110.1	I1638 L1641 L1642 F1662 K1663 A1664 I1731 V1771 P1772 A1773 R1775	I1638-W1733 HydrophobicContact CG2-CH2 4.23Å; I1638-W1733 HydrophobicContact CG2-CZ3 3.9Å; L1641-W1733 HydrophobicContact CB-CH2 4.11Å; L1641-W1733 HydrophobicContact CB-CZ2 4.35Å; L1642-W1733 HydrophobicContact CD1-CZ3 4.28Å; L1642-W1733 HydrophobicContact CD2-CE3 4.3Å; L1642-W1733 HydrophobicContact CD2-CH2 3.68Å; L1642-W1733 HydrophobicContact CD2-CZ2 4.24Å; L1642-W1733 HydrophobicContact CD2-CZ3 3.88Å; L1642-W1733 HydrophobicContact CG-CH2 3.89Å; L1642-W1733 HydrophobicContact CG-CZ3 4.17Å; F1662-W1733 HydrophobicContact CB-CB 4.43Å; F1662-W1733 HydrophobicContact CB-CE3 4.26Å; K1663-W1733 CarbonylContact O-C 3.5Å; K1663-W1733 WeakPolarHBondContact O-CA 3.23Å; A1664-W1733 HydrophobicContact CB-CD2 4.41Å; A1664-W1733 HydrophobicContact CB-CE3 3.78Å; A1664-W1733 HydrophobicContact CB-CG 4.47Å; A1664-W1733 HydrophobicContact CB-CH2 4.37Å; A1664-W1733 HydrophobicContact CB-CZ3 3.73Å; I1731-W1733 HydrophobicContact CB-CH2 4.41Å; I1731-W1733 HydrophobicContact CD1-CH2 4.26Å; I1731-W1733 HydrophobicContact CD1-CZ2 4.01Å; I1731-W1733 HydrophobicContact CG1-CH2 4.24Å; I1731-W1733 HydrophobicContact CG1-CZ2 4.33Å; I1731-W1733 HydrophobicContact CG2-CD2 4.24Å; I1731-W1733 HydrophobicContact CG2-CE3 4.17Å; I1731-W1733 HydrophobicContact CG2-CH2 3.68Å; I1731-W1733 HydrophobicContact CG2-CZ2 4.05Å; I1731-W1733 HydrophobicContact CG2-CZ3 3.98Å; W1733-V1771 VanDerWaalsContact C-CG1 3.45Å; W1733-V1771 HydrophobicContact CB-CG1 3.85Å; W1733-V1771 VanDerWaalsContact O-CG1 3.27Å; W1733-V1771 WeakPolarHBondContact O-CG1 3.27Å; W1733-P1772 HydrophobicContact CB-CB 4.39Å; W1733-P1772 HydrophobicContact CB-CG 4.36Å; W1733-P1772 VanDerWaalsContact CD1-O 3.27Å; W1733-P1772 HydrophobicContact CD2-CB 4.07Å; W1733-P1772 HydrophobicContact CD2-CG 4.28Å; W1733-P1772 HydrophobicContact CE3-CB 3.76Å; W1733-P1772 HydrophobicContact CG-CB 3.95Å; W1733-P1772 HydrophobicContact CG-CG 4.1Å; W1733-P1772 HydrophobicContact CZ3-CB 4.31Å; W1733-A1773 WeakPolarHBondContact CZ3-O 3.38Å; W1733-A1773 PolarHBondContact NE1-O 2.96Å; W1733-R1775 HydrophobicContact CH2-CB 3.66Å; W1733-R1775 VanDerWaalsContact CH2-CB 3.41Å; W1733-R1775 HydrophobicContact CH2-CG 4.33Å; W1733-R1775 HydrophobicContact CZ3-CB 3.74Å
1734	T	71.9	Confident	68.4	Low	37.6 Å²	37.6	69.6 Å²	69.6	23%	0.231	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	137.3	175.8	64	0	0	0	0	110.7	F1662 K1663 Y1665	F1662-T1734 CarbonylContact C-O 3.52Å; F1662-T1734 VanDerWaalsContact CA-O 3.29Å; F1662-T1734 WeakPolarHBondContact CA-O 3.38Å; K1663-T1734 VanDerWaalsContact CB-OG1 3.27Å; K1663-T1734 WeakPolarHBondContact CB-OG1 3.2Å; K1663-T1734 PolarHBondContact N-O 3.17Å; K1663-T1734 PolarHBondContact O-N 3.16Å; K1663-T1734 PolarHBondContact O-OG1 3.03Å; Y1665-T1734 HydrophobicContact CD2-CG2 4.07Å; Y1665-T1734 HydrophobicContact CE2-CG2 4.03Å; Y1665-T1734 WeakPolarHBondContact CE2-OG1 3.27Å
1735	D	67.7	Low	66	Low	39.8 Å²	39.8	74.5 Å²	74.5	21%	0.213	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.7	171.6	-172.7	-7.5	0	0	0	110.2	F1662 N1737 L1738 H1769 V1771	F1662-D1735 HydrophobicContact CD1-CB 4.11Å; F1662-D1735 HydrophobicContact CE1-CB 4.02Å; D1735-N1737 WeakPolarHBondContact OD1-CB 3.44Å; D1735-N1737 PolarHBondContact OD1-N 2.88Å; D1735-N1737 PolarHBondContact OD1-ND2 3.19Å; D1735-L1738 HydrophobicContact CB-CD1 4.2Å; D1735-H1769 IonicContact OD2-CD2 2.97Å; D1735-V1771 HydrophobicContact CB-CG2 4Å
1736	E	57.9	Low	63.5	Low	86 Å²	86	80.9 Å²	80.9	40%	0.402	41%	0.407	S	S	.	.	S	Bend	trans	-93.2	-21	174.9	-71.5	-153.9	147.6	0	0	113.6	N1661 K1663 L1738 K1739	N1661-E1736 PolarHBondContact O-N 2.9Å; K1663-E1736 HydrophobicContact CD-CG 4.11Å; K1663-E1736 WeakPolarHBondContact CD-OE1 3.27Å; K1663-E1736 WeakPolarHBondContact CD-OE2 3.42Å; K1663-E1736 VanDerWaalsContact CE-CD 3.44Å; K1663-E1736 VanDerWaalsContact CE-OE1 3.31Å; K1663-E1736 WeakPolarHBondContact CE-OE1 3.28Å; K1663-E1736 WeakPolarHBondContact CE-OE2 3.35Å; K1663-E1736 HydrophobicContact CG-CG 4.08Å; K1663-E1736 WeakPolarHBondContact CG-OE1 3.29Å; K1663-E1736 IonicContact NZ-OE1 3.08Å; K1663-E1736 PolarHBondContact NZ-OE1 3Å; K1663-E1736 IonicContact NZ-OE2 3.38Å; K1663-E1736 PolarHBondContact NZ-OE2 3.02Å; E1736-L1738 PolarHBondContact O-N 3.12Å; E1736-L1738 VanDerWaalsContact O-N 3.11Å; E1736-K1739 WeakPolarHBondContact O-CB 3.21Å; E1736-K1739 PolarHBondContact O-N 3.32Å; E1736-K1739 VanDerWaalsContact O-N 3.09Å; E1736-K1739 IonicContact OE1-NZ 3.15Å; E1736-K1739 PolarHBondContact OE1-NZ 3.36Å
1737	N	51.6	Low	60.9	Low	77.2 Å²	77.2	83.3 Å²	83.3	41%	0.413	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-74.7	-8.5	-170.8	-68.5	-27.6	0	0	0	113.3	N1661 D1735 K1739 E1740 L1741	N1661-N1737 PolarHBondContact OD1-ND2 3.14Å; D1735-N1737 WeakPolarHBondContact OD1-CB 3.44Å; D1735-N1737 PolarHBondContact OD1-N 2.88Å; D1735-N1737 PolarHBondContact OD1-ND2 3.19Å; N1737-K1739 PolarHBondContact O-N 3.08Å; N1737-K1739 VanDerWaalsContact O-N 3.13Å; N1737-E1740 PolarHBondContact O-N 3.29Å; N1737-E1740 VanDerWaalsContact O-N 3.13Å; N1737-L1741 PolarHBondContact O-N 2.68Å
1738	L	48	Very low	58.3	Low	117.6 Å²	117.6	93.8 Å²	93.8	62%	0.616	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-64.8	-11.3	172.6	-84.5	160.2	0	0	0	114.1	D1735 E1736	D1735-L1738 HydrophobicContact CB-CD1 4.2Å; E1736-L1738 PolarHBondContact O-N 3.12Å; E1736-L1738 VanDerWaalsContact O-N 3.11Å
1739	K	46.3	Very low	55.4	Low	136.6 Å²	136.6	99.7 Å²	99.7	59%	0.594	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-99.1	-19.6	-178.2	-69.6	-175.4	-178.1	175.1	0	115.6	E1736 N1737 K1924 N1926	E1736-K1739 WeakPolarHBondContact O-CB 3.21Å; E1736-K1739 PolarHBondContact O-N 3.32Å; E1736-K1739 VanDerWaalsContact O-N 3.09Å; E1736-K1739 IonicContact OE1-NZ 3.15Å; E1736-K1739 PolarHBondContact OE1-NZ 3.36Å; N1737-K1739 PolarHBondContact O-N 3.08Å; N1737-K1739 VanDerWaalsContact O-N 3.13Å; K1739-K1924 WeakPolarHBondContact CE-O 3.44Å; K1739-K1924 PolarHBondContact NZ-O 2.71Å; K1739-N1926 VanDerWaalsContact CE-N 3.34Å; K1739-N1926 VanDerWaalsContact CE-ND2 3.27Å; K1739-N1926 WeakPolarHBondContact CE-ND2 3.34Å; K1739-N1926 WeakPolarHBondContact CE-OD1 3.12Å; K1739-N1926 VanDerWaalsContact CG-ND2 3.26Å; K1739-N1926 WeakPolarHBondContact CG-ND2 3.31Å; K1739-N1926 VanDerWaalsContact NZ-N 3.11Å; K1739-N1926 PolarHBondContact NZ-OD1 3.02Å
1740	E	43.3	Very low	53	Low	154.2 Å²	154.2	104.7 Å²	104.7	72%	0.721	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-24.3	-176.5	-71.8	-165.3	148.7	0	0	113.7	N1737 D1742 K1743 S1744	N1737-E1740 PolarHBondContact O-N 3.29Å; N1737-E1740 VanDerWaalsContact O-N 3.13Å; E1740-D1742 VanDerWaalsContact C-N 3.29Å; E1740-D1742 PolarHBondContact O-N 3.32Å; E1740-K1743 PolarHBondContact O-N 3.02Å; E1740-S1744 PolarHBondContact O-N 3.08Å; E1740-S1744 PolarHBondContact O-OG 2.88Å; E1740-S1744 VanDerWaalsContact O-OG 3.06Å
1741	L	40.3	Very low	50.5	Low	133.2 Å²	133.2	104.8 Å²	104.8	70%	0.697	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-22.4	-177.4	-149.7	73.8	0	0	0	113.7	N1737 K1743	N1737-L1741 PolarHBondContact O-N 2.68Å; L1741-K1743 VanDerWaalsContact C-N 3.3Å; L1741-K1743 PolarHBondContact O-N 2.85Å
1742	D	42.2	Very low	48.2	Very low	145.4 Å²	145.4	111.6 Å²	111.6	78%	0.778	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-0.8	-179.7	-76.7	-13.6	0	0	0	114	E1740	E1740-D1742 VanDerWaalsContact C-N 3.29Å; E1740-D1742 PolarHBondContact O-N 3.32Å
1743	K	44.4	Very low	46.1	Very low	164.4 Å²	164.4	116.5 Å²	116.5	72%	0.715	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.7	-10.1	-176.8	-75.5	-175.2	-178.1	172.6	0	116	E1740 L1741 N1745	E1740-K1743 PolarHBondContact O-N 3.02Å; L1741-K1743 VanDerWaalsContact C-N 3.3Å; L1741-K1743 PolarHBondContact O-N 2.85Å; K1743-N1745 VanDerWaalsContact C-N 3.29Å; K1743-N1745 PolarHBondContact O-N 3.02Å
1744	S	35.3	Very low	44.2	Very low	90.4 Å²	90.4	121.6 Å²	121.6	63%	0.632	62%	0.622	S	S	*	*			trans	-85.8	58.7	176.3	55	0	0	0	0	112.1	E1740 N1746	E1740-S1744 PolarHBondContact O-N 3.08Å; E1740-S1744 PolarHBondContact O-OG 2.88Å; E1740-S1744 VanDerWaalsContact O-OG 3.06Å; S1744-N1746 VanDerWaalsContact C-N 3.28Å; S1744-N1746 PolarHBondContact O-N 2.89Å
1745	N	36.4	Very low	42.5	Very low	141.2 Å²	141.2	127.5 Å²	127.5	76%	0.755	65%	0.645	S	S	*	*			trans	-83.6	99	161.5	-92.3	-29.1	0	0	0	110.7	K1743 N1747	K1743-N1745 VanDerWaalsContact C-N 3.29Å; K1743-N1745 PolarHBondContact O-N 3.02Å; N1745-N1747 PolarHBondContact O-N 3.12Å
1746	N	36.7	Very low	41.3	Very low	136.2 Å²	136.2	130.7 Å²	130.7	73%	0.728	66%	0.661	S	S	*	*	S	Bend	trans	29.9	106.9	155.4	-67.1	-34.9	0	0	0	114.4	S1744	S1744-N1746 VanDerWaalsContact C-N 3.28Å; S1744-N1746 PolarHBondContact O-N 2.89Å
1747	N	36.9	Very low	40.7	Very low	141.8 Å²	141.8	131.2 Å²	131.2	76%	0.758	67%	0.665	S	S	*	*			trans	99.7	92.9	162	-58.5	-23.4	0	0	0	114	N1745 E1749	N1745-N1747 PolarHBondContact O-N 3.12Å; N1747-E1749 PolarHBondContact O-N 2.77Å
1748	Y	38.8	Very low	40.3	Very low	220 Å²	220	132.6 Å²	132.6	86%	0.863	67%	0.673	S	S	*	*			trans	-178.7	81.5	151.2	-70.5	-67.8	0	0	0	110.9	T1750	Y1748-T1750 VanDerWaalsContact C-N 3.32Å; Y1748-T1750 PolarHBondContact O-N 2.94Å
1749	E	32.8	Very low	40.1	Very low	170 Å²	170	135.1 Å²	135.1	79%	0.794	68%	0.681	S	S	*	*			trans	-77.8	99.1	164.2	-83.4	-176.8	142.5	0	0	109.4	N1747 G1751 K1754	N1747-E1749 PolarHBondContact O-N 2.77Å; E1749-G1751 PolarHBondContact O-N 3.27Å; E1749-K1754 IonicContact OE1-NZ 3.39Å; E1749-K1754 PolarHBondContact OE1-NZ 3.33Å; E1749-K1754 IonicContact OE2-NZ 3.03Å; E1749-K1754 PolarHBondContact OE2-NZ 2.96Å
1750	T	41.4	Very low	40.1	Very low	103.8 Å²	103.8	134.2 Å²	134.2	64%	0.637	68%	0.682	S	S	*	*			trans	-74	122.3	165	49.7	0	0	0	0	110.8	Y1748 L1752 Q1753	Y1748-T1750 VanDerWaalsContact C-N 3.32Å; Y1748-T1750 PolarHBondContact O-N 2.94Å; T1750-L1752 PolarHBondContact O-N 3.11Å; T1750-Q1753 PolarHBondContact O-N 3.08Å
1751	G	39.2	Very low	40	Very low	59.8 Å²	59.8	132.3 Å²	132.3	62%	0.616	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-4.4	-164.8	0	0	0	0	0	117.6	E1749 Q1753 K1754 F1755	E1749-G1751 PolarHBondContact O-N 3.27Å; G1751-Q1753 VanDerWaalsContact C-N 3.26Å; G1751-Q1753 PolarHBondContact O-N 3.41Å; G1751-K1754 PolarHBondContact O-N 3.09Å; G1751-F1755 PolarHBondContact O-N 2.74Å
1752	L	38.6	Very low	40	Very low	142.8 Å²	142.8	133.5 Å²	133.5	75%	0.748	68%	0.684	S	S	*	*	H	α-helix	trans	-73.9	-32	175.8	-101.4	147.7	0	0	0	112.9	T1750 K1754 F1755 I1756	T1750-L1752 PolarHBondContact O-N 3.11Å; L1752-K1754 VanDerWaalsContact C-N 3.28Å; L1752-K1754 PolarHBondContact O-N 2.86Å; L1752-F1755 WeakPolarHBondContact O-CB 3.32Å; L1752-F1755 PolarHBondContact O-N 3.13Å; L1752-I1756 WeakPolarHBondContact O-CG1 3.31Å; L1752-I1756 PolarHBondContact O-N 2.78Å
1753	Q	39.3	Very low	39.8	Very low	130.6 Å²	130.6	134.6 Å²	134.6	61%	0.61	68%	0.682	S	S	*	*	H	α-helix	trans	-72.8	-27.9	-179.1	-115.2	171.9	-1.1	0	0	112.8	T1750 G1751 F1755 I1756 I1757	T1750-Q1753 PolarHBondContact O-N 3.08Å; G1751-Q1753 VanDerWaalsContact C-N 3.26Å; G1751-Q1753 PolarHBondContact O-N 3.41Å; Q1753-F1755 VanDerWaalsContact C-N 3.35Å; Q1753-F1755 PolarHBondContact O-N 3.44Å; Q1753-I1756 PolarHBondContact O-N 2.87Å; Q1753-I1756 VanDerWaalsContact O-N 3.16Å; Q1753-I1757 WeakPolarHBondContact O-CB 3.12Å; Q1753-I1757 VanDerWaalsContact O-CD1 3.28Å; Q1753-I1757 WeakPolarHBondContact O-CD1 3.23Å; Q1753-I1757 WeakPolarHBondContact O-CG1 3.3Å; Q1753-I1757 PolarHBondContact O-N 2.99Å; Q1753-I1757 VanDerWaalsContact O-N 3.16Å
1754	K	39	Very low	39.3	Very low	124.2 Å²	124.2	136 Å²	136	54%	0.54	69%	0.691	S	S	.	*	H	α-helix	trans	-73.1	-32.2	178.6	-157.2	166.3	-170.3	155.3	0	112.8	E1749 G1751 L1752 I1756 I1757 D1758	E1749-K1754 IonicContact OE1-NZ 3.39Å; E1749-K1754 PolarHBondContact OE1-NZ 3.33Å; E1749-K1754 IonicContact OE2-NZ 3.03Å; E1749-K1754 PolarHBondContact OE2-NZ 2.96Å; G1751-K1754 PolarHBondContact O-N 3.09Å; L1752-K1754 VanDerWaalsContact C-N 3.28Å; L1752-K1754 PolarHBondContact O-N 2.86Å; K1754-I1756 VanDerWaalsContact C-N 3.33Å; K1754-I1756 PolarHBondContact O-N 3.35Å; K1754-I1757 PolarHBondContact O-N 3.05Å; K1754-I1757 VanDerWaalsContact O-N 3.15Å; K1754-D1758 VanDerWaalsContact O-CB 3.28Å; K1754-D1758 WeakPolarHBondContact O-CB 3.14Å; K1754-D1758 PolarHBondContact O-N 3.39Å; K1754-D1758 VanDerWaalsContact O-N 3.09Å
1755	F	36.9	Very low	39.1	Very low	162.2 Å²	162.2	141.1 Å²	141.1	71%	0.711	70%	0.698	S	S	*	*	H	α-helix	trans	-66.7	-33.4	175.1	-112.7	-83.9	0	0	0	113	G1751 L1752 Q1753 E1759	G1751-F1755 PolarHBondContact O-N 2.74Å; L1752-F1755 WeakPolarHBondContact O-CB 3.32Å; L1752-F1755 PolarHBondContact O-N 3.13Å; Q1753-F1755 VanDerWaalsContact C-N 3.35Å; Q1753-F1755 PolarHBondContact O-N 3.44Å; F1755-E1759 PolarHBondContact O-N 2.83Å
1756	I	42.9	Very low	39	Very low	107.4 Å²	107.4	139.6 Å²	139.6	55%	0.551	70%	0.696	S	S	*	*	H	α-helix	trans	-75.1	-34.7	178	-63	173.8	0	0	0	111	L1752 Q1753 K1754 L1760	L1752-I1756 WeakPolarHBondContact O-CG1 3.31Å; L1752-I1756 PolarHBondContact O-N 2.78Å; Q1753-I1756 PolarHBondContact O-N 2.87Å; Q1753-I1756 VanDerWaalsContact O-N 3.16Å; K1754-I1756 VanDerWaalsContact C-N 3.33Å; K1754-I1756 PolarHBondContact O-N 3.35Å; I1756-L1760 HydrophobicContact CG2-CD1 3.8Å; I1756-L1760 VanDerWaalsContact O-CB 3.26Å; I1756-L1760 WeakPolarHBondContact O-CB 3.18Å; I1756-L1760 VanDerWaalsContact O-CD1 3.3Å; I1756-L1760 WeakPolarHBondContact O-CD1 3.45Å; I1756-L1760 VanDerWaalsContact O-CG 3.31Å; I1756-L1760 WeakPolarHBondContact O-CG 3.17Å; I1756-L1760 PolarHBondContact O-N 3.12Å
1757	I	45.2	Very low	39.1	Very low	97 Å²	97	142 Å²	142	50%	0.497	70%	0.7	S	S	.	*	H	α-helix	trans	-74.2	-38.5	-178.1	-66.6	167.8	0	0	0	111.8	Q1753 K1754 E1759 N1761	Q1753-I1757 WeakPolarHBondContact O-CB 3.12Å; Q1753-I1757 VanDerWaalsContact O-CD1 3.28Å; Q1753-I1757 WeakPolarHBondContact O-CD1 3.23Å; Q1753-I1757 WeakPolarHBondContact O-CG1 3.3Å; Q1753-I1757 PolarHBondContact O-N 2.99Å; Q1753-I1757 VanDerWaalsContact O-N 3.16Å; K1754-I1757 PolarHBondContact O-N 3.05Å; K1754-I1757 VanDerWaalsContact O-N 3.15Å; I1757-E1759 PolarHBondContact O-N 3.17Å; I1757-N1761 WeakPolarHBondContact CG2-ND2 3.38Å; I1757-N1761 WeakPolarHBondContact O-CB 3.31Å; I1757-N1761 PolarHBondContact O-N 3.27Å; I1757-N1761 PolarHBondContact O-ND2 3.24Å; I1757-N1761 VanDerWaalsContact O-ND2 3.07Å
1758	D	43.6	Very low	39.4	Very low	105.6 Å²	105.6	145.1 Å²	145.1	57%	0.565	70%	0.701	S	S	*	*	H	α-helix	trans	-76.5	-25.7	-175.8	-75.5	-22.9	0	0	0	113.9	K1754 L1760 N1761	K1754-D1758 VanDerWaalsContact O-CB 3.28Å; K1754-D1758 WeakPolarHBondContact O-CB 3.14Å; K1754-D1758 PolarHBondContact O-N 3.39Å; K1754-D1758 VanDerWaalsContact O-N 3.09Å; D1758-L1760 PolarHBondContact O-N 3.46Å; D1758-N1761 PolarHBondContact O-N 3.22Å; D1758-N1761 VanDerWaalsContact O-N 3.09Å
1759	E	43.3	Very low	39.9	Very low	170.2 Å²	170.2	140.3 Å²	140.3	80%	0.795	69%	0.686	S	S	*	*	H	α-helix	trans	-81.1	-24	174.6	-93.8	-158.5	147.7	0	0	114	F1755 I1757 N1761	F1755-E1759 PolarHBondContact O-N 2.83Å; I1757-E1759 PolarHBondContact O-N 3.17Å; E1759-N1761 VanDerWaalsContact C-N 3.31Å; E1759-N1761 PolarHBondContact O-N 3.05Å
1760	L	45.3	Very low	41.1	Very low	118.2 Å²	118.2	139.7 Å²	139.7	62%	0.619	68%	0.683	S	S	*	*	H	α-helix	trans	-85.1	-11.9	-178.1	-81.3	150.9	0	0	0	114.3	I1756 D1758 N1762 K1763	I1756-L1760 HydrophobicContact CG2-CD1 3.8Å; I1756-L1760 VanDerWaalsContact O-CB 3.26Å; I1756-L1760 WeakPolarHBondContact O-CB 3.18Å; I1756-L1760 VanDerWaalsContact O-CD1 3.3Å; I1756-L1760 WeakPolarHBondContact O-CD1 3.45Å; I1756-L1760 VanDerWaalsContact O-CG 3.31Å; I1756-L1760 WeakPolarHBondContact O-CG 3.17Å; I1756-L1760 PolarHBondContact O-N 3.12Å; D1758-L1760 PolarHBondContact O-N 3.46Å; L1760-N1762 PolarHBondContact O-N 3.02Å; L1760-N1762 VanDerWaalsContact O-N 3.1Å; L1760-K1763 PolarHBondContact O-N 2.83Å
1761	N	41.6	Very low	42.1	Very low	114.4 Å²	114.4	137.4 Å²	137.4	61%	0.612	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	18.8	-174.6	-83.4	-30.3	0	0	0	115.1	I1757 D1758 E1759 K1763	I1757-N1761 WeakPolarHBondContact CG2-ND2 3.38Å; I1757-N1761 WeakPolarHBondContact O-CB 3.31Å; I1757-N1761 PolarHBondContact O-N 3.27Å; I1757-N1761 PolarHBondContact O-ND2 3.24Å; I1757-N1761 VanDerWaalsContact O-ND2 3.07Å; D1758-N1761 PolarHBondContact O-N 3.22Å; D1758-N1761 VanDerWaalsContact O-N 3.09Å; E1759-N1761 VanDerWaalsContact C-N 3.31Å; E1759-N1761 PolarHBondContact O-N 3.05Å; N1761-K1763 VanDerWaalsContact C-N 3.33Å; N1761-K1763 PolarHBondContact O-N 3.28Å
1762	N	39.9	Very low	43.5	Very low	157.2 Å²	157.2	136.4 Å²	136.4	84%	0.841	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	24.4	-179.1	-80.5	-40.2	0	0	0	115.7	L1760	L1760-N1762 PolarHBondContact O-N 3.02Å; L1760-N1762 VanDerWaalsContact O-N 3.1Å
1763	K	38.8	Very low	45	Very low	169.6 Å²	169.6	133.3 Å²	133.3	74%	0.737	65%	0.646	S	S	*	*			trans	-135.7	116.1	169.8	-70.9	-174.9	-179.5	173.5	0	111.1	L1760 N1761 Y1765	L1760-K1763 PolarHBondContact O-N 2.83Å; N1761-K1763 VanDerWaalsContact C-N 3.33Å; N1761-K1763 PolarHBondContact O-N 3.28Å; K1763-Y1765 VanDerWaalsContact C-N 3.32Å; K1763-Y1765 HydrophobicContact CB-CD2 3.88Å; K1763-Y1765 HydrophobicContact CB-CE2 4.22Å; K1763-Y1765 HydrophobicContact CD-CE2 3.98Å; K1763-Y1765 HydrophobicContact CG-CE2 4.49Å; K1763-Y1765 PolarHBondContact O-N 2.87Å; K1763-Y1765 VanDerWaalsContact O-N 3.13Å
1764	E	32.7	Very low	46.9	Very low	194.4 Å²	194.4	130.3 Å²	130.3	91%	0.908	64%	0.638	S	S	*	*			trans	-58.6	105.7	171.2	-71.6	179.7	129.6	0	0	110.7	P1766	E1764-P1766 VanDerWaalsContact O-CD 3.27Å; E1764-P1766 WeakPolarHBondContact O-CD 3.38Å
1765	Y	32.7	Very low	48.8	Very low	195.6 Å²	195.6	126.7 Å²	126.7	77%	0.767	62%	0.621	S	S	*	*			trans	-108.6	109.1	164.4	-80.2	-79.1	0	0	0	110.3	K1763 K1767	K1763-Y1765 VanDerWaalsContact C-N 3.32Å; K1763-Y1765 HydrophobicContact CB-CD2 3.88Å; K1763-Y1765 HydrophobicContact CB-CE2 4.22Å; K1763-Y1765 HydrophobicContact CD-CE2 3.98Å; K1763-Y1765 HydrophobicContact CG-CE2 4.49Å; K1763-Y1765 PolarHBondContact O-N 2.87Å; K1763-Y1765 VanDerWaalsContact O-N 3.13Å; Y1765-K1767 PolarHBondContact O-N 3.31Å
1766	P	33.1	Very low	51.1	Low	110.2 Å²	110.2	120.8 Å²	120.8	72%	0.716	60%	0.596	S	S	*	*			trans	-88.1	123.1	-178.7	31.9	-27.4	0	0	0	110.9	E1764 R1768	E1764-P1766 VanDerWaalsContact O-CD 3.27Å; E1764-P1766 WeakPolarHBondContact O-CD 3.38Å; P1766-R1768 PolarHBondContact O-N 2.85Å; P1766-R1768 VanDerWaalsContact O-N 3.15Å
1767	K	40.2	Very low	53.1	Low	186.2 Å²	186.2	116.4 Å²	116.4	81%	0.81	57%	0.574	S	S	*	*			trans	5	101.3	168.7	-72.3	175.6	-179	179.4	0	111.9	Y1765 H1769	Y1765-K1767 PolarHBondContact O-N 3.31Å; K1767-H1769 PolarHBondContact O-N 3.05Å; K1767-H1769 PolarHBondContact O-ND1 2.76Å
1768	R	41.4	Very low	55.2	Low	208.4 Å²	208.4	111.8 Å²	111.8	79%	0.786	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-51.9	134.9	163.8	-66.9	178.2	175.6	177.7	-3.8	108.8	P1766 Q1770 N2027	P1766-R1768 PolarHBondContact O-N 2.85Å; P1766-R1768 VanDerWaalsContact O-N 3.15Å; R1768-Q1770 VanDerWaalsContact C-N 3.32Å; R1768-Q1770 PolarHBondContact O-N 3.06Å; R1768-Q1770 VanDerWaalsContact O-N 3.13Å; R1768-N2027 HydrophobicContact CB-CB 3.69Å; R1768-N2027 PolarHBondContact N-ND2 3.27Å
1769	H	50.4	Low	57.5	Low	117.6 Å²	117.6	107.8 Å²	107.8	54%	0.544	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-61.7	118.1	-176.9	-65	53.8	0	0	0	110.5	F1662 D1735 K1767 V1771	F1662-H1769 HydrophobicContact CE2-CB 4.46Å; F1662-H1769 HydrophobicContact CZ-CB 4.2Å; D1735-H1769 IonicContact OD2-CD2 2.97Å; K1767-H1769 PolarHBondContact O-N 3.05Å; K1767-H1769 PolarHBondContact O-ND1 2.76Å; H1769-V1771 PolarHBondContact O-N 3.39Å; H1769-V1771 VanDerWaalsContact O-N 3.13Å
1770	Q	57.5	Low	59.8	Low	158.2 Å²	158.2	99.7 Å²	99.7	74%	0.739	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-83.2	121.5	178	-80	-175.3	-4.1	0	0	108.8	R1768	R1768-Q1770 VanDerWaalsContact C-N 3.32Å; R1768-Q1770 PolarHBondContact O-N 3.06Å; R1768-Q1770 VanDerWaalsContact O-N 3.13Å
1771	V	63.4	Low	61.8	Low	56.2 Å²	56.2	95.3 Å²	95.3	34%	0.341	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-52.7	128.6	173.9	-179.9	0	0	0	0	109.2	F1662 W1733 D1735 H1769 A1773 R2030	F1662-V1771 HydrophobicContact CD1-CG2 4.29Å; F1662-V1771 HydrophobicContact CE1-CB 4.38Å; F1662-V1771 HydrophobicContact CE1-CG2 3.98Å; W1733-V1771 VanDerWaalsContact C-CG1 3.45Å; W1733-V1771 HydrophobicContact CB-CG1 3.85Å; W1733-V1771 VanDerWaalsContact O-CG1 3.27Å; W1733-V1771 WeakPolarHBondContact O-CG1 3.27Å; D1735-V1771 HydrophobicContact CB-CG2 4Å; H1769-V1771 PolarHBondContact O-N 3.39Å; H1769-V1771 VanDerWaalsContact O-N 3.13Å; V1771-A1773 PolarHBondContact O-N 3.32Å; V1771-R2030 PolarHBondContact O-NH1 3.35Å; V1771-R2030 PolarHBondContact O-NH2 2.66Å
1772	P	67.8	Low	64	Low	39 Å²	39	89.9 Å²	89.9	25%	0.253	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-58.6	140.8	180	-23.1	31.8	0	0	0	112.1	L1642 F1662 W1733	L1642-P1772 HydrophobicContact CD2-CG 4.26Å; F1662-P1772 HydrophobicContact CD2-CG 4.39Å; F1662-P1772 HydrophobicContact CE2-CG 4.29Å; W1733-P1772 HydrophobicContact CB-CB 4.39Å; W1733-P1772 HydrophobicContact CB-CG 4.36Å; W1733-P1772 VanDerWaalsContact CD1-O 3.27Å; W1733-P1772 HydrophobicContact CD2-CB 4.07Å; W1733-P1772 HydrophobicContact CD2-CG 4.28Å; W1733-P1772 HydrophobicContact CE3-CB 3.76Å; W1733-P1772 HydrophobicContact CG-CB 3.95Å; W1733-P1772 HydrophobicContact CG-CG 4.1Å; W1733-P1772 HydrophobicContact CZ3-CB 4.31Å
1773	A	70.6	Confident	66.2	Low	76.4 Å²	76.4	82.9 Å²	82.9	63%	0.631	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-64.2	151	179.3	0	0	0	0	0	111.5	W1733 V1771 R1775	W1733-A1773 WeakPolarHBondContact CZ3-O 3.38Å; W1733-A1773 PolarHBondContact NE1-O 2.96Å; V1771-A1773 PolarHBondContact O-N 3.32Å; A1773-R1775 PolarHBondContact O-N 3.02Å
1774	P	78.7	Confident	68.5	Low	68.4 Å²	68.4	74.9 Å²	74.9	44%	0.444	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-51.8	132.3	175.2	-27.2	35	0	0	0	112.3	W1730 I1731 I1732 F2050	W1730-P1774 HydrophobicContact CE3-CB 4.31Å; W1730-P1774 HydrophobicContact CZ3-CB 4.41Å; I1731-P1774 CarbonylContact O-C 3.51Å; I1731-P1774 VanDerWaalsContact O-CA 3.26Å; I1731-P1774 WeakPolarHBondContact O-CA 3.37Å; I1732-P1774 HydrophobicContact CG1-CB 4.09Å; I1732-P1774 HydrophobicContact CG1-CG 4.26Å; I1732-P1774 HydrophobicContact CG2-CB 3.92Å; I1732-P1774 HydrophobicContact CG2-CG 3.96Å; P1774-F2050 HydrophobicContact CG-CB 4.13Å; P1774-F2050 HydrophobicContact CG-CD2 4.47Å
1775	R	79.2	Confident	71	Confident	47.6 Å²	47.6	66.1 Å²	66.1	18%	0.18	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	124.2	-175.5	-175	175.6	-166.5	-174.5	-1.6	110.8	L1641 D1644 T1645 W1730 I1731 W1733 A1773 I1777	L1641-R1775 VanDerWaalsContact O-CZ 3.24Å; L1641-R1775 PolarHBondContact O-NH1 3.08Å; L1641-R1775 PolarHBondContact O-NH2 3.18Å; D1644-R1775 IonicContact OD2-CZ 3.01Å; D1644-R1775 VanDerWaalsContact OD2-CZ 3.29Å; D1644-R1775 IonicContact OD2-NH1 3.51Å; D1644-R1775 PolarHBondContact OD2-NH1 2.98Å; D1644-R1775 IonicContact OD2-NH2 3.05Å; D1644-R1775 PolarHBondContact OD2-NH2 3.2Å; T1645-R1775 PolarHBondContact OG1-NH2 2.66Å; W1730-R1775 CarbonylContact C-O 3.53Å; W1730-R1775 WeakPolarHBondContact CA-O 3.29Å; W1730-R1775 VanDerWaalsContact CE3-C 3.45Å; I1731-R1775 HydrophobicContact CG2-CB 3.8Å; I1731-R1775 WeakPolarHBondContact CG2-O 3.37Å; I1731-R1775 PolarHBondContact N-O 3.18Å; I1731-R1775 PolarHBondContact O-N 3.09Å; W1733-R1775 HydrophobicContact CH2-CB 3.66Å; W1733-R1775 VanDerWaalsContact CH2-CB 3.41Å; W1733-R1775 HydrophobicContact CH2-CG 4.33Å; W1733-R1775 HydrophobicContact CZ3-CB 3.74Å; A1773-R1775 PolarHBondContact O-N 3.02Å; R1775-I1777 PolarHBondContact O-N 2.97Å
1776	H	85.2	Confident	73.2	Confident	38.2 Å²	38.2	57.6 Å²	57.6	18%	0.177	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	122.4	167.2	179.6	-129.7	0	0	0	109.5	V1729 W1730 G1778 T1779 R1840	V1729-H1776 PolarHBondContact O-CD2 3.08Å; V1729-H1776 VanDerWaalsContact O-CD2 3.29Å; W1730-H1776 AromaticContact CD1-CD2 3.98Å; W1730-H1776 HydrophobicContact CD2-CB 4.03Å; W1730-H1776 AromaticContact CE2-CD2 3.86Å; W1730-H1776 HydrophobicContact CE3-CB 3.96Å; W1730-H1776 HydrophobicContact CH2-CB 3.81Å; W1730-H1776 HydrophobicContact CZ2-CB 3.87Å; W1730-H1776 HydrophobicContact CZ3-CB 3.86Å; W1730-H1776 AromaticContact NE1-CD2 3.78Å; H1776-G1778 VanDerWaalsContact CE1-C 3.43Å; H1776-G1778 VanDerWaalsContact CE1-CA 3.46Å; H1776-G1778 WeakPolarHBondContact CE1-CA 3.47Å; H1776-G1778 PolarHBondContact NE2-O 3.11Å; H1776-G1778 VanDerWaalsContact NE2-O 3.17Å; H1776-T1779 PolarHBondContact CE1-OG1 3.26Å; H1776-T1779 VanDerWaalsContact CE1-OG1 3.25Å; H1776-T1779 PolarHBondContact NE2-OG1 3.03Å; H1776-R1840 WeakPolarHBondContact O-CD 2.93Å; H1776-R1840 PolarHBondContact O-NH1 2.98Å
1777	I	84.4	Confident	75.7	Confident	16.2 Å²	16.2	52.4 Å²	52.4	8%	0.083	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-55	177.2	-55.4	175.2	0	0	0	109.3	L1635 L1641 T1666 V1729 I1731 R1775 R1840 F1846	L1635-I1777 HydrophobicContact CB-CD1 4.48Å; L1635-I1777 HydrophobicContact CD1-CD1 4.05Å; L1635-I1777 HydrophobicContact CD2-CD1 4.01Å; L1635-I1777 HydrophobicContact CD2-CG2 4.31Å; L1635-I1777 HydrophobicContact CG-CD1 4.3Å; L1641-I1777 HydrophobicContact CD1-CD1 4.34Å; L1641-I1777 HydrophobicContact CD2-CG1 4.44Å; T1666-I1777 HydrophobicContact CG2-CD1 4.46Å; V1729-I1777 HydrophobicContact CB-CB 4.46Å; V1729-I1777 HydrophobicContact CB-CD1 4.41Å; V1729-I1777 HydrophobicContact CG1-CB 4.47Å; V1729-I1777 HydrophobicContact CG1-CD1 3.95Å; V1729-I1777 HydrophobicContact CG1-CG1 4.47Å; V1729-I1777 PolarHBondContact O-N 2.97Å; I1731-I1777 HydrophobicContact CB-CD1 4.09Å; I1731-I1777 HydrophobicContact CB-CG1 4.39Å; I1731-I1777 HydrophobicContact CD1-CD1 3.5Å; I1731-I1777 VanDerWaalsContact CD1-CD1 3.46Å; I1731-I1777 HydrophobicContact CD1-CG1 3.78Å; I1731-I1777 HydrophobicContact CG1-CD1 3.53Å; I1731-I1777 HydrophobicContact CG1-CG1 3.81Å; I1731-I1777 HydrophobicContact CG2-CD1 4.29Å; I1731-I1777 HydrophobicContact CG2-CG1 4.13Å; R1775-I1777 PolarHBondContact O-N 2.97Å; I1777-R1840 WeakPolarHBondContact O-CB 3.47Å; I1777-R1840 VanDerWaalsContact O-CD 3.28Å; I1777-R1840 WeakPolarHBondContact O-CD 3.39Å; I1777-F1846 WeakPolarHBondContact O-CE1 3.38Å
1778	G	89.2	Confident	77.6	Confident	0.2 Å²	0.2	44.5 Å²	44.5	0%	0.002	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	180	168.1	179.9	0	0	0	0	0	113	V1729 H1776 Y1839	V1729-G1778 PolarHBondContact N-O 3.02Å; H1776-G1778 VanDerWaalsContact CE1-C 3.43Å; H1776-G1778 VanDerWaalsContact CE1-CA 3.46Å; H1776-G1778 WeakPolarHBondContact CE1-CA 3.47Å; H1776-G1778 PolarHBondContact NE2-O 3.11Å; H1776-G1778 VanDerWaalsContact NE2-O 3.17Å; G1778-Y1839 CarbonylContact C-O 3.43Å; G1778-Y1839 VanDerWaalsContact CA-O 3.25Å; G1778-Y1839 WeakPolarHBondContact CA-O 3.41Å
1779	T	91.9	Very high	79.4	Confident	21.8 Å²	21.8	35.2 Å²	35.2	13%	0.134	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	132.2	-177.4	-49.9	0	0	0	0	110.4	E1726 F1727 Q1728 H1776 T1781 Y1839	E1726-T1779 HydrophobicContact CB-CG2 3.9Å; E1726-T1779 HydrophobicContact CG-CG2 4.24Å; F1727-T1779 CarbonylContact O-C 3.54Å; F1727-T1779 VanDerWaalsContact O-CA 3.27Å; F1727-T1779 WeakPolarHBondContact O-CA 3.22Å; Q1728-T1779 HydrophobicContact CG-CG2 4.07Å; H1776-T1779 PolarHBondContact CE1-OG1 3.26Å; H1776-T1779 VanDerWaalsContact CE1-OG1 3.25Å; H1776-T1779 PolarHBondContact NE2-OG1 3.03Å; T1779-T1781 HydrophobicContact CG2-CG2 4.3Å; T1779-Y1839 PolarHBondContact N-O 3.06Å; T1779-Y1839 WeakPolarHBondContact O-CD2 3.33Å; T1779-Y1839 PolarHBondContact O-N 3.24Å
1780	A	91.2	Very high	80.4	Confident	0.2 Å²	0.2	31.3 Å²	31.3	0%	0.002	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	134.3	163.7	0	0	0	0	0	109.8	E1726 F1727 L1838 I1851	E1726-A1780 WeakPolarHBondContact CA-O 3.4Å; F1727-A1780 HydrophobicContact CB-CB 4.48Å; F1727-A1780 PolarHBondContact N-O 3.12Å; F1727-A1780 PolarHBondContact O-N 3.13Å; A1780-L1838 HydrophobicContact CB-CD2 4Å; A1780-I1851 HydrophobicContact CB-CG2 3.57Å
1781	T	88.2	Confident	80.8	Confident	25.6 Å²	25.6	27.6 Å²	27.6	16%	0.157	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	120.5	179.2	58.9	0	0	0	0	110.5	L1725 E1726 T1779	L1725-T1781 WeakPolarHBondContact O-CA 3.39Å; E1726-T1781 HydrophobicContact CG-CG2 4.21Å; T1779-T1781 HydrophobicContact CG2-CG2 4.3Å
1782	I	88.3	Confident	80.7	Confident	0.8 Å²	0.8	26.4 Å²	26.4	0%	0.004	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	114	-175.1	-54.3	-172.8	0	0	0	109.8	T1724 L1725 F1727 L1806 Y1836 V1853 I1855	T1724-I1782 CarbonylContact C-O 3.48Å; T1724-I1782 VanDerWaalsContact CA-O 3.27Å; T1724-I1782 WeakPolarHBondContact CA-O 3.37Å; L1725-I1782 PolarHBondContact N-O 3.06Å; L1725-I1782 PolarHBondContact O-N 2.96Å; F1727-I1782 HydrophobicContact CD2-CD1 3.78Å; F1727-I1782 HydrophobicContact CD2-CG1 4.13Å; F1727-I1782 HydrophobicContact CE2-CD1 3.63Å; F1727-I1782 HydrophobicContact CE2-CG1 4.2Å; I1782-L1806 HydrophobicContact CG2-CD1 3.69Å; I1782-L1806 HydrophobicContact CG2-CD2 3.11Å; I1782-Y1836 HydrophobicContact CB-CE1 4.33Å; I1782-Y1836 HydrophobicContact CD1-CD1 4.15Å; I1782-Y1836 HydrophobicContact CD1-CD2 3.73Å; I1782-Y1836 HydrophobicContact CD1-CE1 4Å; I1782-Y1836 HydrophobicContact CD1-CE2 3.58Å; I1782-Y1836 HydrophobicContact CD1-CG 4.02Å; I1782-Y1836 HydrophobicContact CG1-CD1 3.82Å; I1782-Y1836 HydrophobicContact CG1-CD2 4.3Å; I1782-Y1836 HydrophobicContact CG1-CE1 3.78Å; I1782-Y1836 HydrophobicContact CG1-CE2 4.28Å; I1782-Y1836 HydrophobicContact CG1-CG 4.08Å; I1782-Y1836 HydrophobicContact CG2-CE1 4.02Å; I1782-V1853 HydrophobicContact CD1-CB 3.95Å; I1782-V1853 HydrophobicContact CD1-CG1 4.09Å; I1782-V1853 HydrophobicContact CD1-CG2 4.41Å; I1782-I1855 HydrophobicContact CD1-CD1 4.36Å; I1782-I1855 HydrophobicContact CG2-CD1 4.23Å
1783	P	85.2	Confident	80.1	Confident	10.6 Å²	10.6	31 Å²	31	7%	0.069	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	130.8	177.7	1	6.7	0	0	0	112.1	T1724 Y1785 P1810	T1724-P1783 HydrophobicContact CG2-CB 4.14Å; T1724-P1783 HydrophobicContact CG2-CG 4.16Å; P1783-Y1785 HydrophobicContact CB-CD1 3.65Å; P1783-Y1785 HydrophobicContact CB-CE1 3.4Å; P1783-Y1785 VanDerWaalsContact CB-CE1 3.43Å; P1783-Y1785 HydrophobicContact CG-CD1 4.46Å; P1783-Y1785 HydrophobicContact CG-CE1 4.09Å; P1783-P1810 HydrophobicContact CG-CG 3.88Å
1784	L	88.1	Confident	78.8	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-85.9	-12.7	-174.1	-64	-174.4	0	0	0	114.5	F1719 L1720 S1723 L1725 H1786 L1787 L1806 I1855	F1719-L1784 HydrophobicContact CD1-CD1 4.2Å; F1719-L1784 HydrophobicContact CE1-CD1 3.36Å; F1719-L1784 VanDerWaalsContact CE1-CD1 3.41Å; F1719-L1784 HydrophobicContact CZ-CD1 3.88Å; L1720-L1784 HydrophobicContact CD2-CB 4.03Å; L1720-L1784 HydrophobicContact CD2-CD1 4.04Å; L1720-L1784 CarbonylContact O-C 3.54Å; L1720-L1784 WeakPolarHBondContact O-CB 3.11Å; S1723-L1784 PolarHBondContact O-N 3.08Å; S1723-L1784 WeakPolarHBondContact OG-CD1 3.33Å; L1725-L1784 HydrophobicContact CB-CD1 4.42Å; L1725-L1784 HydrophobicContact CB-CD2 4.06Å; L1725-L1784 HydrophobicContact CB-CG 4.36Å; L1725-L1784 HydrophobicContact CD1-CD1 4.36Å; L1725-L1784 HydrophobicContact CD1-CD2 3.91Å; L1725-L1784 HydrophobicContact CD2-CD1 4.28Å; L1725-L1784 HydrophobicContact CG-CD1 3.96Å; L1725-L1784 HydrophobicContact CG-CD2 3.89Å; L1725-L1784 HydrophobicContact CG-CG 4.16Å; L1784-H1786 PolarHBondContact O-N 3.17Å; L1784-H1786 VanDerWaalsContact O-N 3.09Å; L1784-L1787 HydrophobicContact CD2-CD1 4.08Å; L1784-L1787 VanDerWaalsContact O-CB 3.29Å; L1784-L1787 WeakPolarHBondContact O-CB 3.24Å; L1784-L1787 PolarHBondContact O-N 3.08Å; L1784-L1806 HydrophobicContact CD2-CD1 4.46Å; L1784-I1855 HydrophobicContact CD2-CD1 4.26Å
1785	Y	83.4	Confident	76.8	Confident	9.6 Å²	9.6	33.4 Å²	33.4	4%	0.038	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-60.9	-25.4	-176.1	67.5	-100.4	0	0	0	113	A1493 F1496 L1720 P1783 L1787 L1788 Y1789	A1493-Y1785 HydrophobicContact CB-CD1 4.37Å; A1493-Y1785 HydrophobicContact CB-CE1 3.66Å; F1496-Y1785 HydrophobicContact CB-CD2 4.29Å; F1496-Y1785 HydrophobicContact CB-CG 4.32Å; F1496-Y1785 AromaticContact CD2-CD2 3.33Å; F1496-Y1785 HydrophobicContact CD2-CD2 3.33Å; F1496-Y1785 AromaticContact CD2-CE2 3.57Å; F1496-Y1785 HydrophobicContact CD2-CE2 3.57Å; F1496-Y1785 VanDerWaalsContact CD2-CE2 3.47Å; F1496-Y1785 AromaticContact CD2-CG 3.93Å; F1496-Y1785 HydrophobicContact CD2-CG 4.1Å; F1496-Y1785 AromaticContact CE2-CD2 3.87Å; F1496-Y1785 HydrophobicContact CE2-CD2 3.87Å; F1496-Y1785 AromaticContact CE2-CE2 3.87Å; F1496-Y1785 HydrophobicContact CE2-CE2 3.87Å; F1496-Y1785 AromaticContact CG-CD2 3.97Å; F1496-Y1785 HydrophobicContact CG-CD2 4.12Å; F1496-Y1785 HydrophobicContact CG-CG 4.5Å; L1720-Y1785 VanDerWaalsContact O-CA 3.24Å; L1720-Y1785 WeakPolarHBondContact O-CA 3.43Å; L1720-Y1785 PolarHBondContact O-N 3.02Å; P1783-Y1785 HydrophobicContact CB-CD1 3.65Å; P1783-Y1785 HydrophobicContact CB-CE1 3.4Å; P1783-Y1785 VanDerWaalsContact CB-CE1 3.43Å; P1783-Y1785 HydrophobicContact CG-CD1 4.46Å; P1783-Y1785 HydrophobicContact CG-CE1 4.09Å; Y1785-L1787 PolarHBondContact O-N 3.18Å; Y1785-L1788 WeakPolarHBondContact O-CB 3.34Å; Y1785-L1788 PolarHBondContact O-N 3.1Å; Y1785-Y1789 WeakPolarHBondContact O-CD2 3.32Å; Y1785-Y1789 PolarHBondContact O-N 3.1Å
1786	H	80.7	Confident	74.4	Confident	16.2 Å²	16.2	35.7 Å²	35.7	8%	0.075	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-66.1	-16.9	174.3	-75.8	-52.5	0	0	0	113.7	D1442 L1784 L1788 Y1789 P1790 R1791 L1806 P1810	D1442-H1786 IonicContact OD1-CE1 2.65Å; D1442-H1786 IonicContact OD2-CE1 3.33Å; D1442-H1786 PolarHBondContact OD2-CE1 2.77Å; D1442-H1786 VanDerWaalsContact OD2-CE1 3.29Å; D1442-H1786 IonicContact OD2-NE2 3.14Å; L1784-H1786 PolarHBondContact O-N 3.17Å; L1784-H1786 VanDerWaalsContact O-N 3.09Å; H1786-L1788 VanDerWaalsContact C-N 3.33Å; H1786-Y1789 WeakPolarHBondContact CA-O 3.4Å; H1786-Y1789 PolarHBondContact ND1-O 3Å; H1786-Y1789 CarbonylContact O-C 3.52Å; H1786-P1790 WeakPolarHBondContact O-CA 3.38Å; H1786-R1791 PolarHBondContact CE1-NH2 3Å; H1786-R1791 VanDerWaalsContact CE1-NH2 3.35Å; H1786-R1791 PolarHBondContact NE2-NH2 2.99Å; H1786-R1791 VanDerWaalsContact NE2-NH2 3.11Å; H1786-L1806 HydrophobicContact CB-CD1 3.31Å; H1786-L1806 HydrophobicContact CB-CD2 3.33Å; H1786-P1810 VanDerWaalsContact NE2-CG 3.3Å; H1786-P1810 WeakPolarHBondContact NE2-CG 3.36Å
1787	L	84.3	Confident	71.8	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-74.6	-27.4	169.6	-64.7	173.8	0	0	0	112	F1626 L1720 L1784 Y1785 N1804 L1806 I1855 M1857	F1626-L1787 HydrophobicContact CD1-CD1 4.25Å; F1626-L1787 HydrophobicContact CE1-CD1 4.06Å; L1720-L1787 HydrophobicContact CD2-CD1 4.21Å; L1784-L1787 HydrophobicContact CD2-CD1 4.08Å; L1784-L1787 VanDerWaalsContact O-CB 3.29Å; L1784-L1787 WeakPolarHBondContact O-CB 3.24Å; L1784-L1787 PolarHBondContact O-N 3.08Å; Y1785-L1787 PolarHBondContact O-N 3.18Å; L1787-N1804 WeakPolarHBondContact O-CB 3.33Å; L1787-N1804 PolarHBondContact O-ND2 3.04Å; L1787-L1806 HydrophobicContact CD1-CD1 4.33Å; L1787-L1806 HydrophobicContact CD2-CB 4.16Å; L1787-L1806 HydrophobicContact CD2-CD1 4.24Å; L1787-L1806 HydrophobicContact CD2-CD2 4.13Å; L1787-L1806 HydrophobicContact CD2-CG 3.75Å; L1787-L1806 HydrophobicContact CG-CD1 4.11Å; L1787-L1806 HydrophobicContact CG-CD2 4.16Å; L1787-L1806 HydrophobicContact CG-CG 4.04Å; L1787-I1855 HydrophobicContact CD1-CG2 4.02Å; L1787-I1855 HydrophobicContact CD2-CG2 4.37Å; L1787-M1857 HydrophobicContact CB-CB 4.48Å; L1787-M1857 HydrophobicContact CB-CE 4.23Å; L1787-M1857 HydrophobicContact CB-SD 4.33Å; L1787-M1857 HydrophobicContact CD1-CB 4.35Å; L1787-M1857 HydrophobicContact CD2-CB 4.12Å; L1787-M1857 WeakPolarHBondContact O-CE 3.16Å
1788	L	81.3	Confident	69.3	Low	20.4 Å²	20.4	45.8 Å²	45.8	11%	0.107	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-41	172.9	-64.4	177.6	0	0	0	111.6	W1612 R1717 L1720 A1721 Y1785 H1786 P1790	W1612-L1788 HydrophobicContact CH2-CD2 3.53Å; W1612-L1788 VanDerWaalsContact CH2-CD2 3.49Å; W1612-L1788 HydrophobicContact CZ2-CD2 3.74Å; W1612-L1788 HydrophobicContact CZ3-CD2 4.45Å; R1717-L1788 HydrophobicContact CG-CD1 4.23Å; R1717-L1788 HydrophobicContact CG-CD2 4.31Å; L1720-L1788 HydrophobicContact CB-CD1 3.78Å; L1720-L1788 HydrophobicContact CB-CD2 4.18Å; L1720-L1788 HydrophobicContact CB-CG 3.82Å; L1720-L1788 HydrophobicContact CD1-CD2 3.76Å; L1720-L1788 HydrophobicContact CD1-CG 4.25Å; L1720-L1788 HydrophobicContact CG-CD2 4.5Å; A1721-L1788 HydrophobicContact CB-CD1 4Å; Y1785-L1788 WeakPolarHBondContact O-CB 3.34Å; Y1785-L1788 PolarHBondContact O-N 3.1Å; H1786-L1788 VanDerWaalsContact C-N 3.33Å; L1788-P1790 VanDerWaalsContact C-CD 3.43Å; L1788-P1790 VanDerWaalsContact O-CD 3.25Å; L1788-P1790 WeakPolarHBondContact O-CD 3.26Å
1789	Y	78.4	Confident	66.5	Low	14.2 Å²	14.2	53.7 Å²	53.7	6%	0.056	30%	0.296	C	S	.	.	S	Bend	trans	-119.3	75.2	-176.3	-48.3	-72.6	0	0	0	110.3	F1496 I1588 F1605 E1608 R1717 Y1785 H1786 R1791	F1496-Y1789 HydrophobicContact CB-CD2 4.17Å; F1496-Y1789 HydrophobicContact CB-CE2 4.15Å; F1496-Y1789 HydrophobicContact CD1-CD1 4.3Å; F1496-Y1789 AromaticContact CD1-CD2 3.35Å; F1496-Y1789 HydrophobicContact CD1-CD2 3.35Å; F1496-Y1789 VanDerWaalsContact CD1-CD2 3.48Å; F1496-Y1789 HydrophobicContact CD1-CE1 4.31Å; F1496-Y1789 AromaticContact CD1-CE2 3.65Å; F1496-Y1789 HydrophobicContact CD1-CE2 3.65Å; F1496-Y1789 AromaticContact CD1-CG 3.73Å; F1496-Y1789 HydrophobicContact CD1-CG 3.73Å; F1496-Y1789 HydrophobicContact CD2-CD2 4.15Å; F1496-Y1789 AromaticContact CE1-CD1 3.72Å; F1496-Y1789 HydrophobicContact CE1-CD1 4.06Å; F1496-Y1789 AromaticContact CE1-CD2 3.72Å; F1496-Y1789 HydrophobicContact CE1-CD2 3.72Å; F1496-Y1789 HydrophobicContact CE1-CE1 4.26Å; F1496-Y1789 HydrophobicContact CE1-CE2 4.33Å; F1496-Y1789 AromaticContact CE1-CG 3.57Å; F1496-Y1789 HydrophobicContact CE1-CG 3.57Å; F1496-Y1789 VanDerWaalsContact CE1-CG 3.47Å; F1496-Y1789 HydrophobicContact CE2-CD2 4.42Å; F1496-Y1789 AromaticContact CG-CD2 3.71Å; F1496-Y1789 HydrophobicContact CG-CD2 3.71Å; F1496-Y1789 AromaticContact CG-CE2 3.95Å; F1496-Y1789 HydrophobicContact CG-CE2 4.09Å; F1496-Y1789 HydrophobicContact CG-CG 4.33Å; F1496-Y1789 HydrophobicContact CZ-CD2 4.34Å; F1496-Y1789 AromaticContact CZ-CG 3.99Å; F1496-Y1789 HydrophobicContact CZ-CG 4.11Å; I1588-Y1789 HydrophobicContact CG1-CD1 4.29Å; I1588-Y1789 HydrophobicContact CG1-CE1 4.23Å; F1605-Y1789 HydrophobicContact CD1-CE1 4.38Å; F1605-Y1789 HydrophobicContact CE1-CD1 4.49Å; F1605-Y1789 AromaticContact CE1-CE1 3.98Å; F1605-Y1789 HydrophobicContact CE1-CE1 4.07Å; E1608-Y1789 PolarHBondContact OE1-OH 3.19Å; E1608-Y1789 PolarHBondContact OE2-OH 3.24Å; R1717-Y1789 PolarHBondContact NH1-OH 3.36Å; R1717-Y1789 PolarHBondContact NH2-OH 3.27Å; Y1785-Y1789 WeakPolarHBondContact O-CD2 3.32Å; Y1785-Y1789 PolarHBondContact O-N 3.1Å; H1786-Y1789 WeakPolarHBondContact CA-O 3.4Å; H1786-Y1789 PolarHBondContact ND1-O 3Å; H1786-Y1789 CarbonylContact O-C 3.52Å; Y1789-R1791 PolarHBondContact O-N 2.77Å
1790	P	70.5	Confident	63.8	Low	35.6 Å²	35.6	57.7 Å²	57.7	23%	0.231	32%	0.321	C	S	.	.			trans	-61.6	139.9	177.7	9.3	-10	0	0	0	110.5	H1786 L1788 N1804	H1786-P1790 WeakPolarHBondContact O-CA 3.38Å; L1788-P1790 VanDerWaalsContact C-CD 3.43Å; L1788-P1790 VanDerWaalsContact O-CD 3.25Å; L1788-P1790 WeakPolarHBondContact O-CD 3.26Å; P1790-N1804 HydrophobicContact CB-CB 4.37Å; P1790-N1804 HydrophobicContact CG-CB 3.89Å; P1790-N1804 WeakPolarHBondContact CG-ND2 3.1Å; P1790-N1804 WeakPolarHBondContact CG-OD1 3.33Å
1791	R	67.2	Low	61.3	Low	79.6 Å²	79.6	63.8 Å²	63.8	30%	0.3	35%	0.353	S	S	.	.			trans	-64	139	178.1	-135.9	-176.9	-114.4	141.9	-2.3	110.2	D1442 M1446 W1586 H1786 Y1789 Q1793 P1810	D1442-R1791 PolarHBondContact O-NE 2.94Å; D1442-R1791 PolarHBondContact O-NH1 3.35Å; D1442-R1791 PolarHBondContact O-NH2 3.24Å; D1442-R1791 VanDerWaalsContact O-NH2 3.16Å; D1442-R1791 IonicContact OD1-CZ 3.3Å; D1442-R1791 VanDerWaalsContact OD1-CZ 3.25Å; D1442-R1791 IonicContact OD1-NE 2.9Å; D1442-R1791 PolarHBondContact OD1-NE 3.35Å; D1442-R1791 IonicContact OD1-NH2 3.22Å; D1442-R1791 PolarHBondContact OD1-NH2 3.14Å; D1442-R1791 IonicContact OD2-NE 3.6Å; D1442-R1791 IonicContact OD2-NH2 2.71Å; M1446-R1791 PolarHBondContact SD-NH1 3.13Å; W1586-R1791 HydrophobicContact CH2-CB 4.25Å; W1586-R1791 HydrophobicContact CH2-CG 3.98Å; W1586-R1791 HydrophobicContact CZ2-CG 4.35Å; W1586-R1791 HydrophobicContact CZ3-CB 4.25Å; W1586-R1791 HydrophobicContact CZ3-CG 4.2Å; H1786-R1791 PolarHBondContact CE1-NH2 3Å; H1786-R1791 VanDerWaalsContact CE1-NH2 3.35Å; H1786-R1791 PolarHBondContact NE2-NH2 2.99Å; H1786-R1791 VanDerWaalsContact NE2-NH2 3.11Å; Y1789-R1791 PolarHBondContact O-N 2.77Å; R1791-Q1793 PolarHBondContact O-N 3.09Å; R1791-Q1793 VanDerWaalsContact O-N 3.09Å; R1791-P1810 VanDerWaalsContact NH2-CB 3.33Å; R1791-P1810 PolarHBondContact NH2-O 3.48Å
1792	P	61.1	Low	59.3	Low	31.2 Å²	31.2	65.4 Å²	65.4	20%	0.203	37%	0.365	C	S	.	.			trans	-58.7	114.9	175.7	-5.5	6.8	0	0	0	111.2	Q1443 D1585 W1586 V1794	Q1443-P1792 HydrophobicContact CG-CG 4.42Å; D1585-P1792 HydrophobicContact CB-CB 4.03Å; D1585-P1792 HydrophobicContact CB-CG 3.95Å; D1585-P1792 VanDerWaalsContact O-CB 3.27Å; D1585-P1792 WeakPolarHBondContact O-CB 3.29Å; D1585-P1792 WeakPolarHBondContact O-CG 3.15Å; W1586-P1792 HydrophobicContact CD2-CG 4.18Å; W1586-P1792 HydrophobicContact CG-CG 4.15Å; W1586-P1792 HydrophobicContact CZ2-CG 4.48Å; P1792-V1794 PolarHBondContact O-N 3.09Å
1793	Q	55.8	Low	57.6	Low	136.4 Å²	136.4	69 Å²	69	64%	0.637	38%	0.384	S	S	*	.			trans	-82.4	123.5	175.2	-67.2	-171	-4.9	0	0	110.3	R1791 T1795 S1796 E1807	R1791-Q1793 PolarHBondContact O-N 3.09Å; R1791-Q1793 VanDerWaalsContact O-N 3.09Å; Q1793-T1795 VanDerWaalsContact C-N 3.34Å; Q1793-T1795 PolarHBondContact O-N 3.14Å; Q1793-T1795 VanDerWaalsContact O-N 3.1Å; Q1793-S1796 PolarHBondContact OE1-OG 2.84Å; Q1793-E1807 PolarHBondContact NE2-OE1 2.95Å; Q1793-E1807 PolarHBondContact NE2-OE2 2.88Å
1794	V	42.8	Very low	56.4	Low	89.8 Å²	89.8	70.1 Å²	70.1	54%	0.544	39%	0.389	S	S	.	.			trans	-82.6	36.3	179.8	-167.3	0	0	0	0	111.5	E1447 R1451 P1792	E1447-V1794 VanDerWaalsContact OE1-CG2 3.25Å; E1447-V1794 WeakPolarHBondContact OE1-CG2 3.46Å; R1451-V1794 VanDerWaalsContact NH1-CG1 3.33Å; R1451-V1794 PolarHBondContact NH2-O 2.88Å; P1792-V1794 PolarHBondContact O-N 3.09Å
1795	T	36.3	Very low	54.9	Low	105.8 Å²	105.8	71.9 Å²	71.9	65%	0.649	40%	0.402	S	S	*	.	S	Bend	trans	-128	109.9	178.8	48.3	0	0	0	0	112.4	Q1793 H1797	Q1793-T1795 VanDerWaalsContact C-N 3.34Å; Q1793-T1795 PolarHBondContact O-N 3.14Å; Q1793-T1795 VanDerWaalsContact O-N 3.1Å; T1795-H1797 VanDerWaalsContact C-N 3.31Å; T1795-H1797 PolarHBondContact O-N 3.15Å
1796	S	29	Very low	53.8	Low	95 Å²	95	71.9 Å²	71.9	66%	0.664	40%	0.402	S	S	*	.			trans	-72.9	108.6	165.1	62.1	0	0	0	0	114	Q1793 S1798	Q1793-S1796 PolarHBondContact OE1-OG 2.84Å; S1796-S1798 PolarHBondContact O-N 2.85Å
1797	H	31.4	Very low	52.7	Low	175.2 Å²	175.2	75.9 Å²	75.9	81%	0.811	42%	0.421	S	S	*	.			trans	-128.5	90.4	158	-62	-58.2	0	0	0	113.3	T1795 Q2151	T1795-H1797 VanDerWaalsContact C-N 3.31Å; T1795-H1797 PolarHBondContact O-N 3.15Å; H1797-Q2151 PolarHBondContact O-NE2 2.78Å
1798	S	30.1	Very low	51.3	Low	91.2 Å²	91.2	76.3 Å²	76.3	64%	0.638	43%	0.426	S	S	*	.			trans	-107.1	118.4	155.7	52.9	0	0	0	0	111	S1796 T1800	S1796-S1798 PolarHBondContact O-N 2.85Å; S1798-T1800 PolarHBondContact O-N 3.07Å; S1798-T1800 PolarHBondContact OG-OG1 2.85Å
1799	N	31.6	Very low	50.4	Low	166 Å²	166	76 Å²	76	89%	0.888	42%	0.424	S	S	*	.			trans	-54.6	51.8	166.5	-69.2	-6.4	0	0	0	113.9	N1801	N1799-N1801 PolarHBondContact O-N 2.83Å
1800	T	35.4	Very low	49.3	Very low	105.6 Å²	105.6	76.3 Å²	76.3	65%	0.648	43%	0.428	S	S	*	.			trans	-115.5	119.9	164.4	50.3	0	0	0	0	109.2	S1798 S1802	S1798-T1800 PolarHBondContact O-N 3.07Å; S1798-T1800 PolarHBondContact OG-OG1 2.85Å; T1800-S1802 PolarHBondContact O-N 3Å
1801	N	37.3	Very low	48.7	Very low	129.4 Å²	129.4	75 Å²	75	69%	0.692	42%	0.419	S	S	*	.			trans	-53	117.3	-177.3	-64.6	-29.1	0	0	0	112.6	N1799 I1803 K1896	N1799-N1801 PolarHBondContact O-N 2.83Å; N1801-I1803 VanDerWaalsContact C-N 3.26Å; N1801-I1803 VanDerWaalsContact O-CG1 3.3Å; N1801-I1803 WeakPolarHBondContact O-CG1 3.44Å; N1801-I1803 PolarHBondContact O-N 3.12Å; N1801-I1803 VanDerWaalsContact O-N 3.15Å; N1801-K1896 PolarHBondContact OD1-NZ 3.08Å
1802	S	48	Very low	48.4	Very low	58.6 Å²	58.6	71.8 Å²	71.8	41%	0.41	41%	0.411	S	S	.	.	S	Bend	trans	-9.7	63.4	171.8	64.1	0	0	0	0	116.5	T1800 N1804 T1858	T1800-S1802 PolarHBondContact O-N 3Å; S1802-N1804 VanDerWaalsContact C-N 3.31Å; S1802-N1804 PolarHBondContact O-N 3.26Å; S1802-T1858 VanDerWaalsContact O-CA 3.26Å; S1802-T1858 WeakPolarHBondContact O-CA 3.33Å
1803	I	52	Low	48.6	Very low	76.2 Å²	76.2	70.6 Å²	70.6	39%	0.391	40%	0.403	S	S	.	.			trans	-92.7	96.6	174.7	-56	179.5	0	0	0	109.5	N1801 E1856 T1858 Y1871	N1801-I1803 VanDerWaalsContact C-N 3.26Å; N1801-I1803 VanDerWaalsContact O-CG1 3.3Å; N1801-I1803 WeakPolarHBondContact O-CG1 3.44Å; N1801-I1803 PolarHBondContact O-N 3.12Å; N1801-I1803 VanDerWaalsContact O-N 3.15Å; I1803-E1856 HydrophobicContact CG2-CB 4.2Å; I1803-E1856 HydrophobicContact CG2-CG 4.27Å; I1803-T1858 HydrophobicContact CB-CG2 4.12Å; I1803-T1858 HydrophobicContact CD1-CG2 4.32Å; I1803-T1858 HydrophobicContact CG1-CG2 3.72Å; I1803-T1858 HydrophobicContact CG2-CG2 3.94Å; I1803-Y1871 HydrophobicContact CD1-CE1 3.94Å; I1803-Y1871 VanDerWaalsContact CD1-OH 3.3Å; I1803-Y1871 WeakPolarHBondContact CD1-OH 3.25Å
1804	N	58.7	Low	49.1	Very low	33.8 Å²	33.8	66.2 Å²	66.2	18%	0.181	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	110.9	177.8	-65.6	-5.9	0	0	0	109.6	L1787 P1790 S1802 E1856 M1857 D2085	L1787-N1804 WeakPolarHBondContact O-CB 3.33Å; L1787-N1804 PolarHBondContact O-ND2 3.04Å; P1790-N1804 HydrophobicContact CB-CB 4.37Å; P1790-N1804 HydrophobicContact CG-CB 3.89Å; P1790-N1804 WeakPolarHBondContact CG-ND2 3.1Å; P1790-N1804 WeakPolarHBondContact CG-OD1 3.33Å; S1802-N1804 VanDerWaalsContact C-N 3.31Å; S1802-N1804 PolarHBondContact O-N 3.26Å; N1804-E1856 CarbonylContact O-C 3.52Å; N1804-E1856 WeakPolarHBondContact O-CA 3.24Å; N1804-M1857 HydrophobicContact CB-CB 4.39Å; N1804-M1857 HydrophobicContact CB-CE 4.18Å; N1804-M1857 PolarHBondContact N-O 3.08Å; N1804-M1857 VanDerWaalsContact ND2-CE 3.3Å; N1804-M1857 WeakPolarHBondContact ND2-CE 3.28Å; N1804-M1857 PolarHBondContact O-N 3.17Å; N1804-D2085 PolarHBondContact ND2-OD1 3.45Å
1805	C	56.9	Low	50.2	Low	39.6 Å²	39.6	63.7 Å²	63.7	27%	0.268	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	135.5	-173.1	175.9	0	0	0	0	112	E1807 H1854 I1855 E1856 Y1895 K2036 Y2088	C1805-E1807 PolarHBondContact O-N 3.42Å; C1805-H1854 PolarHBondContact SG-CD2 3.14Å; C1805-H1854 VanDerWaalsContact SG-CD2 3.59Å; C1805-H1854 VanDerWaalsContact SG-CE1 3.57Å; C1805-H1854 PolarHBondContact SG-NE2 2.93Å; C1805-I1855 CarbonylContact C-O 3.54Å; C1805-I1855 WeakPolarHBondContact CA-O 3.24Å; C1805-I1855 PolarHBondContact SG-O 2.8Å; C1805-I1855 VanDerWaalsContact SG-O 3.35Å; C1805-E1856 HydrophobicContact CB-CG 4.39Å; C1805-Y1895 PolarHBondContact O-OH 3.3Å; C1805-K2036 PolarHBondContact SG-NZ 3.36Å; C1805-Y2088 HydrophobicContact CB-CD1 4.09Å; C1805-Y2088 HydrophobicContact CB-CE1 4.1Å
1806	L	61.3	Low	51.5	Low	8.4 Å²	8.4	60.9 Å²	60.9	4%	0.044	34%	0.339	C	S	.	.			trans	-93.2	109.2	173.6	-125.1	110.3	0	0	0	111	I1782 L1784 H1786 L1787 G1808 Y1836 H1854 I1855 L1892 Y1895 W2017 L2033 K2036	I1782-L1806 HydrophobicContact CG2-CD1 3.69Å; I1782-L1806 HydrophobicContact CG2-CD2 3.11Å; L1784-L1806 HydrophobicContact CD2-CD1 4.46Å; H1786-L1806 HydrophobicContact CB-CD1 3.31Å; H1786-L1806 HydrophobicContact CB-CD2 3.33Å; L1787-L1806 HydrophobicContact CD1-CD1 4.33Å; L1787-L1806 HydrophobicContact CD2-CB 4.16Å; L1787-L1806 HydrophobicContact CD2-CD1 4.24Å; L1787-L1806 HydrophobicContact CD2-CD2 4.13Å; L1787-L1806 HydrophobicContact CD2-CG 3.75Å; L1787-L1806 HydrophobicContact CG-CD1 4.11Å; L1787-L1806 HydrophobicContact CG-CD2 4.16Å; L1787-L1806 HydrophobicContact CG-CG 4.04Å; L1806-G1808 PolarHBondContact O-N 3.19Å; L1806-Y1836 VanDerWaalsContact CD2-OH 3.24Å; L1806-Y1836 WeakPolarHBondContact CD2-OH 2.98Å; L1806-Y1836 WeakPolarHBondContact CG-OH 3.29Å; L1806-H1854 PolarHBondContact O-CD2 3.01Å; L1806-I1855 HydrophobicContact CB-CB 4.28Å; L1806-I1855 HydrophobicContact CD1-CB 4.05Å; L1806-I1855 HydrophobicContact CD1-CD1 4.13Å; L1806-I1855 HydrophobicContact CD1-CG2 4.39Å; L1806-I1855 HydrophobicContact CD2-CD1 4.35Å; L1806-I1855 HydrophobicContact CG-CB 4.25Å; L1806-I1855 PolarHBondContact N-O 3.22Å; L1806-I1855 VanDerWaalsContact N-O 3.11Å; L1806-I1855 PolarHBondContact O-N 3.21Å; L1806-L1892 HydrophobicContact CD1-CD1 4.43Å; L1806-L1892 HydrophobicContact CD1-CD2 4.04Å; L1806-L1892 HydrophobicContact CG-CD2 4.16Å; L1806-Y1895 WeakPolarHBondContact CA-OH 3.23Å; L1806-Y1895 HydrophobicContact CD1-CE2 4.07Å; L1806-Y1895 PolarHBondContact N-OH 3Å; L1806-W2017 HydrophobicContact CB-CH2 3.65Å; L1806-W2017 HydrophobicContact CB-CZ2 3.78Å; L1806-W2017 HydrophobicContact CD2-CH2 4.13Å; L1806-L2033 HydrophobicContact CB-CD2 3.98Å; L1806-L2033 HydrophobicContact CD2-CD2 3.93Å; L1806-L2033 HydrophobicContact CG-CD2 3.87Å; L1806-K2036 WeakPolarHBondContact O-CE 3.48Å
1807	E	56.4	Low	52.8	Low	101 Å²	101	58.7 Å²	58.7	47%	0.472	32%	0.319	S	S	.	.			trans	-99.8	81.3	177.9	-104.7	-172.7	-178.2	0	0	112.6	Q1793 C1805 R1814 A1834	Q1793-E1807 PolarHBondContact NE2-OE1 2.95Å; Q1793-E1807 PolarHBondContact NE2-OE2 2.88Å; C1805-E1807 PolarHBondContact O-N 3.42Å; E1807-R1814 VanDerWaalsContact CD-NH2 3.3Å; E1807-R1814 IonicContact OE1-CZ 3.78Å; E1807-R1814 VanDerWaalsContact OE1-CZ 3.26Å; E1807-R1814 IonicContact OE1-NH1 3.12Å; E1807-R1814 PolarHBondContact OE1-NH1 2.92Å; E1807-R1814 IonicContact OE1-NH2 2.85Å; E1807-R1814 PolarHBondContact OE1-NH2 2.75Å; E1807-R1814 IonicContact OE2-CZ 3.95Å; E1807-R1814 IonicContact OE2-NH1 3.96Å; E1807-R1814 PolarHBondContact OE2-NH1 2.83Å; E1807-R1814 IonicContact OE2-NH2 2.96Å; E1807-R1814 PolarHBondContact OE2-NH2 2.98Å; E1807-A1834 VanDerWaalsContact C-CB 3.48Å; E1807-A1834 HydrophobicContact CG-CB 4.03Å
1808	G	55.2	Low	53.7	Low	10.2 Å²	10.2	53 Å²	53	11%	0.105	30%	0.295	C	S	.	.	S	Bend	trans	96.6	169.1	171	0	0	0	0	0	115.7	L1806 P1810 Y1836 L2033	L1806-G1808 PolarHBondContact O-N 3.19Å; G1808-P1810 WeakPolarHBondContact O-CD 3.38Å; G1808-P1810 VanDerWaalsContact O-N 3.14Å; G1808-Y1836 VanDerWaalsContact C-CZ 3.45Å; G1808-Y1836 VanDerWaalsContact C-OH 3.31Å; G1808-Y1836 WeakPolarHBondContact CA-OH 3.36Å; G1808-Y1836 PolarHBondContact N-OH 2.95Å; G1808-Y1836 VanDerWaalsContact O-CE1 3.25Å; G1808-Y1836 WeakPolarHBondContact O-CE1 3.46Å; G1808-Y1836 PolarHBondContact O-OH 2.92Å; G1808-Y1836 VanDerWaalsContact O-OH 3.05Å; G1808-L2033 VanDerWaalsContact CA-CD2 3.44Å
1809	D	62	Low	54.4	Low	12.2 Å²	12.2	54.1 Å²	54.1	7%	0.065	29%	0.29	C	S	.	.			trans	-59.2	126.8	177.7	179.4	10.3	0	0	0	110.9	M1446 S1811 G1812 I1813 V1835 Y1836 P1837 Y2047	M1446-D1809 WeakPolarHBondContact CE-O 3.16Å; D1809-S1811 VanDerWaalsContact CG-CB 3.49Å; D1809-S1811 VanDerWaalsContact CG-OG 3.22Å; D1809-S1811 PolarHBondContact O-N 3.08Å; D1809-S1811 VanDerWaalsContact O-N 3.13Å; D1809-S1811 VanDerWaalsContact OD1-CB 3.25Å; D1809-S1811 WeakPolarHBondContact OD1-CB 3.38Å; D1809-S1811 PolarHBondContact OD1-N 3.03Å; D1809-S1811 PolarHBondContact OD1-OG 3.02Å; D1809-S1811 VanDerWaalsContact OD1-OG 3.09Å; D1809-S1811 WeakPolarHBondContact OD2-CB 3.35Å; D1809-S1811 PolarHBondContact OD2-N 3.17Å; D1809-S1811 PolarHBondContact OD2-OG 2.96Å; D1809-G1812 VanDerWaalsContact O-CA 3.31Å; D1809-G1812 WeakPolarHBondContact O-CA 3.15Å; D1809-G1812 PolarHBondContact O-N 3.25Å; D1809-G1812 VanDerWaalsContact O-N 3.14Å; D1809-G1812 VanDerWaalsContact OD2-CA 3.29Å; D1809-G1812 WeakPolarHBondContact OD2-CA 3.38Å; D1809-G1812 PolarHBondContact OD2-N 3.46Å; D1809-I1813 PolarHBondContact OD2-N 2.83Å; D1809-I1813 VanDerWaalsContact OD2-N 3.16Å; D1809-V1835 WeakPolarHBondContact CB-O 2.87Å; D1809-Y1836 VanDerWaalsContact CA-CE1 3.44Å; D1809-Y1836 HydrophobicContact CB-CD1 4Å; D1809-Y1836 HydrophobicContact CB-CE1 4.28Å; D1809-P1837 WeakPolarHBondContact OD2-CD 3.38Å; D1809-Y2047 WeakPolarHBondContact O-CE2 3.41Å
1810	P	56.4	Low	54.9	Low	21.4 Å²	21.4	53.4 Å²	53.4	14%	0.139	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.8	176	13.7	-21.4	0	0	0	114.1	Q1445 P1490 P1783 H1786 R1791 G1808 G1812 P2035	Q1445-P1810 WeakPolarHBondContact CG-O 3.42Å; Q1445-P1810 PolarHBondContact NE2-O 3.12Å; P1490-P1810 HydrophobicContact CG-CB 4.07Å; P1490-P1810 HydrophobicContact CG-CG 4.21Å; P1783-P1810 HydrophobicContact CG-CG 3.88Å; H1786-P1810 VanDerWaalsContact NE2-CG 3.3Å; H1786-P1810 WeakPolarHBondContact NE2-CG 3.36Å; R1791-P1810 VanDerWaalsContact NH2-CB 3.33Å; R1791-P1810 PolarHBondContact NH2-O 3.48Å; G1808-P1810 WeakPolarHBondContact O-CD 3.38Å; G1808-P1810 VanDerWaalsContact O-N 3.14Å; P1810-G1812 PolarHBondContact O-N 3.14Å; P1810-G1812 VanDerWaalsContact O-N 3.15Å; P1810-P2035 HydrophobicContact CB-CB 4.07Å; P1810-P2035 HydrophobicContact CB-CG 4.31Å
1811	S	57.1	Low	55	Low	8.4 Å²	8.4	55.5 Å²	55.5	6%	0.059	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-17.6	177.6	-21.6	0	0	0	0	113.2	Q1445 P1508 D1809 I1813 W1890	Q1445-S1811 PolarHBondContact NE2-O 2.93Å; Q1445-S1811 VanDerWaalsContact NE2-O 3.12Å; P1508-S1811 VanDerWaalsContact CD-CB 3.46Å; P1508-S1811 WeakPolarHBondContact CD-OG 3.15Å; P1508-S1811 VanDerWaalsContact CG-OG 3.27Å; P1508-S1811 WeakPolarHBondContact CG-OG 3.44Å; D1809-S1811 VanDerWaalsContact CG-CB 3.49Å; D1809-S1811 VanDerWaalsContact CG-OG 3.22Å; D1809-S1811 PolarHBondContact O-N 3.08Å; D1809-S1811 VanDerWaalsContact O-N 3.13Å; D1809-S1811 VanDerWaalsContact OD1-CB 3.25Å; D1809-S1811 WeakPolarHBondContact OD1-CB 3.38Å; D1809-S1811 PolarHBondContact OD1-N 3.03Å; D1809-S1811 PolarHBondContact OD1-OG 3.02Å; D1809-S1811 VanDerWaalsContact OD1-OG 3.09Å; D1809-S1811 WeakPolarHBondContact OD2-CB 3.35Å; D1809-S1811 PolarHBondContact OD2-N 3.17Å; D1809-S1811 PolarHBondContact OD2-OG 2.96Å; S1811-I1813 VanDerWaalsContact C-N 3.29Å; S1811-I1813 PolarHBondContact O-N 2.94Å; S1811-W1890 VanDerWaalsContact CB-CZ3 3.48Å; S1811-W1890 WeakPolarHBondContact O-CH2 2.77Å; S1811-W1890 WeakPolarHBondContact O-CZ3 3.05Å
1812	G	61.5	Low	54.7	Low	11.8 Å²	11.8	59 Å²	59	12%	0.122	29%	0.288	C	S	.	.			trans	83.3	8	-179.9	0	0	0	0	0	114.6	M1446 D1809 P1810 N1891	M1446-G1812 WeakPolarHBondContact CE-O 3.3Å; M1446-G1812 WeakPolarHBondContact SD-CA 3.49Å; D1809-G1812 VanDerWaalsContact O-CA 3.31Å; D1809-G1812 WeakPolarHBondContact O-CA 3.15Å; D1809-G1812 PolarHBondContact O-N 3.25Å; D1809-G1812 VanDerWaalsContact O-N 3.14Å; D1809-G1812 VanDerWaalsContact OD2-CA 3.29Å; D1809-G1812 WeakPolarHBondContact OD2-CA 3.38Å; D1809-G1812 PolarHBondContact OD2-N 3.46Å; P1810-G1812 PolarHBondContact O-N 3.14Å; P1810-G1812 VanDerWaalsContact O-N 3.15Å; G1812-N1891 WeakPolarHBondContact O-CA 3.18Å; G1812-N1891 WeakPolarHBondContact O-CB 3.2Å; G1812-N1891 PolarHBondContact O-N 3.29Å
1813	I	65.5	Low	53.8	Low	7 Å²	7	65 Å²	65	4%	0.036	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	137.6	-179.9	-65.5	-178.8	0	0	0	110.2	P1508 T1510 F1535 D1809 S1811 W1815 A1834 V1835 Y1836 P1837 L1888 G1889 W1890	P1508-I1813 HydrophobicContact CB-CD1 3.28Å; P1508-I1813 HydrophobicContact CB-CG1 4.27Å; P1508-I1813 HydrophobicContact CG-CD1 3.66Å; P1508-I1813 HydrophobicContact CG-CG1 3.68Å; T1510-I1813 HydrophobicContact CG2-CD1 3.63Å; T1510-I1813 HydrophobicContact CG2-CG1 4.32Å; F1535-I1813 HydrophobicContact CD1-CD1 4.41Å; F1535-I1813 HydrophobicContact CD2-CD1 4.13Å; F1535-I1813 HydrophobicContact CE1-CD1 3.39Å; F1535-I1813 HydrophobicContact CZ-CB 4.48Å; F1535-I1813 HydrophobicContact CZ-CD1 3.81Å; F1535-I1813 HydrophobicContact CZ-CG2 3.91Å; D1809-I1813 PolarHBondContact OD2-N 2.83Å; D1809-I1813 VanDerWaalsContact OD2-N 3.16Å; S1811-I1813 VanDerWaalsContact C-N 3.29Å; S1811-I1813 PolarHBondContact O-N 2.94Å; I1813-W1815 PolarHBondContact O-NE1 2.83Å; I1813-A1834 HydrophobicContact CG2-CB 4.02Å; I1813-V1835 HydrophobicContact CG2-CG2 3.95Å; I1813-V1835 PolarHBondContact O-N 3.12Å; I1813-Y1836 HydrophobicContact CD1-CE1 4.34Å; I1813-Y1836 VanDerWaalsContact CD1-OH 3.29Å; I1813-Y1836 WeakPolarHBondContact CD1-OH 3.29Å; I1813-Y1836 HydrophobicContact CG1-CE1 3.91Å; I1813-P1837 HydrophobicContact CG2-CG 4.3Å; I1813-L1888 HydrophobicContact CG2-CB 4.28Å; I1813-L1888 HydrophobicContact CG2-CD2 3.83Å; I1813-G1889 VanDerWaalsContact CA-O 3.24Å; I1813-G1889 WeakPolarHBondContact CA-O 3.4Å; I1813-W1890 HydrophobicContact CD1-CE3 4.44Å; I1813-W1890 HydrophobicContact CD1-CH2 3.81Å; I1813-W1890 HydrophobicContact CD1-CZ3 3.72Å; I1813-W1890 HydrophobicContact CG1-CD2 4.27Å; I1813-W1890 HydrophobicContact CG1-CE3 3.52Å; I1813-W1890 HydrophobicContact CG1-CH2 3.78Å; I1813-W1890 HydrophobicContact CG1-CZ2 4.48Å; I1813-W1890 HydrophobicContact CG1-CZ3 3.25Å
1814	R	65.8	Low	52.8	Low	43.8 Å²	43.8	64.4 Å²	64.4	17%	0.165	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	153.8	174.9	-65.3	-171.1	179.8	-148.2	-0.5	110.5	M1446 E1807 W1816 G1832 L1833 A1834 V1835 Y1839 L1888 G1889 W1890 N1891 F2050	M1446-R1814 PolarHBondContact SD-NH2 3.05Å; E1807-R1814 VanDerWaalsContact CD-NH2 3.3Å; E1807-R1814 IonicContact OE1-CZ 3.78Å; E1807-R1814 VanDerWaalsContact OE1-CZ 3.26Å; E1807-R1814 IonicContact OE1-NH1 3.12Å; E1807-R1814 PolarHBondContact OE1-NH1 2.92Å; E1807-R1814 IonicContact OE1-NH2 2.85Å; E1807-R1814 PolarHBondContact OE1-NH2 2.75Å; E1807-R1814 IonicContact OE2-CZ 3.95Å; E1807-R1814 IonicContact OE2-NH1 3.96Å; E1807-R1814 PolarHBondContact OE2-NH1 2.83Å; E1807-R1814 IonicContact OE2-NH2 2.96Å; E1807-R1814 PolarHBondContact OE2-NH2 2.98Å; R1814-W1816 HydrophobicContact CB-CZ2 3.98Å; R1814-W1816 HydrophobicContact CG-CZ2 4.43Å; R1814-W1816 WeakPolarHBondContact O-CZ3 3.49Å; R1814-W1816 PolarHBondContact O-NE1 2.9Å; R1814-G1832 VanDerWaalsContact CD-O 3.3Å; R1814-G1832 WeakPolarHBondContact CD-O 3.27Å; R1814-G1832 PolarHBondContact NH1-O 2.84Å; R1814-G1832 VanDerWaalsContact NH1-O 3.11Å; R1814-L1833 CarbonylContact C-O 3.56Å; R1814-L1833 VanDerWaalsContact CA-O 3.25Å; R1814-L1833 WeakPolarHBondContact CA-O 3.38Å; R1814-L1833 WeakPolarHBondContact CB-O 3.35Å; R1814-A1834 HydrophobicContact CG-CB 4.38Å; R1814-V1835 HydrophobicContact CB-CG2 4.05Å; R1814-V1835 PolarHBondContact N-O 2.85Å; R1814-V1835 WeakPolarHBondContact O-CG2 3.15Å; R1814-V1835 PolarHBondContact O-N 3.02Å; R1814-V1835 VanDerWaalsContact O-O 3.12Å; R1814-Y1839 PolarHBondContact NH2-OH 3.17Å; R1814-L1888 HydrophobicContact CB-CD1 3.63Å; R1814-L1888 HydrophobicContact CB-CG 4.15Å; R1814-L1888 HydrophobicContact CG-CD1 4.45Å; R1814-L1888 CarbonylContact O-C 3.5Å; R1814-G1889 PolarHBondContact N-O 2.86Å; R1814-G1889 PolarHBondContact O-N 3.1Å; R1814-G1889 VanDerWaalsContact O-O 3.06Å; R1814-W1890 HydrophobicContact CG-CD2 4.47Å; R1814-W1890 HydrophobicContact CG-CE3 3.86Å; R1814-W1890 HydrophobicContact CG-CH2 3.73Å; R1814-W1890 HydrophobicContact CG-CZ2 4.32Å; R1814-W1890 HydrophobicContact CG-CZ3 3.47Å; R1814-W1890 VanDerWaalsContact CG-CZ3 3.47Å; R1814-N1891 VanDerWaalsContact CD-CG 3.44Å; R1814-N1891 HydrophobicContact CG-CB 4.13Å; R1814-N1891 PolarHBondContact NE-ND2 3.34Å; R1814-F2050 PolarHBondContact NH2-O 2.96Å
1815	W	66.3	Low	51.5	Low	37 Å²	37	69.3 Å²	69.3	14%	0.14	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.9	170.6	-165.5	77.6	0	0	0	109.9	Y1634 I1699 I1813 N1817 G1832 L1833 A1834 V1835 W1850 P1882 E1883 G1886 H1887 L1888 G1889 N1891	Y1634-W1815 HydrophobicContact CD2-CH2 4.26Å; Y1634-W1815 HydrophobicContact CE1-CH2 4.42Å; Y1634-W1815 AromaticContact CE2-CH2 3.92Å; Y1634-W1815 HydrophobicContact CE2-CH2 4.11Å; Y1634-W1815 HydrophobicContact CE2-CZ2 4.5Å; I1699-W1815 HydrophobicContact CD1-CZ2 4.15Å; I1813-W1815 PolarHBondContact O-NE1 2.83Å; W1815-N1817 HydrophobicContact CH2-CB 3.99Å; W1815-N1817 HydrophobicContact CZ2-CB 4.27Å; W1815-G1832 VanDerWaalsContact CZ3-O 3.26Å; W1815-G1832 WeakPolarHBondContact CZ3-O 3.29Å; W1815-G1832 CarbonylContact O-C 3.56Å; W1815-G1832 VanDerWaalsContact O-CA 3.27Å; W1815-G1832 WeakPolarHBondContact O-CA 3.29Å; W1815-L1833 CarbonylContact C-O 3.59Å; W1815-L1833 VanDerWaalsContact CA-O 3.3Å; W1815-L1833 WeakPolarHBondContact CA-O 3.38Å; W1815-L1833 HydrophobicContact CB-CB 4.37Å; W1815-L1833 PolarHBondContact N-O 2.78Å; W1815-L1833 PolarHBondContact O-N 3Å; W1815-A1834 HydrophobicContact CZ2-CB 4.42Å; W1815-V1835 HydrophobicContact CB-CB 4.49Å; W1815-V1835 HydrophobicContact CB-CG1 3.98Å; W1815-V1835 HydrophobicContact CB-CG2 4.02Å; W1815-W1850 HydrophobicContact CB-CH2 4.32Å; W1815-W1850 HydrophobicContact CB-CZ2 4.19Å; W1815-W1850 AromaticContact CD1-CE2 3.63Å; W1815-W1850 AromaticContact CD1-CZ2 3.68Å; W1815-W1850 AromaticContact CD1-NE1 3.52Å; W1815-W1850 AromaticContact CD2-CE2 3.93Å; W1815-W1850 HydrophobicContact CD2-CH2 4.18Å; W1815-W1850 AromaticContact CD2-CZ2 3.55Å; W1815-W1850 HydrophobicContact CD2-CZ2 3.82Å; W1815-W1850 VanDerWaalsContact CD2-CZ2 3.44Å; W1815-W1850 AromaticContact CD2-NE1 3.76Å; W1815-W1850 AromaticContact CE2-CZ2 4Å; W1815-W1850 AromaticContact CE3-CE2 3.73Å; W1815-W1850 HydrophobicContact CE3-CH2 4.49Å; W1815-W1850 AromaticContact CE3-CZ2 3.69Å; W1815-W1850 HydrophobicContact CE3-CZ2 3.69Å; W1815-W1850 AromaticContact CE3-NE1 3.36Å; W1815-W1850 HydrophobicContact CG-CH2 4.11Å; W1815-W1850 AromaticContact CG-CZ2 3.83Å; W1815-W1850 HydrophobicContact CG-CZ2 3.99Å; W1815-W1850 HydrophobicContact CH2-CZ2 4.4Å; W1815-W1850 HydrophobicContact CZ2-CZ2 4.44Å; W1815-W1850 AromaticContact CZ3-CZ2 3.91Å; W1815-W1850 HydrophobicContact CZ3-CZ2 3.91Å; W1815-W1850 AromaticContact CZ3-NE1 3.53Å; W1815-W1850 VanDerWaalsContact CZ3-NE1 3.35Å; W1815-W1850 AromaticContact NE1-CZ2 3.76Å; W1815-P1882 HydrophobicContact CD2-CB 4.39Å; W1815-P1882 HydrophobicContact CE3-CB 4.27Å; W1815-P1882 HydrophobicContact CH2-CB 3.34Å; W1815-P1882 HydrophobicContact CH2-CG 4.39Å; W1815-P1882 HydrophobicContact CZ2-CB 3.33Å; W1815-P1882 HydrophobicContact CZ3-CB 3.93Å; W1815-E1883 WeakPolarHBondContact CZ2-O 2.99Å; W1815-E1883 PolarHBondContact NE1-O 2.89Å; W1815-G1886 VanDerWaalsContact CH2-O 3.31Å; W1815-G1886 WeakPolarHBondContact CH2-O 3.16Å; W1815-G1886 VanDerWaalsContact CZ2-O 3.26Å; W1815-G1886 WeakPolarHBondContact CZ2-O 3.27Å; W1815-G1886 VanDerWaalsContact NE1-C 3.28Å; W1815-G1886 PolarHBondContact NE1-O 2.86Å; W1815-G1886 VanDerWaalsContact NE1-O 3.08Å; W1815-H1887 WeakPolarHBondContact CA-O 3.43Å; W1815-L1888 HydrophobicContact CB-CD2 4.29Å; W1815-L1888 HydrophobicContact CE3-CD2 4.06Å; W1815-L1888 HydrophobicContact CE3-CG 3.87Å; W1815-L1888 HydrophobicContact CZ3-CG 4Å; W1815-G1889 PolarHBondContact N-O 2.8Å; W1815-G1889 CarbonylContact O-C 3.49Å; W1815-G1889 WeakPolarHBondContact O-CA 3.38Å; W1815-G1889 PolarHBondContact O-N 3.21Å; W1815-N1891 HydrophobicContact CD2-CB 3.64Å; W1815-N1891 HydrophobicContact CE3-CB 4.31Å; W1815-N1891 HydrophobicContact CG-CB 3.69Å; W1815-N1891 VanDerWaalsContact CH2-ND2 3.35Å; W1815-N1891 WeakPolarHBondContact CH2-ND2 3.3Å; W1815-N1891 HydrophobicContact CZ2-CB 4.19Å; W1815-N1891 WeakPolarHBondContact CZ2-ND2 3.17Å; W1815-N1891 WeakPolarHBondContact CZ3-ND2 3.35Å
1816	W	62.8	Low	50.2	Low	47.8 Å²	47.8	73.5 Å²	73.5	18%	0.181	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	136	175.7	3.8	67.8	0	0	0	110.6	Q1532 S1533 R1814 N1818 G1832 L1833 V1835 W1850 E1883 G1886 H1887 L1888 G1889 W1890 N1891 K1893	Q1532-W1816 HydrophobicContact CG-CH2 4.25Å; S1533-W1816 VanDerWaalsContact O-CH2 3.29Å; S1533-W1816 WeakPolarHBondContact O-CH2 2.95Å; S1533-W1816 WeakPolarHBondContact O-CZ2 3.15Å; R1814-W1816 HydrophobicContact CB-CZ2 3.98Å; R1814-W1816 HydrophobicContact CG-CZ2 4.43Å; R1814-W1816 WeakPolarHBondContact O-CZ3 3.49Å; R1814-W1816 PolarHBondContact O-NE1 2.9Å; W1816-N1818 VanDerWaalsContact CD1-OD1 3.29Å; W1816-N1818 WeakPolarHBondContact CH2-OD1 3.47Å; W1816-N1818 PolarHBondContact NE1-OD1 3.36Å; W1816-G1832 VanDerWaalsContact CZ3-N 3.28Å; W1816-G1832 CarbonylContact O-C 3.53Å; W1816-G1832 WeakPolarHBondContact O-CA 3.31Å; W1816-L1833 HydrophobicContact CB-CB 4.36Å; W1816-L1833 PolarHBondContact N-O 3.34Å; W1816-L1833 PolarHBondContact O-N 2.77Å; W1816-V1835 HydrophobicContact CB-CG1 4.15Å; W1816-V1835 HydrophobicContact CB-CG2 4.27Å; W1816-W1850 HydrophobicContact CB-CZ2 4.19Å; W1816-W1850 AromaticContact CD2-CE2 3.81Å; W1816-W1850 AromaticContact CD2-CZ2 3.73Å; W1816-W1850 HydrophobicContact CD2-CZ2 3.73Å; W1816-W1850 AromaticContact CD2-NE1 3.44Å; W1816-W1850 AromaticContact CE2-CZ2 3.99Å; W1816-W1850 AromaticContact CE3-CD1 3.78Å; W1816-W1850 AromaticContact CE3-CE2 3.82Å; W1816-W1850 HydrophobicContact CE3-CZ2 4.22Å; W1816-W1850 AromaticContact CE3-NE1 2.97Å; W1816-W1850 AromaticContact CG-CZ2 3.73Å; W1816-W1850 HydrophobicContact CG-CZ2 3.73Å; W1816-W1850 AromaticContact CH2-NE1 3.92Å; W1816-W1850 AromaticContact CZ3-CD1 3.96Å; W1816-W1850 AromaticContact CZ3-NE1 3.24Å; W1816-E1883 WeakPolarHBondContact CZ2-O 3.48Å; W1816-E1883 PolarHBondContact NE1-O 3.01Å; W1816-G1886 WeakPolarHBondContact CH2-O 3.25Å; W1816-G1886 VanDerWaalsContact CZ2-C 3.42Å; W1816-G1886 VanDerWaalsContact CZ2-O 3.27Å; W1816-G1886 WeakPolarHBondContact CZ2-O 3.34Å; W1816-G1886 CarbonylContact O-C 3.54Å; W1816-G1886 WeakPolarHBondContact O-CA 3.28Å; W1816-H1887 PolarHBondContact N-O 2.94Å; W1816-H1887 PolarHBondContact O-N 3.08Å; W1816-H1887 VanDerWaalsContact O-N 3.07Å; W1816-L1888 HydrophobicContact CE3-CB 4.08Å; W1816-L1888 HydrophobicContact CE3-CD1 4.35Å; W1816-L1888 HydrophobicContact CZ3-CB 4.15Å; W1816-G1889 WeakPolarHBondContact CZ3-O 3.47Å; W1816-G1889 PolarHBondContact NE1-O 3.14Å; W1816-W1890 WeakPolarHBondContact CH2-O 3.45Å; W1816-N1891 HydrophobicContact CD2-CB 4.03Å; W1816-N1891 HydrophobicContact CE3-CB 3.69Å; W1816-N1891 HydrophobicContact CH2-CB 4.15Å; W1816-N1891 HydrophobicContact CZ2-CB 3.66Å; W1816-N1891 HydrophobicContact CZ3-CB 4.07Å; W1816-N1891 VanDerWaalsContact CZ3-N 3.35Å; W1816-K1893 HydrophobicContact CH2-CD 4.4Å; W1816-K1893 HydrophobicContact CH2-CG 3.9Å; W1816-K1893 HydrophobicContact CZ3-CG 4.26Å
1817	N	57.5	Low	48.9	Very low	47.4 Å²	47.4	83 Å²	83	25%	0.253	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	138.2	174.7	-136.4	-0.4	0	0	0	110.5	W1815 Q1819 G1832 E1883 D1885 G1886 H1887	W1815-N1817 HydrophobicContact CH2-CB 3.99Å; W1815-N1817 HydrophobicContact CZ2-CB 4.27Å; N1817-Q1819 VanDerWaalsContact C-N 3.28Å; N1817-Q1819 PolarHBondContact O-N 2.97Å; N1817-Q1819 VanDerWaalsContact O-N 3.14Å; N1817-Q1819 WeakPolarHBondContact OD1-CG 3.1Å; N1817-Q1819 PolarHBondContact OD1-N 2.97Å; N1817-G1832 WeakPolarHBondContact OD1-CA 3.29Å; N1817-E1883 HydrophobicContact CB-CB 4.39Å; N1817-E1883 HydrophobicContact CB-CG 4.24Å; N1817-E1883 VanDerWaalsContact CG-CD 3.47Å; N1817-E1883 WeakPolarHBondContact ND2-CB 3.36Å; N1817-E1883 WeakPolarHBondContact ND2-CG 3.44Å; N1817-E1883 PolarHBondContact ND2-O 2.95Å; N1817-E1883 PolarHBondContact ND2-OE1 3.23Å; N1817-E1883 VanDerWaalsContact ND2-OE1 3.12Å; N1817-E1883 PolarHBondContact ND2-OE2 3.03Å; N1817-E1883 WeakPolarHBondContact OD1-CB 3.47Å; N1817-E1883 WeakPolarHBondContact OD1-CG 3.15Å; N1817-E1883 PolarHBondContact OD1-N 3.08Å; N1817-E1883 VanDerWaalsContact OD1-N 3.12Å; N1817-E1883 PolarHBondContact OD1-OE2 3.11Å; N1817-D1885 CarbonylContact C-O 3.58Å; N1817-D1885 VanDerWaalsContact CA-O 3.23Å; N1817-D1885 WeakPolarHBondContact CA-O 3.46Å; N1817-D1885 PolarHBondContact OD1-O 2.92Å; N1817-G1886 WeakPolarHBondContact O-CA 3.42Å; N1817-H1887 PolarHBondContact N-O 3.43Å; N1817-H1887 PolarHBondContact O-N 3.43Å; N1817-H1887 VanDerWaalsContact O-N 3.15Å
1818	N	48.9	Very low	47.8	Very low	57 Å²	57	85.1 Å²	85.1	31%	0.305	42%	0.424	S	S	.	.			trans	-79.9	-3.7	-178.4	-84.6	-3.8	0	0	0	113.9	Q1532 W1816 Q1820 P1882 E1883 D1885 H1887 K1893	Q1532-N1818 PolarHBondContact OE1-ND2 2.68Å; Q1532-N1818 PolarHBondContact OE1-OD1 3.35Å; W1816-N1818 VanDerWaalsContact CD1-OD1 3.29Å; W1816-N1818 WeakPolarHBondContact CH2-OD1 3.47Å; W1816-N1818 PolarHBondContact NE1-OD1 3.36Å; N1818-Q1820 PolarHBondContact O-N 3.05Å; N1818-Q1820 VanDerWaalsContact O-N 3.1Å; N1818-P1882 WeakPolarHBondContact OD1-CA 3.24Å; N1818-E1883 HydrophobicContact CB-CB 4.07Å; N1818-E1883 HydrophobicContact CB-CG 3.9Å; N1818-E1883 PolarHBondContact N-OE2 3.32Å; N1818-E1883 PolarHBondContact OD1-N 2.79Å; N1818-D1885 HydrophobicContact CB-CB 4.48Å; N1818-D1885 VanDerWaalsContact CG-O 3.32Å; N1818-D1885 PolarHBondContact N-O 3.41Å; N1818-D1885 PolarHBondContact ND2-O 3.05Å; N1818-D1885 PolarHBondContact OD1-O 3.43Å; N1818-H1887 VanDerWaalsContact CG-CE1 3.44Å; N1818-H1887 PolarHBondContact ND2-CE1 3.33Å; N1818-H1887 PolarHBondContact ND2-NE2 2.79Å; N1818-H1887 PolarHBondContact OD1-CD2 2.9Å; N1818-H1887 PolarHBondContact OD1-CE1 3.22Å; N1818-H1887 PolarHBondContact OD1-ND1 2.88Å; N1818-H1887 PolarHBondContact OD1-NE2 2.81Å; N1818-K1893 PolarHBondContact O-NZ 2.83Å; N1818-K1893 WeakPolarHBondContact OD1-CE 3.22Å; N1818-K1893 PolarHBondContact OD1-NZ 2.92Å
1819	Q	45.1	Very low	46.8	Very low	113.4 Å²	113.4	90.1 Å²	90.1	53%	0.53	45%	0.448	S	S	.	.			trans	-81.7	125.5	-180	-72.4	-173.8	-4.6	0	0	112.7	N1817 Q1821 E1883 D1885	N1817-Q1819 VanDerWaalsContact C-N 3.28Å; N1817-Q1819 PolarHBondContact O-N 2.97Å; N1817-Q1819 VanDerWaalsContact O-N 3.14Å; N1817-Q1819 WeakPolarHBondContact OD1-CG 3.1Å; N1817-Q1819 PolarHBondContact OD1-N 2.97Å; Q1819-Q1821 HydrophobicContact CB-CG 4.28Å; Q1819-Q1821 PolarHBondContact O-N 3.13Å; Q1819-Q1821 VanDerWaalsContact O-N 3.14Å; Q1819-E1883 VanDerWaalsContact CB-OE1 3.28Å; Q1819-E1883 WeakPolarHBondContact CB-OE1 3.46Å; Q1819-E1883 VanDerWaalsContact CG-OE1 3.23Å; Q1819-E1883 WeakPolarHBondContact CG-OE1 3.44Å; Q1819-E1883 PolarHBondContact N-OE2 3.34Å; Q1819-E1883 VanDerWaalsContact N-OE2 3.15Å; Q1819-E1883 PolarHBondContact NE2-OE1 2.82Å; Q1819-E1883 PolarHBondContact OE1-OE1 3.45Å; Q1819-E1883 PolarHBondContact OE1-OE2 3.03Å; Q1819-D1885 PolarHBondContact NE2-OD2 3.36Å
1820	Q	42.4	Very low	45.8	Very low	151.2 Å²	151.2	93.7 Å²	93.7	71%	0.707	47%	0.474	S	S	*	.			trans	-69	99.7	166	-65.9	-176.9	-3.5	0	0	109.5	N1818 W1822	N1818-Q1820 PolarHBondContact O-N 3.05Å; N1818-Q1820 VanDerWaalsContact O-N 3.1Å; Q1820-W1822 VanDerWaalsContact C-N 3.31Å; Q1820-W1822 VanDerWaalsContact CB-NE1 3.33Å; Q1820-W1822 PolarHBondContact O-N 3.03Å; Q1820-W1822 VanDerWaalsContact O-N 3.09Å
1821	Q	36.7	Very low	45.6	Very low	150.4 Å²	150.4	96.9 Å²	96.9	70%	0.703	50%	0.497	S	S	*	.			trans	-72.7	69.2	174	-77.4	-175.3	-11.9	0	0	111.6	Q1819 N1829 N2027	Q1819-Q1821 HydrophobicContact CB-CG 4.28Å; Q1819-Q1821 PolarHBondContact O-N 3.13Å; Q1819-Q1821 VanDerWaalsContact O-N 3.14Å; Q1821-N1829 PolarHBondContact OE1-ND2 2.58Å; Q1821-N2027 PolarHBondContact OE1-ND2 3.27Å
1822	W	31.2	Very low	45.6	Very low	201.8 Å²	201.8	97.7 Å²	97.7	76%	0.764	51%	0.507	S	S	*	.			trans	-92.9	113.3	168.2	-69.5	68.3	0	0	0	109.7	Q1820 V1897	Q1820-W1822 VanDerWaalsContact C-N 3.31Å; Q1820-W1822 VanDerWaalsContact CB-NE1 3.33Å; Q1820-W1822 PolarHBondContact O-N 3.03Å; Q1820-W1822 VanDerWaalsContact O-N 3.09Å; W1822-V1897 HydrophobicContact CH2-CB 3.9Å; W1822-V1897 HydrophobicContact CH2-CG2 4.36Å; W1822-V1897 HydrophobicContact CZ2-CB 4.18Å; W1822-V1897 HydrophobicContact CZ2-CG2 4.17Å
1823	M	28.9	Very low	45.8	Very low	185.4 Å²	185.4	99 Å²	99	91%	0.913	51%	0.51	S	S	*	.	S	Bend	trans	102.2	114.2	173.9	-60.1	-101.8	-147.5	0	0	113.5
1824	G	31.6	Very low	46.1	Very low	64.2 Å²	64.2	99.3 Å²	99.3	66%	0.662	51%	0.514	S	S	*	.			trans	164.3	117.9	172.5	0	0	0	0	0	114.6	D1826	G1824-D1826 VanDerWaalsContact C-N 3.28Å; G1824-D1826 PolarHBondContact O-N 3.01Å
1825	T	31.6	Very low	46.8	Very low	136 Å²	136	97.3 Å²	97.3	83%	0.834	51%	0.507	S	S	*	.	S	Bend	trans	-28.2	13.6	176.8	42.7	0	0	0	0	118	R1827	T1825-R1827 VanDerWaalsContact C-N 3.33Å; T1825-R1827 PolarHBondContact O-N 2.81Å
1826	D	30.4	Very low	47.7	Very low	127.4 Å²	127.4	96.1 Å²	96.1	68%	0.681	50%	0.503	S	S	*	.			trans	-101.3	76.4	174.6	-79	-17.2	0	0	0	112.2	G1824 I1828 N1829	G1824-D1826 VanDerWaalsContact C-N 3.28Å; G1824-D1826 PolarHBondContact O-N 3.01Å; D1826-I1828 PolarHBondContact O-N 2.94Å; D1826-I1828 VanDerWaalsContact O-N 3.17Å; D1826-N1829 PolarHBondContact O-N 3.28Å
1827	R	32.6	Very low	48.8	Very low	207.8 Å²	207.8	94.1 Å²	94.1	78%	0.784	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	6.9	-175.5	-72.6	-171.2	177.8	-141.1	-2.4	115.7	T1825 V1897 N1902	T1825-R1827 VanDerWaalsContact C-N 3.33Å; T1825-R1827 PolarHBondContact O-N 2.81Å; R1827-V1897 PolarHBondContact NH1-O 3.07Å; R1827-V1897 VanDerWaalsContact NH1-O 3.16Å; R1827-N1902 VanDerWaalsContact NH2-CG 3.3Å; R1827-N1902 PolarHBondContact NH2-ND2 3.35Å; R1827-N1902 PolarHBondContact NH2-OD1 3.49Å
1828	I	34.9	Very low	50.3	Low	145.8 Å²	145.8	92.1 Å²	92.1	75%	0.748	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-23.1	-166.3	-60.9	176.1	0	0	0	113.3	D1826 S1830 S1831	D1826-I1828 PolarHBondContact O-N 2.94Å; D1826-I1828 VanDerWaalsContact O-N 3.17Å; I1828-S1830 PolarHBondContact O-N 3Å; I1828-S1831 PolarHBondContact O-OG 2.86Å
1829	N	34.1	Very low	52.1	Low	115.2 Å²	115.2	90.3 Å²	90.3	62%	0.616	47%	0.474	S	S	*	.			trans	-106.8	13	-165.6	-75.1	-4.1	0	0	0	116.9	Q1821 D1826 S1831 I1880	Q1821-N1829 PolarHBondContact OE1-ND2 2.58Å; D1826-N1829 PolarHBondContact O-N 3.28Å; N1829-S1831 VanDerWaalsContact C-N 3.32Å; N1829-S1831 PolarHBondContact O-N 3.05Å; N1829-S1831 VanDerWaalsContact O-N 3.1Å; N1829-I1880 HydrophobicContact CB-CD1 3.37Å; N1829-I1880 HydrophobicContact CB-CG1 4.46Å; N1829-I1880 WeakPolarHBondContact O-CD1 3.36Å; N1829-I1880 WeakPolarHBondContact OD1-CD1 3.27Å
1830	S	40.8	Very low	53.9	Low	86.6 Å²	86.6	88.9 Å²	88.9	61%	0.606	46%	0.464	S	S	*	.			trans	-84.8	53.6	175.2	52.7	0	0	0	0	112.3	I1828 G1832	I1828-S1830 PolarHBondContact O-N 3Å; S1830-G1832 VanDerWaalsContact C-N 3.32Å; S1830-G1832 PolarHBondContact O-N 3.1Å
1831	S	51	Low	55.5	Low	90.2 Å²	90.2	84.2 Å²	84.2	63%	0.631	45%	0.451	S	S	*	.			trans	-80.8	103.7	172.1	54.6	0	0	0	0	109.6	I1828 N1829 L1833	I1828-S1831 PolarHBondContact O-OG 2.86Å; N1829-S1831 VanDerWaalsContact C-N 3.32Å; N1829-S1831 PolarHBondContact O-N 3.05Å; N1829-S1831 VanDerWaalsContact O-N 3.1Å; S1831-L1833 PolarHBondContact O-N 3.26Å
1832	G	57.4	Low	57	Low	25.2 Å²	25.2	82.2 Å²	82.2	26%	0.26	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-56.3	140.6	174.8	0	0	0	0	0	111.2	R1814 W1815 W1816 N1817 S1830 A1834	R1814-G1832 VanDerWaalsContact CD-O 3.3Å; R1814-G1832 WeakPolarHBondContact CD-O 3.27Å; R1814-G1832 PolarHBondContact NH1-O 2.84Å; R1814-G1832 VanDerWaalsContact NH1-O 3.11Å; W1815-G1832 VanDerWaalsContact CZ3-O 3.26Å; W1815-G1832 WeakPolarHBondContact CZ3-O 3.29Å; W1815-G1832 CarbonylContact O-C 3.56Å; W1815-G1832 VanDerWaalsContact O-CA 3.27Å; W1815-G1832 WeakPolarHBondContact O-CA 3.29Å; W1816-G1832 VanDerWaalsContact CZ3-N 3.28Å; W1816-G1832 CarbonylContact O-C 3.53Å; W1816-G1832 WeakPolarHBondContact O-CA 3.31Å; N1817-G1832 WeakPolarHBondContact OD1-CA 3.29Å; S1830-G1832 VanDerWaalsContact C-N 3.32Å; S1830-G1832 PolarHBondContact O-N 3.1Å; G1832-A1834 PolarHBondContact O-N 3.07Å
1833	L	66.7	Low	59	Low	37.8 Å²	37.8	73.8 Å²	73.8	20%	0.198	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	130.1	178.2	-164.2	80.4	0	0	0	109.9	N1631 F1632 R1814 W1815 W1816 S1831 V1835 W1850 A1852 L1879 P1882	N1631-L1833 HydrophobicContact CB-CD1 4.18Å; N1631-L1833 HydrophobicContact CB-CD2 4.44Å; F1632-L1833 HydrophobicContact CB-CD2 4.47Å; F1632-L1833 HydrophobicContact CD2-CD1 4.24Å; F1632-L1833 HydrophobicContact CD2-CD2 3.84Å; F1632-L1833 HydrophobicContact CE2-CD1 3.97Å; F1632-L1833 HydrophobicContact CE2-CD2 4.29Å; F1632-L1833 HydrophobicContact CG-CD2 4.39Å; R1814-L1833 CarbonylContact C-O 3.56Å; R1814-L1833 VanDerWaalsContact CA-O 3.25Å; R1814-L1833 WeakPolarHBondContact CA-O 3.38Å; R1814-L1833 WeakPolarHBondContact CB-O 3.35Å; W1815-L1833 CarbonylContact C-O 3.59Å; W1815-L1833 VanDerWaalsContact CA-O 3.3Å; W1815-L1833 WeakPolarHBondContact CA-O 3.38Å; W1815-L1833 HydrophobicContact CB-CB 4.37Å; W1815-L1833 PolarHBondContact N-O 2.78Å; W1815-L1833 PolarHBondContact O-N 3Å; W1816-L1833 HydrophobicContact CB-CB 4.36Å; W1816-L1833 PolarHBondContact N-O 3.34Å; W1816-L1833 PolarHBondContact O-N 2.77Å; S1831-L1833 PolarHBondContact O-N 3.26Å; L1833-V1835 VanDerWaalsContact C-N 3.35Å; L1833-V1835 HydrophobicContact CB-CG1 4.41Å; L1833-V1835 HydrophobicContact CB-CG2 4.26Å; L1833-V1835 HydrophobicContact CD2-CG1 4.27Å; L1833-V1835 HydrophobicContact CD2-CG2 4.01Å; L1833-V1835 HydrophobicContact CG-CG1 4.1Å; L1833-V1835 HydrophobicContact CG-CG2 4.07Å; L1833-V1835 WeakPolarHBondContact O-CG2 3.45Å; L1833-V1835 PolarHBondContact O-N 3.09Å; L1833-W1850 HydrophobicContact CD2-CH2 4.17Å; L1833-W1850 HydrophobicContact CD2-CZ3 4.3Å; L1833-A1852 HydrophobicContact CD1-CB 4.16Å; L1833-A1852 HydrophobicContact CD2-CB 3.82Å; L1833-A1852 VanDerWaalsContact CD2-CB 3.47Å; L1833-A1852 HydrophobicContact CG-CB 3.88Å; L1833-L1879 HydrophobicContact CD1-CD1 4.02Å; L1833-L1879 HydrophobicContact CD1-CD2 4.27Å; L1833-L1879 HydrophobicContact CD2-CD1 4.21Å; L1833-L1879 HydrophobicContact CD2-CD2 4.22Å; L1833-P1882 HydrophobicContact CD2-CB 4.12Å; L1833-P1882 HydrophobicContact CD2-CG 3.81Å
1834	A	71.4	Confident	60.8	Low	14.8 Å²	14.8	67.8 Å²	67.8	12%	0.122	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	113.1	176	0	0	0	0	0	110.3	E1807 I1813 R1814 W1815 G1832 Y1836 A1852 V1853	E1807-A1834 VanDerWaalsContact C-CB 3.48Å; E1807-A1834 HydrophobicContact CG-CB 4.03Å; I1813-A1834 HydrophobicContact CG2-CB 4.02Å; R1814-A1834 HydrophobicContact CG-CB 4.38Å; W1815-A1834 HydrophobicContact CZ2-CB 4.42Å; G1832-A1834 PolarHBondContact O-N 3.07Å; A1834-Y1836 HydrophobicContact CB-CE2 4.32Å; A1834-A1852 CarbonylContact O-C 3.43Å; A1834-A1852 VanDerWaalsContact O-CA 3.25Å; A1834-A1852 WeakPolarHBondContact O-CA 3.37Å; A1834-A1852 WeakPolarHBondContact O-CB 3.19Å; A1834-V1853 WeakPolarHBondContact CB-O 3.49Å; A1834-V1853 PolarHBondContact O-N 2.94Å; A1834-V1853 VanDerWaalsContact O-N 3.15Å
1835	V	80	Confident	62.7	Low	1.2 Å²	1.2	67 Å²	67	1%	0.007	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	146.2	-174.9	-74.7	0	0	0	0	111.6	D1809 I1813 R1814 W1815 W1816 L1833 W1850 I1851 A1852 L1888	D1809-V1835 WeakPolarHBondContact CB-O 2.87Å; I1813-V1835 HydrophobicContact CG2-CG2 3.95Å; I1813-V1835 PolarHBondContact O-N 3.12Å; R1814-V1835 HydrophobicContact CB-CG2 4.05Å; R1814-V1835 PolarHBondContact N-O 2.85Å; R1814-V1835 WeakPolarHBondContact O-CG2 3.15Å; R1814-V1835 PolarHBondContact O-N 3.02Å; R1814-V1835 VanDerWaalsContact O-O 3.12Å; W1815-V1835 HydrophobicContact CB-CB 4.49Å; W1815-V1835 HydrophobicContact CB-CG1 3.98Å; W1815-V1835 HydrophobicContact CB-CG2 4.02Å; W1816-V1835 HydrophobicContact CB-CG1 4.15Å; W1816-V1835 HydrophobicContact CB-CG2 4.27Å; L1833-V1835 VanDerWaalsContact C-N 3.35Å; L1833-V1835 HydrophobicContact CB-CG1 4.41Å; L1833-V1835 HydrophobicContact CB-CG2 4.26Å; L1833-V1835 HydrophobicContact CD2-CG1 4.27Å; L1833-V1835 HydrophobicContact CD2-CG2 4.01Å; L1833-V1835 HydrophobicContact CG-CG1 4.1Å; L1833-V1835 HydrophobicContact CG-CG2 4.07Å; L1833-V1835 WeakPolarHBondContact O-CG2 3.45Å; L1833-V1835 PolarHBondContact O-N 3.09Å; V1835-W1850 HydrophobicContact CB-CB 4.16Å; V1835-W1850 HydrophobicContact CB-CD2 4.03Å; V1835-W1850 HydrophobicContact CB-CE3 4.01Å; V1835-W1850 HydrophobicContact CB-CG 4.05Å; V1835-W1850 HydrophobicContact CG1-CB 3.56Å; V1835-W1850 HydrophobicContact CG1-CD2 3.72Å; V1835-W1850 HydrophobicContact CG1-CE3 3.47Å; V1835-W1850 VanDerWaalsContact CG1-CE3 3.4Å; V1835-W1850 HydrophobicContact CG1-CG 4.11Å; V1835-W1850 VanDerWaalsContact CG1-CG 3.49Å; V1835-W1850 HydrophobicContact CG1-CH2 4.25Å; V1835-W1850 HydrophobicContact CG1-CZ2 4.4Å; V1835-W1850 HydrophobicContact CG1-CZ3 3.69Å; V1835-W1850 HydrophobicContact CG2-CB 4.33Å; V1835-W1850 HydrophobicContact CG2-CD2 4.35Å; V1835-W1850 HydrophobicContact CG2-CE3 3.9Å; V1835-W1850 HydrophobicContact CG2-CG 4.26Å; V1835-W1850 HydrophobicContact CG2-CH2 4.5Å; V1835-W1850 HydrophobicContact CG2-CZ3 4Å; V1835-I1851 CarbonylContact C-O 3.51Å; V1835-I1851 WeakPolarHBondContact CA-O 3.05Å; V1835-A1852 HydrophobicContact CG1-CB 4.26Å; V1835-A1852 HydrophobicContact CG2-CB 4.25Å; V1835-L1888 HydrophobicContact CG1-CD2 3.76Å; V1835-L1888 HydrophobicContact CG2-CD1 3.42Å; V1835-L1888 VanDerWaalsContact CG2-CD1 3.42Å; V1835-L1888 HydrophobicContact CG2-CD2 3.98Å
1836	Y	85.5	Confident	64.8	Low	12.2 Å²	12.2	61.6 Å²	61.6	5%	0.048	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.9	175.7	-62.3	-90.2	0	0	0	109.5	I1782 L1806 G1808 D1809 I1813 A1834 W1850 I1851 V1853	I1782-Y1836 HydrophobicContact CB-CE1 4.33Å; I1782-Y1836 HydrophobicContact CD1-CD1 4.15Å; I1782-Y1836 HydrophobicContact CD1-CD2 3.73Å; I1782-Y1836 HydrophobicContact CD1-CE1 4Å; I1782-Y1836 HydrophobicContact CD1-CE2 3.58Å; I1782-Y1836 HydrophobicContact CD1-CG 4.02Å; I1782-Y1836 HydrophobicContact CG1-CD1 3.82Å; I1782-Y1836 HydrophobicContact CG1-CD2 4.3Å; I1782-Y1836 HydrophobicContact CG1-CE1 3.78Å; I1782-Y1836 HydrophobicContact CG1-CE2 4.28Å; I1782-Y1836 HydrophobicContact CG1-CG 4.08Å; I1782-Y1836 HydrophobicContact CG2-CE1 4.02Å; L1806-Y1836 VanDerWaalsContact CD2-OH 3.24Å; L1806-Y1836 WeakPolarHBondContact CD2-OH 2.98Å; L1806-Y1836 WeakPolarHBondContact CG-OH 3.29Å; G1808-Y1836 VanDerWaalsContact C-CZ 3.45Å; G1808-Y1836 VanDerWaalsContact C-OH 3.31Å; G1808-Y1836 WeakPolarHBondContact CA-OH 3.36Å; G1808-Y1836 PolarHBondContact N-OH 2.95Å; G1808-Y1836 VanDerWaalsContact O-CE1 3.25Å; G1808-Y1836 WeakPolarHBondContact O-CE1 3.46Å; G1808-Y1836 PolarHBondContact O-OH 2.92Å; G1808-Y1836 VanDerWaalsContact O-OH 3.05Å; D1809-Y1836 VanDerWaalsContact CA-CE1 3.44Å; D1809-Y1836 HydrophobicContact CB-CD1 4Å; D1809-Y1836 HydrophobicContact CB-CE1 4.28Å; I1813-Y1836 HydrophobicContact CD1-CE1 4.34Å; I1813-Y1836 VanDerWaalsContact CD1-OH 3.29Å; I1813-Y1836 WeakPolarHBondContact CD1-OH 3.29Å; I1813-Y1836 HydrophobicContact CG1-CE1 3.91Å; A1834-Y1836 HydrophobicContact CB-CE2 4.32Å; Y1836-W1850 CarbonylContact O-C 3.54Å; Y1836-W1850 VanDerWaalsContact O-CA 3.26Å; Y1836-W1850 WeakPolarHBondContact O-CA 3.39Å; Y1836-W1850 WeakPolarHBondContact O-CB 3.46Å; Y1836-I1851 PolarHBondContact N-O 3.07Å; Y1836-I1851 PolarHBondContact O-N 2.98Å; Y1836-V1853 HydrophobicContact CD2-CB 4.4Å; Y1836-V1853 HydrophobicContact CE2-CB 4.4Å; Y1836-V1853 WeakPolarHBondContact CE2-O 3.37Å
1837	P	87	Confident	66.9	Low	5.4 Å²	5.4	58 Å²	58	4%	0.035	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	147.1	177.1	-1.1	5.4	0	0	0	112.1	P1508 F1535 D1809 I1813 Y1839 L1888	P1508-P1837 HydrophobicContact CB-CG 4.2Å; P1508-P1837 HydrophobicContact CG-CG 4.09Å; F1535-P1837 HydrophobicContact CD1-CB 4.48Å; F1535-P1837 HydrophobicContact CD1-CG 4.26Å; F1535-P1837 HydrophobicContact CE1-CB 4.26Å; F1535-P1837 HydrophobicContact CE1-CG 3.52Å; F1535-P1837 HydrophobicContact CE2-CB 4.38Å; F1535-P1837 HydrophobicContact CE2-CG 4.45Å; F1535-P1837 HydrophobicContact CZ-CB 4.12Å; F1535-P1837 HydrophobicContact CZ-CG 3.65Å; D1809-P1837 WeakPolarHBondContact OD2-CD 3.38Å; I1813-P1837 HydrophobicContact CG2-CG 4.3Å; P1837-Y1839 HydrophobicContact CB-CE1 4.05Å; P1837-Y1839 HydrophobicContact CB-CE2 4.23Å; P1837-Y1839 HydrophobicContact CG-CE1 4.23Å; P1837-Y1839 HydrophobicContact CG-CE2 3.8Å; P1837-Y1839 VanDerWaalsContact CG-CZ 3.47Å; P1837-Y1839 WeakPolarHBondContact CG-OH 3.31Å; P1837-Y1839 WeakPolarHBondContact O-CE2 3.28Å; P1837-L1888 HydrophobicContact CB-CD1 4.32Å; P1837-L1888 HydrophobicContact CG-CD1 4.34Å
1838	L	88.4	Confident	68.9	Low	4.4 Å²	4.4	50 Å²	50	2%	0.023	29%	0.292	C	S	.	.			trans	-93.5	124.7	175.3	-66.8	176.1	0	0	0	110.8	L1635 V1729 A1780 S1849 I1851	L1635-L1838 HydrophobicContact CD2-CD1 3.65Å; V1729-L1838 HydrophobicContact CB-CD1 4.33Å; V1729-L1838 HydrophobicContact CB-CD2 4.48Å; V1729-L1838 HydrophobicContact CG2-CD1 3.86Å; V1729-L1838 HydrophobicContact CG2-CD2 3.69Å; V1729-L1838 HydrophobicContact CG2-CG 4.44Å; A1780-L1838 HydrophobicContact CB-CD2 4Å; L1838-S1849 PolarHBondContact N-O 2.92Å; L1838-S1849 VanDerWaalsContact N-O 3.09Å; L1838-I1851 HydrophobicContact CD2-CB 4.22Å; L1838-I1851 HydrophobicContact CD2-CG2 3.87Å; L1838-I1851 HydrophobicContact CG-CB 4.43Å; L1838-I1851 HydrophobicContact CG-CG2 4.37Å
1839	Y	85.9	Confident	71.4	Confident	20.2 Å²	20.2	43.2 Å²	43.2	8%	0.079	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-111.9	143.2	-179.5	-54.2	-72.8	0	0	0	111.8	W1506 P1508 F1535 A1538 G1778 T1779 R1814 P1837 F1846 F2050 L2146	W1506-Y1839 HydrophobicContact CB-CD1 3.8Å; W1506-Y1839 HydrophobicContact CB-CD2 3.62Å; W1506-Y1839 HydrophobicContact CB-CE1 4.13Å; W1506-Y1839 HydrophobicContact CB-CE2 3.96Å; W1506-Y1839 HydrophobicContact CB-CG 3.51Å; W1506-Y1839 VanDerWaalsContact CB-CG 3.48Å; W1506-Y1839 HydrophobicContact CG-CD1 4.34Å; W1506-Y1839 HydrophobicContact CG-CD2 4.38Å; W1506-Y1839 AromaticContact CG-CG 3.95Å; W1506-Y1839 HydrophobicContact CG-CG 3.95Å; P1508-Y1839 HydrophobicContact CB-CE1 4.4Å; P1508-Y1839 WeakPolarHBondContact CB-OH 3.29Å; P1508-Y1839 VanDerWaalsContact CD-OH 3.27Å; P1508-Y1839 WeakPolarHBondContact CD-OH 3.25Å; P1508-Y1839 WeakPolarHBondContact CG-OH 3.42Å; F1535-Y1839 HydrophobicContact CE2-CE1 4.37Å; F1535-Y1839 HydrophobicContact CZ-CE1 4.23Å; A1538-Y1839 HydrophobicContact CB-CD1 3.52Å; A1538-Y1839 VanDerWaalsContact CB-CD1 3.45Å; A1538-Y1839 HydrophobicContact CB-CE1 3.6Å; G1778-Y1839 CarbonylContact C-O 3.43Å; G1778-Y1839 VanDerWaalsContact CA-O 3.25Å; G1778-Y1839 WeakPolarHBondContact CA-O 3.41Å; T1779-Y1839 PolarHBondContact N-O 3.06Å; T1779-Y1839 WeakPolarHBondContact O-CD2 3.33Å; T1779-Y1839 PolarHBondContact O-N 3.24Å; R1814-Y1839 PolarHBondContact NH2-OH 3.17Å; P1837-Y1839 HydrophobicContact CB-CE1 4.05Å; P1837-Y1839 HydrophobicContact CB-CE2 4.23Å; P1837-Y1839 HydrophobicContact CG-CE1 4.23Å; P1837-Y1839 HydrophobicContact CG-CE2 3.8Å; P1837-Y1839 VanDerWaalsContact CG-CZ 3.47Å; P1837-Y1839 WeakPolarHBondContact CG-OH 3.31Å; P1837-Y1839 WeakPolarHBondContact O-CE2 3.28Å; Y1839-F1846 HydrophobicContact CD1-CZ 4.5Å; Y1839-F2050 HydrophobicContact CE2-CB 4.21Å; Y1839-F2050 HydrophobicContact CE2-CD2 4.21Å; Y1839-F2050 HydrophobicContact CE2-CG 4.08Å; Y1839-F2050 WeakPolarHBondContact OH-CB 3.48Å; Y1839-L2146 HydrophobicContact CD1-CD1 4.42Å; Y1839-L2146 HydrophobicContact CG-CD1 4.46Å
1840	R	83.6	Confident	73.9	Confident	83 Å²	83	37.8 Å²	37.8	31%	0.313	23%	0.228	S	C	.	.			trans	-148.8	134.2	170.6	176.2	-178.9	169.5	-176.5	1.7	108.5	S1329 H1776 I1777 N1842 T1843 F1846	S1329-R1840 PolarHBondContact OG-O 3.33Å; H1776-R1840 WeakPolarHBondContact O-CD 2.93Å; H1776-R1840 PolarHBondContact O-NH1 2.98Å; I1777-R1840 WeakPolarHBondContact O-CB 3.47Å; I1777-R1840 VanDerWaalsContact O-CD 3.28Å; I1777-R1840 WeakPolarHBondContact O-CD 3.39Å; R1840-N1842 VanDerWaalsContact C-N 3.26Å; R1840-N1842 PolarHBondContact O-N 3.04Å; R1840-N1842 VanDerWaalsContact O-N 3.17Å; R1840-T1843 HydrophobicContact CB-CG2 3.63Å; R1840-T1843 WeakPolarHBondContact CD-OG1 3.2Å; R1840-T1843 HydrophobicContact CG-CG2 3.65Å; R1840-T1843 PolarHBondContact O-OG1 3.1Å; R1840-F1846 HydrophobicContact CB-CE1 3.82Å; R1840-F1846 HydrophobicContact CB-CZ 3.55Å; R1840-F1846 HydrophobicContact CG-CZ 4.21Å; R1840-F1846 WeakPolarHBondContact O-CE1 3.41Å; R1840-F1846 WeakPolarHBondContact O-CE2 3.14Å; R1840-F1846 VanDerWaalsContact O-CZ 3.27Å; R1840-F1846 WeakPolarHBondContact O-CZ 3.46Å
1841	A	74.8	Confident	76.2	Confident	54 Å²	54	33.7 Å²	33.7	45%	0.446	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	145.2	176.5	0	0	0	0	0	111.5	Y1392 W1506 T1843 N2148	Y1392-A1841 HydrophobicContact CE2-CB 4.23Å; W1506-A1841 HydrophobicContact CZ2-CB 4.23Å; A1841-T1843 PolarHBondContact O-N 3Å; A1841-N2148 HydrophobicContact CB-CB 3.89Å
1842	N	69.9	Low	78	Confident	107.8 Å²	107.8	29.4 Å²	29.4	58%	0.576	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.5	20.3	178.5	-51.4	2.1	0	0	0	114.7	S1329 Y1392 R1840 N2148 Q2151	S1329-N1842 PolarHBondContact OG-N 3.11Å; Y1392-N1842 HydrophobicContact CD1-CB 4.5Å; Y1392-N1842 HydrophobicContact CD2-CB 3.98Å; Y1392-N1842 HydrophobicContact CE2-CB 4.06Å; Y1392-N1842 WeakPolarHBondContact CE2-OD1 3.36Å; Y1392-N1842 HydrophobicContact CG-CB 4.34Å; Y1392-N1842 PolarHBondContact OH-OD1 2.86Å; R1840-N1842 VanDerWaalsContact C-N 3.26Å; R1840-N1842 PolarHBondContact O-N 3.04Å; R1840-N1842 VanDerWaalsContact O-N 3.17Å; N1842-N2148 PolarHBondContact OD1-ND2 3.04Å; N1842-Q2151 PolarHBondContact ND2-OE1 3.49Å
1843	T	71.5	Confident	79.3	Confident	25.6 Å²	25.6	28.4 Å²	28.4	16%	0.157	16%	0.158	C	C	.	.			trans	-100.5	131.5	174.3	17.4	0	0	0	0	110.7	S1329 G1330 H1391 R1840 A1841 N1845 F1846	S1329-T1843 PolarHBondContact OG-N 2.88Å; S1329-T1843 VanDerWaalsContact OG-N 3.13Å; S1329-T1843 PolarHBondContact OG-O 3.15Å; S1329-T1843 VanDerWaalsContact OG-O 3.04Å; S1329-T1843 PolarHBondContact OG-OG1 2.98Å; S1329-T1843 VanDerWaalsContact OG-OG1 3.1Å; G1330-T1843 VanDerWaalsContact CA-O 3.29Å; G1330-T1843 WeakPolarHBondContact CA-O 3.47Å; G1330-T1843 PolarHBondContact N-O 3.09Å; H1391-T1843 VanDerWaalsContact O-O 3.08Å; R1840-T1843 HydrophobicContact CB-CG2 3.63Å; R1840-T1843 WeakPolarHBondContact CD-OG1 3.2Å; R1840-T1843 HydrophobicContact CG-CG2 3.65Å; R1840-T1843 PolarHBondContact O-OG1 3.1Å; A1841-T1843 PolarHBondContact O-N 3Å; T1843-N1845 VanDerWaalsContact C-N 3.3Å; T1843-N1845 VanDerWaalsContact CG2-O 3.29Å; T1843-N1845 WeakPolarHBondContact CG2-O 3.41Å; T1843-N1845 PolarHBondContact O-N 3.18Å; T1843-F1846 VanDerWaalsContact CB-CZ 3.42Å; T1843-F1846 HydrophobicContact CG2-CD1 4.4Å; T1843-F1846 HydrophobicContact CG2-CE1 4.27Å; T1843-F1846 HydrophobicContact CG2-CE2 4.28Å; T1843-F1846 HydrophobicContact CG2-CZ 4.13Å; T1843-F1846 WeakPolarHBondContact O-CE2 3.32Å; T1843-F1846 WeakPolarHBondContact OG1-CD1 3.41Å; T1843-F1846 WeakPolarHBondContact OG1-CE1 3.35Å; T1843-F1846 WeakPolarHBondContact OG1-CZ 3.44Å
1844	A	67.3	Low	80.2	Confident	59.6 Å²	59.6	29.3 Å²	29.3	49%	0.493	16%	0.161	S	C	.	.	S	Bend	trans	-71.2	-32.9	176.2	0	0	0	0	0	112.6	G1330 K1332 H1391	G1330-A1844 CarbonylContact C-O 3.5Å; G1330-A1844 VanDerWaalsContact C-O 3.3Å; G1330-A1844 WeakPolarHBondContact CA-O 3.35Å; K1332-A1844 WeakPolarHBondContact CB-O 3.48Å; K1332-A1844 HydrophobicContact CD-CB 4.26Å; K1332-A1844 PolarHBondContact N-O 2.93Å; H1391-A1844 HydrophobicContact CB-CB 4.21Å
1845	N	71.9	Confident	80.9	Confident	46.8 Å²	46.8	28.8 Å²	28.8	25%	0.25	16%	0.157	S	C	.	.			trans	-146.1	140.7	-177	-171.1	4.7	0	0	0	110.2	F1333 T1843 Y1847	F1333-N1845 WeakPolarHBondContact CD2-ND2 3.07Å; F1333-N1845 WeakPolarHBondContact CD2-OD1 3.18Å; F1333-N1845 WeakPolarHBondContact CE2-ND2 2.99Å; T1843-N1845 VanDerWaalsContact C-N 3.3Å; T1843-N1845 VanDerWaalsContact CG2-O 3.29Å; T1843-N1845 WeakPolarHBondContact CG2-O 3.41Å; T1843-N1845 PolarHBondContact O-N 3.18Å; N1845-Y1847 HydrophobicContact CB-CD2 4.32Å; N1845-Y1847 HydrophobicContact CB-CE1 4.4Å; N1845-Y1847 HydrophobicContact CB-CE2 4.17Å; N1845-Y1847 VanDerWaalsContact ND2-CD1 3.29Å; N1845-Y1847 WeakPolarHBondContact ND2-CD1 3.11Å; N1845-Y1847 VanDerWaalsContact ND2-CE1 3.31Å; N1845-Y1847 WeakPolarHBondContact ND2-CE1 3.41Å; N1845-Y1847 PolarHBondContact OD1-N 2.87Å
1846	F	74.6	Confident	81.1	Confident	23 Å²	23	30.8 Å²	30.8	10%	0.101	17%	0.166	C	C	.	.			trans	-98.7	-4.4	173.1	-67.4	-67.2	0	0	0	113.2	S1329 F1535 A1538 I1777 Y1839 R1840 T1843 D1848 S1849	S1329-F1846 WeakPolarHBondContact O-CE2 3.22Å; F1535-F1846 HydrophobicContact CE1-CB 3.75Å; F1535-F1846 AromaticContact CE1-CD2 3.89Å; F1535-F1846 HydrophobicContact CE1-CD2 3.89Å; F1535-F1846 HydrophobicContact CE1-CG 4.13Å; F1535-F1846 HydrophobicContact CZ-CB 4.24Å; F1535-F1846 AromaticContact CZ-CD2 3.71Å; F1535-F1846 HydrophobicContact CZ-CD2 3.71Å; F1535-F1846 HydrophobicContact CZ-CE2 4.37Å; F1535-F1846 HydrophobicContact CZ-CG 4.27Å; A1538-F1846 HydrophobicContact CB-CE2 3.7Å; A1538-F1846 HydrophobicContact CB-CZ 4.03Å; I1777-F1846 WeakPolarHBondContact O-CE1 3.38Å; Y1839-F1846 HydrophobicContact CD1-CZ 4.5Å; R1840-F1846 HydrophobicContact CB-CE1 3.82Å; R1840-F1846 HydrophobicContact CB-CZ 3.55Å; R1840-F1846 HydrophobicContact CG-CZ 4.21Å; R1840-F1846 WeakPolarHBondContact O-CE1 3.41Å; R1840-F1846 WeakPolarHBondContact O-CE2 3.14Å; R1840-F1846 VanDerWaalsContact O-CZ 3.27Å; R1840-F1846 WeakPolarHBondContact O-CZ 3.46Å; T1843-F1846 VanDerWaalsContact CB-CZ 3.42Å; T1843-F1846 HydrophobicContact CG2-CD1 4.4Å; T1843-F1846 HydrophobicContact CG2-CE1 4.27Å; T1843-F1846 HydrophobicContact CG2-CE2 4.28Å; T1843-F1846 HydrophobicContact CG2-CZ 4.13Å; T1843-F1846 WeakPolarHBondContact O-CE2 3.32Å; T1843-F1846 WeakPolarHBondContact OG1-CD1 3.41Å; T1843-F1846 WeakPolarHBondContact OG1-CE1 3.35Å; T1843-F1846 WeakPolarHBondContact OG1-CZ 3.44Å; F1846-D1848 PolarHBondContact O-N 3Å; F1846-S1849 WeakPolarHBondContact O-CB 3.34Å; F1846-S1849 PolarHBondContact O-N 3.19Å; F1846-S1849 PolarHBondContact O-OG 3.16Å
1847	Y	74.6	Confident	81.2	Confident	50.8 Å²	50.8	30.8 Å²	30.8	20%	0.199	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	39.8	-179.5	-54.2	-82.9	0	0	0	113.2	Y1634 P1636 Q1640 D1644 Q1696 S1697 N1845 S1849	Y1634-Y1847 WeakPolarHBondContact CE1-O 3.17Å; P1636-Y1847 HydrophobicContact CB-CD2 3.95Å; P1636-Y1847 HydrophobicContact CB-CE2 4.3Å; P1636-Y1847 HydrophobicContact CB-CG 4.09Å; P1636-Y1847 HydrophobicContact CG-CD2 3.78Å; P1636-Y1847 HydrophobicContact CG-CE2 4.48Å; P1636-Y1847 HydrophobicContact CG-CG 4.16Å; Q1640-Y1847 HydrophobicContact CB-CE1 4.4Å; Q1640-Y1847 HydrophobicContact CB-CE2 4.24Å; Q1640-Y1847 VanDerWaalsContact OE1-CE1 3.3Å; Q1640-Y1847 PolarHBondContact OE1-OH 2.84Å; D1644-Y1847 PolarHBondContact OD1-OH 3.49Å; Q1696-Y1847 HydrophobicContact CB-CD1 4.01Å; Q1696-Y1847 HydrophobicContact CB-CE1 4.24Å; Q1696-Y1847 VanDerWaalsContact OE1-CD1 3.27Å; S1697-Y1847 WeakPolarHBondContact OG-CB 3.47Å; S1697-Y1847 PolarHBondContact OG-O 2.77Å; S1697-Y1847 VanDerWaalsContact OG-O 3.08Å; N1845-Y1847 HydrophobicContact CB-CD2 4.32Å; N1845-Y1847 HydrophobicContact CB-CE1 4.4Å; N1845-Y1847 HydrophobicContact CB-CE2 4.17Å; N1845-Y1847 VanDerWaalsContact ND2-CD1 3.29Å; N1845-Y1847 WeakPolarHBondContact ND2-CD1 3.11Å; N1845-Y1847 VanDerWaalsContact ND2-CE1 3.31Å; N1845-Y1847 WeakPolarHBondContact ND2-CE1 3.41Å; N1845-Y1847 PolarHBondContact OD1-N 2.87Å; Y1847-S1849 PolarHBondContact O-N 3.13Å; Y1847-S1849 VanDerWaalsContact O-N 3.12Å
1848	D	76.4	Confident	81	Confident	40 Å²	40	31.8 Å²	31.8	21%	0.214	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	26.8	-173.4	-68.7	-34.9	0	0	0	114.7	K1534 F1535 Y1634 F1846 H1887 L1888	K1534-D1848 WeakPolarHBondContact CE-OD1 3.38Å; K1534-D1848 WeakPolarHBondContact CE-OD2 3.48Å; K1534-D1848 IonicContact NZ-OD1 2.67Å; K1534-D1848 IonicContact NZ-OD2 2.77Å; K1534-D1848 PolarHBondContact NZ-OD2 3.29Å; F1535-D1848 WeakPolarHBondContact CA-OD1 3.38Å; F1535-D1848 WeakPolarHBondContact CB-OD1 3.5Å; F1535-D1848 PolarHBondContact N-OD1 2.96Å; Y1634-D1848 VanDerWaalsContact CD1-O 3.27Å; Y1634-D1848 WeakPolarHBondContact CD1-O 3.37Å; Y1634-D1848 HydrophobicContact CE1-CB 4.25Å; F1846-D1848 PolarHBondContact O-N 3Å; D1848-H1887 IonicContact OD2-CE1 3.18Å; D1848-H1887 IonicContact OD2-CG 2.74Å; D1848-H1887 IonicContact OD2-ND1 3.33Å; D1848-H1887 PolarHBondContact OD2-ND1 2.82Å; D1848-L1888 HydrophobicContact CB-CD1 4.15Å
1849	S	85.5	Confident	80.8	Confident	3.6 Å²	3.6	32.5 Å²	32.5	3%	0.025	18%	0.181	C	C	.	.			trans	-65.2	135.1	-176.1	-59.3	0	0	0	0	113.4	Y1634 P1636 L1838 F1846 Y1847	Y1634-S1849 CarbonylContact O-C 3.6Å; Y1634-S1849 WeakPolarHBondContact O-CA 3.22Å; Y1634-S1849 WeakPolarHBondContact O-CB 3.19Å; Y1634-S1849 PolarHBondContact O-OG 3.48Å; P1636-S1849 WeakPolarHBondContact CD-OG 3.24Å; L1838-S1849 PolarHBondContact N-O 2.92Å; L1838-S1849 VanDerWaalsContact N-O 3.09Å; F1846-S1849 WeakPolarHBondContact O-CB 3.34Å; F1846-S1849 PolarHBondContact O-N 3.19Å; F1846-S1849 PolarHBondContact O-OG 3.16Å; Y1847-S1849 PolarHBondContact O-N 3.13Å; Y1847-S1849 VanDerWaalsContact O-N 3.12Å
1850	W	88.4	Confident	80.5	Confident	0.6 Å²	0.6	31.9 Å²	31.9	0%	0.002	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	163.8	-179.7	53.2	-101.8	0	0	0	112.2	F1535 F1632 A1633 Y1634 W1815 W1816 L1833 V1835 Y1836 A1852 P1882 L1888	F1535-W1850 HydrophobicContact CE2-CB 4.48Å; F1632-W1850 HydrophobicContact CB-CH2 4.44Å; F1632-W1850 HydrophobicContact CB-CZ3 4.15Å; A1633-W1850 CarbonylContact C-O 3.55Å; A1633-W1850 VanDerWaalsContact CA-O 3.27Å; A1633-W1850 WeakPolarHBondContact CA-O 3.28Å; Y1634-W1850 VanDerWaalsContact CB-NE1 3.29Å; Y1634-W1850 AromaticContact CD1-NE1 3.95Å; Y1634-W1850 HydrophobicContact CD2-CZ2 4.2Å; Y1634-W1850 AromaticContact CG-CE2 3.89Å; Y1634-W1850 HydrophobicContact CG-CZ2 4.22Å; Y1634-W1850 AromaticContact CG-NE1 3.62Å; Y1634-W1850 PolarHBondContact N-O 3.08Å; Y1634-W1850 PolarHBondContact O-N 3.18Å; Y1634-W1850 VanDerWaalsContact O-N 3.12Å; W1815-W1850 HydrophobicContact CB-CH2 4.32Å; W1815-W1850 HydrophobicContact CB-CZ2 4.19Å; W1815-W1850 AromaticContact CD1-CE2 3.63Å; W1815-W1850 AromaticContact CD1-CZ2 3.68Å; W1815-W1850 AromaticContact CD1-NE1 3.52Å; W1815-W1850 AromaticContact CD2-CE2 3.93Å; W1815-W1850 HydrophobicContact CD2-CH2 4.18Å; W1815-W1850 AromaticContact CD2-CZ2 3.55Å; W1815-W1850 HydrophobicContact CD2-CZ2 3.82Å; W1815-W1850 VanDerWaalsContact CD2-CZ2 3.44Å; W1815-W1850 AromaticContact CD2-NE1 3.76Å; W1815-W1850 AromaticContact CE2-CZ2 4Å; W1815-W1850 AromaticContact CE3-CE2 3.73Å; W1815-W1850 HydrophobicContact CE3-CH2 4.49Å; W1815-W1850 AromaticContact CE3-CZ2 3.69Å; W1815-W1850 HydrophobicContact CE3-CZ2 3.69Å; W1815-W1850 AromaticContact CE3-NE1 3.36Å; W1815-W1850 HydrophobicContact CG-CH2 4.11Å; W1815-W1850 AromaticContact CG-CZ2 3.83Å; W1815-W1850 HydrophobicContact CG-CZ2 3.99Å; W1815-W1850 HydrophobicContact CH2-CZ2 4.4Å; W1815-W1850 HydrophobicContact CZ2-CZ2 4.44Å; W1815-W1850 AromaticContact CZ3-CZ2 3.91Å; W1815-W1850 HydrophobicContact CZ3-CZ2 3.91Å; W1815-W1850 AromaticContact CZ3-NE1 3.53Å; W1815-W1850 VanDerWaalsContact CZ3-NE1 3.35Å; W1815-W1850 AromaticContact NE1-CZ2 3.76Å; W1816-W1850 HydrophobicContact CB-CZ2 4.19Å; W1816-W1850 AromaticContact CD2-CE2 3.81Å; W1816-W1850 AromaticContact CD2-CZ2 3.73Å; W1816-W1850 HydrophobicContact CD2-CZ2 3.73Å; W1816-W1850 AromaticContact CD2-NE1 3.44Å; W1816-W1850 AromaticContact CE2-CZ2 3.99Å; W1816-W1850 AromaticContact CE3-CD1 3.78Å; W1816-W1850 AromaticContact CE3-CE2 3.82Å; W1816-W1850 HydrophobicContact CE3-CZ2 4.22Å; W1816-W1850 AromaticContact CE3-NE1 2.97Å; W1816-W1850 AromaticContact CG-CZ2 3.73Å; W1816-W1850 HydrophobicContact CG-CZ2 3.73Å; W1816-W1850 AromaticContact CH2-NE1 3.92Å; W1816-W1850 AromaticContact CZ3-CD1 3.96Å; W1816-W1850 AromaticContact CZ3-NE1 3.24Å; L1833-W1850 HydrophobicContact CD2-CH2 4.17Å; L1833-W1850 HydrophobicContact CD2-CZ3 4.3Å; V1835-W1850 HydrophobicContact CB-CB 4.16Å; V1835-W1850 HydrophobicContact CB-CD2 4.03Å; V1835-W1850 HydrophobicContact CB-CE3 4.01Å; V1835-W1850 HydrophobicContact CB-CG 4.05Å; V1835-W1850 HydrophobicContact CG1-CB 3.56Å; V1835-W1850 HydrophobicContact CG1-CD2 3.72Å; V1835-W1850 HydrophobicContact CG1-CE3 3.47Å; V1835-W1850 VanDerWaalsContact CG1-CE3 3.4Å; V1835-W1850 HydrophobicContact CG1-CG 4.11Å; V1835-W1850 VanDerWaalsContact CG1-CG 3.49Å; V1835-W1850 HydrophobicContact CG1-CH2 4.25Å; V1835-W1850 HydrophobicContact CG1-CZ2 4.4Å; V1835-W1850 HydrophobicContact CG1-CZ3 3.69Å; V1835-W1850 HydrophobicContact CG2-CB 4.33Å; V1835-W1850 HydrophobicContact CG2-CD2 4.35Å; V1835-W1850 HydrophobicContact CG2-CE3 3.9Å; V1835-W1850 HydrophobicContact CG2-CG 4.26Å; V1835-W1850 HydrophobicContact CG2-CH2 4.5Å; V1835-W1850 HydrophobicContact CG2-CZ3 4Å; Y1836-W1850 CarbonylContact O-C 3.54Å; Y1836-W1850 VanDerWaalsContact O-CA 3.26Å; Y1836-W1850 WeakPolarHBondContact O-CA 3.39Å; Y1836-W1850 WeakPolarHBondContact O-CB 3.46Å; W1850-A1852 HydrophobicContact CE3-CB 4.41Å; W1850-A1852 HydrophobicContact CZ3-CB 3.97Å; W1850-P1882 HydrophobicContact CH2-CB 4.28Å; W1850-P1882 HydrophobicContact CH2-CG 4Å; W1850-P1882 HydrophobicContact CZ2-CB 4.43Å; W1850-P1882 HydrophobicContact CZ2-CG 4.47Å; W1850-L1888 HydrophobicContact CB-CD1 4.05Å; W1850-L1888 HydrophobicContact CB-CD2 4.15Å; W1850-L1888 HydrophobicContact CB-CG 4.4Å; W1850-L1888 VanDerWaalsContact CD1-CG 3.49Å; W1850-L1888 HydrophobicContact CG-CD1 4.32Å; W1850-L1888 HydrophobicContact CG-CD2 3.97Å; W1850-L1888 HydrophobicContact CG-CG 4.27Å
1851	I	89.2	Confident	80.4	Confident	1.2 Å²	1.2	34.8 Å²	34.8	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	136.9	171.6	-170.1	176.1	0	0	0	110.5	L1630 A1633 V1668 F1727 V1729 A1780 V1835 Y1836 L1838 V1853	L1630-I1851 HydrophobicContact CD2-CD1 4.46Å; A1633-I1851 HydrophobicContact CB-CB 4.38Å; A1633-I1851 HydrophobicContact CB-CG1 4.25Å; V1668-I1851 HydrophobicContact CG1-CD1 4.04Å; V1668-I1851 HydrophobicContact CG2-CD1 3.77Å; F1727-I1851 HydrophobicContact CB-CD1 4.46Å; V1729-I1851 HydrophobicContact CG2-CD1 4.25Å; A1780-I1851 HydrophobicContact CB-CG2 3.57Å; V1835-I1851 CarbonylContact C-O 3.51Å; V1835-I1851 WeakPolarHBondContact CA-O 3.05Å; Y1836-I1851 PolarHBondContact N-O 3.07Å; Y1836-I1851 PolarHBondContact O-N 2.98Å; L1838-I1851 HydrophobicContact CD2-CB 4.22Å; L1838-I1851 HydrophobicContact CD2-CG2 3.87Å; L1838-I1851 HydrophobicContact CG-CB 4.43Å; L1838-I1851 HydrophobicContact CG-CG2 4.37Å; I1851-V1853 HydrophobicContact CB-CG2 4.44Å; I1851-V1853 HydrophobicContact CD1-CG2 3.8Å; I1851-V1853 HydrophobicContact CG1-CG2 3.77Å; I1851-V1853 HydrophobicContact CG2-CG2 4.11Å
1852	A	87.1	Confident	80.4	Confident	0.4 Å²	0.4	35.8 Å²	35.8	0%	0.003	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	107	174.3	0	0	0	0	0	109.9	N1631 F1632 L1833 A1834 V1835 W1850	N1631-A1852 HydrophobicContact CB-CB 4.28Å; N1631-A1852 PolarHBondContact N-O 2.97Å; N1631-A1852 VanDerWaalsContact N-O 3.12Å; F1632-A1852 HydrophobicContact CB-CB 4.29Å; F1632-A1852 HydrophobicContact CD2-CB 4.42Å; F1632-A1852 PolarHBondContact O-N 3.15Å; L1833-A1852 HydrophobicContact CD1-CB 4.16Å; L1833-A1852 HydrophobicContact CD2-CB 3.82Å; L1833-A1852 VanDerWaalsContact CD2-CB 3.47Å; L1833-A1852 HydrophobicContact CG-CB 3.88Å; A1834-A1852 CarbonylContact O-C 3.43Å; A1834-A1852 VanDerWaalsContact O-CA 3.25Å; A1834-A1852 WeakPolarHBondContact O-CA 3.37Å; A1834-A1852 WeakPolarHBondContact O-CB 3.19Å; V1835-A1852 HydrophobicContact CG1-CB 4.26Å; V1835-A1852 HydrophobicContact CG2-CB 4.25Å; W1850-A1852 HydrophobicContact CE3-CB 4.41Å; W1850-A1852 HydrophobicContact CZ3-CB 3.97Å
1853	V	86.2	Confident	80.7	Confident	3.2 Å²	3.2	35.9 Å²	35.9	2%	0.019	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.6	-179.6	-175.6	0	0	0	0	109.1	I1628 Y1629 L1630 F1727 I1782 A1834 Y1836 I1851 I1855	I1628-V1853 HydrophobicContact CG2-CG1 4Å; Y1629-V1853 WeakPolarHBondContact O-CA 3.32Å; L1630-V1853 HydrophobicContact CD2-CG1 4.32Å; L1630-V1853 HydrophobicContact CD2-CG2 3.99Å; F1727-V1853 HydrophobicContact CD1-CG2 4.47Å; F1727-V1853 HydrophobicContact CD2-CG2 4.46Å; F1727-V1853 HydrophobicContact CE1-CG1 4.15Å; F1727-V1853 HydrophobicContact CE2-CG1 4.1Å; F1727-V1853 HydrophobicContact CE2-CG2 4.49Å; F1727-V1853 HydrophobicContact CG-CG2 4.41Å; F1727-V1853 HydrophobicContact CZ-CG1 3.77Å; F1727-V1853 HydrophobicContact CZ-CG2 4.5Å; I1782-V1853 HydrophobicContact CD1-CB 3.95Å; I1782-V1853 HydrophobicContact CD1-CG1 4.09Å; I1782-V1853 HydrophobicContact CD1-CG2 4.41Å; A1834-V1853 WeakPolarHBondContact CB-O 3.49Å; A1834-V1853 PolarHBondContact O-N 2.94Å; A1834-V1853 VanDerWaalsContact O-N 3.15Å; Y1836-V1853 HydrophobicContact CD2-CB 4.4Å; Y1836-V1853 HydrophobicContact CE2-CB 4.4Å; Y1836-V1853 WeakPolarHBondContact CE2-O 3.37Å; I1851-V1853 HydrophobicContact CB-CG2 4.44Å; I1851-V1853 HydrophobicContact CD1-CG2 3.8Å; I1851-V1853 HydrophobicContact CG1-CG2 3.77Å; I1851-V1853 HydrophobicContact CG2-CG2 4.11Å; V1853-I1855 HydrophobicContact CG1-CD1 4.35Å; V1853-I1855 HydrophobicContact CG1-CG1 4.07Å
1854	H	84	Confident	80.2	Confident	56.6 Å²	56.6	40 Å²	40	26%	0.262	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134	173.8	177.1	-112.6	0	0	0	109	I1628 Y1629 C1805 L1806 E1856	I1628-H1854 CarbonylContact C-O 3.54Å; I1628-H1854 WeakPolarHBondContact CA-O 3.11Å; Y1629-H1854 HydrophobicContact CD2-CB 4.33Å; Y1629-H1854 AromaticContact CD2-ND1 3.24Å; Y1629-H1854 VanDerWaalsContact CD2-ND1 3.32Å; Y1629-H1854 WeakPolarHBondContact CD2-ND1 3.21Å; Y1629-H1854 AromaticContact CE2-ND1 3.62Å; Y1629-H1854 AromaticContact CG-ND1 3.89Å; Y1629-H1854 PolarHBondContact N-O 2.94Å; Y1629-H1854 PolarHBondContact O-N 3.18Å; C1805-H1854 PolarHBondContact SG-CD2 3.14Å; C1805-H1854 VanDerWaalsContact SG-CD2 3.59Å; C1805-H1854 VanDerWaalsContact SG-CE1 3.57Å; C1805-H1854 PolarHBondContact SG-NE2 2.93Å; L1806-H1854 PolarHBondContact O-CD2 3.01Å; H1854-E1856 VanDerWaalsContact CE1-CD 3.45Å; H1854-E1856 VanDerWaalsContact CE1-CG 3.48Å; H1854-E1856 WeakPolarHBondContact CE1-CG 3.31Å; H1854-E1856 IonicContact CE1-OE1 3.57Å; H1854-E1856 PolarHBondContact CE1-OE1 3.23Å; H1854-E1856 IonicContact ND1-OE1 3.2Å; H1854-E1856 PolarHBondContact ND1-OE1 2.84Å; H1854-E1856 IonicContact NE2-OE1 3.05Å
1855	I	86.9	Confident	79.5	Confident	5.6 Å²	5.6	39.4 Å²	39.4	3%	0.029	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	121	-177.7	-54.3	178	0	0	0	108.2	T1627 I1628 L1725 F1727 I1782 L1784 L1787 C1805 L1806 V1853	T1627-I1855 WeakPolarHBondContact O-CA 3.2Å; I1628-I1855 HydrophobicContact CG1-CD1 4.46Å; I1628-I1855 HydrophobicContact CG1-CG1 4.37Å; I1628-I1855 HydrophobicContact CG1-CG2 4.36Å; I1628-I1855 HydrophobicContact CG2-CG1 4.39Å; L1725-I1855 HydrophobicContact CD1-CD1 3.86Å; L1725-I1855 HydrophobicContact CD2-CD1 4.15Å; F1727-I1855 HydrophobicContact CE2-CD1 4.27Å; F1727-I1855 HydrophobicContact CZ-CD1 4.31Å; I1782-I1855 HydrophobicContact CD1-CD1 4.36Å; I1782-I1855 HydrophobicContact CG2-CD1 4.23Å; L1784-I1855 HydrophobicContact CD2-CD1 4.26Å; L1787-I1855 HydrophobicContact CD1-CG2 4.02Å; L1787-I1855 HydrophobicContact CD2-CG2 4.37Å; C1805-I1855 CarbonylContact C-O 3.54Å; C1805-I1855 WeakPolarHBondContact CA-O 3.24Å; C1805-I1855 PolarHBondContact SG-O 2.8Å; C1805-I1855 VanDerWaalsContact SG-O 3.35Å; L1806-I1855 HydrophobicContact CB-CB 4.28Å; L1806-I1855 HydrophobicContact CD1-CB 4.05Å; L1806-I1855 HydrophobicContact CD1-CD1 4.13Å; L1806-I1855 HydrophobicContact CD1-CG2 4.39Å; L1806-I1855 HydrophobicContact CD2-CD1 4.35Å; L1806-I1855 HydrophobicContact CG-CB 4.25Å; L1806-I1855 PolarHBondContact N-O 3.22Å; L1806-I1855 VanDerWaalsContact N-O 3.11Å; L1806-I1855 PolarHBondContact O-N 3.21Å; V1853-I1855 HydrophobicContact CG1-CD1 4.35Å; V1853-I1855 HydrophobicContact CG1-CG1 4.07Å
1856	E	84.7	Confident	78.3	Confident	43.8 Å²	43.8	40.8 Å²	40.8	21%	0.205	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	143.1	174.3	-65.1	178.4	157	0	0	110	F1626 T1627 Y1629 I1803 N1804 C1805 H1854	F1626-E1856 CarbonylContact C-O 3.42Å; F1626-E1856 VanDerWaalsContact CA-O 3.28Å; F1626-E1856 WeakPolarHBondContact CA-O 3.42Å; T1627-E1856 PolarHBondContact N-O 3.05Å; T1627-E1856 PolarHBondContact O-N 3.05Å; Y1629-E1856 HydrophobicContact CE2-CB 4.43Å; Y1629-E1856 VanDerWaalsContact CE2-CD 3.5Å; Y1629-E1856 HydrophobicContact CE2-CG 3.95Å; Y1629-E1856 VanDerWaalsContact CE2-OE2 3.23Å; Y1629-E1856 WeakPolarHBondContact CE2-OE2 3.23Å; Y1629-E1856 PolarHBondContact OH-OE2 3.16Å; I1803-E1856 HydrophobicContact CG2-CB 4.2Å; I1803-E1856 HydrophobicContact CG2-CG 4.27Å; N1804-E1856 CarbonylContact O-C 3.52Å; N1804-E1856 WeakPolarHBondContact O-CA 3.24Å; C1805-E1856 HydrophobicContact CB-CG 4.39Å; H1854-E1856 VanDerWaalsContact CE1-CD 3.45Å; H1854-E1856 VanDerWaalsContact CE1-CG 3.48Å; H1854-E1856 WeakPolarHBondContact CE1-CG 3.31Å; H1854-E1856 IonicContact CE1-OE1 3.57Å; H1854-E1856 PolarHBondContact CE1-OE1 3.23Å; H1854-E1856 IonicContact ND1-OE1 3.2Å; H1854-E1856 PolarHBondContact ND1-OE1 2.84Å; H1854-E1856 IonicContact NE2-OE1 3.05Å
1857	M	86.5	Confident	76.8	Confident	11.6 Å²	11.6	48.6 Å²	48.6	6%	0.057	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	126.4	169.2	-177.9	-173.7	69.5	0	0	109.1	K1624 H1625 F1626 L1720 L1787 N1804	K1624-M1857 HydrophobicContact CB-CG 4.34Å; K1624-M1857 HydrophobicContact CB-SD 4.48Å; K1624-M1857 HydrophobicContact CD-CG 4.29Å; K1624-M1857 HydrophobicContact CD-SD 4.1Å; K1624-M1857 HydrophobicContact CG-SD 4.32Å; H1625-M1857 CarbonylContact O-C 3.54Å; H1625-M1857 WeakPolarHBondContact O-CA 3.25Å; F1626-M1857 HydrophobicContact CD1-CB 3.97Å; F1626-M1857 HydrophobicContact CD1-CG 3.97Å; F1626-M1857 HydrophobicContact CD1-SD 4.49Å; F1626-M1857 HydrophobicContact CE1-CB 3.91Å; F1626-M1857 HydrophobicContact CE1-CG 3.54Å; F1626-M1857 VanDerWaalsContact CE1-CG 3.45Å; F1626-M1857 HydrophobicContact CE1-SD 3.57Å; F1626-M1857 VanDerWaalsContact CE1-SD 3.53Å; F1626-M1857 HydrophobicContact CZ-CG 3.92Å; F1626-M1857 HydrophobicContact CZ-SD 3.74Å; L1720-M1857 HydrophobicContact CD1-SD 3.93Å; L1787-M1857 HydrophobicContact CB-CB 4.48Å; L1787-M1857 HydrophobicContact CB-CE 4.23Å; L1787-M1857 HydrophobicContact CB-SD 4.33Å; L1787-M1857 HydrophobicContact CD1-CB 4.35Å; L1787-M1857 HydrophobicContact CD2-CB 4.12Å; L1787-M1857 WeakPolarHBondContact O-CE 3.16Å; N1804-M1857 HydrophobicContact CB-CB 4.39Å; N1804-M1857 HydrophobicContact CB-CE 4.18Å; N1804-M1857 PolarHBondContact N-O 3.08Å; N1804-M1857 VanDerWaalsContact ND2-CE 3.3Å; N1804-M1857 WeakPolarHBondContact ND2-CE 3.28Å; N1804-M1857 PolarHBondContact O-N 3.17Å
1858	T	83.4	Confident	75.1	Confident	26.2 Å²	26.2	49.8 Å²	49.8	16%	0.161	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	142	177.8	65.1	0	0	0	0	111.4	K1624 H1625 S1802 I1803 W1867 R1870	K1624-T1858 CarbonylContact C-O 3.56Å; K1624-T1858 WeakPolarHBondContact CA-O 3.28Å; H1625-T1858 WeakPolarHBondContact CB-OG1 3.21Å; H1625-T1858 PolarHBondContact N-O 3.21Å; H1625-T1858 PolarHBondContact O-N 3.04Å; S1802-T1858 VanDerWaalsContact O-CA 3.26Å; S1802-T1858 WeakPolarHBondContact O-CA 3.33Å; I1803-T1858 HydrophobicContact CB-CG2 4.12Å; I1803-T1858 HydrophobicContact CD1-CG2 4.32Å; I1803-T1858 HydrophobicContact CG1-CG2 3.72Å; I1803-T1858 HydrophobicContact CG2-CG2 3.94Å; T1858-W1867 HydrophobicContact CG2-CZ3 4.49Å; T1858-R1870 PolarHBondContact OG1-NH1 3.11Å; T1858-R1870 PolarHBondContact OG1-NH2 2.94Å
1859	G	83.7	Confident	73.3	Confident	18.8 Å²	18.8	57.1 Å²	57.1	19%	0.194	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	142.7	176	0	0	0	0	0	112.4	C1621 Y1623	C1621-G1859 VanDerWaalsContact SG-C 3.56Å; Y1623-G1859 WeakPolarHBondContact O-CA 3.49Å
1860	S	79.8	Confident	71	Confident	8.6 Å²	8.6	65.1 Å²	65.1	6%	0.06	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	155.2	170.8	91.3	0	0	0	0	112.8	C1621 Q1622 Y1623 H1625 T1862 C1865	C1621-S1860 CarbonylContact C-O 3.55Å; C1621-S1860 WeakPolarHBondContact CA-O 3.25Å; C1621-S1860 VanDerWaalsContact CB-O 3.27Å; C1621-S1860 WeakPolarHBondContact CB-O 3.34Å; Q1622-S1860 PolarHBondContact N-O 2.94Å; Y1623-S1860 PolarHBondContact N-O 2.85Å; Y1623-S1860 PolarHBondContact O-N 3Å; H1625-S1860 WeakPolarHBondContact CD2-CB 3.44Å; H1625-S1860 PolarHBondContact CD2-OG 2.93Å; H1625-S1860 WeakPolarHBondContact CE1-CB 3.47Å; H1625-S1860 PolarHBondContact CE1-OG 3.07Å; H1625-S1860 WeakPolarHBondContact NE2-CB 3.19Å; H1625-S1860 PolarHBondContact NE2-OG 3.04Å; S1860-T1862 VanDerWaalsContact C-N 3.33Å; S1860-T1862 PolarHBondContact OG-N 3.29Å; S1860-T1862 VanDerWaalsContact OG-N 3.08Å; S1860-T1862 PolarHBondContact OG-O 2.83Å; S1860-C1865 VanDerWaalsContact CB-CB 3.49Å; S1860-C1865 WeakPolarHBondContact OG-CB 3.46Å
1861	K	81.9	Confident	68.7	Low	142.2 Å²	142.2	70.8 Å²	70.8	62%	0.618	34%	0.338	S	S	*	.	S	Bend	trans	-85.1	-8.1	173.6	-64.9	-172	177.7	-173.6	0	113.6	G1620 Q1622	G1620-K1861 WeakPolarHBondContact O-CE 3.42Å; Q1622-K1861 PolarHBondContact OE1-O 3.23Å; Q1622-K1861 VanDerWaalsContact OE1-O 3.12Å
1862	T	76	Confident	66.3	Low	76.6 Å²	76.6	77.8 Å²	77.8	47%	0.47	37%	0.371	S	S	.	.	S	Bend	trans	-140.7	142.4	-175.9	55.6	0	0	0	0	110.4	Y1623 S1860 N1864 C1865	Y1623-T1862 VanDerWaalsContact CD2-C 3.46Å; S1860-T1862 VanDerWaalsContact C-N 3.33Å; S1860-T1862 PolarHBondContact OG-N 3.29Å; S1860-T1862 VanDerWaalsContact OG-N 3.08Å; S1860-T1862 PolarHBondContact OG-O 2.83Å; T1862-N1864 VanDerWaalsContact C-N 3.28Å; T1862-N1864 PolarHBondContact O-N 3.02Å; T1862-N1864 PolarHBondContact OG1-O 2.95Å; T1862-C1865 WeakPolarHBondContact O-CB 3.36Å; T1862-C1865 PolarHBondContact O-N 2.96Å
1863	E	75.2	Confident	63.8	Low	110 Å²	110	82.7 Å²	82.7	51%	0.514	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-40.4	173.5	-178.4	-178.5	-172.6	0	0	111.7	Y1623 H1625 V1709 C1865	Y1623-E1863 HydrophobicContact CD1-CB 4.17Å; Y1623-E1863 HydrophobicContact CD1-CG 4.37Å; Y1623-E1863 HydrophobicContact CD2-CB 4.46Å; Y1623-E1863 VanDerWaalsContact CD2-N 3.3Å; Y1623-E1863 HydrophobicContact CE1-CB 3.8Å; Y1623-E1863 HydrophobicContact CE1-CG 4.07Å; Y1623-E1863 HydrophobicContact CE2-CB 4.19Å; Y1623-E1863 VanDerWaalsContact CE2-N 3.32Å; Y1623-E1863 HydrophobicContact CG-CB 4.46Å; H1625-E1863 PolarHBondContact CE1-O 3.19Å; H1625-E1863 VanDerWaalsContact CE1-O 3.26Å; V1709-E1863 HydrophobicContact CG1-CG 4.22Å; E1863-C1865 VanDerWaalsContact C-N 3.3Å; E1863-C1865 PolarHBondContact O-N 2.86Å; E1863-C1865 VanDerWaalsContact O-N 3.1Å
1864	N	61.1	Low	61.4	Low	109.8 Å²	109.8	85.7 Å²	85.7	59%	0.587	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	40.9	-177	-66.2	-22.4	0	0	0	113.6	T1862 L1866 W1867	T1862-N1864 VanDerWaalsContact C-N 3.28Å; T1862-N1864 PolarHBondContact O-N 3.02Å; T1862-N1864 PolarHBondContact OG1-O 2.95Å; N1864-L1866 VanDerWaalsContact C-N 3.31Å; N1864-L1866 PolarHBondContact O-N 2.94Å; N1864-L1866 VanDerWaalsContact O-N 3.15Å; N1864-W1867 HydrophobicContact CB-CE3 4.05Å; N1864-W1867 HydrophobicContact CB-CZ3 4.06Å; N1864-W1867 PolarHBondContact O-N 3Å; N1864-W1867 WeakPolarHBondContact OD1-CZ3 3.1Å
1865	C	52.4	Low	59.3	Low	48 Å²	48	90.2 Å²	90.2	32%	0.324	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-78.2	8	177.5	-145.6	0	0	0	0	113.1	H1625 S1860 T1862 E1863 W1867 S1868 Y1871	H1625-C1865 VanDerWaalsContact CE1-CB 3.43Å; H1625-C1865 WeakPolarHBondContact CE1-CB 3.25Å; H1625-C1865 WeakPolarHBondContact NE2-CB 3.26Å; S1860-C1865 VanDerWaalsContact CB-CB 3.49Å; S1860-C1865 WeakPolarHBondContact OG-CB 3.46Å; T1862-C1865 WeakPolarHBondContact O-CB 3.36Å; T1862-C1865 PolarHBondContact O-N 2.96Å; E1863-C1865 VanDerWaalsContact C-N 3.3Å; E1863-C1865 PolarHBondContact O-N 2.86Å; E1863-C1865 VanDerWaalsContact O-N 3.1Å; C1865-W1867 PolarHBondContact O-N 3.11Å; C1865-W1867 VanDerWaalsContact O-N 3.15Å; C1865-W1867 VanDerWaalsContact SG-CD1 3.53Å; C1865-W1867 PolarHBondContact SG-NE1 2.99Å; C1865-W1867 VanDerWaalsContact SG-NE1 3.39Å; C1865-S1868 WeakPolarHBondContact O-CB 3.49Å; C1865-S1868 PolarHBondContact O-N 2.98Å; C1865-Y1871 WeakPolarHBondContact O-CD2 3.46Å
1866	L	45.9	Very low	57.2	Low	76.4 Å²	76.4	92.8 Å²	92.8	40%	0.4	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-68.5	16.6	175.7	-76.2	164.3	0	0	0	112.9	H1625 E1707 V1709 N1864 S1868 H1872	H1625-L1866 VanDerWaalsContact ND1-CD1 3.28Å; H1625-L1866 WeakPolarHBondContact ND1-CD1 3.49Å; H1625-L1866 WeakPolarHBondContact ND1-CG 3.06Å; E1707-L1866 WeakPolarHBondContact OE2-CD2 3.37Å; V1709-L1866 HydrophobicContact CG2-CD1 4.31Å; N1864-L1866 VanDerWaalsContact C-N 3.31Å; N1864-L1866 PolarHBondContact O-N 2.94Å; N1864-L1866 VanDerWaalsContact O-N 3.15Å; L1866-S1868 VanDerWaalsContact C-N 3.27Å; L1866-S1868 PolarHBondContact O-N 2.99Å; L1866-H1872 PolarHBondContact O-CE1 3.17Å; L1866-H1872 PolarHBondContact O-NE2 3.18Å
1867	W	43.3	Very low	55.1	Low	187.4 Å²	187.4	97.1 Å²	97.1	71%	0.71	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-94	7.4	-178.8	-61.4	-24.8	0	0	0	116	T1858 N1864 C1865 K1869 R1870	T1858-W1867 HydrophobicContact CG2-CZ3 4.49Å; N1864-W1867 HydrophobicContact CB-CE3 4.05Å; N1864-W1867 HydrophobicContact CB-CZ3 4.06Å; N1864-W1867 PolarHBondContact O-N 3Å; N1864-W1867 WeakPolarHBondContact OD1-CZ3 3.1Å; C1865-W1867 PolarHBondContact O-N 3.11Å; C1865-W1867 VanDerWaalsContact O-N 3.15Å; C1865-W1867 VanDerWaalsContact SG-CD1 3.53Å; C1865-W1867 PolarHBondContact SG-NE1 2.99Å; C1865-W1867 VanDerWaalsContact SG-NE1 3.39Å; W1867-K1869 PolarHBondContact O-N 3.3Å; W1867-R1870 PolarHBondContact O-N 3.18Å
1868	S	38.7	Very low	53	Low	74.4 Å²	74.4	105.1 Å²	105.1	52%	0.52	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	71.7	171.6	-67.3	0	0	0	0	112.2	C1865 L1866 R1870 Y1871	C1865-S1868 WeakPolarHBondContact O-CB 3.49Å; C1865-S1868 PolarHBondContact O-N 2.98Å; L1866-S1868 VanDerWaalsContact C-N 3.27Å; L1866-S1868 PolarHBondContact O-N 2.99Å; S1868-R1870 PolarHBondContact O-N 2.96Å; S1868-Y1871 PolarHBondContact O-N 3.05Å
1869	K	39	Very low	51.4	Low	194.6 Å²	194.6	106.8 Å²	106.8	85%	0.846	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-7.7	176.8	-74.9	-175.4	175.3	-179.8	0	116.7	W1867	W1867-K1869 PolarHBondContact O-N 3.3Å
1870	R	37.9	Very low	49.9	Very low	171.4 Å²	171.4	111.1 Å²	111.1	65%	0.647	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-14	175.6	-72.2	-172.4	-171.1	141.9	2.3	115.3	T1858 W1867 S1868 H1872 T1873 C1874	T1858-R1870 PolarHBondContact OG1-NH1 3.11Å; T1858-R1870 PolarHBondContact OG1-NH2 2.94Å; W1867-R1870 PolarHBondContact O-N 3.18Å; S1868-R1870 PolarHBondContact O-N 2.96Å; R1870-H1872 PolarHBondContact O-N 3.01Å; R1870-T1873 PolarHBondContact O-N 2.85Å; R1870-T1873 PolarHBondContact O-OG1 2.92Å; R1870-C1874 PolarHBondContact O-N 2.86Å
1871	Y	40.4	Very low	48.8	Very low	119.6 Å²	119.6	115.4 Å²	115.4	47%	0.469	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.5	-8.3	-179.2	-70	-74.5	0	0	0	115.1	I1803 C1865 S1868 T1873 C1874	I1803-Y1871 HydrophobicContact CD1-CE1 3.94Å; I1803-Y1871 VanDerWaalsContact CD1-OH 3.3Å; I1803-Y1871 WeakPolarHBondContact CD1-OH 3.25Å; C1865-Y1871 WeakPolarHBondContact O-CD2 3.46Å; S1868-Y1871 PolarHBondContact O-N 3.05Å; Y1871-T1873 PolarHBondContact O-N 3.18Å; Y1871-T1873 VanDerWaalsContact O-N 3.11Å; Y1871-C1874 HydrophobicContact CD1-CB 3.63Å; Y1871-C1874 WeakPolarHBondContact CD1-SG 3.45Å; Y1871-C1874 HydrophobicContact CE1-CB 4.47Å; Y1871-C1874 WeakPolarHBondContact CE1-SG 3.37Å; Y1871-C1874 HydrophobicContact CG-CB 4.29Å; Y1871-C1874 WeakPolarHBondContact O-CB 3.45Å; Y1871-C1874 PolarHBondContact O-N 3.28Å; Y1871-C1874 VanDerWaalsContact O-N 3.07Å; Y1871-C1874 PolarHBondContact O-SG 3.33Å
1872	H	38.2	Very low	47.7	Very low	148.8 Å²	148.8	109 Å²	109	69%	0.689	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-1.2	166.1	-68.1	-49.1	0	0	0	113.7	L1866 R1870 K2144	L1866-H1872 PolarHBondContact O-CE1 3.17Å; L1866-H1872 PolarHBondContact O-NE2 3.18Å; R1870-H1872 PolarHBondContact O-N 3.01Å; H1872-K2144 PolarHBondContact O-NZ 3.21Å
1873	T	35	Very low	46.8	Very low	104 Å²	104	109.1 Å²	109.1	64%	0.638	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	0	169.6	44.5	0	0	0	0	113.9	R1870 Y1871 K1875	R1870-T1873 PolarHBondContact O-N 2.85Å; R1870-T1873 PolarHBondContact O-OG1 2.92Å; Y1871-T1873 PolarHBondContact O-N 3.18Å; Y1871-T1873 VanDerWaalsContact O-N 3.11Å; T1873-K1875 PolarHBondContact O-N 3.07Å
1874	C	36.4	Very low	46	Very low	65.6 Å²	65.6	107.9 Å²	107.9	44%	0.443	52%	0.523	S	S	.	.			trans	-70.3	56.5	153.8	-66.2	0	0	0	0	109.3	R1870 Y1871 M1876	R1870-C1874 PolarHBondContact O-N 2.86Å; Y1871-C1874 HydrophobicContact CD1-CB 3.63Å; Y1871-C1874 WeakPolarHBondContact CD1-SG 3.45Å; Y1871-C1874 HydrophobicContact CE1-CB 4.47Å; Y1871-C1874 WeakPolarHBondContact CE1-SG 3.37Å; Y1871-C1874 HydrophobicContact CG-CB 4.29Å; Y1871-C1874 WeakPolarHBondContact O-CB 3.45Å; Y1871-C1874 PolarHBondContact O-N 3.28Å; Y1871-C1874 VanDerWaalsContact O-N 3.07Å; Y1871-C1874 PolarHBondContact O-SG 3.33Å; C1874-M1876 VanDerWaalsContact C-N 3.33Å; C1874-M1876 PolarHBondContact O-N 3.26Å; C1874-M1876 VanDerWaalsContact O-N 3.1Å
1875	K	38.5	Very low	45.8	Very low	150.8 Å²	150.8	106.1 Å²	106.1	66%	0.656	51%	0.513	S	S	*	.			trans	-53.6	118.2	149.1	-77.3	178.7	171.6	-176.5	0	103.7	T1873 N1877 E1932 C2048	T1873-K1875 PolarHBondContact O-N 3.07Å; K1875-N1877 VanDerWaalsContact C-N 3.35Å; K1875-N1877 WeakPolarHBondContact O-CA 3.12Å; K1875-N1877 WeakPolarHBondContact O-CB 3.49Å; K1875-N1877 PolarHBondContact O-N 3.02Å; K1875-E1932 VanDerWaalsContact CD-OE1 3.31Å; K1875-E1932 WeakPolarHBondContact CD-OE1 3.37Å; K1875-E1932 WeakPolarHBondContact CD-OE2 3.48Å; K1875-E1932 IonicContact NZ-OE1 3.58Å; K1875-E1932 PolarHBondContact NZ-OE1 3Å; K1875-E1932 IonicContact NZ-OE2 2.68Å; K1875-E1932 PolarHBondContact NZ-OE2 2.79Å; K1875-C2048 PolarHBondContact NZ-SG 2.9Å
1876	M	42.4	Very low	46.1	Very low	60.8 Å²	60.8	103.9 Å²	103.9	30%	0.3	50%	0.498	S	S	.	.			trans	-44.1	102.5	164.2	-78.3	-89.8	179.6	0	0	105.8	Y1629 N1631 K1703 Y1705 C1874 K1878 L1879	Y1629-M1876 HydrophobicContact CD1-CE 3.7Å; Y1629-M1876 HydrophobicContact CD1-SD 4.11Å; Y1629-M1876 HydrophobicContact CE1-CE 4.15Å; Y1629-M1876 HydrophobicContact CE1-SD 4.45Å; N1631-M1876 VanDerWaalsContact OD1-CE 3.26Å; N1631-M1876 WeakPolarHBondContact OD1-CE 3.4Å; K1703-M1876 HydrophobicContact CG-SD 4.1Å; Y1705-M1876 HydrophobicContact CD1-CE 3.97Å; Y1705-M1876 HydrophobicContact CG-CE 4.45Å; C1874-M1876 VanDerWaalsContact C-N 3.33Å; C1874-M1876 PolarHBondContact O-N 3.26Å; C1874-M1876 VanDerWaalsContact O-N 3.1Å; M1876-K1878 VanDerWaalsContact C-N 3.3Å; M1876-K1878 WeakPolarHBondContact O-CA 3.19Å; M1876-K1878 PolarHBondContact O-N 3.28Å; M1876-L1879 HydrophobicContact CB-CD1 4.3Å; M1876-L1879 HydrophobicContact CB-CG 4.49Å; M1876-L1879 HydrophobicContact CG-CD1 4.46Å; M1876-L1879 HydrophobicContact SD-CD1 3.55Å; M1876-L1879 VanDerWaalsContact SD-CD1 3.55Å; M1876-L1879 HydrophobicContact SD-CG 4.38Å
1877	N	41.2	Very low	47.1	Very low	132.8 Å²	132.8	103.6 Å²	103.6	71%	0.71	50%	0.495	S	S	*	.			trans	-57.6	107.7	-167.4	-99.6	-26	0	0	0	105.8	K1875 L1879	K1875-N1877 VanDerWaalsContact C-N 3.35Å; K1875-N1877 WeakPolarHBondContact O-CA 3.12Å; K1875-N1877 WeakPolarHBondContact O-CB 3.49Å; K1875-N1877 PolarHBondContact O-N 3.02Å; N1877-L1879 VanDerWaalsContact C-N 3.29Å; N1877-L1879 WeakPolarHBondContact O-CA 3.29Å; N1877-L1879 WeakPolarHBondContact O-CD2 3.28Å; N1877-L1879 VanDerWaalsContact O-CG 3.27Å; N1877-L1879 WeakPolarHBondContact O-CG 3.31Å; N1877-L1879 PolarHBondContact O-N 3.24Å
1878	K	43.2	Very low	48.3	Very low	180 Å²	180	94.9 Å²	94.9	78%	0.783	46%	0.462	S	S	*	.			trans	-26.2	82.4	-162.1	-154.9	-175	-168.6	-177.5	0	109.6	M1876 I1880 F2050	M1876-K1878 VanDerWaalsContact C-N 3.3Å; M1876-K1878 WeakPolarHBondContact O-CA 3.19Å; M1876-K1878 PolarHBondContact O-N 3.28Å; K1878-I1880 VanDerWaalsContact C-N 3.25Å; K1878-I1880 PolarHBondContact O-N 2.94Å; K1878-F2050 HydrophobicContact CB-CB 4.05Å; K1878-F2050 HydrophobicContact CB-CD1 4.04Å; K1878-F2050 HydrophobicContact CB-CD2 3.52Å; K1878-F2050 HydrophobicContact CB-CE1 4.36Å; K1878-F2050 HydrophobicContact CB-CE2 3.86Å; K1878-F2050 HydrophobicContact CB-CG 3.62Å; K1878-F2050 HydrophobicContact CB-CZ 4.28Å; K1878-F2050 HydrophobicContact CD-CB 3.99Å; K1878-F2050 HydrophobicContact CD-CD2 4.31Å; K1878-F2050 HydrophobicContact CD-CG 4.4Å; K1878-F2050 HydrophobicContact CG-CD2 4.04Å; K1878-F2050 HydrophobicContact CG-CG 4.39Å; K1878-F2050 PolarHBondContact NZ-O 3.03Å
1879	L	49.9	Very low	49.3	Very low	62.6 Å²	62.6	91.7 Å²	91.7	33%	0.328	44%	0.441	S	S	.	.			trans	-61.8	119.5	-170.2	-76.7	174.1	0	0	0	104	N1631 F1632 L1833 M1876 N1877 L1881	N1631-L1879 HydrophobicContact CB-CD1 3.89Å; N1631-L1879 VanDerWaalsContact CG-CD1 3.43Å; N1631-L1879 WeakPolarHBondContact OD1-CD1 3.16Å; F1632-L1879 HydrophobicContact CE2-CB 3.95Å; F1632-L1879 HydrophobicContact CE2-CD1 4.15Å; F1632-L1879 HydrophobicContact CE2-CG 4.45Å; F1632-L1879 HydrophobicContact CZ-CB 4.04Å; F1632-L1879 HydrophobicContact CZ-CD1 4.49Å; L1833-L1879 HydrophobicContact CD1-CD1 4.02Å; L1833-L1879 HydrophobicContact CD1-CD2 4.27Å; L1833-L1879 HydrophobicContact CD2-CD1 4.21Å; L1833-L1879 HydrophobicContact CD2-CD2 4.22Å; M1876-L1879 HydrophobicContact CB-CD1 4.3Å; M1876-L1879 HydrophobicContact CB-CG 4.49Å; M1876-L1879 HydrophobicContact CG-CD1 4.46Å; M1876-L1879 HydrophobicContact SD-CD1 3.55Å; M1876-L1879 VanDerWaalsContact SD-CD1 3.55Å; M1876-L1879 HydrophobicContact SD-CG 4.38Å; N1877-L1879 VanDerWaalsContact C-N 3.29Å; N1877-L1879 WeakPolarHBondContact O-CA 3.29Å; N1877-L1879 WeakPolarHBondContact O-CD2 3.28Å; N1877-L1879 VanDerWaalsContact O-CG 3.27Å; N1877-L1879 WeakPolarHBondContact O-CG 3.31Å; N1877-L1879 PolarHBondContact O-N 3.24Å; L1879-L1881 VanDerWaalsContact C-N 3.33Å; L1879-L1881 PolarHBondContact O-N 2.9Å; L1879-L1881 VanDerWaalsContact O-N 3.1Å
1880	I	52.2	Low	50.2	Low	109.2 Å²	109.2	83.5 Å²	83.5	56%	0.56	41%	0.405	S	S	*	.			trans	-58.5	113.1	-179.6	-60.4	172.7	0	0	0	104.1	N1829 K1878 P1882	N1829-I1880 HydrophobicContact CB-CD1 3.37Å; N1829-I1880 HydrophobicContact CB-CG1 4.46Å; N1829-I1880 WeakPolarHBondContact O-CD1 3.36Å; N1829-I1880 WeakPolarHBondContact OD1-CD1 3.27Å; K1878-I1880 VanDerWaalsContact C-N 3.25Å; K1878-I1880 PolarHBondContact O-N 2.94Å; I1880-P1882 VanDerWaalsContact O-CD 3.24Å; I1880-P1882 WeakPolarHBondContact O-CD 3.24Å; I1880-P1882 VanDerWaalsContact O-N 3.12Å
1881	L	56.7	Low	50.8	Low	99.2 Å²	99.2	76.9 Å²	76.9	52%	0.519	38%	0.382	S	S	.	.			trans	-52.3	116.4	178	-166.5	74.9	0	0	0	105.1	F1632 E1701 L1879 E1883	F1632-L1881 HydrophobicContact CD1-CD1 4.26Å; F1632-L1881 HydrophobicContact CE1-CD1 3.9Å; F1632-L1881 HydrophobicContact CZ-CD1 4.31Å; E1701-L1881 VanDerWaalsContact OE1-CD1 3.27Å; E1701-L1881 WeakPolarHBondContact OE1-CD1 3.25Å; L1879-L1881 VanDerWaalsContact C-N 3.33Å; L1879-L1881 PolarHBondContact O-N 2.9Å; L1879-L1881 VanDerWaalsContact O-N 3.1Å; L1881-E1883 PolarHBondContact O-N 3.14Å
1882	P	58.6	Low	51.1	Low	6.4 Å²	6.4	73.6 Å²	73.6	4%	0.042	37%	0.373	C	S	.	.			trans	-57.2	125.1	-174.6	15.8	-25.6	0	0	0	107.9	F1632 I1699 W1815 N1818 L1833 W1850 I1880 I1884	F1632-P1882 HydrophobicContact CB-CG 4.25Å; F1632-P1882 HydrophobicContact CD1-CG 3.87Å; F1632-P1882 HydrophobicContact CD2-CG 3.99Å; F1632-P1882 HydrophobicContact CE1-CG 4.11Å; F1632-P1882 HydrophobicContact CE2-CG 4.23Å; F1632-P1882 HydrophobicContact CG-CG 3.82Å; F1632-P1882 HydrophobicContact CZ-CG 4.04Å; I1699-P1882 HydrophobicContact CD1-CB 4.11Å; I1699-P1882 HydrophobicContact CD1-CG 4.2Å; I1699-P1882 WeakPolarHBondContact CD1-O 3.28Å; I1699-P1882 HydrophobicContact CG2-CG 4.07Å; W1815-P1882 HydrophobicContact CD2-CB 4.39Å; W1815-P1882 HydrophobicContact CE3-CB 4.27Å; W1815-P1882 HydrophobicContact CH2-CB 3.34Å; W1815-P1882 HydrophobicContact CH2-CG 4.39Å; W1815-P1882 HydrophobicContact CZ2-CB 3.33Å; W1815-P1882 HydrophobicContact CZ3-CB 3.93Å; N1818-P1882 WeakPolarHBondContact OD1-CA 3.24Å; L1833-P1882 HydrophobicContact CD2-CB 4.12Å; L1833-P1882 HydrophobicContact CD2-CG 3.81Å; W1850-P1882 HydrophobicContact CH2-CB 4.28Å; W1850-P1882 HydrophobicContact CH2-CG 4Å; W1850-P1882 HydrophobicContact CZ2-CB 4.43Å; W1850-P1882 HydrophobicContact CZ2-CG 4.47Å; I1880-P1882 VanDerWaalsContact O-CD 3.24Å; I1880-P1882 WeakPolarHBondContact O-CD 3.24Å; I1880-P1882 VanDerWaalsContact O-N 3.12Å; P1882-I1884 WeakPolarHBondContact O-CA 3.39Å; P1882-I1884 PolarHBondContact O-N 2.82Å; P1882-I1884 VanDerWaalsContact O-N 3.09Å
1883	E	57.4	Low	51.2	Low	78.8 Å²	78.8	70.6 Å²	70.6	37%	0.368	36%	0.357	S	S	.	.			trans	-63.6	133.7	179.1	-74.7	174.4	174.6	0	0	108	W1815 W1816 N1817 N1818 Q1819 L1881 D1885 G1886	W1815-E1883 WeakPolarHBondContact CZ2-O 2.99Å; W1815-E1883 PolarHBondContact NE1-O 2.89Å; W1816-E1883 WeakPolarHBondContact CZ2-O 3.48Å; W1816-E1883 PolarHBondContact NE1-O 3.01Å; N1817-E1883 HydrophobicContact CB-CB 4.39Å; N1817-E1883 HydrophobicContact CB-CG 4.24Å; N1817-E1883 VanDerWaalsContact CG-CD 3.47Å; N1817-E1883 WeakPolarHBondContact ND2-CB 3.36Å; N1817-E1883 WeakPolarHBondContact ND2-CG 3.44Å; N1817-E1883 PolarHBondContact ND2-O 2.95Å; N1817-E1883 PolarHBondContact ND2-OE1 3.23Å; N1817-E1883 VanDerWaalsContact ND2-OE1 3.12Å; N1817-E1883 PolarHBondContact ND2-OE2 3.03Å; N1817-E1883 WeakPolarHBondContact OD1-CB 3.47Å; N1817-E1883 WeakPolarHBondContact OD1-CG 3.15Å; N1817-E1883 PolarHBondContact OD1-N 3.08Å; N1817-E1883 VanDerWaalsContact OD1-N 3.12Å; N1817-E1883 PolarHBondContact OD1-OE2 3.11Å; N1818-E1883 HydrophobicContact CB-CB 4.07Å; N1818-E1883 HydrophobicContact CB-CG 3.9Å; N1818-E1883 PolarHBondContact N-OE2 3.32Å; N1818-E1883 PolarHBondContact OD1-N 2.79Å; Q1819-E1883 VanDerWaalsContact CB-OE1 3.28Å; Q1819-E1883 WeakPolarHBondContact CB-OE1 3.46Å; Q1819-E1883 VanDerWaalsContact CG-OE1 3.23Å; Q1819-E1883 WeakPolarHBondContact CG-OE1 3.44Å; Q1819-E1883 PolarHBondContact N-OE2 3.34Å; Q1819-E1883 VanDerWaalsContact N-OE2 3.15Å; Q1819-E1883 PolarHBondContact NE2-OE1 2.82Å; Q1819-E1883 PolarHBondContact OE1-OE1 3.45Å; Q1819-E1883 PolarHBondContact OE1-OE2 3.03Å; L1881-E1883 PolarHBondContact O-N 3.14Å; E1883-D1885 PolarHBondContact O-N 3.09Å; E1883-G1886 PolarHBondContact O-N 3.26Å
1884	I	58	Low	51.3	Low	86 Å²	86	71.6 Å²	71.6	44%	0.441	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-16.2	-168.2	-57.5	170.1	0	0	0	111.8	R1695 I1699 P1882 G1886	R1695-I1884 PolarHBondContact NH1-O 2.94Å; R1695-I1884 VanDerWaalsContact NH1-O 3.13Å; I1699-I1884 HydrophobicContact CD1-CB 4.42Å; I1699-I1884 HydrophobicContact CD1-CG1 4.09Å; I1699-I1884 HydrophobicContact CD1-CG2 4.38Å; I1699-I1884 HydrophobicContact CG1-CG1 4.19Å; P1882-I1884 WeakPolarHBondContact O-CA 3.39Å; P1882-I1884 PolarHBondContact O-N 2.82Å; P1882-I1884 VanDerWaalsContact O-N 3.09Å; I1884-G1886 VanDerWaalsContact C-N 3.32Å; I1884-G1886 PolarHBondContact O-N 3.4Å
1885	D	56.7	Low	51.1	Low	70.4 Å²	70.4	73.9 Å²	73.9	38%	0.376	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	13.8	-178.2	-67	-20.5	0	0	0	114.1	R1695 N1817 N1818 Q1819 E1883 H1887	R1695-D1885 IonicContact CZ-OD1 3.2Å; R1695-D1885 VanDerWaalsContact CZ-OD1 3.22Å; R1695-D1885 IonicContact NE-OD1 3.34Å; R1695-D1885 PolarHBondContact NE-OD1 2.91Å; R1695-D1885 VanDerWaalsContact NH1-CA 3.35Å; R1695-D1885 PolarHBondContact NH1-O 3.12Å; R1695-D1885 IonicContact NH1-OD1 2.94Å; R1695-D1885 PolarHBondContact NH1-OD1 3.43Å; R1695-D1885 VanDerWaalsContact NH2-CG 3.33Å; R1695-D1885 PolarHBondContact NH2-O 2.78Å; R1695-D1885 IonicContact NH2-OD1 3.25Å; R1695-D1885 PolarHBondContact NH2-OD1 2.78Å; R1695-D1885 IonicContact NH2-OD2 2.74Å; R1695-D1885 PolarHBondContact NH2-OD2 2.94Å; N1817-D1885 CarbonylContact C-O 3.58Å; N1817-D1885 VanDerWaalsContact CA-O 3.23Å; N1817-D1885 WeakPolarHBondContact CA-O 3.46Å; N1817-D1885 PolarHBondContact OD1-O 2.92Å; N1818-D1885 HydrophobicContact CB-CB 4.48Å; N1818-D1885 VanDerWaalsContact CG-O 3.32Å; N1818-D1885 PolarHBondContact N-O 3.41Å; N1818-D1885 PolarHBondContact ND2-O 3.05Å; N1818-D1885 PolarHBondContact OD1-O 3.43Å; Q1819-D1885 PolarHBondContact NE2-OD2 3.36Å; E1883-D1885 PolarHBondContact O-N 3.09Å; D1885-H1887 PolarHBondContact O-CD2 2.86Å; D1885-H1887 PolarHBondContact O-CE1 3.49Å; D1885-H1887 PolarHBondContact O-ND1 3.24Å
1886	G	59.6	Low	50.7	Low	2 Å²	2	74.6 Å²	74.6	2%	0.021	36%	0.358	C	S	.	.			trans	-82.9	159.6	-179.9	0	0	0	0	0	115.2	W1815 W1816 N1817 E1883 I1884	W1815-G1886 VanDerWaalsContact CH2-O 3.31Å; W1815-G1886 WeakPolarHBondContact CH2-O 3.16Å; W1815-G1886 VanDerWaalsContact CZ2-O 3.26Å; W1815-G1886 WeakPolarHBondContact CZ2-O 3.27Å; W1815-G1886 VanDerWaalsContact NE1-C 3.28Å; W1815-G1886 PolarHBondContact NE1-O 2.86Å; W1815-G1886 VanDerWaalsContact NE1-O 3.08Å; W1816-G1886 WeakPolarHBondContact CH2-O 3.25Å; W1816-G1886 VanDerWaalsContact CZ2-C 3.42Å; W1816-G1886 VanDerWaalsContact CZ2-O 3.27Å; W1816-G1886 WeakPolarHBondContact CZ2-O 3.34Å; W1816-G1886 CarbonylContact O-C 3.54Å; W1816-G1886 WeakPolarHBondContact O-CA 3.28Å; N1817-G1886 WeakPolarHBondContact O-CA 3.42Å; E1883-G1886 PolarHBondContact O-N 3.26Å; I1884-G1886 VanDerWaalsContact C-N 3.32Å; I1884-G1886 PolarHBondContact O-N 3.4Å
1887	H	65.4	Low	50.1	Low	70 Å²	70	75.9 Å²	75.9	32%	0.324	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	149.7	-177.3	-61.3	-52.7	0	0	0	111.9	Q1532 W1815 W1816 N1817 N1818 D1848 D1885 G1889	Q1532-H1887 PolarHBondContact NE2-ND1 2.89Å; Q1532-H1887 VanDerWaalsContact NE2-ND1 3.19Å; W1815-H1887 WeakPolarHBondContact CA-O 3.43Å; W1816-H1887 PolarHBondContact N-O 2.94Å; W1816-H1887 PolarHBondContact O-N 3.08Å; W1816-H1887 VanDerWaalsContact O-N 3.07Å; N1817-H1887 PolarHBondContact N-O 3.43Å; N1817-H1887 PolarHBondContact O-N 3.43Å; N1817-H1887 VanDerWaalsContact O-N 3.15Å; N1818-H1887 VanDerWaalsContact CG-CE1 3.44Å; N1818-H1887 PolarHBondContact ND2-CE1 3.33Å; N1818-H1887 PolarHBondContact ND2-NE2 2.79Å; N1818-H1887 PolarHBondContact OD1-CD2 2.9Å; N1818-H1887 PolarHBondContact OD1-CE1 3.22Å; N1818-H1887 PolarHBondContact OD1-ND1 2.88Å; N1818-H1887 PolarHBondContact OD1-NE2 2.81Å; D1848-H1887 IonicContact OD2-CE1 3.18Å; D1848-H1887 IonicContact OD2-CG 2.74Å; D1848-H1887 IonicContact OD2-ND1 3.33Å; D1848-H1887 PolarHBondContact OD2-ND1 2.82Å; D1885-H1887 PolarHBondContact O-CD2 2.86Å; D1885-H1887 PolarHBondContact O-CE1 3.49Å; D1885-H1887 PolarHBondContact O-ND1 3.24Å; H1887-G1889 PolarHBondContact O-N 3.2Å; H1887-G1889 VanDerWaalsContact O-N 3.07Å
1888	L	68.5	Low	49.5	Very low	5.6 Å²	5.6	73.3 Å²	73.3	3%	0.029	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	127.4	169.1	-85.8	151.6	0	0	0	109.9	S1533 K1534 F1535 I1813 R1814 W1815 W1816 V1835 P1837 D1848 W1850 R2030	S1533-L1888 PolarHBondContact N-O 2.91Å; S1533-L1888 WeakPolarHBondContact O-CB 3.21Å; S1533-L1888 VanDerWaalsContact OG-C 3.23Å; S1533-L1888 PolarHBondContact OG-O 2.78Å; K1534-L1888 CarbonylContact C-O 3.57Å; K1534-L1888 WeakPolarHBondContact CA-O 3.26Å; F1535-L1888 HydrophobicContact CB-CB 3.59Å; F1535-L1888 HydrophobicContact CB-CD1 4.17Å; F1535-L1888 WeakPolarHBondContact CB-O 3.26Å; F1535-L1888 HydrophobicContact CD1-CD1 3.85Å; F1535-L1888 HydrophobicContact CD2-CD1 3.49Å; F1535-L1888 VanDerWaalsContact CD2-CD1 3.49Å; F1535-L1888 HydrophobicContact CE1-CD1 4.36Å; F1535-L1888 HydrophobicContact CE2-CD1 3.38Å; F1535-L1888 HydrophobicContact CE2-CD2 3.72Å; F1535-L1888 HydrophobicContact CE2-CG 4.2Å; F1535-L1888 HydrophobicContact CG-CB 4.26Å; F1535-L1888 HydrophobicContact CG-CD1 4.16Å; F1535-L1888 HydrophobicContact CZ-CD1 4.37Å; F1535-L1888 HydrophobicContact CZ-CD2 4.21Å; F1535-L1888 PolarHBondContact N-O 2.86Å; I1813-L1888 HydrophobicContact CG2-CB 4.28Å; I1813-L1888 HydrophobicContact CG2-CD2 3.83Å; R1814-L1888 HydrophobicContact CB-CD1 3.63Å; R1814-L1888 HydrophobicContact CB-CG 4.15Å; R1814-L1888 HydrophobicContact CG-CD1 4.45Å; R1814-L1888 CarbonylContact O-C 3.5Å; W1815-L1888 HydrophobicContact CB-CD2 4.29Å; W1815-L1888 HydrophobicContact CE3-CD2 4.06Å; W1815-L1888 HydrophobicContact CE3-CG 3.87Å; W1815-L1888 HydrophobicContact CZ3-CG 4Å; W1816-L1888 HydrophobicContact CE3-CB 4.08Å; W1816-L1888 HydrophobicContact CE3-CD1 4.35Å; W1816-L1888 HydrophobicContact CZ3-CB 4.15Å; V1835-L1888 HydrophobicContact CG1-CD2 3.76Å; V1835-L1888 HydrophobicContact CG2-CD1 3.42Å; V1835-L1888 VanDerWaalsContact CG2-CD1 3.42Å; V1835-L1888 HydrophobicContact CG2-CD2 3.98Å; P1837-L1888 HydrophobicContact CB-CD1 4.32Å; P1837-L1888 HydrophobicContact CG-CD1 4.34Å; D1848-L1888 HydrophobicContact CB-CD1 4.15Å; W1850-L1888 HydrophobicContact CB-CD1 4.05Å; W1850-L1888 HydrophobicContact CB-CD2 4.15Å; W1850-L1888 HydrophobicContact CB-CG 4.4Å; W1850-L1888 VanDerWaalsContact CD1-CG 3.49Å; W1850-L1888 HydrophobicContact CG-CD1 4.32Å; W1850-L1888 HydrophobicContact CG-CD2 3.97Å; W1850-L1888 HydrophobicContact CG-CG 4.27Å; L1888-R2030 PolarHBondContact O-NH1 2.83Å
1889	G	60.2	Low	48.7	Very low	6.8 Å²	6.8	69.3 Å²	69.3	7%	0.07	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	-179.7	173.9	0	0	0	0	0	112.4	I1813 R1814 W1815 W1816 H1887 N1891	I1813-G1889 VanDerWaalsContact CA-O 3.24Å; I1813-G1889 WeakPolarHBondContact CA-O 3.4Å; R1814-G1889 PolarHBondContact N-O 2.86Å; R1814-G1889 PolarHBondContact O-N 3.1Å; R1814-G1889 VanDerWaalsContact O-O 3.06Å; W1815-G1889 PolarHBondContact N-O 2.8Å; W1815-G1889 CarbonylContact O-C 3.49Å; W1815-G1889 WeakPolarHBondContact O-CA 3.38Å; W1815-G1889 PolarHBondContact O-N 3.21Å; W1816-G1889 WeakPolarHBondContact CZ3-O 3.47Å; W1816-G1889 PolarHBondContact NE1-O 3.14Å; H1887-G1889 PolarHBondContact O-N 3.2Å; H1887-G1889 VanDerWaalsContact O-N 3.07Å; G1889-N1891 PolarHBondContact O-N 3.38Å
1890	W	58.2	Low	47.7	Very low	21.8 Å²	21.8	73.8 Å²	73.8	8%	0.083	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	139.2	170.6	-58.9	57.8	0	0	0	109.9	M1446 Y1449 S1486 R1488 T1510 F1512 S1533 S1811 I1813 R1814 W1816 L1892 V1992 R2049	M1446-W1890 HydrophobicContact CE-CE3 4.33Å; Y1449-W1890 HydrophobicContact CD2-CB 4.32Å; Y1449-W1890 AromaticContact CD2-CD2 3.74Å; Y1449-W1890 HydrophobicContact CD2-CD2 3.74Å; Y1449-W1890 AromaticContact CD2-CE3 3.71Å; Y1449-W1890 HydrophobicContact CD2-CE3 3.71Å; Y1449-W1890 VanDerWaalsContact CD2-CE3 3.47Å; Y1449-W1890 HydrophobicContact CD2-CG 4.11Å; Y1449-W1890 AromaticContact CD2-CZ3 3.97Å; Y1449-W1890 HydrophobicContact CD2-CZ3 4.23Å; Y1449-W1890 HydrophobicContact CE2-CB 3.84Å; Y1449-W1890 AromaticContact CE2-CD2 3.48Å; Y1449-W1890 HydrophobicContact CE2-CD2 3.87Å; Y1449-W1890 VanDerWaalsContact CE2-CD2 3.48Å; Y1449-W1890 AromaticContact CE2-CE2 3.8Å; Y1449-W1890 AromaticContact CE2-CE3 3.18Å; Y1449-W1890 HydrophobicContact CE2-CE3 3.46Å; Y1449-W1890 AromaticContact CE2-CG 3.97Å; Y1449-W1890 HydrophobicContact CE2-CG 4.07Å; Y1449-W1890 AromaticContact CE2-CH2 3.78Å; Y1449-W1890 HydrophobicContact CE2-CH2 4.14Å; Y1449-W1890 AromaticContact CE2-CZ2 3.97Å; Y1449-W1890 HydrophobicContact CE2-CZ2 3.97Å; Y1449-W1890 AromaticContact CE2-CZ3 3.37Å; Y1449-W1890 HydrophobicContact CE2-CZ3 3.37Å; Y1449-W1890 VanDerWaalsContact CE2-CZ3 3.42Å; Y1449-W1890 AromaticContact CZ-CE3 3.67Å; Y1449-W1890 AromaticContact CZ-CZ3 3.58Å; Y1449-W1890 WeakPolarHBondContact OH-CZ3 3.3Å; S1486-W1890 WeakPolarHBondContact OG-CH2 3.31Å; R1488-W1890 HydrophobicContact CB-CH2 4.03Å; R1488-W1890 HydrophobicContact CB-CZ2 4.09Å; R1488-W1890 HydrophobicContact CG-CH2 3.68Å; R1488-W1890 HydrophobicContact CG-CZ2 4.23Å; R1488-W1890 HydrophobicContact CG-CZ3 4.48Å; T1510-W1890 HydrophobicContact CG2-CD2 4.21Å; T1510-W1890 HydrophobicContact CG2-CG 4.38Å; F1512-W1890 AromaticContact CE1-CD1 3.95Å; F1512-W1890 AromaticContact CE1-CE2 3.91Å; F1512-W1890 HydrophobicContact CE1-CE3 4.04Å; F1512-W1890 HydrophobicContact CE1-CZ2 4.24Å; F1512-W1890 HydrophobicContact CE1-CZ3 4.38Å; F1512-W1890 AromaticContact CE1-NE1 3.17Å; F1512-W1890 AromaticContact CZ-CE3 3.76Å; F1512-W1890 HydrophobicContact CZ-CE3 3.76Å; F1512-W1890 AromaticContact CZ-CZ2 3.89Å; F1512-W1890 HydrophobicContact CZ-CZ2 3.89Å; F1512-W1890 AromaticContact CZ-CZ3 3.74Å; F1512-W1890 HydrophobicContact CZ-CZ3 3.74Å; F1512-W1890 AromaticContact CZ-NE1 3.72Å; S1533-W1890 WeakPolarHBondContact OG-CA 3.42Å; S1533-W1890 WeakPolarHBondContact OG-CB 3.1Å; S1533-W1890 PolarHBondContact OG-N 2.98Å; S1533-W1890 PolarHBondContact OG-O 3.09Å; S1811-W1890 VanDerWaalsContact CB-CZ3 3.48Å; S1811-W1890 WeakPolarHBondContact O-CH2 2.77Å; S1811-W1890 WeakPolarHBondContact O-CZ3 3.05Å; I1813-W1890 HydrophobicContact CD1-CE3 4.44Å; I1813-W1890 HydrophobicContact CD1-CH2 3.81Å; I1813-W1890 HydrophobicContact CD1-CZ3 3.72Å; I1813-W1890 HydrophobicContact CG1-CD2 4.27Å; I1813-W1890 HydrophobicContact CG1-CE3 3.52Å; I1813-W1890 HydrophobicContact CG1-CH2 3.78Å; I1813-W1890 HydrophobicContact CG1-CZ2 4.48Å; I1813-W1890 HydrophobicContact CG1-CZ3 3.25Å; R1814-W1890 HydrophobicContact CG-CD2 4.47Å; R1814-W1890 HydrophobicContact CG-CE3 3.86Å; R1814-W1890 HydrophobicContact CG-CH2 3.73Å; R1814-W1890 HydrophobicContact CG-CZ2 4.32Å; R1814-W1890 HydrophobicContact CG-CZ3 3.47Å; R1814-W1890 VanDerWaalsContact CG-CZ3 3.47Å; W1816-W1890 WeakPolarHBondContact CH2-O 3.45Å; W1890-L1892 VanDerWaalsContact C-N 3.3Å; W1890-L1892 HydrophobicContact CB-CG 4.48Å; W1890-L1892 PolarHBondContact O-N 3.04Å; W1890-L1892 VanDerWaalsContact O-N 3.11Å; W1890-V1992 HydrophobicContact CZ2-CG1 3.86Å; W1890-R2049 HydrophobicContact CH2-CG 4.05Å; W1890-R2049 HydrophobicContact CZ3-CG 4.23Å
1891	N	50.4	Low	46.7	Very low	33.2 Å²	33.2	74.2 Å²	74.2	18%	0.178	39%	0.385	C	S	.	.			trans	-76.9	93.2	179.8	-174.1	-11.1	0	0	0	110.7	M1446 R1450 G1812 R1814 W1815 W1816 G1889 K1893	M1446-N1891 HydrophobicContact CE-CB 3.97Å; R1450-N1891 WeakPolarHBondContact CG-O 3.19Å; R1450-N1891 VanDerWaalsContact CZ-O 3.27Å; R1450-N1891 VanDerWaalsContact CZ-OD1 3.22Å; R1450-N1891 PolarHBondContact NE-O 3.05Å; R1450-N1891 PolarHBondContact NE-OD1 3.38Å; R1450-N1891 PolarHBondContact NH2-ND2 3.2Å; R1450-N1891 VanDerWaalsContact NH2-ND2 3.12Å; R1450-N1891 PolarHBondContact NH2-O 2.84Å; R1450-N1891 PolarHBondContact NH2-OD1 3.23Å; G1812-N1891 WeakPolarHBondContact O-CA 3.18Å; G1812-N1891 WeakPolarHBondContact O-CB 3.2Å; G1812-N1891 PolarHBondContact O-N 3.29Å; R1814-N1891 VanDerWaalsContact CD-CG 3.44Å; R1814-N1891 HydrophobicContact CG-CB 4.13Å; R1814-N1891 PolarHBondContact NE-ND2 3.34Å; W1815-N1891 HydrophobicContact CD2-CB 3.64Å; W1815-N1891 HydrophobicContact CE3-CB 4.31Å; W1815-N1891 HydrophobicContact CG-CB 3.69Å; W1815-N1891 VanDerWaalsContact CH2-ND2 3.35Å; W1815-N1891 WeakPolarHBondContact CH2-ND2 3.3Å; W1815-N1891 HydrophobicContact CZ2-CB 4.19Å; W1815-N1891 WeakPolarHBondContact CZ2-ND2 3.17Å; W1815-N1891 WeakPolarHBondContact CZ3-ND2 3.35Å; W1816-N1891 HydrophobicContact CD2-CB 4.03Å; W1816-N1891 HydrophobicContact CE3-CB 3.69Å; W1816-N1891 HydrophobicContact CH2-CB 4.15Å; W1816-N1891 HydrophobicContact CZ2-CB 3.66Å; W1816-N1891 HydrophobicContact CZ3-CB 4.07Å; W1816-N1891 VanDerWaalsContact CZ3-N 3.35Å; G1889-N1891 PolarHBondContact O-N 3.38Å; N1891-K1893 VanDerWaalsContact C-N 3.25Å; N1891-K1893 WeakPolarHBondContact ND2-CE 3.36Å; N1891-K1893 PolarHBondContact O-N 2.95Å; N1891-K1893 VanDerWaalsContact O-N 3.16Å; N1891-K1893 VanDerWaalsContact OD1-CB 3.27Å; N1891-K1893 WeakPolarHBondContact OD1-CB 3.42Å; N1891-K1893 VanDerWaalsContact OD1-CD 3.28Å; N1891-K1893 WeakPolarHBondContact OD1-CD 3.25Å; N1891-K1893 VanDerWaalsContact OD1-CG 3.22Å; N1891-K1893 WeakPolarHBondContact OD1-CG 3.3Å; N1891-K1893 PolarHBondContact OD1-N 3.05Å; N1891-K1893 VanDerWaalsContact OD1-N 3.07Å
1892	L	46.5	Very low	45.3	Very low	51 Å²	51	75.8 Å²	75.8	27%	0.267	39%	0.394	S	S	.	.			trans	-86	36.3	173	-64.8	171.7	0	0	0	111.5	Y1449 F1512 W1531 L1806 W1890 H1894 Y1895 F2050	Y1449-L1892 HydrophobicContact CD1-CD2 3.41Å; Y1449-L1892 VanDerWaalsContact CD1-CD2 3.43Å; Y1449-L1892 HydrophobicContact CE1-CD2 3.76Å; Y1449-L1892 HydrophobicContact CG-CD2 3.95Å; Y1449-L1892 VanDerWaalsContact O-CD2 3.22Å; Y1449-L1892 WeakPolarHBondContact O-CD2 3.41Å; F1512-L1892 HydrophobicContact CD1-CD1 3.94Å; F1512-L1892 HydrophobicContact CE1-CD1 4.18Å; W1531-L1892 HydrophobicContact CB-CD1 3.9Å; W1531-L1892 VanDerWaalsContact O-CD1 3.27Å; W1531-L1892 WeakPolarHBondContact O-CD1 3.11Å; L1806-L1892 HydrophobicContact CD1-CD1 4.43Å; L1806-L1892 HydrophobicContact CD1-CD2 4.04Å; L1806-L1892 HydrophobicContact CG-CD2 4.16Å; W1890-L1892 VanDerWaalsContact C-N 3.3Å; W1890-L1892 HydrophobicContact CB-CG 4.48Å; W1890-L1892 PolarHBondContact O-N 3.04Å; W1890-L1892 VanDerWaalsContact O-N 3.11Å; L1892-H1894 PolarHBondContact O-N 3.39Å; L1892-Y1895 HydrophobicContact CB-CD2 4.37Å; L1892-Y1895 VanDerWaalsContact O-CD2 3.26Å; L1892-Y1895 WeakPolarHBondContact O-CD2 3.49Å; L1892-Y1895 WeakPolarHBondContact O-CE2 3.32Å; L1892-Y1895 PolarHBondContact O-N 2.99Å; L1892-Y1895 VanDerWaalsContact O-N 3.12Å; L1892-F2050 HydrophobicContact CD2-CB 3.6Å
1893	K	41.2	Very low	43.9	Very low	85 Å²	85	83.1 Å²	83.1	37%	0.37	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	44.7	-171.5	-81	179.5	-174.7	-174.8	0	115.1	W1816 N1818 N1891 Y1895	W1816-K1893 HydrophobicContact CH2-CD 4.4Å; W1816-K1893 HydrophobicContact CH2-CG 3.9Å; W1816-K1893 HydrophobicContact CZ3-CG 4.26Å; N1818-K1893 PolarHBondContact O-NZ 2.83Å; N1818-K1893 WeakPolarHBondContact OD1-CE 3.22Å; N1818-K1893 PolarHBondContact OD1-NZ 2.92Å; N1891-K1893 VanDerWaalsContact C-N 3.25Å; N1891-K1893 WeakPolarHBondContact ND2-CE 3.36Å; N1891-K1893 PolarHBondContact O-N 2.95Å; N1891-K1893 VanDerWaalsContact O-N 3.16Å; N1891-K1893 VanDerWaalsContact OD1-CB 3.27Å; N1891-K1893 WeakPolarHBondContact OD1-CB 3.42Å; N1891-K1893 VanDerWaalsContact OD1-CD 3.28Å; N1891-K1893 WeakPolarHBondContact OD1-CD 3.25Å; N1891-K1893 VanDerWaalsContact OD1-CG 3.22Å; N1891-K1893 WeakPolarHBondContact OD1-CG 3.3Å; N1891-K1893 PolarHBondContact OD1-N 3.05Å; N1891-K1893 VanDerWaalsContact OD1-N 3.07Å; K1893-Y1895 WeakPolarHBondContact O-CD2 3.37Å; K1893-Y1895 PolarHBondContact O-N 2.93Å
1894	H	36.3	Very low	42.6	Very low	125 Å²	125	84.6 Å²	84.6	58%	0.579	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.4	25.4	166.8	-65.5	65.4	0	0	0	114.9	L1892 K1896 R2030	L1892-H1894 PolarHBondContact O-N 3.39Å; H1894-K1896 PolarHBondContact O-N 2.89Å; H1894-K1896 VanDerWaalsContact O-N 3.12Å; H1894-R2030 WeakPolarHBondContact O-CD 3.06Å; H1894-R2030 PolarHBondContact O-NE 3.45Å; H1894-R2030 PolarHBondContact O-NH1 2.94Å; H1894-R2030 PolarHBondContact O-NH2 2.93Å
1895	Y	31.7	Very low	41.2	Very low	114 Å²	114	88.1 Å²	88.1	45%	0.447	47%	0.468	S	S	.	.			trans	-84.3	103.3	168.5	-84.4	-88.6	0	0	0	111.4	Y1449 C1805 L1806 L1892 K1893 V1897 V1992 N1993 R2030 R2049	Y1449-Y1895 HydrophobicContact CD1-CE2 4.32Å; C1805-Y1895 PolarHBondContact O-OH 3.3Å; L1806-Y1895 WeakPolarHBondContact CA-OH 3.23Å; L1806-Y1895 HydrophobicContact CD1-CE2 4.07Å; L1806-Y1895 PolarHBondContact N-OH 3Å; L1892-Y1895 HydrophobicContact CB-CD2 4.37Å; L1892-Y1895 VanDerWaalsContact O-CD2 3.26Å; L1892-Y1895 WeakPolarHBondContact O-CD2 3.49Å; L1892-Y1895 WeakPolarHBondContact O-CE2 3.32Å; L1892-Y1895 PolarHBondContact O-N 2.99Å; L1892-Y1895 VanDerWaalsContact O-N 3.12Å; K1893-Y1895 WeakPolarHBondContact O-CD2 3.37Å; K1893-Y1895 PolarHBondContact O-N 2.93Å; Y1895-V1897 PolarHBondContact O-N 3.07Å; Y1895-V1897 VanDerWaalsContact O-N 3.09Å; Y1895-V1992 HydrophobicContact CE1-CB 4.42Å; Y1895-V1992 HydrophobicContact CE1-CG1 4.39Å; Y1895-V1992 HydrophobicContact CE2-CG1 4.39Å; Y1895-V1992 WeakPolarHBondContact OH-CB 3.22Å; Y1895-V1992 WeakPolarHBondContact OH-CG1 3.41Å; Y1895-N1993 WeakPolarHBondContact CD1-ND2 3.17Å; Y1895-N1993 WeakPolarHBondContact CE1-ND2 3.21Å; Y1895-N1993 WeakPolarHBondContact CE1-OD1 3.3Å; Y1895-R2030 VanDerWaalsContact CA-CZ 3.46Å; Y1895-R2030 HydrophobicContact CD1-CB 4.24Å; Y1895-R2030 HydrophobicContact CD1-CG 3.92Å; Y1895-R2030 HydrophobicContact CE1-CB 3.53Å; Y1895-R2030 VanDerWaalsContact CE1-CD 3.49Å; Y1895-R2030 HydrophobicContact CE1-CG 3.72Å; Y1895-R2049 PolarHBondContact OH-NH2 2.72Å
1896	K	29.7	Very low	39.8	Very low	166.2 Å²	166.2	94.8 Å²	94.8	72%	0.723	49%	0.489	S	S	*	.			trans	-69	108.4	163.4	-80.6	-175.6	176.5	-179.7	0	108.2	N1801 H1894 P1898 N2027 R2030	N1801-K1896 PolarHBondContact OD1-NZ 3.08Å; H1894-K1896 PolarHBondContact O-N 2.89Å; H1894-K1896 VanDerWaalsContact O-N 3.12Å; K1896-P1898 VanDerWaalsContact O-CD 3.23Å; K1896-P1898 WeakPolarHBondContact O-CD 3.46Å; K1896-N2027 CarbonylContact C-O 3.52Å; K1896-N2027 HydrophobicContact CB-CB 3.93Å; K1896-N2027 HydrophobicContact CD-CB 4.48Å; K1896-N2027 WeakPolarHBondContact CD-OD1 2.92Å; K1896-R2030 VanDerWaalsContact N-CZ 3.27Å; K1896-R2030 PolarHBondContact O-NH1 3.22Å
1897	V	30.6	Very low	38.3	Very low	88.6 Å²	88.6	101.4 Å²	101.4	54%	0.537	53%	0.525	S	S	.	.			trans	-70.1	126.2	165.8	-178.6	0	0	0	0	108.1	L1528 W1822 R1827 Y1895 S1899 N2027	L1528-V1897 HydrophobicContact CD2-CG2 4.46Å; W1822-V1897 HydrophobicContact CH2-CB 3.9Å; W1822-V1897 HydrophobicContact CH2-CG2 4.36Å; W1822-V1897 HydrophobicContact CZ2-CB 4.18Å; W1822-V1897 HydrophobicContact CZ2-CG2 4.17Å; R1827-V1897 PolarHBondContact NH1-O 3.07Å; R1827-V1897 VanDerWaalsContact NH1-O 3.16Å; Y1895-V1897 PolarHBondContact O-N 3.07Å; Y1895-V1897 VanDerWaalsContact O-N 3.09Å; V1897-S1899 PolarHBondContact O-N 3.14Å; V1897-N2027 CarbonylContact C-O 3.6Å
1898	P	27.9	Very low	36.5	Very low	76.8 Å²	76.8	102.2 Å²	102.2	50%	0.499	54%	0.538	S	S	.	.			trans	-68.9	121.2	176.4	-8.8	20.7	0	0	0	110	M1370 K1896 L1900 N2027 S2028	M1370-P1898 HydrophobicContact CE-CB 3.89Å; M1370-P1898 HydrophobicContact CE-CG 3.82Å; M1370-P1898 HydrophobicContact SD-CB 3.71Å; M1370-P1898 HydrophobicContact SD-CG 3.58Å; M1370-P1898 VanDerWaalsContact SD-CG 3.58Å; K1896-P1898 VanDerWaalsContact O-CD 3.23Å; K1896-P1898 WeakPolarHBondContact O-CD 3.46Å; P1898-L1900 PolarHBondContact O-N 2.94Å; P1898-N2027 WeakPolarHBondContact CA-O 3.06Å; P1898-N2027 HydrophobicContact CB-CB 4.44Å; P1898-N2027 WeakPolarHBondContact CD-O 3.39Å; P1898-S2028 WeakPolarHBondContact CB-OG 3.28Å; P1898-S2028 VanDerWaalsContact CG-CB 3.46Å; P1898-S2028 WeakPolarHBondContact CG-OG 3.4Å
1899	S	27.5	Very low	34.5	Very low	97.6 Å²	97.6	108.5 Å²	108.5	68%	0.683	57%	0.572	S	S	*	*			trans	-68.1	99.4	173.2	52.8	0	0	0	0	110.7	V1897 V1901	V1897-S1899 PolarHBondContact O-N 3.14Å; S1899-V1901 PolarHBondContact O-N 2.91Å
1900	L	29.1	Very low	33.1	Very low	155.4 Å²	155.4	115.6 Å²	115.6	81%	0.814	61%	0.608	S	S	*	*			trans	-86.3	109	162.8	-94.7	118.9	0	0	0	110.7	M1370 P1898	M1370-L1900 HydrophobicContact CE-CD1 3.9Å; M1370-L1900 HydrophobicContact SD-CD1 4.25Å; P1898-L1900 PolarHBondContact O-N 2.94Å
1901	V	30	Very low	31.6	Very low	118.6 Å²	118.6	122 Å²	122	72%	0.719	64%	0.644	S	S	*	*			trans	-85.9	107.5	163.7	-173.5	0	0	0	0	112.5	S1899	S1899-V1901 PolarHBondContact O-N 2.91Å
1902	N	27.8	Very low	30.4	Very low	133.4 Å²	133.4	126.3 Å²	126.3	71%	0.713	68%	0.675	S	S	*	*			trans	42.9	103	147.5	-62.2	-15.7	0	0	0	116.2	R1827 P1904	R1827-N1902 VanDerWaalsContact NH2-CG 3.3Å; R1827-N1902 PolarHBondContact NH2-ND2 3.35Å; R1827-N1902 PolarHBondContact NH2-OD1 3.49Å; N1902-P1904 WeakPolarHBondContact O-CD 3.34Å
1903	N	29	Very low	29.3	Very low	158 Å²	158	131.4 Å²	131.4	85%	0.845	70%	0.697	S	S	*	*			trans	-142.2	115.6	138.4	-94.3	-14.9	0	0	0	112.2	L1905	N1903-L1905 PolarHBondContact O-N 3.48Å
1904	P	30.7	Very low	28.7	Very low	110.6 Å²	110.6	135.2 Å²	135.2	72%	0.718	72%	0.721	S	S	*	*			trans	-91.3	113.6	167.9	34.4	-26.6	0	0	0	109.5	N1902	N1902-P1904 WeakPolarHBondContact O-CD 3.34Å
1905	L	27.9	Very low	28.2	Very low	160.6 Å²	160.6	133.6 Å²	133.6	84%	0.841	72%	0.72	S	S	*	*			trans	-160.4	109.4	152.8	-116.1	92.9	0	0	0	110.3	N1903 N1907	N1903-L1905 PolarHBondContact O-N 3.48Å; L1905-N1907 PolarHBondContact O-N 3.23Å
1906	Y	28	Very low	27.9	Very low	209.6 Å²	209.6	134.6 Å²	134.6	82%	0.822	74%	0.738	S	S	*	*			trans	-70.5	135.1	149.1	-92.4	-91.9	0	0	0	112.7
1907	N	27.4	Very low	27.8	Very low	141.6 Å²	141.6	134 Å²	134	76%	0.757	74%	0.738	S	S	*	*			trans	-159.1	110.9	141.5	-115.4	-4.5	0	0	0	114	L1905 N1909	L1905-N1907 PolarHBondContact O-N 3.23Å; N1907-N1909 PolarHBondContact O-N 3.37Å
1908	S	27	Very low	27.7	Very low	87.2 Å²	87.2	138.2 Å²	138.2	61%	0.61	75%	0.749	S	S	*	*				93.5	128	115.8	68.7	0	0	0	0	114.9
1909	N	27.8	Very low	27.7	Very low	136.6 Å²	136.6	145.1 Å²	145.1	73%	0.73	77%	0.767	S	S	*	*			trans	68.9	92.1	149.5	-61.8	-14.6	0	0	0	115.2	N1907	N1907-N1909 PolarHBondContact O-N 3.37Å
1910	N	30.7	Very low	27.7	Very low	156.4 Å²	156.4	147.4 Å²	147.4	84%	0.836	77%	0.772	S	S	*	*				-167	113	121	-87.6	-35	0	0	0	110.4	C1912	N1910-C1912 VanDerWaalsContact C-N 3.29Å; N1910-C1912 PolarHBondContact O-N 3.39Å
1911	N	26.6	Very low	27.7	Very low	156.6 Å²	156.6	146.8 Å²	146.8	84%	0.837	77%	0.769	S	S	*	*			trans	-25.5	104.4	163.1	-66.6	-16.9	0	0	0	114.4	H1913	N1911-H1913 PolarHBondContact O-N 2.92Å
1912	C	24.4	Very low	27.5	Very low	124 Å²	124	147.3 Å²	147.3	84%	0.838	77%	0.768	S	S	*	*			trans	-120.4	105.6	144.8	77.4	0	0	0	0	109.1	N1910 L1914	N1910-C1912 VanDerWaalsContact C-N 3.29Å; N1910-C1912 PolarHBondContact O-N 3.39Å; C1912-L1914 VanDerWaalsContact C-N 3.27Å; C1912-L1914 PolarHBondContact O-N 3.27Å
1913	H	24.7	Very low	27.5	Very low	157.6 Å²	157.6	150.5 Å²	150.5	73%	0.73	77%	0.772	S	S	*	*			trans	-89.5	102.6	-176.6	-156.2	-70.4	0	0	0	109.1	N1911 T1915	N1911-H1913 PolarHBondContact O-N 2.92Å; H1913-T1915 VanDerWaalsContact CE1-CG2 3.4Å; H1913-T1915 WeakPolarHBondContact CE1-CG2 3.4Å; H1913-T1915 PolarHBondContact CE1-OG1 3.05Å; H1913-T1915 VanDerWaalsContact ND1-CG2 3.29Å; H1913-T1915 WeakPolarHBondContact ND1-CG2 3.48Å; H1913-T1915 PolarHBondContact ND1-OG1 3.21Å; H1913-T1915 PolarHBondContact O-N 3.2Å
1914	L	27.1	Very low	27.8	Very low	165.4 Å²	165.4	150.8 Å²	150.8	87%	0.866	77%	0.765	S	S	*	*			trans	-108.1	90.6	160.6	-102.6	114.6	0	0	0	108.7	C1912 T1916	C1912-L1914 VanDerWaalsContact C-N 3.27Å; C1912-L1914 PolarHBondContact O-N 3.27Å; L1914-T1916 PolarHBondContact O-N 3.18Å
1915	T	26.4	Very low	28.2	Very low	91.8 Å²	91.8	153.6 Å²	153.6	56%	0.563	77%	0.766	S	S	*	*			trans	-64.6	124.2	170.7	37.7	0	0	0	0	111.9	H1913 E1917	H1913-T1915 VanDerWaalsContact CE1-CG2 3.4Å; H1913-T1915 WeakPolarHBondContact CE1-CG2 3.4Å; H1913-T1915 PolarHBondContact CE1-OG1 3.05Å; H1913-T1915 VanDerWaalsContact ND1-CG2 3.29Å; H1913-T1915 WeakPolarHBondContact ND1-CG2 3.48Å; H1913-T1915 PolarHBondContact ND1-OG1 3.21Å; H1913-T1915 PolarHBondContact O-N 3.2Å; T1915-E1917 WeakPolarHBondContact CB-OE1 3.11Å; T1915-E1917 PolarHBondContact O-N 3.21Å; T1915-E1917 PolarHBondContact OG1-OE1 3.5Å
1916	T	26.4	Very low	29	Very low	134.4 Å²	134.4	149.5 Å²	149.5	83%	0.825	75%	0.745	S	S	*	*			trans	-60.4	98.6	156	-30.9	0	0	0	0	111.5	L1914	L1914-T1916 PolarHBondContact O-N 3.18Å
1917	E	27	Very low	30.7	Very low	152.8 Å²	152.8	143.6 Å²	143.6	71%	0.714	73%	0.725	S	S	*	*			trans	-140.8	107.9	152.8	-71.4	178.6	-164.3	0	0	107.5	T1915	T1915-E1917 WeakPolarHBondContact CB-OE1 3.11Å; T1915-E1917 PolarHBondContact O-N 3.21Å; T1915-E1917 PolarHBondContact OG1-OE1 3.5Å
1918	F	27.7	Very low	32.6	Very low	177.8 Å²	177.8	138.4 Å²	138.4	78%	0.78	70%	0.698	S	S	*	*				-135.2	104.7	121.5	-73	-80.9	0	0	0	112.9
1919	Y	28.6	Very low	34.6	Very low	220.8 Å²	220.8	134.4 Å²	134.4	87%	0.866	67%	0.67	S	S	*	*			trans	-106.2	118.1	151.6	-78.4	-86	0	0	0	112.1
1920	D	27.9	Very low	36.9	Very low	146.4 Å²	146.4	129.5 Å²	129.5	78%	0.783	65%	0.645	S	S	*	*			trans	-101.8	110.2	164.1	-103.1	-26.5	0	0	0	110.8	N1922	D1920-N1922 VanDerWaalsContact C-N 3.29Å; D1920-N1922 PolarHBondContact O-N 2.99Å
1921	D	28	Very low	39.1	Very low	142.8 Å²	142.8	122 Å²	122	76%	0.764	61%	0.606	S	S	*	*			trans	-141.5	101.8	151.4	-95.1	-25.9	0	0	0	113.1
1922	N	26.3	Very low	41.8	Very low	128.6 Å²	128.6	115.6 Å²	115.6	69%	0.688	57%	0.57	S	S	*	*			trans	141.7	106.6	156.6	-78.7	-65.5	0	0	0	116.3	D1920 K1924	D1920-N1922 VanDerWaalsContact C-N 3.29Å; D1920-N1922 PolarHBondContact O-N 2.99Å; N1922-K1924 VanDerWaalsContact C-N 3.28Å; N1922-K1924 PolarHBondContact O-N 3.16Å; N1922-K1924 VanDerWaalsContact O-N 3.08Å
1923	Y	28.8	Very low	44.7	Very low	201.4 Å²	201.4	109.7 Å²	109.7	79%	0.79	53%	0.53	S	S	*	.			trans	12	87.3	148.8	-68.5	-82.8	0	0	0	116.3	K1925	Y1923-K1925 PolarHBondContact O-N 2.99Å
1924	K	34.1	Very low	47.7	Very low	163.4 Å²	163.4	104.1 Å²	104.1	71%	0.71	51%	0.506	S	S	*	.			trans	-127.7	110.6	149.3	-84.6	-173.9	178.4	-174.3	0	112	K1739 N1922 N1926 E1927	K1739-K1924 WeakPolarHBondContact CE-O 3.44Å; K1739-K1924 PolarHBondContact NZ-O 2.71Å; N1922-K1924 VanDerWaalsContact C-N 3.28Å; N1922-K1924 PolarHBondContact O-N 3.16Å; N1922-K1924 VanDerWaalsContact O-N 3.08Å; K1924-N1926 VanDerWaalsContact C-N 3.28Å; K1924-N1926 PolarHBondContact O-N 2.84Å; K1924-N1926 PolarHBondContact O-OD1 3.16Å; K1924-E1927 VanDerWaalsContact CD-OE2 3.23Å; K1924-E1927 WeakPolarHBondContact CD-OE2 3.47Å; K1924-E1927 IonicContact NZ-OE1 3.06Å; K1924-E1927 PolarHBondContact NZ-OE1 3.29Å; K1924-E1927 IonicContact NZ-OE2 3.45Å; K1924-E1927 PolarHBondContact NZ-OE2 2.73Å
1925	K	38.9	Very low	50.7	Low	170.8 Å²	170.8	96.2 Å²	96.2	74%	0.743	46%	0.464	S	S	*	.			trans	-61.8	116.6	169.4	-74.7	177.4	174.9	179.3	0	109.7	Y1923 E1927 N2156	Y1923-K1925 PolarHBondContact O-N 2.99Å; K1925-E1927 HydrophobicContact CB-CG 4.14Å; K1925-E1927 PolarHBondContact O-N 3.35Å; K1925-E1927 VanDerWaalsContact O-N 3.08Å; K1925-N2156 PolarHBondContact NZ-OD1 3.24Å
1926	N	46	Very low	53.6	Low	73.6 Å²	73.6	93.5 Å²	93.5	39%	0.394	45%	0.445	S	S	.	.			trans	-61	97.1	163.5	-67.7	13.6	0	0	0	109.5	K1739 K1924 T1928 N1996 E2056	K1739-N1926 VanDerWaalsContact CE-N 3.34Å; K1739-N1926 VanDerWaalsContact CE-ND2 3.27Å; K1739-N1926 WeakPolarHBondContact CE-ND2 3.34Å; K1739-N1926 WeakPolarHBondContact CE-OD1 3.12Å; K1739-N1926 VanDerWaalsContact CG-ND2 3.26Å; K1739-N1926 WeakPolarHBondContact CG-ND2 3.31Å; K1739-N1926 VanDerWaalsContact NZ-N 3.11Å; K1739-N1926 PolarHBondContact NZ-OD1 3.02Å; K1924-N1926 VanDerWaalsContact C-N 3.28Å; K1924-N1926 PolarHBondContact O-N 2.84Å; K1924-N1926 PolarHBondContact O-OD1 3.16Å; N1926-T1928 VanDerWaalsContact C-N 3.27Å; N1926-T1928 WeakPolarHBondContact O-CG2 3.47Å; N1926-T1928 PolarHBondContact O-N 3.37Å; N1926-T1928 VanDerWaalsContact O-N 3.13Å; N1926-N1996 PolarHBondContact ND2-OD1 3.16Å; N1926-N1996 PolarHBondContact OD1-ND2 3.36Å; N1926-N1996 PolarHBondContact OD1-OD1 3.01Å; N1926-E2056 PolarHBondContact ND2-OE1 3.14Å; N1926-E2056 PolarHBondContact ND2-OE2 2.9Å
1927	E	62.3	Low	56.6	Low	84.8 Å²	84.8	89 Å²	89	40%	0.396	41%	0.414	S	S	.	.			trans	-80.1	78.2	178.8	-62.7	-178.5	163.8	0	0	111.1	K1924 K1925 P2054 L2055 Q2059	K1924-E1927 VanDerWaalsContact CD-OE2 3.23Å; K1924-E1927 WeakPolarHBondContact CD-OE2 3.47Å; K1924-E1927 IonicContact NZ-OE1 3.06Å; K1924-E1927 PolarHBondContact NZ-OE1 3.29Å; K1924-E1927 IonicContact NZ-OE2 3.45Å; K1924-E1927 PolarHBondContact NZ-OE2 2.73Å; K1925-E1927 HydrophobicContact CB-CG 4.14Å; K1925-E1927 PolarHBondContact O-N 3.35Å; K1925-E1927 VanDerWaalsContact O-N 3.08Å; E1927-P2054 CarbonylContact O-C 3.57Å; E1927-P2054 WeakPolarHBondContact O-CA 3.38Å; E1927-L2055 HydrophobicContact CB-CB 4Å; E1927-L2055 VanDerWaalsContact CB-CB 3.42Å; E1927-L2055 HydrophobicContact CB-CD2 4.03Å; E1927-L2055 HydrophobicContact CB-CG 4.25Å; E1927-L2055 HydrophobicContact CG-CD2 4.24Å; E1927-L2055 WeakPolarHBondContact O-CB 3.25Å; E1927-L2055 PolarHBondContact O-N 2.9Å; E1927-L2055 VanDerWaalsContact OE2-CD2 3.25Å; E1927-L2055 WeakPolarHBondContact OE2-CD2 3.17Å; E1927-Q2059 PolarHBondContact OE2-NE2 2.86Å
1928	T	67.1	Low	59.7	Low	32.8 Å²	32.8	81.7 Å²	81.7	20%	0.201	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	142.7	175.6	58.2	0	0	0	0	110.4	N1926 R2052 I2053 P2054	N1926-T1928 VanDerWaalsContact C-N 3.27Å; N1926-T1928 WeakPolarHBondContact O-CG2 3.47Å; N1926-T1928 PolarHBondContact O-N 3.37Å; N1926-T1928 VanDerWaalsContact O-N 3.13Å; T1928-R2052 PolarHBondContact O-NE 2.8Å; T1928-R2052 PolarHBondContact O-NH2 2.65Å; T1928-R2052 VanDerWaalsContact OG1-CZ 3.31Å; T1928-R2052 PolarHBondContact OG1-NE 3.34Å; T1928-R2052 VanDerWaalsContact OG1-NE 3.11Å; T1928-R2052 PolarHBondContact OG1-NH2 3.4Å; T1928-I2053 CarbonylContact C-O 3.56Å; T1928-I2053 VanDerWaalsContact CA-O 3.23Å; T1928-I2053 WeakPolarHBondContact CA-O 3.24Å; T1928-I2053 WeakPolarHBondContact CB-O 3.3Å; T1928-P2054 HydrophobicContact CG2-CB 4.47Å; T1928-P2054 HydrophobicContact CG2-CG 4.42Å
1929	F	70.8	Confident	62.5	Low	3.6 Å²	3.6	77.3 Å²	77.3	2%	0.016	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146.3	177.2	69.4	-80.3	0	0	0	111.7	A1931 R2052 I2053 L2055 I2058 L2100 F2107 P2145 I2147	F1929-A1931 HydrophobicContact CD2-CB 4.19Å; F1929-A1931 HydrophobicContact CE2-CB 3.78Å; F1929-R2052 CarbonylContact O-C 3.55Å; F1929-R2052 VanDerWaalsContact O-CA 3.3Å; F1929-R2052 WeakPolarHBondContact O-CA 3.37Å; F1929-I2053 HydrophobicContact CD1-CB 4.14Å; F1929-I2053 HydrophobicContact CD1-CG2 4.46Å; F1929-I2053 VanDerWaalsContact CD1-O 3.25Å; F1929-I2053 WeakPolarHBondContact CD1-O 3.29Å; F1929-I2053 HydrophobicContact CE1-CB 3.51Å; F1929-I2053 VanDerWaalsContact CE1-CB 3.49Å; F1929-I2053 HydrophobicContact CE1-CG2 3.56Å; F1929-I2053 VanDerWaalsContact CE1-CG2 3.49Å; F1929-I2053 WeakPolarHBondContact CE1-O 3.34Å; F1929-I2053 HydrophobicContact CE2-CB 4.24Å; F1929-I2053 HydrophobicContact CE2-CD1 4.33Å; F1929-I2053 HydrophobicContact CZ-CB 3.59Å; F1929-I2053 HydrophobicContact CZ-CD1 4.02Å; F1929-I2053 HydrophobicContact CZ-CG1 4.28Å; F1929-I2053 HydrophobicContact CZ-CG2 3.71Å; F1929-I2053 PolarHBondContact N-O 3.19Å; F1929-I2053 PolarHBondContact O-N 3.1Å; F1929-L2055 HydrophobicContact CD1-CD1 4.3Å; F1929-I2058 HydrophobicContact CD1-CD1 3.66Å; F1929-I2058 VanDerWaalsContact CD1-CD1 3.45Å; F1929-I2058 HydrophobicContact CD1-CG1 4.43Å; F1929-I2058 HydrophobicContact CD2-CD1 4.43Å; F1929-I2058 HydrophobicContact CE1-CD1 3.13Å; F1929-I2058 HydrophobicContact CE1-CG1 3.83Å; F1929-I2058 HydrophobicContact CE2-CD1 4.18Å; F1929-I2058 HydrophobicContact CG-CD1 4.32Å; F1929-I2058 HydrophobicContact CZ-CD1 3.43Å; F1929-I2058 HydrophobicContact CZ-CG1 4.06Å; F1929-L2100 HydrophobicContact CZ-CD1 4.34Å; F1929-F2107 HydrophobicContact CB-CE1 3.77Å; F1929-F2107 HydrophobicContact CB-CZ 3.95Å; F1929-F2107 HydrophobicContact CD1-CE1 4.28Å; F1929-F2107 AromaticContact CD1-CZ 3.94Å; F1929-F2107 HydrophobicContact CD1-CZ 3.99Å; F1929-F2107 HydrophobicContact CD2-CE1 4.39Å; F1929-F2107 AromaticContact CD2-CZ 3.77Å; F1929-F2107 HydrophobicContact CD2-CZ 3.77Å; F1929-F2107 HydrophobicContact CE1-CZ 4.37Å; F1929-F2107 HydrophobicContact CE2-CZ 4.23Å; F1929-F2107 AromaticContact CG-CE1 3.94Å; F1929-F2107 HydrophobicContact CG-CE1 3.94Å; F1929-F2107 AromaticContact CG-CZ 3.63Å; F1929-F2107 HydrophobicContact CG-CZ 3.63Å; F1929-F2107 HydrophobicContact CZ-CZ 4.45Å; F1929-P2145 HydrophobicContact CD2-CB 4.16Å; F1929-P2145 HydrophobicContact CD2-CG 4.43Å; F1929-P2145 HydrophobicContact CE2-CB 4.14Å; F1929-P2145 HydrophobicContact CE2-CG 4.03Å; F1929-I2147 HydrophobicContact CB-CD1 3.75Å; F1929-I2147 HydrophobicContact CB-CG1 4.25Å; F1929-I2147 HydrophobicContact CD2-CD1 4.2Å; F1929-I2147 HydrophobicContact CG-CD1 4.3Å
1930	P	75.2	Confident	65.2	Low	33 Å²	33	72.9 Å²	72.9	21%	0.214	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	135.6	173.7	30.6	-33.5	0	0	0	110.6	V2051 L2146 I2147	P1930-V2051 WeakPolarHBondContact CA-O 3.42Å; P1930-L2146 HydrophobicContact CB-CB 4.13Å; P1930-L2146 HydrophobicContact CB-CD1 4.32Å; P1930-L2146 HydrophobicContact CB-CG 4.45Å; P1930-L2146 HydrophobicContact CG-CB 4.11Å; P1930-L2146 PolarHBondContact O-N 3.19Å; P1930-I2147 HydrophobicContact CG-CG1 4.3Å; P1930-I2147 HydrophobicContact CG-CG2 4.32Å
1931	A	77.1	Confident	67.8	Low	0 Å²	0	66.3 Å²	66.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	152	178.1	0	0	0	0	0	111.8	F1929 F2050 V2051 I2053 V2143 K2144	F1929-A1931 HydrophobicContact CD2-CB 4.19Å; F1929-A1931 HydrophobicContact CE2-CB 3.78Å; A1931-F2050 CarbonylContact O-C 3.53Å; A1931-F2050 WeakPolarHBondContact O-CA 3.36Å; A1931-V2051 HydrophobicContact CB-CG2 4.36Å; A1931-V2051 PolarHBondContact N-O 3.18Å; A1931-V2051 WeakPolarHBondContact O-CG2 3.48Å; A1931-V2051 PolarHBondContact O-N 3.04Å; A1931-I2053 HydrophobicContact CB-CD1 3.53Å; A1931-I2053 VanDerWaalsContact CB-CD1 3.49Å; A1931-I2053 HydrophobicContact CB-CG1 3.98Å; A1931-V2143 HydrophobicContact CB-CG1 4.35Å; A1931-K2144 CarbonylContact C-O 3.47Å; A1931-K2144 VanDerWaalsContact CA-O 3.24Å; A1931-K2144 WeakPolarHBondContact CA-O 3.43Å
1932	E	82.6	Confident	70.1	Confident	20.8 Å²	20.8	67.8 Å²	67.8	10%	0.097	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	125.3	167.7	-176.4	-178.6	-160.1	0	0	109.2	M1679 K1875 I1934 C2048 F2050 V2143 K2144 L2146	M1679-E1932 WeakPolarHBondContact CE-OE2 3.28Å; K1875-E1932 VanDerWaalsContact CD-OE1 3.31Å; K1875-E1932 WeakPolarHBondContact CD-OE1 3.37Å; K1875-E1932 WeakPolarHBondContact CD-OE2 3.48Å; K1875-E1932 IonicContact NZ-OE1 3.58Å; K1875-E1932 PolarHBondContact NZ-OE1 3Å; K1875-E1932 IonicContact NZ-OE2 2.68Å; K1875-E1932 PolarHBondContact NZ-OE2 2.79Å; E1932-I1934 HydrophobicContact CG-CG1 4.3Å; E1932-C2048 VanDerWaalsContact CD-SG 3.55Å; E1932-C2048 VanDerWaalsContact CG-SG 3.52Å; E1932-C2048 WeakPolarHBondContact CG-SG 3.25Å; E1932-C2048 PolarHBondContact OE1-SG 3.22Å; E1932-F2050 HydrophobicContact CB-CD1 4.05Å; E1932-F2050 HydrophobicContact CB-CE1 3.84Å; E1932-F2050 HydrophobicContact CG-CD1 4.16Å; E1932-F2050 HydrophobicContact CG-CE1 3.8Å; E1932-F2050 HydrophobicContact CG-CZ 4.42Å; E1932-V2143 CarbonylContact O-C 3.58Å; E1932-V2143 WeakPolarHBondContact O-CA 3.32Å; E1932-K2144 HydrophobicContact CB-CB 4.35Å; E1932-K2144 PolarHBondContact N-O 2.91Å; E1932-K2144 PolarHBondContact O-N 3.07Å; E1932-K2144 WeakPolarHBondContact OE2-CD 3.36Å; E1932-K2144 WeakPolarHBondContact OE2-CE 3.47Å; E1932-K2144 IonicContact OE2-NZ 3.35Å; E1932-K2144 PolarHBondContact OE2-NZ 2.74Å; E1932-L2146 HydrophobicContact CB-CD1 4.4Å; E1932-L2146 HydrophobicContact CB-CD2 4.35Å
1933	I	85.5	Confident	72.3	Confident	0.2 Å²	0.2	63.1 Å²	63.1	0%	0.001	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.6	172.7	-67.5	174.4	0	0	0	109	V1935 F1990 C2048 R2049 V2051 I2053 L2066 F2068 G2142 V2143	I1933-V1935 HydrophobicContact CG2-CG2 4.25Å; I1933-F1990 HydrophobicContact CB-CE2 4.18Å; I1933-F1990 HydrophobicContact CB-CZ 4.27Å; I1933-F1990 HydrophobicContact CD1-CD2 3.82Å; I1933-F1990 HydrophobicContact CD1-CE2 3.59Å; I1933-F1990 HydrophobicContact CD1-CZ 4.45Å; I1933-F1990 HydrophobicContact CG1-CE2 4.45Å; I1933-F1990 HydrophobicContact CG2-CD2 4.39Å; I1933-F1990 HydrophobicContact CG2-CE1 4.28Å; I1933-F1990 HydrophobicContact CG2-CE2 3.92Å; I1933-F1990 HydrophobicContact CG2-CZ 3.77Å; I1933-C2048 CarbonylContact O-C 3.55Å; I1933-C2048 WeakPolarHBondContact O-CA 3.43Å; I1933-R2049 PolarHBondContact N-O 3.04Å; I1933-R2049 PolarHBondContact O-N 2.95Å; I1933-V2051 HydrophobicContact CD1-CB 4.37Å; I1933-V2051 HydrophobicContact CD1-CG1 4.06Å; I1933-V2051 HydrophobicContact CD1-CG2 3.43Å; I1933-V2051 VanDerWaalsContact CD1-CG2 3.45Å; I1933-V2051 HydrophobicContact CG1-CG1 4.44Å; I1933-V2051 HydrophobicContact CG1-CG2 3.83Å; I1933-I2053 HydrophobicContact CD1-CD1 4.37Å; I1933-I2053 HydrophobicContact CG1-CD1 4.46Å; I1933-L2066 HydrophobicContact CD1-CD2 3.69Å; I1933-L2066 HydrophobicContact CG1-CD2 4.35Å; I1933-F2068 HydrophobicContact CG2-CE1 3.71Å; I1933-F2068 HydrophobicContact CG2-CZ 3.82Å; I1933-G2142 CarbonylContact C-O 3.48Å; I1933-G2142 VanDerWaalsContact CA-O 3.3Å; I1933-G2142 WeakPolarHBondContact CA-O 3.35Å; I1933-V2143 HydrophobicContact CG1-CG2 4.43Å
1934	I	87.7	Confident	73.7	Confident	40.2 Å²	40.2	55.2 Å²	55.2	21%	0.206	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	129.9	177.5	-54.9	170.1	0	0	0	108.2	E1932 E1936 Y2047 Y2122 I2141 G2142	E1932-I1934 HydrophobicContact CG-CG1 4.3Å; I1934-E1936 HydrophobicContact CG2-CB 4.46Å; I1934-Y2047 CarbonylContact C-O 3.54Å; I1934-Y2047 WeakPolarHBondContact CA-O 3.31Å; I1934-Y2122 HydrophobicContact CB-CE2 4.41Å; I1934-Y2122 HydrophobicContact CD1-CE2 4.05Å; I1934-Y2122 HydrophobicContact CG2-CE2 4.23Å; I1934-I2141 CarbonylContact O-C 3.57Å; I1934-I2141 VanDerWaalsContact O-CA 3.29Å; I1934-I2141 WeakPolarHBondContact O-CA 3.32Å; I1934-I2141 WeakPolarHBondContact O-CG2 3.47Å; I1934-G2142 PolarHBondContact N-O 3.2Å; I1934-G2142 PolarHBondContact O-N 2.93Å
1935	V	89.7	Confident	74.5	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	98.5	172.2	-178.1	0	0	0	0	107.3	I1933 V1988 F1990 T2034 W2045 N2046 Y2047 F2068 I2139	I1933-V1935 HydrophobicContact CG2-CG2 4.25Å; V1935-V1988 HydrophobicContact CG1-CB 4.42Å; V1935-V1988 HydrophobicContact CG1-CG1 4.46Å; V1935-V1988 HydrophobicContact CG1-CG2 4.25Å; V1935-F1990 HydrophobicContact CG2-CD1 4.48Å; V1935-F1990 HydrophobicContact CG2-CE1 4.1Å; V1935-T2034 HydrophobicContact CB-CG2 4.27Å; V1935-T2034 HydrophobicContact CG1-CG2 4.16Å; V1935-T2034 HydrophobicContact CG2-CG2 4.41Å; V1935-W2045 HydrophobicContact CG1-CE3 3.95Å; V1935-W2045 HydrophobicContact CG1-CZ3 4.38Å; V1935-N2046 PolarHBondContact O-N 2.87Å; V1935-Y2047 HydrophobicContact CB-CD1 4.49Å; V1935-Y2047 PolarHBondContact N-O 2.88Å; V1935-Y2047 PolarHBondContact O-N 2.98Å; V1935-F2068 HydrophobicContact CG2-CD1 4.07Å; V1935-F2068 HydrophobicContact CG2-CE1 3.79Å; V1935-I2139 HydrophobicContact CG1-CD1 3.89Å; V1935-I2139 HydrophobicContact CG1-CG1 4.43Å
1936	E	87.5	Confident	74.6	Confident	34.6 Å²	34.6	54.1 Å²	54.1	16%	0.162	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-59.1	-166.7	-166.6	-172.6	122.9	0	0	112.3	I1934 H2044 W2045 N2046 Y2122 L2140	I1934-E1936 HydrophobicContact CG2-CB 4.46Å; E1936-H2044 PolarHBondContact O-CD2 3.21Å; E1936-H2044 VanDerWaalsContact O-CD2 3.24Å; E1936-H2044 PolarHBondContact O-ND1 3.06Å; E1936-W2045 PolarHBondContact O-N 2.98Å; E1936-N2046 VanDerWaalsContact CG-OD1 3.26Å; E1936-N2046 WeakPolarHBondContact CG-OD1 3.35Å; E1936-N2046 PolarHBondContact O-N 2.92Å; E1936-N2046 VanDerWaalsContact O-N 3.09Å; E1936-Y2122 PolarHBondContact OE2-OH 3.06Å; E1936-L2140 HydrophobicContact CB-CB 4.34Å; E1936-L2140 HydrophobicContact CB-CD2 4.15Å; E1936-L2140 HydrophobicContact CB-CG 4.12Å; E1936-L2140 HydrophobicContact CG-CD2 4.3Å; E1936-L2140 PolarHBondContact N-O 2.99Å; E1936-L2140 WeakPolarHBondContact OE1-CD2 3.08Å; E1936-L2140 WeakPolarHBondContact OE2-CD2 3.49Å
1937	K	90.6	Very high	74	Confident	40.4 Å²	40.4	57.5 Å²	57.5	18%	0.176	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	162.4	-173.5	50.3	174.8	177.5	-115.9	0	112.6	Y1939 Y2042 A2043 H2044 W2124 I2139 L2140	K1937-Y1939 HydrophobicContact CD-CE2 4.19Å; K1937-Y2042 HydrophobicContact CB-CE2 4.3Å; K1937-Y2042 HydrophobicContact CD-CE2 4.17Å; K1937-A2043 CarbonylContact C-O 3.5Å; K1937-A2043 WeakPolarHBondContact CA-O 3.26Å; K1937-A2043 VanDerWaalsContact CB-O 3.29Å; K1937-A2043 WeakPolarHBondContact CB-O 3.39Å; K1937-H2044 HydrophobicContact CB-CB 4.46Å; K1937-W2124 HydrophobicContact CD-CH2 3.91Å; K1937-W2124 HydrophobicContact CD-CZ2 4.26Å; K1937-W2124 VanDerWaalsContact CE-CZ2 3.5Å; K1937-W2124 HydrophobicContact CG-CH2 3.79Å; K1937-W2124 HydrophobicContact CG-CZ2 4.39Å; K1937-I2139 CarbonylContact O-C 3.57Å; K1937-I2139 WeakPolarHBondContact O-CA 3.47Å; K1937-L2140 HydrophobicContact CD-CD2 4.48Å; K1937-L2140 HydrophobicContact CG-CB 4.12Å; K1937-L2140 HydrophobicContact CG-CD2 4.08Å; K1937-L2140 PolarHBondContact O-N 3.29Å
1938	A	90.4	Very high	72.5	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	151	170.7	0	0	0	0	0	111.8	L1941 A2043 W2045 Q2138 I2139	A1938-L1941 HydrophobicContact CB-CD1 3.95Å; A1938-L1941 HydrophobicContact CB-CD2 4.15Å; A1938-L1941 HydrophobicContact CB-CG 4.17Å; A1938-A2043 HydrophobicContact CB-CB 4.48Å; A1938-A2043 PolarHBondContact N-O 3.11Å; A1938-A2043 PolarHBondContact O-N 3.24Å; A1938-A2043 VanDerWaalsContact O-N 3.11Å; A1938-W2045 HydrophobicContact CB-CH2 3.82Å; A1938-W2045 HydrophobicContact CB-CZ3 3.66Å; A1938-Q2138 CarbonylContact C-O 3.5Å; A1938-Q2138 WeakPolarHBondContact CA-O 3.29Å; A1938-Q2138 VanDerWaalsContact CB-O 3.28Å; A1938-Q2138 WeakPolarHBondContact CB-O 3.36Å; A1938-I2139 HydrophobicContact CB-CB 4.16Å; A1938-I2139 HydrophobicContact CB-CG1 4.2Å
1939	Y	88.2	Confident	70.8	Confident	84.2 Å²	84.2	70 Å²	70	33%	0.33	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	151.7	177	-72.5	-61.3	0	0	0	111.8	K1937 L1941 E2041 Y2042 W2124 G2137 Q2138	K1937-Y1939 HydrophobicContact CD-CE2 4.19Å; Y1939-L1941 VanDerWaalsContact C-N 3.32Å; Y1939-L1941 PolarHBondContact O-N 3.06Å; Y1939-E2041 CarbonylContact C-O 3.55Å; Y1939-E2041 WeakPolarHBondContact CA-O 3.4Å; Y1939-Y2042 AromaticContact CD1-CD2 3.47Å; Y1939-Y2042 HydrophobicContact CD1-CD2 3.47Å; Y1939-Y2042 VanDerWaalsContact CD1-CD2 3.46Å; Y1939-Y2042 HydrophobicContact CD1-CE2 4.13Å; Y1939-Y2042 HydrophobicContact CD1-CG 4.32Å; Y1939-Y2042 AromaticContact CE1-CD2 3.08Å; Y1939-Y2042 HydrophobicContact CE1-CD2 3.08Å; Y1939-Y2042 AromaticContact CE1-CE2 3.35Å; Y1939-Y2042 HydrophobicContact CE1-CE2 3.35Å; Y1939-Y2042 VanDerWaalsContact CE1-CE2 3.43Å; Y1939-Y2042 AromaticContact CE1-CG 3.96Å; Y1939-Y2042 HydrophobicContact CE1-CG 4Å; Y1939-Y2042 HydrophobicContact CE2-CE2 4.49Å; Y1939-Y2042 HydrophobicContact CG-CD2 4.47Å; Y1939-Y2042 AromaticContact CZ-CD2 3.76Å; Y1939-Y2042 AromaticContact CZ-CE2 3.68Å; Y1939-Y2042 VanDerWaalsContact CZ-CE2 3.47Å; Y1939-Y2042 VanDerWaalsContact OH-CE2 3.31Å; Y1939-Y2042 WeakPolarHBondContact OH-CE2 3.22Å; Y1939-W2124 AromaticContact CD2-CH2 3.18Å; Y1939-W2124 HydrophobicContact CD2-CH2 3.18Å; Y1939-W2124 AromaticContact CD2-CZ2 3.84Å; Y1939-W2124 HydrophobicContact CD2-CZ2 3.84Å; Y1939-W2124 AromaticContact CD2-CZ3 3.72Å; Y1939-W2124 HydrophobicContact CD2-CZ3 3.72Å; Y1939-W2124 AromaticContact CE2-CH2 3.33Å; Y1939-W2124 HydrophobicContact CE2-CH2 3.33Å; Y1939-W2124 VanDerWaalsContact CE2-CH2 3.44Å; Y1939-W2124 AromaticContact CE2-CZ2 3.67Å; Y1939-W2124 HydrophobicContact CE2-CZ2 3.67Å; Y1939-W2124 HydrophobicContact CE2-CZ3 4.31Å; Y1939-W2124 HydrophobicContact CG-CH2 4.29Å; Y1939-G2137 WeakPolarHBondContact O-CA 3.35Å; Y1939-Q2138 PolarHBondContact N-O 2.99Å; Y1939-Q2138 PolarHBondContact O-N 2.94Å
1940	H	84.2	Confident	68.9	Low	129.6 Å²	129.6	76.9 Å²	76.9	60%	0.6	36%	0.36	S	S	*	.			trans	55.7	38.9	170.8	-53.3	-64.3	0	0	0	113.9	R1942 E2041 G2137	H1940-R1942 PolarHBondContact O-N 2.98Å; H1940-E2041 PolarHBondContact N-O 3.09Å; H1940-G2137 VanDerWaalsContact O-CA 3.23Å; H1940-G2137 WeakPolarHBondContact O-CA 3.38Å
1941	L	83.4	Confident	66.6	Low	6.6 Å²	6.6	83.3 Å²	83.3	4%	0.035	39%	0.392	C	S	.	.			trans	-69.6	127.9	177.9	-55.4	168.5	0	0	0	110	A1938 Y1939 V1986 L2040 A2043 V2070 I2093 V2127 S2136	A1938-L1941 HydrophobicContact CB-CD1 3.95Å; A1938-L1941 HydrophobicContact CB-CD2 4.15Å; A1938-L1941 HydrophobicContact CB-CG 4.17Å; Y1939-L1941 VanDerWaalsContact C-N 3.32Å; Y1939-L1941 PolarHBondContact O-N 3.06Å; L1941-V1986 HydrophobicContact CD1-CB 4.36Å; L1941-V1986 HydrophobicContact CD1-CG1 3.66Å; L1941-V1986 HydrophobicContact CD1-CG2 4.35Å; L1941-L2040 HydrophobicContact CB-CD2 4.43Å; L1941-L2040 HydrophobicContact CB-CG 4.34Å; L1941-L2040 VanDerWaalsContact CB-O 3.25Å; L1941-L2040 WeakPolarHBondContact CB-O 3.38Å; L1941-L2040 PolarHBondContact N-O 3.03Å; L1941-L2040 VanDerWaalsContact O-CD2 3.27Å; L1941-L2040 WeakPolarHBondContact O-CD2 3.43Å; L1941-L2040 WeakPolarHBondContact O-CG 3.4Å; L1941-A2043 HydrophobicContact CD1-CB 4.5Å; L1941-V2070 HydrophobicContact CD1-CG1 4.12Å; L1941-V2070 HydrophobicContact CD2-CG1 4.23Å; L1941-I2093 HydrophobicContact CB-CD1 4.16Å; L1941-I2093 HydrophobicContact CB-CG2 4.36Å; L1941-I2093 HydrophobicContact CD1-CD1 4.23Å; L1941-I2093 HydrophobicContact CD2-CG2 4.45Å; L1941-V2127 HydrophobicContact CD2-CB 4.42Å; L1941-V2127 HydrophobicContact CD2-CG1 4.44Å; L1941-V2127 HydrophobicContact CD2-CG2 4.06Å; L1941-S2136 CarbonylContact C-O 3.59Å; L1941-S2136 VanDerWaalsContact CA-O 3.28Å; L1941-S2136 WeakPolarHBondContact CA-O 3.4Å
1942	R	76.6	Confident	64.5	Low	175 Å²	175	88.3 Å²	88.3	66%	0.66	43%	0.427	S	S	*	.			trans	-117.8	127.5	-178.2	-66.5	-179.8	-179.4	172.9	-1.2	110.9	H1940 I2093 S2136	H1940-R1942 PolarHBondContact O-N 2.98Å; R1942-I2093 WeakPolarHBondContact O-CG2 3.46Å; R1942-S2136 PolarHBondContact N-O 3.13Å; R1942-S2136 VanDerWaalsContact N-O 3.09Å
1943	L	71.4	Confident	62.1	Low	31 Å²	31	92.9 Å²	92.9	16%	0.162	46%	0.457	C	S	.	.			trans	-74.7	138	169.2	-73.6	167.2	0	0	0	109.9	H1945 Y1984 L2040 A2072 K2091 I2093	L1943-H1945 PolarHBondContact O-N 2.96Å; L1943-H1945 VanDerWaalsContact O-N 3.13Å; L1943-H1945 PolarHBondContact O-ND1 3.1Å; L1943-Y1984 HydrophobicContact CD1-CD1 4.11Å; L1943-Y1984 HydrophobicContact CD1-CD2 4.07Å; L1943-Y1984 HydrophobicContact CD1-CE1 4.02Å; L1943-Y1984 HydrophobicContact CD1-CE2 3.98Å; L1943-Y1984 HydrophobicContact CD1-CG 4.13Å; L1943-L2040 HydrophobicContact CB-CD2 4.43Å; L1943-L2040 HydrophobicContact CD1-CD1 3.94Å; L1943-L2040 HydrophobicContact CD1-CD2 4.01Å; L1943-L2040 HydrophobicContact CD2-CD1 4.5Å; L1943-L2040 HydrophobicContact CG-CD1 4.05Å; L1943-L2040 HydrophobicContact CG-CD2 3.88Å; L1943-A2072 HydrophobicContact CD2-CB 3.74Å; L1943-K2091 HydrophobicContact CD2-CD 4.21Å; L1943-K2091 HydrophobicContact CD2-CG 4.4Å; L1943-I2093 HydrophobicContact CD2-CG1 4.18Å
1944	S	58.7	Low	59.6	Low	35.4 Å²	35.4	101.1 Å²	101.1	25%	0.248	50%	0.495	C	S	.	.			trans	-64.1	92.9	173.7	48.4	0	0	0	0	111.4	H1946 K2091	S1944-H1946 PolarHBondContact O-N 3.07Å; S1944-K2091 PolarHBondContact O-NZ 3.18Å; S1944-K2091 WeakPolarHBondContact OG-CE 3.29Å; S1944-K2091 PolarHBondContact OG-NZ 2.75Å; S1944-K2091 VanDerWaalsContact OG-NZ 3.11Å
1945	H	50.6	Low	56.9	Low	154.4 Å²	154.4	104.6 Å²	104.6	72%	0.715	52%	0.523	S	S	*	.			trans	-72.9	119.8	175	-76.1	-40.2	0	0	0	110.9	L1943 N1947	L1943-H1945 PolarHBondContact O-N 2.96Å; L1943-H1945 VanDerWaalsContact O-N 3.13Å; L1943-H1945 PolarHBondContact O-ND1 3.1Å; H1945-N1947 VanDerWaalsContact C-N 3.32Å; H1945-N1947 PolarHBondContact O-N 3.13Å; H1945-N1947 VanDerWaalsContact O-N 3.09Å
1946	H	41.4	Very low	54.2	Low	156.4 Å²	156.4	109.9 Å²	109.9	72%	0.724	56%	0.561	S	S	*	*			trans	-82.8	78.8	-179.6	-97.4	-66.1	0	0	0	110.9	S1944 K1948 K2091	S1944-H1946 PolarHBondContact O-N 3.07Å; H1946-K1948 PolarHBondContact O-N 2.85Å; H1946-K2091 PolarHBondContact NE2-NZ 3.42Å
1947	N	32	Very low	51.6	Low	144.2 Å²	144.2	116.6 Å²	116.6	77%	0.771	59%	0.592	S	S	*	*			trans	-80	74.2	170.6	-78.9	2.5	0	0	0	110.7	H1945 F1949	H1945-N1947 VanDerWaalsContact C-N 3.32Å; H1945-N1947 PolarHBondContact O-N 3.13Å; H1945-N1947 VanDerWaalsContact O-N 3.09Å; N1947-F1949 VanDerWaalsContact C-N 3.28Å; N1947-F1949 PolarHBondContact O-N 3.02Å; N1947-F1949 VanDerWaalsContact O-N 3.13Å
1948	K	30.9	Very low	48.8	Very low	185.6 Å²	185.6	122.3 Å²	122.3	81%	0.807	62%	0.624	S	S	*	*			trans	-86.1	84.7	154.1	-84.1	-173.3	175.5	-179.1	0	107.5	H1946 D1950	H1946-K1948 PolarHBondContact O-N 2.85Å; K1948-D1950 PolarHBondContact O-N 2.99Å
1949	F	31.5	Very low	46	Very low	194.8 Å²	194.8	127.9 Å²	127.9	85%	0.854	66%	0.663	S	S	*	*			trans	-118.7	124.1	155.6	-100	-84.7	0	0	0	107.9	N1947 N1951	N1947-F1949 VanDerWaalsContact C-N 3.28Å; N1947-F1949 PolarHBondContact O-N 3.02Å; N1947-F1949 VanDerWaalsContact O-N 3.13Å; F1949-N1951 PolarHBondContact O-N 3.06Å
1950	D	31.1	Very low	43.1	Very low	147.6 Å²	147.6	132.3 Å²	132.3	79%	0.789	69%	0.687	S	S	*	*			trans	-69.3	152.4	-173	-72.6	-58.8	0	0	0	112.9	K1948 S1952	K1948-D1950 PolarHBondContact O-N 2.99Å; D1950-S1952 PolarHBondContact O-N 2.96Å; D1950-S1952 VanDerWaalsContact O-N 3.12Å
1951	N	27.4	Very low	40.6	Very low	167.8 Å²	167.8	131.8 Å²	131.8	90%	0.897	70%	0.695	S	S	*	*			trans	-52.3	107.7	179.1	-64.7	-46.6	0	0	0	113.1	F1949	F1949-N1951 PolarHBondContact O-N 3.06Å
1952	S	33.5	Very low	38	Very low	105 Å²	105	141.1 Å²	141.1	73%	0.734	73%	0.731	S	S	*	*			trans	-152.8	112.1	147.3	54.6	0	0	0	0	112.2	D1950	D1950-S1952 PolarHBondContact O-N 2.96Å; D1950-S1952 VanDerWaalsContact O-N 3.12Å
1953	T	31.6	Very low	35.8	Very low	118.2 Å²	118.2	141.8 Å²	141.8	73%	0.725	74%	0.739	S	S	*	*			trans	35.6	120.5	146.2	12.8	0	0	0	0	118.9
1954	E	32.2	Very low	33.8	Very low	172 Å²	172	149.3 Å²	149.3	80%	0.804	77%	0.771	S	S	*	*			trans	75.5	112	137.7	-66.9	173.6	-174.4	0	0	120
1955	S	31.5	Very low	32.5	Very low	114.4 Å²	114.4	153.2 Å²	153.2	80%	0.8	79%	0.794	S	S	*	*			trans	76.4	130.5	137.7	70.6	0	0	0	0	118.5
1956	S	34.4	Very low	31.6	Very low	111.6 Å²	111.6	152.6 Å²	152.6	78%	0.78	80%	0.796	S	S	*	*				152.7	120.7	129.1	52.2	0	0	0	0	113.9	N1958	S1956-N1958 PolarHBondContact O-N 3.05Å; S1956-N1958 VanDerWaalsContact O-N 3.14Å
1957	E	31.2	Very low	31.3	Very low	175.2 Å²	175.2	151.5 Å²	151.5	82%	0.819	80%	0.795	S	S	*	*			trans	-44.2	143.4	151.9	-61.5	165.8	159.2	0	0	111.4
1958	N	32.4	Very low	31.6	Very low	158.6 Å²	158.6	151.5 Å²	151.5	85%	0.848	80%	0.795	S	S	*	*			trans	106.6	76.4	167.9	-54.1	-49.1	0	0	0	116.2	S1956	S1956-N1958 PolarHBondContact O-N 3.05Å; S1956-N1958 VanDerWaalsContact O-N 3.14Å
1959	S	31.1	Very low	32	Very low	118.4 Å²	118.4	149.4 Å²	149.4	83%	0.828	79%	0.793	S	S	*	*			trans	-159.1	113.9	140.4	42.4	0	0	0	0	111.8
1960	E	28.5	Very low	32.5	Very low	175.6 Å²	175.6	147 Å²	147	82%	0.821	79%	0.789	S	S	*	*			trans	-82.1	144.3	160.8	-74.4	-176.6	158	0	0	108.6	Y1962	E1960-Y1962 PolarHBondContact O-N 2.87Å; E1960-Y1962 VanDerWaalsContact O-N 3.15Å
1961	P	31.8	Very low	33	Very low	120 Å²	120	146.7 Å²	146.7	78%	0.779	79%	0.787	S	S	*	*			trans	-103.3	101.8	-174.1	31.1	-21.1	0	0	0	110.6
1962	Y	28.8	Very low	33.6	Very low	201.4 Å²	201.4	146 Å²	146	79%	0.79	78%	0.783	S	S	*	*			trans	-101.2	132.6	161.3	-101	-95	0	0	0	111.8	E1960 K1964	E1960-Y1962 PolarHBondContact O-N 2.87Å; E1960-Y1962 VanDerWaalsContact O-N 3.15Å; Y1962-K1964 PolarHBondContact O-N 2.83Å; Y1962-K1964 VanDerWaalsContact O-N 3.14Å
1963	F	29.4	Very low	33.9	Very low	190 Å²	190	148.2 Å²	148.2	83%	0.833	79%	0.787	S	S	*	*			trans	-29.8	111.2	173.4	-70.7	-87.8	0	0	0	114.8
1964	K	30.3	Very low	34.2	Very low	188.2 Å²	188.2	149.6 Å²	149.6	82%	0.818	79%	0.79	S	S	*	*			trans	-114.1	117.4	149.5	-86.2	-172.9	174.2	-175.6	0	108.8	Y1962 N1966	Y1962-K1964 PolarHBondContact O-N 2.83Å; Y1962-K1964 VanDerWaalsContact O-N 3.14Å; K1964-N1966 VanDerWaalsContact C-N 3.34Å; K1964-N1966 PolarHBondContact O-N 3.1Å
1965	T	30.4	Very low	34.4	Very low	118.6 Å²	118.6	148.2 Å²	148.2	73%	0.728	79%	0.788	S	S	*	*			trans	-68.1	126.2	157.5	47.1	0	0	0	0	108.3	D1967	T1965-D1967 VanDerWaalsContact C-N 3.32Å; T1965-D1967 PolarHBondContact O-N 3.18Å; T1965-D1967 VanDerWaalsContact O-N 3.13Å
1966	N	31.4	Very low	34.6	Very low	141.4 Å²	141.4	149.4 Å²	149.4	76%	0.756	79%	0.786	S	S	*	*			trans	-104.1	104.4	159.8	-72.3	3.5	0	0	0	108.7	K1964	K1964-N1966 VanDerWaalsContact C-N 3.34Å; K1964-N1966 PolarHBondContact O-N 3.1Å
1967	D	35.6	Very low	34.8	Very low	132.2 Å²	132.2	150.3 Å²	150.3	71%	0.707	78%	0.781	S	S	*	*			trans	-91.1	134.2	152.2	-60.6	-48.6	0	0	0	110.5	T1965	T1965-D1967 VanDerWaalsContact C-N 3.32Å; T1965-D1967 PolarHBondContact O-N 3.18Å; T1965-D1967 VanDerWaalsContact O-N 3.13Å
1968	D	37.9	Very low	35.2	Very low	144.4 Å²	144.4	149.3 Å²	149.3	77%	0.772	78%	0.782	S	S	*	*			trans	92.3	117.9	161.8	-57.6	-30.1	0	0	0	117
1969	D	40.9	Very low	35.6	Very low	142.2 Å²	142.2	150.1 Å²	150.1	76%	0.76	78%	0.778	S	S	*	*			trans	100	104.7	152.1	-60.1	-21	0	0	0	118.5
1970	D	41.2	Very low	36.2	Very low	144 Å²	144	151.1 Å²	151.1	77%	0.77	77%	0.769	S	S	*	*			trans	93.2	125.7	136.6	-63.1	-21.5	0	0	0	120.2
1971	D	41	Very low	37.2	Very low	142.2 Å²	142.2	146.9 Å²	146.9	76%	0.76	76%	0.756	S	S	*	*			trans	64.5	109.5	151.7	-58.8	-20.9	0	0	0	121.6
1972	D	40.2	Very low	38.1	Very low	152 Å²	152	144.3 Å²	144.3	81%	0.813	74%	0.744	S	S	*	*			trans	66.2	141.9	139.4	-64.8	-26.2	0	0	0	122.7
1973	D	40.5	Very low	39.9	Very low	152.6 Å²	152.6	138.5 Å²	138.5	82%	0.816	73%	0.727	S	S	*	*			trans	78.7	120.3	164	-73.3	-18.5	0	0	0	121.9
1974	D	38.1	Very low	42.2	Very low	146 Å²	146	132.4 Å²	132.4	78%	0.781	70%	0.699	S	S	*	*			trans	19.3	115.8	156	-75	-27.9	0	0	0	120.2
1975	N	35	Very low	44.7	Very low	142.6 Å²	142.6	123.6 Å²	123.6	76%	0.763	66%	0.661	S	S	*	*			trans	-175.5	106.7	145.2	-89.2	-58.9	0	0	0	116.1	N1977	N1975-N1977 PolarHBondContact O-N 2.81Å; N1975-N1977 PolarHBondContact OD1-ND2 3.12Å; N1975-N1977 VanDerWaalsContact OD1-ND2 3.07Å
1976	N	37.6	Very low	47.4	Very low	141.2 Å²	141.2	118 Å²	118	76%	0.755	63%	0.626	S	S	*	*			trans	-128.2	27.3	164.9	-119.2	-20	0	0	0	115.1	N1978 K1979	N1976-N1978 VanDerWaalsContact C-N 3.26Å; N1976-N1978 PolarHBondContact O-N 2.99Å; N1976-N1978 VanDerWaalsContact O-N 3.16Å; N1976-K1979 PolarHBondContact O-N 3.47Å
1977	N	38	Very low	50.2	Low	128.6 Å²	128.6	111.3 Å²	111.3	69%	0.688	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	13.3	-164.3	-66.5	-30.6	0	0	0	115.7	N1975	N1975-N1977 PolarHBondContact O-N 2.81Å; N1975-N1977 PolarHBondContact OD1-ND2 3.12Å; N1975-N1977 VanDerWaalsContact OD1-ND2 3.07Å
1978	N	39.2	Very low	52.7	Low	155 Å²	155	105 Å²	105	83%	0.829	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	24	-179.7	-75.3	-16.3	0	0	0	113.9	N1976 E1980	N1976-N1978 VanDerWaalsContact C-N 3.26Å; N1976-N1978 PolarHBondContact O-N 2.99Å; N1976-N1978 VanDerWaalsContact O-N 3.16Å; N1978-E1980 PolarHBondContact O-N 2.86Å; N1978-E1980 VanDerWaalsContact O-N 3.09Å
1979	K	40.5	Very low	55.1	Low	176 Å²	176	98.3 Å²	98.3	77%	0.765	52%	0.521	S	S	*	.	S	Bend	trans	-98.5	-4.7	178.5	-108.8	179.4	177.5	-178.7	0	113.8	N1976 T1981 A1982	N1976-K1979 PolarHBondContact O-N 3.47Å; K1979-T1981 VanDerWaalsContact C-N 3.33Å; K1979-T1981 PolarHBondContact O-N 2.96Å; K1979-T1981 VanDerWaalsContact O-N 3.09Å; K1979-A1982 PolarHBondContact O-N 2.89Å
1980	E	44.9	Very low	57.2	Low	139.8 Å²	139.8	91.6 Å²	91.6	65%	0.653	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-0.2	-173.8	-67.5	-171.6	151.4	0	0	114.5	N1978 A1982 Y1984	N1978-E1980 PolarHBondContact O-N 2.86Å; N1978-E1980 VanDerWaalsContact O-N 3.09Å; E1980-A1982 VanDerWaalsContact C-N 3.32Å; E1980-A1982 PolarHBondContact O-N 3.08Å; E1980-A1982 VanDerWaalsContact O-N 3.17Å; E1980-Y1984 WeakPolarHBondContact O-CD2 3.17Å; E1980-Y1984 WeakPolarHBondContact O-CE2 3.18Å
1981	T	48.8	Very low	58.8	Low	87.2 Å²	87.2	86.8 Å²	86.8	54%	0.535	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-1.2	179.9	53.6	0	0	0	0	113	K1979 D1983	K1979-T1981 VanDerWaalsContact C-N 3.33Å; K1979-T1981 PolarHBondContact O-N 2.96Å; K1979-T1981 VanDerWaalsContact O-N 3.09Å; T1981-D1983 PolarHBondContact O-N 3.44Å
1982	A	50.7	Low	59.8	Low	65 Å²	65	80.3 Å²	80.3	54%	0.537	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-11.5	-175.6	0	0	0	0	0	113.8	K1979 E1980 Y1984	K1979-A1982 PolarHBondContact O-N 2.89Å; E1980-A1982 VanDerWaalsContact C-N 3.32Å; E1980-A1982 PolarHBondContact O-N 3.08Å; E1980-A1982 VanDerWaalsContact O-N 3.17Å; A1982-Y1984 VanDerWaalsContact C-N 3.31Å; A1982-Y1984 HydrophobicContact CB-CD2 4.33Å; A1982-Y1984 HydrophobicContact CB-CE2 3.84Å; A1982-Y1984 WeakPolarHBondContact O-CD2 3.06Å; A1982-Y1984 PolarHBondContact O-N 3.05Å
1983	D	67.1	Low	60.7	Low	78.6 Å²	78.6	76 Å²	76	42%	0.42	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	15.8	-170	-64.2	-17.8	0	0	0	113.2	T1981 K2074 H2075	T1981-D1983 PolarHBondContact O-N 3.44Å; D1983-K2074 HydrophobicContact CB-CG 4.42Å; D1983-K2074 CarbonylContact O-C 3.5Å; D1983-H2075 PolarHBondContact O-N 2.83Å
1984	Y	77.1	Confident	61	Low	62.8 Å²	62.8	69.6 Å²	69.6	25%	0.246	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	141.1	-179.6	-71.3	-88.7	0	0	0	112.8	L1943 E1980 A1982 N2039 L2040 A2072 M2073 K2074	L1943-Y1984 HydrophobicContact CD1-CD1 4.11Å; L1943-Y1984 HydrophobicContact CD1-CD2 4.07Å; L1943-Y1984 HydrophobicContact CD1-CE1 4.02Å; L1943-Y1984 HydrophobicContact CD1-CE2 3.98Å; L1943-Y1984 HydrophobicContact CD1-CG 4.13Å; E1980-Y1984 WeakPolarHBondContact O-CD2 3.17Å; E1980-Y1984 WeakPolarHBondContact O-CE2 3.18Å; A1982-Y1984 VanDerWaalsContact C-N 3.31Å; A1982-Y1984 HydrophobicContact CB-CD2 4.33Å; A1982-Y1984 HydrophobicContact CB-CE2 3.84Å; A1982-Y1984 WeakPolarHBondContact O-CD2 3.06Å; A1982-Y1984 PolarHBondContact O-N 3.05Å; Y1984-N2039 PolarHBondContact O-N 3.25Å; Y1984-L2040 HydrophobicContact CD2-CD1 4.02Å; Y1984-L2040 HydrophobicContact CG-CD1 4.03Å; Y1984-A2072 HydrophobicContact CD1-CB 4.24Å; Y1984-M2073 CarbonylContact C-O 3.4Å; Y1984-M2073 WeakPolarHBondContact CA-O 3.39Å; Y1984-K2074 HydrophobicContact CD1-CB 4.07Å; Y1984-K2074 HydrophobicContact CD1-CG 4.44Å; Y1984-K2074 HydrophobicContact CE1-CB 3.74Å; Y1984-K2074 HydrophobicContact CE1-CD 4.48Å; Y1984-K2074 HydrophobicContact CE1-CG 4.17Å
1985	S	83.1	Confident	61.1	Low	3.4 Å²	3.4	64 Å²	64	2%	0.024	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	137.6	171.5	64.1	0	0	0	0	111.6	V2037 A2072 M2073	S1985-V2037 CarbonylContact C-O 3.53Å; S1985-V2037 VanDerWaalsContact CA-O 3.32Å; S1985-V2037 WeakPolarHBondContact CA-O 3.36Å; S1985-A2072 CarbonylContact O-C 3.45Å; S1985-A2072 WeakPolarHBondContact O-CA 3.2Å; S1985-M2073 PolarHBondContact N-O 3.12Å; S1985-M2073 PolarHBondContact O-N 3Å; S1985-M2073 WeakPolarHBondContact OG-CB 3.47Å; S1985-M2073 PolarHBondContact OG-O 3.19Å; S1985-M2073 VanDerWaalsContact OG-O 3.09Å
1986	V	87.5	Confident	61.4	Low	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	138.6	-173.2	-169.7	0	0	0	0	111.2	L1941 K2036 V2037 L2040 A2043 W2045 V2070 W2071 I2093	L1941-V1986 HydrophobicContact CD1-CB 4.36Å; L1941-V1986 HydrophobicContact CD1-CG1 3.66Å; L1941-V1986 HydrophobicContact CD1-CG2 4.35Å; V1986-K2036 CarbonylContact O-C 3.5Å; V1986-K2036 WeakPolarHBondContact O-CA 2.96Å; V1986-V2037 PolarHBondContact N-O 2.89Å; V1986-V2037 PolarHBondContact O-N 3.15Å; V1986-L2040 HydrophobicContact CG2-CD1 3.91Å; V1986-L2040 HydrophobicContact CG2-CD2 3.85Å; V1986-L2040 HydrophobicContact CG2-CG 4.27Å; V1986-A2043 HydrophobicContact CB-CB 4.41Å; V1986-W2045 HydrophobicContact CB-CZ2 4.2Å; V1986-W2045 HydrophobicContact CG1-CH2 4.19Å; V1986-W2045 HydrophobicContact CG1-CZ2 3.8Å; V1986-W2045 PolarHBondContact O-NE1 2.89Å; V1986-W2045 VanDerWaalsContact O-NE1 3.13Å; V1986-V2070 HydrophobicContact CG1-CG1 3.79Å; V1986-W2071 VanDerWaalsContact CA-O 3.25Å; V1986-W2071 WeakPolarHBondContact CA-O 3.35Å; V1986-W2071 VanDerWaalsContact CG1-O 3.29Å; V1986-W2071 WeakPolarHBondContact CG1-O 3.26Å; V1986-I2093 HydrophobicContact CG1-CD1 4.04Å; V1986-I2093 HydrophobicContact CG2-CD1 4.32Å
1987	F	89.4	Confident	61.5	Low	2.4 Å²	2.4	63.1 Å²	63.1	1%	0.011	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	164	173.7	64.9	-85.6	0	0	0	112	T1989 W2017 L2033 T2034 K2036 W2071 M2073 P2090	F1987-T1989 HydrophobicContact CD2-CG2 4.05Å; F1987-T1989 HydrophobicContact CE2-CG2 3.94Å; F1987-W2017 HydrophobicContact CE2-CH2 4.26Å; F1987-W2017 AromaticContact CE2-CZ3 3.96Å; F1987-W2017 HydrophobicContact CE2-CZ3 4.13Å; F1987-W2017 AromaticContact CZ-CH2 3.99Å; F1987-W2017 HydrophobicContact CZ-CH2 4.15Å; F1987-W2017 HydrophobicContact CZ-CZ3 4.11Å; F1987-L2033 HydrophobicContact CB-CD1 3.95Å; F1987-L2033 HydrophobicContact CD2-CD1 3.65Å; F1987-L2033 HydrophobicContact CD2-CD2 4.2Å; F1987-L2033 HydrophobicContact CD2-CG 3.83Å; F1987-L2033 HydrophobicContact CE2-CD1 3.84Å; F1987-L2033 HydrophobicContact CE2-CD2 4.21Å; F1987-L2033 HydrophobicContact CE2-CG 4.19Å; F1987-L2033 HydrophobicContact CG-CD1 3.7Å; F1987-L2033 HydrophobicContact CG-CD2 4.45Å; F1987-T2034 WeakPolarHBondContact CA-OG1 3.22Å; F1987-K2036 HydrophobicContact CB-CB 4.29Å; F1987-K2036 HydrophobicContact CB-CG 4.21Å; F1987-K2036 HydrophobicContact CD1-CD 4.06Å; F1987-K2036 HydrophobicContact CD1-CG 3.97Å; F1987-K2036 HydrophobicContact CE1-CD 4.13Å; F1987-K2036 HydrophobicContact CG-CD 4.36Å; F1987-K2036 HydrophobicContact CG-CG 4.33Å; F1987-W2071 HydrophobicContact CD1-CB 4.06Å; F1987-W2071 HydrophobicContact CD2-CB 4.05Å; F1987-W2071 AromaticContact CD2-CD1 3.86Å; F1987-W2071 HydrophobicContact CD2-CG 4.24Å; F1987-W2071 HydrophobicContact CE1-CB 3.65Å; F1987-W2071 HydrophobicContact CE1-CG 4.35Å; F1987-W2071 HydrophobicContact CE2-CB 3.64Å; F1987-W2071 VanDerWaalsContact CE2-CB 3.42Å; F1987-W2071 AromaticContact CE2-CD1 3.56Å; F1987-W2071 VanDerWaalsContact CE2-CD1 3.4Å; F1987-W2071 HydrophobicContact CE2-CD2 4.33Å; F1987-W2071 AromaticContact CE2-CG 3.64Å; F1987-W2071 HydrophobicContact CE2-CG 3.64Å; F1987-W2071 VanDerWaalsContact CE2-CG 3.44Å; F1987-W2071 HydrophobicContact CG-CB 4.26Å; F1987-W2071 HydrophobicContact CZ-CB 3.43Å; F1987-W2071 VanDerWaalsContact CZ-CB 3.47Å; F1987-W2071 HydrophobicContact CZ-CD2 4.44Å; F1987-W2071 AromaticContact CZ-CG 3.79Å; F1987-W2071 HydrophobicContact CZ-CG 3.79Å; F1987-W2071 PolarHBondContact N-O 2.89Å; F1987-W2071 PolarHBondContact O-N 3.09Å; F1987-M2073 HydrophobicContact CE1-CB 4.3Å; F1987-P2090 HydrophobicContact CE1-CB 3.99Å; F1987-P2090 HydrophobicContact CZ-CB 3.78Å; F1987-P2090 HydrophobicContact CZ-CG 4.02Å
1988	V	89.1	Confident	61.6	Low	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	140.6	-175.1	-173.9	0	0	0	0	110.5	V1935 L2033 T2034 W2045 F2068 H2069 V2070 I2139	V1935-V1988 HydrophobicContact CG1-CB 4.42Å; V1935-V1988 HydrophobicContact CG1-CG1 4.46Å; V1935-V1988 HydrophobicContact CG1-CG2 4.25Å; V1988-L2033 WeakPolarHBondContact O-CA 3.34Å; V1988-T2034 WeakPolarHBondContact CA-OG1 3.28Å; V1988-T2034 HydrophobicContact CB-CG2 3.87Å; V1988-T2034 WeakPolarHBondContact CB-OG1 3.39Å; V1988-T2034 HydrophobicContact CG2-CG2 4.47Å; V1988-T2034 PolarHBondContact N-OG1 3.2Å; V1988-T2034 PolarHBondContact O-N 2.98Å; V1988-T2034 PolarHBondContact O-OG1 2.93Å; V1988-T2034 VanDerWaalsContact O-OG1 3.06Å; V1988-W2045 HydrophobicContact CG2-CD2 4.43Å; V1988-W2045 HydrophobicContact CG2-CE3 4.3Å; V1988-W2045 HydrophobicContact CG2-CH2 3.54Å; V1988-W2045 HydrophobicContact CG2-CZ2 3.72Å; V1988-W2045 HydrophobicContact CG2-CZ3 3.85Å; V1988-F2068 HydrophobicContact CG1-CB 4.03Å; V1988-F2068 HydrophobicContact CG1-CD1 4.16Å; V1988-H2069 CarbonylContact C-O 3.52Å; V1988-H2069 VanDerWaalsContact CA-O 3.27Å; V1988-H2069 WeakPolarHBondContact CA-O 3.31Å; V1988-H2069 WeakPolarHBondContact CG1-O 3.1Å; V1988-V2070 HydrophobicContact CG1-CG2 4.46Å; V1988-V2070 HydrophobicContact CG2-CG1 4.39Å; V1988-V2070 HydrophobicContact CG2-CG2 4.29Å; V1988-I2139 HydrophobicContact CG1-CD1 4.22Å; V1988-I2139 HydrophobicContact CG2-CD1 3.76Å
1989	T	87.2	Confident	61.3	Low	2 Å²	2	56.7 Å²	56.7	1%	0.012	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	138.9	175.8	66.7	0	0	0	0	113.4	F1987 I2031 A2032 L2033 H2069 W2071	F1987-T1989 HydrophobicContact CD2-CG2 4.05Å; F1987-T1989 HydrophobicContact CE2-CG2 3.94Å; T1989-I2031 HydrophobicContact CG2-CG2 4.36Å; T1989-A2032 WeakPolarHBondContact CA-O 3.35Å; T1989-A2032 VanDerWaalsContact CB-O 3.31Å; T1989-A2032 WeakPolarHBondContact CB-O 3.19Å; T1989-L2033 HydrophobicContact CG2-CB 4.4Å; T1989-L2033 HydrophobicContact CG2-CD1 3.6Å; T1989-L2033 VanDerWaalsContact CG2-CD1 3.45Å; T1989-L2033 HydrophobicContact CG2-CD2 3.94Å; T1989-L2033 HydrophobicContact CG2-CG 3.85Å; T1989-H2069 PolarHBondContact N-O 2.87Å; T1989-H2069 PolarHBondContact O-N 3.14Å; T1989-H2069 WeakPolarHBondContact OG1-CB 2.97Å; T1989-W2071 PolarHBondContact OG1-NE1 3.03Å
1990	F	85.5	Confident	61.1	Low	1.8 Å²	1.8	53.8 Å²	53.8	1%	0.008	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	155.3	178.9	61.6	-91.5	0	0	0	111.8	I1933 V1935 V1992 I2031 A2032 Y2047 R2049 V2051 M2067 F2068	I1933-F1990 HydrophobicContact CB-CE2 4.18Å; I1933-F1990 HydrophobicContact CB-CZ 4.27Å; I1933-F1990 HydrophobicContact CD1-CD2 3.82Å; I1933-F1990 HydrophobicContact CD1-CE2 3.59Å; I1933-F1990 HydrophobicContact CD1-CZ 4.45Å; I1933-F1990 HydrophobicContact CG1-CE2 4.45Å; I1933-F1990 HydrophobicContact CG2-CD2 4.39Å; I1933-F1990 HydrophobicContact CG2-CE1 4.28Å; I1933-F1990 HydrophobicContact CG2-CE2 3.92Å; I1933-F1990 HydrophobicContact CG2-CZ 3.77Å; V1935-F1990 HydrophobicContact CG2-CD1 4.48Å; V1935-F1990 HydrophobicContact CG2-CE1 4.1Å; F1990-V1992 HydrophobicContact CD2-CG2 4.36Å; F1990-V1992 HydrophobicContact CE2-CG2 4.13Å; F1990-I2031 CarbonylContact O-C 3.51Å; F1990-I2031 WeakPolarHBondContact O-CA 3.22Å; F1990-A2032 HydrophobicContact CD1-CB 3.84Å; F1990-A2032 HydrophobicContact CD2-CB 3.82Å; F1990-A2032 HydrophobicContact CE1-CB 3.54Å; F1990-A2032 VanDerWaalsContact CE1-CB 3.46Å; F1990-A2032 HydrophobicContact CE2-CB 3.51Å; F1990-A2032 VanDerWaalsContact CE2-CB 3.47Å; F1990-A2032 HydrophobicContact CG-CB 3.99Å; F1990-A2032 HydrophobicContact CZ-CB 3.38Å; F1990-A2032 PolarHBondContact N-O 3.06Å; F1990-A2032 VanDerWaalsContact N-O 3.16Å; F1990-A2032 WeakPolarHBondContact O-CB 3.21Å; F1990-A2032 PolarHBondContact O-N 3.03Å; F1990-Y2047 HydrophobicContact CE1-CD1 4.18Å; F1990-Y2047 AromaticContact CE1-CE1 3.8Å; F1990-Y2047 HydrophobicContact CE1-CE1 3.86Å; F1990-Y2047 HydrophobicContact CZ-CD1 4.37Å; F1990-Y2047 AromaticContact CZ-CE1 3.84Å; F1990-Y2047 HydrophobicContact CZ-CE1 3.84Å; F1990-R2049 HydrophobicContact CE2-CB 4.43Å; F1990-R2049 HydrophobicContact CZ-CB 4.17Å; F1990-V2051 HydrophobicContact CE2-CG1 4.14Å; F1990-M2067 WeakPolarHBondContact CB-O 3.45Å; F1990-F2068 HydrophobicContact CB-CD1 3.71Å; F1990-F2068 HydrophobicContact CB-CE1 3.89Å; F1990-F2068 HydrophobicContact CB-CG 4.22Å; F1990-F2068 HydrophobicContact CB-CZ 4.4Å; F1990-F2068 AromaticContact CD1-CD1 3.74Å; F1990-F2068 HydrophobicContact CD1-CD1 3.74Å; F1990-F2068 AromaticContact CD1-CE1 3.69Å; F1990-F2068 HydrophobicContact CD1-CE1 3.69Å; F1990-F2068 HydrophobicContact CD2-CE1 4.33Å; F1990-F2068 HydrophobicContact CE1-CD1 4.44Å; F1990-F2068 HydrophobicContact CE1-CE1 4.24Å; F1990-F2068 AromaticContact CG-CD1 3.91Å; F1990-F2068 HydrophobicContact CG-CD1 3.91Å; F1990-F2068 AromaticContact CG-CE1 3.73Å; F1990-F2068 HydrophobicContact CG-CE1 3.73Å; F1990-F2068 HydrophobicContact CG-CZ 4.38Å
1991	P	74.8	Confident	60.4	Low	43.6 Å²	43.6	52.4 Å²	52.4	28%	0.283	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	146	-178	29	-34.6	0	0	0	112.9	Y1998 L2066 M2067	P1991-Y1998 HydrophobicContact CB-CE1 4.36Å; P1991-Y1998 HydrophobicContact CG-CE1 4.22Å; P1991-Y1998 VanDerWaalsContact CG-OH 3.25Å; P1991-Y1998 WeakPolarHBondContact CG-OH 3.26Å; P1991-L2066 HydrophobicContact CG-CD1 4.04Å; P1991-M2067 WeakPolarHBondContact CD-O 3.39Å
1992	V	62.5	Low	59.5	Low	5 Å²	5	55.3 Å²	55.3	3%	0.03	30%	0.304	C	S	.	.			trans	-120.5	16.9	-175.6	179.8	0	0	0	0	112.2	W1890 Y1895 F1990 R2030 I2031 A2032 V2051 R2052	W1890-V1992 HydrophobicContact CZ2-CG1 3.86Å; Y1895-V1992 HydrophobicContact CE1-CB 4.42Å; Y1895-V1992 HydrophobicContact CE1-CG1 4.39Å; Y1895-V1992 HydrophobicContact CE2-CG1 4.39Å; Y1895-V1992 WeakPolarHBondContact OH-CB 3.22Å; Y1895-V1992 WeakPolarHBondContact OH-CG1 3.41Å; F1990-V1992 HydrophobicContact CD2-CG2 4.36Å; F1990-V1992 HydrophobicContact CE2-CG2 4.13Å; V1992-R2030 HydrophobicContact CB-CB 4.13Å; V1992-R2030 VanDerWaalsContact CB-O 3.32Å; V1992-R2030 WeakPolarHBondContact CB-O 3.2Å; V1992-R2030 HydrophobicContact CG1-CB 4.35Å; V1992-R2030 PolarHBondContact N-O 2.86Å; V1992-R2030 VanDerWaalsContact N-O 3.11Å; V1992-R2030 VanDerWaalsContact O-O 3.07Å; V1992-I2031 VanDerWaalsContact CG2-C 3.49Å; V1992-A2032 HydrophobicContact CG2-CB 3.52Å; V1992-A2032 VanDerWaalsContact CG2-CB 3.45Å; V1992-A2032 VanDerWaalsContact CG2-N 3.32Å; V1992-V2051 HydrophobicContact CB-CG1 4.35Å; V1992-V2051 HydrophobicContact CG1-CB 4.05Å; V1992-V2051 HydrophobicContact CG1-CG1 3.9Å; V1992-V2051 VanDerWaalsContact CG1-CG1 3.48Å; V1992-V2051 HydrophobicContact CG2-CG1 4.21Å; V1992-V2051 WeakPolarHBondContact O-CB 3.42Å; V1992-R2052 PolarHBondContact O-N 3.08Å
1993	N	57.9	Low	58.5	Low	61.4 Å²	61.4	60.6 Å²	60.6	33%	0.328	32%	0.315	S	S	.	.	S	Bend	trans	-165.6	126.9	-177.3	-62.5	-11.3	0	0	0	111.9	Y1895 G1995 R2052	Y1895-N1993 WeakPolarHBondContact CD1-ND2 3.17Å; Y1895-N1993 WeakPolarHBondContact CE1-ND2 3.21Å; Y1895-N1993 WeakPolarHBondContact CE1-OD1 3.3Å; N1993-G1995 PolarHBondContact O-N 3.13Å; N1993-R2052 WeakPolarHBondContact CA-O 3.36Å; N1993-R2052 PolarHBondContact N-O 3.19Å
1994	G	46.4	Very low	56.7	Low	19 Å²	19	65.2 Å²	65.2	20%	0.196	33%	0.334	C	S	.	.			trans	-72.1	53.5	174.6	0	0	0	0	0	114.9	R2052	G1994-R2052 PolarHBondContact N-O 2.89Å
1995	G	41.6	Very low	54.4	Low	28.6 Å²	28.6	67.3 Å²	67.3	30%	0.295	36%	0.358	S	S	.	.			trans	-64.8	145.3	165.2	0	0	0	0	0	110.3	N1993 H1997	N1993-G1995 PolarHBondContact O-N 3.13Å; G1995-H1997 PolarHBondContact O-N 3.13Å
1996	N	41	Very low	51.9	Low	125.6 Å²	125.6	74.2 Å²	74.2	67%	0.672	39%	0.393	S	S	*	.	S	Bend	trans	-68.4	34.5	-168.1	-114.5	-0.3	0	0	0	115.6	N1926	N1926-N1996 PolarHBondContact ND2-OD1 3.16Å; N1926-N1996 PolarHBondContact OD1-ND2 3.36Å; N1926-N1996 PolarHBondContact OD1-OD1 3.01Å
1997	H	39.5	Very low	49.1	Very low	139.8 Å²	139.8	80.2 Å²	80.2	65%	0.647	43%	0.429	S	S	*	.			trans	-135.5	60.6	179.3	-113.9	-57.1	0	0	0	112.2	G1995 C1999 N2029	G1995-H1997 PolarHBondContact O-N 3.13Å; H1997-C1999 WeakPolarHBondContact ND1-CB 3.46Å; H1997-C1999 PolarHBondContact ND1-SG 2.97Å; H1997-C1999 PolarHBondContact O-N 3.01Å; H1997-N2029 PolarHBondContact O-ND2 3.48Å
1998	Y	39.6	Very low	46.2	Very low	74.2 Å²	74.2	83.8 Å²	83.8	29%	0.291	47%	0.468	S	S	.	.			trans	-72.8	57.4	158	-74.9	-89.6	0	0	0	110.3	P1991 F2000 N2001 P2054 E2056 L2057 Q2064	P1991-Y1998 HydrophobicContact CB-CE1 4.36Å; P1991-Y1998 HydrophobicContact CG-CE1 4.22Å; P1991-Y1998 VanDerWaalsContact CG-OH 3.25Å; P1991-Y1998 WeakPolarHBondContact CG-OH 3.26Å; Y1998-F2000 VanDerWaalsContact C-N 3.25Å; Y1998-F2000 PolarHBondContact O-N 3.11Å; Y1998-F2000 VanDerWaalsContact O-N 3.17Å; Y1998-N2001 PolarHBondContact O-N 2.91Å; Y1998-P2054 HydrophobicContact CD2-CG 4.11Å; Y1998-P2054 HydrophobicContact CE1-CG 4.42Å; Y1998-P2054 HydrophobicContact CE2-CB 4.34Å; Y1998-P2054 HydrophobicContact CE2-CG 3.35Å; Y1998-P2054 WeakPolarHBondContact OH-CB 3.28Å; Y1998-P2054 WeakPolarHBondContact OH-CD 3.44Å; Y1998-P2054 WeakPolarHBondContact OH-CG 3.28Å; Y1998-E2056 WeakPolarHBondContact CE2-OE2 3.38Å; Y1998-E2056 PolarHBondContact OH-OE2 3.24Å; Y1998-L2057 HydrophobicContact CE1-CD1 4.25Å; Y1998-L2057 HydrophobicContact CE1-CD2 4.13Å; Y1998-L2057 WeakPolarHBondContact OH-CG 3.46Å; Y1998-Q2064 PolarHBondContact O-NE2 3.19Å
1999	C	33.1	Very low	43.5	Very low	73.6 Å²	73.6	89.7 Å²	89.7	50%	0.497	50%	0.499	S	S	.	.			trans	-106.5	62	-179.7	-66.6	0	0	0	0	111.3	H1997 N2001	H1997-C1999 WeakPolarHBondContact ND1-CB 3.46Å; H1997-C1999 PolarHBondContact ND1-SG 2.97Å; H1997-C1999 PolarHBondContact O-N 3.01Å; C1999-N2001 PolarHBondContact O-N 2.94Å
2000	F	35.9	Very low	41.3	Very low	115.2 Å²	115.2	95.5 Å²	95.5	51%	0.505	54%	0.535	S	S	.	.			trans	-87.7	-6.6	157.1	-82.6	-76.9	0	0	0	112.2	Y1998 N2002 L2016 Q2019 I2020 L2023	Y1998-F2000 VanDerWaalsContact C-N 3.25Å; Y1998-F2000 PolarHBondContact O-N 3.11Å; Y1998-F2000 VanDerWaalsContact O-N 3.17Å; F2000-N2002 VanDerWaalsContact C-N 3.35Å; F2000-N2002 PolarHBondContact O-N 3.06Å; F2000-L2016 HydrophobicContact CD1-CD2 3.67Å; F2000-L2016 HydrophobicContact CE1-CD2 3.69Å; F2000-L2016 HydrophobicContact CE2-CD2 4.47Å; F2000-L2016 HydrophobicContact CZ-CD2 3.87Å; F2000-L2016 HydrophobicContact CZ-CG 4.21Å; F2000-Q2019 HydrophobicContact CE1-CB 4.37Å; F2000-Q2019 VanDerWaalsContact CE1-OE1 3.27Å; F2000-I2020 HydrophobicContact CZ-CG1 4.27Å; F2000-L2023 HydrophobicContact CZ-CD1 4.34Å
2001	N	30.2	Very low	39.6	Very low	111.75 Å²	111.75	98.9 Å²	98.9	60%	0.598	55%	0.553	S	S	*	*			trans	-95.9	57.9	179.8	-70.4	-14.7	0	0	0	112.8	Y1998 C1999 K2003 Q2064	Y1998-N2001 PolarHBondContact O-N 2.91Å; C1999-N2001 PolarHBondContact O-N 2.94Å; N2001-K2003 VanDerWaalsContact C-N 3.26Å; N2001-K2003 PolarHBondContact O-N 2.97Å; N2001-K2003 VanDerWaalsContact O-N 3.13Å; N2001-Q2064 PolarHBondContact ND2-NE2 2.77Å
2002	N	29.9	Very low	38.3	Very low	148.25 Å²	148.25	101.6 Å²	101.6	79%	0.793	56%	0.562	S	S	*	*			trans	-78.6	90.5	161.6	-124.2	1.9	0	0	0	108.6	F2000 H2004	F2000-N2002 VanDerWaalsContact C-N 3.35Å; F2000-N2002 PolarHBondContact O-N 3.06Å; N2002-H2004 PolarHBondContact O-N 3Å
2003	K	29.8	Very low	38	Very low	175.75 Å²	175.75	103.2 Å²	103.2	76%	0.764	57%	0.57	S	S	*	*			trans	-65.8	55.4	175.6	-91.3	-173.1	171.9	-171	0	111.9	N2001	N2001-K2003 VanDerWaalsContact C-N 3.26Å; N2001-K2003 PolarHBondContact O-N 2.97Å; N2001-K2003 VanDerWaalsContact O-N 3.13Å
2004	H	29.7	Very low	38	Very low	175.75 Å²	175.75	103.5 Å²	103.5	81%	0.814	57%	0.57	S	S	*	*	S	Bend	trans	-151.6	101	167.7	-77.3	-52.6	0	0	0	112	N2002	N2002-H2004 PolarHBondContact O-N 3Å
2005	S	28.2	Very low	38.6	Very low	106.5 Å²	106.5	109 Å²	109	75%	0.745	59%	0.588	S	S	*	*			trans	101	79.3	165.5	-158.3	0	0	0	0	115.3	T2007	S2005-T2007 PolarHBondContact O-N 3.39Å
2006	I	30.3	Very low	39.6	Very low	149 Å²	149	109.2 Å²	109.2	76%	0.764	58%	0.582	S	S	*	*			trans	-74.4	100.1	142.1	-59.6	171.5	0	0	0	109.1	Q2012	I2006-Q2012 VanDerWaalsContact CG2-OE1 3.3Å
2007	T	29.5	Very low	40.9	Very low	124 Å²	124	105.1 Å²	105.1	76%	0.761	56%	0.557	S	S	*	*			trans	-164.7	125.2	162	40.3	0	0	0	0	112.2	S2005 N2009	S2005-T2007 PolarHBondContact O-N 3.39Å; T2007-N2009 PolarHBondContact O-N 3.34Å
2008	G	28.7	Very low	41.9	Very low	79.5 Å²	79.5	103.2 Å²	103.2	82%	0.82	55%	0.547	S	S	*	.			trans	-20.9	112.8	177.8	0	0	0	0	0	117.9
2009	N	32.3	Very low	42.8	Very low	123.25 Å²	123.25	104.1 Å²	104.1	66%	0.659	55%	0.554	S	S	*	*			trans	-157.4	140.1	156.1	-138.3	-17.3	0	0	0	110.9	T2007 N2011 Q2012	T2007-N2009 PolarHBondContact O-N 3.34Å; N2009-N2011 VanDerWaalsContact C-N 3.26Å; N2009-N2011 PolarHBondContact O-N 3.03Å; N2009-N2011 VanDerWaalsContact O-N 3.12Å; N2009-Q2012 WeakPolarHBondContact O-CG 3.34Å; N2009-Q2012 PolarHBondContact O-NE2 2.82Å
2010	T	40.2	Very low	44.1	Very low	124.75 Å²	124.75	101.3 Å²	101.3	77%	0.765	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	2.5	-166.7	44.2	0	0	0	0	116.3	Q2012	T2010-Q2012 PolarHBondContact O-N 2.76Å
2011	N	50.4	Low	45.2	Very low	73.25 Å²	73.25	98.4 Å²	98.4	39%	0.392	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	20.4	-168.6	-61.6	13.2	0	0	0	113.7	N2009 N2013 E2014 K2015	N2009-N2011 VanDerWaalsContact C-N 3.26Å; N2009-N2011 PolarHBondContact O-N 3.03Å; N2009-N2011 VanDerWaalsContact O-N 3.12Å; N2011-N2013 PolarHBondContact O-N 2.94Å; N2011-E2014 HydrophobicContact CB-CB 4.47Å; N2011-E2014 PolarHBondContact ND2-OE2 3.16Å; N2011-K2015 VanDerWaalsContact O-CG 3.3Å; N2011-K2015 WeakPolarHBondContact O-CG 3.45Å; N2011-K2015 PolarHBondContact O-N 3.13Å; N2011-K2015 VanDerWaalsContact O-N 3.13Å
2012	Q	48.3	Very low	46.3	Very low	99.75 Å²	99.75	100.2 Å²	100.2	47%	0.466	53%	0.528	S	S	.	.	H	α-helix	trans	-71	-41.7	-177.4	-67.9	-167.5	12.8	0	0	112.9	I2006 N2009 T2010 E2014 K2015 L2016	I2006-Q2012 VanDerWaalsContact CG2-OE1 3.3Å; N2009-Q2012 WeakPolarHBondContact O-CG 3.34Å; N2009-Q2012 PolarHBondContact O-NE2 2.82Å; T2010-Q2012 PolarHBondContact O-N 2.76Å; Q2012-E2014 VanDerWaalsContact C-N 3.33Å; Q2012-E2014 PolarHBondContact O-N 3.32Å; Q2012-K2015 WeakPolarHBondContact O-CA 3.45Å; Q2012-K2015 WeakPolarHBondContact O-CB 3.37Å; Q2012-K2015 PolarHBondContact O-N 3.11Å; Q2012-K2015 VanDerWaalsContact O-N 3.1Å; Q2012-L2016 PolarHBondContact O-N 3.1Å
2013	N	55.7	Low	47.1	Very low	37.25 Å²	37.25	95.6 Å²	95.6	20%	0.199	50%	0.504	C	S	.	.	H	α-helix	trans	-64.3	-39.7	178.6	-66.4	-23.5	0	0	0	111.8	N2011 K2015 L2016 W2017 L2092	N2011-N2013 PolarHBondContact O-N 2.94Å; N2013-K2015 VanDerWaalsContact C-N 3.34Å; N2013-K2015 PolarHBondContact O-N 2.95Å; N2013-L2016 PolarHBondContact O-N 3.25Å; N2013-W2017 PolarHBondContact O-N 2.92Å; N2013-W2017 VanDerWaalsContact O-N 3.1Å; N2013-L2092 HydrophobicContact CB-CB 4.44Å; N2013-L2092 WeakPolarHBondContact OD1-CB 3.35Å
2014	E	57	Low	47.7	Very low	69.75 Å²	69.75	90.4 Å²	90.4	33%	0.326	49%	0.49	S	S	.	.	H	α-helix	trans	-60.9	-42	170.4	-78.7	-163.6	-176.8	0	0	112.5	N2011 Q2012 L2016 W2017 K2018	N2011-E2014 HydrophobicContact CB-CB 4.47Å; N2011-E2014 PolarHBondContact ND2-OE2 3.16Å; Q2012-E2014 VanDerWaalsContact C-N 3.33Å; Q2012-E2014 PolarHBondContact O-N 3.32Å; E2014-L2016 VanDerWaalsContact C-N 3.34Å; E2014-L2016 PolarHBondContact O-N 3.17Å; E2014-W2017 PolarHBondContact O-N 3.05Å; E2014-K2018 HydrophobicContact CB-CD 4.43Å; E2014-K2018 WeakPolarHBondContact O-CB 3.3Å; E2014-K2018 WeakPolarHBondContact O-CD 3.31Å; E2014-K2018 WeakPolarHBondContact O-CG 3.41Å; E2014-K2018 PolarHBondContact O-N 3.02Å; E2014-K2018 WeakPolarHBondContact OE1-CE 3.42Å; E2014-K2018 IonicContact OE1-NZ 3.43Å; E2014-K2018 PolarHBondContact OE1-NZ 3.18Å; E2014-K2018 IonicContact OE2-NZ 2.96Å; E2014-K2018 PolarHBondContact OE2-NZ 3.17Å
2015	K	59.4	Low	48	Very low	134 Å²	134	88.3 Å²	88.3	58%	0.583	48%	0.484	S	S	*	.	H	α-helix	trans	-64.3	-40.9	178.9	-77.2	175.7	-179.2	-178.9	0	111.5	N2011 Q2012 N2013 K2018 Q2019	N2011-K2015 VanDerWaalsContact O-CG 3.3Å; N2011-K2015 WeakPolarHBondContact O-CG 3.45Å; N2011-K2015 PolarHBondContact O-N 3.13Å; N2011-K2015 VanDerWaalsContact O-N 3.13Å; Q2012-K2015 WeakPolarHBondContact O-CA 3.45Å; Q2012-K2015 WeakPolarHBondContact O-CB 3.37Å; Q2012-K2015 PolarHBondContact O-N 3.11Å; Q2012-K2015 VanDerWaalsContact O-N 3.1Å; N2013-K2015 VanDerWaalsContact C-N 3.34Å; N2013-K2015 PolarHBondContact O-N 2.95Å; K2015-K2018 CarbonylContact O-C 3.49Å; K2015-K2018 PolarHBondContact O-N 2.98Å; K2015-Q2019 WeakPolarHBondContact O-CB 3.35Å; K2015-Q2019 VanDerWaalsContact O-CG 3.27Å; K2015-Q2019 WeakPolarHBondContact O-CG 3.37Å; K2015-Q2019 PolarHBondContact O-N 3.01Å
2016	L	62.4	Low	48.5	Very low	31.25 Å²	31.25	89 Å²	89	16%	0.164	48%	0.478	C	S	.	.	H	α-helix	trans	-63	-48	174.3	-77.9	170.6	0	0	0	111.3	F2000 Q2012 N2013 E2014 K2018 Q2019 I2020 W2071 L2092	F2000-L2016 HydrophobicContact CD1-CD2 3.67Å; F2000-L2016 HydrophobicContact CE1-CD2 3.69Å; F2000-L2016 HydrophobicContact CE2-CD2 4.47Å; F2000-L2016 HydrophobicContact CZ-CD2 3.87Å; F2000-L2016 HydrophobicContact CZ-CG 4.21Å; Q2012-L2016 PolarHBondContact O-N 3.1Å; N2013-L2016 PolarHBondContact O-N 3.25Å; E2014-L2016 VanDerWaalsContact C-N 3.34Å; E2014-L2016 PolarHBondContact O-N 3.17Å; L2016-K2018 PolarHBondContact O-N 3.04Å; L2016-Q2019 CarbonylContact O-C 3.43Å; L2016-Q2019 WeakPolarHBondContact O-CB 3.44Å; L2016-Q2019 PolarHBondContact O-N 3.35Å; L2016-Q2019 VanDerWaalsContact O-N 3.16Å; L2016-I2020 VanDerWaalsContact O-CG1 3.3Å; L2016-I2020 WeakPolarHBondContact O-CG1 3.15Å; L2016-I2020 PolarHBondContact O-N 3.18Å; L2016-W2071 HydrophobicContact CB-CH2 4.37Å; L2016-L2092 HydrophobicContact CD1-CD2 4.42Å
2017	W	68.7	Low	48.9	Very low	39.75 Å²	39.75	86.2 Å²	86.2	15%	0.151	47%	0.465	C	S	.	.	H	α-helix	trans	-63.5	-40.9	176.1	-175	-113.2	0	0	0	112.6	L1806 F1987 N2013 E2014 Q2019 I2020 T2021 W2071 P2090	L1806-W2017 HydrophobicContact CB-CH2 3.65Å; L1806-W2017 HydrophobicContact CB-CZ2 3.78Å; L1806-W2017 HydrophobicContact CD2-CH2 4.13Å; F1987-W2017 HydrophobicContact CE2-CH2 4.26Å; F1987-W2017 AromaticContact CE2-CZ3 3.96Å; F1987-W2017 HydrophobicContact CE2-CZ3 4.13Å; F1987-W2017 AromaticContact CZ-CH2 3.99Å; F1987-W2017 HydrophobicContact CZ-CH2 4.15Å; F1987-W2017 HydrophobicContact CZ-CZ3 4.11Å; N2013-W2017 PolarHBondContact O-N 2.92Å; N2013-W2017 VanDerWaalsContact O-N 3.1Å; E2014-W2017 PolarHBondContact O-N 3.05Å; W2017-Q2019 VanDerWaalsContact C-N 3.26Å; W2017-Q2019 PolarHBondContact O-N 3.02Å; W2017-I2020 HydrophobicContact CE3-CB 4.32Å; W2017-I2020 HydrophobicContact CE3-CD1 4.24Å; W2017-I2020 HydrophobicContact CE3-CG2 4.23Å; W2017-I2020 HydrophobicContact CZ3-CD1 4.45Å; W2017-I2020 HydrophobicContact CZ3-CG2 4.14Å; W2017-I2020 WeakPolarHBondContact O-CB 3.33Å; W2017-I2020 PolarHBondContact O-N 3.15Å; W2017-I2020 VanDerWaalsContact O-N 3.16Å; W2017-T2021 HydrophobicContact CD2-CG2 4.19Å; W2017-T2021 VanDerWaalsContact CE2-CG2 3.49Å; W2017-T2021 HydrophobicContact CG-CG2 4.39Å; W2017-T2021 HydrophobicContact CH2-CG2 4.48Å; W2017-T2021 HydrophobicContact CZ2-CG2 3.93Å; W2017-T2021 WeakPolarHBondContact O-CB 3.22Å; W2017-T2021 WeakPolarHBondContact O-CG2 3.34Å; W2017-T2021 PolarHBondContact O-N 2.91Å; W2017-T2021 PolarHBondContact O-OG1 3.05Å; W2017-W2071 HydrophobicContact CB-CH2 4.44Å; W2017-W2071 HydrophobicContact CB-CZ3 4.35Å; W2017-W2071 HydrophobicContact CE3-CE3 4.4Å; W2017-W2071 HydrophobicContact CE3-CH2 4.34Å; W2017-W2071 HydrophobicContact CE3-CZ2 4.42Å; W2017-W2071 HydrophobicContact CE3-CZ3 4.34Å; W2017-P2090 HydrophobicContact CD2-CG 3.43Å; W2017-P2090 VanDerWaalsContact CD2-CG 3.42Å; W2017-P2090 VanDerWaalsContact CE2-CG 3.43Å; W2017-P2090 HydrophobicContact CE3-CG 3.55Å; W2017-P2090 VanDerWaalsContact CE3-CG 3.49Å; W2017-P2090 HydrophobicContact CG-CG 4.03Å; W2017-P2090 HydrophobicContact CH2-CG 3.86Å; W2017-P2090 HydrophobicContact CZ2-CG 3.74Å; W2017-P2090 HydrophobicContact CZ3-CG 3.76Å
2018	K	61.5	Low	49.4	Very low	99.75 Å²	99.75	83.3 Å²	83.3	43%	0.434	45%	0.45	S	S	.	.	H	α-helix	trans	-66.7	-24.9	174.4	-73.1	167.9	-179.1	169.8	0	112.5	E2014 K2015 L2016 T2021 K2022	E2014-K2018 HydrophobicContact CB-CD 4.43Å; E2014-K2018 WeakPolarHBondContact O-CB 3.3Å; E2014-K2018 WeakPolarHBondContact O-CD 3.31Å; E2014-K2018 WeakPolarHBondContact O-CG 3.41Å; E2014-K2018 PolarHBondContact O-N 3.02Å; E2014-K2018 WeakPolarHBondContact OE1-CE 3.42Å; E2014-K2018 IonicContact OE1-NZ 3.43Å; E2014-K2018 PolarHBondContact OE1-NZ 3.18Å; E2014-K2018 IonicContact OE2-NZ 2.96Å; E2014-K2018 PolarHBondContact OE2-NZ 3.17Å; K2015-K2018 CarbonylContact O-C 3.49Å; K2015-K2018 PolarHBondContact O-N 2.98Å; L2016-K2018 PolarHBondContact O-N 3.04Å; K2018-T2021 VanDerWaalsContact CA-OG1 3.29Å; K2018-T2021 WeakPolarHBondContact CA-OG1 3.35Å; K2018-T2021 PolarHBondContact O-OG1 2.92Å; K2018-K2022 WeakPolarHBondContact O-CB 3.39Å; K2018-K2022 VanDerWaalsContact O-CD 3.31Å; K2018-K2022 WeakPolarHBondContact O-CD 3.33Å; K2018-K2022 VanDerWaalsContact O-CG 3.22Å; K2018-K2022 WeakPolarHBondContact O-CG 3.29Å; K2018-K2022 PolarHBondContact O-N 3.09Å
2019	Q	58.7	Low	50.3	Low	94.5 Å²	94.5	81.8 Å²	81.8	44%	0.442	42%	0.423	S	S	.	.	H	α-helix	trans	-76.9	-46.5	169.2	-77.8	170.9	-8.2	0	0	110.9	F2000 K2015 L2016 W2017 T2021 K2022 L2023	F2000-Q2019 HydrophobicContact CE1-CB 4.37Å; F2000-Q2019 VanDerWaalsContact CE1-OE1 3.27Å; K2015-Q2019 WeakPolarHBondContact O-CB 3.35Å; K2015-Q2019 VanDerWaalsContact O-CG 3.27Å; K2015-Q2019 WeakPolarHBondContact O-CG 3.37Å; K2015-Q2019 PolarHBondContact O-N 3.01Å; L2016-Q2019 CarbonylContact O-C 3.43Å; L2016-Q2019 WeakPolarHBondContact O-CB 3.44Å; L2016-Q2019 PolarHBondContact O-N 3.35Å; L2016-Q2019 VanDerWaalsContact O-N 3.16Å; W2017-Q2019 VanDerWaalsContact C-N 3.26Å; W2017-Q2019 PolarHBondContact O-N 3.02Å; Q2019-T2021 VanDerWaalsContact C-N 3.31Å; Q2019-T2021 PolarHBondContact O-N 3.08Å; Q2019-K2022 PolarHBondContact O-N 2.91Å; Q2019-K2022 VanDerWaalsContact O-N 3.13Å; Q2019-L2023 WeakPolarHBondContact O-CB 3.27Å; Q2019-L2023 VanDerWaalsContact O-CD1 3.32Å; Q2019-L2023 WeakPolarHBondContact O-CD1 3.08Å; Q2019-L2023 VanDerWaalsContact O-CG 3.24Å; Q2019-L2023 WeakPolarHBondContact O-CG 3.35Å; Q2019-L2023 PolarHBondContact O-N 3.22Å
2020	I	60.2	Low	51.6	Low	15 Å²	15	80.3 Å²	80.3	8%	0.077	41%	0.408	C	S	.	.	H	α-helix	trans	-57.1	-45.4	176.8	-70.3	166.9	0	0	0	111.2	F2000 L2016 W2017 K2022 L2023 S2024 I2031 W2071	F2000-I2020 HydrophobicContact CZ-CG1 4.27Å; L2016-I2020 VanDerWaalsContact O-CG1 3.3Å; L2016-I2020 WeakPolarHBondContact O-CG1 3.15Å; L2016-I2020 PolarHBondContact O-N 3.18Å; W2017-I2020 HydrophobicContact CE3-CB 4.32Å; W2017-I2020 HydrophobicContact CE3-CD1 4.24Å; W2017-I2020 HydrophobicContact CE3-CG2 4.23Å; W2017-I2020 HydrophobicContact CZ3-CD1 4.45Å; W2017-I2020 HydrophobicContact CZ3-CG2 4.14Å; W2017-I2020 WeakPolarHBondContact O-CB 3.33Å; W2017-I2020 PolarHBondContact O-N 3.15Å; W2017-I2020 VanDerWaalsContact O-N 3.16Å; I2020-K2022 VanDerWaalsContact C-N 3.34Å; I2020-K2022 PolarHBondContact O-N 2.87Å; I2020-L2023 PolarHBondContact O-N 3.2Å; I2020-S2024 WeakPolarHBondContact O-CB 3.16Å; I2020-S2024 PolarHBondContact O-N 3.32Å; I2020-S2024 PolarHBondContact O-OG 2.92Å; I2020-I2031 HydrophobicContact CB-CD1 4.08Å; I2020-I2031 HydrophobicContact CG1-CD1 3.85Å; I2020-I2031 HydrophobicContact CG2-CD1 3.81Å; I2020-I2031 HydrophobicContact CG2-CG2 4.41Å; I2020-W2071 HydrophobicContact CD1-CH2 3.99Å; I2020-W2071 HydrophobicContact CD1-CZ2 3.62Å; I2020-W2071 VanDerWaalsContact CD1-CZ2 3.44Å
2021	T	58.2	Low	52.9	Low	54 Å²	54	76.5 Å²	76.5	33%	0.331	38%	0.382	S	S	.	.	H	α-helix	trans	-74.1	-25	179.1	49.8	0	0	0	0	113.8	W2017 K2018 Q2019 S2024 N2025	W2017-T2021 HydrophobicContact CD2-CG2 4.19Å; W2017-T2021 VanDerWaalsContact CE2-CG2 3.49Å; W2017-T2021 HydrophobicContact CG-CG2 4.39Å; W2017-T2021 HydrophobicContact CH2-CG2 4.48Å; W2017-T2021 HydrophobicContact CZ2-CG2 3.93Å; W2017-T2021 WeakPolarHBondContact O-CB 3.22Å; W2017-T2021 WeakPolarHBondContact O-CG2 3.34Å; W2017-T2021 PolarHBondContact O-N 2.91Å; W2017-T2021 PolarHBondContact O-OG1 3.05Å; K2018-T2021 VanDerWaalsContact CA-OG1 3.29Å; K2018-T2021 WeakPolarHBondContact CA-OG1 3.35Å; K2018-T2021 PolarHBondContact O-OG1 2.92Å; Q2019-T2021 VanDerWaalsContact C-N 3.31Å; Q2019-T2021 PolarHBondContact O-N 3.08Å; T2021-S2024 WeakPolarHBondContact CA-OG 3.3Å; T2021-S2024 WeakPolarHBondContact O-CB 3.14Å; T2021-S2024 PolarHBondContact O-N 3.08Å; T2021-S2024 PolarHBondContact O-OG 3.22Å; T2021-N2025 PolarHBondContact O-N 3.46Å; T2021-N2025 PolarHBondContact O-ND2 2.92Å
2022	K	53.2	Low	53.9	Low	148.75 Å²	148.75	73 Å²	73	65%	0.647	36%	0.364	S	S	*	.	H	α-helix	trans	-80.1	-27.2	172.2	-77.2	179.4	-179.6	-173.2	0	113	K2018 Q2019 I2020 S2024 N2025 I2026	K2018-K2022 WeakPolarHBondContact O-CB 3.39Å; K2018-K2022 VanDerWaalsContact O-CD 3.31Å; K2018-K2022 WeakPolarHBondContact O-CD 3.33Å; K2018-K2022 VanDerWaalsContact O-CG 3.22Å; K2018-K2022 WeakPolarHBondContact O-CG 3.29Å; K2018-K2022 PolarHBondContact O-N 3.09Å; Q2019-K2022 PolarHBondContact O-N 2.91Å; Q2019-K2022 VanDerWaalsContact O-N 3.13Å; I2020-K2022 VanDerWaalsContact C-N 3.34Å; I2020-K2022 PolarHBondContact O-N 2.87Å; K2022-S2024 VanDerWaalsContact C-N 3.31Å; K2022-S2024 PolarHBondContact O-N 3.21Å; K2022-N2025 PolarHBondContact O-N 2.97Å; K2022-N2025 VanDerWaalsContact O-N 3.11Å; K2022-I2026 WeakPolarHBondContact O-CG1 3.25Å; K2022-I2026 PolarHBondContact O-N 3.06Å
2023	L	46	Very low	55.4	Low	52.25 Å²	52.25	71 Å²	71	27%	0.274	36%	0.356	S	S	.	.	H	α-helix	trans	-70.7	-11.2	177.3	-72.1	165.7	0	0	0	111.9	F2000 Q2019 I2020 N2025 I2026 N2029 I2031	F2000-L2023 HydrophobicContact CZ-CD1 4.34Å; Q2019-L2023 WeakPolarHBondContact O-CB 3.27Å; Q2019-L2023 VanDerWaalsContact O-CD1 3.32Å; Q2019-L2023 WeakPolarHBondContact O-CD1 3.08Å; Q2019-L2023 VanDerWaalsContact O-CG 3.24Å; Q2019-L2023 WeakPolarHBondContact O-CG 3.35Å; Q2019-L2023 PolarHBondContact O-N 3.22Å; I2020-L2023 PolarHBondContact O-N 3.2Å; L2023-N2025 VanDerWaalsContact C-N 3.32Å; L2023-N2025 PolarHBondContact O-N 3.1Å; L2023-I2026 PolarHBondContact O-N 2.99Å; L2023-I2026 VanDerWaalsContact O-O 3.07Å; L2023-N2029 WeakPolarHBondContact CD1-O 3.28Å; L2023-N2029 HydrophobicContact CD2-CB 4.23Å; L2023-N2029 VanDerWaalsContact CD2-O 3.24Å; L2023-N2029 WeakPolarHBondContact CD2-O 3.44Å; L2023-I2031 HydrophobicContact CB-CD1 4.22Å; L2023-I2031 HydrophobicContact CD1-CD1 4.16Å; L2023-I2031 HydrophobicContact CD1-CG1 4.31Å
2024	S	42.2	Very low	56.7	Low	67.25 Å²	67.25	69.4 Å²	69.4	47%	0.47	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-15.8	173.2	67.9	0	0	0	0	114.2	I2020 T2021 K2022	I2020-S2024 WeakPolarHBondContact O-CB 3.16Å; I2020-S2024 PolarHBondContact O-N 3.32Å; I2020-S2024 PolarHBondContact O-OG 2.92Å; T2021-S2024 WeakPolarHBondContact CA-OG 3.3Å; T2021-S2024 WeakPolarHBondContact O-CB 3.14Å; T2021-S2024 PolarHBondContact O-N 3.08Å; T2021-S2024 PolarHBondContact O-OG 3.22Å; K2022-S2024 VanDerWaalsContact C-N 3.31Å; K2022-S2024 PolarHBondContact O-N 3.21Å
2025	N	37.8	Very low	57.7	Low	131 Å²	131	68.1 Å²	68.1	70%	0.701	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-8.2	-179.2	-85.8	-21.5	0	0	0	114.8	T2021 K2022 L2023	T2021-N2025 PolarHBondContact O-N 3.46Å; T2021-N2025 PolarHBondContact O-ND2 2.92Å; K2022-N2025 PolarHBondContact O-N 2.97Å; K2022-N2025 VanDerWaalsContact O-N 3.11Å; L2023-N2025 VanDerWaalsContact C-N 3.32Å; L2023-N2025 PolarHBondContact O-N 3.1Å
2026	I	37.3	Very low	58.8	Low	120.25 Å²	120.25	65.4 Å²	65.4	62%	0.617	33%	0.334	S	S	*	.	S	Bend	trans	-118.3	123.3	179.2	-56.8	173.4	0	0	0	108.9	K2022 L2023 S2028	K2022-I2026 WeakPolarHBondContact O-CG1 3.25Å; K2022-I2026 PolarHBondContact O-N 3.06Å; L2023-I2026 PolarHBondContact O-N 2.99Å; L2023-I2026 VanDerWaalsContact O-O 3.07Å; I2026-S2028 PolarHBondContact O-N 2.91Å
2027	N	38.5	Very low	59.6	Low	91.75 Å²	91.75	65.3 Å²	65.3	49%	0.491	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	7.6	-163.9	-72.4	-43.9	0	0	0	117.5	R1768 Q1821 K1896 V1897 P1898	R1768-N2027 HydrophobicContact CB-CB 3.69Å; R1768-N2027 PolarHBondContact N-ND2 3.27Å; Q1821-N2027 PolarHBondContact OE1-ND2 3.27Å; K1896-N2027 CarbonylContact C-O 3.52Å; K1896-N2027 HydrophobicContact CB-CB 3.93Å; K1896-N2027 HydrophobicContact CD-CB 4.48Å; K1896-N2027 WeakPolarHBondContact CD-OD1 2.92Å; V1897-N2027 CarbonylContact C-O 3.6Å; P1898-N2027 WeakPolarHBondContact CA-O 3.06Å; P1898-N2027 HydrophobicContact CB-CB 4.44Å; P1898-N2027 WeakPolarHBondContact CD-O 3.39Å
2028	S	40.6	Very low	59.8	Low	62.5 Å²	62.5	69.3 Å²	69.3	44%	0.437	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-33.2	-168.8	-118.4	0	0	0	0	116.6	P1898 I2026	P1898-S2028 WeakPolarHBondContact CB-OG 3.28Å; P1898-S2028 VanDerWaalsContact CG-CB 3.46Å; P1898-S2028 WeakPolarHBondContact CG-OG 3.4Å; I2026-S2028 PolarHBondContact O-N 2.91Å
2029	N	48.8	Very low	60.2	Low	48.25 Å²	48.25	67.8 Å²	67.8	26%	0.258	35%	0.349	S	S	.	.			trans	-127.6	94.5	-170.5	-79.2	-0.9	0	0	0	110.8	H1997 L2023	H1997-N2029 PolarHBondContact O-ND2 3.48Å; L2023-N2029 WeakPolarHBondContact CD1-O 3.28Å; L2023-N2029 HydrophobicContact CD2-CB 4.23Å; L2023-N2029 VanDerWaalsContact CD2-O 3.24Å; L2023-N2029 WeakPolarHBondContact CD2-O 3.44Å
2030	R	58.1	Low	60.8	Low	91.75 Å²	91.75	63.8 Å²	63.8	35%	0.346	33%	0.331	S	S	.	.			trans	-85.2	137.7	176.7	-63.7	-175.7	175.4	154.7	-6.2	110.9	V1771 L1888 H1894 Y1895 K1896 V1992	V1771-R2030 PolarHBondContact O-NH1 3.35Å; V1771-R2030 PolarHBondContact O-NH2 2.66Å; L1888-R2030 PolarHBondContact O-NH1 2.83Å; H1894-R2030 WeakPolarHBondContact O-CD 3.06Å; H1894-R2030 PolarHBondContact O-NE 3.45Å; H1894-R2030 PolarHBondContact O-NH1 2.94Å; H1894-R2030 PolarHBondContact O-NH2 2.93Å; Y1895-R2030 VanDerWaalsContact CA-CZ 3.46Å; Y1895-R2030 HydrophobicContact CD1-CB 4.24Å; Y1895-R2030 HydrophobicContact CD1-CG 3.92Å; Y1895-R2030 HydrophobicContact CE1-CB 3.53Å; Y1895-R2030 VanDerWaalsContact CE1-CD 3.49Å; Y1895-R2030 HydrophobicContact CE1-CG 3.72Å; K1896-R2030 VanDerWaalsContact N-CZ 3.27Å; K1896-R2030 PolarHBondContact O-NH1 3.22Å; V1992-R2030 HydrophobicContact CB-CB 4.13Å; V1992-R2030 VanDerWaalsContact CB-O 3.32Å; V1992-R2030 WeakPolarHBondContact CB-O 3.2Å; V1992-R2030 HydrophobicContact CG1-CB 4.35Å; V1992-R2030 PolarHBondContact N-O 2.86Å; V1992-R2030 VanDerWaalsContact N-O 3.11Å; V1992-R2030 VanDerWaalsContact O-O 3.07Å
2031	I	67.2	Low	61.4	Low	44.75 Å²	44.75	69 Å²	69	23%	0.229	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.1	176.4	-64.5	171.5	0	0	0	108.2	T1989 F1990 V1992 I2020 L2023	T1989-I2031 HydrophobicContact CG2-CG2 4.36Å; F1990-I2031 CarbonylContact O-C 3.51Å; F1990-I2031 WeakPolarHBondContact O-CA 3.22Å; V1992-I2031 VanDerWaalsContact CG2-C 3.49Å; I2020-I2031 HydrophobicContact CB-CD1 4.08Å; I2020-I2031 HydrophobicContact CG1-CD1 3.85Å; I2020-I2031 HydrophobicContact CG2-CD1 3.81Å; I2020-I2031 HydrophobicContact CG2-CG2 4.41Å; L2023-I2031 HydrophobicContact CB-CD1 4.22Å; L2023-I2031 HydrophobicContact CD1-CD1 4.16Å; L2023-I2031 HydrophobicContact CD1-CG1 4.31Å
2032	A	73	Confident	62.5	Low	0.25 Å²	0.25	70.2 Å²	70.2	0%	0.002	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	147.3	170.7	0	0	0	0	0	110.4	T1989 F1990 V1992 Y2047 R2049	T1989-A2032 WeakPolarHBondContact CA-O 3.35Å; T1989-A2032 VanDerWaalsContact CB-O 3.31Å; T1989-A2032 WeakPolarHBondContact CB-O 3.19Å; F1990-A2032 HydrophobicContact CD1-CB 3.84Å; F1990-A2032 HydrophobicContact CD2-CB 3.82Å; F1990-A2032 HydrophobicContact CE1-CB 3.54Å; F1990-A2032 VanDerWaalsContact CE1-CB 3.46Å; F1990-A2032 HydrophobicContact CE2-CB 3.51Å; F1990-A2032 VanDerWaalsContact CE2-CB 3.47Å; F1990-A2032 HydrophobicContact CG-CB 3.99Å; F1990-A2032 HydrophobicContact CZ-CB 3.38Å; F1990-A2032 PolarHBondContact N-O 3.06Å; F1990-A2032 VanDerWaalsContact N-O 3.16Å; F1990-A2032 WeakPolarHBondContact O-CB 3.21Å; F1990-A2032 PolarHBondContact O-N 3.03Å; V1992-A2032 HydrophobicContact CG2-CB 3.52Å; V1992-A2032 VanDerWaalsContact CG2-CB 3.45Å; V1992-A2032 VanDerWaalsContact CG2-N 3.32Å; A2032-Y2047 HydrophobicContact CB-CE1 4.47Å; A2032-R2049 VanDerWaalsContact CA-NH1 3.32Å
2033	L	79.7	Confident	64	Low	56.25 Å²	56.25	63.1 Å²	63.1	30%	0.295	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	131.8	172.6	-110.3	89.6	0	0	0	107.9	L1806 G1808 F1987 V1988 T1989 Y2047	L1806-L2033 HydrophobicContact CB-CD2 3.98Å; L1806-L2033 HydrophobicContact CD2-CD2 3.93Å; L1806-L2033 HydrophobicContact CG-CD2 3.87Å; G1808-L2033 VanDerWaalsContact CA-CD2 3.44Å; F1987-L2033 HydrophobicContact CB-CD1 3.95Å; F1987-L2033 HydrophobicContact CD2-CD1 3.65Å; F1987-L2033 HydrophobicContact CD2-CD2 4.2Å; F1987-L2033 HydrophobicContact CD2-CG 3.83Å; F1987-L2033 HydrophobicContact CE2-CD1 3.84Å; F1987-L2033 HydrophobicContact CE2-CD2 4.21Å; F1987-L2033 HydrophobicContact CE2-CG 4.19Å; F1987-L2033 HydrophobicContact CG-CD1 3.7Å; F1987-L2033 HydrophobicContact CG-CD2 4.45Å; V1988-L2033 WeakPolarHBondContact O-CA 3.34Å; T1989-L2033 HydrophobicContact CG2-CB 4.4Å; T1989-L2033 HydrophobicContact CG2-CD1 3.6Å; T1989-L2033 VanDerWaalsContact CG2-CD1 3.45Å; T1989-L2033 HydrophobicContact CG2-CD2 3.94Å; T1989-L2033 HydrophobicContact CG2-CG 3.85Å; L2033-Y2047 VanDerWaalsContact O-CE2 3.28Å; L2033-Y2047 WeakPolarHBondContact O-CE2 3.44Å; L2033-Y2047 PolarHBondContact O-OH 3.1Å
2034	T	81.6	Confident	65.9	Low	3.75 Å²	3.75	63.7 Å²	63.7	2%	0.023	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-77.6	159.3	167.6	63.5	0	0	0	0	110.3	V1935 F1987 V1988 W2045 Y2047	V1935-T2034 HydrophobicContact CB-CG2 4.27Å; V1935-T2034 HydrophobicContact CG1-CG2 4.16Å; V1935-T2034 HydrophobicContact CG2-CG2 4.41Å; F1987-T2034 WeakPolarHBondContact CA-OG1 3.22Å; V1988-T2034 WeakPolarHBondContact CA-OG1 3.28Å; V1988-T2034 HydrophobicContact CB-CG2 3.87Å; V1988-T2034 WeakPolarHBondContact CB-OG1 3.39Å; V1988-T2034 HydrophobicContact CG2-CG2 4.47Å; V1988-T2034 PolarHBondContact N-OG1 3.2Å; V1988-T2034 PolarHBondContact O-N 2.98Å; V1988-T2034 PolarHBondContact O-OG1 2.93Å; V1988-T2034 VanDerWaalsContact O-OG1 3.06Å; T2034-W2045 HydrophobicContact CG2-CG 4.42Å; T2034-W2045 PolarHBondContact OG1-NE1 3.07Å; T2034-Y2047 HydrophobicContact CG2-CD1 3.79Å; T2034-Y2047 HydrophobicContact CG2-CD2 4.4Å; T2034-Y2047 HydrophobicContact CG2-CE1 4.39Å; T2034-Y2047 HydrophobicContact CG2-CG 3.77Å
2035	P	79.2	Confident	68	Low	43.75 Å²	43.75	61.3 Å²	61.3	28%	0.284	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-57.1	149.3	169.5	-9.7	16.3	0	0	0	111.2	P1810 V2037 W2045	P1810-P2035 HydrophobicContact CB-CB 4.07Å; P1810-P2035 HydrophobicContact CB-CG 4.31Å; P2035-V2037 PolarHBondContact O-N 3.37Å; P2035-W2045 PolarHBondContact O-NE1 3.14Å; P2035-W2045 VanDerWaalsContact O-NE1 3.07Å
2036	K	81.7	Confident	70.1	Confident	77.25 Å²	77.25	59.2 Å²	59.2	34%	0.336	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-76.8	129.7	174.7	-59.4	-172.6	-163.9	-179.3	0	109.6	C1805 L1806 V1986 F1987 M2073	C1805-K2036 PolarHBondContact SG-NZ 3.36Å; L1806-K2036 WeakPolarHBondContact O-CE 3.48Å; V1986-K2036 CarbonylContact O-C 3.5Å; V1986-K2036 WeakPolarHBondContact O-CA 2.96Å; F1987-K2036 HydrophobicContact CB-CB 4.29Å; F1987-K2036 HydrophobicContact CB-CG 4.21Å; F1987-K2036 HydrophobicContact CD1-CD 4.06Å; F1987-K2036 HydrophobicContact CD1-CG 3.97Å; F1987-K2036 HydrophobicContact CE1-CD 4.13Å; F1987-K2036 HydrophobicContact CG-CD 4.36Å; F1987-K2036 HydrophobicContact CG-CG 4.33Å; K2036-M2073 HydrophobicContact CD-SD 4.41Å; K2036-M2073 PolarHBondContact NZ-SD 3.2Å
2037	V	80.3	Confident	72.2	Confident	28 Å²	28	54.9 Å²	54.9	17%	0.17	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.6	-178.7	174.1	0	0	0	0	109	S1985 V1986 P2035 A2043 H2044 W2045	S1985-V2037 CarbonylContact C-O 3.53Å; S1985-V2037 VanDerWaalsContact CA-O 3.32Å; S1985-V2037 WeakPolarHBondContact CA-O 3.36Å; V1986-V2037 PolarHBondContact N-O 2.89Å; V1986-V2037 PolarHBondContact O-N 3.15Å; P2035-V2037 PolarHBondContact O-N 3.37Å; V2037-A2043 HydrophobicContact CB-CB 4.42Å; V2037-A2043 HydrophobicContact CG1-CB 4.29Å; V2037-H2044 WeakPolarHBondContact CG2-O 3.32Å; V2037-W2045 HydrophobicContact CG2-CG 4.2Å
2038	K	72.7	Confident	74.2	Confident	125 Å²	125	52.9 Å²	52.9	54%	0.543	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	145.2	171.5	-61.8	-167.7	177.4	-164.4	0	109.3	H2075	K2038-H2075 WeakPolarHBondContact CE-NE2 3.41Å
2039	N	69.9	Low	75.8	Confident	66.75 Å²	66.75	52 Å²	52	36%	0.357	25%	0.25	S	C	.	.			trans	95.2	119.8	-172.3	-167.7	-3.9	0	0	0	114	Y1984 E2041 Y2042	Y1984-N2039 PolarHBondContact O-N 3.25Å; N2039-E2041 PolarHBondContact OD1-N 3.05Å; N2039-Y2042 WeakPolarHBondContact CB-O 3.32Å; N2039-Y2042 PolarHBondContact ND2-N 2.8Å; N2039-Y2042 PolarHBondContact ND2-O 2.88Å; N2039-Y2042 PolarHBondContact OD1-N 2.81Å
2040	L	70.9	Confident	77.1	Confident	11 Å²	11	51.5 Å²	51.5	6%	0.058	25%	0.245	C	C	.	.	S	Bend	trans	-81.3	-37.8	176.3	-137.2	108.7	0	0	0	112.4	L1941 L1943 Y1984 V1986 Y2042 A2072 I2093	L1941-L2040 HydrophobicContact CB-CD2 4.43Å; L1941-L2040 HydrophobicContact CB-CG 4.34Å; L1941-L2040 VanDerWaalsContact CB-O 3.25Å; L1941-L2040 WeakPolarHBondContact CB-O 3.38Å; L1941-L2040 PolarHBondContact N-O 3.03Å; L1941-L2040 VanDerWaalsContact O-CD2 3.27Å; L1941-L2040 WeakPolarHBondContact O-CD2 3.43Å; L1941-L2040 WeakPolarHBondContact O-CG 3.4Å; L1943-L2040 HydrophobicContact CB-CD2 4.43Å; L1943-L2040 HydrophobicContact CD1-CD1 3.94Å; L1943-L2040 HydrophobicContact CD1-CD2 4.01Å; L1943-L2040 HydrophobicContact CD2-CD1 4.5Å; L1943-L2040 HydrophobicContact CG-CD1 4.05Å; L1943-L2040 HydrophobicContact CG-CD2 3.88Å; Y1984-L2040 HydrophobicContact CD2-CD1 4.02Å; Y1984-L2040 HydrophobicContact CG-CD1 4.03Å; V1986-L2040 HydrophobicContact CG2-CD1 3.91Å; V1986-L2040 HydrophobicContact CG2-CD2 3.85Å; V1986-L2040 HydrophobicContact CG2-CG 4.27Å; L2040-Y2042 VanDerWaalsContact C-N 3.31Å; L2040-Y2042 PolarHBondContact O-N 2.91Å; L2040-A2072 HydrophobicContact CD1-CB 4.2Å; L2040-A2072 HydrophobicContact CD2-CB 4.39Å; L2040-I2093 HydrophobicContact CD1-CD1 4.04Å; L2040-I2093 HydrophobicContact CD2-CD1 3.97Å
2041	E	72.1	Confident	77.8	Confident	125.5 Å²	125.5	47.4 Å²	47.4	59%	0.586	23%	0.231	S	C	*	.	S	Bend	trans	-74.3	-31.1	-174	-60.9	-172.6	165.6	0	0	113	Y1939 H1940 N2039	Y1939-E2041 CarbonylContact C-O 3.55Å; Y1939-E2041 WeakPolarHBondContact CA-O 3.4Å; H1940-E2041 PolarHBondContact N-O 3.09Å; N2039-E2041 PolarHBondContact OD1-N 3.05Å
2042	Y	82.8	Confident	78	Confident	77.5 Å²	77.5	50.6 Å²	50.6	30%	0.304	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	109.7	176.6	176.5	-122.7	0	0	0	111	K1937 Y1939 N2039 L2040 H2044	K1937-Y2042 HydrophobicContact CB-CE2 4.3Å; K1937-Y2042 HydrophobicContact CD-CE2 4.17Å; Y1939-Y2042 AromaticContact CD1-CD2 3.47Å; Y1939-Y2042 HydrophobicContact CD1-CD2 3.47Å; Y1939-Y2042 VanDerWaalsContact CD1-CD2 3.46Å; Y1939-Y2042 HydrophobicContact CD1-CE2 4.13Å; Y1939-Y2042 HydrophobicContact CD1-CG 4.32Å; Y1939-Y2042 AromaticContact CE1-CD2 3.08Å; Y1939-Y2042 HydrophobicContact CE1-CD2 3.08Å; Y1939-Y2042 AromaticContact CE1-CE2 3.35Å; Y1939-Y2042 HydrophobicContact CE1-CE2 3.35Å; Y1939-Y2042 VanDerWaalsContact CE1-CE2 3.43Å; Y1939-Y2042 AromaticContact CE1-CG 3.96Å; Y1939-Y2042 HydrophobicContact CE1-CG 4Å; Y1939-Y2042 HydrophobicContact CE2-CE2 4.49Å; Y1939-Y2042 HydrophobicContact CG-CD2 4.47Å; Y1939-Y2042 AromaticContact CZ-CD2 3.76Å; Y1939-Y2042 AromaticContact CZ-CE2 3.68Å; Y1939-Y2042 VanDerWaalsContact CZ-CE2 3.47Å; Y1939-Y2042 VanDerWaalsContact OH-CE2 3.31Å; Y1939-Y2042 WeakPolarHBondContact OH-CE2 3.22Å; N2039-Y2042 WeakPolarHBondContact CB-O 3.32Å; N2039-Y2042 PolarHBondContact ND2-N 2.8Å; N2039-Y2042 PolarHBondContact ND2-O 2.88Å; N2039-Y2042 PolarHBondContact OD1-N 2.81Å; L2040-Y2042 VanDerWaalsContact C-N 3.31Å; L2040-Y2042 PolarHBondContact O-N 2.91Å; Y2042-H2044 HydrophobicContact CE1-CB 4.24Å; Y2042-H2044 HydrophobicContact CE2-CB 4.22Å; Y2042-H2044 AromaticContact CZ-ND1 3.88Å; Y2042-H2044 PolarHBondContact OH-ND1 2.88Å
2043	A	84.1	Confident	78.1	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	131.9	174	0	0	0	0	0	109.9	K1937 A1938 L1941 V1986 V2037 W2045	K1937-A2043 CarbonylContact C-O 3.5Å; K1937-A2043 WeakPolarHBondContact CA-O 3.26Å; K1937-A2043 VanDerWaalsContact CB-O 3.29Å; K1937-A2043 WeakPolarHBondContact CB-O 3.39Å; A1938-A2043 HydrophobicContact CB-CB 4.48Å; A1938-A2043 PolarHBondContact N-O 3.11Å; A1938-A2043 PolarHBondContact O-N 3.24Å; A1938-A2043 VanDerWaalsContact O-N 3.11Å; L1941-A2043 HydrophobicContact CD1-CB 4.5Å; V1986-A2043 HydrophobicContact CB-CB 4.41Å; V2037-A2043 HydrophobicContact CB-CB 4.42Å; V2037-A2043 HydrophobicContact CG1-CB 4.29Å; A2043-W2045 HydrophobicContact CB-CH2 3.56Å; A2043-W2045 VanDerWaalsContact CB-CH2 3.48Å; A2043-W2045 HydrophobicContact CB-CZ2 3.55Å; A2043-W2045 HydrophobicContact CB-CZ3 4.11Å
2044	H	86.6	Confident	77.9	Confident	66 Å²	66	48.4 Å²	48.4	31%	0.306	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	115	-179.4	-169.7	101.3	0	0	0	109.5	E1936 K1937 V2037 Y2042 N2046	E1936-H2044 PolarHBondContact O-CD2 3.21Å; E1936-H2044 VanDerWaalsContact O-CD2 3.24Å; E1936-H2044 PolarHBondContact O-ND1 3.06Å; K1937-H2044 HydrophobicContact CB-CB 4.46Å; V2037-H2044 WeakPolarHBondContact CG2-O 3.32Å; Y2042-H2044 HydrophobicContact CE1-CB 4.24Å; Y2042-H2044 HydrophobicContact CE2-CB 4.22Å; Y2042-H2044 AromaticContact CZ-ND1 3.88Å; Y2042-H2044 PolarHBondContact OH-ND1 2.88Å; H2044-N2046 PolarHBondContact CD2-OD1 3.33Å; H2044-N2046 PolarHBondContact CE1-ND2 3.12Å; H2044-N2046 PolarHBondContact CE1-OD1 3.15Å; H2044-N2046 PolarHBondContact ND1-OD1 2.71Å; H2044-N2046 VanDerWaalsContact NE2-CG 3.29Å; H2044-N2046 PolarHBondContact NE2-ND2 2.83Å; H2044-N2046 VanDerWaalsContact NE2-ND2 3.13Å; H2044-N2046 PolarHBondContact NE2-OD1 3.25Å
2045	W	84.7	Confident	77.5	Confident	16.75 Å²	16.75	49.9 Å²	49.9	6%	0.063	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	-36.5	-175.1	-63	-75.8	0	0	0	113.6	V1935 E1936 A1938 V1986 V1988 T2034 P2035 V2037 A2043 Y2047 I2139	V1935-W2045 HydrophobicContact CG1-CE3 3.95Å; V1935-W2045 HydrophobicContact CG1-CZ3 4.38Å; E1936-W2045 PolarHBondContact O-N 2.98Å; A1938-W2045 HydrophobicContact CB-CH2 3.82Å; A1938-W2045 HydrophobicContact CB-CZ3 3.66Å; V1986-W2045 HydrophobicContact CB-CZ2 4.2Å; V1986-W2045 HydrophobicContact CG1-CH2 4.19Å; V1986-W2045 HydrophobicContact CG1-CZ2 3.8Å; V1986-W2045 PolarHBondContact O-NE1 2.89Å; V1986-W2045 VanDerWaalsContact O-NE1 3.13Å; V1988-W2045 HydrophobicContact CG2-CD2 4.43Å; V1988-W2045 HydrophobicContact CG2-CE3 4.3Å; V1988-W2045 HydrophobicContact CG2-CH2 3.54Å; V1988-W2045 HydrophobicContact CG2-CZ2 3.72Å; V1988-W2045 HydrophobicContact CG2-CZ3 3.85Å; T2034-W2045 HydrophobicContact CG2-CG 4.42Å; T2034-W2045 PolarHBondContact OG1-NE1 3.07Å; P2035-W2045 PolarHBondContact O-NE1 3.14Å; P2035-W2045 VanDerWaalsContact O-NE1 3.07Å; V2037-W2045 HydrophobicContact CG2-CG 4.2Å; A2043-W2045 HydrophobicContact CB-CH2 3.56Å; A2043-W2045 VanDerWaalsContact CB-CH2 3.48Å; A2043-W2045 HydrophobicContact CB-CZ2 3.55Å; A2043-W2045 HydrophobicContact CB-CZ3 4.11Å; W2045-Y2047 PolarHBondContact O-N 3.26Å; W2045-I2139 HydrophobicContact CZ3-CD1 4.04Å; W2045-I2139 HydrophobicContact CZ3-CG1 4.37Å
2046	N	82.5	Confident	77.3	Confident	86.75 Å²	86.75	51.5 Å²	51.5	46%	0.464	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	47.7	36.3	-168.4	-68.8	-29.3	0	0	0	113.4	V1935 E1936 H2044 C2048	V1935-N2046 PolarHBondContact O-N 2.87Å; E1936-N2046 VanDerWaalsContact CG-OD1 3.26Å; E1936-N2046 WeakPolarHBondContact CG-OD1 3.35Å; E1936-N2046 PolarHBondContact O-N 2.92Å; E1936-N2046 VanDerWaalsContact O-N 3.09Å; H2044-N2046 PolarHBondContact CD2-OD1 3.33Å; H2044-N2046 PolarHBondContact CE1-ND2 3.12Å; H2044-N2046 PolarHBondContact CE1-OD1 3.15Å; H2044-N2046 PolarHBondContact ND1-OD1 2.71Å; H2044-N2046 VanDerWaalsContact NE2-CG 3.29Å; H2044-N2046 PolarHBondContact NE2-ND2 2.83Å; H2044-N2046 VanDerWaalsContact NE2-ND2 3.13Å; H2044-N2046 PolarHBondContact NE2-OD1 3.25Å; N2046-C2048 PolarHBondContact O-N 2.95Å
2047	Y	81.5	Confident	77.1	Confident	28.75 Å²	28.75	48.1 Å²	48.1	11%	0.113	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	129.3	-173.9	-175.1	-101.1	0	0	0	110.7	D1809 I1934 V1935 F1990 A2032 L2033 T2034 W2045 R2049	D1809-Y2047 WeakPolarHBondContact O-CE2 3.41Å; I1934-Y2047 CarbonylContact C-O 3.54Å; I1934-Y2047 WeakPolarHBondContact CA-O 3.31Å; V1935-Y2047 HydrophobicContact CB-CD1 4.49Å; V1935-Y2047 PolarHBondContact N-O 2.88Å; V1935-Y2047 PolarHBondContact O-N 2.98Å; F1990-Y2047 HydrophobicContact CE1-CD1 4.18Å; F1990-Y2047 AromaticContact CE1-CE1 3.8Å; F1990-Y2047 HydrophobicContact CE1-CE1 3.86Å; F1990-Y2047 HydrophobicContact CZ-CD1 4.37Å; F1990-Y2047 AromaticContact CZ-CE1 3.84Å; F1990-Y2047 HydrophobicContact CZ-CE1 3.84Å; A2032-Y2047 HydrophobicContact CB-CE1 4.47Å; L2033-Y2047 VanDerWaalsContact O-CE2 3.28Å; L2033-Y2047 WeakPolarHBondContact O-CE2 3.44Å; L2033-Y2047 PolarHBondContact O-OH 3.1Å; T2034-Y2047 HydrophobicContact CG2-CD1 3.79Å; T2034-Y2047 HydrophobicContact CG2-CD2 4.4Å; T2034-Y2047 HydrophobicContact CG2-CE1 4.39Å; T2034-Y2047 HydrophobicContact CG2-CG 3.77Å; W2045-Y2047 PolarHBondContact O-N 3.26Å; Y2047-R2049 HydrophobicContact CD1-CB 4.48Å; Y2047-R2049 HydrophobicContact CE1-CB 3.75Å; Y2047-R2049 HydrophobicContact CE1-CG 4.48Å; Y2047-R2049 WeakPolarHBondContact OH-CD 3.36Å; Y2047-R2049 PolarHBondContact OH-NH1 3.27Å; Y2047-R2049 VanDerWaalsContact OH-NH1 3.1Å
2048	C	80.5	Confident	76.9	Confident	50.5 Å²	50.5	47 Å²	47	34%	0.341	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.9	174.7	-174.3	0	0	0	0	110.4	K1875 E1932 I1933 N2046	K1875-C2048 PolarHBondContact NZ-SG 2.9Å; E1932-C2048 VanDerWaalsContact CD-SG 3.55Å; E1932-C2048 VanDerWaalsContact CG-SG 3.52Å; E1932-C2048 WeakPolarHBondContact CG-SG 3.25Å; E1932-C2048 PolarHBondContact OE1-SG 3.22Å; I1933-C2048 CarbonylContact O-C 3.55Å; I1933-C2048 WeakPolarHBondContact O-CA 3.43Å; N2046-C2048 PolarHBondContact O-N 2.95Å
2049	R	74.9	Confident	76.7	Confident	44.5 Å²	44.5	44.9 Å²	44.9	17%	0.168	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	131.1	179.6	-166.6	-177.9	-172.2	133.4	-7.9	112.1	W1890 Y1895 I1933 F1990 A2032 Y2047 V2051	W1890-R2049 HydrophobicContact CH2-CG 4.05Å; W1890-R2049 HydrophobicContact CZ3-CG 4.23Å; Y1895-R2049 PolarHBondContact OH-NH2 2.72Å; I1933-R2049 PolarHBondContact N-O 3.04Å; I1933-R2049 PolarHBondContact O-N 2.95Å; F1990-R2049 HydrophobicContact CE2-CB 4.43Å; F1990-R2049 HydrophobicContact CZ-CB 4.17Å; A2032-R2049 VanDerWaalsContact CA-NH1 3.32Å; Y2047-R2049 HydrophobicContact CD1-CB 4.48Å; Y2047-R2049 HydrophobicContact CE1-CB 3.75Å; Y2047-R2049 HydrophobicContact CE1-CG 4.48Å; Y2047-R2049 WeakPolarHBondContact OH-CD 3.36Å; Y2047-R2049 PolarHBondContact OH-NH1 3.27Å; Y2047-R2049 VanDerWaalsContact OH-NH1 3.1Å; R2049-V2051 HydrophobicContact CB-CG1 4.44Å; R2049-V2051 HydrophobicContact CG-CG1 4.18Å
2050	F	74.9	Confident	76.4	Confident	36 Å²	36	46.7 Å²	46.7	16%	0.158	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	130.9	170	-58.2	-83	0	0	0	111.2	P1774 R1814 Y1839 K1878 L1892 A1931 E1932 L2146	P1774-F2050 HydrophobicContact CG-CB 4.13Å; P1774-F2050 HydrophobicContact CG-CD2 4.47Å; R1814-F2050 PolarHBondContact NH2-O 2.96Å; Y1839-F2050 HydrophobicContact CE2-CB 4.21Å; Y1839-F2050 HydrophobicContact CE2-CD2 4.21Å; Y1839-F2050 HydrophobicContact CE2-CG 4.08Å; Y1839-F2050 WeakPolarHBondContact OH-CB 3.48Å; K1878-F2050 HydrophobicContact CB-CB 4.05Å; K1878-F2050 HydrophobicContact CB-CD1 4.04Å; K1878-F2050 HydrophobicContact CB-CD2 3.52Å; K1878-F2050 HydrophobicContact CB-CE1 4.36Å; K1878-F2050 HydrophobicContact CB-CE2 3.86Å; K1878-F2050 HydrophobicContact CB-CG 3.62Å; K1878-F2050 HydrophobicContact CB-CZ 4.28Å; K1878-F2050 HydrophobicContact CD-CB 3.99Å; K1878-F2050 HydrophobicContact CD-CD2 4.31Å; K1878-F2050 HydrophobicContact CD-CG 4.4Å; K1878-F2050 HydrophobicContact CG-CD2 4.04Å; K1878-F2050 HydrophobicContact CG-CG 4.39Å; K1878-F2050 PolarHBondContact NZ-O 3.03Å; L1892-F2050 HydrophobicContact CD2-CB 3.6Å; A1931-F2050 CarbonylContact O-C 3.53Å; A1931-F2050 WeakPolarHBondContact O-CA 3.36Å; E1932-F2050 HydrophobicContact CB-CD1 4.05Å; E1932-F2050 HydrophobicContact CB-CE1 3.84Å; E1932-F2050 HydrophobicContact CG-CD1 4.16Å; E1932-F2050 HydrophobicContact CG-CE1 3.8Å; E1932-F2050 HydrophobicContact CG-CZ 4.42Å; F2050-L2146 HydrophobicContact CD1-CD1 3.71Å; F2050-L2146 HydrophobicContact CE1-CD1 4.11Å
2051	V	73.2	Confident	75.8	Confident	7.25 Å²	7.25	50.7 Å²	50.7	4%	0.044	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	169.5	-173.9	-57.7	0	0	0	0	111.5	P1930 A1931 I1933 F1990 V1992 R2049 I2053	P1930-V2051 WeakPolarHBondContact CA-O 3.42Å; A1931-V2051 HydrophobicContact CB-CG2 4.36Å; A1931-V2051 PolarHBondContact N-O 3.18Å; A1931-V2051 WeakPolarHBondContact O-CG2 3.48Å; A1931-V2051 PolarHBondContact O-N 3.04Å; I1933-V2051 HydrophobicContact CD1-CB 4.37Å; I1933-V2051 HydrophobicContact CD1-CG1 4.06Å; I1933-V2051 HydrophobicContact CD1-CG2 3.43Å; I1933-V2051 VanDerWaalsContact CD1-CG2 3.45Å; I1933-V2051 HydrophobicContact CG1-CG1 4.44Å; I1933-V2051 HydrophobicContact CG1-CG2 3.83Å; F1990-V2051 HydrophobicContact CE2-CG1 4.14Å; V1992-V2051 HydrophobicContact CB-CG1 4.35Å; V1992-V2051 HydrophobicContact CG1-CB 4.05Å; V1992-V2051 HydrophobicContact CG1-CG1 3.9Å; V1992-V2051 VanDerWaalsContact CG1-CG1 3.48Å; V1992-V2051 HydrophobicContact CG2-CG1 4.21Å; V1992-V2051 WeakPolarHBondContact O-CB 3.42Å; R2049-V2051 HydrophobicContact CB-CG1 4.44Å; R2049-V2051 HydrophobicContact CG-CG1 4.18Å; V2051-I2053 HydrophobicContact CG2-CD1 4.08Å; V2051-I2053 HydrophobicContact CG2-CG1 3.64Å
2052	R	71.3	Confident	75.2	Confident	111.25 Å²	111.25	45.9 Å²	45.9	42%	0.42	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	121.9	163	-73.9	-174.6	124.2	-169.3	4.3	109.7	T1928 F1929 V1992 N1993 G1994	T1928-R2052 PolarHBondContact O-NE 2.8Å; T1928-R2052 PolarHBondContact O-NH2 2.65Å; T1928-R2052 VanDerWaalsContact OG1-CZ 3.31Å; T1928-R2052 PolarHBondContact OG1-NE 3.34Å; T1928-R2052 VanDerWaalsContact OG1-NE 3.11Å; T1928-R2052 PolarHBondContact OG1-NH2 3.4Å; F1929-R2052 CarbonylContact O-C 3.55Å; F1929-R2052 VanDerWaalsContact O-CA 3.3Å; F1929-R2052 WeakPolarHBondContact O-CA 3.37Å; V1992-R2052 PolarHBondContact O-N 3.08Å; N1993-R2052 WeakPolarHBondContact CA-O 3.36Å; N1993-R2052 PolarHBondContact N-O 3.19Å; G1994-R2052 PolarHBondContact N-O 2.89Å
2053	I	75.6	Confident	74.1	Confident	3.75 Å²	3.75	47.6 Å²	47.6	2%	0.019	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	135.9	-178.3	-55.8	-177.1	0	0	0	108.6	T1928 F1929 A1931 I1933 V2051 L2057 L2066 L2100 V2143	T1928-I2053 CarbonylContact C-O 3.56Å; T1928-I2053 VanDerWaalsContact CA-O 3.23Å; T1928-I2053 WeakPolarHBondContact CA-O 3.24Å; T1928-I2053 WeakPolarHBondContact CB-O 3.3Å; F1929-I2053 HydrophobicContact CD1-CB 4.14Å; F1929-I2053 HydrophobicContact CD1-CG2 4.46Å; F1929-I2053 VanDerWaalsContact CD1-O 3.25Å; F1929-I2053 WeakPolarHBondContact CD1-O 3.29Å; F1929-I2053 HydrophobicContact CE1-CB 3.51Å; F1929-I2053 VanDerWaalsContact CE1-CB 3.49Å; F1929-I2053 HydrophobicContact CE1-CG2 3.56Å; F1929-I2053 VanDerWaalsContact CE1-CG2 3.49Å; F1929-I2053 WeakPolarHBondContact CE1-O 3.34Å; F1929-I2053 HydrophobicContact CE2-CB 4.24Å; F1929-I2053 HydrophobicContact CE2-CD1 4.33Å; F1929-I2053 HydrophobicContact CZ-CB 3.59Å; F1929-I2053 HydrophobicContact CZ-CD1 4.02Å; F1929-I2053 HydrophobicContact CZ-CG1 4.28Å; F1929-I2053 HydrophobicContact CZ-CG2 3.71Å; F1929-I2053 PolarHBondContact N-O 3.19Å; F1929-I2053 PolarHBondContact O-N 3.1Å; A1931-I2053 HydrophobicContact CB-CD1 3.53Å; A1931-I2053 VanDerWaalsContact CB-CD1 3.49Å; A1931-I2053 HydrophobicContact CB-CG1 3.98Å; I1933-I2053 HydrophobicContact CD1-CD1 4.37Å; I1933-I2053 HydrophobicContact CG1-CD1 4.46Å; V2051-I2053 HydrophobicContact CG2-CD1 4.08Å; V2051-I2053 HydrophobicContact CG2-CG1 3.64Å; I2053-L2057 HydrophobicContact CG2-CB 4.4Å; I2053-L2057 HydrophobicContact CG2-CD1 3.71Å; I2053-L2066 HydrophobicContact CD1-CD2 4.26Å; I2053-L2100 HydrophobicContact CD1-CD1 4.24Å; I2053-L2100 HydrophobicContact CG2-CD1 3.68Å; I2053-V2143 HydrophobicContact CD1-CG1 3.79Å
2054	P	74.3	Confident	73.3	Confident	6.75 Å²	6.75	51.5 Å²	51.5	4%	0.044	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	137.6	171.5	-20	27.7	0	0	0	112.8	E1927 T1928 Y1998 E2056 L2057	E1927-P2054 CarbonylContact O-C 3.57Å; E1927-P2054 WeakPolarHBondContact O-CA 3.38Å; T1928-P2054 HydrophobicContact CG2-CB 4.47Å; T1928-P2054 HydrophobicContact CG2-CG 4.42Å; Y1998-P2054 HydrophobicContact CD2-CG 4.11Å; Y1998-P2054 HydrophobicContact CE1-CG 4.42Å; Y1998-P2054 HydrophobicContact CE2-CB 4.34Å; Y1998-P2054 HydrophobicContact CE2-CG 3.35Å; Y1998-P2054 WeakPolarHBondContact OH-CB 3.28Å; Y1998-P2054 WeakPolarHBondContact OH-CD 3.44Å; Y1998-P2054 WeakPolarHBondContact OH-CG 3.28Å; P2054-E2056 HydrophobicContact CB-CB 4.33Å; P2054-E2056 HydrophobicContact CB-CG 4.48Å; P2054-E2056 PolarHBondContact O-N 2.86Å; P2054-L2057 HydrophobicContact CB-CG 4.48Å; P2054-L2057 HydrophobicContact CG-CD1 4.41Å; P2054-L2057 PolarHBondContact O-N 3.25Å; P2054-L2057 VanDerWaalsContact O-N 3.13Å
2055	L	74.3	Confident	72.8	Confident	34 Å²	34	49.2 Å²	49.2	18%	0.178	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-63.3	-26.3	173.7	-165.1	69.5	0	0	0	111.7	E1927 F1929 L2057 I2058 Q2059 F2107	E1927-L2055 HydrophobicContact CB-CB 4Å; E1927-L2055 VanDerWaalsContact CB-CB 3.42Å; E1927-L2055 HydrophobicContact CB-CD2 4.03Å; E1927-L2055 HydrophobicContact CB-CG 4.25Å; E1927-L2055 HydrophobicContact CG-CD2 4.24Å; E1927-L2055 WeakPolarHBondContact O-CB 3.25Å; E1927-L2055 PolarHBondContact O-N 2.9Å; E1927-L2055 VanDerWaalsContact OE2-CD2 3.25Å; E1927-L2055 WeakPolarHBondContact OE2-CD2 3.17Å; F1929-L2055 HydrophobicContact CD1-CD1 4.3Å; L2055-L2057 VanDerWaalsContact C-N 3.27Å; L2055-L2057 PolarHBondContact O-N 2.89Å; L2055-I2058 HydrophobicContact CD1-CB 4.46Å; L2055-I2058 HydrophobicContact CD1-CD1 3.85Å; L2055-I2058 WeakPolarHBondContact O-CB 3.44Å; L2055-I2058 PolarHBondContact O-N 2.99Å; L2055-I2058 VanDerWaalsContact O-N 3.09Å; L2055-Q2059 PolarHBondContact O-N 3.15Å; L2055-F2107 HydrophobicContact CD1-CB 4.24Å; L2055-F2107 HydrophobicContact CD1-CD1 3.34Å; L2055-F2107 VanDerWaalsContact CD1-CD1 3.43Å; L2055-F2107 HydrophobicContact CD1-CD2 4.4Å; L2055-F2107 HydrophobicContact CD1-CE1 3.52Å; L2055-F2107 VanDerWaalsContact CD1-CE1 3.4Å; L2055-F2107 HydrophobicContact CD1-CG 3.87Å; L2055-F2107 HydrophobicContact CD1-CZ 4.25Å
2056	E	75.1	Confident	72.8	Confident	78.25 Å²	78.25	48.6 Å²	48.6	37%	0.366	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-52.1	-39.4	174.1	-63.3	175.9	161.5	0	0	112.4	N1926 Y1998 P2054 I2058 Q2059 C2062	N1926-E2056 PolarHBondContact ND2-OE1 3.14Å; N1926-E2056 PolarHBondContact ND2-OE2 2.9Å; Y1998-E2056 WeakPolarHBondContact CE2-OE2 3.38Å; Y1998-E2056 PolarHBondContact OH-OE2 3.24Å; P2054-E2056 HydrophobicContact CB-CB 4.33Å; P2054-E2056 HydrophobicContact CB-CG 4.48Å; P2054-E2056 PolarHBondContact O-N 2.86Å; E2056-I2058 PolarHBondContact O-N 3Å; E2056-I2058 VanDerWaalsContact O-N 3.11Å; E2056-Q2059 WeakPolarHBondContact O-CB 3.2Å; E2056-Q2059 PolarHBondContact O-N 3.1Å; E2056-Q2059 VanDerWaalsContact O-N 3.12Å; E2056-C2062 WeakPolarHBondContact O-CB 3.41Å; E2056-C2062 PolarHBondContact O-SG 3Å
2057	L	76.1	Confident	73.1	Confident	5.25 Å²	5.25	47.9 Å²	47.9	3%	0.027	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-68.3	-12.5	-179.5	-64.3	173.7	0	0	0	113.7	Y1998 I2053 P2054 L2055 Q2064 L2066 L2100	Y1998-L2057 HydrophobicContact CE1-CD1 4.25Å; Y1998-L2057 HydrophobicContact CE1-CD2 4.13Å; Y1998-L2057 WeakPolarHBondContact OH-CG 3.46Å; I2053-L2057 HydrophobicContact CG2-CB 4.4Å; I2053-L2057 HydrophobicContact CG2-CD1 3.71Å; P2054-L2057 HydrophobicContact CB-CG 4.48Å; P2054-L2057 HydrophobicContact CG-CD1 4.41Å; P2054-L2057 PolarHBondContact O-N 3.25Å; P2054-L2057 VanDerWaalsContact O-N 3.13Å; L2055-L2057 VanDerWaalsContact C-N 3.27Å; L2055-L2057 PolarHBondContact O-N 2.89Å; L2057-Q2064 HydrophobicContact CD2-CB 4.06Å; L2057-Q2064 VanDerWaalsContact CD2-O 3.24Å; L2057-Q2064 WeakPolarHBondContact CD2-O 3.32Å; L2057-L2066 HydrophobicContact CD1-CD1 4.37Å; L2057-L2100 HydrophobicContact CB-CD1 4.01Å; L2057-L2100 HydrophobicContact CD1-CD1 4.34Å; L2057-L2100 WeakPolarHBondContact O-CB 3.33Å
2058	I	76.6	Confident	73.5	Confident	4.75 Å²	4.75	46.5 Å²	46.5	2%	0.024	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-96.2	-21.6	176.4	-64.7	167	0	0	0	111.6	F1929 L2055 E2056 L2100 T2101 L2103 S2104 F2107	F1929-I2058 HydrophobicContact CD1-CD1 3.66Å; F1929-I2058 VanDerWaalsContact CD1-CD1 3.45Å; F1929-I2058 HydrophobicContact CD1-CG1 4.43Å; F1929-I2058 HydrophobicContact CD2-CD1 4.43Å; F1929-I2058 HydrophobicContact CE1-CD1 3.13Å; F1929-I2058 HydrophobicContact CE1-CG1 3.83Å; F1929-I2058 HydrophobicContact CE2-CD1 4.18Å; F1929-I2058 HydrophobicContact CG-CD1 4.32Å; F1929-I2058 HydrophobicContact CZ-CD1 3.43Å; F1929-I2058 HydrophobicContact CZ-CG1 4.06Å; L2055-I2058 HydrophobicContact CD1-CB 4.46Å; L2055-I2058 HydrophobicContact CD1-CD1 3.85Å; L2055-I2058 WeakPolarHBondContact O-CB 3.44Å; L2055-I2058 PolarHBondContact O-N 2.99Å; L2055-I2058 VanDerWaalsContact O-N 3.09Å; E2056-I2058 PolarHBondContact O-N 3Å; E2056-I2058 VanDerWaalsContact O-N 3.11Å; I2058-L2100 HydrophobicContact CG1-CB 4.08Å; I2058-T2101 WeakPolarHBondContact O-CA 3.14Å; I2058-L2103 HydrophobicContact CD1-CB 3.94Å; I2058-S2104 VanDerWaalsContact CG2-CA 3.43Å; I2058-F2107 HydrophobicContact CD1-CD2 3.84Å; I2058-F2107 HydrophobicContact CD1-CE1 4.15Å; I2058-F2107 HydrophobicContact CD1-CE2 3.26Å; I2058-F2107 HydrophobicContact CD1-CG 4.33Å; I2058-F2107 HydrophobicContact CD1-CZ 3.48Å; I2058-F2107 VanDerWaalsContact CD1-CZ 3.48Å; I2058-F2107 HydrophobicContact CG1-CE2 4.38Å; I2058-F2107 HydrophobicContact CG2-CD2 4.08Å; I2058-F2107 HydrophobicContact CG2-CE2 4.24Å
2059	Q	68.5	Low	74	Confident	81 Å²	81	45 Å²	45	38%	0.379	24%	0.237	S	C	.	.	S	Bend	trans	-66.3	132.6	-177.1	-65	-177.5	3.4	0	0	110.4	E1927 L2055 E2056 S2061 C2062	E1927-Q2059 PolarHBondContact OE2-NE2 2.86Å; L2055-Q2059 PolarHBondContact O-N 3.15Å; E2056-Q2059 WeakPolarHBondContact O-CB 3.2Å; E2056-Q2059 PolarHBondContact O-N 3.1Å; E2056-Q2059 VanDerWaalsContact O-N 3.12Å; Q2059-S2061 WeakPolarHBondContact CB-OG 3.35Å; Q2059-S2061 PolarHBondContact O-N 3.06Å; Q2059-S2061 PolarHBondContact OE1-OG 2.88Å; Q2059-C2062 HydrophobicContact CB-CB 4.43Å; Q2059-C2062 VanDerWaalsContact O-CB 3.32Å; Q2059-C2062 WeakPolarHBondContact O-CB 3.42Å; Q2059-C2062 PolarHBondContact O-N 3.03Å
2060	P	64	Low	74.7	Confident	105.5 Å²	105.5	42.9 Å²	42.9	69%	0.685	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-17.7	177	-25.9	34.6	0	0	0	114.7	C2062	P2060-C2062 VanDerWaalsContact C-N 3.32Å
2061	S	58.4	Low	75.4	Confident	94.5 Å²	94.5	41.2 Å²	41.2	66%	0.661	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-13.5	173.5	45.7	0	0	0	0	113.9	Q2059 N2063	Q2059-S2061 WeakPolarHBondContact CB-OG 3.35Å; Q2059-S2061 PolarHBondContact O-N 3.06Å; Q2059-S2061 PolarHBondContact OE1-OG 2.88Å; S2061-N2063 PolarHBondContact O-N 2.96Å
2062	C	58.7	Low	76.1	Confident	25.75 Å²	25.75	40.9 Å²	40.9	17%	0.174	22%	0.22	C	C	.	.			trans	-96.4	105.8	-177.8	-168.6	0	0	0	0	110.8	E2056 Q2059 P2060 Q2064	E2056-C2062 WeakPolarHBondContact O-CB 3.41Å; E2056-C2062 PolarHBondContact O-SG 3Å; Q2059-C2062 HydrophobicContact CB-CB 4.43Å; Q2059-C2062 VanDerWaalsContact O-CB 3.32Å; Q2059-C2062 WeakPolarHBondContact O-CB 3.42Å; Q2059-C2062 PolarHBondContact O-N 3.03Å; P2060-C2062 VanDerWaalsContact C-N 3.32Å; C2062-Q2064 PolarHBondContact O-N 3.08Å
2063	N	59.8	Low	76.6	Confident	112.75 Å²	112.75	36.7 Å²	36.7	60%	0.603	21%	0.206	S	C	*	.			trans	-76	14.2	175.8	-68.9	-11.2	0	0	0	113.4	S2061 S2236	S2061-N2063 PolarHBondContact O-N 2.96Å; N2063-S2236 WeakPolarHBondContact O-CB 3.26Å; N2063-S2236 PolarHBondContact O-OG 3.27Å
2064	Q	67.1	Low	76.6	Confident	80.5 Å²	80.5	40.9 Å²	40.9	38%	0.376	22%	0.224	S	C	.	.			trans	-108.2	121.5	-176.4	-59.7	-176.3	-6	0	0	110.4	Y1998 N2001 L2057 C2062	Y1998-Q2064 PolarHBondContact O-NE2 3.19Å; N2001-Q2064 PolarHBondContact ND2-NE2 2.77Å; L2057-Q2064 HydrophobicContact CD2-CB 4.06Å; L2057-Q2064 VanDerWaalsContact CD2-O 3.24Å; L2057-Q2064 WeakPolarHBondContact CD2-O 3.32Å; C2062-Q2064 PolarHBondContact O-N 3.08Å
2065	G	76.6	Confident	76.1	Confident	19.25 Å²	19.25	44 Å²	44	20%	0.198	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-90.2	164.9	169.8	0	0	0	0	0	112.3	M2067 V2098	G2065-M2067 PolarHBondContact O-N 3.21Å; G2065-V2098 CarbonylContact C-O 3.55Å; G2065-V2098 WeakPolarHBondContact CA-O 3.28Å
2066	L	86	Confident	75.2	Confident	4.25 Å²	4.25	46.5 Å²	46.5	2%	0.022	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	121.8	171.4	-177.4	67.2	0	0	0	110	I1933 P1991 I2053 L2057 F2068 T2097 V2098 L2100 V2143	I1933-L2066 HydrophobicContact CD1-CD2 3.69Å; I1933-L2066 HydrophobicContact CG1-CD2 4.35Å; P1991-L2066 HydrophobicContact CG-CD1 4.04Å; I2053-L2066 HydrophobicContact CD1-CD2 4.26Å; L2057-L2066 HydrophobicContact CD1-CD1 4.37Å; L2066-F2068 HydrophobicContact CB-CE2 4.29Å; L2066-F2068 HydrophobicContact CD2-CE2 3.71Å; L2066-F2068 HydrophobicContact CD2-CZ 3.71Å; L2066-F2068 HydrophobicContact CG-CD2 4.48Å; L2066-F2068 HydrophobicContact CG-CE2 3.72Å; L2066-F2068 HydrophobicContact CG-CZ 4.14Å; L2066-F2068 WeakPolarHBondContact O-CD2 3.14Å; L2066-T2097 WeakPolarHBondContact O-CA 3.3Å; L2066-V2098 HydrophobicContact CB-CB 4.44Å; L2066-V2098 PolarHBondContact N-O 3.14Å; L2066-V2098 PolarHBondContact O-N 3.12Å; L2066-L2100 HydrophobicContact CB-CD1 4.22Å; L2066-L2100 HydrophobicContact CB-CG 4.43Å; L2066-V2143 HydrophobicContact CD2-CG2 4.17Å
2067	M	87.8	Confident	73.8	Confident	71.25 Å²	71.25	49.1 Å²	49.1	35%	0.351	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.6	-172.3	-60.7	175.8	70.3	0	0	113	F1990 P1991 G2065 I2095 T2097	F1990-M2067 WeakPolarHBondContact CB-O 3.45Å; P1991-M2067 WeakPolarHBondContact CD-O 3.39Å; G2065-M2067 PolarHBondContact O-N 3.21Å; M2067-I2095 HydrophobicContact CB-CG2 4.33Å; M2067-I2095 HydrophobicContact CE-CD1 4.06Å; M2067-I2095 HydrophobicContact CE-CG2 3.82Å; M2067-T2097 HydrophobicContact CG-CG2 4.27Å
2068	F	90.8	Very high	72.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	116.6	176	-64.8	-102.6	0	0	0	109.2	I1933 V1935 V1988 F1990 L2066 I2095 A2096 V2098 I2141	I1933-F2068 HydrophobicContact CG2-CE1 3.71Å; I1933-F2068 HydrophobicContact CG2-CZ 3.82Å; V1935-F2068 HydrophobicContact CG2-CD1 4.07Å; V1935-F2068 HydrophobicContact CG2-CE1 3.79Å; V1988-F2068 HydrophobicContact CG1-CB 4.03Å; V1988-F2068 HydrophobicContact CG1-CD1 4.16Å; F1990-F2068 HydrophobicContact CB-CD1 3.71Å; F1990-F2068 HydrophobicContact CB-CE1 3.89Å; F1990-F2068 HydrophobicContact CB-CG 4.22Å; F1990-F2068 HydrophobicContact CB-CZ 4.4Å; F1990-F2068 AromaticContact CD1-CD1 3.74Å; F1990-F2068 HydrophobicContact CD1-CD1 3.74Å; F1990-F2068 AromaticContact CD1-CE1 3.69Å; F1990-F2068 HydrophobicContact CD1-CE1 3.69Å; F1990-F2068 HydrophobicContact CD2-CE1 4.33Å; F1990-F2068 HydrophobicContact CE1-CD1 4.44Å; F1990-F2068 HydrophobicContact CE1-CE1 4.24Å; F1990-F2068 AromaticContact CG-CD1 3.91Å; F1990-F2068 HydrophobicContact CG-CD1 3.91Å; F1990-F2068 AromaticContact CG-CE1 3.73Å; F1990-F2068 HydrophobicContact CG-CE1 3.73Å; F1990-F2068 HydrophobicContact CG-CZ 4.38Å; L2066-F2068 HydrophobicContact CB-CE2 4.29Å; L2066-F2068 HydrophobicContact CD2-CE2 3.71Å; L2066-F2068 HydrophobicContact CD2-CZ 3.71Å; L2066-F2068 HydrophobicContact CG-CD2 4.48Å; L2066-F2068 HydrophobicContact CG-CE2 3.72Å; L2066-F2068 HydrophobicContact CG-CZ 4.14Å; L2066-F2068 WeakPolarHBondContact O-CD2 3.14Å; F2068-I2095 CarbonylContact O-C 3.57Å; F2068-I2095 WeakPolarHBondContact O-CA 3.35Å; F2068-A2096 HydrophobicContact CB-CB 4.39Å; F2068-A2096 PolarHBondContact N-O 3Å; F2068-A2096 PolarHBondContact O-N 3.11Å; F2068-V2098 HydrophobicContact CD2-CG2 4.03Å; F2068-V2098 HydrophobicContact CE2-CB 4.34Å; F2068-V2098 HydrophobicContact CE2-CG2 3.66Å; F2068-I2141 HydrophobicContact CB-CD1 4.07Å; F2068-I2141 HydrophobicContact CD1-CD1 3.95Å; F2068-I2141 HydrophobicContact CD2-CD1 3.63Å; F2068-I2141 HydrophobicContact CE1-CD1 4.28Å; F2068-I2141 HydrophobicContact CE1-CG2 4Å; F2068-I2141 HydrophobicContact CE2-CD1 4Å; F2068-I2141 HydrophobicContact CE2-CG2 3.89Å; F2068-I2141 HydrophobicContact CG-CD1 3.62Å; F2068-I2141 HydrophobicContact CZ-CD1 4.31Å; F2068-I2141 HydrophobicContact CZ-CG2 3.56Å
2069	H	89.6	Confident	70.4	Confident	18.75 Å²	18.75	62.2 Å²	62.2	9%	0.087	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	126.9	179.3	-58	74	0	0	0	109.1	V1988 T1989 W2071 L2092	V1988-H2069 CarbonylContact C-O 3.52Å; V1988-H2069 VanDerWaalsContact CA-O 3.27Å; V1988-H2069 WeakPolarHBondContact CA-O 3.31Å; V1988-H2069 WeakPolarHBondContact CG1-O 3.1Å; T1989-H2069 PolarHBondContact N-O 2.87Å; T1989-H2069 PolarHBondContact O-N 3.14Å; T1989-H2069 WeakPolarHBondContact OG1-CB 2.97Å; H2069-W2071 HydrophobicContact CB-CZ2 4.07Å; H2069-W2071 VanDerWaalsContact O-CD1 3.31Å; H2069-L2092 HydrophobicContact CB-CD1 3.86Å
2070	V	90.4	Very high	69.2	Low	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	123	-179.6	-171.2	0	0	0	0	109	L1941 V1986 V1988 L2092 I2093 G2094 V2127 I2139	L1941-V2070 HydrophobicContact CD1-CG1 4.12Å; L1941-V2070 HydrophobicContact CD2-CG1 4.23Å; V1986-V2070 HydrophobicContact CG1-CG1 3.79Å; V1988-V2070 HydrophobicContact CG1-CG2 4.46Å; V1988-V2070 HydrophobicContact CG2-CG1 4.39Å; V1988-V2070 HydrophobicContact CG2-CG2 4.29Å; V2070-L2092 WeakPolarHBondContact O-CD1 3.33Å; V2070-I2093 HydrophobicContact CB-CB 4.47Å; V2070-I2093 HydrophobicContact CG1-CB 4.47Å; V2070-I2093 HydrophobicContact CG1-CD1 4.05Å; V2070-I2093 WeakPolarHBondContact O-CB 3.38Å; V2070-I2093 PolarHBondContact O-N 3.15Å; V2070-G2094 PolarHBondContact N-O 3.14Å; V2070-G2094 PolarHBondContact O-N 3.09Å; V2070-V2127 HydrophobicContact CB-CG1 4.11Å; V2070-V2127 HydrophobicContact CG2-CG1 3.93Å; V2070-V2127 HydrophobicContact CG2-CG2 3.98Å; V2070-I2139 HydrophobicContact CG2-CD1 4.23Å
2071	W	89.5	Confident	68	Low	0.75 Å²	0.75	69.1 Å²	69.1	0%	0.003	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	147.2	-171.7	-57.1	88.6	0	0	0	111.4	V1986 F1987 T1989 L2016 W2017 I2020 H2069 P2090 K2091 L2092	V1986-W2071 VanDerWaalsContact CA-O 3.25Å; V1986-W2071 WeakPolarHBondContact CA-O 3.35Å; V1986-W2071 VanDerWaalsContact CG1-O 3.29Å; V1986-W2071 WeakPolarHBondContact CG1-O 3.26Å; F1987-W2071 HydrophobicContact CD1-CB 4.06Å; F1987-W2071 HydrophobicContact CD2-CB 4.05Å; F1987-W2071 AromaticContact CD2-CD1 3.86Å; F1987-W2071 HydrophobicContact CD2-CG 4.24Å; F1987-W2071 HydrophobicContact CE1-CB 3.65Å; F1987-W2071 HydrophobicContact CE1-CG 4.35Å; F1987-W2071 HydrophobicContact CE2-CB 3.64Å; F1987-W2071 VanDerWaalsContact CE2-CB 3.42Å; F1987-W2071 AromaticContact CE2-CD1 3.56Å; F1987-W2071 VanDerWaalsContact CE2-CD1 3.4Å; F1987-W2071 HydrophobicContact CE2-CD2 4.33Å; F1987-W2071 AromaticContact CE2-CG 3.64Å; F1987-W2071 HydrophobicContact CE2-CG 3.64Å; F1987-W2071 VanDerWaalsContact CE2-CG 3.44Å; F1987-W2071 HydrophobicContact CG-CB 4.26Å; F1987-W2071 HydrophobicContact CZ-CB 3.43Å; F1987-W2071 VanDerWaalsContact CZ-CB 3.47Å; F1987-W2071 HydrophobicContact CZ-CD2 4.44Å; F1987-W2071 AromaticContact CZ-CG 3.79Å; F1987-W2071 HydrophobicContact CZ-CG 3.79Å; F1987-W2071 PolarHBondContact N-O 2.89Å; F1987-W2071 PolarHBondContact O-N 3.09Å; T1989-W2071 PolarHBondContact OG1-NE1 3.03Å; L2016-W2071 HydrophobicContact CB-CH2 4.37Å; W2017-W2071 HydrophobicContact CB-CH2 4.44Å; W2017-W2071 HydrophobicContact CB-CZ3 4.35Å; W2017-W2071 HydrophobicContact CE3-CE3 4.4Å; W2017-W2071 HydrophobicContact CE3-CH2 4.34Å; W2017-W2071 HydrophobicContact CE3-CZ2 4.42Å; W2017-W2071 HydrophobicContact CE3-CZ3 4.34Å; I2020-W2071 HydrophobicContact CD1-CH2 3.99Å; I2020-W2071 HydrophobicContact CD1-CZ2 3.62Å; I2020-W2071 VanDerWaalsContact CD1-CZ2 3.44Å; H2069-W2071 HydrophobicContact CB-CZ2 4.07Å; H2069-W2071 VanDerWaalsContact O-CD1 3.31Å; W2071-P2090 HydrophobicContact CB-CB 4.35Å; W2071-P2090 HydrophobicContact CE3-CB 4.15Å; W2071-P2090 HydrophobicContact CE3-CG 4.12Å; W2071-K2091 CarbonylContact C-O 3.51Å; W2071-K2091 WeakPolarHBondContact CA-O 3.41Å; W2071-L2092 HydrophobicContact CD2-CD1 4Å; W2071-L2092 HydrophobicContact CE3-CB 4.03Å; W2071-L2092 HydrophobicContact CE3-CD1 4.17Å; W2071-L2092 HydrophobicContact CH2-CB 4.35Å; W2071-L2092 HydrophobicContact CH2-CD1 4.12Å; W2071-L2092 HydrophobicContact CZ2-CD1 3.95Å; W2071-L2092 HydrophobicContact CZ3-CB 3.88Å; W2071-L2092 HydrophobicContact CZ3-CD1 4.24Å
2072	A	87.2	Confident	67.1	Low	1.25 Å²	1.25	72.3 Å²	72.3	1%	0.01	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	143.1	169	0	0	0	0	0	110.7	L1943 Y1984 S1985 L2040 P2090 K2091 I2093	L1943-A2072 HydrophobicContact CD2-CB 3.74Å; Y1984-A2072 HydrophobicContact CD1-CB 4.24Å; S1985-A2072 CarbonylContact O-C 3.45Å; S1985-A2072 WeakPolarHBondContact O-CA 3.2Å; L2040-A2072 HydrophobicContact CD1-CB 4.2Å; L2040-A2072 HydrophobicContact CD2-CB 4.39Å; A2072-P2090 CarbonylContact O-C 3.49Å; A2072-P2090 VanDerWaalsContact O-CA 3.3Å; A2072-P2090 WeakPolarHBondContact O-CA 3.3Å; A2072-P2090 WeakPolarHBondContact O-CB 3.5Å; A2072-K2091 PolarHBondContact N-O 3Å; A2072-K2091 PolarHBondContact O-N 3.02Å; A2072-I2093 HydrophobicContact CB-CD1 3.95Å; A2072-I2093 HydrophobicContact CB-CG1 3.99Å
2073	M	82.7	Confident	66.4	Low	23.25 Å²	23.25	77.8 Å²	77.8	12%	0.115	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	125.1	177.2	179.1	129.8	176.1	0	0	109.2	Y1984 S1985 F1987 K2036 Y2088 P2090	Y1984-M2073 CarbonylContact C-O 3.4Å; Y1984-M2073 WeakPolarHBondContact CA-O 3.39Å; S1985-M2073 PolarHBondContact N-O 3.12Å; S1985-M2073 PolarHBondContact O-N 3Å; S1985-M2073 WeakPolarHBondContact OG-CB 3.47Å; S1985-M2073 PolarHBondContact OG-O 3.19Å; S1985-M2073 VanDerWaalsContact OG-O 3.09Å; F1987-M2073 HydrophobicContact CE1-CB 4.3Å; K2036-M2073 HydrophobicContact CD-SD 4.41Å; K2036-M2073 PolarHBondContact NZ-SD 3.2Å; M2073-Y2088 HydrophobicContact CE-CD1 3.53Å; M2073-Y2088 VanDerWaalsContact CE-CD1 3.44Å; M2073-Y2088 HydrophobicContact CE-CE1 3.84Å; M2073-Y2088 HydrophobicContact CE-CG 3.97Å; M2073-P2090 HydrophobicContact CB-CB 4.4Å; M2073-P2090 HydrophobicContact SD-CB 4.11Å
2074	K	75.9	Confident	65.2	Low	91 Å²	91	78 Å²	78	40%	0.396	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	141.6	177.6	-165.9	177	178.1	-94.7	0	110.4	D1983 Y1984 D2076	D1983-K2074 HydrophobicContact CB-CG 4.42Å; D1983-K2074 CarbonylContact O-C 3.5Å; Y1984-K2074 HydrophobicContact CD1-CB 4.07Å; Y1984-K2074 HydrophobicContact CD1-CG 4.44Å; Y1984-K2074 HydrophobicContact CE1-CB 3.74Å; Y1984-K2074 HydrophobicContact CE1-CD 4.48Å; Y1984-K2074 HydrophobicContact CE1-CG 4.17Å; K2074-D2076 WeakPolarHBondContact CD-OD1 3.2Å; K2074-D2076 WeakPolarHBondContact CE-OD1 3.13Å; K2074-D2076 IonicContact NZ-OD1 3.3Å; K2074-D2076 PolarHBondContact NZ-OD1 3.05Å
2075	H	64.2	Low	63.9	Low	73 Å²	73	82.1 Å²	82.1	34%	0.338	42%	0.42	S	S	.	.			trans	-85.2	117.9	159.1	-96.3	-93.9	0	0	0	108	D1983 K2038 D2077	D1983-H2075 PolarHBondContact O-N 2.83Å; K2038-H2075 WeakPolarHBondContact CE-NE2 3.41Å; H2075-D2077 VanDerWaalsContact C-N 3.32Å; H2075-D2077 IonicContact CG-OD1 3.59Å; H2075-D2077 IonicContact ND1-OD1 3.35Å; H2075-D2077 PolarHBondContact ND1-OD1 2.86Å; H2075-D2077 PolarHBondContact O-N 3.45Å
2076	D	55.1	Low	62.5	Low	84.5 Å²	84.5	85.1 Å²	85.1	45%	0.452	44%	0.437	S	S	.	.			trans	-96.7	109.7	163.7	-68.2	-34	0	0	0	106.8	K2074 D2078	K2074-D2076 WeakPolarHBondContact CD-OD1 3.2Å; K2074-D2076 WeakPolarHBondContact CE-OD1 3.13Å; K2074-D2076 IonicContact NZ-OD1 3.3Å; K2074-D2076 PolarHBondContact NZ-OD1 3.05Å; D2076-D2078 PolarHBondContact O-N 3.03Å
2077	D	46	Very low	60.6	Low	134.25 Å²	134.25	88.2 Å²	88.2	72%	0.718	46%	0.459	S	S	*	.			trans	-85.2	48.8	176.2	-75.6	-22.7	0	0	0	110.7	H2075 D2079	H2075-D2077 VanDerWaalsContact C-N 3.32Å; H2075-D2077 IonicContact CG-OD1 3.59Å; H2075-D2077 IonicContact ND1-OD1 3.35Å; H2075-D2077 PolarHBondContact ND1-OD1 2.86Å; H2075-D2077 PolarHBondContact O-N 3.45Å; D2077-D2079 PolarHBondContact O-N 3.19Å
2078	D	42.1	Very low	59.1	Low	156 Å²	156	92.5 Å²	92.5	83%	0.834	47%	0.473	S	S	*	.			trans	-117.1	119.9	-178.3	-69.6	-37.6	0	0	0	114.1	D2076	D2076-D2078 PolarHBondContact O-N 3.03Å
2079	D	39.2	Very low	58	Low	129 Å²	129	95.6 Å²	95.6	69%	0.69	49%	0.492	S	S	*	.			trans	-41.4	129.5	169.4	-124.4	-11.6	0	0	0	114.5	D2077 D2081	D2077-D2079 PolarHBondContact O-N 3.19Å; D2079-D2081 VanDerWaalsContact C-N 3.34Å; D2079-D2081 PolarHBondContact O-N 3.19Å
2080	Y	41.8	Very low	57.3	Low	205.5 Å²	205.5	95 Å²	95	81%	0.806	49%	0.49	S	S	*	.			trans	64.7	59.5	161.5	-57.7	-80.2	0	0	0	121	L2082	Y2080-L2082 VanDerWaalsContact C-N 3.33Å; Y2080-L2082 PolarHBondContact O-N 3.2Å
2081	D	40	Very low	57	Low	124.75 Å²	124.75	98.3 Å²	98.3	67%	0.667	50%	0.504	S	S	*	.			trans	-140.3	90	148.6	-136.4	-15	0	0	0	113.1	D2079 N2083	D2079-D2081 VanDerWaalsContact C-N 3.34Å; D2079-D2081 PolarHBondContact O-N 3.19Å; D2081-N2083 PolarHBondContact O-N 3.18Å; D2081-N2083 PolarHBondContact OD1-N 3.35Å; D2081-N2083 PolarHBondContact OD1-ND2 3.08Å
2082	L	39.8	Very low	56.7	Low	163.5 Å²	163.5	98.6 Å²	98.6	86%	0.856	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	16.7	-177	-80.3	166.1	0	0	0	115.1	Y2080	Y2080-L2082 VanDerWaalsContact C-N 3.33Å; Y2080-L2082 PolarHBondContact O-N 3.2Å
2083	N	42.5	Very low	56.7	Low	140.75 Å²	140.75	98.7 Å²	98.7	75%	0.753	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.3	-0	-170.2	-64.2	-61.3	0	0	0	115.4	D2081	D2081-N2083 PolarHBondContact O-N 3.18Å; D2081-N2083 PolarHBondContact OD1-N 3.35Å; D2081-N2083 PolarHBondContact OD1-ND2 3.08Å
2084	N	35.7	Very low	56.9	Low	116.25 Å²	116.25	97.6 Å²	97.6	62%	0.622	50%	0.5	S	S	*	.			trans	-113.4	89.3	-178.5	-109.8	-21.8	0	0	0	112.6	S2086 S2087	N2084-S2086 PolarHBondContact O-N 3.11Å; N2084-S2087 PolarHBondContact O-N 3.45Å
2085	D	40	Very low	57.6	Low	167.75 Å²	167.75	94.4 Å²	94.4	90%	0.897	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	16.4	-174.7	-144	12	0	0	0	114.8	N1804	N1804-D2085 PolarHBondContact ND2-OD1 3.45Å
2086	S	45.6	Very low	58.8	Low	81 Å²	81	90.9 Å²	90.9	57%	0.566	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	-8.7	-169.2	62	0	0	0	0	116.7	N2084 Y2088 T2089	N2084-S2086 PolarHBondContact O-N 3.11Å; S2086-Y2088 VanDerWaalsContact C-N 3.25Å; S2086-Y2088 PolarHBondContact O-N 3Å; S2086-T2089 PolarHBondContact O-OG1 3.16Å
2087	S	45.9	Very low	60.4	Low	69 Å²	69	89.2 Å²	89.2	48%	0.483	46%	0.464	S	S	.	.	S	Bend	trans	-81.3	-21.9	-175.1	54.7	0	0	0	0	114.6	N2084 T2089	N2084-S2087 PolarHBondContact O-N 3.45Å; S2087-T2089 VanDerWaalsContact C-N 3.29Å; S2087-T2089 PolarHBondContact O-N 3.06Å
2088	Y	58.3	Low	62.5	Low	161.5 Å²	161.5	82.9 Å²	82.9	63%	0.633	43%	0.43	S	S	*	.			trans	-88	19.3	-170.3	-96.1	-90.6	0	0	0	116.3	C1805 M2073 S2086	C1805-Y2088 HydrophobicContact CB-CD1 4.09Å; C1805-Y2088 HydrophobicContact CB-CE1 4.1Å; M2073-Y2088 HydrophobicContact CE-CD1 3.53Å; M2073-Y2088 VanDerWaalsContact CE-CD1 3.44Å; M2073-Y2088 HydrophobicContact CE-CE1 3.84Å; M2073-Y2088 HydrophobicContact CE-CG 3.97Å; S2086-Y2088 VanDerWaalsContact C-N 3.25Å; S2086-Y2088 PolarHBondContact O-N 3Å
2089	T	65.8	Low	64.5	Low	65.5 Å²	65.5	78.4 Å²	78.4	40%	0.402	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-90.2	122.9	-179.8	59.5	0	0	0	0	112.4	S2086 S2087	S2086-T2089 PolarHBondContact O-OG1 3.16Å; S2087-T2089 VanDerWaalsContact C-N 3.29Å; S2087-T2089 PolarHBondContact O-N 3.06Å
2090	P	76.8	Confident	66.8	Low	7.25 Å²	7.25	72.2 Å²	72.2	5%	0.047	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-70.6	140.3	177.6	29.7	-34.3	0	0	0	111.6	F1987 W2017 W2071 A2072 M2073	F1987-P2090 HydrophobicContact CE1-CB 3.99Å; F1987-P2090 HydrophobicContact CZ-CB 3.78Å; F1987-P2090 HydrophobicContact CZ-CG 4.02Å; W2017-P2090 HydrophobicContact CD2-CG 3.43Å; W2017-P2090 VanDerWaalsContact CD2-CG 3.42Å; W2017-P2090 VanDerWaalsContact CE2-CG 3.43Å; W2017-P2090 HydrophobicContact CE3-CG 3.55Å; W2017-P2090 VanDerWaalsContact CE3-CG 3.49Å; W2017-P2090 HydrophobicContact CG-CG 4.03Å; W2017-P2090 HydrophobicContact CH2-CG 3.86Å; W2017-P2090 HydrophobicContact CZ2-CG 3.74Å; W2017-P2090 HydrophobicContact CZ3-CG 3.76Å; W2071-P2090 HydrophobicContact CB-CB 4.35Å; W2071-P2090 HydrophobicContact CE3-CB 4.15Å; W2071-P2090 HydrophobicContact CE3-CG 4.12Å; A2072-P2090 CarbonylContact O-C 3.49Å; A2072-P2090 VanDerWaalsContact O-CA 3.3Å; A2072-P2090 WeakPolarHBondContact O-CA 3.3Å; A2072-P2090 WeakPolarHBondContact O-CB 3.5Å; M2073-P2090 HydrophobicContact CB-CB 4.4Å; M2073-P2090 HydrophobicContact SD-CB 4.11Å
2091	K	82.2	Confident	68.6	Low	69.25 Å²	69.25	63.8 Å²	63.8	30%	0.301	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	129.2	176.9	-175.8	171.3	173.9	-179	0	110	L1943 S1944 H1946 W2071 A2072 I2093	L1943-K2091 HydrophobicContact CD2-CD 4.21Å; L1943-K2091 HydrophobicContact CD2-CG 4.4Å; S1944-K2091 PolarHBondContact O-NZ 3.18Å; S1944-K2091 WeakPolarHBondContact OG-CE 3.29Å; S1944-K2091 PolarHBondContact OG-NZ 2.75Å; S1944-K2091 VanDerWaalsContact OG-NZ 3.11Å; H1946-K2091 PolarHBondContact NE2-NZ 3.42Å; W2071-K2091 CarbonylContact C-O 3.51Å; W2071-K2091 WeakPolarHBondContact CA-O 3.41Å; A2072-K2091 PolarHBondContact N-O 3Å; A2072-K2091 PolarHBondContact O-N 3.02Å; K2091-I2093 PolarHBondContact O-N 2.93Å
2092	L	85	Confident	70.5	Confident	7 Å²	7	61.3 Å²	61.3	4%	0.037	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	124.9	173.8	-173.9	69.1	0	0	0	109.5	N2013 L2016 H2069 V2070 W2071 I2095 N2130	N2013-L2092 HydrophobicContact CB-CB 4.44Å; N2013-L2092 WeakPolarHBondContact OD1-CB 3.35Å; L2016-L2092 HydrophobicContact CD1-CD2 4.42Å; H2069-L2092 HydrophobicContact CB-CD1 3.86Å; V2070-L2092 WeakPolarHBondContact O-CD1 3.33Å; W2071-L2092 HydrophobicContact CD2-CD1 4Å; W2071-L2092 HydrophobicContact CE3-CB 4.03Å; W2071-L2092 HydrophobicContact CE3-CD1 4.17Å; W2071-L2092 HydrophobicContact CH2-CB 4.35Å; W2071-L2092 HydrophobicContact CH2-CD1 4.12Å; W2071-L2092 HydrophobicContact CZ2-CD1 3.95Å; W2071-L2092 HydrophobicContact CZ3-CB 3.88Å; W2071-L2092 HydrophobicContact CZ3-CD1 4.24Å; L2092-I2095 HydrophobicContact CD2-CD1 4.5Å; L2092-I2095 HydrophobicContact CD2-CG1 4.32Å; L2092-N2130 HydrophobicContact CD2-CB 4.14Å
2093	I	86.3	Confident	72.4	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-44.8	170.5	-62.3	171.3	0	0	0	109.4	L1941 R1942 L1943 V1986 L2040 V2070 A2072 K2091 V2127 N2129 S2136	L1941-I2093 HydrophobicContact CB-CD1 4.16Å; L1941-I2093 HydrophobicContact CB-CG2 4.36Å; L1941-I2093 HydrophobicContact CD1-CD1 4.23Å; L1941-I2093 HydrophobicContact CD2-CG2 4.45Å; R1942-I2093 WeakPolarHBondContact O-CG2 3.46Å; L1943-I2093 HydrophobicContact CD2-CG1 4.18Å; V1986-I2093 HydrophobicContact CG1-CD1 4.04Å; V1986-I2093 HydrophobicContact CG2-CD1 4.32Å; L2040-I2093 HydrophobicContact CD1-CD1 4.04Å; L2040-I2093 HydrophobicContact CD2-CD1 3.97Å; V2070-I2093 HydrophobicContact CB-CB 4.47Å; V2070-I2093 HydrophobicContact CG1-CB 4.47Å; V2070-I2093 HydrophobicContact CG1-CD1 4.05Å; V2070-I2093 WeakPolarHBondContact O-CB 3.38Å; V2070-I2093 PolarHBondContact O-N 3.15Å; A2072-I2093 HydrophobicContact CB-CD1 3.95Å; A2072-I2093 HydrophobicContact CB-CG1 3.99Å; K2091-I2093 PolarHBondContact O-N 2.93Å; I2093-V2127 HydrophobicContact CG2-CG1 4.28Å; I2093-N2129 PolarHBondContact O-ND2 2.9Å; I2093-S2136 PolarHBondContact O-OG 2.91Å
2094	G	87.6	Confident	74	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.1	-173.2	-179.5	0	0	0	0	0	113.5	V2070 L2128	V2070-G2094 PolarHBondContact N-O 3.14Å; V2070-G2094 PolarHBondContact O-N 3.09Å; G2094-L2128 CarbonylContact C-O 3.49Å; G2094-L2128 WeakPolarHBondContact CA-O 3.47Å
2095	I	89.3	Confident	75.7	Confident	25 Å²	25	44.9 Å²	44.9	13%	0.128	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	132.9	-174.8	-53.6	176.4	0	0	0	109.3	M2067 F2068 L2092 T2097 L2128	M2067-I2095 HydrophobicContact CB-CG2 4.33Å; M2067-I2095 HydrophobicContact CE-CD1 4.06Å; M2067-I2095 HydrophobicContact CE-CG2 3.82Å; F2068-I2095 CarbonylContact O-C 3.57Å; F2068-I2095 WeakPolarHBondContact O-CA 3.35Å; L2092-I2095 HydrophobicContact CD2-CD1 4.5Å; L2092-I2095 HydrophobicContact CD2-CG1 4.32Å; I2095-T2097 HydrophobicContact CG2-CG2 4.28Å; I2095-L2128 PolarHBondContact N-O 3.24Å; I2095-L2128 PolarHBondContact O-N 2.94Å
2096	A	90.5	Very high	77.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	137	167.8	0	0	0	0	0	109.9	F2068 V2127 I2139 I2141	F2068-A2096 HydrophobicContact CB-CB 4.39Å; F2068-A2096 PolarHBondContact N-O 3Å; F2068-A2096 PolarHBondContact O-N 3.11Å; A2096-V2127 HydrophobicContact CB-CG2 4.47Å; A2096-I2139 HydrophobicContact CB-CG2 3.5Å; A2096-I2139 VanDerWaalsContact CB-CG2 3.49Å; A2096-I2141 HydrophobicContact CB-CD1 4.3Å
2097	T	88.7	Confident	78.2	Confident	48.75 Å²	48.75	36.6 Å²	36.6	30%	0.299	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	124.6	-176.4	57.6	0	0	0	0	110.7	L2066 M2067 I2095 Y2125 N2239	L2066-T2097 WeakPolarHBondContact O-CA 3.3Å; M2067-T2097 HydrophobicContact CG-CG2 4.27Å; I2095-T2097 HydrophobicContact CG2-CG2 4.28Å; T2097-Y2125 WeakPolarHBondContact O-CD1 3.22Å; T2097-N2239 PolarHBondContact OG1-ND2 2.83Å
2098	V	88.4	Confident	78.8	Confident	0.25 Å²	0.25	36.9 Å²	36.9	0%	0.002	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115	179.8	-176.8	0	0	0	0	110	G2065 L2066 F2068 L2100 I2121 Y2125 I2141 V2143	G2065-V2098 CarbonylContact C-O 3.55Å; G2065-V2098 WeakPolarHBondContact CA-O 3.28Å; L2066-V2098 HydrophobicContact CB-CB 4.44Å; L2066-V2098 PolarHBondContact N-O 3.14Å; L2066-V2098 PolarHBondContact O-N 3.12Å; F2068-V2098 HydrophobicContact CD2-CG2 4.03Å; F2068-V2098 HydrophobicContact CE2-CB 4.34Å; F2068-V2098 HydrophobicContact CE2-CG2 3.66Å; V2098-L2100 HydrophobicContact CB-CD2 4.48Å; V2098-L2100 HydrophobicContact CG1-CD2 3.85Å; V2098-L2100 PolarHBondContact O-N 2.83Å; V2098-I2121 HydrophobicContact CG1-CD1 4.35Å; V2098-I2121 HydrophobicContact CG1-CG2 3.91Å; V2098-Y2125 HydrophobicContact CB-CE1 4.23Å; V2098-Y2125 HydrophobicContact CG1-CE1 4.09Å; V2098-Y2125 HydrophobicContact CG1-CE2 4.4Å; V2098-Y2125 HydrophobicContact CG2-CD1 4.07Å; V2098-Y2125 HydrophobicContact CG2-CD2 4.01Å; V2098-Y2125 HydrophobicContact CG2-CE1 3.96Å; V2098-Y2125 HydrophobicContact CG2-CE2 3.9Å; V2098-Y2125 HydrophobicContact CG2-CG 4.11Å; V2098-I2141 HydrophobicContact CG2-CB 4.35Å; V2098-I2141 HydrophobicContact CG2-CD1 4.12Å; V2098-I2141 HydrophobicContact CG2-CG2 4.02Å; V2098-V2143 HydrophobicContact CG1-CG2 4.24Å
2099	D	85.7	Confident	78.4	Confident	61.75 Å²	61.75	34.6 Å²	34.6	33%	0.33	20%	0.195	S	C	.	.			trans	-74.9	117.2	174.8	-176	-11.6	0	0	0	110.2	T2101 T2102 I2121 R2240	D2099-T2101 VanDerWaalsContact OD1-CB 3.29Å; D2099-T2101 WeakPolarHBondContact OD1-CB 3.37Å; D2099-T2101 VanDerWaalsContact OD1-CG2 3.3Å; D2099-T2101 WeakPolarHBondContact OD1-CG2 3.27Å; D2099-T2101 PolarHBondContact OD1-N 3.01Å; D2099-T2101 PolarHBondContact OD1-OG1 3.11Å; D2099-T2101 PolarHBondContact OD2-OG1 3.41Å; D2099-T2102 PolarHBondContact O-OG1 2.85Å; D2099-I2121 VanDerWaalsContact O-CD1 3.27Å; D2099-I2121 WeakPolarHBondContact O-CD1 3.31Å; D2099-R2240 IonicContact OD2-CZ 3.87Å; D2099-R2240 IonicContact OD2-NE 3.21Å; D2099-R2240 PolarHBondContact OD2-NE 3.02Å; D2099-R2240 IonicContact OD2-NH2 3.3Å; D2099-R2240 PolarHBondContact OD2-NH2 3.35Å
2100	L	85.9	Confident	77.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.203	C	C	.	.			trans	-94.4	-0.5	-178.5	-52.5	-177	0	0	0	113.4	F1929 I2053 L2057 I2058 L2066 V2098 T2102 L2103 I2121 V2143	F1929-L2100 HydrophobicContact CZ-CD1 4.34Å; I2053-L2100 HydrophobicContact CD1-CD1 4.24Å; I2053-L2100 HydrophobicContact CG2-CD1 3.68Å; L2057-L2100 HydrophobicContact CB-CD1 4.01Å; L2057-L2100 HydrophobicContact CD1-CD1 4.34Å; L2057-L2100 WeakPolarHBondContact O-CB 3.33Å; I2058-L2100 HydrophobicContact CG1-CB 4.08Å; L2066-L2100 HydrophobicContact CB-CD1 4.22Å; L2066-L2100 HydrophobicContact CB-CG 4.43Å; V2098-L2100 HydrophobicContact CB-CD2 4.48Å; V2098-L2100 HydrophobicContact CG1-CD2 3.85Å; V2098-L2100 PolarHBondContact O-N 2.83Å; L2100-T2102 PolarHBondContact O-N 2.91Å; L2100-T2102 VanDerWaalsContact O-N 3.14Å; L2100-L2103 HydrophobicContact CB-CD1 4.45Å; L2100-L2103 HydrophobicContact CD2-CD1 4.34Å; L2100-L2103 WeakPolarHBondContact O-CB 3.37Å; L2100-L2103 PolarHBondContact O-N 2.95Å; L2100-I2121 HydrophobicContact CB-CD1 4.45Å; L2100-I2121 HydrophobicContact CD2-CD1 3.61Å; L2100-V2143 HydrophobicContact CD2-CB 4.13Å; L2100-V2143 HydrophobicContact CD2-CG1 3.96Å; L2100-V2143 HydrophobicContact CD2-CG2 4.11Å
2101	T	81.7	Confident	76	Confident	28.75 Å²	28.75	41.3 Å²	41.3	18%	0.176	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-61.5	-23.8	-179.6	59.3	0	0	0	0	113	I2058 D2099 L2103 S2104	I2058-T2101 WeakPolarHBondContact O-CA 3.14Å; D2099-T2101 VanDerWaalsContact OD1-CB 3.29Å; D2099-T2101 WeakPolarHBondContact OD1-CB 3.37Å; D2099-T2101 VanDerWaalsContact OD1-CG2 3.3Å; D2099-T2101 WeakPolarHBondContact OD1-CG2 3.27Å; D2099-T2101 PolarHBondContact OD1-N 3.01Å; D2099-T2101 PolarHBondContact OD1-OG1 3.11Å; D2099-T2101 PolarHBondContact OD2-OG1 3.41Å; T2101-L2103 PolarHBondContact O-N 3.3Å; T2101-L2103 VanDerWaalsContact O-N 3.16Å; T2101-S2104 VanDerWaalsContact O-CB 3.26Å; T2101-S2104 WeakPolarHBondContact O-CB 3.37Å; T2101-S2104 PolarHBondContact O-N 3.03Å; T2101-S2104 PolarHBondContact O-OG 2.99Å; T2101-S2104 VanDerWaalsContact O-OG 3.12Å
2102	T	79.8	Confident	74.2	Confident	72.5 Å²	72.5	45.9 Å²	45.9	45%	0.445	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-62.8	-20.8	173.3	56.1	0	0	0	0	113.3	D2099 L2100 H2105 I2121	D2099-T2102 PolarHBondContact O-OG1 2.85Å; L2100-T2102 PolarHBondContact O-N 2.91Å; L2100-T2102 VanDerWaalsContact O-N 3.14Å; T2102-H2105 PolarHBondContact O-CE1 3.19Å; T2102-H2105 PolarHBondContact O-ND1 3.04Å; T2102-I2121 VanDerWaalsContact OG1-CD1 3.25Å; T2102-I2121 WeakPolarHBondContact OG1-CD1 3.43Å; T2102-I2121 VanDerWaalsContact OG1-CG1 3.27Å; T2102-I2121 WeakPolarHBondContact OG1-CG1 3.35Å
2103	L	78.9	Confident	72	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-87.5	-0.8	176.8	-61.7	168	0	0	0	113.2	I2058 L2100 T2101 H2105 L2106 F2107 F2118 I2121 V2143 P2145	I2058-L2103 HydrophobicContact CD1-CB 3.94Å; L2100-L2103 HydrophobicContact CB-CD1 4.45Å; L2100-L2103 HydrophobicContact CD2-CD1 4.34Å; L2100-L2103 WeakPolarHBondContact O-CB 3.37Å; L2100-L2103 PolarHBondContact O-N 2.95Å; T2101-L2103 PolarHBondContact O-N 3.3Å; T2101-L2103 VanDerWaalsContact O-N 3.16Å; L2103-H2105 VanDerWaalsContact C-N 3.27Å; L2103-H2105 PolarHBondContact O-N 2.99Å; L2103-L2106 HydrophobicContact CB-CD1 4.34Å; L2103-L2106 HydrophobicContact CD2-CD1 3.9Å; L2103-L2106 VanDerWaalsContact O-CB 3.32Å; L2103-L2106 WeakPolarHBondContact O-CB 3.36Å; L2103-L2106 WeakPolarHBondContact O-CG 3.3Å; L2103-L2106 PolarHBondContact O-N 2.96Å; L2103-L2106 VanDerWaalsContact O-N 3.11Å; L2103-F2107 VanDerWaalsContact O-CD2 3.3Å; L2103-F2107 WeakPolarHBondContact O-CD2 3.14Å; L2103-F2107 WeakPolarHBondContact O-CE2 3.23Å; L2103-F2118 WeakPolarHBondContact CD2-O 3.28Å; L2103-I2121 HydrophobicContact CD1-CD1 3.56Å; L2103-I2121 VanDerWaalsContact CD1-CD1 3.48Å; L2103-I2121 HydrophobicContact CD1-CG1 4.03Å; L2103-I2121 HydrophobicContact CD2-CD1 4.41Å; L2103-I2121 HydrophobicContact CD2-CG1 4.11Å; L2103-I2121 HydrophobicContact CG-CD1 3.69Å; L2103-I2121 HydrophobicContact CG-CG1 3.91Å; L2103-V2143 HydrophobicContact CD1-CG1 4.36Å; L2103-P2145 HydrophobicContact CB-CG 4.38Å; L2103-P2145 HydrophobicContact CD1-CG 3.74Å; L2103-P2145 HydrophobicContact CD2-CG 3.97Å; L2103-P2145 HydrophobicContact CG-CG 4.29Å
2104	S	76.2	Confident	69.9	Low	35.25 Å²	35.25	53.2 Å²	53.2	25%	0.247	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-60	-28.8	-175.2	59.1	0	0	0	0	115.2	I2058 T2101 L2106 F2107 S2108	I2058-S2104 VanDerWaalsContact CG2-CA 3.43Å; T2101-S2104 VanDerWaalsContact O-CB 3.26Å; T2101-S2104 WeakPolarHBondContact O-CB 3.37Å; T2101-S2104 PolarHBondContact O-N 3.03Å; T2101-S2104 PolarHBondContact O-OG 2.99Å; T2101-S2104 VanDerWaalsContact O-OG 3.12Å; S2104-L2106 VanDerWaalsContact C-N 3.25Å; S2104-L2106 PolarHBondContact O-N 3.14Å; S2104-F2107 PolarHBondContact O-N 3.13Å; S2104-F2107 VanDerWaalsContact O-N 3.13Å; S2104-S2108 PolarHBondContact O-N 3.03Å; S2104-S2108 PolarHBondContact O-OG 3.03Å; S2104-S2108 VanDerWaalsContact O-OG 3.08Å
2105	H	70.7	Confident	67.8	Low	39.75 Å²	39.75	59.2 Å²	59.2	18%	0.184	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-60.2	-29.8	174.8	65.1	-79.4	0	0	0	112.8	T2102 L2103 F2107 S2108 E2117 F2118	T2102-H2105 PolarHBondContact O-CE1 3.19Å; T2102-H2105 PolarHBondContact O-ND1 3.04Å; L2103-H2105 VanDerWaalsContact C-N 3.27Å; L2103-H2105 PolarHBondContact O-N 2.99Å; H2105-F2107 PolarHBondContact O-N 2.98Å; H2105-F2107 VanDerWaalsContact O-N 3.14Å; H2105-S2108 PolarHBondContact O-N 3.1Å; H2105-E2117 HydrophobicContact CB-CB 4.42Å; H2105-E2117 HydrophobicContact CB-CG 4.49Å; H2105-E2117 WeakPolarHBondContact CB-OE2 3.37Å; H2105-E2117 VanDerWaalsContact CD2-CB 3.44Å; H2105-E2117 WeakPolarHBondContact CD2-CB 3.23Å; H2105-E2117 IonicContact CD2-OE2 2.98Å; H2105-E2117 PolarHBondContact CD2-OE2 3.4Å; H2105-E2117 IonicContact CG-OE2 2.91Å; H2105-E2117 WeakPolarHBondContact NE2-CB 3.48Å; H2105-F2118 PolarHBondContact CE1-N 2.83Å; H2105-F2118 PolarHBondContact CE1-O 3.08Å; H2105-F2118 VanDerWaalsContact CE1-O 3.28Å; H2105-F2118 PolarHBondContact NE2-N 3.02Å; H2105-F2118 PolarHBondContact NE2-O 3.23Å
2106	L	69.2	Low	65.7	Low	20.25 Å²	20.25	63.8 Å²	63.8	11%	0.106	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-70.1	-9.8	177.9	-57	175.6	0	0	0	113.7	L2103 S2104 P2145 I2147 I2149	L2103-L2106 HydrophobicContact CB-CD1 4.34Å; L2103-L2106 HydrophobicContact CD2-CD1 3.9Å; L2103-L2106 VanDerWaalsContact O-CB 3.32Å; L2103-L2106 WeakPolarHBondContact O-CB 3.36Å; L2103-L2106 WeakPolarHBondContact O-CG 3.3Å; L2103-L2106 PolarHBondContact O-N 2.96Å; L2103-L2106 VanDerWaalsContact O-N 3.11Å; S2104-L2106 VanDerWaalsContact C-N 3.25Å; S2104-L2106 PolarHBondContact O-N 3.14Å; L2106-P2145 HydrophobicContact CD1-CB 4.18Å; L2106-P2145 HydrophobicContact CD1-CG 3.79Å; L2106-I2147 HydrophobicContact CB-CD1 3.68Å; L2106-I2147 HydrophobicContact CD1-CD1 4.31Å; L2106-I2149 HydrophobicContact CD1-CD1 4.22Å; L2106-I2149 HydrophobicContact CD2-CB 4.46Å; L2106-I2149 HydrophobicContact CD2-CD1 3.56Å; L2106-I2149 HydrophobicContact CD2-CG1 3.86Å; L2106-I2149 HydrophobicContact CD2-CG2 3.92Å; L2106-I2149 HydrophobicContact CG-CD1 4.32Å
2107	F	68.5	Low	64.1	Low	54.5 Å²	54.5	67 Å²	67	24%	0.239	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-124.8	4.6	-174.8	-57.2	-95.4	0	0	0	112.9	F1929 L2055 I2058 L2103 S2104 H2105 P2145 I2147	F1929-F2107 HydrophobicContact CB-CE1 3.77Å; F1929-F2107 HydrophobicContact CB-CZ 3.95Å; F1929-F2107 HydrophobicContact CD1-CE1 4.28Å; F1929-F2107 AromaticContact CD1-CZ 3.94Å; F1929-F2107 HydrophobicContact CD1-CZ 3.99Å; F1929-F2107 HydrophobicContact CD2-CE1 4.39Å; F1929-F2107 AromaticContact CD2-CZ 3.77Å; F1929-F2107 HydrophobicContact CD2-CZ 3.77Å; F1929-F2107 HydrophobicContact CE1-CZ 4.37Å; F1929-F2107 HydrophobicContact CE2-CZ 4.23Å; F1929-F2107 AromaticContact CG-CE1 3.94Å; F1929-F2107 HydrophobicContact CG-CE1 3.94Å; F1929-F2107 AromaticContact CG-CZ 3.63Å; F1929-F2107 HydrophobicContact CG-CZ 3.63Å; F1929-F2107 HydrophobicContact CZ-CZ 4.45Å; L2055-F2107 HydrophobicContact CD1-CB 4.24Å; L2055-F2107 HydrophobicContact CD1-CD1 3.34Å; L2055-F2107 VanDerWaalsContact CD1-CD1 3.43Å; L2055-F2107 HydrophobicContact CD1-CD2 4.4Å; L2055-F2107 HydrophobicContact CD1-CE1 3.52Å; L2055-F2107 VanDerWaalsContact CD1-CE1 3.4Å; L2055-F2107 HydrophobicContact CD1-CG 3.87Å; L2055-F2107 HydrophobicContact CD1-CZ 4.25Å; I2058-F2107 HydrophobicContact CD1-CD2 3.84Å; I2058-F2107 HydrophobicContact CD1-CE1 4.15Å; I2058-F2107 HydrophobicContact CD1-CE2 3.26Å; I2058-F2107 HydrophobicContact CD1-CG 4.33Å; I2058-F2107 HydrophobicContact CD1-CZ 3.48Å; I2058-F2107 VanDerWaalsContact CD1-CZ 3.48Å; I2058-F2107 HydrophobicContact CG1-CE2 4.38Å; I2058-F2107 HydrophobicContact CG2-CD2 4.08Å; I2058-F2107 HydrophobicContact CG2-CE2 4.24Å; L2103-F2107 VanDerWaalsContact O-CD2 3.3Å; L2103-F2107 WeakPolarHBondContact O-CD2 3.14Å; L2103-F2107 WeakPolarHBondContact O-CE2 3.23Å; S2104-F2107 PolarHBondContact O-N 3.13Å; S2104-F2107 VanDerWaalsContact O-N 3.13Å; H2105-F2107 PolarHBondContact O-N 2.98Å; H2105-F2107 VanDerWaalsContact O-N 3.14Å; F2107-P2145 HydrophobicContact CZ-CB 4.47Å; F2107-I2147 HydrophobicContact CD1-CD1 4.14Å; F2107-I2147 HydrophobicContact CD2-CD1 4.49Å; F2107-I2147 HydrophobicContact CE1-CD1 3.28Å; F2107-I2147 HydrophobicContact CE1-CG1 4.43Å; F2107-I2147 HydrophobicContact CE2-CD1 3.98Å; F2107-I2147 HydrophobicContact CZ-CD1 3.34Å; F2107-I2147 VanDerWaalsContact CZ-CD1 3.41Å
2108	S	59.5	Low	62.8	Low	75.75 Å²	75.75	71.8 Å²	71.8	53%	0.53	39%	0.39	S	S	.	.	S	Bend	trans	-108.3	157.3	-179.7	-57.3	0	0	0	0	110.5	S2104 H2105	S2104-S2108 PolarHBondContact O-N 3.03Å; S2104-S2108 PolarHBondContact O-OG 3.03Å; S2104-S2108 VanDerWaalsContact O-OG 3.08Å; H2105-S2108 PolarHBondContact O-N 3.1Å
2109	D	49.8	Very low	62.1	Low	113.5 Å²	113.5	76 Å²	76	61%	0.607	41%	0.412	S	S	*	.			trans	-54.7	135.1	-172.8	-80.3	-49.9	0	0	0	113.6	I2111 H2153	D2109-I2111 PolarHBondContact O-N 3.08Å; D2109-H2153 IonicContact OD1-CE1 2.98Å; D2109-H2153 PolarHBondContact OD1-CE1 3.33Å; D2109-H2153 IonicContact OD1-CG 2.84Å; D2109-H2153 IonicContact OD1-ND1 3.41Å; D2109-H2153 PolarHBondContact OD1-ND1 3.15Å; D2109-H2153 IonicContact OD2-CE1 2.64Å; D2109-H2153 IonicContact OD2-ND1 3.11Å
2110	P	45.9	Very low	62	Low	89.25 Å²	89.25	76.8 Å²	76.8	58%	0.58	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	6.1	-169.5	20	-22.3	0	0	0	114.7	H2112 S2113	P2110-H2112 PolarHBondContact O-N 3Å; P2110-S2113 PolarHBondContact O-N 3.34Å
2111	I	46.7	Very low	62	Low	123.5 Å²	123.5	77.4 Å²	77.4	63%	0.633	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-17.2	-169	-58.5	176.3	0	0	0	112	D2109	D2109-I2111 PolarHBondContact O-N 3.08Å
2112	H	43.5	Very low	62.3	Low	165.5 Å²	165.5	81.2 Å²	81.2	77%	0.766	43%	0.429	S	S	*	.	S	Bend	trans	-134.4	10.7	-175.7	-65.1	-40.2	0	0	0	116.2	P2110 T2114	P2110-H2112 PolarHBondContact O-N 3Å; H2112-T2114 PolarHBondContact O-N 3.09Å; H2112-T2114 VanDerWaalsContact O-N 3.07Å
2113	S	39.5	Very low	62.8	Low	64.5 Å²	64.5	78.7 Å²	78.7	45%	0.451	42%	0.418	S	S	.	.			trans	-68.7	117.5	177.1	161.6	0	0	0	0	110.8	P2110 N2115 E2117	P2110-S2113 PolarHBondContact O-N 3.34Å; S2113-N2115 PolarHBondContact O-N 3.17Å; S2113-N2115 PolarHBondContact O-OD1 3.19Å; S2113-E2117 WeakPolarHBondContact CA-OE1 3.37Å; S2113-E2117 WeakPolarHBondContact CB-OE1 3.46Å; S2113-E2117 WeakPolarHBondContact CB-OE2 3.31Å; S2113-E2117 PolarHBondContact OG-OE2 3.17Å
2114	T	41.7	Very low	63.4	Low	98.25 Å²	98.25	83.6 Å²	83.6	60%	0.603	44%	0.436	S	S	*	.			trans	-90.6	107.2	174.9	55.6	0	0	0	0	110	H2112 N2116 E2117	H2112-T2114 PolarHBondContact O-N 3.09Å; H2112-T2114 VanDerWaalsContact O-N 3.07Å; T2114-N2116 WeakPolarHBondContact O-CB 3.46Å; T2114-N2116 PolarHBondContact O-N 3.12Å; T2114-E2117 WeakPolarHBondContact CA-OE1 3.34Å; T2114-E2117 PolarHBondContact N-OE1 3.27Å; T2114-E2117 WeakPolarHBondContact O-CG 3.13Å; T2114-E2117 PolarHBondContact OG1-OE1 2.86Å
2115	N	43.1	Very low	64.2	Low	126.25 Å²	126.25	84.1 Å²	84.1	68%	0.675	43%	0.433	S	S	*	.	S	Bend	trans	-1.9	13.8	169	-62	-24.6	0	0	0	118.7	S2113 Q2184 I2185 K2186 P2187	S2113-N2115 PolarHBondContact O-N 3.17Å; S2113-N2115 PolarHBondContact O-OD1 3.19Å; N2115-Q2184 PolarHBondContact ND2-O 3.29Å; N2115-I2185 HydrophobicContact CB-CB 4.05Å; N2115-I2185 HydrophobicContact CB-CG1 4.48Å; N2115-I2185 HydrophobicContact CB-CG2 3.42Å; N2115-I2185 VanDerWaalsContact CB-CG2 3.42Å; N2115-I2185 VanDerWaalsContact CG-CA 3.43Å; N2115-I2185 VanDerWaalsContact ND2-CA 3.32Å; N2115-I2185 WeakPolarHBondContact ND2-CA 3.43Å; N2115-I2185 WeakPolarHBondContact OD1-CB 3.48Å; N2115-I2185 WeakPolarHBondContact OD1-CD1 3.49Å; N2115-I2185 WeakPolarHBondContact OD1-CG1 3.2Å; N2115-I2185 WeakPolarHBondContact OD1-CG2 3.39Å; N2115-K2186 CarbonylContact O-C 3.55Å; N2115-P2187 WeakPolarHBondContact O-CB 3.17Å; N2115-P2187 WeakPolarHBondContact O-CD 3.21Å; N2115-P2187 WeakPolarHBondContact O-CG 3.48Å
2116	N	45.9	Very low	65.1	Low	122.5 Å²	122.5	85.5 Å²	85.5	66%	0.655	44%	0.44	S	S	*	.			trans	-137.4	19.8	-164.7	-121.5	14.2	0	0	0	113.9	T2114 F2188	T2114-N2116 WeakPolarHBondContact O-CB 3.46Å; T2114-N2116 PolarHBondContact O-N 3.12Å; N2116-F2188 WeakPolarHBondContact OD1-CD2 3.3Å
2117	E	56.6	Low	66.1	Low	66 Å²	66	84.5 Å²	84.5	31%	0.308	44%	0.435	S	S	.	.			trans	-99	153.9	-166.3	-63.2	166.3	-177.4	0	0	113.2	H2105 S2113 T2114 N2119	H2105-E2117 HydrophobicContact CB-CB 4.42Å; H2105-E2117 HydrophobicContact CB-CG 4.49Å; H2105-E2117 WeakPolarHBondContact CB-OE2 3.37Å; H2105-E2117 VanDerWaalsContact CD2-CB 3.44Å; H2105-E2117 WeakPolarHBondContact CD2-CB 3.23Å; H2105-E2117 IonicContact CD2-OE2 2.98Å; H2105-E2117 PolarHBondContact CD2-OE2 3.4Å; H2105-E2117 IonicContact CG-OE2 2.91Å; H2105-E2117 WeakPolarHBondContact NE2-CB 3.48Å; S2113-E2117 WeakPolarHBondContact CA-OE1 3.37Å; S2113-E2117 WeakPolarHBondContact CB-OE1 3.46Å; S2113-E2117 WeakPolarHBondContact CB-OE2 3.31Å; S2113-E2117 PolarHBondContact OG-OE2 3.17Å; T2114-E2117 WeakPolarHBondContact CA-OE1 3.34Å; T2114-E2117 PolarHBondContact N-OE1 3.27Å; T2114-E2117 WeakPolarHBondContact O-CG 3.13Å; T2114-E2117 PolarHBondContact OG1-OE1 2.86Å; E2117-N2119 PolarHBondContact O-N 3.06Å; E2117-N2119 VanDerWaalsContact O-N 3.14Å; E2117-N2119 PolarHBondContact O-OD1 3.22Å
2118	F	62.1	Low	67	Low	150.25 Å²	150.25	83.8 Å²	83.8	66%	0.659	43%	0.433	S	S	*	.			trans	-82	95.2	-168.3	-79.4	-87.7	0	0	0	113.2	L2103 H2105 Q2120	L2103-F2118 WeakPolarHBondContact CD2-O 3.28Å; H2105-F2118 PolarHBondContact CE1-N 2.83Å; H2105-F2118 PolarHBondContact CE1-O 3.08Å; H2105-F2118 VanDerWaalsContact CE1-O 3.28Å; H2105-F2118 PolarHBondContact NE2-N 3.02Å; H2105-F2118 PolarHBondContact NE2-O 3.23Å; F2118-Q2120 PolarHBondContact O-N 3.04Å; F2118-Q2120 VanDerWaalsContact O-N 3.12Å
2119	N	73.3	Confident	68.1	Low	87.5 Å²	87.5	80.7 Å²	80.7	47%	0.468	41%	0.411	S	S	.	.	S	Bend	trans	-66.1	-7	178	-62.1	-16.1	0	0	0	115.3	E2117 I2149	E2117-N2119 PolarHBondContact O-N 3.06Å; E2117-N2119 VanDerWaalsContact O-N 3.14Å; E2117-N2119 PolarHBondContact O-OD1 3.22Å; N2119-I2149 HydrophobicContact CB-CD1 4.17Å; N2119-I2149 VanDerWaalsContact OD1-CD1 3.26Å; N2119-I2149 WeakPolarHBondContact OD1-CD1 3.33Å
2120	Q	82.5	Confident	69.3	Low	78 Å²	78	78.5 Å²	78.5	36%	0.364	40%	0.399	S	S	.	.	S	Bend	trans	-154	151.9	174.8	64.1	178.2	34.7	0	0	110.2	F2118 K2144	F2118-Q2120 PolarHBondContact O-N 3.04Å; F2118-Q2120 VanDerWaalsContact O-N 3.12Å; Q2120-K2144 HydrophobicContact CB-CB 4.07Å; Q2120-K2144 HydrophobicContact CB-CG 4.21Å
2121	I	85.9	Confident	70.5	Confident	13.5 Å²	13.5	79.1 Å²	79.1	7%	0.069	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	129.6	166.9	-65.7	167.5	0	0	0	107.7	V2098 D2099 L2100 T2102 L2103 Y2125 G2142 V2143	V2098-I2121 HydrophobicContact CG1-CD1 4.35Å; V2098-I2121 HydrophobicContact CG1-CG2 3.91Å; D2099-I2121 VanDerWaalsContact O-CD1 3.27Å; D2099-I2121 WeakPolarHBondContact O-CD1 3.31Å; L2100-I2121 HydrophobicContact CB-CD1 4.45Å; L2100-I2121 HydrophobicContact CD2-CD1 3.61Å; T2102-I2121 VanDerWaalsContact OG1-CD1 3.25Å; T2102-I2121 WeakPolarHBondContact OG1-CD1 3.43Å; T2102-I2121 VanDerWaalsContact OG1-CG1 3.27Å; T2102-I2121 WeakPolarHBondContact OG1-CG1 3.35Å; L2103-I2121 HydrophobicContact CD1-CD1 3.56Å; L2103-I2121 VanDerWaalsContact CD1-CD1 3.48Å; L2103-I2121 HydrophobicContact CD1-CG1 4.03Å; L2103-I2121 HydrophobicContact CD2-CD1 4.41Å; L2103-I2121 HydrophobicContact CD2-CG1 4.11Å; L2103-I2121 HydrophobicContact CG-CD1 3.69Å; L2103-I2121 HydrophobicContact CG-CG1 3.91Å; I2121-Y2125 WeakPolarHBondContact CG2-OH 3.36Å; I2121-G2142 CarbonylContact O-C 3.53Å; I2121-G2142 VanDerWaalsContact O-CA 3.29Å; I2121-G2142 WeakPolarHBondContact O-CA 3.35Å; I2121-V2143 HydrophobicContact CB-CB 4.41Å; I2121-V2143 PolarHBondContact N-O 3.03Å; I2121-V2143 PolarHBondContact O-N 2.98Å
2122	Y	89.2	Confident	71.7	Confident	109 Å²	109	77.4 Å²	77.4	43%	0.427	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	117.6	174	-173.2	-93.3	0	0	0	109.6	I1934 E1936 L2140 I2141	I1934-Y2122 HydrophobicContact CB-CE2 4.41Å; I1934-Y2122 HydrophobicContact CD1-CE2 4.05Å; I1934-Y2122 HydrophobicContact CG2-CE2 4.23Å; E1936-Y2122 PolarHBondContact OE2-OH 3.06Å; Y2122-L2140 HydrophobicContact CD1-CD1 4.24Å; Y2122-L2140 HydrophobicContact CE1-CD1 3.95Å; Y2122-L2140 HydrophobicContact CE1-CD2 4.3Å; Y2122-L2140 HydrophobicContact CE1-CG 4.12Å; Y2122-L2140 HydrophobicContact CE2-CD1 4.42Å; Y2122-L2140 HydrophobicContact CE2-CG 4.46Å; Y2122-I2141 WeakPolarHBondContact CA-O 3.23Å
2123	G	90.1	Very high	73	Confident	19.25 Å²	19.25	71.4 Å²	71.4	20%	0.198	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.5	176.2	-173.8	0	0	0	0	0	115.2	Y2125 L2140 I2141	G2123-Y2125 VanDerWaalsContact O-CD2 3.28Å; G2123-Y2125 WeakPolarHBondContact O-CD2 3.37Å; G2123-Y2125 VanDerWaalsContact O-CE2 3.24Å; G2123-Y2125 WeakPolarHBondContact O-CE2 3.2Å; G2123-L2140 VanDerWaalsContact C-CD1 3.49Å; G2123-L2140 WeakPolarHBondContact O-CA 3.38Å; G2123-L2140 VanDerWaalsContact O-CD1 3.31Å; G2123-L2140 WeakPolarHBondContact O-CD1 3.24Å; G2123-I2141 PolarHBondContact N-O 3.04Å; G2123-I2141 PolarHBondContact O-N 3.03Å
2124	W	92	Very high	74.8	Confident	102.5 Å²	102.5	71.5 Å²	71.5	39%	0.388	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132	176	-71.4	99.7	0	0	0	111.1	K1937 Y1939 Q2138 I2139 L2140	K1937-W2124 HydrophobicContact CD-CH2 3.91Å; K1937-W2124 HydrophobicContact CD-CZ2 4.26Å; K1937-W2124 VanDerWaalsContact CE-CZ2 3.5Å; K1937-W2124 HydrophobicContact CG-CH2 3.79Å; K1937-W2124 HydrophobicContact CG-CZ2 4.39Å; Y1939-W2124 AromaticContact CD2-CH2 3.18Å; Y1939-W2124 HydrophobicContact CD2-CH2 3.18Å; Y1939-W2124 AromaticContact CD2-CZ2 3.84Å; Y1939-W2124 HydrophobicContact CD2-CZ2 3.84Å; Y1939-W2124 AromaticContact CD2-CZ3 3.72Å; Y1939-W2124 HydrophobicContact CD2-CZ3 3.72Å; Y1939-W2124 AromaticContact CE2-CH2 3.33Å; Y1939-W2124 HydrophobicContact CE2-CH2 3.33Å; Y1939-W2124 VanDerWaalsContact CE2-CH2 3.44Å; Y1939-W2124 AromaticContact CE2-CZ2 3.67Å; Y1939-W2124 HydrophobicContact CE2-CZ2 3.67Å; Y1939-W2124 HydrophobicContact CE2-CZ3 4.31Å; Y1939-W2124 HydrophobicContact CG-CH2 4.29Å; W2124-Q2138 HydrophobicContact CE3-CB 3.93Å; W2124-Q2138 HydrophobicContact CZ3-CB 4.43Å; W2124-I2139 CarbonylContact C-O 3.57Å; W2124-I2139 WeakPolarHBondContact CA-O 3.39Å; W2124-I2139 VanDerWaalsContact CE3-C 3.48Å; W2124-L2140 HydrophobicContact CD2-CB 4.01Å; W2124-L2140 HydrophobicContact CD2-CD1 4.38Å; W2124-L2140 HydrophobicContact CE3-CB 3.88Å; W2124-L2140 HydrophobicContact CG-CD1 4.4Å; W2124-L2140 HydrophobicContact CH2-CB 3.87Å; W2124-L2140 HydrophobicContact CH2-CD2 4.42Å; W2124-L2140 HydrophobicContact CZ2-CB 4.02Å; W2124-L2140 HydrophobicContact CZ2-CD2 3.95Å; W2124-L2140 HydrophobicContact CZ2-CG 4.41Å; W2124-L2140 HydrophobicContact CZ3-CB 3.81Å
2125	Y	92	Very high	76.8	Confident	47.5 Å²	47.5	70.5 Å²	70.5	19%	0.186	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	139.2	178.2	-63.6	-86.6	0	0	0	110.1	T2097 V2098 I2121 G2123 Q2138 I2139 I2141	T2097-Y2125 WeakPolarHBondContact O-CD1 3.22Å; V2098-Y2125 HydrophobicContact CB-CE1 4.23Å; V2098-Y2125 HydrophobicContact CG1-CE1 4.09Å; V2098-Y2125 HydrophobicContact CG1-CE2 4.4Å; V2098-Y2125 HydrophobicContact CG2-CD1 4.07Å; V2098-Y2125 HydrophobicContact CG2-CD2 4.01Å; V2098-Y2125 HydrophobicContact CG2-CE1 3.96Å; V2098-Y2125 HydrophobicContact CG2-CE2 3.9Å; V2098-Y2125 HydrophobicContact CG2-CG 4.11Å; I2121-Y2125 WeakPolarHBondContact CG2-OH 3.36Å; G2123-Y2125 VanDerWaalsContact O-CD2 3.28Å; G2123-Y2125 WeakPolarHBondContact O-CD2 3.37Å; G2123-Y2125 VanDerWaalsContact O-CE2 3.24Å; G2123-Y2125 WeakPolarHBondContact O-CE2 3.2Å; Y2125-Q2138 CarbonylContact O-C 3.51Å; Y2125-Q2138 VanDerWaalsContact O-CA 3.28Å; Y2125-Q2138 WeakPolarHBondContact O-CA 3.32Å; Y2125-I2139 PolarHBondContact N-O 3.17Å; Y2125-I2139 PolarHBondContact O-N 3.12Å; Y2125-I2141 HydrophobicContact CD2-CB 3.87Å; Y2125-I2141 HydrophobicContact CD2-CD1 4.26Å; Y2125-I2141 HydrophobicContact CD2-CG1 4.25Å; Y2125-I2141 HydrophobicContact CE2-CB 4.03Å
2126	H	90.8	Very high	78.6	Confident	68.5 Å²	68.5	64.9 Å²	64.9	32%	0.317	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	134.5	173.7	-65.5	-64.6	0	0	0	110.7	L2128 P2135 Q2138	H2126-L2128 HydrophobicContact CB-CD2 4.06Å; H2126-L2128 PolarHBondContact O-N 2.87Å; H2126-P2135 HydrophobicContact CB-CB 4.43Å; H2126-Q2138 PolarHBondContact CE1-NE2 3.18Å
2127	V	90	Very high	80.7	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	102	170.1	-179.7	0	0	0	0	106.7	L1941 V2070 I2093 A2096 P2135 S2136 G2137 I2139	L1941-V2127 HydrophobicContact CD2-CB 4.42Å; L1941-V2127 HydrophobicContact CD2-CG1 4.44Å; L1941-V2127 HydrophobicContact CD2-CG2 4.06Å; V2070-V2127 HydrophobicContact CB-CG1 4.11Å; V2070-V2127 HydrophobicContact CG2-CG1 3.93Å; V2070-V2127 HydrophobicContact CG2-CG2 3.98Å; I2093-V2127 HydrophobicContact CG2-CG1 4.28Å; A2096-V2127 HydrophobicContact CB-CG2 4.47Å; V2127-P2135 CarbonylContact O-C 3.58Å; V2127-S2136 WeakPolarHBondContact O-CA 3.49Å; V2127-S2136 PolarHBondContact O-N 3.09Å; V2127-G2137 PolarHBondContact N-O 2.88Å; V2127-I2139 HydrophobicContact CG2-CB 4.04Å; V2127-I2139 HydrophobicContact CG2-CG2 3.8Å
2128	L	86.9	Confident	82.3	Confident	39.75 Å²	39.75	59.8 Å²	59.8	21%	0.208	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	130.5	-177.4	-59.5	-177.8	0	0	0	110.6	G2094 I2095 H2126 N2130 P2135 N2239	G2094-L2128 CarbonylContact C-O 3.49Å; G2094-L2128 WeakPolarHBondContact CA-O 3.47Å; I2095-L2128 PolarHBondContact N-O 3.24Å; I2095-L2128 PolarHBondContact O-N 2.94Å; H2126-L2128 HydrophobicContact CB-CD2 4.06Å; H2126-L2128 PolarHBondContact O-N 2.87Å; L2128-N2130 PolarHBondContact O-N 3.12Å; L2128-P2135 HydrophobicContact CD2-CB 4.42Å; L2128-P2135 HydrophobicContact CD2-CG 4.33Å; L2128-N2239 WeakPolarHBondContact CD1-OD1 3.48Å
2129	N	83.1	Confident	83.8	Confident	10.5 Å²	10.5	52.7 Å²	52.7	6%	0.056	28%	0.284	C	S	.	.			trans	-63.8	131.6	172.3	-164.1	-39.8	0	0	0	109.8	I2093 D2131 T2132 G2133 C2134 S2136	I2093-N2129 PolarHBondContact O-ND2 2.9Å; N2129-D2131 VanDerWaalsContact C-N 3.25Å; N2129-D2131 PolarHBondContact O-N 3.13Å; N2129-D2131 PolarHBondContact OD1-N 3.31Å; N2129-T2132 VanDerWaalsContact CB-OG1 3.28Å; N2129-T2132 WeakPolarHBondContact CB-OG1 3.29Å; N2129-T2132 PolarHBondContact ND2-OG1 2.83Å; N2129-G2133 VanDerWaalsContact O-CA 3.3Å; N2129-G2133 WeakPolarHBondContact O-CA 3.32Å; N2129-G2133 PolarHBondContact O-N 3.18Å; N2129-C2134 WeakPolarHBondContact CB-O 3.43Å; N2129-C2134 PolarHBondContact N-O 3.1Å; N2129-S2136 VanDerWaalsContact CB-OG 3.29Å; N2129-S2136 WeakPolarHBondContact CB-OG 3.24Å; N2129-S2136 PolarHBondContact ND2-OG 3.41Å; N2129-S2136 VanDerWaalsContact ND2-OG 3.1Å
2130	N	73.7	Confident	84.8	Confident	67 Å²	67	48.9 Å²	48.9	36%	0.358	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-33.8	177.5	-176	77.7	0	0	0	112.4	L2092 L2128	L2092-N2130 HydrophobicContact CD2-CB 4.14Å; L2128-N2130 PolarHBondContact O-N 3.12Å
2131	D	72.2	Confident	85.3	Confident	101.75 Å²	101.75	45.3 Å²	45.3	54%	0.544	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-29.2	-169.8	-56	-26.6	0	0	0	112.8	N2129	N2129-D2131 VanDerWaalsContact C-N 3.25Å; N2129-D2131 PolarHBondContact O-N 3.13Å; N2129-D2131 PolarHBondContact OD1-N 3.31Å
2132	T	71.4	Confident	85.4	Confident	87.5 Å²	87.5	44.7 Å²	44.7	54%	0.537	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-13.9	-177	66	0	0	0	0	114.2	N2129 C2134	N2129-T2132 VanDerWaalsContact CB-OG1 3.28Å; N2129-T2132 WeakPolarHBondContact CB-OG1 3.29Å; N2129-T2132 PolarHBondContact ND2-OG1 2.83Å; T2132-C2134 PolarHBondContact O-N 3.21Å; T2132-C2134 VanDerWaalsContact O-N 3.08Å; T2132-C2134 WeakPolarHBondContact OG1-CB 3.33Å; T2132-C2134 PolarHBondContact OG1-N 3.23Å; T2132-C2134 PolarHBondContact OG1-SG 3.11Å
2133	G	71.8	Confident	85.4	Confident	38.75 Å²	38.75	39.5 Å²	39.5	40%	0.399	22%	0.224	S	C	.	.			trans	66.1	-1.6	-169.6	0	0	0	0	0	114.4	N2129	N2129-G2133 VanDerWaalsContact O-CA 3.3Å; N2129-G2133 WeakPolarHBondContact O-CA 3.32Å; N2129-G2133 PolarHBondContact O-N 3.18Å
2134	C	77.2	Confident	85.1	Confident	67.75 Å²	67.75	41.1 Å²	41.1	46%	0.458	23%	0.226	S	C	.	.			trans	-77.3	147	-178.4	-56.1	0	0	0	0	111.4	N2129 T2132 S2136	N2129-C2134 WeakPolarHBondContact CB-O 3.43Å; N2129-C2134 PolarHBondContact N-O 3.1Å; T2132-C2134 PolarHBondContact O-N 3.21Å; T2132-C2134 VanDerWaalsContact O-N 3.08Å; T2132-C2134 WeakPolarHBondContact OG1-CB 3.33Å; T2132-C2134 PolarHBondContact OG1-N 3.23Å; T2132-C2134 PolarHBondContact OG1-SG 3.11Å; C2134-S2136 PolarHBondContact O-N 3.08Å; C2134-S2136 VanDerWaalsContact O-N 3.13Å; C2134-S2136 PolarHBondContact O-OG 3.07Å
2135	P	82.2	Confident	84.6	Confident	76 Å²	76	36.8 Å²	36.8	49%	0.494	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	113.9	172.8	2.7	-0.4	0	0	0	111	H2126 V2127 L2128 G2137	H2126-P2135 HydrophobicContact CB-CB 4.43Å; V2127-P2135 CarbonylContact O-C 3.58Å; L2128-P2135 HydrophobicContact CD2-CB 4.42Å; L2128-P2135 HydrophobicContact CD2-CG 4.33Å; P2135-G2137 VanDerWaalsContact C-N 3.29Å
2136	S	82.5	Confident	83.6	Confident	8.75 Å²	8.75	36.2 Å²	36.2	6%	0.061	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	28	174.8	-62.6	0	0	0	0	111.8	L1941 R1942 I2093 V2127 N2129 C2134	L1941-S2136 CarbonylContact C-O 3.59Å; L1941-S2136 VanDerWaalsContact CA-O 3.28Å; L1941-S2136 WeakPolarHBondContact CA-O 3.4Å; R1942-S2136 PolarHBondContact N-O 3.13Å; R1942-S2136 VanDerWaalsContact N-O 3.09Å; I2093-S2136 PolarHBondContact O-OG 2.91Å; V2127-S2136 WeakPolarHBondContact O-CA 3.49Å; V2127-S2136 PolarHBondContact O-N 3.09Å; N2129-S2136 VanDerWaalsContact CB-OG 3.29Å; N2129-S2136 WeakPolarHBondContact CB-OG 3.24Å; N2129-S2136 PolarHBondContact ND2-OG 3.41Å; N2129-S2136 VanDerWaalsContact ND2-OG 3.1Å; C2134-S2136 PolarHBondContact O-N 3.08Å; C2134-S2136 VanDerWaalsContact O-N 3.13Å; C2134-S2136 PolarHBondContact O-OG 3.07Å
2137	G	88.8	Confident	82.4	Confident	8.5 Å²	8.5	34.4 Å²	34.4	9%	0.088	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	133.9	-171.8	177	0	0	0	0	0	113.8	Y1939 H1940 V2127 P2135	Y1939-G2137 WeakPolarHBondContact O-CA 3.35Å; H1940-G2137 VanDerWaalsContact O-CA 3.23Å; H1940-G2137 WeakPolarHBondContact O-CA 3.38Å; V2127-G2137 PolarHBondContact N-O 2.88Å; P2135-G2137 VanDerWaalsContact C-N 3.29Å
2138	Q	91.3	Very high	80.6	Confident	74.25 Å²	74.25	37.3 Å²	37.3	35%	0.347	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	147.4	176.3	-62.4	-177	6.3	0	0	111.4	A1938 Y1939 W2124 Y2125 H2126	A1938-Q2138 CarbonylContact C-O 3.5Å; A1938-Q2138 WeakPolarHBondContact CA-O 3.29Å; A1938-Q2138 VanDerWaalsContact CB-O 3.28Å; A1938-Q2138 WeakPolarHBondContact CB-O 3.36Å; Y1939-Q2138 PolarHBondContact N-O 2.99Å; Y1939-Q2138 PolarHBondContact O-N 2.94Å; W2124-Q2138 HydrophobicContact CE3-CB 3.93Å; W2124-Q2138 HydrophobicContact CZ3-CB 4.43Å; Y2125-Q2138 CarbonylContact O-C 3.51Å; Y2125-Q2138 VanDerWaalsContact O-CA 3.28Å; Y2125-Q2138 WeakPolarHBondContact O-CA 3.32Å; H2126-Q2138 PolarHBondContact CE1-NE2 3.18Å
2139	I	92.8	Very high	78.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	138	-179.9	-172.4	169.2	0	0	0	111.4	V1935 K1937 A1938 V1988 W2045 V2070 A2096 W2124 Y2125 V2127 I2141	V1935-I2139 HydrophobicContact CG1-CD1 3.89Å; V1935-I2139 HydrophobicContact CG1-CG1 4.43Å; K1937-I2139 CarbonylContact O-C 3.57Å; K1937-I2139 WeakPolarHBondContact O-CA 3.47Å; A1938-I2139 HydrophobicContact CB-CB 4.16Å; A1938-I2139 HydrophobicContact CB-CG1 4.2Å; V1988-I2139 HydrophobicContact CG1-CD1 4.22Å; V1988-I2139 HydrophobicContact CG2-CD1 3.76Å; W2045-I2139 HydrophobicContact CZ3-CD1 4.04Å; W2045-I2139 HydrophobicContact CZ3-CG1 4.37Å; V2070-I2139 HydrophobicContact CG2-CD1 4.23Å; A2096-I2139 HydrophobicContact CB-CG2 3.5Å; A2096-I2139 VanDerWaalsContact CB-CG2 3.49Å; W2124-I2139 CarbonylContact C-O 3.57Å; W2124-I2139 WeakPolarHBondContact CA-O 3.39Å; W2124-I2139 VanDerWaalsContact CE3-C 3.48Å; Y2125-I2139 PolarHBondContact N-O 3.17Å; Y2125-I2139 PolarHBondContact O-N 3.12Å; V2127-I2139 HydrophobicContact CG2-CB 4.04Å; V2127-I2139 HydrophobicContact CG2-CG2 3.8Å; I2139-I2141 HydrophobicContact CD1-CD1 4.36Å; I2139-I2141 HydrophobicContact CD1-CG1 4.38Å; I2139-I2141 HydrophobicContact CG1-CD1 4.33Å; I2139-I2141 HydrophobicContact CG1-CG1 4.02Å; I2139-I2141 HydrophobicContact CG2-CD1 3.71Å; I2139-I2141 HydrophobicContact CG2-CG1 4.1Å
2140	L	93.7	Very high	76.7	Confident	9 Å²	9	41.7 Å²	41.7	5%	0.047	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	113.7	179.4	-179.3	53.8	0	0	0	110.1	E1936 K1937 Y2122 G2123 W2124	E1936-L2140 HydrophobicContact CB-CB 4.34Å; E1936-L2140 HydrophobicContact CB-CD2 4.15Å; E1936-L2140 HydrophobicContact CB-CG 4.12Å; E1936-L2140 HydrophobicContact CG-CD2 4.3Å; E1936-L2140 PolarHBondContact N-O 2.99Å; E1936-L2140 WeakPolarHBondContact OE1-CD2 3.08Å; E1936-L2140 WeakPolarHBondContact OE2-CD2 3.49Å; K1937-L2140 HydrophobicContact CD-CD2 4.48Å; K1937-L2140 HydrophobicContact CG-CB 4.12Å; K1937-L2140 HydrophobicContact CG-CD2 4.08Å; K1937-L2140 PolarHBondContact O-N 3.29Å; Y2122-L2140 HydrophobicContact CD1-CD1 4.24Å; Y2122-L2140 HydrophobicContact CE1-CD1 3.95Å; Y2122-L2140 HydrophobicContact CE1-CD2 4.3Å; Y2122-L2140 HydrophobicContact CE1-CG 4.12Å; Y2122-L2140 HydrophobicContact CE2-CD1 4.42Å; Y2122-L2140 HydrophobicContact CE2-CG 4.46Å; G2123-L2140 VanDerWaalsContact C-CD1 3.49Å; G2123-L2140 WeakPolarHBondContact O-CA 3.38Å; G2123-L2140 VanDerWaalsContact O-CD1 3.31Å; G2123-L2140 WeakPolarHBondContact O-CD1 3.24Å; W2124-L2140 HydrophobicContact CD2-CB 4.01Å; W2124-L2140 HydrophobicContact CD2-CD1 4.38Å; W2124-L2140 HydrophobicContact CE3-CB 3.88Å; W2124-L2140 HydrophobicContact CG-CD1 4.4Å; W2124-L2140 HydrophobicContact CH2-CB 3.87Å; W2124-L2140 HydrophobicContact CH2-CD2 4.42Å; W2124-L2140 HydrophobicContact CZ2-CB 4.02Å; W2124-L2140 HydrophobicContact CZ2-CD2 3.95Å; W2124-L2140 HydrophobicContact CZ2-CG 4.41Å; W2124-L2140 HydrophobicContact CZ3-CB 3.81Å
2141	I	93	Very high	75	Confident	0.5 Å²	0.5	43.6 Å²	43.6	0%	0.003	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	139.2	-173.7	-57.1	174.2	0	0	0	110.2	I1934 F2068 A2096 V2098 Y2122 G2123 Y2125 I2139 V2143	I1934-I2141 CarbonylContact O-C 3.57Å; I1934-I2141 VanDerWaalsContact O-CA 3.29Å; I1934-I2141 WeakPolarHBondContact O-CA 3.32Å; I1934-I2141 WeakPolarHBondContact O-CG2 3.47Å; F2068-I2141 HydrophobicContact CB-CD1 4.07Å; F2068-I2141 HydrophobicContact CD1-CD1 3.95Å; F2068-I2141 HydrophobicContact CD2-CD1 3.63Å; F2068-I2141 HydrophobicContact CE1-CD1 4.28Å; F2068-I2141 HydrophobicContact CE1-CG2 4Å; F2068-I2141 HydrophobicContact CE2-CD1 4Å; F2068-I2141 HydrophobicContact CE2-CG2 3.89Å; F2068-I2141 HydrophobicContact CG-CD1 3.62Å; F2068-I2141 HydrophobicContact CZ-CD1 4.31Å; F2068-I2141 HydrophobicContact CZ-CG2 3.56Å; A2096-I2141 HydrophobicContact CB-CD1 4.3Å; V2098-I2141 HydrophobicContact CG2-CB 4.35Å; V2098-I2141 HydrophobicContact CG2-CD1 4.12Å; V2098-I2141 HydrophobicContact CG2-CG2 4.02Å; Y2122-I2141 WeakPolarHBondContact CA-O 3.23Å; G2123-I2141 PolarHBondContact N-O 3.04Å; G2123-I2141 PolarHBondContact O-N 3.03Å; Y2125-I2141 HydrophobicContact CD2-CB 3.87Å; Y2125-I2141 HydrophobicContact CD2-CD1 4.26Å; Y2125-I2141 HydrophobicContact CD2-CG1 4.25Å; Y2125-I2141 HydrophobicContact CE2-CB 4.03Å; I2139-I2141 HydrophobicContact CD1-CD1 4.36Å; I2139-I2141 HydrophobicContact CD1-CG1 4.38Å; I2139-I2141 HydrophobicContact CG1-CD1 4.33Å; I2139-I2141 HydrophobicContact CG1-CG1 4.02Å; I2139-I2141 HydrophobicContact CG2-CD1 3.71Å; I2139-I2141 HydrophobicContact CG2-CG1 4.1Å; I2141-V2143 HydrophobicContact CG2-CG2 4.45Å
2142	G	89.8	Confident	73.3	Confident	1.25 Å²	1.25	44.2 Å²	44.2	1%	0.013	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	142	169.8	0	0	0	0	0	112.6	I1933 I1934 I2121	I1933-G2142 CarbonylContact C-O 3.48Å; I1933-G2142 VanDerWaalsContact CA-O 3.3Å; I1933-G2142 WeakPolarHBondContact CA-O 3.35Å; I1934-G2142 PolarHBondContact N-O 3.2Å; I1934-G2142 PolarHBondContact O-N 2.93Å; I2121-G2142 CarbonylContact O-C 3.53Å; I2121-G2142 VanDerWaalsContact O-CA 3.29Å; I2121-G2142 WeakPolarHBondContact O-CA 3.35Å
2143	V	88.3	Confident	71.6	Confident	0.75 Å²	0.75	44.7 Å²	44.7	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	115.3	169.6	-174.3	0	0	0	0	108.6	A1931 E1932 I1933 I2053 L2066 V2098 L2100 L2103 I2121 I2141	A1931-V2143 HydrophobicContact CB-CG1 4.35Å; E1932-V2143 CarbonylContact O-C 3.58Å; E1932-V2143 WeakPolarHBondContact O-CA 3.32Å; I1933-V2143 HydrophobicContact CG1-CG2 4.43Å; I2053-V2143 HydrophobicContact CD1-CG1 3.79Å; L2066-V2143 HydrophobicContact CD2-CG2 4.17Å; V2098-V2143 HydrophobicContact CG1-CG2 4.24Å; L2100-V2143 HydrophobicContact CD2-CB 4.13Å; L2100-V2143 HydrophobicContact CD2-CG1 3.96Å; L2100-V2143 HydrophobicContact CD2-CG2 4.11Å; L2103-V2143 HydrophobicContact CD1-CG1 4.36Å; I2121-V2143 HydrophobicContact CB-CB 4.41Å; I2121-V2143 PolarHBondContact N-O 3.03Å; I2121-V2143 PolarHBondContact O-N 2.98Å; I2141-V2143 HydrophobicContact CG2-CG2 4.45Å
2144	K	84.2	Confident	69.7	Low	53.25 Å²	53.25	49.6 Å²	49.6	23%	0.232	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	110.9	-176.9	176.5	-177.6	171.6	-166.7	0	110.3	H1872 A1931 E1932 Q2120	H1872-K2144 PolarHBondContact O-NZ 3.21Å; A1931-K2144 CarbonylContact C-O 3.47Å; A1931-K2144 VanDerWaalsContact CA-O 3.24Å; A1931-K2144 WeakPolarHBondContact CA-O 3.43Å; E1932-K2144 HydrophobicContact CB-CB 4.35Å; E1932-K2144 PolarHBondContact N-O 2.91Å; E1932-K2144 PolarHBondContact O-N 3.07Å; E1932-K2144 WeakPolarHBondContact OE2-CD 3.36Å; E1932-K2144 WeakPolarHBondContact OE2-CE 3.47Å; E1932-K2144 IonicContact OE2-NZ 3.35Å; E1932-K2144 PolarHBondContact OE2-NZ 2.74Å; Q2120-K2144 HydrophobicContact CB-CB 4.07Å; Q2120-K2144 HydrophobicContact CB-CG 4.21Å
2145	P	81.9	Confident	67.6	Low	11.75 Å²	11.75	51.3 Å²	51.3	8%	0.076	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	145.2	173.4	-25.2	37	0	0	0	112.4	F1929 L2103 L2106 F2107 I2147	F1929-P2145 HydrophobicContact CD2-CB 4.16Å; F1929-P2145 HydrophobicContact CD2-CG 4.43Å; F1929-P2145 HydrophobicContact CE2-CB 4.14Å; F1929-P2145 HydrophobicContact CE2-CG 4.03Å; L2103-P2145 HydrophobicContact CB-CG 4.38Å; L2103-P2145 HydrophobicContact CD1-CG 3.74Å; L2103-P2145 HydrophobicContact CD2-CG 3.97Å; L2103-P2145 HydrophobicContact CG-CG 4.29Å; L2106-P2145 HydrophobicContact CD1-CB 4.18Å; L2106-P2145 HydrophobicContact CD1-CG 3.79Å; F2107-P2145 HydrophobicContact CZ-CB 4.47Å; P2145-I2147 HydrophobicContact CB-CD1 4.09Å; P2145-I2147 HydrophobicContact CB-CG1 4.06Å; P2145-I2147 PolarHBondContact O-N 2.84Å
2146	L	70.3	Confident	65.1	Low	35.25 Å²	35.25	52.8 Å²	52.8	19%	0.185	29%	0.285	C	S	.	.			trans	-105.4	43.8	178.9	-57.8	177.6	0	0	0	111.1	M1679 I1732 Y1839 P1930 E1932 F2050	M1679-L2146 HydrophobicContact CE-CD2 3.37Å; M1679-L2146 HydrophobicContact SD-CD2 4.04Å; I1732-L2146 HydrophobicContact CD1-CD1 4.41Å; Y1839-L2146 HydrophobicContact CD1-CD1 4.42Å; Y1839-L2146 HydrophobicContact CG-CD1 4.46Å; P1930-L2146 HydrophobicContact CB-CB 4.13Å; P1930-L2146 HydrophobicContact CB-CD1 4.32Å; P1930-L2146 HydrophobicContact CB-CG 4.45Å; P1930-L2146 HydrophobicContact CG-CB 4.11Å; P1930-L2146 PolarHBondContact O-N 3.19Å; E1932-L2146 HydrophobicContact CB-CD1 4.4Å; E1932-L2146 HydrophobicContact CB-CD2 4.35Å; F2050-L2146 HydrophobicContact CD1-CD1 3.71Å; F2050-L2146 HydrophobicContact CE1-CD1 4.11Å
2147	I	66.2	Low	62.7	Low	30.5 Å²	30.5	60.4 Å²	60.4	16%	0.156	31%	0.313	C	S	.	.			trans	-111.2	142.2	-173.8	-42.7	171.6	0	0	0	110.1	F1929 P1930 L2106 F2107 P2145 I2149	F1929-I2147 HydrophobicContact CB-CD1 3.75Å; F1929-I2147 HydrophobicContact CB-CG1 4.25Å; F1929-I2147 HydrophobicContact CD2-CD1 4.2Å; F1929-I2147 HydrophobicContact CG-CD1 4.3Å; P1930-I2147 HydrophobicContact CG-CG1 4.3Å; P1930-I2147 HydrophobicContact CG-CG2 4.32Å; L2106-I2147 HydrophobicContact CB-CD1 3.68Å; L2106-I2147 HydrophobicContact CD1-CD1 4.31Å; F2107-I2147 HydrophobicContact CD1-CD1 4.14Å; F2107-I2147 HydrophobicContact CD2-CD1 4.49Å; F2107-I2147 HydrophobicContact CE1-CD1 3.28Å; F2107-I2147 HydrophobicContact CE1-CG1 4.43Å; F2107-I2147 HydrophobicContact CE2-CD1 3.98Å; F2107-I2147 HydrophobicContact CZ-CD1 3.34Å; F2107-I2147 VanDerWaalsContact CZ-CD1 3.41Å; P2145-I2147 HydrophobicContact CB-CD1 4.09Å; P2145-I2147 HydrophobicContact CB-CG1 4.06Å; P2145-I2147 PolarHBondContact O-N 2.84Å; I2147-I2149 HydrophobicContact CG1-CG1 4.46Å; I2147-I2149 PolarHBondContact O-N 3.1Å
2148	N	51.7	Low	59.9	Low	59.75 Å²	59.75	68.9 Å²	68.9	32%	0.32	34%	0.344	S	S	.	.			trans	-86.6	110.8	-179.2	-163	8.6	0	0	0	110.7	Q1681 A1841 N1842 G2150	Q1681-N2148 WeakPolarHBondContact CG-ND2 3.46Å; Q1681-N2148 PolarHBondContact NE2-ND2 2.85Å; Q1681-N2148 PolarHBondContact OE1-ND2 2.8Å; A1841-N2148 HydrophobicContact CB-CB 3.89Å; N1842-N2148 PolarHBondContact OD1-ND2 3.04Å; N2148-G2150 VanDerWaalsContact C-N 3.29Å; N2148-G2150 PolarHBondContact O-N 2.99Å
2149	I	47	Very low	56.9	Low	92.75 Å²	92.75	70.8 Å²	70.8	48%	0.476	37%	0.365	S	S	.	.	S	Bend	trans	-79.8	81.3	-175.1	-49.5	159.3	0	0	0	109.1	L2106 N2119 I2147	L2106-I2149 HydrophobicContact CD1-CD1 4.22Å; L2106-I2149 HydrophobicContact CD2-CB 4.46Å; L2106-I2149 HydrophobicContact CD2-CD1 3.56Å; L2106-I2149 HydrophobicContact CD2-CG1 3.86Å; L2106-I2149 HydrophobicContact CD2-CG2 3.92Å; L2106-I2149 HydrophobicContact CG-CD1 4.32Å; N2119-I2149 HydrophobicContact CB-CD1 4.17Å; N2119-I2149 VanDerWaalsContact OD1-CD1 3.26Å; N2119-I2149 WeakPolarHBondContact OD1-CD1 3.33Å; I2147-I2149 HydrophobicContact CG1-CG1 4.46Å; I2147-I2149 PolarHBondContact O-N 3.1Å
2150	G	40.6	Very low	53.8	Low	51.5 Å²	51.5	75.9 Å²	75.9	53%	0.531	40%	0.401	S	S	.	.	S	Bend	trans	146.5	18.9	176.4	0	0	0	0	0	117.7	N2148	N2148-G2150 VanDerWaalsContact C-N 3.29Å; N2148-G2150 PolarHBondContact O-N 2.99Å
2151	Q	37.3	Very low	50.8	Low	105.5 Å²	105.5	80.1 Å²	80.1	49%	0.493	43%	0.431	S	S	.	.			trans	-134.5	-4.5	172.3	-79.9	179.4	-17.4	0	0	115.8	H1797 N1842 H2153	H1797-Q2151 PolarHBondContact O-NE2 2.78Å; N1842-Q2151 PolarHBondContact ND2-OE1 3.49Å; Q2151-H2153 VanDerWaalsContact C-N 3.27Å; Q2151-H2153 PolarHBondContact O-N 3.06Å; Q2151-H2153 VanDerWaalsContact O-N 3.14Å
2152	Q	36.7	Very low	47.7	Very low	114.25 Å²	114.25	87 Å²	87	53%	0.534	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	1.8	-170.4	-67.2	-168.3	-17.6	0	0	116.8
2153	H	36.1	Very low	44.7	Very low	99.5 Å²	99.5	93.8 Å²	93.8	46%	0.461	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	-5.4	179	-117.4	-118.5	0	0	0	116.2	D2109 Q2151 T2155 Y2157	D2109-H2153 IonicContact OD1-CE1 2.98Å; D2109-H2153 PolarHBondContact OD1-CE1 3.33Å; D2109-H2153 IonicContact OD1-CG 2.84Å; D2109-H2153 IonicContact OD1-ND1 3.41Å; D2109-H2153 PolarHBondContact OD1-ND1 3.15Å; D2109-H2153 IonicContact OD2-CE1 2.64Å; D2109-H2153 IonicContact OD2-ND1 3.11Å; Q2151-H2153 VanDerWaalsContact C-N 3.27Å; Q2151-H2153 PolarHBondContact O-N 3.06Å; Q2151-H2153 VanDerWaalsContact O-N 3.14Å; H2153-T2155 VanDerWaalsContact C-N 3.31Å; H2153-T2155 PolarHBondContact O-N 2.9Å; H2153-Y2157 AromaticContact CD2-CD2 3.88Å; H2153-Y2157 AromaticContact CD2-CE2 3.96Å; H2153-Y2157 AromaticContact CE1-CD2 3.26Å; H2153-Y2157 VanDerWaalsContact CE1-CD2 3.41Å; H2153-Y2157 WeakPolarHBondContact CE1-CD2 3.21Å; H2153-Y2157 AromaticContact CE1-CE2 3.29Å; H2153-Y2157 WeakPolarHBondContact CE1-CE2 3.4Å; H2153-Y2157 AromaticContact CE1-CG 3.85Å; H2153-Y2157 AromaticContact CE1-CZ 3.5Å; H2153-Y2157 VanDerWaalsContact CE1-CZ 3.5Å; H2153-Y2157 AromaticContact CG-CD2 3.92Å; H2153-Y2157 AromaticContact ND1-CD2 3.23Å; H2153-Y2157 WeakPolarHBondContact ND1-CD2 3.41Å; H2153-Y2157 AromaticContact ND1-CE2 3.57Å; H2153-Y2157 AromaticContact ND1-CG 3.87Å; H2153-Y2157 AromaticContact NE2-CD2 3.47Å; H2153-Y2157 VanDerWaalsContact NE2-CD2 3.25Å; H2153-Y2157 WeakPolarHBondContact NE2-CD2 3.32Å; H2153-Y2157 AromaticContact NE2-CE2 3.19Å; H2153-Y2157 WeakPolarHBondContact NE2-CE2 3.13Å; H2153-Y2157 AromaticContact NE2-CZ 3.86Å
2154	L	32.9	Very low	41.9	Very low	140.5 Å²	140.5	100.8 Å²	100.8	74%	0.736	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-6.5	-175	-83.7	159.5	0	0	0	115	Y2158	L2154-Y2158 HydrophobicContact CD2-CD2 4.44Å; L2154-Y2158 HydrophobicContact CD2-CE2 4.26Å
2155	T	32.2	Very low	39.4	Very low	103.75 Å²	103.75	105.4 Å²	105.4	64%	0.637	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	-9	-174.3	51.9	0	0	0	0	115.5	H2153 S2159	H2153-T2155 VanDerWaalsContact C-N 3.31Å; H2153-T2155 PolarHBondContact O-N 2.9Å; T2155-S2159 PolarHBondContact O-OG 2.94Å
2156	N	30.1	Very low	36.8	Very low	108 Å²	108	112.9 Å²	112.9	58%	0.578	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	-6.6	-172.9	-80.1	-23.5	0	0	0	116.5	K1925 S2160	K1925-N2156 PolarHBondContact NZ-OD1 3.24Å; N2156-S2160 PolarHBondContact O-OG 3.39Å
2157	Y	31.5	Very low	34.9	Very low	167.25 Å²	167.25	120.4 Å²	120.4	66%	0.656	63%	0.633	S	S	*	*	S	Bend	trans	-117.7	5.7	-174.9	-83	-81	0	0	0	116.3	H2153 S2161	H2153-Y2157 AromaticContact CD2-CD2 3.88Å; H2153-Y2157 AromaticContact CD2-CE2 3.96Å; H2153-Y2157 AromaticContact CE1-CD2 3.26Å; H2153-Y2157 VanDerWaalsContact CE1-CD2 3.41Å; H2153-Y2157 WeakPolarHBondContact CE1-CD2 3.21Å; H2153-Y2157 AromaticContact CE1-CE2 3.29Å; H2153-Y2157 WeakPolarHBondContact CE1-CE2 3.4Å; H2153-Y2157 AromaticContact CE1-CG 3.85Å; H2153-Y2157 AromaticContact CE1-CZ 3.5Å; H2153-Y2157 VanDerWaalsContact CE1-CZ 3.5Å; H2153-Y2157 AromaticContact CG-CD2 3.92Å; H2153-Y2157 AromaticContact ND1-CD2 3.23Å; H2153-Y2157 WeakPolarHBondContact ND1-CD2 3.41Å; H2153-Y2157 AromaticContact ND1-CE2 3.57Å; H2153-Y2157 AromaticContact ND1-CG 3.87Å; H2153-Y2157 AromaticContact NE2-CD2 3.47Å; H2153-Y2157 VanDerWaalsContact NE2-CD2 3.25Å; H2153-Y2157 WeakPolarHBondContact NE2-CD2 3.32Å; H2153-Y2157 AromaticContact NE2-CE2 3.19Å; H2153-Y2157 WeakPolarHBondContact NE2-CE2 3.13Å; H2153-Y2157 AromaticContact NE2-CZ 3.86Å; Y2157-S2161 PolarHBondContact O-OG 2.77Å
2158	Y	30.9	Very low	33.1	Very low	186.75 Å²	186.75	124 Å²	124	73%	0.732	66%	0.657	S	S	*	*	S	Bend	trans	-118.4	28.8	172.1	-73.7	-71.9	0	0	0	113	L2154 S2160 L2162	L2154-Y2158 HydrophobicContact CD2-CD2 4.44Å; L2154-Y2158 HydrophobicContact CD2-CE2 4.26Å; Y2158-S2160 PolarHBondContact O-N 2.96Å; Y2158-L2162 HydrophobicContact CD1-CD1 4.09Å
2159	S	27.6	Very low	32.1	Very low	114.75 Å²	114.75	126.6 Å²	126.6	80%	0.802	68%	0.675	S	S	*	*	S	Bend	trans	-124.6	26.6	175.8	-61	0	0	0	0	113	T2155	T2155-S2159 PolarHBondContact O-OG 2.94Å
2160	S	28.6	Very low	31.3	Very low	108.25 Å²	108.25	128.8 Å²	128.8	76%	0.757	69%	0.688	S	S	*	*	S	Bend	trans	-146.3	34.4	176.7	61.9	0	0	0	0	114.3	N2156 Y2158	N2156-S2160 PolarHBondContact O-OG 3.39Å; Y2158-S2160 PolarHBondContact O-N 2.96Å
2161	S	29.5	Very low	30.7	Very low	96.75 Å²	96.75	132.6 Å²	132.6	68%	0.677	70%	0.696	S	S	*	*	S	Bend	trans	-153.9	45.2	175	63	0	0	0	0	115.7	Y2157	Y2157-S2161 PolarHBondContact O-OG 2.77Å
2162	L	27.8	Very low	30.2	Very low	144.5 Å²	144.5	134 Å²	134	76%	0.757	71%	0.707	S	S	*	*	S	Bend	trans	-106.1	97	163.7	-78.8	109.5	0	0	0	111.8	Y2158	Y2158-L2162 HydrophobicContact CD1-CD1 4.09Å
2163	N	27.4	Very low	29.9	Very low	145.25 Å²	145.25	138.3 Å²	138.3	78%	0.777	72%	0.724	S	S	*	*			trans	-170.6	103.5	148.7	-87.2	-13.6	0	0	0	111.8	N2165	N2163-N2165 PolarHBondContact O-N 3.2Å
2164	N	29.3	Very low	29.3	Very low	147.5 Å²	147.5	138.3 Å²	138.3	79%	0.789	74%	0.735	S	S	*	*			trans	136	103.6	152.1	-70	-15	0	0	0	113.4
2165	N	31.2	Very low	28.9	Very low	149.5 Å²	149.5	136.4 Å²	136.4	80%	0.799	73%	0.734	S	S	*	*			trans	131.3	103.7	145.3	-75.3	-15.6	0	0	0	114.6	N2163 F2167	N2163-N2165 PolarHBondContact O-N 3.2Å; N2165-F2167 PolarHBondContact O-N 3.29Å
2166	E	27.7	Very low	28.6	Very low	169.25 Å²	169.25	139.7 Å²	139.7	79%	0.791	75%	0.747	S	S	*	*			trans	-16.4	122.1	144.8	-63.1	177	144.5	0	0	113.5
2167	F	30.3	Very low	28.4	Very low	192.5 Å²	192.5	139.7 Å²	139.7	84%	0.844	76%	0.755	S	S	*	*				-164.5	117	128.7	-106.9	-80.5	0	0	0	111.6	N2165	N2165-F2167 PolarHBondContact O-N 3.29Å
2168	T	29.3	Very low	28.2	Very low	105.5 Å²	105.5	140 Å²	140	65%	0.647	76%	0.762	S	S	*	*			trans	-13.2	131.8	161.9	56	0	0	0	0	118.4
2169	T	29.1	Very low	28	Very low	116 Å²	116	138 Å²	138	71%	0.712	76%	0.764	S	S	*	*			trans	66.2	120.7	139.5	60.7	0	0	0	0	120.2
2170	N	30.2	Very low	28	Very low	139 Å²	139	138.2 Å²	138.2	74%	0.743	76%	0.761	S	S	*	*				134.9	115.8	125.3	-79.5	-29.1	0	0	0	116.6
2171	N	28.3	Very low	27.9	Very low	131.25 Å²	131.25	142.9 Å²	142.9	70%	0.702	76%	0.763	S	S	*	*			trans	53.1	137.5	138	-62.7	-23.1	0	0	0	118.3
2172	N	27.4	Very low	27.8	Very low	135 Å²	135	143.7 Å²	143.7	72%	0.722	76%	0.764	S	S	*	*			trans	77.8	103.4	145.6	-55	-24.3	0	0	0	117.1
2173	F	29.4	Very low	27.8	Very low	204.25 Å²	204.25	143.7 Å²	143.7	90%	0.896	77%	0.765	S	S	*	*				-176.5	119.8	125.6	-91.7	-78.1	0	0	0	110.7
2174	S	24.6	Very low	27.8	Very low	97.75 Å²	97.75	144.5 Å²	144.5	68%	0.684	76%	0.764	S	S	*	*			trans	-40.4	135.8	153.9	44.1	0	0	0	0	114.1
2175	S	24.4	Very low	27.8	Very low	102 Å²	102	144.5 Å²	144.5	71%	0.713	76%	0.763	S	S	*	*			trans	77.6	116.8	150.7	54.6	0	0	0	0	116.5
2176	L	27	Very low	27.7	Very low	173.25 Å²	173.25	145.6 Å²	145.6	91%	0.907	76%	0.76	S	S	*	*			trans	178.7	97.8	133.4	-97.5	138.8	0	0	0	111.1
2177	S	24.3	Very low	27.8	Very low	108 Å²	108	141.9 Å²	141.9	76%	0.755	75%	0.751	S	S	*	*			trans	-110.7	112.9	143.9	52.4	0	0	0	0	111.7
2178	H	28	Very low	27.7	Very low	172.25 Å²	172.25	140.8 Å²	140.8	80%	0.797	75%	0.746	S	S	*	*			trans	-161.6	124	149.9	-131.6	-77.1	0	0	0	110.8
2179	N	27	Very low	27.6	Very low	144.5 Å²	144.5	138.5 Å²	138.5	77%	0.773	74%	0.743	S	S	*	*			trans	-8.6	125.8	141.9	-65.5	-28.1	0	0	0	113.3	Y2181	N2179-Y2181 PolarHBondContact O-N 2.99Å
2180	V	27.3	Very low	27.5	Very low	120.75 Å²	120.75	139.7 Å²	139.7	73%	0.732	75%	0.745	S	S	*	*			trans	-148.1	111.1	156.8	-178.6	0	0	0	0	110.7
2181	Y	27.1	Very low	27.4	Very low	206 Å²	206	144.2 Å²	144.2	81%	0.808	75%	0.753	S	S	*	*			trans	-145.1	127	133.2	-101.1	-98.8	0	0	0	112.3	N2179	N2179-Y2181 PolarHBondContact O-N 2.99Å
2182	T	26.3	Very low	27.3	Very low	113.75 Å²	113.75	142.7 Å²	142.7	70%	0.698	75%	0.753	S	S	*	*			trans	-6.6	110.1	153.4	55.4	0	0	0	0	113.2	Q2184	T2182-Q2184 PolarHBondContact O-N 3.09Å
2183	D	27.5	Very low	27.3	Very low	145.25 Å²	145.25	143 Å²	143	78%	0.777	75%	0.753	S	S	*	*			trans	-149.5	121.1	148	-97.4	-20.3	0	0	0	113.3	I2185	D2183-I2185 PolarHBondContact O-N 3.16Å
2184	Q	27.7	Very low	27.3	Very low	162 Å²	162	142.2 Å²	142.2	76%	0.757	75%	0.75	S	S	*	*			trans	-2.8	113.6	162.3	-61.5	171.2	27.5	0	0	114.8	N2115 T2182 K2186	N2115-Q2184 PolarHBondContact ND2-O 3.29Å; T2182-Q2184 PolarHBondContact O-N 3.09Å; Q2184-K2186 PolarHBondContact O-N 3.27Å
2185	I	30.4	Very low	27.4	Very low	147.5 Å²	147.5	145.3 Å²	145.3	76%	0.756	75%	0.753	S	S	*	*			trans	-124.5	109.7	149.8	-60.5	174.1	0	0	0	109.7	N2115 D2183 P2187	N2115-I2185 HydrophobicContact CB-CB 4.05Å; N2115-I2185 HydrophobicContact CB-CG1 4.48Å; N2115-I2185 HydrophobicContact CB-CG2 3.42Å; N2115-I2185 VanDerWaalsContact CB-CG2 3.42Å; N2115-I2185 VanDerWaalsContact CG-CA 3.43Å; N2115-I2185 VanDerWaalsContact ND2-CA 3.32Å; N2115-I2185 WeakPolarHBondContact ND2-CA 3.43Å; N2115-I2185 WeakPolarHBondContact OD1-CB 3.48Å; N2115-I2185 WeakPolarHBondContact OD1-CD1 3.49Å; N2115-I2185 WeakPolarHBondContact OD1-CG1 3.2Å; N2115-I2185 WeakPolarHBondContact OD1-CG2 3.39Å; D2183-I2185 PolarHBondContact O-N 3.16Å; I2185-P2187 WeakPolarHBondContact O-CD 3.49Å
2186	K	28.6	Very low	27.7	Very low	172.75 Å²	172.75	150.4 Å²	150.4	75%	0.751	76%	0.758	S	S	*	*			trans	-91.9	147.3	166.7	-90.5	-179.8	176.4	177.9	0	109.5	N2115 Q2184 F2188	N2115-K2186 CarbonylContact O-C 3.55Å; Q2184-K2186 PolarHBondContact O-N 3.27Å; K2186-F2188 HydrophobicContact CB-CE2 4.25Å; K2186-F2188 PolarHBondContact O-N 2.99Å
2187	P	29.8	Very low	27.6	Very low	90.5 Å²	90.5	145.6 Å²	145.6	59%	0.588	75%	0.751	S	S	*	*			trans	-106.2	134.4	149	38.1	-31.6	0	0	0	112.6	N2115 I2185 G2189	N2115-P2187 WeakPolarHBondContact O-CB 3.17Å; N2115-P2187 WeakPolarHBondContact O-CD 3.21Å; N2115-P2187 WeakPolarHBondContact O-CG 3.48Å; I2185-P2187 WeakPolarHBondContact O-CD 3.49Å; P2187-G2189 PolarHBondContact O-N 3.43Å
2188	F	28.5	Very low	27.8	Very low	169.5 Å²	169.5	148.1 Å²	148.1	74%	0.743	76%	0.755	S	S	*	*				-132.2	113.3	121.7	-72.7	-76	0	0	0	111.9	N2116 K2186	N2116-F2188 WeakPolarHBondContact OD1-CD2 3.3Å; K2186-F2188 HydrophobicContact CB-CE2 4.25Å; K2186-F2188 PolarHBondContact O-N 2.99Å
2189	G	27.6	Very low	27.7	Very low	56.5 Å²	56.5	147.5 Å²	147.5	58%	0.582	76%	0.757	S	S	*	*			trans	-115.9	173.8	163.7	0	0	0	0	0	112.4	P2187 Y2191	P2187-G2189 PolarHBondContact O-N 3.43Å; G2189-Y2191 PolarHBondContact O-N 3.18Å
2190	N	26.7	Very low	27.7	Very low	142.25 Å²	142.25	145.4 Å²	145.4	76%	0.761	75%	0.754	S	S	*	*			trans	134.6	90.4	174.2	-64.7	-8	0	0	0	112.4
2191	Y	27.3	Very low	27.6	Very low	233.75 Å²	233.75	145.7 Å²	145.7	92%	0.917	76%	0.756	S	S	*	*				-132.1	86.3	124.1	-79.9	-75.4	0	0	0	110.8	G2189	G2189-Y2191 PolarHBondContact O-N 3.18Å
2192	S	27.1	Very low	27.6	Very low	99.25 Å²	99.25	143.7 Å²	143.7	69%	0.694	76%	0.759	S	S	*	*			trans	-122.2	127.8	152.1	85.5	0	0	0	0	107.7	F2194	S2192-F2194 PolarHBondContact O-N 2.83Å
2193	I	27.7	Very low	27.6	Very low	140.25 Å²	140.25	142.5 Å²	142.5	72%	0.719	76%	0.755	S	S	*	*			trans	-97.3	115.7	149.9	-68.2	169.4	0	0	0	107.2
2194	F	29.5	Very low	27.4	Very low	189.25 Å²	189.25	142.3 Å²	142.3	83%	0.83	75%	0.754	S	S	*	*			trans	-124.4	136.2	152.9	-82.6	-75.6	0	0	0	110	S2192 Y2196	S2192-F2194 PolarHBondContact O-N 2.83Å; F2194-Y2196 HydrophobicContact CB-CD2 4.35Å; F2194-Y2196 HydrophobicContact CD1-CD2 4.25Å; F2194-Y2196 HydrophobicContact CD1-CE2 4.33Å
2195	Q	25.4	Very low	27.5	Very low	162 Å²	162	141.1 Å²	141.1	76%	0.757	76%	0.762	S	S	*	*			trans	-107.7	117.4	-171.7	-172.7	174.5	2.2	0	0	110.7
2196	Y	30.7	Very low	27.2	Very low	209.75 Å²	209.75	140.9 Å²	140.9	82%	0.823	76%	0.762	S	S	*	*			trans	-158.4	120.2	161.1	-77.9	-74.7	0	0	0	110.7	F2194	F2194-Y2196 HydrophobicContact CB-CD2 4.35Å; F2194-Y2196 HydrophobicContact CD1-CD2 4.25Å; F2194-Y2196 HydrophobicContact CD1-CE2 4.33Å
2197	G	26	Very low	27.2	Very low	72.75 Å²	72.75	141 Å²	141	75%	0.75	77%	0.77	S	S	*	*			trans	-97	166	-170.7	0	0	0	0	0	113.5
2198	L	28.5	Very low	27	Very low	160 Å²	160	140.5 Å²	140.5	84%	0.838	77%	0.774	S	S	*	*			trans	-145.5	127.6	152.9	-85.1	167.9	0	0	0	110.2	S2200	L2198-S2200 PolarHBondContact O-N 3.07Å
2199	N	24.3	Very low	26.9	Very low	159.25 Å²	159.25	142.1 Å²	142.1	85%	0.852	78%	0.78	S	S	*	*			trans	-66.1	134.5	153.3	-72.7	-31.9	0	0	0	113.6
2200	S	27.2	Very low	26.9	Very low	101.25 Å²	101.25	144.4 Å²	144.4	71%	0.708	79%	0.787	S	S	*	*			trans	175.2	133.4	136.2	65.5	0	0	0	0	111.7	L2198 L2202	L2198-S2200 PolarHBondContact O-N 3.07Å; S2200-L2202 PolarHBondContact O-N 3.19Å
2201	T	25.2	Very low	26.8	Very low	126.333 Å²	126.333	143.7 Å²	143.7	78%	0.775	79%	0.788	S	S	*	*			trans	-65.9	133.6	134	43.9	0	0	0	0	113.2
2202	L	27.5	Very low	26.9	Very low	163.667 Å²	163.667	140.7 Å²	140.7	86%	0.857	78%	0.782	S	S	*	*			trans	158.5	123.7	146.7	-85.7	132.9	0	0	0	111.7	S2200	S2200-L2202 PolarHBondContact O-N 3.19Å
2203	S	25.9	Very low	26.9	Very low	88 Å²	88	140.6 Å²	140.6	62%	0.615	78%	0.782	S	S	*	*				175.8	135.1	63.2	58.2	0	0	0	0	112.7
2204	N	24.7	Very low	26.8	Very low	142.333 Å²	142.333	141.9 Å²	141.9	76%	0.761	79%	0.79	S	S	*	*			trans	53.5	107.5	148.7	-59.5	4.7	0	0	0	118.8
2205	C	28.3	Very low	26.7	Very low	135.333 Å²	135.333	139 Å²	139	91%	0.914	78%	0.783	S	S	*	*			trans	-146	100	131.3	-96.7	0	0	0	0	109.4	L2207	C2205-L2207 PolarHBondContact O-N 3.39Å
2206	D	25.3	Very low	26.8	Very low	144.667 Å²	144.667	137.4 Å²	137.4	77%	0.774	78%	0.779	S	S	*	*			trans	-64.9	130	170.8	-69.3	-64.8	0	0	0	111.5
2207	L	27.9	Very low	26.7	Very low	174.667 Å²	174.667	133.8 Å²	133.8	91%	0.914	78%	0.783	S	S	*	*			trans	-143.3	84.2	145.5	-151.1	70.1	0	0	0	111.2	C2205	C2205-L2207 PolarHBondContact O-N 3.39Å
2208	A	25	Very low	26.7	Very low	80.6667 Å²	80.6667	137.2 Å²	137.2	67%	0.667	78%	0.784	S	S	*	*			trans	-74	147	168	0	0	0	0	0	111.2
2209	K	26.7	Very low	26.6	Very low	201.333 Å²	201.333	135.9 Å²	135.9	88%	0.875	78%	0.783	S	S	*	*			trans	104.7	97.3	157.4	-61.3	167.8	-175.2	177.3	0	114.8
2210	S	27.2	Very low	26.8	Very low	104.667 Å²	104.667	132.1 Å²	132.1	73%	0.732	78%	0.782	S	S	*	*				-153.2	100.6	128.1	-165.3	0	0	0	0	110.8	H2212	S2210-H2212 VanDerWaalsContact C-N 3.3Å; S2210-H2212 PolarHBondContact O-N 3.39Å; S2210-H2212 PolarHBondContact OG-CD2 2.76Å; S2210-H2212 PolarHBondContact OG-CE1 3.28Å; S2210-H2212 VanDerWaalsContact OG-CE1 3.28Å; S2210-H2212 PolarHBondContact OG-NE2 2.92Å
2211	T	24.7	Very low	26.7	Very low	128 Å²	128	137 Å²	137	79%	0.785	79%	0.79	S	S	*	*			trans	-89.4	118.3	163.6	46.5	0	0	0	0	108.8	S2213	T2211-S2213 PolarHBondContact O-N 3.49Å; T2211-S2213 VanDerWaalsContact O-N 3.16Å
2212	H	30.1	Very low	26.9	Very low	170.667 Å²	170.667	136.9 Å²	136.9	79%	0.79	79%	0.789	S	S	*	*			trans	-118.8	111.6	168.6	-72.8	-62.1	0	0	0	110.2	S2210	S2210-H2212 VanDerWaalsContact C-N 3.3Å; S2210-H2212 PolarHBondContact O-N 3.39Å; S2210-H2212 PolarHBondContact OG-CD2 2.76Å; S2210-H2212 PolarHBondContact OG-CE1 3.28Å; S2210-H2212 VanDerWaalsContact OG-CE1 3.28Å; S2210-H2212 PolarHBondContact OG-NE2 2.92Å
2213	S	26.3	Very low	27	Very low	98.3333 Å²	98.3333	134 Å²	134	69%	0.688	78%	0.783	S	S	*	*				172	129.5	91.6	52.9	0	0	0	0	111.7	T2211 N2215	T2211-S2213 PolarHBondContact O-N 3.49Å; T2211-S2213 VanDerWaalsContact O-N 3.16Å; S2213-N2215 VanDerWaalsContact C-N 3.33Å
2214	L	27.1	Very low	27	Very low	168 Å²	168	136.6 Å²	136.6	88%	0.88	79%	0.79	S	S	*	*			trans	-100.4	98.9	148.1	-78.6	161.1	0	0	0	110.1
2215	N	27.4	Very low	27.4	Very low	128.333 Å²	128.333	136.6 Å²	136.6	69%	0.686	79%	0.79	S	S	*	*				165.5	144	122.1	-93.9	37.1	0	0	0	111.5	S2213	S2213-N2215 VanDerWaalsContact C-N 3.33Å
2216	D	27.2	Very low	27.4	Very low	127.667 Å²	127.667	137.1 Å²	137.1	68%	0.683	78%	0.782	S	S	*	*			trans	96.7	110.4	131.6	-62.4	-38	0	0	0	113.9
2217	C	27.3	Very low	27.6	Very low	133.333 Å²	133.333	137.7 Å²	137.7	90%	0.901	78%	0.784	S	S	*	*				-141.1	105.6	107.8	-73.6	0	0	0	0	112.1
2218	N	26.3	Very low	27.6	Very low	144 Å²	144	134.9 Å²	134.9	77%	0.77	77%	0.774	S	S	*	*			trans	-116.1	121.2	-179.7	-102.8	-34.1	0	0	0	114.3
2219	T	26.5	Very low	28	Very low	133.333 Å²	133.333	138.4 Å²	138.4	82%	0.818	78%	0.781	S	S	*	*			trans	78.7	110.2	145.5	55.1	0	0	0	0	118.7
2220	G	28.2	Very low	28.1	Very low	79.6667 Å²	79.6667	137.7 Å²	137.7	82%	0.821	78%	0.778	S	S	*	*			trans	-161.2	81.6	161.5	0	0	0	0	0	113.4	V2222	G2220-V2222 PolarHBondContact O-N 3.46Å; G2220-V2222 VanDerWaalsContact O-N 3.13Å
2221	K	26.9	Very low	28.3	Very low	203 Å²	203	141.4 Å²	141.4	88%	0.883	78%	0.784	S	S	*	*			trans	-82	135.2	-179.4	-88	-173.7	175.8	-176.6	0	111.9
2222	V	28	Very low	28.6	Very low	125.333 Å²	125.333	143.9 Å²	143.9	76%	0.76	79%	0.787	S	S	*	*			trans	159.2	123.5	142.3	172.2	0	0	0	0	111.6	G2220	G2220-V2222 PolarHBondContact O-N 3.46Å; G2220-V2222 VanDerWaalsContact O-N 3.13Å
2223	S	29.6	Very low	28.7	Very low	103.333 Å²	103.333	140.3 Å²	140.3	72%	0.723	78%	0.781	S	S	*	*			trans	80.2	128.4	131.4	22.2	0	0	0	0	119.5
2224	D	27.1	Very low	29.1	Very low	142 Å²	142	139.8 Å²	139.8	76%	0.759	77%	0.77	S	S	*	*			trans	-2.3	124.8	139.6	-50.2	-47.3	0	0	0	116.2
2225	D	31.6	Very low	29.8	Very low	142.667 Å²	142.667	137.8 Å²	137.8	76%	0.763	76%	0.757	S	S	*	*				172.2	122.5	114.8	-92.7	-24.5	0	0	0	113
2226	I	28.5	Very low	30.4	Very low	145 Å²	145	134.2 Å²	134.2	74%	0.744	74%	0.741	S	S	*	*			trans	60.9	112	137.7	-53.7	166.6	0	0	0	118.4
2227	L	29.4	Very low	31.2	Very low	157.333 Å²	157.333	133.8 Å²	133.8	82%	0.824	74%	0.735	S	S	*	*				160	134	94.2	-133.7	116.2	0	0	0	114.6
2228	V	29.2	Very low	31.9	Very low	116.667 Å²	116.667	131.3 Å²	131.3	71%	0.707	71%	0.712	S	S	*	*			trans	23.5	119.4	157.1	-174.1	0	0	0	0	117.7
2229	N	31.9	Very low	32.7	Very low	153.333 Å²	153.333	127 Å²	127	82%	0.82	69%	0.69	S	S	*	*			trans	-138.6	141.3	140.7	-78.5	-33.3	0	0	0	110.6
2230	K	30.1	Very low	33.6	Very low	187 Å²	187	127.6 Å²	127.6	81%	0.813	68%	0.677	S	S	*	*				-170.3	126.6	106	-104.2	178.6	176.4	-161.8	0	112.2
2231	E	31.5	Very low	34.7	Very low	183.333 Å²	183.333	126.5 Å²	126.5	86%	0.857	66%	0.657	S	S	*	*			trans	-137.7	133.4	155.9	-69.4	178.3	177.4	0	0	112.7
2232	E	29.7	Very low	36.3	Very low	179.667 Å²	179.667	120 Å²	120	84%	0.84	63%	0.634	S	S	*	*			trans	-105	142.8	-178.1	-66.4	179.5	144.4	0	0	112.4	N2234	E2232-N2234 PolarHBondContact O-N 2.93Å
2233	S	32.5	Very low	37.7	Very low	95.3333 Å²	95.3333	118.9 Å²	118.9	67%	0.667	62%	0.623	S	S	*	*			trans	-91.6	116.9	177.8	60.9	0	0	0	0	114.9	H2235	S2233-H2235 PolarHBondContact O-N 2.99Å
2234	N	35.6	Very low	39.3	Very low	86.6667 Å²	86.6667	119.9 Å²	119.9	46%	0.463	62%	0.615	S	S	.	*			trans	-68.5	90.6	170.3	-65.4	-28	0	0	0	114.8	E2232 S2236 E2237 L2238	E2232-N2234 PolarHBondContact O-N 2.93Å; N2234-S2236 PolarHBondContact O-N 2.85Å; N2234-S2236 VanDerWaalsContact O-N 3.14Å; N2234-E2237 HydrophobicContact CB-CB 4.13Å; N2234-E2237 HydrophobicContact CB-CG 3.85Å; N2234-E2237 WeakPolarHBondContact CB-OE1 3.44Å; N2234-E2237 PolarHBondContact ND2-OE1 2.87Å; N2234-E2237 WeakPolarHBondContact O-CB 3.43Å; N2234-E2237 PolarHBondContact O-N 2.85Å; N2234-L2238 WeakPolarHBondContact O-CD1 3.22Å; N2234-L2238 PolarHBondContact O-N 2.83Å
2235	H	40.5	Very low	41.3	Very low	127 Å²	127	118.1 Å²	118.1	59%	0.588	60%	0.602	S	S	*	*	H	α-helix	trans	-69.9	-18	177.1	-70.7	-70.9	0	0	0	115.2	S2233 L2238 N2239	S2233-H2235 PolarHBondContact O-N 2.99Å; H2235-L2238 PolarHBondContact O-N 2.99Å; H2235-N2239 PolarHBondContact O-N 2.96Å
2236	S	41.1	Very low	43.1	Very low	52.6667 Å²	52.6667	115.3 Å²	115.3	37%	0.368	59%	0.587	S	S	.	*	H	α-helix	trans	-78.6	-29.3	176.2	49.9	0	0	0	0	113.5	N2063 N2234 L2238 R2240	N2063-S2236 WeakPolarHBondContact O-CB 3.26Å; N2063-S2236 PolarHBondContact O-OG 3.27Å; N2234-S2236 PolarHBondContact O-N 2.85Å; N2234-S2236 VanDerWaalsContact O-N 3.14Å; S2236-L2238 VanDerWaalsContact C-N 3.32Å; S2236-L2238 PolarHBondContact O-N 3.48Å; S2236-R2240 PolarHBondContact O-N 3.13Å
2237	E	43.4	Very low	45.1	Very low	119.333 Å²	119.333	113 Å²	113	56%	0.558	58%	0.576	S	S	*	*	H	α-helix	trans	-74.6	-29.8	175.4	-70.4	178.5	-171.8	0	0	112.1	N2234 N2239 R2240 S2241	N2234-E2237 HydrophobicContact CB-CB 4.13Å; N2234-E2237 HydrophobicContact CB-CG 3.85Å; N2234-E2237 WeakPolarHBondContact CB-OE1 3.44Å; N2234-E2237 PolarHBondContact ND2-OE1 2.87Å; N2234-E2237 WeakPolarHBondContact O-CB 3.43Å; N2234-E2237 PolarHBondContact O-N 2.85Å; E2237-N2239 PolarHBondContact O-N 3.02Å; E2237-R2240 PolarHBondContact O-N 3.41Å; E2237-R2240 VanDerWaalsContact O-N 3.16Å; E2237-S2241 WeakPolarHBondContact O-CA 3.16Å; E2237-S2241 WeakPolarHBondContact O-CB 3.28Å; E2237-S2241 PolarHBondContact O-N 3.3Å; E2237-S2241 VanDerWaalsContact O-N 3.08Å; E2237-S2241 PolarHBondContact O-OG 3.18Å
2238	L	42	Very low	47.2	Very low	79.6667 Å²	79.6667	113 Å²	113	42%	0.417	57%	0.565	S	S	.	*	H	α-helix	trans	-65.3	-38.2	179	-71.2	169.2	0	0	0	112.6	N2234 H2235 S2236 R2240 S2241 V2242	N2234-L2238 WeakPolarHBondContact O-CD1 3.22Å; N2234-L2238 PolarHBondContact O-N 2.83Å; H2235-L2238 PolarHBondContact O-N 2.99Å; S2236-L2238 VanDerWaalsContact C-N 3.32Å; S2236-L2238 PolarHBondContact O-N 3.48Å; L2238-R2240 VanDerWaalsContact C-N 3.31Å; L2238-R2240 PolarHBondContact O-N 3.3Å; L2238-S2241 WeakPolarHBondContact CA-OG 3.13Å; L2238-S2241 PolarHBondContact O-N 2.86Å; L2238-S2241 PolarHBondContact O-OG 3.02Å; L2238-S2241 VanDerWaalsContact O-OG 3.12Å; L2238-V2242 VanDerWaalsContact O-CB 3.26Å; L2238-V2242 WeakPolarHBondContact O-CB 3.3Å; L2238-V2242 VanDerWaalsContact O-CG2 3.29Å; L2238-V2242 WeakPolarHBondContact O-CG2 3.18Å; L2238-V2242 PolarHBondContact O-N 3.1Å; L2238-V2242 VanDerWaalsContact O-N 3.11Å
2239	N	44.1	Very low	49.5	Very low	54.6667 Å²	54.6667	110.3 Å²	110.3	29%	0.292	55%	0.549	S	S	.	.	H	α-helix	trans	-73.9	-33.4	176.8	-83.4	-26.1	0	0	0	112.9	T2097 L2128 H2235 E2237 L2243	T2097-N2239 PolarHBondContact OG1-ND2 2.83Å; L2128-N2239 WeakPolarHBondContact CD1-OD1 3.48Å; H2235-N2239 PolarHBondContact O-N 2.96Å; E2237-N2239 PolarHBondContact O-N 3.02Å; N2239-L2243 WeakPolarHBondContact O-CB 3.25Å; N2239-L2243 WeakPolarHBondContact O-CD1 3.33Å; N2239-L2243 WeakPolarHBondContact O-CG 3.25Å; N2239-L2243 PolarHBondContact O-N 3.03Å
2240	R	44.1	Very low	51.6	Low	145 Å²	145	110.6 Å²	110.6	55%	0.547	54%	0.538	S	S	.	.	H	α-helix	trans	-69.4	-49.4	173.6	-87.5	179.2	134.9	-173.9	0.3	111.3	D2099 S2236 E2237 L2238 L2243 F2244	D2099-R2240 IonicContact OD2-CZ 3.87Å; D2099-R2240 IonicContact OD2-NE 3.21Å; D2099-R2240 PolarHBondContact OD2-NE 3.02Å; D2099-R2240 IonicContact OD2-NH2 3.3Å; D2099-R2240 PolarHBondContact OD2-NH2 3.35Å; S2236-R2240 PolarHBondContact O-N 3.13Å; E2237-R2240 PolarHBondContact O-N 3.41Å; E2237-R2240 VanDerWaalsContact O-N 3.16Å; L2238-R2240 VanDerWaalsContact C-N 3.31Å; L2238-R2240 PolarHBondContact O-N 3.3Å; R2240-L2243 PolarHBondContact O-N 3.06Å; R2240-F2244 HydrophobicContact CB-CE2 4.46Å; R2240-F2244 HydrophobicContact CG-CE2 4.41Å; R2240-F2244 WeakPolarHBondContact O-CB 3.43Å; R2240-F2244 WeakPolarHBondContact O-CD2 3.22Å; R2240-F2244 PolarHBondContact O-N 3.12Å
2241	S	52.4	Low	54	Low	57.6667 Å²	57.6667	106.4 Å²	106.4	40%	0.403	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-45.3	-179.3	58.9	0	0	0	0	111.6	E2237 L2238 L2243 F2244 E2245	E2237-S2241 WeakPolarHBondContact O-CA 3.16Å; E2237-S2241 WeakPolarHBondContact O-CB 3.28Å; E2237-S2241 PolarHBondContact O-N 3.3Å; E2237-S2241 VanDerWaalsContact O-N 3.08Å; E2237-S2241 PolarHBondContact O-OG 3.18Å; L2238-S2241 WeakPolarHBondContact CA-OG 3.13Å; L2238-S2241 PolarHBondContact O-N 2.86Å; L2238-S2241 PolarHBondContact O-OG 3.02Å; L2238-S2241 VanDerWaalsContact O-OG 3.12Å; S2241-L2243 VanDerWaalsContact C-N 3.33Å; S2241-L2243 PolarHBondContact O-N 3.16Å; S2241-F2244 PolarHBondContact O-N 2.85Å; S2241-E2245 WeakPolarHBondContact O-CA 3.34Å; S2241-E2245 WeakPolarHBondContact O-CB 3.21Å; S2241-E2245 PolarHBondContact O-N 3.15Å
2242	V	60.8	Low	56.3	Low	66 Å²	66	102.7 Å²	102.7	40%	0.4	51%	0.51	S	S	.	.	H	α-helix	trans	-64.8	-35.5	178.8	173.4	0	0	0	0	112.4	L2238 N2246	L2238-V2242 VanDerWaalsContact O-CB 3.26Å; L2238-V2242 WeakPolarHBondContact O-CB 3.3Å; L2238-V2242 VanDerWaalsContact O-CG2 3.29Å; L2238-V2242 WeakPolarHBondContact O-CG2 3.18Å; L2238-V2242 PolarHBondContact O-N 3.1Å; L2238-V2242 VanDerWaalsContact O-N 3.11Å; V2242-N2246 WeakPolarHBondContact CG1-ND2 3.1Å; V2242-N2246 WeakPolarHBondContact O-CA 3.39Å; V2242-N2246 WeakPolarHBondContact O-CB 3.2Å; V2242-N2246 PolarHBondContact O-N 3.15Å; V2242-N2246 VanDerWaalsContact O-N 3.11Å; V2242-N2246 PolarHBondContact O-ND2 3.12Å; V2242-N2246 VanDerWaalsContact O-ND2 3.16Å
2243	L	55.7	Low	58.8	Low	101.667 Å²	101.667	98.2 Å²	98.2	53%	0.532	49%	0.489	S	S	.	.	H	α-helix	trans	-70.5	-44.3	175.2	-104.3	166.9	0	0	0	112.1	N2239 R2240 S2241 E2245 N2246 L2247	N2239-L2243 WeakPolarHBondContact O-CB 3.25Å; N2239-L2243 WeakPolarHBondContact O-CD1 3.33Å; N2239-L2243 WeakPolarHBondContact O-CG 3.25Å; N2239-L2243 PolarHBondContact O-N 3.03Å; R2240-L2243 PolarHBondContact O-N 3.06Å; S2241-L2243 VanDerWaalsContact C-N 3.33Å; S2241-L2243 PolarHBondContact O-N 3.16Å; L2243-E2245 PolarHBondContact O-N 3.16Å; L2243-N2246 PolarHBondContact O-N 3.1Å; L2243-L2247 HydrophobicContact CD2-CD1 3.72Å; L2243-L2247 HydrophobicContact CD2-CG 4.41Å; L2243-L2247 VanDerWaalsContact O-CB 3.31Å; L2243-L2247 WeakPolarHBondContact O-CB 3.33Å; L2243-L2247 PolarHBondContact O-N 3.14Å
2244	F	63.8	Low	61.1	Low	125.333 Å²	125.333	99 Å²	99	55%	0.55	49%	0.485	S	S	.	.	H	α-helix	trans	-66.5	-37.5	176.2	-79.9	-66.1	0	0	0	112.4	R2240 S2241 L2247 R2248	R2240-F2244 HydrophobicContact CB-CE2 4.46Å; R2240-F2244 HydrophobicContact CG-CE2 4.41Å; R2240-F2244 WeakPolarHBondContact O-CB 3.43Å; R2240-F2244 WeakPolarHBondContact O-CD2 3.22Å; R2240-F2244 PolarHBondContact O-N 3.12Å; S2241-F2244 PolarHBondContact O-N 2.85Å; F2244-L2247 WeakPolarHBondContact O-CB 3.32Å; F2244-L2247 PolarHBondContact O-N 3.39Å; F2244-R2248 VanDerWaalsContact O-CB 3.27Å; F2244-R2248 WeakPolarHBondContact O-CB 3.27Å; F2244-R2248 WeakPolarHBondContact O-CG 3.44Å; F2244-R2248 PolarHBondContact O-N 3.09Å
2245	E	68.9	Low	63.3	Low	104.667 Å²	104.667	99.4 Å²	99.4	49%	0.489	49%	0.488	S	S	.	.	H	α-helix	trans	-71	-40.3	177.3	-150.2	75.2	179.4	0	0	110.9	S2241 L2243 L2247 R2248 T2249	S2241-E2245 WeakPolarHBondContact O-CA 3.34Å; S2241-E2245 WeakPolarHBondContact O-CB 3.21Å; S2241-E2245 PolarHBondContact O-N 3.15Å; L2243-E2245 PolarHBondContact O-N 3.16Å; E2245-L2247 VanDerWaalsContact C-N 3.27Å; E2245-L2247 PolarHBondContact O-N 2.79Å; E2245-R2248 WeakPolarHBondContact O-CB 3.45Å; E2245-R2248 PolarHBondContact O-N 3Å; E2245-R2248 VanDerWaalsContact OE2-CD 3.31Å; E2245-R2248 WeakPolarHBondContact OE2-CD 3.37Å; E2245-R2248 IonicContact OE2-CZ 2.65Å; E2245-R2248 IonicContact OE2-NE 2.82Å; E2245-R2248 IonicContact OE2-NH1 2.69Å; E2245-R2248 PolarHBondContact OE2-NH1 3.42Å; E2245-T2249 WeakPolarHBondContact O-CB 2.76Å; E2245-T2249 VanDerWaalsContact O-CG2 3.29Å; E2245-T2249 WeakPolarHBondContact O-CG2 3.27Å; E2245-T2249 PolarHBondContact O-N 3.04Å; E2245-T2249 PolarHBondContact O-OG1 3.13Å
2246	N	69.9	Low	65.3	Low	84.3333 Å²	84.3333	98.5 Å²	98.5	45%	0.451	48%	0.484	S	S	.	.	H	α-helix	trans	-64.5	-37.7	171.7	-86	-51.1	0	0	0	112.4	V2242 L2243 T2249 R2250	V2242-N2246 WeakPolarHBondContact CG1-ND2 3.1Å; V2242-N2246 WeakPolarHBondContact O-CA 3.39Å; V2242-N2246 WeakPolarHBondContact O-CB 3.2Å; V2242-N2246 PolarHBondContact O-N 3.15Å; V2242-N2246 VanDerWaalsContact O-N 3.11Å; V2242-N2246 PolarHBondContact O-ND2 3.12Å; V2242-N2246 VanDerWaalsContact O-ND2 3.16Å; L2243-N2246 PolarHBondContact O-N 3.1Å; N2246-T2249 VanDerWaalsContact CA-OG1 3.25Å; N2246-T2249 WeakPolarHBondContact CA-OG1 3.35Å; N2246-T2249 PolarHBondContact O-OG1 3.31Å; N2246-T2249 VanDerWaalsContact O-OG1 3.09Å; N2246-R2250 VanDerWaalsContact O-CB 3.26Å; N2246-R2250 WeakPolarHBondContact O-CB 3.24Å; N2246-R2250 VanDerWaalsContact O-CG 3.29Å; N2246-R2250 WeakPolarHBondContact O-CG 3.25Å; N2246-R2250 PolarHBondContact O-N 3.27Å; N2246-R2250 VanDerWaalsContact O-N 3.1Å
2247	L	69.7	Low	67.4	Low	96.6667 Å²	96.6667	100.8 Å²	100.8	51%	0.506	49%	0.491	S	S	.	.	H	α-helix	trans	-66.1	-41.6	173.6	-102.1	161.6	0	0	0	111.3	L2243 F2244 E2245 R2250 L2251	L2243-L2247 HydrophobicContact CD2-CD1 3.72Å; L2243-L2247 HydrophobicContact CD2-CG 4.41Å; L2243-L2247 VanDerWaalsContact O-CB 3.31Å; L2243-L2247 WeakPolarHBondContact O-CB 3.33Å; L2243-L2247 PolarHBondContact O-N 3.14Å; F2244-L2247 WeakPolarHBondContact O-CB 3.32Å; F2244-L2247 PolarHBondContact O-N 3.39Å; E2245-L2247 VanDerWaalsContact C-N 3.27Å; E2245-L2247 PolarHBondContact O-N 2.79Å; L2247-R2250 PolarHBondContact O-N 3.41Å; L2247-L2251 HydrophobicContact CD2-CD1 4.4Å; L2247-L2251 VanDerWaalsContact O-CB 3.26Å; L2247-L2251 WeakPolarHBondContact O-CB 3.22Å; L2247-L2251 VanDerWaalsContact O-CG 3.25Å; L2247-L2251 WeakPolarHBondContact O-CG 3.26Å; L2247-L2251 PolarHBondContact O-N 3.06Å
2248	R	73.8	Confident	69.1	Low	155.667 Å²	155.667	98.3 Å²	98.3	59%	0.587	48%	0.481	S	S	*	.	H	α-helix	trans	-62.8	-46.6	174.7	-82.3	178.7	-179.3	147.7	-0.2	112.1	F2244 E2245 L2251 N2252	F2244-R2248 VanDerWaalsContact O-CB 3.27Å; F2244-R2248 WeakPolarHBondContact O-CB 3.27Å; F2244-R2248 WeakPolarHBondContact O-CG 3.44Å; F2244-R2248 PolarHBondContact O-N 3.09Å; E2245-R2248 WeakPolarHBondContact O-CB 3.45Å; E2245-R2248 PolarHBondContact O-N 3Å; E2245-R2248 VanDerWaalsContact OE2-CD 3.31Å; E2245-R2248 WeakPolarHBondContact OE2-CD 3.37Å; E2245-R2248 IonicContact OE2-CZ 2.65Å; E2245-R2248 IonicContact OE2-NE 2.82Å; E2245-R2248 IonicContact OE2-NH1 2.69Å; E2245-R2248 PolarHBondContact OE2-NH1 3.42Å; R2248-L2251 PolarHBondContact O-N 2.96Å; R2248-N2252 VanDerWaalsContact O-CB 3.31Å; R2248-N2252 WeakPolarHBondContact O-CB 3.23Å; R2248-N2252 VanDerWaalsContact O-CG 3.27Å; R2248-N2252 PolarHBondContact O-N 3.48Å; R2248-N2252 PolarHBondContact O-ND2 3.42Å
2249	T	77.7	Confident	70.9	Confident	61.3333 Å²	61.3333	97.8 Å²	97.8	38%	0.376	48%	0.482	S	S	.	.	H	α-helix	trans	-64.6	-43.6	178.4	49.3	0	0	0	0	111.1	E2245 N2246 L2251 N2252 E2253	E2245-T2249 WeakPolarHBondContact O-CB 2.76Å; E2245-T2249 VanDerWaalsContact O-CG2 3.29Å; E2245-T2249 WeakPolarHBondContact O-CG2 3.27Å; E2245-T2249 PolarHBondContact O-N 3.04Å; E2245-T2249 PolarHBondContact O-OG1 3.13Å; N2246-T2249 VanDerWaalsContact CA-OG1 3.25Å; N2246-T2249 WeakPolarHBondContact CA-OG1 3.35Å; N2246-T2249 PolarHBondContact O-OG1 3.31Å; N2246-T2249 VanDerWaalsContact O-OG1 3.09Å; T2249-L2251 PolarHBondContact O-N 3.3Å; T2249-N2252 PolarHBondContact O-N 3.03Å; T2249-E2253 VanDerWaalsContact O-CB 3.31Å; T2249-E2253 WeakPolarHBondContact O-CB 3.37Å; T2249-E2253 VanDerWaalsContact O-CG 3.29Å; T2249-E2253 WeakPolarHBondContact O-CG 3.34Å; T2249-E2253 PolarHBondContact O-N 3.07Å
2250	R	76.8	Confident	72.7	Confident	159.333 Å²	159.333	101 Å²	101	60%	0.601	49%	0.493	S	S	*	.	H	α-helix	trans	-65.9	-36.7	176.4	-70	-60	-170.6	175.5	1.7	113.6	N2246 L2247 E2253 L2254	N2246-R2250 VanDerWaalsContact O-CB 3.26Å; N2246-R2250 WeakPolarHBondContact O-CB 3.24Å; N2246-R2250 VanDerWaalsContact O-CG 3.29Å; N2246-R2250 WeakPolarHBondContact O-CG 3.25Å; N2246-R2250 PolarHBondContact O-N 3.27Å; N2246-R2250 VanDerWaalsContact O-N 3.1Å; L2247-R2250 PolarHBondContact O-N 3.41Å; R2250-E2253 WeakPolarHBondContact CD-OE2 3.36Å; R2250-E2253 IonicContact CZ-OE1 3.23Å; R2250-E2253 IonicContact CZ-OE2 3.51Å; R2250-E2253 IonicContact NE-OE2 3.21Å; R2250-E2253 IonicContact NH1-OE1 2.77Å; R2250-E2253 PolarHBondContact NH1-OE1 2.97Å; R2250-E2253 IonicContact NH1-OE2 3.17Å; R2250-E2253 PolarHBondContact NH1-OE2 3Å; R2250-E2253 PolarHBondContact O-N 3.49Å; R2250-L2254 WeakPolarHBondContact O-CB 3.3Å; R2250-L2254 PolarHBondContact O-N 3.36Å; R2250-L2254 VanDerWaalsContact O-N 3.12Å
2251	L	79.6	Confident	74.1	Confident	97.6667 Å²	97.6667	98.6 Å²	98.6	51%	0.511	49%	0.49	S	S	.	.	H	α-helix	trans	-68.5	-41.2	173.6	-73.7	168.9	0	0	0	111.3	L2247 R2248 T2249 L2254 D2255	L2247-L2251 HydrophobicContact CD2-CD1 4.4Å; L2247-L2251 VanDerWaalsContact O-CB 3.26Å; L2247-L2251 WeakPolarHBondContact O-CB 3.22Å; L2247-L2251 VanDerWaalsContact O-CG 3.25Å; L2247-L2251 WeakPolarHBondContact O-CG 3.26Å; L2247-L2251 PolarHBondContact O-N 3.06Å; R2248-L2251 PolarHBondContact O-N 2.96Å; T2249-L2251 PolarHBondContact O-N 3.3Å; L2251-L2254 CarbonylContact O-C 3.51Å; L2251-L2254 WeakPolarHBondContact O-CB 3.18Å; L2251-L2254 PolarHBondContact O-N 2.87Å; L2251-D2255 WeakPolarHBondContact O-CB 3.42Å; L2251-D2255 PolarHBondContact O-N 3.07Å
2252	N	80	Confident	75.3	Confident	106.333 Å²	106.333	101.2 Å²	101.2	57%	0.569	49%	0.494	S	S	*	.	H	α-helix	trans	-64.5	-42	174.4	-72.3	-18.2	0	0	0	112.1	R2248 T2249 L2254 D2255 E2256	R2248-N2252 VanDerWaalsContact O-CB 3.31Å; R2248-N2252 WeakPolarHBondContact O-CB 3.23Å; R2248-N2252 VanDerWaalsContact O-CG 3.27Å; R2248-N2252 PolarHBondContact O-N 3.48Å; R2248-N2252 PolarHBondContact O-ND2 3.42Å; T2249-N2252 PolarHBondContact O-N 3.03Å; N2252-L2254 VanDerWaalsContact C-N 3.32Å; N2252-L2254 PolarHBondContact O-N 3.4Å; N2252-D2255 CarbonylContact O-C 3.52Å; N2252-D2255 PolarHBondContact O-N 2.91Å; N2252-E2256 VanDerWaalsContact O-CB 3.32Å; N2252-E2256 WeakPolarHBondContact O-CB 3.07Å; N2252-E2256 PolarHBondContact O-N 3.01Å
2253	E	81.4	Confident	76	Confident	85.3333 Å²	85.3333	102.6 Å²	102.6	40%	0.399	50%	0.5	S	S	.	.	H	α-helix	trans	-60.3	-42.3	172.3	-78	176.4	-173	0	0	111	T2249 R2250 E2256 I2257	T2249-E2253 VanDerWaalsContact O-CB 3.31Å; T2249-E2253 WeakPolarHBondContact O-CB 3.37Å; T2249-E2253 VanDerWaalsContact O-CG 3.29Å; T2249-E2253 WeakPolarHBondContact O-CG 3.34Å; T2249-E2253 PolarHBondContact O-N 3.07Å; R2250-E2253 WeakPolarHBondContact CD-OE2 3.36Å; R2250-E2253 IonicContact CZ-OE1 3.23Å; R2250-E2253 IonicContact CZ-OE2 3.51Å; R2250-E2253 IonicContact NE-OE2 3.21Å; R2250-E2253 IonicContact NH1-OE1 2.77Å; R2250-E2253 PolarHBondContact NH1-OE1 2.97Å; R2250-E2253 IonicContact NH1-OE2 3.17Å; R2250-E2253 PolarHBondContact NH1-OE2 3Å; R2250-E2253 PolarHBondContact O-N 3.49Å; E2253-E2256 PolarHBondContact O-N 3.06Å; E2253-I2257 WeakPolarHBondContact O-CB 3.35Å; E2253-I2257 WeakPolarHBondContact O-CD1 3.47Å; E2253-I2257 VanDerWaalsContact O-CG1 3.28Å; E2253-I2257 WeakPolarHBondContact O-CG1 3.32Å; E2253-I2257 PolarHBondContact O-N 3Å
2254	L	82.3	Confident	76.9	Confident	111.667 Å²	111.667	107.6 Å²	107.6	59%	0.585	51%	0.512	S	S	*	.	H	α-helix	trans	-64.4	-41.8	177.8	-145.7	95.9	0	0	0	111.2	R2250 L2251 N2252 E2256 I2257 N2258	R2250-L2254 WeakPolarHBondContact O-CB 3.3Å; R2250-L2254 PolarHBondContact O-N 3.36Å; R2250-L2254 VanDerWaalsContact O-N 3.12Å; L2251-L2254 CarbonylContact O-C 3.51Å; L2251-L2254 WeakPolarHBondContact O-CB 3.18Å; L2251-L2254 PolarHBondContact O-N 2.87Å; N2252-L2254 VanDerWaalsContact C-N 3.32Å; N2252-L2254 PolarHBondContact O-N 3.4Å; L2254-E2256 VanDerWaalsContact C-N 3.34Å; L2254-I2257 PolarHBondContact O-N 2.94Å; L2254-N2258 VanDerWaalsContact O-CB 3.28Å; L2254-N2258 WeakPolarHBondContact O-CB 3.23Å; L2254-N2258 PolarHBondContact O-N 2.81Å
2255	D	81.8	Confident	76.9	Confident	96 Å²	96	107.1 Å²	107.1	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-66.5	-37.3	174.7	-81.5	-25.2	0	0	0	111.7	L2251 N2252 I2257 N2258 T2259	L2251-D2255 WeakPolarHBondContact O-CB 3.42Å; L2251-D2255 PolarHBondContact O-N 3.07Å; N2252-D2255 CarbonylContact O-C 3.52Å; N2252-D2255 PolarHBondContact O-N 2.91Å; D2255-I2257 PolarHBondContact O-N 3.19Å; D2255-N2258 WeakPolarHBondContact O-CB 3.29Å; D2255-N2258 PolarHBondContact O-N 3.44Å; D2255-T2259 VanDerWaalsContact O-CB 3.26Å; D2255-T2259 WeakPolarHBondContact O-CB 3.34Å; D2255-T2259 VanDerWaalsContact O-CG2 3.23Å; D2255-T2259 WeakPolarHBondContact O-CG2 3.28Å; D2255-T2259 PolarHBondContact O-N 2.94Å; D2255-T2259 PolarHBondContact O-OG1 3.25Å
2256	E	82.1	Confident	76.5	Confident	107.667 Å²	107.667	108 Å²	108	50%	0.503	52%	0.522	S	S	.	.	H	α-helix	trans	-67.6	-40.6	175.2	-150.5	-160.3	151.4	0	0	111.6	N2252 E2253 L2254 N2258 T2259 K2260	N2252-E2256 VanDerWaalsContact O-CB 3.32Å; N2252-E2256 WeakPolarHBondContact O-CB 3.07Å; N2252-E2256 PolarHBondContact O-N 3.01Å; E2253-E2256 PolarHBondContact O-N 3.06Å; L2254-E2256 VanDerWaalsContact C-N 3.34Å; E2256-N2258 VanDerWaalsContact C-N 3.32Å; E2256-N2258 PolarHBondContact O-N 2.78Å; E2256-T2259 VanDerWaalsContact CA-OG1 3.26Å; E2256-T2259 WeakPolarHBondContact CA-OG1 3.35Å; E2256-T2259 PolarHBondContact O-N 2.94Å; E2256-T2259 PolarHBondContact O-OG1 2.83Å; E2256-K2260 VanDerWaalsContact O-CB 3.23Å; E2256-K2260 WeakPolarHBondContact O-CB 3.22Å; E2256-K2260 WeakPolarHBondContact O-CG 3.46Å; E2256-K2260 PolarHBondContact O-N 3.09Å; E2256-K2260 WeakPolarHBondContact OE1-CE 3.43Å; E2256-K2260 IonicContact OE1-NZ 3.19Å; E2256-K2260 PolarHBondContact OE1-NZ 3.03Å
2257	I	84.3	Confident	75.4	Confident	100 Å²	100	111 Å²	111	51%	0.513	54%	0.537	S	S	.	.	H	α-helix	trans	-64.6	-44.3	172.6	-69.8	165.7	0	0	0	110.1	E2253 L2254 D2255 T2259 K2260 L2261	E2253-I2257 WeakPolarHBondContact O-CB 3.35Å; E2253-I2257 WeakPolarHBondContact O-CD1 3.47Å; E2253-I2257 VanDerWaalsContact O-CG1 3.28Å; E2253-I2257 WeakPolarHBondContact O-CG1 3.32Å; E2253-I2257 PolarHBondContact O-N 3Å; L2254-I2257 PolarHBondContact O-N 2.94Å; D2255-I2257 PolarHBondContact O-N 3.19Å; I2257-T2259 VanDerWaalsContact C-N 3.33Å; I2257-T2259 PolarHBondContact O-N 3.46Å; I2257-K2260 CarbonylContact O-C 3.57Å; I2257-K2260 PolarHBondContact O-N 3Å; I2257-L2261 HydrophobicContact CG2-CD1 4.1Å; I2257-L2261 VanDerWaalsContact O-CB 3.28Å; I2257-L2261 WeakPolarHBondContact O-CB 3.2Å; I2257-L2261 PolarHBondContact O-N 3.18Å
2258	N	79.7	Confident	73.7	Confident	68 Å²	68	110.4 Å²	110.4	36%	0.364	54%	0.541	S	S	.	.	H	α-helix	trans	-66.6	-37	179.8	-162.4	2	0	0	0	111.3	L2254 D2255 E2256 L2261 K2262	L2254-N2258 VanDerWaalsContact O-CB 3.28Å; L2254-N2258 WeakPolarHBondContact O-CB 3.23Å; L2254-N2258 PolarHBondContact O-N 2.81Å; D2255-N2258 WeakPolarHBondContact O-CB 3.29Å; D2255-N2258 PolarHBondContact O-N 3.44Å; E2256-N2258 VanDerWaalsContact C-N 3.32Å; E2256-N2258 PolarHBondContact O-N 2.78Å; N2258-L2261 PolarHBondContact O-N 3.09Å; N2258-K2262 WeakPolarHBondContact O-CB 3.34Å; N2258-K2262 VanDerWaalsContact O-CG 3.23Å; N2258-K2262 WeakPolarHBondContact O-CG 3.27Å; N2258-K2262 PolarHBondContact O-N 3.11Å; N2258-K2262 WeakPolarHBondContact OD1-CE 3.47Å; N2258-K2262 PolarHBondContact OD1-NZ 2.95Å
2259	T	81	Confident	71.8	Confident	69.3333 Å²	69.3333	109.4 Å²	109.4	43%	0.425	55%	0.553	S	S	.	*	H	α-helix	trans	-69.9	-41.6	171.4	57.8	0	0	0	0	112	D2255 E2256 I2257 L2261 K2262 N2263	D2255-T2259 VanDerWaalsContact O-CB 3.26Å; D2255-T2259 WeakPolarHBondContact O-CB 3.34Å; D2255-T2259 VanDerWaalsContact O-CG2 3.23Å; D2255-T2259 WeakPolarHBondContact O-CG2 3.28Å; D2255-T2259 PolarHBondContact O-N 2.94Å; D2255-T2259 PolarHBondContact O-OG1 3.25Å; E2256-T2259 VanDerWaalsContact CA-OG1 3.26Å; E2256-T2259 WeakPolarHBondContact CA-OG1 3.35Å; E2256-T2259 PolarHBondContact O-N 2.94Å; E2256-T2259 PolarHBondContact O-OG1 2.83Å; I2257-T2259 VanDerWaalsContact C-N 3.33Å; I2257-T2259 PolarHBondContact O-N 3.46Å; T2259-L2261 VanDerWaalsContact C-N 3.3Å; T2259-L2261 PolarHBondContact O-N 3.11Å; T2259-K2262 PolarHBondContact O-N 2.89Å; T2259-N2263 WeakPolarHBondContact O-CB 3.26Å; T2259-N2263 PolarHBondContact O-N 3.15Å; T2259-N2263 PolarHBondContact O-ND2 3.3Å; T2259-N2263 PolarHBondContact O-OD1 3.49Å
2260	K	80.6	Confident	69.7	Low	122.333 Å²	122.333	111.5 Å²	111.5	53%	0.532	57%	0.57	S	S	.	*	H	α-helix	trans	-60.2	-40	171.4	-86.4	171.9	174.8	157.3	0	112	E2256 I2257 N2263 R2264	E2256-K2260 VanDerWaalsContact O-CB 3.23Å; E2256-K2260 WeakPolarHBondContact O-CB 3.22Å; E2256-K2260 WeakPolarHBondContact O-CG 3.46Å; E2256-K2260 PolarHBondContact O-N 3.09Å; E2256-K2260 WeakPolarHBondContact OE1-CE 3.43Å; E2256-K2260 IonicContact OE1-NZ 3.19Å; E2256-K2260 PolarHBondContact OE1-NZ 3.03Å; I2257-K2260 CarbonylContact O-C 3.57Å; I2257-K2260 PolarHBondContact O-N 3Å; K2260-N2263 PolarHBondContact O-N 2.71Å; K2260-R2264 VanDerWaalsContact O-CB 3.28Å; K2260-R2264 WeakPolarHBondContact O-CB 3.05Å; K2260-R2264 VanDerWaalsContact O-CG 3.26Å; K2260-R2264 WeakPolarHBondContact O-CG 3.33Å; K2260-R2264 PolarHBondContact O-N 3.05Å
2261	L	74.5	Confident	67.6	Low	93.3333 Å²	93.3333	111.3 Å²	111.3	49%	0.489	58%	0.58	S	S	.	*	H	α-helix	trans	-71.5	-45.1	179.1	-133.7	158.2	0	0	0	110.8	I2257 N2258 T2259 N2263 R2264 L2265	I2257-L2261 HydrophobicContact CG2-CD1 4.1Å; I2257-L2261 VanDerWaalsContact O-CB 3.28Å; I2257-L2261 WeakPolarHBondContact O-CB 3.2Å; I2257-L2261 PolarHBondContact O-N 3.18Å; N2258-L2261 PolarHBondContact O-N 3.09Å; T2259-L2261 VanDerWaalsContact C-N 3.3Å; T2259-L2261 PolarHBondContact O-N 3.11Å; L2261-N2263 VanDerWaalsContact C-N 3.32Å; L2261-N2263 PolarHBondContact O-N 3.18Å; L2261-R2264 PolarHBondContact O-N 2.89Å; L2261-L2265 HydrophobicContact CD2-CD1 3.66Å; L2261-L2265 HydrophobicContact CD2-CG 4.08Å; L2261-L2265 VanDerWaalsContact O-CB 3.23Å; L2261-L2265 WeakPolarHBondContact O-CB 3.26Å; L2261-L2265 WeakPolarHBondContact O-CD1 3.15Å; L2261-L2265 VanDerWaalsContact O-CG 3.25Å; L2261-L2265 WeakPolarHBondContact O-CG 3.31Å; L2261-L2265 PolarHBondContact O-N 3.28Å
2262	K	77.3	Confident	65.3	Low	112 Å²	112	115.6 Å²	115.6	49%	0.487	60%	0.598	S	S	.	*	H	α-helix	trans	-58.6	-41.5	170.6	-76.4	171.2	-179.3	171.2	0	111.8	N2258 T2259 R2264 L2265 N2266	N2258-K2262 WeakPolarHBondContact O-CB 3.34Å; N2258-K2262 VanDerWaalsContact O-CG 3.23Å; N2258-K2262 WeakPolarHBondContact O-CG 3.27Å; N2258-K2262 PolarHBondContact O-N 3.11Å; N2258-K2262 WeakPolarHBondContact OD1-CE 3.47Å; N2258-K2262 PolarHBondContact OD1-NZ 2.95Å; T2259-K2262 PolarHBondContact O-N 2.89Å; K2262-R2264 PolarHBondContact O-N 3.07Å; K2262-L2265 PolarHBondContact O-N 3.16Å; K2262-N2266 WeakPolarHBondContact O-CA 3.38Å; K2262-N2266 WeakPolarHBondContact O-CB 3.39Å; K2262-N2266 VanDerWaalsContact O-CG 3.32Å; K2262-N2266 PolarHBondContact O-N 3.07Å; K2262-N2266 PolarHBondContact O-ND2 2.9Å; K2262-N2266 VanDerWaalsContact O-ND2 3.15Å
2263	N	75	Confident	63.1	Low	95 Å²	95	119.2 Å²	119.2	51%	0.508	61%	0.609	S	S	.	*	H	α-helix	trans	-66.1	-41.3	175.8	-71.4	-19.9	0	0	0	111.4	T2259 K2260 L2261 N2266 L2267	T2259-N2263 WeakPolarHBondContact O-CB 3.26Å; T2259-N2263 PolarHBondContact O-N 3.15Å; T2259-N2263 PolarHBondContact O-ND2 3.3Å; T2259-N2263 PolarHBondContact O-OD1 3.49Å; K2260-N2263 PolarHBondContact O-N 2.71Å; L2261-N2263 VanDerWaalsContact C-N 3.32Å; L2261-N2263 PolarHBondContact O-N 3.18Å; N2263-N2266 CarbonylContact O-C 3.5Å; N2263-N2266 PolarHBondContact O-N 3.14Å; N2263-L2267 HydrophobicContact CB-CD1 4.1Å; N2263-L2267 WeakPolarHBondContact O-CB 3.28Å; N2263-L2267 WeakPolarHBondContact O-CD1 3.35Å; N2263-L2267 PolarHBondContact O-N 3.09Å; N2263-L2267 VanDerWaalsContact O-N 3.1Å
2264	R	74.2	Confident	60.7	Low	208.333 Å²	208.333	125.2 Å²	125.2	79%	0.786	63%	0.634	S	S	*	*	H	α-helix	trans	-67.8	-33.8	175.2	-73.8	-179.5	91.8	171.9	3.5	113	K2260 L2261 K2262 N2266 L2267	K2260-R2264 VanDerWaalsContact O-CB 3.28Å; K2260-R2264 WeakPolarHBondContact O-CB 3.05Å; K2260-R2264 VanDerWaalsContact O-CG 3.26Å; K2260-R2264 WeakPolarHBondContact O-CG 3.33Å; K2260-R2264 PolarHBondContact O-N 3.05Å; L2261-R2264 PolarHBondContact O-N 2.89Å; K2262-R2264 PolarHBondContact O-N 3.07Å; R2264-N2266 VanDerWaalsContact C-N 3.33Å; R2264-L2267 PolarHBondContact O-N 3.5Å
2265	L	64.3	Low	58.2	Low	114 Å²	114	129.2 Å²	129.2	60%	0.597	65%	0.647	S	S	*	*	H	α-helix	trans	-75.5	-30.8	175.5	-70.9	169.8	0	0	0	112.5	L2261 K2262 L2267 S2268	L2261-L2265 HydrophobicContact CD2-CD1 3.66Å; L2261-L2265 HydrophobicContact CD2-CG 4.08Å; L2261-L2265 VanDerWaalsContact O-CB 3.23Å; L2261-L2265 WeakPolarHBondContact O-CB 3.26Å; L2261-L2265 WeakPolarHBondContact O-CD1 3.15Å; L2261-L2265 VanDerWaalsContact O-CG 3.25Å; L2261-L2265 WeakPolarHBondContact O-CG 3.31Å; L2261-L2265 PolarHBondContact O-N 3.28Å; K2262-L2265 PolarHBondContact O-N 3.16Å; L2265-L2267 VanDerWaalsContact C-N 3.31Å; L2265-L2267 PolarHBondContact O-N 3.42Å; L2265-S2268 PolarHBondContact O-OG 3.25Å
2266	N	59.5	Low	55.8	Low	124 Å²	124	128.9 Å²	128.9	66%	0.663	65%	0.652	S	S	*	*	H	α-helix	trans	-83.4	-11.2	176.6	-69.1	-19.6	0	0	0	113.5	K2262 N2263 R2264 S2268	K2262-N2266 WeakPolarHBondContact O-CA 3.38Å; K2262-N2266 WeakPolarHBondContact O-CB 3.39Å; K2262-N2266 VanDerWaalsContact O-CG 3.32Å; K2262-N2266 PolarHBondContact O-N 3.07Å; K2262-N2266 PolarHBondContact O-ND2 2.9Å; K2262-N2266 VanDerWaalsContact O-ND2 3.15Å; N2263-N2266 CarbonylContact O-C 3.5Å; N2263-N2266 PolarHBondContact O-N 3.14Å; R2264-N2266 VanDerWaalsContact C-N 3.33Å; N2266-S2268 PolarHBondContact O-N 3.24Å; N2266-S2268 VanDerWaalsContact O-N 3.16Å
2267	L	46.7	Very low	53.6	Low	147 Å²	147	132.3 Å²	132.3	77%	0.77	67%	0.668	S	S	*	*			trans	-93.3	45.2	169.7	-88.6	90.2	0	0	0	111.7	N2263 R2264 L2265	N2263-L2267 HydrophobicContact CB-CD1 4.1Å; N2263-L2267 WeakPolarHBondContact O-CB 3.28Å; N2263-L2267 WeakPolarHBondContact O-CD1 3.35Å; N2263-L2267 PolarHBondContact O-N 3.09Å; N2263-L2267 VanDerWaalsContact O-N 3.1Å; R2264-L2267 PolarHBondContact O-N 3.5Å; L2265-L2267 VanDerWaalsContact C-N 3.31Å; L2265-L2267 PolarHBondContact O-N 3.42Å
2268	S	35.7	Very low	51.1	Low	83.6667 Å²	83.6667	131.3 Å²	131.3	59%	0.585	68%	0.675	S	S	*	*			trans	-115.5	75.8	169.9	65.3	0	0	0	0	111.6	L2265 N2266	L2265-S2268 PolarHBondContact O-OG 3.25Å; N2266-S2268 PolarHBondContact O-N 3.24Å; N2266-S2268 VanDerWaalsContact O-N 3.16Å
2269	T	34.2	Very low	49	Very low	135.667 Å²	135.667	134.6 Å²	134.6	83%	0.832	69%	0.692	S	S	*	*	S	Bend	trans	159.9	56.6	167.3	55.5	0	0	0	0	115
2270	S	33.1	Very low	46.8	Very low	104.667 Å²	104.667	137.4 Å²	137.4	73%	0.732	71%	0.705	S	S	*	*			trans	-158.4	99.7	156.3	32.2	0	0	0	0	112.4
2271	N	32.5	Very low	44.6	Very low	154.333 Å²	154.333	138.3 Å²	138.3	83%	0.825	72%	0.715	S	S	*	*			trans	105.8	79	155.6	-65.4	-19	0	0	0	115.3	K2273	N2271-K2273 PolarHBondContact O-N 3.27Å
2272	E	31	Very low	42.5	Very low	189.667 Å²	189.667	138.6 Å²	138.6	89%	0.886	72%	0.721	S	S	*	*			trans	-33.3	101.9	133.2	-66.3	-177.7	158.2	0	0	112
2273	K	33	Very low	40.4	Very low	181.667 Å²	181.667	138.5 Å²	138.5	79%	0.79	73%	0.73	S	S	*	*			trans	175	70	153.2	-100.8	165.3	-174	-179.6	0	111.9	N2271 F2275	N2271-K2273 PolarHBondContact O-N 3.27Å; K2273-F2275 HydrophobicContact CB-CD2 4.34Å; K2273-F2275 HydrophobicContact CD-CE2 4.49Å; K2273-F2275 HydrophobicContact CG-CD2 3.76Å; K2273-F2275 HydrophobicContact CG-CE2 3.53Å
2274	F	31.6	Very low	38.5	Very low	210.333 Å²	210.333	140 Å²	140	92%	0.923	74%	0.738	S	S	*	*			trans	-139.5	59	153.6	-93	-74.6	0	0	0	110.5
2275	F	29.6	Very low	36.6	Very low	196.667 Å²	196.667	136.3 Å²	136.3	86%	0.863	73%	0.733	S	S	*	*			trans	-92.3	124.3	153.4	-83.9	-84.5	0	0	0	108.8	K2273	K2273-F2275 HydrophobicContact CB-CD2 4.34Å; K2273-F2275 HydrophobicContact CD-CE2 4.49Å; K2273-F2275 HydrophobicContact CG-CD2 3.76Å; K2273-F2275 HydrophobicContact CG-CE2 3.53Å
2276	S	31.6	Very low	35.3	Very low	89.6667 Å²	89.6667	136.7 Å²	136.7	63%	0.627	74%	0.735	S	S	*	*				-171.9	145.3	110.7	48.7	0	0	0	0	110.9
2277	H	35.4	Very low	34.1	Very low	179 Å²	179	138.7 Å²	138.7	83%	0.829	74%	0.738	S	S	*	*			trans	82.6	121.4	164.5	-53.9	-59	0	0	0	117.5
2278	A	32.7	Very low	33.3	Very low	79.6667 Å²	79.6667	137.5 Å²	137.5	66%	0.658	73%	0.733	S	S	*	*			cis	-144.6	159.8	19.5	0	0	0	0	0	107.9
2279	D	35.9	Very low	33.1	Very low	136.667 Å²	136.667	142.6 Å²	142.6	73%	0.731	74%	0.74	S	S	*	*			trans	74.1	120.6	142.7	-54	-28.7	0	0	0	116.5
2280	N	34.4	Very low	32.9	Very low	128 Å²	128	141.7 Å²	141.7	68%	0.684	73%	0.73	S	S	*	*			cis	173.7	133.9	19.6	-98.6	-42.6	0	0	0	109
2281	N	33.4	Very low	32.8	Very low	140 Å²	140	142.4 Å²	142.4	75%	0.749	73%	0.726	S	S	*	*			trans	74.2	132.1	136.1	-73.1	-15.4	0	0	0	121.9
2282	T	31.6	Very low	32.8	Very low	100 Å²	100	141.2 Å²	141.2	61%	0.613	72%	0.719	S	S	*	*			cis	154.5	133.3	15.6	-57.6	0	0	0	0	109.7
2283	T	32.9	Very low	32.8	Very low	111.333 Å²	111.333	137.6 Å²	137.6	68%	0.683	71%	0.711	S	S	*	*			trans	62.6	148.1	146.9	59.5	0	0	0	0	119
2284	D	34.5	Very low	32.6	Very low	126.333 Å²	126.333	135 Å²	135	68%	0.676	71%	0.705	S	S	*	*			cis	-175.9	159.8	6	-117.1	-17.4	0	0	0	110.1
2285	I	35.4	Very low	32.6	Very low	130.667 Å²	130.667	131.4 Å²	131.4	67%	0.67	69%	0.693	S	S	*	*			trans	72.9	112.9	137.3	-68.3	164.6	0	0	0	120.7
2286	D	35.6	Very low	32.6	Very low	120.667 Å²	120.667	129.7 Å²	129.7	65%	0.645	69%	0.685	S	S	*	*			trans	61.7	123.2	131.9	-68.9	-12.5	0	0	0	123.5
2287	K	34.3	Very low	32.4	Very low	166 Å²	166	131.4 Å²	131.4	72%	0.722	69%	0.687	S	S	*	*				105	115.4	120.9	-78.9	168.1	-174.5	128.6	0	117
2288	N	30.9	Very low	32.2	Very low	123.333 Å²	123.333	130.5 Å²	130.5	66%	0.66	68%	0.683	S	S	*	*				91.9	136.1	103	-102.1	1.6	0	0	0	117.2
2289	Y	31.4	Very low	32	Very low	189.333 Å²	189.333	130.9 Å²	130.9	74%	0.742	68%	0.682	S	S	*	*			trans	72.1	122.4	156.1	-68	-69	0	0	0	118
2290	N	30.9	Very low	31.6	Very low	117.333 Å²	117.333	132.7 Å²	132.7	63%	0.627	68%	0.683	S	S	*	*				102.4	143.1	96.1	-92.3	25.5	0	0	0	114.4
2291	D	30.4	Very low	31.2	Very low	119 Å²	119	134.2 Å²	134.2	64%	0.636	68%	0.684	S	S	*	*				96.4	142.3	89.7	-86.6	-23.9	0	0	0	114.5
2292	D	31.3	Very low	30.9	Very low	129.667 Å²	129.667	132.6 Å²	132.6	69%	0.693	68%	0.675	S	S	*	*			trans	73.6	119.2	140.2	-71.1	-21.5	0	0	0	119.2
2293	T	32.4	Very low	30.8	Very low	114.667 Å²	114.667	135.3 Å²	135.3	70%	0.703	68%	0.681	S	S	*	*				111.7	123.5	106.4	51.7	0	0	0	0	115
2294	N	29	Very low	30.5	Very low	125.667 Å²	125.667	134.9 Å²	134.9	67%	0.672	68%	0.683	S	S	*	*				81.2	124.9	103.2	-98.9	-29.9	0	0	0	116.7
2295	M	31.2	Very low	30.3	Very low	135.333 Å²	135.333	133.5 Å²	133.5	67%	0.667	68%	0.683	S	S	*	*			trans	88.2	106.5	137.8	-63.3	-83.4	163.1	0	0	115.5
2296	K	28.4	Very low	30	Very low	162.333 Å²	162.333	135.6 Å²	135.6	71%	0.706	69%	0.69	S	S	*	*				98	143	76.6	-93.2	177.1	-178.3	176.8	0	114.3
2297	N	28.5	Very low	29.8	Very low	124.333 Å²	124.333	136.4 Å²	136.4	67%	0.665	69%	0.694	S	S	*	*			trans	87.4	128.1	146.1	-63.4	3.5	0	0	0	116
2298	E	30.5	Very low	29.5	Very low	159.667 Å²	159.667	137.1 Å²	137.1	75%	0.746	70%	0.697	S	S	*	*			cis	170.7	118.6	45.9	-90.1	155.1	-142.6	0	0	109.4
2299	S	28.8	Very low	29.4	Very low	89.3333 Å²	89.3333	138.1 Å²	138.1	63%	0.625	70%	0.702	S	S	*	*				96.1	137.8	82.1	62.3	0	0	0	0	113.9
2300	F	27	Very low	29.1	Very low	173.667 Å²	173.667	137 Å²	137	76%	0.762	70%	0.704	S	S	*	*			trans	70.2	119.1	140.6	-71.5	-80	0	0	0	114.6
2301	F	27.1	Very low	29	Very low	159.333 Å²	159.333	136.2 Å²	136.2	70%	0.699	71%	0.707	S	S	*	*				144.5	135.3	50.9	-118.9	-82.4	0	0	0	107.4
2302	N	27.9	Very low	29	Very low	106.667 Å²	106.667	137.5 Å²	137.5	57%	0.57	71%	0.713	S	S	*	*				91.2	147.8	127.7	-78.8	-18.8	0	0	0	116.6
2303	Q	28.7	Very low	28.8	Very low	155.667 Å²	155.667	137.7 Å²	137.7	73%	0.727	72%	0.715	S	S	*	*			cis	161.9	140.2	26	-99.9	165	6.6	0	0	110.9
2304	S	26.9	Very low	28.8	Very low	103.667 Å²	103.667	139.8 Å²	139.8	73%	0.725	72%	0.716	S	S	*	*				84.5	146.3	120.3	38	0	0	0	0	115.8
2305	S	30.1	Very low	28.7	Very low	97.6667 Å²	97.6667	141.9 Å²	141.9	68%	0.683	72%	0.722	S	S	*	*				116.2	125.7	114.6	64.1	0	0	0	0	115.8
2306	Q	29.5	Very low	28.8	Very low	174.333 Å²	174.333	141.5 Å²	141.5	82%	0.815	72%	0.721	S	S	*	*				-164.4	126.3	99	-107.2	177	0.5	0	0	112
2307	N	30.1	Very low	28.8	Very low	138 Å²	138	140.2 Å²	140.2	74%	0.738	72%	0.722	S	S	*	*			trans	88.9	103.4	143.2	-78.4	-18.6	0	0	0	115.2
2308	K	27.5	Very low	28.9	Very low	179.333 Å²	179.333	144 Å²	144	78%	0.78	73%	0.728	S	S	*	*			trans	149.8	123	133.8	-95.7	177.5	172.8	179.6	0	115.5
2309	L	29.5	Very low	28.7	Very low	144.667 Å²	144.667	140.6 Å²	140.6	76%	0.757	72%	0.722	S	S	*	*			trans	102.9	103.6	133.3	-66.7	165.4	0	0	0	111.8
2310	Q	26	Very low	28.6	Very low	167.333 Å²	167.333	141.7 Å²	141.7	78%	0.782	73%	0.725	S	S	*	*			cis	71.4	118.9	48.1	-157.9	176.4	28.1	0	0	112.3
2311	S	28.8	Very low	28.8	Very low	100.333 Å²	100.333	141.2 Å²	141.2	70%	0.702	73%	0.73	S	S	*	*			trans	101	137.5	164.5	69.8	0	0	0	0	113.4
2312	L	30.4	Very low	28.8	Very low	146 Å²	146	138.4 Å²	138.4	76%	0.764	73%	0.726	S	S	*	*			cis	179.9	120.7	41.6	-76.7	152.5	0	0	0	109.9
2313	N	26.9	Very low	28.7	Very low	134.333 Å²	134.333	140 Å²	140	72%	0.718	73%	0.734	S	S	*	*				58.6	131.2	83	-74	13.2	0	0	0	114.2
2314	E	31.2	Very low	28.7	Very low	158.333 Å²	158.333	139.7 Å²	139.7	74%	0.74	74%	0.737	S	S	*	*				165.8	120.1	97.3	-88.7	155.6	-157	0	0	111.7
2315	E	27	Very low	28.9	Very low	169.333 Å²	169.333	142 Å²	142	79%	0.791	74%	0.741	S	S	*	*				62.1	117.7	96.4	-149.3	174.5	-166	0	0	113.2
2316	I	34.3	Very low	28.6	Very low	127 Å²	127	142.2 Å²	142.2	65%	0.651	74%	0.742	S	S	*	*				-157.3	124.9	92	-69.8	168.5	0	0	0	111.2	Y2318	I2316-Y2318 HydrophobicContact CB-CE2 4.41Å; I2316-Y2318 HydrophobicContact CG2-CD2 3.62Å; I2316-Y2318 HydrophobicContact CG2-CE2 3.41Å; I2316-Y2318 HydrophobicContact CG2-CG 4.36Å
2317	D	27.9	Very low	28.5	Very low	134.333 Å²	134.333	141.1 Å²	141.1	72%	0.718	74%	0.741	S	S	*	*			trans	-33.9	142.1	149.8	-79.1	-38.9	0	0	0	115.7
2318	Y	30.8	Very low	28.4	Very low	204.667 Å²	204.667	139 Å²	139	80%	0.803	74%	0.737	S	S	*	*			trans	-134.6	103.8	132.9	-93	-72.3	0	0	0	111.9	I2316	I2316-Y2318 HydrophobicContact CB-CE2 4.41Å; I2316-Y2318 HydrophobicContact CG2-CD2 3.62Å; I2316-Y2318 HydrophobicContact CG2-CE2 3.41Å; I2316-Y2318 HydrophobicContact CG2-CG 4.36Å
2319	S	25.4	Very low	28.3	Very low	88 Å²	88	137.8 Å²	137.8	62%	0.615	73%	0.734	S	S	*	*			trans	-65.2	159.4	151.1	54.3	0	0	0	0	111.5
2320	T	26.9	Very low	28.4	Very low	112.667 Å²	112.667	139.2 Å²	139.2	69%	0.691	74%	0.737	S	S	*	*			trans	103.8	101.7	139.9	-15.7	0	0	0	0	114.4	V2322	T2320-V2322 HydrophobicContact CG2-CG2 3.89Å
2321	L	30.8	Very low	28.4	Very low	164.333 Å²	164.333	138.5 Å²	138.5	86%	0.86	73%	0.733	S	S	*	*				-164.8	97.6	121.7	-93.7	165.7	0	0	0	105.6
2322	V	27.8	Very low	28.5	Very low	100.667 Å²	100.667	139.2 Å²	139.2	61%	0.61	74%	0.736	S	S	*	*				66	105.3	70.4	179.7	0	0	0	0	112.9	T2320	T2320-V2322 HydrophobicContact CG2-CG2 3.89Å
2323	N	26.4	Very low	28.3	Very low	140 Å²	140	139 Å²	139	75%	0.749	73%	0.73	S	S	*	*			trans	50.3	124.9	141.8	-57.2	-13.9	0	0	0	120.1
2324	D	28.7	Very low	28.4	Very low	147.667 Å²	147.667	143.1 Å²	143.1	79%	0.79	74%	0.737	S	S	*	*			trans	158.8	132.3	131.1	-87.9	-22.7	0	0	0	112.5
2325	L	30	Very low	28.1	Very low	154 Å²	154	139.5 Å²	139.5	81%	0.806	73%	0.73	S	S	*	*				158.2	114.2	117.9	-109.8	80.3	0	0	0	112.4
2326	S	24.7	Very low	28.2	Very low	100.667 Å²	100.667	139.5 Å²	139.5	70%	0.704	73%	0.729	S	S	*	*			trans	-65.4	138.7	132.5	62.2	0	0	0	0	113.2
2327	L	28	Very low	27.9	Very low	150.667 Å²	150.667	141.5 Å²	141.5	79%	0.789	74%	0.736	S	S	*	*			trans	104.6	122.2	162.4	-87.8	95.3	0	0	0	115.3
2328	S	26.6	Very low	27.7	Very low	94 Å²	94	142.5 Å²	142.5	66%	0.657	74%	0.74	S	S	*	*				-148.2	146.9	65.3	54.3	0	0	0	0	113.3
2329	Q	27	Very low	27.6	Very low	154.333 Å²	154.333	136.8 Å²	136.8	72%	0.721	74%	0.736	S	S	*	*				73.4	98.6	119.3	-65.3	177.1	-9.8	0	0	117.3
2330	H	30.3	Very low	27.5	Very low	174.333 Å²	174.333	139.7 Å²	139.7	81%	0.807	74%	0.744	S	S	*	*				176.1	122.3	104.7	-90.7	-68.7	0	0	0	110.7
2331	Q	25.9	Very low	27.5	Very low	152.333 Å²	152.333	142.4 Å²	142.4	71%	0.712	75%	0.754	S	S	*	*				-50.2	154.9	128.2	-96.4	-177.4	-32.3	0	0	111.4	H2333	Q2331-H2333 PolarHBondContact NE2-CD2 2.9Å; Q2331-H2333 PolarHBondContact NE2-NE2 3.46Å
2332	P	30.5	Very low	27.2	Very low	115.333 Å²	115.333	143.4 Å²	143.4	75%	0.749	75%	0.754	S	S	*	*				-134.4	142.3	82.3	34.1	-19	0	0	0	114.1
2333	H	26.5	Very low	27.2	Very low	141 Å²	141	142.5 Å²	142.5	65%	0.653	76%	0.756	S	S	*	*			trans	-16.1	134.3	138.9	-72.2	-87.9	0	0	0	115.2	Q2331	Q2331-H2333 PolarHBondContact NE2-CD2 2.9Å; Q2331-H2333 PolarHBondContact NE2-NE2 3.46Å
2334	Y	30.2	Very low	27.2	Very low	221.667 Å²	221.667	142.9 Å²	142.9	87%	0.869	76%	0.758	S	S	*	*				-162	105.9	129.4	-99.6	-79.6	0	0	0	107.5
2335	S	25.3	Very low	27.1	Very low	82.3333 Å²	82.3333	143.3 Å²	143.3	58%	0.576	76%	0.761	S	S	*	*				52.1	134.7	79.8	90.5	0	0	0	0	113.9
2336	Q	28.4	Very low	26.9	Very low	168.667 Å²	168.667	143.9 Å²	143.9	79%	0.788	76%	0.759	S	S	*	*			trans	112.1	117.1	155.4	-76.8	170.4	-18.1	0	0	114.2
2337	H	27.2	Very low	27.1	Very low	170.667 Å²	170.667	146.5 Å²	146.5	79%	0.79	77%	0.765	S	S	*	*				175.1	125.3	69.3	-110.6	-89.2	0	0	0	111.5
2338	L	24.3	Very low	26.9	Very low	154.333 Å²	154.333	146.3 Å²	146.3	81%	0.808	76%	0.762	S	S	*	*				-94.5	149.9	129.2	-82.5	145.7	0	0	0	110.6
2339	A	27.9	Very low	26.8	Very low	85 Å²	85	149.5 Å²	149.5	70%	0.702	77%	0.771	S	S	*	*				-171.4	122.6	123.3	0	0	0	0	0	107.5
2340	D	24.8	Very low	26.7	Very low	149.667 Å²	149.667	150.6 Å²	150.6	80%	0.8	77%	0.77	S	S	*	*			trans	-22.8	127.3	140.3	-59.8	-58.2	0	0	0	112.1
2341	L	26.4	Very low	26.5	Very low	169 Å²	169	148.4 Å²	148.4	89%	0.885	77%	0.769	S	S	*	*			trans	-150.9	89.6	146.9	-106.2	160.9	0	0	0	109.9	A2343	L2341-A2343 HydrophobicContact CD2-CB 4.27Å
2342	H	24.3	Very low	26.3	Very low	186 Å²	186	147.3 Å²	147.3	86%	0.861	77%	0.767	S	S	*	*			trans	-74.5	119.5	153.7	-121.2	-85.6	0	0	0	107.6
2343	A	28.5	Very low	26.1	Very low	80 Å²	80	146.3 Å²	146.3	66%	0.661	76%	0.763	S	S	*	*			trans	-155.7	123.9	157.6	0	0	0	0	0	109.9	L2341 D2345	L2341-A2343 HydrophobicContact CD2-CB 4.27Å; A2343-D2345 PolarHBondContact O-N 3.1Å
2344	N	26.2	Very low	25.9	Very low	148.333 Å²	148.333	147.4 Å²	147.4	79%	0.793	77%	0.766	S	S	*	*			trans	-51.9	120.8	159.8	-59.2	-23.7	0	0	0	111.4
2345	D	26.8	Very low	25.6	Very low	157 Å²	157	147.1 Å²	147.1	84%	0.84	77%	0.77	S	S	*	*				-128.8	143.2	129.2	-86.5	-31.7	0	0	0	111.3	A2343 N2347	A2343-D2345 PolarHBondContact O-N 3.1Å; D2345-N2347 PolarHBondContact O-N 3.44Å
2346	E	25.4	Very low	25.5	Very low	166.333 Å²	166.333	150.4 Å²	150.4	78%	0.777	78%	0.776	S	S	*	*			trans	-27.5	111.1	170.9	-56	-176.4	149.2	0	0	112.6	Q2420	E2346-Q2420 PolarHBondContact OE1-NE2 2.89Å
2347	N	28.2	Very low	25.3	Very low	155 Å²	155	147.9 Å²	147.9	83%	0.829	78%	0.776	S	S	*	*				-173.7	118.9	129.1	-96.4	-49.1	0	0	0	112.2	D2345 L2349	D2345-N2347 PolarHBondContact O-N 3.44Å; N2347-L2349 PolarHBondContact O-N 3.28Å; N2347-L2349 VanDerWaalsContact O-N 3.15Å
2348	M	24.1	Very low	25.1	Very low	146.667 Å²	146.667	144.6 Å²	144.6	72%	0.722	77%	0.767	S	S	*	*			trans	-32.2	117.1	156.8	-81.6	-92.2	-167.8	0	0	113.4	Y2350	M2348-Y2350 HydrophobicContact CE-CD2 4.31Å; M2348-Y2350 HydrophobicContact CE-CE2 4.34Å; M2348-Y2350 HydrophobicContact SD-CD2 3.98Å; M2348-Y2350 HydrophobicContact SD-CE2 4.3Å
2349	L	25.4	Very low	25.1	Very low	161 Å²	161	142.6 Å²	142.6	84%	0.843	76%	0.762	S	S	*	*			trans	-143.5	102.4	133.7	-102.8	164.4	0	0	0	110.2	N2347 V2351	N2347-L2349 PolarHBondContact O-N 3.28Å; N2347-L2349 VanDerWaalsContact O-N 3.15Å; L2349-V2351 PolarHBondContact O-N 3.32Å; L2349-V2351 VanDerWaalsContact O-N 3.07Å
2350	Y	23.2	Very low	24.9	Very low	178 Å²	178	146.2 Å²	146.2	70%	0.698	77%	0.768	S	S	*	*			trans	-50.3	119.3	157.8	-97.6	-107.1	0	0	0	110.5	M2348 N2352	M2348-Y2350 HydrophobicContact CE-CD2 4.31Å; M2348-Y2350 HydrophobicContact CE-CE2 4.34Å; M2348-Y2350 HydrophobicContact SD-CD2 3.98Å; M2348-Y2350 HydrophobicContact SD-CE2 4.3Å; Y2350-N2352 HydrophobicContact CD1-CB 4.32Å
2351	V	25.8	Very low	24.8	Very low	129 Å²	129	147.2 Å²	147.2	78%	0.782	77%	0.768	S	S	*	*			trans	-110.1	88.3	152.7	-178.6	0	0	0	0	107.4	L2349 S2353	L2349-V2351 PolarHBondContact O-N 3.32Å; L2349-V2351 VanDerWaalsContact O-N 3.07Å; V2351-S2353 VanDerWaalsContact C-N 3.3Å; V2351-S2353 WeakPolarHBondContact CG1-OG 3.44Å; V2351-S2353 PolarHBondContact O-N 3.05Å
2352	N	23.1	Very low	24.8	Very low	129 Å²	129	144.4 Å²	144.4	69%	0.69	76%	0.762	S	S	*	*			trans	-82.3	94.5	166.3	-143.4	-12.9	0	0	0	108	Y2350 K2354	Y2350-N2352 HydrophobicContact CD1-CB 4.32Å; N2352-K2354 PolarHBondContact O-N 3.23Å
2353	S	25.1	Very low	24.9	Very low	93.6667 Å²	93.6667	143.2 Å²	143.2	66%	0.655	76%	0.757	S	S	*	*			trans	-115.5	87.9	167.2	51.1	0	0	0	0	111.1	V2351 F2355	V2351-S2353 VanDerWaalsContact C-N 3.3Å; V2351-S2353 WeakPolarHBondContact CG1-OG 3.44Å; V2351-S2353 PolarHBondContact O-N 3.05Å; S2353-F2355 PolarHBondContact O-N 3.38Å
2354	K	23.2	Very low	24.8	Very low	164.333 Å²	164.333	146.7 Å²	146.7	71%	0.714	76%	0.764	S	S	*	*			trans	-41.8	113.6	158.6	-73.9	177.1	171.1	-176.8	0	111.1	N2352 Q2356	N2352-K2354 PolarHBondContact O-N 3.23Å; K2354-Q2356 VanDerWaalsContact C-N 3.3Å; K2354-Q2356 PolarHBondContact O-N 2.99Å
2355	F	24.4	Very low	24.7	Very low	215.667 Å²	215.667	145.9 Å²	145.9	95%	0.946	76%	0.76	S	S	*	*			trans	-95.2	82.4	146.6	-92.9	-80.2	0	0	0	108.4	S2353	S2353-F2355 PolarHBondContact O-N 3.38Å
2356	Q	22.8	Very low	24.9	Very low	151.667 Å²	151.667	146.2 Å²	146.2	71%	0.709	76%	0.756	S	S	*	*			trans	-96.4	112.6	167.6	-158.5	171.2	6.3	0	0	107.1	K2354 T2358	K2354-Q2356 VanDerWaalsContact C-N 3.3Å; K2354-Q2356 PolarHBondContact O-N 2.99Å; Q2356-T2358 PolarHBondContact O-N 3.22Å
2357	C	23.8	Very low	25	Very low	115.333 Å²	115.333	144.6 Å²	144.6	78%	0.779	75%	0.753	S	S	*	*			trans	-43	123.8	167.2	-158.7	0	0	0	0	113.1
2358	T	24.2	Very low	25	Very low	100.667 Å²	100.667	142.3 Å²	142.3	62%	0.618	75%	0.749	S	S	*	*			trans	-142.4	128.6	156.8	-7.4	0	0	0	0	112.1	Q2356 L2360	Q2356-T2358 PolarHBondContact O-N 3.22Å; T2358-L2360 HydrophobicContact CG2-CD2 4.47Å; T2358-L2360 HydrophobicContact CG2-CG 4.13Å; T2358-L2360 PolarHBondContact O-N 3.13Å
2359	V	23	Very low	25.1	Very low	113.333 Å²	113.333	142.2 Å²	142.2	69%	0.687	75%	0.751	S	S	*	*			trans	-36.2	117.6	156.8	-179	0	0	0	0	109.3	Q2361	V2359-Q2361 VanDerWaalsContact C-N 3.27Å; V2359-Q2361 HydrophobicContact CG1-CB 4.35Å; V2359-Q2361 PolarHBondContact O-N 2.84Å
2360	L	23.9	Very low	25.4	Very low	160 Å²	160	141.2 Å²	141.2	84%	0.838	75%	0.746	S	S	*	*			trans	-108.5	119.3	144.1	-76.5	169.9	0	0	0	111.2	T2358	T2358-L2360 HydrophobicContact CG2-CD2 4.47Å; T2358-L2360 HydrophobicContact CG2-CG 4.13Å; T2358-L2360 PolarHBondContact O-N 3.13Å
2361	Q	23.4	Very low	25.6	Very low	172 Å²	172	138.7 Å²	138.7	80%	0.804	75%	0.745	S	S	*	*			trans	-129.5	105.5	175.8	-164.4	166.2	13.9	0	0	107.7	V2359 Q2363	V2359-Q2361 VanDerWaalsContact C-N 3.27Å; V2359-Q2361 HydrophobicContact CG1-CB 4.35Å; V2359-Q2361 PolarHBondContact O-N 2.84Å; Q2361-Q2363 PolarHBondContact O-N 3.32Å
2362	S	25.7	Very low	25.8	Very low	109 Å²	109	138.3 Å²	138.3	76%	0.762	74%	0.743	S	S	*	*			trans	-62.2	112.3	173.9	60.1	0	0	0	0	110.4
2363	Q	25.7	Very low	26	Very low	161.333 Å²	161.333	141 Å²	141	75%	0.754	75%	0.745	S	S	*	*				-141.7	126.1	96.2	-78.5	-165.4	-10.3	0	0	112.3	Q2361	Q2361-Q2363 PolarHBondContact O-N 3.32Å
2364	L	26.4	Very low	26.3	Very low	152.333 Å²	152.333	145.4 Å²	145.4	80%	0.798	75%	0.753	S	S	*	*			trans	-73.7	120.4	148.1	-79.5	163.7	0	0	0	114
2365	N	25.4	Very low	26.4	Very low	132.333 Å²	132.333	142.7 Å²	142.7	71%	0.708	75%	0.75	S	S	*	*			trans	64.3	126.3	146.7	-65.3	-13.5	0	0	0	117.4
2366	H	30	Very low	26.6	Very low	164.333 Å²	164.333	140.5 Å²	140.5	76%	0.761	74%	0.742	S	S	*	*			trans	164.1	126.5	132.9	-92.5	-65	0	0	0	113.5
2367	D	27.3	Very low	26.9	Very low	132.333 Å²	132.333	141.3 Å²	141.3	71%	0.708	74%	0.744	S	S	*	*				98.6	143.8	109.6	-78.1	-11.8	0	0	0	120.4
2368	S	29	Very low	27.2	Very low	107 Å²	107	142.8 Å²	142.8	75%	0.748	74%	0.742	S	S	*	*			trans	79.2	119.5	155.3	70.1	0	0	0	0	117.6
2369	D	27.1	Very low	27.3	Very low	144.333 Å²	144.333	144 Å²	144	77%	0.772	75%	0.745	S	S	*	*			cis	-138.4	159	7.9	-89.1	-46.4	0	0	0	106.8
2370	D	31.8	Very low	27.6	Very low	138.667 Å²	138.667	144.8 Å²	144.8	74%	0.742	75%	0.745	S	S	*	*			trans	106.5	116.1	144.3	-88.7	-28.2	0	0	0	116.9
2371	N	26.2	Very low	27.9	Very low	126.667 Å²	126.667	144.1 Å²	144.1	68%	0.677	74%	0.742	S	S	*	*				78.2	117.3	114.2	-78.9	-55.3	0	0	0	111
2372	T	30.8	Very low	28.1	Very low	121.333 Å²	121.333	145.2 Å²	145.2	74%	0.744	75%	0.745	S	S	*	*				173	131.9	106.1	23.2	0	0	0	0	108.4
2373	Y	27.3	Very low	28.2	Very low	185.667 Å²	185.667	145.2 Å²	145.2	73%	0.728	74%	0.74	S	S	*	*				72.9	129.6	77.7	-91.7	-84.2	0	0	0	114	T2375	Y2373-T2375 HydrophobicContact CD1-CG2 4.24Å; Y2373-T2375 HydrophobicContact CE1-CG2 4.41Å
2374	F	30.3	Very low	28.2	Very low	186 Å²	186	144.4 Å²	144.4	82%	0.816	74%	0.74	S	S	*	*				172.4	110.8	127.8	-95.1	-72.2	0	0	0	114.1
2375	T	25.2	Very low	28.3	Very low	106.667 Å²	106.667	143.7 Å²	143.7	65%	0.654	74%	0.737	S	S	*	*			trans	-51.8	132.9	142.7	52.1	0	0	0	0	113.2	Y2373	Y2373-T2375 HydrophobicContact CD1-CG2 4.24Å; Y2373-T2375 HydrophobicContact CE1-CG2 4.41Å
2376	H	30.5	Very low	28.4	Very low	168.667 Å²	168.667	145.5 Å²	145.5	78%	0.781	74%	0.738	S	S	*	*			trans	-175	118.4	142.8	-96.7	-49.6	0	0	0	109.2
2377	K	27.5	Very low	28.2	Very low	169.667 Å²	169.667	147.3 Å²	147.3	74%	0.738	75%	0.745	S	S	*	*				-81.4	140.1	85.5	-117.8	175.6	-179.7	179.4	0	111.5
2378	I	29.9	Very low	28.1	Very low	146.667 Å²	146.667	147.4 Å²	147.4	75%	0.752	74%	0.744	S	S	*	*			trans	120.7	103.1	146.7	-66.6	169.8	0	0	0	112.2
2379	N	27	Very low	28.1	Very low	125 Å²	125	148.8 Å²	148.8	67%	0.668	74%	0.743	S	S	*	*				39	149.3	118.5	-84.5	20.5	0	0	0	113
2380	D	30.1	Very low	28	Very low	130 Å²	130	149.7 Å²	149.7	70%	0.695	74%	0.742	S	S	*	*				-177.6	133.8	108.3	-76	-30.8	0	0	0	111.4
2381	D	28.6	Very low	27.8	Very low	146 Å²	146	149.2 Å²	149.2	78%	0.781	75%	0.748	S	S	*	*				-64.5	139	128	-82	-39.8	0	0	0	114.9
2382	F	28.4	Very low	27.7	Very low	194.333 Å²	194.333	149.4 Å²	149.4	85%	0.852	75%	0.749	S	S	*	*			trans	-132.2	123.2	148.7	-92.6	-90	0	0	0	110.7
2383	T	27.7	Very low	27.7	Very low	109.667 Å²	109.667	152.8 Å²	152.8	67%	0.673	76%	0.756	S	S	*	*				-82.7	141	128.4	-22.1	0	0	0	0	113.5
2384	I	26.3	Very low	27.6	Very low	145.667 Å²	145.667	150.9 Å²	150.9	75%	0.747	75%	0.754	S	S	*	*			trans	177.9	115.2	141.1	-71.5	160.6	0	0	0	112.4
2385	N	27.8	Very low	27.4	Very low	135.667 Å²	135.667	151.5 Å²	151.5	73%	0.725	76%	0.756	S	S	*	*			trans	-165.5	123.5	132.6	-76	-51.3	0	0	0	113.1
2386	K	26.9	Very low	27.4	Very low	171.333 Å²	171.333	150.8 Å²	150.8	75%	0.745	75%	0.752	S	S	*	*				93	109.9	74.8	-165	-177.7	-179.9	-179.8	0	112.8
2387	F	26.1	Very low	27.2	Very low	203 Å²	203	149.9 Å²	149.9	89%	0.89	75%	0.751	S	S	*	*			trans	-154.4	118.6	130	-105.9	-75.4	0	0	0	110.3
2388	I	25.4	Very low	27.1	Very low	134.333 Å²	134.333	148.4 Å²	148.4	69%	0.689	75%	0.751	S	S	*	*			trans	-104.8	139	167.3	-71.8	170.3	0	0	0	106	Q2390	I2388-Q2390 HydrophobicContact CG2-CG 3.74Å
2389	N	28.4	Very low	26.9	Very low	136.333 Å²	136.333	148.2 Å²	148.2	73%	0.729	75%	0.752	S	S	*	*			trans	159.1	121.3	153.6	-79	-23.2	0	0	0	110.2
2390	Q	26.7	Very low	26.8	Very low	161.333 Å²	161.333	147.7 Å²	147.7	75%	0.754	76%	0.757	S	S	*	*				71.5	106.4	121.5	-69.8	178.5	-7.3	0	0	112.5	I2388	I2388-Q2390 HydrophobicContact CG2-CG 3.74Å
2391	C	26.1	Very low	26.5	Very low	129 Å²	129	146.3 Å²	146.3	87%	0.872	76%	0.757	S	S	*	*				-149.1	110.8	78.6	-65.7	0	0	0	0	112.3	H2393	C2391-H2393 PolarHBondContact O-N 3.44Å
2392	N	24.5	Very low	26.4	Very low	130.333 Å²	130.333	148.3 Å²	148.3	70%	0.697	76%	0.76	S	S	*	*			trans	-54.1	117.8	157.6	-71.6	-18.4	0	0	0	112.6
2393	H	30.2	Very low	26.4	Very low	193 Å²	193	144.6 Å²	144.6	89%	0.894	75%	0.753	S	S	*	*			trans	-135.5	102.5	135	-92.4	-53.1	0	0	0	108.1	C2391 F2395	C2391-H2393 PolarHBondContact O-N 3.44Å; H2393-F2395 PolarHBondContact O-N 2.75Å
2394	H	25.2	Very low	26.2	Very low	146.667 Å²	146.667	146.4 Å²	146.4	68%	0.679	76%	0.758	S	S	*	*			trans	-49.8	120.3	134.1	-131	67	0	0	0	109.7	T2396	H2394-T2396 VanDerWaalsContact CD2-CG2 3.41Å; H2394-T2396 WeakPolarHBondContact CD2-CG2 3.31Å
2395	F	27.4	Very low	26.4	Very low	197.667 Å²	197.667	144.7 Å²	144.7	87%	0.867	76%	0.759	S	S	*	*			trans	-150.5	106.1	145.6	-92.4	-73.3	0	0	0	106.5	H2393	H2393-F2395 PolarHBondContact O-N 2.75Å
2396	T	25.5	Very low	26.3	Very low	92.6667 Å²	92.6667	143.4 Å²	143.4	57%	0.569	76%	0.757	S	S	*	*				-73.9	139.7	98	46.6	0	0	0	0	111.8	H2394 D2398	H2394-T2396 VanDerWaalsContact CD2-CG2 3.41Å; H2394-T2396 WeakPolarHBondContact CD2-CG2 3.31Å; T2396-D2398 WeakPolarHBondContact CB-OD1 3.5Å; T2396-D2398 PolarHBondContact O-N 3.23Å; T2396-D2398 VanDerWaalsContact O-N 3.13Å; T2396-D2398 PolarHBondContact OG1-OD1 2.84Å
2397	I	24.9	Very low	26.3	Very low	149.333 Å²	149.333	141.3 Å²	141.3	77%	0.766	75%	0.754	S	S	*	*			trans	-69.7	120.4	155.4	-65	165	0	0	0	107	D2399	I2397-D2399 PolarHBondContact O-N 3.43Å
2398	D	26.5	Very low	26.5	Very low	137.667 Å²	137.667	138.3 Å²	138.3	74%	0.736	74%	0.742	S	S	*	*			trans	-103.4	93.4	164.8	-84	-4	0	0	0	109	T2396 C2400	T2396-D2398 WeakPolarHBondContact CB-OD1 3.5Å; T2396-D2398 PolarHBondContact O-N 3.23Å; T2396-D2398 VanDerWaalsContact O-N 3.13Å; T2396-D2398 PolarHBondContact OG1-OD1 2.84Å; D2398-C2400 VanDerWaalsContact C-N 3.32Å; D2398-C2400 PolarHBondContact O-N 2.96Å
2399	D	24.4	Very low	26.7	Very low	143.667 Å²	143.667	139.5 Å²	139.5	77%	0.768	75%	0.75	S	S	*	*			trans	-63.8	98.1	160.2	-87.1	-40.1	0	0	0	109	I2397 S2401	I2397-D2399 PolarHBondContact O-N 3.43Å; D2399-S2401 PolarHBondContact O-N 2.92Å
2400	C	26.1	Very low	26.6	Very low	114.667 Å²	114.667	139.4 Å²	139.4	78%	0.775	75%	0.748	S	S	*	*			trans	-119.2	93.7	166.3	-88.7	0	0	0	0	110.7	D2398	D2398-C2400 VanDerWaalsContact C-N 3.32Å; D2398-C2400 PolarHBondContact O-N 2.96Å
2401	S	24.4	Very low	26.6	Very low	100 Å²	100	138.8 Å²	138.8	70%	0.699	75%	0.75	S	S	*	*			trans	-17.2	73.1	161.7	52.6	0	0	0	0	113.4	D2399 T2403	D2399-S2401 PolarHBondContact O-N 2.92Å; S2401-T2403 PolarHBondContact O-N 3.39Å
2402	F	25.7	Very low	26.6	Very low	188.5 Å²	188.5	138 Å²	138	83%	0.827	75%	0.745	S	S	*	*			trans	-102.1	107	151.1	-103.1	-83.5	0	0	0	110.5
2403	T	28	Very low	26.7	Very low	115.5 Å²	115.5	139 Å²	139	71%	0.709	75%	0.749	S	S	*	*			trans	156.8	119.6	147	52.8	0	0	0	0	115.1	S2401	S2401-T2403 PolarHBondContact O-N 3.39Å
2404	N	24.5	Very low	26.5	Very low	147.5 Å²	147.5	137.2 Å²	137.2	79%	0.789	75%	0.745	S	S	*	*			trans	-24.7	118.7	158.6	-72.4	-31	0	0	0	115.6	T2406	N2404-T2406 HydrophobicContact CB-CG2 4.04Å
2405	S	29.5	Very low	26.6	Very low	110 Å²	110	134.7 Å²	134.7	77%	0.769	74%	0.744	S	S	*	*			trans	-152.6	72.9	145.9	61.1	0	0	0	0	108.8
2406	T	26.8	Very low	26.6	Very low	109 Å²	109	132.1 Å²	132.1	67%	0.669	74%	0.739	S	S	*	*				42	97.4	91.7	64.7	0	0	0	0	114.6	N2404	N2404-T2406 HydrophobicContact CB-CG2 4.04Å
2407	N	27	Very low	26.8	Very low	127 Å²	127	132.9 Å²	132.9	68%	0.679	75%	0.748	S	S	*	*				126.6	128.8	116.5	-83.9	22.7	0	0	0	115.8
2408	E	28.4	Very low	26.8	Very low	140.5 Å²	140.5	132.9 Å²	132.9	66%	0.657	75%	0.749	S	S	*	*				98.6	121.9	119.1	-79.4	164.3	-138.4	0	0	116.3	I2410	E2408-I2410 HydrophobicContact CB-CD1 4.04Å; E2408-I2410 HydrophobicContact CB-CG1 4.22Å; E2408-I2410 HydrophobicContact CG-CD1 3.47Å; E2408-I2410 VanDerWaalsContact CG-CD1 3.47Å; E2408-I2410 HydrophobicContact CG-CG1 3.84Å
2409	N	30.6	Very low	26.8	Very low	159 Å²	159	134.3 Å²	134.3	85%	0.85	75%	0.748	S	S	*	*				-160.4	107	81.1	-87.7	-35.4	0	0	0	109.7
2410	I	25.8	Very low	26.9	Very low	134.5 Å²	134.5	134.4 Å²	134.4	69%	0.69	74%	0.744	S	S	*	*				-12.9	121.8	116.2	-67.6	176.6	0	0	0	110.3	E2408	E2408-I2410 HydrophobicContact CB-CD1 4.04Å; E2408-I2410 HydrophobicContact CB-CG1 4.22Å; E2408-I2410 HydrophobicContact CG-CD1 3.47Å; E2408-I2410 VanDerWaalsContact CG-CD1 3.47Å; E2408-I2410 HydrophobicContact CG-CG1 3.84Å
2411	D	26.3	Very low	27	Very low	149 Å²	149	134.5 Å²	134.5	80%	0.797	75%	0.746	S	S	*	*			trans	147.8	146.1	139.6	-92.3	-19.8	0	0	0	119.2
2412	C	27.8	Very low	27	Very low	111.5 Å²	111.5	135.7 Å²	135.7	75%	0.753	75%	0.75	S	S	*	*			trans	63.2	107.2	170.3	-70.7	0	0	0	0	117.2
2413	L	26.7	Very low	27.1	Very low	152 Å²	152	134.4 Å²	134.4	80%	0.796	75%	0.746	S	S	*	*			cis	125.9	115.4	23.2	-83.9	166.8	0	0	0	112.3
2414	I	25.3	Very low	27.1	Very low	155 Å²	155	136.1 Å²	136.1	80%	0.795	75%	0.751	S	S	*	*			trans	-13.3	110.2	148.4	-58.1	170.8	0	0	0	112.1
2415	S	27.4	Very low	27.3	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	75%	0.75	S	S	*	*			trans	171.3	152.4	137.7	36.6	0	0	0	0	110.7
2416	N	27.7	Very low	27.1	Very low	143 Å²	143	138.1 Å²	138.1	77%	0.765	75%	0.754	S	S	*	*				136.6	127.1	-108	-77.6	-29.9	0	0	0	109.4
2417	S	29.5	Very low	27.1	Very low	108.5 Å²	108.5	139.2 Å²	139.2	76%	0.759	76%	0.755	S	S	*	*				122.3	109.1	78.9	-61.9	0	0	0	0	115.7
2418	L	24.7	Very low	27.1	Very low	149.5 Å²	149.5	139.2 Å²	139.2	78%	0.783	76%	0.755	S	S	*	*			trans	-23.1	111.2	130.4	-169.4	98.2	0	0	0	112.3
2419	K	26.9	Very low	27.1	Very low	167 Å²	167	138.7 Å²	138.7	73%	0.726	76%	0.762	S	S	*	*			trans	173.5	145.7	131	-98.5	176.4	-177.5	-171.1	0	114.7
2420	Q	25.1	Very low	26.9	Very low	145.5 Å²	145.5	138.6 Å²	138.6	68%	0.68	76%	0.758	S	S	*	*			trans	17.1	121.2	155.1	-61.6	158.2	-29.7	0	0	117.7	E2346	E2346-Q2420 PolarHBondContact OE1-NE2 2.89Å
2421	S	28.2	Very low	27.2	Very low	116.5 Å²	116.5	140.9 Å²	140.9	82%	0.815	77%	0.766	S	S	*	*				-173.9	126.8	119.9	34.1	0	0	0	0	109.8
2422	T	25.6	Very low	27.5	Very low	125.5 Å²	125.5	142.5 Å²	142.5	77%	0.77	77%	0.765	S	S	*	*			trans	-45	135.4	143.5	41.6	0	0	0	0	114
2423	E	28	Very low	27.6	Very low	161.5 Å²	161.5	143.4 Å²	143.4	76%	0.755	76%	0.763	S	S	*	*			trans	117	116.6	137.7	-82.5	-177.4	138.8	0	0	115.2
2424	N	26.6	Very low	27.9	Very low	150.5 Å²	150.5	143.4 Å²	143.4	81%	0.805	76%	0.763	S	S	*	*				66.8	111.1	110.9	-67.9	-26.2	0	0	0	116.2
2425	G	29.2	Very low	28.2	Very low	74.5 Å²	74.5	142.1 Å²	142.1	77%	0.768	76%	0.758	S	S	*	*			trans	162.3	56.2	174.9	0	0	0	0	0	115.4
2426	R	25.8	Very low	28.4	Very low	226.5 Å²	226.5	143.4 Å²	143.4	86%	0.855	76%	0.758	S	S	*	*				37.1	136.4	109	-141.8	-172	-176.7	152.3	1.3	115.6
2427	L	26.5	Very low	28.7	Very low	132 Å²	132	142.5 Å²	142.5	69%	0.691	75%	0.753	S	S	*	*			trans	95.3	124.9	156.7	-53.7	164.6	0	0	0	116.2
2428	N	27.2	Very low	28.7	Very low	126.5 Å²	126.5	143.3 Å²	143.3	68%	0.676	75%	0.749	S	S	*	*				120.9	126	67.1	-85.6	5.5	0	0	0	113.6
2429	T	27.6	Very low	29.1	Very low	130.5 Å²	130.5	142.3 Å²	142.3	80%	0.801	74%	0.743	S	S	*	*			trans	-13.8	129.4	134.9	50.1	0	0	0	0	114.5
2430	M	27.5	Very low	29.3	Very low	157 Å²	157	140.4 Å²	140.4	77%	0.773	74%	0.741	S	S	*	*			trans	-170	95.2	147.9	-134	178.9	136.4	0	0	107.7
2431	E	31	Very low	29.8	Very low	182 Å²	182	138.8 Å²	138.8	85%	0.85	74%	0.74	S	S	*	*	P	Polyproline II helix		-24.2	129.5	127.4	-104.8	177.3	178.2	0	0	111.2
2432	K	33.4	Very low	29.9	Very low	181.5 Å²	181.5	141.2 Å²	141.2	79%	0.789	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-133.4	124.9	169.4	-90.6	172.6	-179.2	175.1	0	112.1
2433	D	29.5	Very low	30.3	Very low	131 Å²	131	139.9 Å²	139.9	70%	0.701	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-26.5	137	144.8	-43.4	-64.6	0	0	0	113.7
2434	N	32.8	Very low	30.6	Very low	152 Å²	152	136.2 Å²	136.2	81%	0.813	73%	0.732	S	S	*	*				-168.7	114.1	126.7	-93.5	-38.3	0	0	0	107.8
2435	D	31.9	Very low	30.8	Very low	128.5 Å²	128.5	136.5 Å²	136.5	69%	0.687	73%	0.733	S	S	*	*			trans	-1.6	147.4	132.2	-60.7	-43.7	0	0	0	112.7
2436	N	31.9	Very low	31.1	Very low	122.5 Å²	122.5	138.4 Å²	138.4	66%	0.655	73%	0.729	S	S	*	*				132.7	110.9	125.3	-78.4	-54.3	0	0	0	115.8
2437	N	32.7	Very low	31.5	Very low	124 Å²	124	133.5 Å²	133.5	66%	0.663	72%	0.72	S	S	*	*				88	134.3	117.6	-68.7	-20.7	0	0	0	120.1
2438	N	31.3	Very low	31.9	Very low	125 Å²	125	134.3 Å²	134.3	67%	0.668	73%	0.725	S	S	*	*			trans	89.3	114.9	137.2	-74.9	4	0	0	0	116.6
2439	I	32.6	Very low	32.3	Very low	127.5 Å²	127.5	131.5 Å²	131.5	65%	0.654	73%	0.726	S	S	*	*				88.1	126.3	80.8	-81.2	174.2	0	0	0	108
2440	D	31.9	Very low	32.8	Very low	127.5 Å²	127.5	132.3 Å²	132.3	68%	0.682	73%	0.725	S	S	*	*			cis	-175.3	178	16.9	-113.9	-6.1	0	0	0	109
2441	V	34.3	Very low	33.3	Very low	111.5 Å²	111.5	130.7 Å²	130.7	68%	0.676	72%	0.72	S	S	*	*			trans	78.3	120	144	177.8	0	0	0	0	116.5
2442	E	31.5	Very low	33.5	Very low	167 Å²	167	128.1 Å²	128.1	78%	0.78	71%	0.712	S	S	*	*			cis	128.5	145.3	39.6	-96.2	179.7	159.9	0	0	109.6
2443	S	33.4	Very low	33.8	Very low	99.5 Å²	99.5	126.4 Å²	126.4	70%	0.696	71%	0.712	S	S	*	*				122.5	148.4	55.6	74.6	0	0	0	0	114
2444	A	34.2	Very low	34.2	Very low	82.5 Å²	82.5	127.8 Å²	127.8	68%	0.682	72%	0.719	S	S	*	*				120.8	126.3	114.3	0	0	0	0	0	114.2
2445	L	30.9	Very low	34.5	Very low	158 Å²	158	124.3 Å²	124.3	83%	0.827	71%	0.711	S	S	*	*				64.2	118.7	72.7	-65	173	0	0	0	113
2446	T	34.6	Very low	34.8	Very low	114 Å²	114	125.9 Å²	125.9	70%	0.699	71%	0.714	S	S	*	*				172.4	144.2	69.3	31.8	0	0	0	0	111.4
2447	N	34.7	Very low	34.9	Very low	123.5 Å²	123.5	126.4 Å²	126.4	66%	0.66	72%	0.717	S	S	*	*			trans	72	122.7	136.2	-71.5	40.1	0	0	0	124.3
2448	D	35.5	Very low	35	Very low	148.5 Å²	148.5	128.2 Å²	128.2	79%	0.794	72%	0.719	S	S	*	*				73.5	130.6	124	-49.8	-19.7	0	0	0	122.1
2449	G	36.1	Very low	35.1	Very low	67 Å²	67	128.6 Å²	128.6	69%	0.691	72%	0.716	S	S	*	*			trans	121.9	82.7	142.1	0	0	0	0	0	116.9
2450	D	37.4	Very low	35.2	Very low	148 Å²	148	128.2 Å²	128.2	79%	0.791	72%	0.716	S	S	*	*				56.2	123.3	110.4	-68.7	-7.6	0	0	0	118.3
2451	N	37.1	Very low	35.4	Very low	123 Å²	123	129 Å²	129	66%	0.658	72%	0.719	S	S	*	*			trans	85.8	113.6	130.3	-71.3	18.7	0	0	0	122.5
2452	D	37	Very low	35.4	Very low	128.5 Å²	128.5	128.7 Å²	128.7	69%	0.687	72%	0.717	S	S	*	*				98.2	136.3	118.5	-63.3	-12.5	0	0	0	121.7
2453	D	38.8	Very low	35.7	Very low	146 Å²	146	127.1 Å²	127.1	78%	0.781	71%	0.713	S	S	*	*			trans	78.6	88.8	151.2	-59.9	-17.2	0	0	0	120.8
2454	D	38.6	Very low	35.8	Very low	160 Å²	160	127.9 Å²	127.9	86%	0.856	71%	0.714	S	S	*	*			trans	-1.4	117.2	140.7	-87.8	-28.8	0	0	0	117.2
2455	A	37.5	Very low	35.9	Very low	77.5 Å²	77.5	129.7 Å²	129.7	64%	0.64	71%	0.712	S	S	*	*			trans	146.4	144.6	139.9	0	0	0	0	0	117.2
2456	H	39.4	Very low	36.1	Very low	163.5 Å²	163.5	129.5 Å²	129.5	76%	0.757	71%	0.705	S	S	*	*			trans	74.8	110	154.7	-70.2	-55	0	0	0	120.6
2457	N	34	Very low	36.3	Very low	133 Å²	133	130 Å²	130	71%	0.711	70%	0.703	S	S	*	*				61.9	126.1	119.3	-74.6	-22.7	0	0	0	121
2458	K	33.4	Very low	36.4	Very low	162 Å²	162	131 Å²	131	70%	0.704	71%	0.709	S	S	*	*			trans	87	125.9	130.4	-85.7	-178	162	-126.9	0	119.4
2459	E	34.4	Very low	36.4	Very low	132 Å²	132	131.5 Å²	131.5	62%	0.617	71%	0.706	S	S	*	*			trans	81.4	123.5	130.3	-80.2	176.9	-141.2	0	0	119.4
2460	N	34	Very low	36.2	Very low	120 Å²	120	136.2 Å²	136.2	64%	0.642	71%	0.71	S	S	*	*				96.7	123	126.5	-78.3	-22.4	0	0	0	120.4
2461	I	36	Very low	36	Very low	144.5 Å²	144.5	134.2 Å²	134.2	74%	0.741	71%	0.708	S	S	*	*				92.2	125.5	125.1	-75.3	168.9	0	0	0	117
2462	V	35.6	Very low	35.8	Very low	105.5 Å²	105.5	136.4 Å²	136.4	64%	0.639	71%	0.714	S	S	*	*				128.9	136.7	71.6	137.5	0	0	0	0	112.8
2463	N	36.3	Very low	35.6	Very low	132 Å²	132	137.5 Å²	137.5	71%	0.706	72%	0.718	S	S	*	*			trans	91.5	127.7	142.1	-58.2	-22.1	0	0	0	116.3
2464	T	37	Very low	35.2	Very low	117 Å²	117	135.1 Å²	135.1	72%	0.718	71%	0.713	S	S	*	*				143	161.7	54.3	19.1	0	0	0	0	108.7
2465	D	36.3	Very low	34.8	Very low	119.5 Å²	119.5	133.6 Å²	133.6	64%	0.639	71%	0.71	S	S	*	*			cis	-170.8	148.6	1.5	-130.7	-17.5	0	0	0	106
2466	K	35.5	Very low	34.4	Very low	155.5 Å²	155.5	135.9 Å²	135.9	68%	0.676	72%	0.715	S	S	*	*			trans	67.8	138.8	146.8	-65.9	-179.3	177.3	115.9	0	121.8
2467	D	37.2	Very low	34	Very low	124 Å²	124	132.8 Å²	132.8	66%	0.663	71%	0.712	S	S	*	*				140.5	146.7	56.7	-75.5	-21.2	0	0	0	114.7
2468	D	36.6	Very low	33.9	Very low	144 Å²	144	132.3 Å²	132.3	77%	0.77	72%	0.716	S	S	*	*			trans	75.2	133.3	154.2	-59.1	-23.3	0	0	0	121.1
2469	E	35.4	Very low	33.7	Very low	159 Å²	159	132 Å²	132	74%	0.743	72%	0.722	S	S	*	*				140.7	132.7	69.5	-93.1	-172	163.7	0	0	116.3
2470	Q	32.8	Very low	33.6	Very low	165.5 Å²	165.5	133.6 Å²	133.6	77%	0.773	73%	0.734	S	S	*	*			trans	39.3	133.4	146	-57	178.8	21.3	0	0	119.8
2471	S	33.8	Very low	33.5	Very low	107 Å²	107	134.8 Å²	134.8	75%	0.748	74%	0.735	S	S	*	*				-177.9	139.4	61.5	-85	0	0	0	0	109.2
2472	E	33.1	Very low	33.3	Very low	168.5 Å²	168.5	134.4 Å²	134.4	79%	0.787	73%	0.734	S	S	*	*				-120.4	160.6	75.1	-92.3	174.4	-148.5	0	0	110.9
2473	I	32.5	Very low	33.1	Very low	150.5 Å²	150.5	137.1 Å²	137.1	77%	0.772	74%	0.74	S	S	*	*			trans	107.8	109.8	148.3	-76	161.5	0	0	0	112.6
2474	S	29	Very low	32.8	Very low	97 Å²	97	135.6 Å²	135.6	68%	0.678	74%	0.74	S	S	*	*				82.6	133	74.2	-159	0	0	0	0	114.8
2475	V	31.9	Very low	32.6	Very low	128 Å²	128	135.7 Å²	135.7	78%	0.776	75%	0.745	S	S	*	*				-145.9	117.1	104.7	177.1	0	0	0	0	109.3	S2477	V2475-S2477 VanDerWaalsContact CG1-OG 3.27Å; V2475-S2477 WeakPolarHBondContact CG1-OG 3.33Å
2476	V	28.9	Very low	32.3	Very low	125.5 Å²	125.5	137.4 Å²	137.4	76%	0.761	75%	0.754	S	S	*	*				-18	133.2	111.9	173.4	0	0	0	0	110.1
2477	S	29.5	Very low	32.1	Very low	99 Å²	99	137.8 Å²	137.8	69%	0.692	76%	0.762	S	S	*	*				-165.7	172.6	90.5	-88.2	0	0	0	0	109.7	V2475	V2475-S2477 VanDerWaalsContact CG1-OG 3.27Å; V2475-S2477 WeakPolarHBondContact CG1-OG 3.33Å
2478	P	33.2	Very low	31.7	Very low	121.5 Å²	121.5	136 Å²	136	79%	0.789	76%	0.759	S	S	*	*				-127.3	170.4	-62.5	34.6	-19.3	0	0	0	117.2
2479	L	28.5	Very low	31.5	Very low	157.5 Å²	157.5	136.2 Å²	136.2	83%	0.825	76%	0.76	S	S	*	*			trans	-76.3	151.2	161.7	-81.4	113.5	0	0	0	111.2
2480	L	31.7	Very low	31.4	Very low	165.5 Å²	165.5	132.5 Å²	132.5	87%	0.866	76%	0.757	S	S	*	*			trans	-129.3	122.9	148.4	-80.4	171.1	0	0	0	107.9
2481	H	32.5	Very low	31.5	Very low	145 Å²	145	132.9 Å²	132.9	67%	0.671	76%	0.759	S	S	*	*				-4.8	141.1	119	-88.1	45.8	0	0	0	111
2482	D	32	Very low	31.5	Very low	135.5 Å²	135.5	132.5 Å²	132.5	73%	0.725	75%	0.748	S	S	*	*				-151.1	134.8	82.6	-105.7	-40.2	0	0	0	112.8
2483	Q	31.3	Very low	31.7	Very low	163 Å²	163	133.5 Å²	133.5	76%	0.762	75%	0.746	S	S	*	*			trans	-25.8	108.5	151.1	-73	-175.7	17.1	0	0	116.2
2484	S	29.4	Very low	31.8	Very low	100.5 Å²	100.5	132.2 Å²	132.2	70%	0.703	74%	0.74	S	S	*	*				135.2	133.1	124.4	66.9	0	0	0	0	113
2485	S	33.9	Very low	32.1	Very low	117.5 Å²	117.5	133.5 Å²	133.5	82%	0.822	74%	0.74	S	S	*	*			cis	-174.1	150.7	36.1	40.7	0	0	0	0	111.1
2486	N	29.2	Very low	32.3	Very low	155.5 Å²	155.5	133.9 Å²	133.9	83%	0.832	74%	0.738	S	S	*	*			trans	-70	158.6	173.2	-77.5	-33.6	0	0	0	113.3
2487	I	31.8	Very low	32.6	Very low	164 Å²	164	135.2 Å²	135.2	84%	0.841	74%	0.735	S	S	*	*			trans	135.3	147	147.8	-81.9	155.6	0	0	0	114.8
2488	S	28.5	Very low	32.7	Very low	87.5 Å²	87.5	137 Å²	137	61%	0.612	74%	0.737	S	S	*	*			trans	5.8	143.2	175.7	42.3	0	0	0	0	118.8
2489	D	32.7	Very low	32.7	Very low	147.5 Å²	147.5	138.1 Å²	138.1	79%	0.789	74%	0.735	S	S	*	*			trans	90.6	93.5	139.8	-53.7	-19.6	0	0	0	118.9
2490	A	33	Very low	32.8	Very low	82 Å²	82	137.5 Å²	137.5	68%	0.678	73%	0.731	S	S	*	*				87.5	144.5	86.2	0	0	0	0	0	117
2491	H	35.6	Very low	32.5	Very low	173.5 Å²	173.5	134.6 Å²	134.6	80%	0.803	73%	0.725	S	S	*	*			trans	69.9	143.4	165.9	-68.5	-64.3	0	0	0	117.5
2492	D	33.5	Very low	32.4	Very low	98 Å²	98	134.5 Å²	134.5	52%	0.524	73%	0.728	S	S	.	*			cis	-176.1	168	-14.5	-148.7	-24.6	0	0	0	107.4
2493	Y	37.9	Very low	32.1	Very low	189.5 Å²	189.5	130.8 Å²	130.8	74%	0.743	72%	0.722	S	S	*	*			trans	72.7	116.6	171.2	-54.8	-69.2	0	0	0	117.1
2494	N	33.9	Very low	32.1	Very low	123 Å²	123	128.1 Å²	128.1	66%	0.658	72%	0.716	S	S	*	*				80.7	140.8	63.2	-78.9	22.9	0	0	0	112.9
2495	D	34.3	Very low	32	Very low	124.5 Å²	124.5	129.6 Å²	129.6	67%	0.666	72%	0.717	S	S	*	*				142.8	157.3	82	-75.3	-22.4	0	0	0	112.2
2496	D	37.2	Very low	31.9	Very low	136.5 Å²	136.5	131.2 Å²	131.2	73%	0.73	71%	0.714	S	S	*	*				131.6	143.2	81.8	-80.3	-23.3	0	0	0	114.3
2497	E	35.6	Very low	31.9	Very low	153 Å²	153	131 Å²	131	72%	0.715	71%	0.708	S	S	*	*				124.7	141.3	58.2	-64.6	-123.6	144.8	0	0	114.9
2498	D	31.3	Very low	31.9	Very low	137.5 Å²	137.5	130.3 Å²	130.3	74%	0.735	70%	0.701	S	S	*	*				105.3	103.2	128.6	-82.7	-3.7	0	0	0	115.3
2499	I	32.4	Very low	31.9	Very low	143 Å²	143	132.6 Å²	132.6	73%	0.733	71%	0.705	S	S	*	*				154.6	114.7	119.4	-61	174.8	0	0	0	109	S2501	I2499-S2501 PolarHBondContact O-N 3.37Å
2500	I	30.3	Very low	31.7	Very low	145 Å²	145	131.5 Å²	131.5	74%	0.744	70%	0.704	S	S	*	*				-115.8	118.9	122	-64.6	168.3	0	0	0	108.6	I2502	I2500-I2502 HydrophobicContact CG2-CG1 4.09Å; I2500-I2502 PolarHBondContact O-N 3.49Å
2501	S	27	Very low	31.4	Very low	105 Å²	105	132.2 Å²	132.2	73%	0.734	70%	0.704	S	S	*	*				11.4	118.7	112.6	-88.1	0	0	0	0	113.3	I2499	I2499-S2501 PolarHBondContact O-N 3.37Å
2502	I	29.4	Very low	31.1	Very low	143 Å²	143	129.1 Å²	129.1	73%	0.733	70%	0.701	S	S	*	*			trans	-11	112.3	152.7	-56.3	168.9	0	0	0	111.5	I2500 T2504	I2500-I2502 HydrophobicContact CG2-CG1 4.09Å; I2500-I2502 PolarHBondContact O-N 3.49Å; I2502-T2504 HydrophobicContact CG2-CG2 4.49Å
2503	G	26.7	Very low	30.9	Very low	58.5 Å²	58.5	131.4 Å²	131.4	60%	0.603	71%	0.713	S	S	*	*				-136.4	139.9	89.2	0	0	0	0	0	108.9
2504	T	30.2	Very low	30.4	Very low	105 Å²	105	130.1 Å²	130.1	64%	0.644	71%	0.714	S	S	*	*				146.5	111.7	129.1	55.1	0	0	0	0	110.7	I2502	I2502-T2504 HydrophobicContact CG2-CG2 4.49Å
2505	D	27.5	Very low	30.2	Very low	133.5 Å²	133.5	130.9 Å²	130.9	71%	0.714	72%	0.716	S	S	*	*			trans	-134.4	123.7	142.7	-64.3	-62.1	0	0	0	112.8
2506	I	31.2	Very low	30	Very low	149.5 Å²	149.5	130.5 Å²	130.5	77%	0.767	72%	0.723	S	S	*	*				146	119.2	113.8	-52.4	177.3	0	0	0	110
2507	Q	30.8	Very low	29.6	Very low	151.5 Å²	151.5	134.6 Å²	134.6	71%	0.708	73%	0.729	S	S	*	*			trans	-158.7	139	155.7	-70.1	-173.4	-5.7	0	0	111.9
2508	H	29.8	Very low	29.4	Very low	150.5 Å²	150.5	136.3 Å²	136.3	70%	0.697	74%	0.736	S	S	*	*				-114.1	134.4	91.7	-89.5	-81.8	0	0	0	109
2509	I	29.9	Very low	29.4	Very low	136 Å²	136	133.6 Å²	133.6	70%	0.697	74%	0.741	S	S	*	*				147.2	113.8	119.8	-61.6	-172.3	0	0	0	109.6
2510	T	28.5	Very low	29.2	Very low	124.5 Å²	124.5	130.9 Å²	130.9	76%	0.764	75%	0.749	S	S	*	*				-135.7	113.9	106.2	22.4	0	0	0	0	108.1
2511	S	26.9	Very low	29.3	Very low	95 Å²	95	127.7 Å²	127.7	66%	0.664	75%	0.751	S	S	*	*				130.3	139.8	128.7	80.3	0	0	0	0	112.6
2512	C	29.7	Very low	29.5	Very low	109.5 Å²	109.5	127.1 Å²	127.1	74%	0.74	75%	0.747	S	S	*	*				179.8	116.7	76.8	-108.6	0	0	0	0	109.3
2513	N	28.1	Very low	29.7	Very low	145 Å²	145	130.4 Å²	130.4	78%	0.775	75%	0.752	S	S	*	*			trans	-11.1	125.9	140.2	-77	2.1	0	0	0	113
2514	E	28.6	Very low	30	Very low	164 Å²	164	134 Å²	134	77%	0.766	76%	0.758	S	S	*	*				-166.5	156.6	83.3	-120.6	166.3	-172.5	0	0	111.1
2515	I	27.8	Very low	30.3	Very low	139 Å²	139	134.3 Å²	134.3	71%	0.713	76%	0.759	S	S	*	*			trans	-11.4	114.8	167.1	-63.2	162.5	0	0	0	115.2	R2517	I2515-R2517 HydrophobicContact CG2-CG 4.31Å
2516	S	30.6	Very low	30.6	Very low	115 Å²	115	134.6 Å²	134.6	80%	0.804	76%	0.761	S	S	*	*			trans	158.9	121.6	140	-59.5	0	0	0	0	117
2517	R	29.7	Very low	30.7	Very low	224.5 Å²	224.5	131.9 Å²	131.9	85%	0.847	75%	0.754	S	S	*	*			trans	-173.7	107.3	152.7	-94.4	179	169.6	169.5	-1.6	114.7	I2515	I2515-R2517 HydrophobicContact CG2-CG 4.31Å
2518	E	30.2	Very low	30.9	Very low	187 Å²	187	131.1 Å²	131.1	87%	0.874	76%	0.755	S	S	*	*			trans	136	129	142.5	-74.6	178.3	163.9	0	0	113.3
2519	G	31.5	Very low	31.2	Very low	82 Å²	82	130.2 Å²	130.2	85%	0.845	76%	0.755	S	S	*	*				130.1	115.6	56.4	0	0	0	0	0	113
2520	G	29.9	Very low	31.6	Very low	86 Å²	86	129.8 Å²	129.8	89%	0.887	75%	0.754	S	S	*	*				138.6	139.4	59.3	0	0	0	0	0	114
2521	G	31.1	Very low	31.7	Very low	77.5 Å²	77.5	131.6 Å²	131.6	80%	0.799	75%	0.754	S	S	*	*			trans	147.7	108.6	152.5	0	0	0	0	0	116.7
2522	S	30.7	Very low	32.3	Very low	92.5 Å²	92.5	135 Å²	135	65%	0.647	76%	0.757	S	S	*	*			trans	18.9	119.4	151.8	174.3	0	0	0	0	117.1
2523	Y	34.1	Very low	32.4	Very low	211.5 Å²	211.5	138 Å²	138	83%	0.829	76%	0.758	S	S	*	*				131.2	147.8	113.2	-72.9	-64.9	0	0	0	116.9
2524	D	33.6	Very low	32.7	Very low	136 Å²	136	138.7 Å²	138.7	73%	0.727	76%	0.76	S	S	*	*			trans	-164.4	136	163.5	-58	-56.7	0	0	0	116.2
2525	T	35.5	Very low	33	Very low	110.5 Å²	110.5	138.1 Å²	138.1	68%	0.678	76%	0.757	S	S	*	*				129.1	141.3	79.4	-2.4	0	0	0	0	116.3
2526	D	34.9	Very low	33.3	Very low	140 Å²	140	139.3 Å²	139.3	75%	0.749	76%	0.76	S	S	*	*			trans	66.2	129.1	138.2	-71.6	-9.4	0	0	0	121.7
2527	C	33.1	Very low	33.6	Very low	92.5 Å²	92.5	140.4 Å²	140.4	63%	0.625	76%	0.757	S	S	*	*				139.4	125.8	65.2	-98.4	0	0	0	0	116.8
2528	N	35.1	Very low	33.6	Very low	134.5 Å²	134.5	136.2 Å²	136.2	72%	0.719	75%	0.751	S	S	*	*				72.7	129.2	129.1	-71.2	-17.3	0	0	0	122.5
2529	N	35.8	Very low	33.8	Very low	131.5 Å²	131.5	132.4 Å²	132.4	70%	0.703	74%	0.741	S	S	*	*			trans	93.7	132.6	136.3	-70.2	8.1	0	0	0	118.8
2530	D	37.5	Very low	34	Very low	128 Å²	128	137.5 Å²	137.5	68%	0.684	74%	0.74	S	S	*	*				151.8	126.9	76.5	-89.4	-37.1	0	0	0	116.7	K2532	D2530-K2532 IonicContact OD1-NZ 3.41Å
2531	E	32.6	Very low	34.1	Very low	162 Å²	162	141.5 Å²	141.5	76%	0.757	74%	0.735	S	S	*	*			trans	-22.6	132.2	143	-74.3	-167.7	143.7	0	0	116.9
2532	K	37.7	Very low	34.2	Very low	165.5 Å²	165.5	145.1 Å²	145.1	72%	0.72	74%	0.735	S	S	*	*			trans	152.5	120.6	136.7	-86	140.1	-167.1	149.5	0	114.4	D2530	D2530-K2532 IonicContact OD1-NZ 3.41Å
2533	K	33.1	Very low	34.4	Very low	174.5 Å²	174.5	148.2 Å²	148.2	76%	0.759	74%	0.739	S	S	*	*				68.8	113.3	108.1	-73.8	-167.6	171.7	-153.5	0	116.5
2534	L	33.4	Very low	34.3	Very low	158 Å²	158	144.6 Å²	144.6	83%	0.827	73%	0.734	S	S	*	*				142.8	146.1	90	-99.1	163.7	0	0	0	112.2
2535	E	34.5	Very low	34.3	Very low	152 Å²	152	144.2 Å²	144.2	71%	0.71	73%	0.732	S	S	*	*			trans	157.8	157.4	171.1	-68.8	166.6	140.4	0	0	113.6
2536	E	35	Very low	34.1	Very low	165 Å²	165	145.3 Å²	145.3	77%	0.771	73%	0.734	S	S	*	*				122.9	142.4	81.4	-91.7	176.4	160.8	0	0	113
2537	D	36.3	Very low	34	Very low	138 Å²	138	145.7 Å²	145.7	74%	0.738	74%	0.736	S	S	*	*				148.3	128.6	123.8	-107	-5.6	0	0	0	118.2
2538	N	30.4	Very low	33.9	Very low	135 Å²	135	148.3 Å²	148.3	72%	0.722	74%	0.744	S	S	*	*			trans	160.2	153.3	145.6	-94	-49.7	0	0	0	117.2
2539	V	34.8	Very low	33.8	Very low	108.5 Å²	108.5	147.5 Å²	147.5	66%	0.658	75%	0.749	S	S	*	*			trans	99.9	121.2	132.9	178.4	0	0	0	0	119.3
2540	K	34.5	Very low	33.5	Very low	189.5 Å²	189.5	152.6 Å²	152.6	82%	0.824	76%	0.758	S	S	*	*			trans	127.6	144.7	137	-83.5	163.2	-162.7	162.1	0	117.4
2541	Q	32.7	Very low	33.2	Very low	170 Å²	170	151.8 Å²	151.8	79%	0.794	76%	0.762	S	S	*	*				-130.7	149.6	-106.8	-89.1	173.5	-8.3	0	0	112.6
2542	L	33.5	Very low	33	Very low	153 Å²	153	148.8 Å²	148.8	80%	0.801	76%	0.759	S	S	*	*				177.3	149.8	114.6	-122.5	85.9	0	0	0	115
2543	H	34	Very low	32.7	Very low	157.5 Å²	157.5	148.1 Å²	148.1	73%	0.729	76%	0.764	S	S	*	*			trans	159.7	136.9	159.6	-82.2	-55.8	0	0	0	121
2544	N	33.5	Very low	32.5	Very low	135.5 Å²	135.5	148.5 Å²	148.5	73%	0.725	77%	0.765	S	S	*	*				117.5	151.1	129.6	-81.5	-3.7	0	0	0	116.1
2545	N	32.8	Very low	32.2	Very low	127 Å²	127	147.9 Å²	147.9	68%	0.679	76%	0.761	S	S	*	*			cis	-165.7	155.1	-19.1	-117.5	-24.2	0	0	0	110.3
2546	N	30.3	Very low	32	Very low	134.5 Å²	134.5	145.7 Å²	145.7	72%	0.719	76%	0.758	S	S	*	*			trans	-9.4	147	162.8	-61.5	-22.1	0	0	0	121.5
2547	N	33.8	Very low	31.8	Very low	148.5 Å²	148.5	145.6 Å²	145.6	79%	0.794	76%	0.757	S	S	*	*				147.3	127.8	125.4	-80.9	-11.3	0	0	0	119.3
2548	D	30.7	Very low	31.4	Very low	146 Å²	146	145.2 Å²	145.2	78%	0.781	76%	0.755	S	S	*	*			trans	-6.6	137	150.9	-65.6	-53.3	0	0	0	120.4
2549	S	33.2	Very low	31.4	Very low	118 Å²	118	147 Å²	147	83%	0.825	76%	0.759	S	S	*	*				142.1	141.4	124.5	52.6	0	0	0	0	119.7
2550	R	29.6	Very low	31.1	Very low	239 Å²	239	147.5 Å²	147.5	90%	0.902	77%	0.767	S	S	*	*			trans	160.3	137.4	160.8	-80.1	171.8	161.5	163.5	-5.7	119.7
2551	S	30.9	Very low	30.8	Very low	110.5 Å²	110.5	146.8 Å²	146.8	77%	0.773	77%	0.767	S	S	*	*			trans	123.4	147.5	136.4	53.8	0	0	0	0	114.6
2552	S	28.9	Very low	30.7	Very low	99 Å²	99	147.3 Å²	147.3	69%	0.692	77%	0.769	S	S	*	*			cis	148.2	144.5	-1	-70.9	0	0	0	0	110.7
2553	N	30.7	Very low	30.5	Very low	152 Å²	152	150.3 Å²	150.3	81%	0.813	77%	0.772	S	S	*	*			trans	77.8	122.8	164.2	-57.2	-23.4	0	0	0	119.5
2554	K	28.5	Very low	30.1	Very low	182.5 Å²	182.5	148.1 Å²	148.1	79%	0.793	77%	0.774	S	S	*	*				95	106.5	60.3	-121.9	-174.8	175.2	-178.8	0	120.9
2555	I	28.8	Very low	30	Very low	144 Å²	144	147 Å²	147	74%	0.738	77%	0.774	S	S	*	*			trans	134.3	130.7	142.5	-63.2	151.1	0	0	0	112.9
2556	V	28.9	Very low	29.7	Very low	106.5 Å²	106.5	149.7 Å²	149.7	65%	0.645	79%	0.785	S	S	*	*				123.8	128.1	73.9	176.4	0	0	0	0	113.5
2557	H	31.3	Very low	29.7	Very low	164 Å²	164	149.6 Å²	149.6	76%	0.759	78%	0.784	S	S	*	*			trans	60.2	139.3	162	-60.3	-82.2	0	0	0	118.3
2558	N	27.6	Very low	29.5	Very low	129 Å²	129	149.1 Å²	149.1	69%	0.69	78%	0.782	S	S	*	*			cis	133.6	127	27	-99.3	15.5	0	0	0	114.4
2559	E	29.7	Very low	29.4	Very low	173 Å²	173	151.1 Å²	151.1	81%	0.808	78%	0.784	S	S	*	*			trans	120.3	126.5	142.1	-83.5	159.2	-156.8	0	0	114.9
2560	S	28.9	Very low	29.1	Very low	118 Å²	118	151.8 Å²	151.8	83%	0.825	78%	0.777	S	S	*	*				138.3	105	72.3	60.9	0	0	0	0	115.2
2561	E	29.3	Very low	29.2	Very low	175 Å²	175	144.8 Å²	144.8	82%	0.818	77%	0.765	S	S	*	*			trans	-117.2	139.2	172.9	-80.4	164.4	176.3	0	0	111.1
2562	Q	29.2	Very low	29.1	Very low	181.5 Å²	181.5	147.2 Å²	147.2	85%	0.848	76%	0.763	S	S	*	*				127.9	91.3	85.2	-131.7	175.7	50.1	0	0	114.8
2563	Y	29.1	Very low	29.1	Very low	216 Å²	216	148.5 Å²	148.5	85%	0.847	77%	0.767	S	S	*	*			trans	-58.7	134.2	150.8	-79.5	-85.4	0	0	0	117.6
2564	S	26.3	Very low	29	Very low	111.5 Å²	111.5	149.8 Å²	149.8	78%	0.78	77%	0.768	S	S	*	*			trans	-150.8	155.3	148.1	-67.7	0	0	0	0	114.1
2565	P	30.8	Very low	29.2	Very low	112 Å²	112	147.9 Å²	147.9	73%	0.727	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-98.4	154	-164.3	36.5	-31.9	0	0	0	114.7
2566	M	27.7	Very low	29.3	Very low	182.5 Å²	182.5	148 Å²	148	90%	0.899	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-143.4	122.3	152.2	-97.5	-164.2	164.3	0	0	111.3
2567	N	30.5	Very low	29.4	Very low	133 Å²	133	149.2 Å²	149.2	71%	0.711	77%	0.77	S	S	*	*			trans	-131.6	119.3	146.8	-81	-69.7	0	0	0	110.3	K2569	N2567-K2569 HydrophobicContact CB-CG 4.14Å; N2567-K2569 VanDerWaalsContact OD1-CE 3.27Å; N2567-K2569 WeakPolarHBondContact OD1-CE 3.45Å
2568	N	28.5	Very low	29.4	Very low	138.5 Å²	138.5	147.3 Å²	147.3	74%	0.741	77%	0.77	S	S	*	*			trans	-89.2	119.9	148.8	-94.5	-20.5	0	0	0	108.6
2569	K	29.4	Very low	29.6	Very low	188.5 Å²	188.5	148.5 Å²	148.5	82%	0.82	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-120.5	121.6	156.7	-94.9	177	-177.7	-177.3	0	109.7	N2567	N2567-K2569 HydrophobicContact CB-CG 4.14Å; N2567-K2569 VanDerWaalsContact OD1-CE 3.27Å; N2567-K2569 WeakPolarHBondContact OD1-CE 3.45Å
2570	L	26.9	Very low	29.7	Very low	132 Å²	132	144.5 Å²	144.5	69%	0.691	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-82.6	141	157.4	-87	127.4	0	0	0	109.4	H2572	L2570-H2572 VanDerWaalsContact CD2-CD2 3.45Å; L2570-H2572 WeakPolarHBondContact CD2-CD2 3.38Å
2571	S	30.5	Very low	29.8	Very low	91.5 Å²	91.5	147.2 Å²	147.2	64%	0.64	76%	0.763	S	S	*	*			trans	-120.1	134.5	164.5	49.4	0	0	0	0	111.6	T2573	S2571-T2573 PolarHBondContact O-N 2.79Å
2572	H	29.7	Very low	29.9	Very low	161 Å²	161	147 Å²	147	75%	0.745	77%	0.767	S	S	*	*			trans	-66.1	144.2	157.4	-70.4	-87.9	0	0	0	109.4	L2570	L2570-H2572 VanDerWaalsContact CD2-CD2 3.45Å; L2570-H2572 WeakPolarHBondContact CD2-CD2 3.38Å
2573	T	29.5	Very low	30	Very low	125.5 Å²	125.5	144.9 Å²	144.9	77%	0.77	76%	0.76	S	S	*	*			trans	157.7	143.8	135.3	-53	0	0	0	0	108.1	S2571	S2571-T2573 PolarHBondContact O-N 2.79Å
2574	E	29	Very low	30	Very low	180 Å²	180	141.4 Å²	141.4	84%	0.841	76%	0.756	S	S	*	*	S	Bend	trans	78.6	112.7	-178.9	-47.2	-179	177.3	0	0	113.2
2575	I	30.8	Very low	30.3	Very low	143 Å²	143	145.1 Å²	145.1	73%	0.733	76%	0.761	S	S	*	*			cis	-137	91.6	37.2	-64.9	163.2	0	0	0	108.7	N2577 V2578	I2575-N2577 HydrophobicContact CG2-CB 4.05Å; I2575-N2577 PolarHBondContact O-N 2.85Å; I2575-V2578 HydrophobicContact CG2-CB 4.32Å; I2575-V2578 HydrophobicContact CG2-CG2 3.68Å
2576	N	32.3	Very low	30.2	Very low	145 Å²	145	147.6 Å²	147.6	78%	0.775	76%	0.761	S	S	*	*	S	Bend	trans	-113.7	26.6	169.3	-114.5	-18	0	0	0	112.3	T2580	N2576-T2580 PolarHBondContact O-OG1 2.82Å
2577	N	30.6	Very low	30.3	Very low	133 Å²	133	144.2 Å²	144.2	71%	0.711	76%	0.755	S	S	*	*	S	Bend	trans	-124.6	15.2	-168.7	-88.2	-8.3	0	0	0	115.1	I2575	I2575-N2577 HydrophobicContact CG2-CB 4.05Å; I2575-N2577 PolarHBondContact O-N 2.85Å
2578	V	31	Very low	30.2	Very low	124 Å²	124	144.2 Å²	144.2	75%	0.752	75%	0.754	S	S	*	*	S	Bend	trans	-117.8	-9.5	174	177.1	0	0	0	0	113	I2575 T2580	I2575-V2578 HydrophobicContact CG2-CB 4.32Å; I2575-V2578 HydrophobicContact CG2-CG2 3.68Å; V2578-T2580 PolarHBondContact O-N 3.16Å
2579	L	31.6	Very low	30.3	Very low	154.5 Å²	154.5	141.4 Å²	141.4	81%	0.809	75%	0.746	S	S	*	*	S	Bend	trans	-96.3	3.4	172.7	-84	165.5	0	0	0	114.3
2580	T	32.3	Very low	30.2	Very low	89.5 Å²	89.5	140.2 Å²	140.2	55%	0.549	74%	0.743	S	S	.	*	S	Bend	trans	-111.7	-1.8	-174	24.5	0	0	0	0	115	N2576 V2578	N2576-T2580 PolarHBondContact O-OG1 2.82Å; V2578-T2580 PolarHBondContact O-N 3.16Å
2581	E	31.1	Very low	30.2	Very low	174.5 Å²	174.5	140 Å²	140	82%	0.815	75%	0.747	S	S	*	*	S	Bend	trans	-111.2	0.1	-177.2	-151.8	159.7	-156.9	0	0	115
2582	L	31.9	Very low	30.1	Very low	170.5 Å²	170.5	141.4 Å²	141.4	89%	0.893	76%	0.757	S	S	*	*	S	Bend	trans	-115.6	8.4	174.6	-101.4	164.9	0	0	0	114.7
2583	L	31.1	Very low	30	Very low	136 Å²	136	137.8 Å²	137.8	71%	0.712	76%	0.755	S	S	*	*	S	Bend	trans	-117.6	27	-178	-122.1	148.3	0	0	0	113.6
2584	N	28.9	Very low	29.9	Very low	142.5 Å²	142.5	135.2 Å²	135.2	76%	0.762	74%	0.742	S	S	*	*	S	Bend	trans	-115.9	30	-177.3	-103.4	-18	0	0	0	115.4
2585	Q	32.8	Very low	29.9	Very low	191 Å²	191	130.5 Å²	130.5	89%	0.893	73%	0.729	S	S	*	*	S	Bend	trans	-148	69	158.9	-70.4	-164.7	14.7	0	0	110
2586	K	29.2	Very low	29.8	Very low	164 Å²	164	128.7 Å²	128.7	71%	0.713	73%	0.725	S	S	*	*				130.5	100.9	87.5	-142.5	163.9	-173.2	168.2	0	113.5	L2588	K2586-L2588 PolarHBondContact O-N 3.27Å
2587	S	28	Very low	29.7	Very low	111 Å²	111	132.1 Å²	132.1	78%	0.776	73%	0.727	S	S	*	*			trans	4.8	116.5	174.4	61.9	0	0	0	0	111.4
2588	L	30.1	Very low	29.7	Very low	132 Å²	132	132.8 Å²	132.8	69%	0.691	73%	0.729	S	S	*	*				-132.2	115.6	81.9	-81	170.8	0	0	0	111.3	K2586	K2586-L2588 PolarHBondContact O-N 3.27Å
2589	S	29.4	Very low	29.9	Very low	81 Å²	81	131.6 Å²	131.6	57%	0.566	73%	0.725	S	S	*	*			trans	10.4	127	146.8	56.9	0	0	0	0	119.1
2590	E	27	Very low	29.8	Very low	163 Å²	163	131.2 Å²	131.2	76%	0.762	72%	0.723	S	S	*	*				138.3	108.3	98.5	-109.1	176	178.3	0	0	111.7
2591	T	27.8	Very low	30.1	Very low	127.5 Å²	127.5	133.4 Å²	133.4	78%	0.782	73%	0.732	S	S	*	*			trans	167.5	128.6	164.9	-8.4	0	0	0	0	112.1
2592	S	28	Very low	30.4	Very low	120.5 Å²	120.5	131.9 Å²	131.9	84%	0.843	73%	0.729	S	S	*	*			trans	130.2	115.8	154.4	-63	0	0	0	0	115
2593	A	28	Very low	30.9	Very low	86.5 Å²	86.5	130.7 Å²	130.7	72%	0.715	72%	0.724	S	S	*	*	S	Bend	trans	-132.3	146.1	151.4	0	0	0	0	0	111.1
2594	S	27.8	Very low	31.3	Very low	70.5 Å²	70.5	130.5 Å²	130.5	49%	0.493	72%	0.723	S	S	.	*				138.6	132.8	62.2	-177.4	0	0	0	0	112.8	V2596 D2736	S2594-V2596 PolarHBondContact O-N 2.84Å; S2594-D2736 VanDerWaalsContact CA-CG 3.45Å; S2594-D2736 WeakPolarHBondContact CA-OD1 3.21Å; S2594-D2736 WeakPolarHBondContact CA-OD2 3.27Å; S2594-D2736 WeakPolarHBondContact CB-OD1 3.32Å; S2594-D2736 VanDerWaalsContact OG-CB 3.23Å; S2594-D2736 WeakPolarHBondContact OG-CB 3.12Å; S2594-D2736 PolarHBondContact OG-OD1 3.04Å
2595	S	27.9	Very low	31.7	Very low	81 Å²	81	130.6 Å²	130.6	57%	0.566	72%	0.724	S	S	*	*			trans	10.6	110.3	160.7	63.5	0	0	0	0	113.7	W2735 D2736	S2595-W2735 VanDerWaalsContact CB-CZ3 3.46Å; S2595-W2735 VanDerWaalsContact OG-CH2 3.27Å; S2595-W2735 WeakPolarHBondContact OG-CH2 3.36Å; S2595-D2736 PolarHBondContact N-OD1 2.83Å
2596	V	29.2	Very low	32	Very low	105 Å²	105	126.4 Å²	126.4	64%	0.636	71%	0.711	S	S	*	*			trans	-84.8	121.1	162.9	-178.9	0	0	0	0	109.8	S2594 L2598 R2734	S2594-V2596 PolarHBondContact O-N 2.84Å; V2596-L2598 HydrophobicContact CG1-CG 4.42Å; V2596-R2734 PolarHBondContact O-NH2 3.49Å; V2596-R2734 VanDerWaalsContact O-NH2 3.08Å
2597	W	29.5	Very low	32.5	Very low	217.5 Å²	217.5	125.6 Å²	125.6	82%	0.824	71%	0.714	S	S	*	*			trans	-116.8	144.7	146.7	-82.3	97	0	0	0	110.8	R2734	W2597-R2734 VanDerWaalsContact CD2-NH2 3.34Å
2598	L	30.8	Very low	32.8	Very low	146 Å²	146	126.3 Å²	126.3	76%	0.764	71%	0.709	S	S	*	*			trans	-125.7	163.2	167.2	-71.2	171.4	0	0	0	107.7	V2596	V2596-L2598 HydrophobicContact CG1-CG 4.42Å
2599	P	35	Very low	33.1	Very low	100.5 Å²	100.5	124.9 Å²	124.9	65%	0.653	71%	0.711	S	S	*	*				-107.1	-172.3	-110.5	17.8	2.3	0	0	0	111.6
2600	D	30.2	Very low	33.4	Very low	145 Å²	145	125.3 Å²	125.3	78%	0.775	71%	0.714	S	S	*	*			trans	12.3	133.7	159.5	-60.2	-39.8	0	0	0	116.1
2601	D	38.7	Very low	33.9	Very low	136 Å²	136	123.6 Å²	123.6	73%	0.727	71%	0.71	S	S	*	*			trans	73.9	96	161	-56.3	-12.6	0	0	0	123.5
2602	D	37.9	Very low	34.3	Very low	143 Å²	143	124.7 Å²	124.7	77%	0.765	71%	0.711	S	S	*	*				83.3	162.7	111	-69.8	-6.6	0	0	0	126.8
2603	D	40.8	Very low	34.5	Very low	145 Å²	145	122.9 Å²	122.9	78%	0.775	71%	0.711	S	S	*	*			trans	81.3	94.1	161.3	-72.8	-8.2	0	0	0	123.7
2604	D	39.9	Very low	34.6	Very low	131 Å²	131	125.7 Å²	125.7	70%	0.701	71%	0.713	S	S	*	*				45.1	121.5	117.4	-80.6	6.5	0	0	0	123.2
2605	N	36.7	Very low	34.9	Very low	145 Å²	145	130 Å²	130	78%	0.775	73%	0.729	S	S	*	*				174.9	122.5	108	-93.9	-85.8	0	0	0	108.7
2606	V	40.2	Very low	35.1	Very low	104 Å²	104	135.1 Å²	135.1	63%	0.63	74%	0.737	S	S	*	*				68.9	100.3	66.5	-178.8	0	0	0	0	114.7
2607	D	39.8	Very low	35.3	Very low	146 Å²	146	137.2 Å²	137.2	78%	0.781	74%	0.74	S	S	*	*			trans	168.9	155	136.2	-99	-13	0	0	0	111.5
2608	N	35.1	Very low	35.6	Very low	126 Å²	126	132.5 Å²	132.5	67%	0.674	73%	0.731	S	S	*	*			cis	-165.1	162.3	-41.9	-138.3	-50.4	0	0	0	110.9
2609	S	36.1	Very low	35.7	Very low	102 Å²	102	133 Å²	133	71%	0.713	74%	0.735	S	S	*	*			trans	68.2	153.7	161.9	87.7	0	0	0	0	118.6
2610	S	35.6	Very low	35.9	Very low	90 Å²	90	133.8 Å²	133.8	63%	0.629	74%	0.74	S	S	*	*			cis	-169.7	169.7	-23.3	50	0	0	0	0	112.6
2611	N	36.4	Very low	36	Very low	127 Å²	127	132.3 Å²	132.3	68%	0.679	74%	0.741	S	S	*	*			trans	90.7	93	152.2	-63.7	-35.5	0	0	0	122.2
2612	N	35.9	Very low	35.6	Very low	152 Å²	152	130.6 Å²	130.6	81%	0.813	74%	0.74	S	S	*	*				77.2	124.8	116.7	-54.2	-23.8	0	0	0	121.4
2613	G	33.4	Very low	35.3	Very low	82 Å²	82	131.3 Å²	131.3	85%	0.845	74%	0.743	S	S	*	*			trans	178.8	30	170	0	0	0	0	0	116.4
2614	I	30.4	Very low	34.7	Very low	145 Å²	145	133.8 Å²	133.8	74%	0.744	74%	0.742	S	S	*	*			trans	-87.4	140	-179.2	-62.9	171.6	0	0	0	110.9	Y2616	I2614-Y2616 HydrophobicContact CG2-CD2 3.99Å; I2614-Y2616 HydrophobicContact CG2-CE2 4.21Å
2615	L	33.2	Very low	34.3	Very low	160 Å²	160	134.6 Å²	134.6	84%	0.838	75%	0.752	S	S	*	*			trans	153.6	148.9	144.8	-81.1	151.3	0	0	0	109.3
2616	Y	32.7	Very low	33.9	Very low	189 Å²	189	137.7 Å²	137.7	74%	0.741	75%	0.753	S	S	*	*			cis	-179	164.4	-36.4	-129.4	-76.9	0	0	0	106.4	I2614	I2614-Y2616 HydrophobicContact CG2-CD2 3.99Å; I2614-Y2616 HydrophobicContact CG2-CE2 4.21Å
2617	E	33	Very low	33.3	Very low	149 Å²	149	137.4 Å²	137.4	70%	0.696	76%	0.756	S	S	*	*			trans	73	112.8	154	-66.7	-155.5	119.1	0	0	123.8
2618	N	35.2	Very low	33	Very low	119 Å²	119	136.2 Å²	136.2	64%	0.636	75%	0.754	S	S	*	*				86.6	111.9	117.3	-54.6	-8.2	0	0	0	124
2619	D	32.7	Very low	32.7	Very low	157 Å²	157	136.9 Å²	136.9	84%	0.84	76%	0.756	S	S	*	*				86.5	153.5	126.1	-81.4	5.7	0	0	0	124.6
2620	P	39.3	Very low	32.4	Very low	117 Å²	117	137.7 Å²	137.7	76%	0.76	76%	0.757	S	S	*	*			trans	-126.2	154.9	-153.8	41	-25.4	0	0	0	117
2621	S	33.6	Very low	32.1	Very low	114 Å²	114	141.4 Å²	141.4	80%	0.797	76%	0.764	S	S	*	*			trans	-167.3	154.3	161.7	57.5	0	0	0	0	110.1
2622	S	29.9	Very low	31.7	Very low	100 Å²	100	140.3 Å²	140.3	70%	0.699	77%	0.766	S	S	*	*			cis	175.4	-178.3	-29	56.1	0	0	0	0	106.5
2623	L	32.2	Very low	31.4	Very low	158 Å²	158	138.8 Å²	138.8	83%	0.827	77%	0.765	S	S	*	*			trans	84.5	87.9	167.5	-55.5	175.7	0	0	0	120.7
2624	Y	27.2	Very low	31.3	Very low	197 Å²	197	140.2 Å²	140.2	77%	0.773	76%	0.759	S	S	*	*			trans	5.1	143.5	131.3	-91.4	-91.2	0	0	0	121.8
2625	T	32.8	Very low	31.1	Very low	147 Å²	147	138.2 Å²	138.2	90%	0.902	76%	0.758	S	S	*	*			trans	-147.7	159.4	131.3	-4	0	0	0	0	110.5
2626	R	27.4	Very low	30.9	Very low	210 Å²	210	138.5 Å²	138.5	79%	0.792	76%	0.759	S	S	*	*			trans	-154.9	156.9	-163.9	176	-178.7	168.2	-178.5	-1.2	113.4
2627	S	28.1	Very low	30.7	Very low	99 Å²	99	136.1 Å²	136.1	69%	0.692	76%	0.759	S	S	*	*			trans	96.3	149.5	169	-36.7	0	0	0	0	114
2628	T	32	Very low	30.4	Very low	120 Å²	120	135.9 Å²	135.9	74%	0.736	76%	0.762	S	S	*	*			cis	-134.2	136.6	14.5	42.7	0	0	0	0	111.6
2629	I	28.7	Very low	29.9	Very low	140 Å²	140	139.1 Å²	139.1	72%	0.718	77%	0.774	S	S	*	*				52.8	117.2	93.1	-54.8	171.5	0	0	0	112
2630	T	31.7	Very low	29.6	Very low	120 Å²	120	136.9 Å²	136.9	74%	0.736	77%	0.771	S	S	*	*				-129.8	135.4	53.7	44.7	0	0	0	0	114.3
2631	Q	29.2	Very low	29.2	Very low	167 Å²	167	139.3 Å²	139.3	78%	0.78	78%	0.775	S	S	*	*				54.6	132	89.1	-67.7	-172.6	-15.2	0	0	115.3
2632	S	27.8	Very low	28.8	Very low	104 Å²	104	145 Å²	145	73%	0.727	78%	0.779	S	S	*	*			cis	-171.8	172.7	-4.6	-83	0	0	0	0	108.8
2633	P	29.6	Very low	28.7	Very low	121 Å²	121	149 Å²	149	79%	0.786	79%	0.787	S	S	*	*			cis	-121.4	174.2	-11.1	39.6	-24.8	0	0	0	114
2634	P	29.9	Very low	28.5	Very low	111 Å²	111	148 Å²	148	72%	0.721	79%	0.787	S	S	*	*			trans	-118.2	170.5	-173.9	41.8	-31.7	0	0	0	116.3
2635	S	26.5	Very low	28.6	Very low	103 Å²	103	146.6 Å²	146.6	72%	0.72	79%	0.788	S	S	*	*			trans	55.3	128.8	149.9	64.4	0	0	0	0	121
2636	I	29.2	Very low	28.4	Very low	166 Å²	166	144.8 Å²	144.8	85%	0.851	78%	0.776	S	S	*	*				-142.8	121.9	125.6	-111.2	164	0	0	0	108.8
2637	D	28.4	Very low	28.4	Very low	139 Å²	139	139.2 Å²	139.2	74%	0.743	77%	0.769	S	S	*	*			trans	-87.7	173.7	168.5	-110.5	-62.6	0	0	0	109.9
2638	N	26.7	Very low	28.3	Very low	144 Å²	144	142 Å²	142	77%	0.77	78%	0.776	S	S	*	*	S	Bend	trans	-31.2	139.3	179.2	-68	-81.4	0	0	0	116.8
2639	Q	26.1	Very low	28	Very low	187 Å²	187	143.4 Å²	143.4	87%	0.874	78%	0.784	S	S	*	*			trans	82.1	75.6	173.6	-49.2	-178	12.4	0	0	117.7
2640	S	26.4	Very low	28	Very low	111 Å²	111	144.1 Å²	144.1	78%	0.776	79%	0.789	S	S	*	*				175.5	120	125.7	-82	0	0	0	0	113.2
2641	I	30.3	Very low	28	Very low	167 Å²	167	142.2 Å²	142.2	86%	0.856	78%	0.781	S	S	*	*				-170.8	113.9	124.8	-93	152.2	0	0	0	107.3
2642	R	25.3	Very low	28.1	Very low	235 Å²	235	143 Å²	143	89%	0.887	78%	0.784	S	S	*	*			trans	-116.7	166.4	155	-81.3	-170.8	175.8	-136.3	2.1	106.4
2643	Q	27.5	Very low	28.1	Very low	182 Å²	182	145.4 Å²	145.4	85%	0.85	79%	0.789	S	S	*	*			trans	80.6	153.8	171.2	-54	-176.1	-41.7	0	0	115.8
2644	V	27.9	Very low	28.1	Very low	137 Å²	137	147 Å²	147	83%	0.83	79%	0.79	S	S	*	*	S	Bend	trans	65.7	89.5	-160.7	-167.5	0	0	0	0	112.3
2645	E	29.5	Very low	28.1	Very low	169 Å²	169	150 Å²	150	79%	0.79	79%	0.794	S	S	*	*	S	Bend	cis	-154.8	157.3	1.2	-116.4	-165.7	-94.4	0	0	108.2
2646	V	29	Very low	28.1	Very low	109 Å²	109	153.2 Å²	153.2	66%	0.661	80%	0.8	S	S	*	*			cis	-152.4	172.7	-0.4	74.1	0	0	0	0	110.8
2647	S	26.2	Very low	28.1	Very low	92 Å²	92	153.3 Å²	153.3	64%	0.643	80%	0.802	S	S	*	*			trans	35.8	116.9	158.8	-68.4	0	0	0	0	123.7
2648	L	26	Very low	28	Very low	159 Å²	159	156.2 Å²	156.2	83%	0.832	81%	0.808	S	S	*	*				73.2	89	129.4	-59.1	172.3	0	0	0	120.8
2649	T	26.3	Very low	28.3	Very low	149 Å²	149	155.1 Å²	155.1	91%	0.914	81%	0.809	S	S	*	*				-134.2	145.6	115.2	42.9	0	0	0	0	108.4
2650	N	29.2	Very low	28.4	Very low	155 Å²	155	153.5 Å²	153.5	83%	0.829	80%	0.804	S	S	*	*			trans	-110	145	-173.2	-156.9	3.7	0	0	0	113.1
2651	S	30.2	Very low	28.3	Very low	80 Å²	80	156.2 Å²	156.2	56%	0.559	81%	0.809	S	S	*	*			trans	-66.3	151.5	-166.4	56.6	0	0	0	0	117.2
2652	Q	32	Very low	28.3	Very low	182 Å²	182	153 Å²	153	85%	0.85	80%	0.801	S	S	*	*				171	109.1	118.9	-89.5	159.9	24.7	0	0	108.1
2653	N	27.1	Very low	28.3	Very low	155 Å²	155	150.4 Å²	150.4	83%	0.829	80%	0.798	S	S	*	*			cis	84.2	152	48.9	-145	7.7	0	0	0	113.4
2654	I	30.7	Very low	28.5	Very low	155 Å²	155	151 Å²	151	80%	0.795	80%	0.801	S	S	*	*			trans	85.4	131.8	-168.2	-56	169.6	0	0	0	113.3
2655	Q	30.6	Very low	28.5	Very low	174 Å²	174	152.8 Å²	152.8	81%	0.813	80%	0.8	S	S	*	*			cis	-161.4	166.5	-17.2	178.5	165.2	-2.8	0	0	109.7
2656	M	24.9	Very low	28.4	Very low	170 Å²	170	152.9 Å²	152.9	84%	0.837	80%	0.801	S	S	*	*			trans	-62.9	153.8	-175.2	-47.6	-176.4	-154.1	0	0	115.4
2657	N	29.2	Very low	28.5	Very low	169 Å²	169	155.3 Å²	155.3	90%	0.904	81%	0.809	S	S	*	*				-158.9	171.7	124.2	-107	-28.9	0	0	0	113.5
2658	K	26.6	Very low	28.5	Very low	199 Å²	199	156.7 Å²	156.7	87%	0.865	81%	0.814	S	S	*	*			trans	-91.5	169.1	-169.2	-103.2	-176.4	176.8	-178.3	0	113.9
2659	P	33.9	Very low	28.4	Very low	121 Å²	121	157.3 Å²	157.3	79%	0.786	81%	0.812	S	S	*	*			trans	-86.2	161.2	-159.2	35.4	-38.5	0	0	0	115
2660	I	27.7	Very low	28.6	Very low	153 Å²	153	156.7 Å²	156.7	79%	0.785	80%	0.804	S	S	*	*			trans	-133.3	141.1	166.4	-67.4	-179.4	0	0	0	108.6
2661	I	25.3	Very low	28.6	Very low	169 Å²	169	159.2 Å²	159.2	87%	0.867	80%	0.802	S	S	*	*			trans	-92.4	128.2	166.9	-64.5	165.7	0	0	0	107.4
2662	S	29.2	Very low	28.6	Very low	99 Å²	99	163.3 Å²	163.3	69%	0.692	82%	0.815	S	S	*	*			trans	-151.1	113.5	167.4	54	0	0	0	0	110.3
2663	H	26.4	Very low	28.4	Very low	180 Å²	180	160.7 Å²	160.7	83%	0.833	81%	0.806	S	S	*	*			trans	-58.2	141.6	145.6	-87.9	-98.9	0	0	0	107.7
2664	E	31.7	Very low	28.6	Very low	194 Å²	194	161.4 Å²	161.4	91%	0.907	80%	0.804	S	S	*	*			trans	-158.2	160.6	136.1	-117.1	156.4	-148.9	0	0	110.7
2665	H	27.2	Very low	28.5	Very low	175 Å²	175	161.5 Å²	161.5	81%	0.81	81%	0.806	S	S	*	*			trans	-111.1	173.5	-176	-152	-107	0	0	0	108.6
2666	E	26.7	Very low	28.4	Very low	171 Å²	171	162.5 Å²	162.5	80%	0.799	81%	0.808	S	S	*	*			trans	70.1	147.6	-175.9	-42	-167.7	150.3	0	0	112.5
2667	L	31.2	Very low	28.6	Very low	161 Å²	161	159.8 Å²	159.8	84%	0.843	80%	0.801	S	S	*	*			cis	-139.6	141.4	39.8	-81.5	157.4	0	0	0	113.4
2668	T	25.7	Very low	28.6	Very low	120 Å²	120	163 Å²	163	74%	0.736	80%	0.802	S	S	*	*			trans	-77.7	159	165.9	45.8	0	0	0	0	113
2669	Q	25.6	Very low	28.6	Very low	172 Å²	172	161.4 Å²	161.4	80%	0.804	80%	0.798	S	S	*	*			trans	78.7	147.9	168.5	-51.7	-178.3	2.3	0	0	117.2
2670	N	29	Very low	28.5	Very low	137 Å²	137	160.3 Å²	160.3	73%	0.733	79%	0.793	S	S	*	*			trans	78.8	133.9	-177	-52.3	-85.1	0	0	0	114.1
2671	R	30.2	Very low	28.7	Very low	208 Å²	208	159.8 Å²	159.8	79%	0.785	79%	0.791	S	S	*	*			cis	-149.9	129.1	11.7	-136.4	171.8	-119.9	164.4	0.2	113	I2673	R2671-I2673 HydrophobicContact CG-CD1 4.43Å
2672	I	30.6	Very low	29.1	Very low	165 Å²	165	159.3 Å²	159.3	85%	0.846	79%	0.785	S	S	*	*			trans	-71.2	135.5	150.6	-63.9	166.4	0	0	0	107.4
2673	I	27.6	Very low	29.2	Very low	127 Å²	127	161.1 Å²	161.1	65%	0.651	78%	0.783	S	S	*	*			trans	166.1	142.5	166	-95.6	154.5	0	0	0	106.1	R2671	R2671-I2673 HydrophobicContact CG-CD1 4.43Å
2674	Q	31.5	Very low	29.6	Very low	171 Å²	171	159.4 Å²	159.4	80%	0.799	77%	0.773	S	S	*	*			cis	-150.3	149.7	29	-152.7	143.2	47.2	0	0	113.6
2675	N	26.9	Very low	29.8	Very low	156 Å²	156	157.2 Å²	157.2	83%	0.834	77%	0.765	S	S	*	*			trans	-84.8	145.6	163.4	-74.3	-26.2	0	0	0	111.5
2676	K	30.4	Very low	30.4	Very low	196 Å²	196	153.4 Å²	153.4	85%	0.852	75%	0.75	S	S	*	*			trans	-164.8	111	142.1	-107.4	171.2	-179.5	-177.4	0	109.6
2677	V	27.5	Very low	30.9	Very low	113 Å²	113	153.8 Å²	153.8	69%	0.685	74%	0.744	S	S	*	*				73.6	111.5	92.6	171.1	0	0	0	0	113.2
2678	Y	30.5	Very low	31.3	Very low	235 Å²	235	152.4 Å²	152.4	92%	0.922	74%	0.738	S	S	*	*				-140.8	140.1	128.8	-115	-81.9	0	0	0	108.9
2679	E	26.6	Very low	31.7	Very low	167 Å²	167	155.6 Å²	155.6	78%	0.78	74%	0.736	S	S	*	*			trans	-94.4	149.2	178.8	-62.4	162.5	107.1	0	0	110.1
2680	S	31.7	Very low	32.4	Very low	98 Å²	98	152.4 Å²	152.4	69%	0.685	73%	0.725	S	S	*	*				164.8	133.5	112.1	61.6	0	0	0	0	113.4
2681	N	31.9	Very low	33	Very low	141 Å²	141	151.5 Å²	151.5	75%	0.754	72%	0.72	S	S	*	*			trans	64.9	146.3	147	-53.1	-0.8	0	0	0	119.3
2682	E	32.7	Very low	33.4	Very low	159 Å²	159	148.5 Å²	148.5	74%	0.743	72%	0.715	S	S	*	*			cis	-159	172.1	-21.3	-120.9	173.1	157.4	0	0	108.9
2683	E	31.2	Very low	33.7	Very low	138 Å²	138	148.3 Å²	148.3	65%	0.645	71%	0.71	S	S	*	*			trans	-1.8	147.9	157.1	-66.3	-165.8	117.4	0	0	120.7
2684	K	34.5	Very low	34	Very low	144 Å²	144	148.9 Å²	148.9	63%	0.626	71%	0.711	S	S	*	*			cis	-174.6	148.5	34.4	-132.9	154.3	-173	140.7	0	112.3
2685	M	36.8	Very low	34.1	Very low	148 Å²	148	146.2 Å²	146.2	73%	0.729	70%	0.698	S	S	*	*			trans	63.2	149.4	145.8	-80.6	179.7	162.4	0	0	120.3
2686	D	39.1	Very low	34.3	Very low	95 Å²	95	148 Å²	148	51%	0.508	69%	0.693	S	S	.	*			cis	-159.6	153.7	-6.9	-131.4	-20.3	0	0	0	114.3
2687	R	37.4	Very low	34.5	Very low	178 Å²	178	143.3 Å²	143.3	67%	0.672	68%	0.677	S	S	*	*			trans	60.7	126.1	144.9	-82.1	173.8	-114.7	-169.6	4	124.2
2688	N	39.4	Very low	34.9	Very low	132 Å²	132	146.4 Å²	146.4	71%	0.706	68%	0.682	S	S	*	*				77.5	153.6	128.2	-63.2	-2.2	0	0	0	119.6
2689	R	35.4	Very low	34.9	Very low	187 Å²	187	139.7 Å²	139.7	71%	0.706	68%	0.675	S	S	*	*			cis	-173.6	158.6	-17.8	-96.1	-166.6	84.8	-141.3	-9.6	105
2690	D	39.6	Very low	35.2	Very low	106 Å²	106	140.5 Å²	140.5	57%	0.567	68%	0.676	S	S	*	*			cis	-166.5	-162.1	-12.9	-106.1	18.3	0	0	0	107
2691	N	40.9	Very low	35.1	Very low	117 Å²	117	142.4 Å²	142.4	63%	0.626	68%	0.677	S	S	*	*			trans	78	142	166.6	-61.1	34.6	0	0	0	116.8
2692	E	39.8	Very low	35.1	Very low	145 Å²	145	142.2 Å²	142.2	68%	0.678	68%	0.675	S	S	*	*			cis	-158.8	132.3	-13.7	-111.8	148.1	-171.5	0	0	106.3
2693	E	35.6	Very low	35	Very low	161 Å²	161	145.2 Å²	145.2	75%	0.752	68%	0.68	S	S	*	*				63.3	142.6	100.7	-72.4	-166.7	150.3	0	0	116.5
2694	E	35.3	Very low	35.2	Very low	140 Å²	140	145 Å²	145	65%	0.654	68%	0.682	S	S	*	*			cis	-144.4	150.1	-4.9	-111.7	-157.8	125.6	0	0	108.3
2695	Q	33.3	Very low	35.3	Very low	114 Å²	114	144.2 Å²	144.2	53%	0.533	69%	0.685	S	S	.	*				46.9	148.3	83.3	-43	-176.4	63.1	0	0	115.2
2696	R	30.2	Very low	35.4	Very low	193 Å²	193	143.3 Å²	143.3	73%	0.728	68%	0.683	S	S	*	*			cis	-162.7	175.3	0.1	-143.1	-176.2	-101.2	-131	0.4	111.3
2697	D	35.1	Very low	35.5	Very low	99 Å²	99	144.6 Å²	144.6	53%	0.529	69%	0.69	S	S	.	*			trans	84.5	127	135.4	-85	-23.6	0	0	0	124.5
2698	K	35.6	Very low	35.9	Very low	177 Å²	177	142.6 Å²	142.6	77%	0.77	69%	0.692	S	S	*	*			trans	74.1	102.8	131.2	-66	163.3	-169.9	146.8	0	120.7
2699	A	30.8	Very low	36.2	Very low	94 Å²	94	143.3 Å²	143.3	78%	0.777	70%	0.696	S	S	*	*			trans	-43.9	142.8	155.4	0	0	0	0	0	115.9
2700	K	33	Very low	36.7	Very low	185 Å²	185	141.2 Å²	141.2	80%	0.804	70%	0.699	S	S	*	*				175.3	129.9	128.5	-100.5	171.3	177.9	-178.7	0	114.5
2701	I	28.9	Very low	37	Very low	138 Å²	138	141.3 Å²	141.3	71%	0.708	70%	0.7	S	S	*	*			trans	74	146.5	133.7	-67.1	168.4	0	0	0	119.3
2702	L	33.4	Very low	37	Very low	137 Å²	137	142 Å²	142	72%	0.717	70%	0.703	S	S	*	*			trans	74.7	123.9	-176.5	-60.9	139.7	0	0	0	113.3
2703	R	28.9	Very low	36.9	Very low	222 Å²	222	139.9 Å²	139.9	84%	0.838	71%	0.705	S	S	*	*			cis	84.6	152.8	36.9	-71.7	-172	170.9	-173.9	-3.7	113.8
2704	L	36	Very low	37	Very low	134 Å²	134	137 Å²	137	70%	0.702	71%	0.708	S	S	*	*			trans	81.2	134	171.5	-42.4	173.1	0	0	0	113.1
2705	D	36.7	Very low	37.1	Very low	127 Å²	127	133.3 Å²	133.3	68%	0.679	71%	0.707	S	S	*	*			cis	-170.4	173.3	-11.3	-113.1	-3.1	0	0	0	110.2
2706	N	39.4	Very low	37.4	Very low	129 Å²	129	138.7 Å²	138.7	69%	0.69	72%	0.724	S	S	*	*			trans	69	157.3	163.5	-62.9	18.3	0	0	0	118.2
2707	D	41.1	Very low	37.8	Very low	121 Å²	121	133.6 Å²	133.6	65%	0.647	72%	0.718	S	S	*	*			cis	-166.2	172.8	-26.4	-83.5	-29.7	0	0	0	104.4
2708	D	45.2	Very low	37.9	Very low	136 Å²	136	134.6 Å²	134.6	73%	0.727	72%	0.724	S	S	*	*			cis	-136.7	-177.1	4.8	-60.8	-89.6	0	0	0	109.4
2709	D	46.8	Very low	37.9	Very low	148 Å²	148	133.5 Å²	133.5	79%	0.791	72%	0.719	S	S	*	*			trans	25.9	138.6	143.4	-57.2	-5.7	0	0	0	122.6
2710	D	46.2	Very low	38.1	Very low	142 Å²	142	135.5 Å²	135.5	76%	0.759	72%	0.716	S	S	*	*			cis	-169.4	-173	-13.8	-148.8	14.9	0	0	0	106.5
2711	D	45.6	Very low	38.1	Very low	109 Å²	109	135 Å²	135	58%	0.583	71%	0.714	S	S	*	*			cis	-153.6	-179.6	1.6	-170.3	22	0	0	0	110.6
2712	N	39.6	Very low	38.2	Very low	131 Å²	131	135.5 Å²	135.5	70%	0.701	72%	0.717	S	S	*	*			trans	-13.2	151.8	159.5	-70.7	-50.2	0	0	0	121.5
2713	S	38.1	Very low	38.2	Very low	101 Å²	101	136.6 Å²	136.6	71%	0.706	72%	0.723	S	S	*	*			cis	-167.8	161.2	-11.8	58	0	0	0	0	112.7
2714	A	37.6	Very low	38.4	Very low	99 Å²	99	132.6 Å²	132.6	82%	0.818	72%	0.718	S	S	*	*			trans	35.7	133.9	151	0	0	0	0	0	121.8
2715	G	37.1	Very low	38.2	Very low	63 Å²	63	133.9 Å²	133.9	65%	0.649	72%	0.718	S	S	*	*			cis	155.7	-177.7	-2.8	0	0	0	0	0	114
2716	Y	39.3	Very low	38.2	Very low	227 Å²	227	133.3 Å²	133.3	89%	0.89	72%	0.715	S	S	*	*			trans	66.8	138.5	177.4	-63.6	-96.8	0	0	0	117
2717	S	38.7	Very low	38.1	Very low	86 Å²	86	134.3 Å²	134.3	60%	0.601	72%	0.721	S	S	*	*			cis	-171.2	148.2	-17.9	53.9	0	0	0	0	111.2
2718	D	37.2	Very low	37.9	Very low	121 Å²	121	136 Å²	136	65%	0.647	73%	0.729	S	S	*	*			trans	54.3	144.9	132.4	-69.2	-14.2	0	0	0	121.9
2719	K	37.2	Very low	37.5	Very low	153 Å²	153	138.3 Å²	138.3	67%	0.665	74%	0.741	S	S	*	*			cis	-171.2	162.5	-3.9	-119	168.8	-175.4	106.8	0	110.8
2720	L	34.7	Very low	36.8	Very low	136 Å²	136	135.7 Å²	135.7	71%	0.712	74%	0.74	S	S	*	*			trans	60.3	115.7	151.1	-61.1	167.8	0	0	0	117.7
2721	K	31.9	Very low	36.1	Very low	175 Å²	175	137.1 Å²	137.1	76%	0.761	74%	0.742	S	S	*	*				69	120.2	68.7	-72.3	-168.9	-175.1	178.2	0	115.3
2722	L	31	Very low	35.3	Very low	149 Å²	149	138 Å²	138	78%	0.78	75%	0.751	S	S	*	*			trans	52	116.4	135.6	-56.8	168.6	0	0	0	118
2723	L	34	Very low	35	Very low	160 Å²	160	137 Å²	137	84%	0.838	75%	0.754	S	S	*	*				-170.6	171.3	87.1	-112.3	130.8	0	0	0	113.1
2724	N	33.2	Very low	34.6	Very low	138 Å²	138	138.3 Å²	138.3	74%	0.738	74%	0.744	S	S	*	*			trans	-73	158.3	-174.3	-61.1	-34.2	0	0	0	114.5
2725	K	32.4	Very low	34.4	Very low	161 Å²	161	142.2 Å²	142.2	70%	0.7	74%	0.737	S	S	*	*				93.9	136.9	126.8	-98.7	179.2	145	-68.1	0	122
2726	D	35.7	Very low	34.2	Very low	114 Å²	114	143.5 Å²	143.5	61%	0.61	73%	0.729	S	S	*	*			trans	81.7	154.7	144	-56.6	-23.3	0	0	0	120.7
2727	D	38.1	Very low	33.7	Very low	151 Å²	151	138.3 Å²	138.3	81%	0.807	72%	0.721	S	S	*	*			trans	76.6	79.1	165.8	-57.3	-13.3	0	0	0	120.9
2728	D	36.4	Very low	33.4	Very low	156 Å²	156	142.6 Å²	142.6	83%	0.834	73%	0.732	S	S	*	*				15.9	115.7	127.7	-59.8	-12.4	0	0	0	119.9
2729	L	36.9	Very low	32.9	Very low	185 Å²	185	144.7 Å²	144.7	97%	0.969	74%	0.738	S	S	*	*			trans	-144.7	150.7	136.1	-83	-171.6	0	0	0	110
2730	A	32.1	Very low	32.4	Very low	92 Å²	92	143 Å²	143	76%	0.76	74%	0.742	S	S	*	*			trans	-119.2	172.8	-167.6	0	0	0	0	0	114.2
2731	E	30.9	Very low	32.1	Very low	173 Å²	173	144.7 Å²	144.7	81%	0.808	75%	0.751	S	S	*	*			trans	80.7	109.4	154.8	-75.6	-172.3	165.2	0	0	121.7
2732	T	29.8	Very low	31.8	Very low	128 Å²	128	140.2 Å²	140.2	79%	0.785	74%	0.742	S	S	*	*			trans	107	152	130.7	65.2	0	0	0	0	121.3
2733	S	33.1	Very low	31.8	Very low	108 Å²	108	139.4 Å²	139.4	76%	0.755	74%	0.743	S	S	*	*			trans	61.4	120	-164.1	55.3	0	0	0	0	114.6
2734	R	28.8	Very low	31.3	Very low	130 Å²	130	138.4 Å²	138.4	49%	0.491	74%	0.739	S	S	.	*			cis	77.9	156.5	27.1	-155.9	174.1	176.9	142.6	-15.5	113	V2596 W2597	V2596-R2734 PolarHBondContact O-NH2 3.49Å; V2596-R2734 VanDerWaalsContact O-NH2 3.08Å; W2597-R2734 VanDerWaalsContact CD2-NH2 3.34Å
2735	W	34.3	Very low	31.1	Very low	180 Å²	180	135.9 Å²	135.9	68%	0.682	73%	0.731	S	S	*	*			trans	71.5	119.2	-170.1	-47.9	69	0	0	0	111.4	S2595	S2595-W2735 VanDerWaalsContact CB-CZ3 3.46Å; S2595-W2735 VanDerWaalsContact OG-CH2 3.27Å; S2595-W2735 WeakPolarHBondContact OG-CH2 3.36Å
2736	D	31.4	Very low	30.8	Very low	90 Å²	90	137.7 Å²	137.7	48%	0.481	74%	0.74	S	S	.	*			cis	-158.7	-171.7	-11.6	-147.5	87.2	0	0	0	112.6	S2594 S2595	S2594-D2736 VanDerWaalsContact CA-CG 3.45Å; S2594-D2736 WeakPolarHBondContact CA-OD1 3.21Å; S2594-D2736 WeakPolarHBondContact CA-OD2 3.27Å; S2594-D2736 WeakPolarHBondContact CB-OD1 3.32Å; S2594-D2736 VanDerWaalsContact OG-CB 3.23Å; S2594-D2736 WeakPolarHBondContact OG-CB 3.12Å; S2594-D2736 PolarHBondContact OG-OD1 3.04Å; S2595-D2736 PolarHBondContact N-OD1 2.83Å
2737	T	29.2	Very low	30.5	Very low	118 Å²	118	139.8 Å²	139.8	72%	0.724	75%	0.75	S	S	*	*			trans	-129.4	115.3	-170.5	-52.5	0	0	0	0	112.4
2738	E	32.1	Very low	30	Very low	177 Å²	177	138 Å²	138	83%	0.827	74%	0.744	S	S	*	*			trans	-90.8	156.6	171.3	-65	-159	146.3	0	0	113.2
2739	Q	27.2	Very low	29.7	Very low	165 Å²	165	135.5 Å²	135.5	77%	0.771	74%	0.737	S	S	*	*			trans	-108	147.6	-150.2	-59.9	179.4	-6.1	0	0	114.8
2740	P	27.3	Very low	29.3	Very low	116 Å²	116	132.3 Å²	132.3	75%	0.753	72%	0.718	S	S	*	*			trans	-70.9	130.9	154.2	31.5	-31.8	0	0	0	109.9	S2742	P2740-S2742 PolarHBondContact O-N 3.23Å
2741	L	27.7	Very low	29.3	Very low	173 Å²	173	136.9 Å²	136.9	91%	0.906	72%	0.721	S	S	*	*			trans	-65.3	96.6	179.9	-80.2	167	0	0	0	111.9	V2743	L2741-V2743 PolarHBondContact O-N 3.45Å
2742	S	27	Very low	29.5	Very low	81 Å²	81	132.4 Å²	132.4	57%	0.566	70%	0.702	S	S	*	*			trans	-86.7	94.4	-179.1	59.5	0	0	0	0	112.5	P2740 N2744	P2740-S2742 PolarHBondContact O-N 3.23Å; S2742-N2744 VanDerWaalsContact C-N 3.25Å; S2742-N2744 WeakPolarHBondContact CB-ND2 3.41Å; S2742-N2744 PolarHBondContact O-N 2.83Å; S2742-N2744 PolarHBondContact OG-ND2 3.29Å; S2742-N2744 VanDerWaalsContact OG-ND2 3.16Å
2743	V	29.6	Very low	29.4	Very low	132 Å²	132	130.4 Å²	130.4	80%	0.8	69%	0.691	S	S	*	*			trans	-71.3	85.7	165.3	-177.2	0	0	0	0	108.6	L2741 S2745	L2741-V2743 PolarHBondContact O-N 3.45Å; V2743-S2745 PolarHBondContact O-N 2.8Å
2744	N	25.2	Very low	29.5	Very low	139 Å²	139	133 Å²	133	74%	0.743	70%	0.697	S	S	*	*			trans	-77	59.7	-172.3	-93.2	-52.8	0	0	0	114	S2742	S2742-N2744 VanDerWaalsContact C-N 3.25Å; S2742-N2744 WeakPolarHBondContact CB-ND2 3.41Å; S2742-N2744 PolarHBondContact O-N 2.83Å; S2742-N2744 PolarHBondContact OG-ND2 3.29Å; S2742-N2744 VanDerWaalsContact OG-ND2 3.16Å
2745	S	28	Very low	29.8	Very low	84 Å²	84	134.5 Å²	134.5	59%	0.587	71%	0.707	S	S	*	*			trans	-81.2	113.5	159.2	57.3	0	0	0	0	109.5	V2743 L2747	V2743-S2745 PolarHBondContact O-N 2.8Å; S2745-L2747 VanDerWaalsContact C-N 3.29Å; S2745-L2747 PolarHBondContact O-N 2.77Å
2746	K	25.8	Very low	29.8	Very low	200 Å²	200	130.8 Å²	130.8	87%	0.87	70%	0.696	S	S	*	*			trans	-69.1	77.4	-179.7	-80.8	-179.4	173.7	171.5	0	112.8	T2748	K2746-T2748 VanDerWaalsContact C-N 3.26Å; K2746-T2748 PolarHBondContact O-N 3.06Å
2747	L	29.7	Very low	29.6	Very low	157 Å²	157	131.8 Å²	131.8	82%	0.822	71%	0.707	S	S	*	*			trans	-72.2	80.4	163.3	-91.1	159.8	0	0	0	109.8	S2745	S2745-L2747 VanDerWaalsContact C-N 3.29Å; S2745-L2747 PolarHBondContact O-N 2.77Å
2748	T	28	Very low	29.6	Very low	113 Å²	113	130.5 Å²	130.5	69%	0.693	70%	0.703	S	S	*	*			trans	-59.8	123.8	165.1	39.6	0	0	0	0	109.2	K2746 M2750	K2746-T2748 VanDerWaalsContact C-N 3.26Å; K2746-T2748 PolarHBondContact O-N 3.06Å; T2748-M2750 PolarHBondContact O-N 3.16Å
2749	P	29.9	Very low	29.7	Very low	104 Å²	104	126.5 Å²	126.5	68%	0.675	69%	0.691	S	S	*	*			trans	-64.8	108.3	179.2	25.5	-33.4	0	0	0	109.8	F2751	P2749-F2751 HydrophobicContact CB-CE2 4.33Å; P2749-F2751 HydrophobicContact CG-CE2 4.28Å; P2749-F2751 PolarHBondContact O-N 3.33Å; P2749-F2751 VanDerWaalsContact O-N 3.09Å
2750	M	28.6	Very low	29.8	Very low	119 Å²	119	120.5 Å²	120.5	59%	0.586	67%	0.667	S	S	*	*			trans	-77.8	95.3	176.8	-172.8	-179.7	-65.7	0	0	109	T2748 I2752	T2748-M2750 PolarHBondContact O-N 3.16Å; M2750-I2752 PolarHBondContact O-N 3.39Å
2751	F	31.6	Very low	29.9	Very low	187 Å²	187	125.1 Å²	125.1	82%	0.82	67%	0.67	S	S	*	*			trans	-64.8	98.6	169.5	-74.8	-88.7	0	0	0	109.7	P2749 P2753	P2749-F2751 HydrophobicContact CB-CE2 4.33Å; P2749-F2751 HydrophobicContact CG-CE2 4.28Å; P2749-F2751 PolarHBondContact O-N 3.33Å; P2749-F2751 VanDerWaalsContact O-N 3.09Å; F2751-P2753 WeakPolarHBondContact O-CD 3.48Å
2752	I	34.3	Very low	30	Very low	80 Å²	80	123 Å²	123	41%	0.41	66%	0.658	S	S	.	*			trans	-71.6	124	171.3	-59.2	177.7	0	0	0	107.7	M2750 F2755	M2750-I2752 PolarHBondContact O-N 3.39Å; I2752-F2755 HydrophobicContact CG2-CD2 4.11Å; I2752-F2755 HydrophobicContact CG2-CE2 4.46Å
2753	P	29.2	Very low	30.3	Very low	85 Å²	85	126.4 Å²	126.4	55%	0.552	67%	0.665	S	S	*	*			trans	-57.1	150.4	171.8	-24.6	34.1	0	0	0	111.9	F2751 F2755	F2751-P2753 WeakPolarHBondContact O-CD 3.48Å; P2753-F2755 VanDerWaalsContact C-N 3.27Å; P2753-F2755 HydrophobicContact CB-CD2 4.31Å; P2753-F2755 HydrophobicContact CB-CE2 3.97Å; P2753-F2755 HydrophobicContact CB-CZ 4.3Å; P2753-F2755 HydrophobicContact CG-CE2 4.04Å; P2753-F2755 HydrophobicContact CG-CZ 4.35Å; P2753-F2755 WeakPolarHBondContact O-CD2 3.41Å; P2753-F2755 PolarHBondContact O-N 3.03Å
2754	N	34.4	Very low	30.4	Very low	163 Å²	163	126.4 Å²	126.4	87%	0.872	66%	0.656	S	S	*	*			trans	-67.5	81.4	177.1	-78.3	-15.7	0	0	0	111.8	F2756	N2754-F2756 VanDerWaalsContact C-N 3.25Å; N2754-F2756 PolarHBondContact O-N 3.08Å
2755	F	35.4	Very low	30.7	Very low	161 Å²	161	125.9 Å²	125.9	71%	0.706	65%	0.653	S	S	*	*			trans	-75.9	-11.3	174	-73.2	-69.8	0	0	0	113.4	I2752 P2753	I2752-F2755 HydrophobicContact CG2-CD2 4.11Å; I2752-F2755 HydrophobicContact CG2-CE2 4.46Å; P2753-F2755 VanDerWaalsContact C-N 3.27Å; P2753-F2755 HydrophobicContact CB-CD2 4.31Å; P2753-F2755 HydrophobicContact CB-CE2 3.97Å; P2753-F2755 HydrophobicContact CB-CZ 4.3Å; P2753-F2755 HydrophobicContact CG-CE2 4.04Å; P2753-F2755 HydrophobicContact CG-CZ 4.35Å; P2753-F2755 WeakPolarHBondContact O-CD2 3.41Å; P2753-F2755 PolarHBondContact O-N 3.03Å
2756	F	34.4	Very low	30.9	Very low	102 Å²	102	128.6 Å²	128.6	45%	0.447	65%	0.654	S	S	.	*	S	Bend	trans	-105.7	132.6	177.4	-58	-74.5	0	0	0	110.3	N2754 S2758	N2754-F2756 VanDerWaalsContact C-N 3.25Å; N2754-F2756 PolarHBondContact O-N 3.08Å; F2756-S2758 PolarHBondContact O-N 3.43Å
2757	P	27.7	Very low	31.1	Very low	111 Å²	111	124.6 Å²	124.6	72%	0.721	65%	0.647	S	S	*	*			trans	-67.2	133.9	176.4	28	-33.8	0	0	0	110.5
2758	S	29.4	Very low	31.1	Very low	92 Å²	92	121.7 Å²	121.7	64%	0.643	64%	0.64	S	S	*	*			trans	-63.3	137.2	170.7	51	0	0	0	0	110.5	F2756 S2760	F2756-S2758 PolarHBondContact O-N 3.43Å; S2758-S2760 PolarHBondContact O-N 3.5Å; S2758-S2760 PolarHBondContact OG-OG 3.47Å
2759	T	33.9	Very low	31.1	Very low	93 Å²	93	126.4 Å²	126.4	57%	0.571	65%	0.645	S	S	*	*	S	Bend	trans	-78.2	41.2	174.1	55	0	0	0	0	111.8
2760	S	28.3	Very low	31.3	Very low	39 Å²	39	127.9 Å²	127.9	27%	0.273	65%	0.652	S	S	.	*			trans	-85.8	-6.9	-168	48.5	0	0	0	0	114.9	S2758 I2762 E2763	S2758-S2760 PolarHBondContact O-N 3.5Å; S2758-S2760 PolarHBondContact OG-OG 3.47Å; S2760-I2762 PolarHBondContact O-N 3.4Å; S2760-E2763 PolarHBondContact O-N 2.91Å; S2760-E2763 VanDerWaalsContact O-N 3.13Å
2761	R	30.3	Very low	31.3	Very low	212 Å²	212	127.6 Å²	127.6	80%	0.8	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	10.3	-173.6	-96.6	-171.8	174.1	-165.9	-2.3	116.9
2762	I	29.4	Very low	31.3	Very low	129 Å²	129	126.1 Å²	126.1	66%	0.662	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-27	172.3	-64.6	178.4	0	0	0	111.3	S2760 F2766	S2760-I2762 PolarHBondContact O-N 3.4Å; I2762-F2766 VanDerWaalsContact O-CD2 3.28Å; I2762-F2766 WeakPolarHBondContact O-CD2 3.41Å; I2762-F2766 WeakPolarHBondContact O-CE2 3.47Å
2763	E	32.3	Very low	31.2	Very low	152 Å²	152	128.7 Å²	128.7	71%	0.71	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-37.7	-176	-70.2	165.5	-171.4	0	0	112.2	S2760 L2765 F2766	S2760-E2763 PolarHBondContact O-N 2.91Å; S2760-E2763 VanDerWaalsContact O-N 3.13Å; E2763-L2765 PolarHBondContact O-N 3.35Å; E2763-F2766 PolarHBondContact O-N 3.3Å
2764	E	33.7	Very low	31.2	Very low	132 Å²	132	132.6 Å²	132.6	62%	0.617	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-17.4	177.6	-67.2	-177.3	116	0	0	114.2	F2766	E2764-F2766 VanDerWaalsContact C-N 3.33Å; E2764-F2766 PolarHBondContact O-N 3.11Å
2765	L	31	Very low	31	Very low	129 Å²	129	132.3 Å²	132.3	68%	0.675	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-9.5	-179.6	-78.3	170	0	0	0	114.4	E2763	E2763-L2765 PolarHBondContact O-N 3.35Å
2766	F	30.9	Very low	31	Very low	140 Å²	140	131.7 Å²	131.7	61%	0.614	69%	0.686	S	S	*	*	S	Bend	trans	-113.7	-2.6	-173.9	-66.4	-78.6	0	0	0	114.8	I2762 E2763 E2764	I2762-F2766 VanDerWaalsContact O-CD2 3.28Å; I2762-F2766 WeakPolarHBondContact O-CD2 3.41Å; I2762-F2766 WeakPolarHBondContact O-CE2 3.47Å; E2763-F2766 PolarHBondContact O-N 3.3Å; E2764-F2766 VanDerWaalsContact C-N 3.33Å; E2764-F2766 PolarHBondContact O-N 3.11Å
2767	T	30.5	Very low	30.9	Very low	116 Å²	116	131 Å²	131	71%	0.712	69%	0.693	S	S	*	*			trans	-116.3	14.7	-173.6	58.8	0	0	0	0	114.7	R2769	T2767-R2769 PolarHBondContact O-N 3.45Å
2768	S	30.6	Very low	31.2	Very low	97 Å²	97	132.4 Å²	132.4	68%	0.678	70%	0.695	S	S	*	*			trans	-79.9	79.7	179.5	64.7	0	0	0	0	112.9	T2770	S2768-T2770 PolarHBondContact O-N 3.29Å
2769	R	28	Very low	31.2	Very low	211 Å²	211	133.4 Å²	133.4	80%	0.796	70%	0.702	S	S	*	*			trans	-34.9	118.3	169.8	179.7	-172.6	-170.4	171.1	3.8	114.8	T2767	T2767-R2769 PolarHBondContact O-N 3.45Å
2770	T	33.3	Very low	31.2	Very low	135 Å²	135	137.2 Å²	137.2	83%	0.828	72%	0.715	S	S	*	*			trans	-112.9	96.4	166.1	55.6	0	0	0	0	110.8	S2768	S2768-T2770 PolarHBondContact O-N 3.29Å
2771	N	28.8	Very low	31.3	Very low	114 Å²	114	142.3 Å²	142.3	61%	0.61	74%	0.739	S	S	*	*			trans	-86.6	137.4	158	-74.2	23.6	0	0	0	108
2772	D	31	Very low	31.5	Very low	155 Å²	155	138 Å²	138	83%	0.829	74%	0.742	S	S	*	*			trans	171.2	169.1	131.3	-87.9	-11.4	0	0	0	111.1
2773	C	32.8	Very low	31.6	Very low	134 Å²	134	139.3 Å²	139.3	91%	0.905	75%	0.75	S	S	*	*			trans	72.5	93.8	176.7	-64.5	0	0	0	0	117.2
2774	Q	28.4	Very low	31.5	Very low	168 Å²	168	138.2 Å²	138.2	79%	0.785	75%	0.754	S	S	*	*			trans	-71.8	-179.9	168.6	-166.2	179.6	-83.6	0	0	112.8
2775	E	32	Very low	31.3	Very low	156 Å²	156	138.4 Å²	138.4	73%	0.729	76%	0.759	S	S	*	*			trans	85.1	132.6	165.3	-57.7	172.4	-167.8	0	0	116.3
2776	D	35.3	Very low	31.1	Very low	149 Å²	149	140 Å²	140	80%	0.797	77%	0.768	S	S	*	*			cis	-154.6	166.7	-8.9	-126.6	-0.8	0	0	0	113
2777	S	32.1	Very low	30.9	Very low	86 Å²	86	138.4 Å²	138.4	60%	0.601	77%	0.774	S	S	*	*			trans	-79.7	154	-173.4	60.3	0	0	0	0	115.8
2778	N	33	Very low	30.8	Very low	142 Å²	142	139 Å²	139	76%	0.759	77%	0.772	S	S	*	*				170.4	124.5	116.1	-91.5	-54.7	0	0	0	116.1
2779	S	30.7	Very low	30.8	Very low	113 Å²	113	140 Å²	140	79%	0.79	77%	0.77	S	S	*	*			trans	62.9	160.5	147.7	82.2	0	0	0	0	119.3
2780	M	32.7	Very low	31	Very low	173 Å²	173	137.8 Å²	137.8	85%	0.852	77%	0.774	S	S	*	*			cis	-148.9	164.9	-8.1	-146.6	176.4	179	0	0	110.6
2781	D	29.9	Very low	30.9	Very low	145 Å²	145	139.4 Å²	139.4	78%	0.775	77%	0.77	S	S	*	*			trans	-69.8	150.3	-176.8	-47.8	-96.2	0	0	0	115.4
2782	S	35.9	Very low	31.5	Very low	121 Å²	121	141.3 Å²	141.3	85%	0.846	78%	0.78	S	S	*	*			trans	-169.4	139.2	134.2	30.3	0	0	0	0	112
2783	N	30.1	Very low	32.1	Very low	157 Å²	157	140.3 Å²	140.3	84%	0.84	77%	0.773	S	S	*	*			trans	-82	139.7	179.4	-65.5	-67.2	0	0	0	111.7
2784	T	30.5	Very low	32.9	Very low	129 Å²	129	138.2 Å²	138.2	79%	0.791	75%	0.753	S	S	*	*			trans	-168.7	130.3	136.1	7.5	0	0	0	0	114.3
2785	N	29.1	Very low	34.1	Very low	136 Å²	136	134.4 Å²	134.4	73%	0.727	74%	0.743	S	S	*	*			trans	40.4	112	142.2	-62.3	-11.5	0	0	0	122
2786	L	26.8	Very low	34.7	Very low	163 Å²	163	131.3 Å²	131.3	85%	0.853	73%	0.731	S	S	*	*			trans	63	130.8	132.8	-75.8	125.2	0	0	0	121.5
2787	S	27.4	Very low	35.3	Very low	107 Å²	107	131.8 Å²	131.8	75%	0.748	72%	0.722	S	S	*	*			trans	80.1	154.3	158	-147.4	0	0	0	0	118.5
2788	N	28.9	Very low	36.5	Very low	127 Å²	127	131.9 Å²	131.9	68%	0.679	72%	0.715	S	S	*	*			trans	82	102.8	160.1	-62.4	-0.5	0	0	0	120.5
2789	N	29.6	Very low	37.7	Very low	119 Å²	119	133.1 Å²	133.1	64%	0.636	71%	0.709	S	S	*	*				90	95.7	122.4	-58.1	-12.9	0	0	0	121.3	K2791	N2789-K2791 PolarHBondContact O-N 3.4Å
2790	N	32	Very low	38.8	Very low	164 Å²	164	131.6 Å²	131.6	88%	0.877	69%	0.692	S	S	*	*				30.5	80.4	110.6	-60.6	-3.2	0	0	0	117.5
2791	K	32.8	Very low	40	Very low	170 Å²	170	126.8 Å²	126.8	74%	0.739	67%	0.669	S	S	*	*			trans	-142	-0	170.4	-75.7	-160.2	174.1	-174.5	0	118.5	N2789	N2789-K2791 PolarHBondContact O-N 3.4Å
2792	N	40	Very low	41.5	Very low	153 Å²	153	124.8 Å²	124.8	82%	0.818	66%	0.659	S	S	*	*	S	Bend	trans	-100.1	7.3	-169.8	-71.8	3.1	0	0	0	116.3
2793	I	43.9	Very low	42.3	Very low	135 Å²	135	127.2 Å²	127.2	69%	0.692	65%	0.649	S	S	*	*	S	Bend	trans	-87.1	-29.3	-176.8	-70.3	171.8	0	0	0	112.8	R2797	I2793-R2797 PolarHBondContact O-N 3.44Å
2794	D	50.9	Low	43.7	Very low	90 Å²	90	124.5 Å²	124.5	48%	0.481	63%	0.634	S	S	.	*	H	α-helix	trans	-65.3	-37.1	-171.3	-60.1	-48.2	0	0	0	116	L2796 R2797 N2798	D2794-L2796 PolarHBondContact O-N 2.78Å; D2794-R2797 PolarHBondContact O-N 3.42Å; D2794-N2798 WeakPolarHBondContact O-CB 3.33Å; D2794-N2798 VanDerWaalsContact O-CG 3.3Å; D2794-N2798 PolarHBondContact O-N 3.39Å; D2794-N2798 PolarHBondContact O-ND2 2.69Å
2795	P	53	Low	45.2	Very low	88 Å²	88	121.9 Å²	121.9	57%	0.571	62%	0.622	S	S	*	*	H	α-helix	trans	-61.5	-41.1	-176.1	-24.9	34.8	0	0	0	113.6	R2799	P2795-R2799 WeakPolarHBondContact O-CB 3.08Å; P2795-R2799 PolarHBondContact O-N 2.77Å
2796	L	43.9	Very low	46.5	Very low	90 Å²	90	121.6 Å²	121.6	47%	0.471	62%	0.616	S	S	.	*	H	α-helix	trans	-81.3	-33.3	-178.5	-71.4	169.1	0	0	0	112	D2794 R2799 L2800 F2859	D2794-L2796 PolarHBondContact O-N 2.78Å; L2796-R2799 PolarHBondContact O-N 3.48Å; L2796-L2800 PolarHBondContact O-N 2.94Å; L2796-F2859 HydrophobicContact CD1-CE2 4.18Å; L2796-F2859 HydrophobicContact CD1-CZ 3.62Å
2797	R	49	Very low	47.7	Very low	160 Å²	160	116.3 Å²	116.3	60%	0.604	60%	0.595	S	S	*	*	H	α-helix	trans	-62.6	-43.2	170.4	-166.4	178	-172.4	-174.8	3.1	111.4	I2793 D2794 L2800 N2801	I2793-R2797 PolarHBondContact O-N 3.44Å; D2794-R2797 PolarHBondContact O-N 3.42Å; R2797-L2800 PolarHBondContact O-N 2.89Å; R2797-N2801 WeakPolarHBondContact O-CB 3.22Å; R2797-N2801 PolarHBondContact O-N 2.95Å
2798	N	56.7	Low	49.1	Very low	87 Å²	87	114.7 Å²	114.7	47%	0.465	58%	0.581	S	S	.	*	H	α-helix	trans	-65.9	-38.3	173.5	-72.5	-21.2	0	0	0	112.1	D2794 N2801 N2802	D2794-N2798 WeakPolarHBondContact O-CB 3.33Å; D2794-N2798 VanDerWaalsContact O-CG 3.3Å; D2794-N2798 PolarHBondContact O-N 3.39Å; D2794-N2798 PolarHBondContact O-ND2 2.69Å; N2798-N2801 PolarHBondContact O-N 3.21Å; N2798-N2802 VanDerWaalsContact O-CB 3.28Å; N2798-N2802 WeakPolarHBondContact O-CB 3.1Å; N2798-N2802 PolarHBondContact O-N 2.71Å; N2798-N2802 PolarHBondContact O-OD1 2.77Å
2799	R	57.4	Low	50.4	Low	169 Å²	169	113.4 Å²	113.4	64%	0.638	57%	0.574	S	S	*	*	H	α-helix	trans	-64.3	-39.5	174.2	-173.4	174.7	175.2	-178.1	-3.4	112.6	P2795 L2796 R2803	P2795-R2799 WeakPolarHBondContact O-CB 3.08Å; P2795-R2799 PolarHBondContact O-N 2.77Å; L2796-R2799 PolarHBondContact O-N 3.48Å; R2799-R2803 WeakPolarHBondContact O-CG 3.41Å; R2799-R2803 PolarHBondContact O-N 3Å; R2799-R2803 VanDerWaalsContact O-N 3.14Å
2800	L	54.4	Low	51.6	Low	80 Å²	80	115.8 Å²	115.8	42%	0.419	58%	0.575	S	S	.	*	H	α-helix	trans	-66.7	-49	174.3	-169.1	94	0	0	0	111	L2796 R2797 N2802 R2803 L2804 F2855	L2796-L2800 PolarHBondContact O-N 2.94Å; R2797-L2800 PolarHBondContact O-N 2.89Å; L2800-N2802 VanDerWaalsContact C-N 3.3Å; L2800-N2802 PolarHBondContact O-N 2.78Å; L2800-R2803 PolarHBondContact O-N 2.98Å; L2800-R2803 VanDerWaalsContact O-N 3.16Å; L2800-L2804 HydrophobicContact CD2-CD1 4.26Å; L2800-L2804 HydrophobicContact CG-CD1 4.38Å; L2800-L2804 PolarHBondContact O-N 3.38Å; L2800-F2855 HydrophobicContact CD1-CE2 4.12Å; L2800-F2855 HydrophobicContact CD1-CZ 4.01Å
2801	N	57.1	Low	52.3	Low	72 Å²	72	111.9 Å²	111.9	39%	0.385	56%	0.557	S	S	.	*	H	α-helix	trans	-58.1	-42.2	177.2	-72.2	-9.7	0	0	0	111.4	R2797 N2798 L2804 S2805	R2797-N2801 WeakPolarHBondContact O-CB 3.22Å; R2797-N2801 PolarHBondContact O-N 2.95Å; N2798-N2801 PolarHBondContact O-N 3.21Å; N2801-L2804 PolarHBondContact O-N 2.96Å; N2801-S2805 WeakPolarHBondContact O-CB 3.26Å; N2801-S2805 PolarHBondContact O-N 3.37Å; N2801-S2805 PolarHBondContact O-OG 3.12Å; N2801-S2805 VanDerWaalsContact O-OG 3.06Å
2802	N	63	Low	52.9	Low	103 Å²	103	108.3 Å²	108.3	55%	0.551	54%	0.544	S	S	*	.	H	α-helix	trans	-63.3	-42.4	176.3	-74.4	3.1	0	0	0	111.8	N2798 L2800 S2805 E2806	N2798-N2802 VanDerWaalsContact O-CB 3.28Å; N2798-N2802 WeakPolarHBondContact O-CB 3.1Å; N2798-N2802 PolarHBondContact O-N 2.71Å; N2798-N2802 PolarHBondContact O-OD1 2.77Å; L2800-N2802 VanDerWaalsContact C-N 3.3Å; L2800-N2802 PolarHBondContact O-N 2.78Å; N2802-S2805 CarbonylContact O-C 3.58Å; N2802-S2805 PolarHBondContact O-N 2.75Å; N2802-E2806 WeakPolarHBondContact O-CB 3.44Å; N2802-E2806 WeakPolarHBondContact O-CG 3.48Å; N2802-E2806 PolarHBondContact O-N 3.31Å
2803	R	52.8	Low	53.3	Low	172 Å²	172	105.2 Å²	105.2	65%	0.649	53%	0.528	S	S	*	.	H	α-helix	trans	-70.6	-30.5	176.8	-68.2	-168.2	80.3	-167.5	5	113.4	R2799 L2800 A2807	R2799-R2803 WeakPolarHBondContact O-CG 3.41Å; R2799-R2803 PolarHBondContact O-N 3Å; R2799-R2803 VanDerWaalsContact O-N 3.14Å; L2800-R2803 PolarHBondContact O-N 2.98Å; L2800-R2803 VanDerWaalsContact O-N 3.16Å; R2803-A2807 WeakPolarHBondContact O-CB 3.38Å; R2803-A2807 PolarHBondContact O-N 2.92Å
2804	L	57.8	Low	53.6	Low	100 Å²	100	101.4 Å²	101.4	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-66.9	-44.3	169.2	-92.8	161.4	0	0	0	111.1	L2800 N2801 A2807 V2808	L2800-L2804 HydrophobicContact CD2-CD1 4.26Å; L2800-L2804 HydrophobicContact CG-CD1 4.38Å; L2800-L2804 PolarHBondContact O-N 3.38Å; N2801-L2804 PolarHBondContact O-N 2.96Å; L2804-A2807 PolarHBondContact O-N 2.85Å; L2804-V2808 WeakPolarHBondContact O-CB 3.32Å; L2804-V2808 WeakPolarHBondContact O-CG2 3.09Å; L2804-V2808 PolarHBondContact O-N 3.16Å
2805	S	62.6	Low	53.4	Low	75 Å²	75	100.1 Å²	100.1	52%	0.524	51%	0.506	S	S	.	.	H	α-helix	trans	-62.4	-41.3	173.3	-65.2	0	0	0	0	112.1	N2801 N2802 L2809	N2801-S2805 WeakPolarHBondContact O-CB 3.26Å; N2801-S2805 PolarHBondContact O-N 3.37Å; N2801-S2805 PolarHBondContact O-OG 3.12Å; N2801-S2805 VanDerWaalsContact O-OG 3.06Å; N2802-S2805 CarbonylContact O-C 3.58Å; N2802-S2805 PolarHBondContact O-N 2.75Å; S2805-L2809 WeakPolarHBondContact O-CB 3.38Å; S2805-L2809 PolarHBondContact O-N 3.11Å
2806	E	57.4	Low	52.7	Low	129 Å²	129	100.5 Å²	100.5	60%	0.603	50%	0.502	S	S	*	.	H	α-helix	trans	-62.8	-43.4	173.2	-76.6	177	147.6	0	0	111.7	N2802 L2809 Y2810	N2802-E2806 WeakPolarHBondContact O-CB 3.44Å; N2802-E2806 WeakPolarHBondContact O-CG 3.48Å; N2802-E2806 PolarHBondContact O-N 3.31Å; E2806-L2809 PolarHBondContact O-N 3.47Å; E2806-Y2810 WeakPolarHBondContact O-CB 3.29Å; E2806-Y2810 PolarHBondContact O-N 3.4Å
2807	A	51	Low	52.7	Low	52 Å²	52	101.2 Å²	101.2	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-45.7	177.5	0	0	0	0	0	111.7	R2803 L2804 Y2810 T2811	R2803-A2807 WeakPolarHBondContact O-CB 3.38Å; R2803-A2807 PolarHBondContact O-N 2.92Å; L2804-A2807 PolarHBondContact O-N 2.85Å; A2807-Y2810 PolarHBondContact O-N 3.03Å; A2807-T2811 PolarHBondContact O-N 3.11Å; A2807-T2811 PolarHBondContact O-OG1 3.1Å; A2807-T2811 VanDerWaalsContact O-OG1 3.1Å
2808	V	55.9	Low	52.3	Low	73 Å²	73	100.5 Å²	100.5	44%	0.442	52%	0.518	S	S	.	.	H	α-helix	trans	-63.6	-44	175.3	170.4	0	0	0	0	111	L2804 Y2810 T2811 M2812	L2804-V2808 WeakPolarHBondContact O-CB 3.32Å; L2804-V2808 WeakPolarHBondContact O-CG2 3.09Å; L2804-V2808 PolarHBondContact O-N 3.16Å; V2808-Y2810 VanDerWaalsContact C-N 3.34Å; V2808-Y2810 PolarHBondContact O-N 3.3Å; V2808-T2811 PolarHBondContact O-N 3.02Å; V2808-M2812 HydrophobicContact CG1-CE 3.79Å; V2808-M2812 HydrophobicContact CG1-CG 4.35Å; V2808-M2812 HydrophobicContact CG1-SD 3.95Å; V2808-M2812 VanDerWaalsContact O-CB 3.32Å; V2808-M2812 WeakPolarHBondContact O-CB 3.4Å; V2808-M2812 VanDerWaalsContact O-CG 3.27Å; V2808-M2812 WeakPolarHBondContact O-CG 3.4Å; V2808-M2812 PolarHBondContact O-N 3.09Å
2809	L	56.5	Low	51.2	Low	101 Å²	101	100 Å²	100	53%	0.529	52%	0.521	S	S	.	.	H	α-helix	trans	-66.5	-36	177.8	-163.2	80.5	0	0	0	111.7	S2805 E2806 N2813	S2805-L2809 WeakPolarHBondContact O-CB 3.38Å; S2805-L2809 PolarHBondContact O-N 3.11Å; E2806-L2809 PolarHBondContact O-N 3.47Å; L2809-N2813 WeakPolarHBondContact O-CB 3.44Å; L2809-N2813 PolarHBondContact O-N 2.93Å; L2809-N2813 PolarHBondContact O-ND2 3.28Å; L2809-N2813 VanDerWaalsContact O-ND2 3.16Å
2810	Y	55.6	Low	50.1	Low	169 Å²	169	98.9 Å²	98.9	66%	0.663	53%	0.528	S	S	*	.	H	α-helix	trans	-65.5	-51	173.3	-171.6	-92.7	0	0	0	110.6	E2806 A2807 V2808 M2812 N2813 T2814	E2806-Y2810 WeakPolarHBondContact O-CB 3.29Å; E2806-Y2810 PolarHBondContact O-N 3.4Å; A2807-Y2810 PolarHBondContact O-N 3.03Å; V2808-Y2810 VanDerWaalsContact C-N 3.34Å; V2808-Y2810 PolarHBondContact O-N 3.3Å; Y2810-M2812 PolarHBondContact O-N 3.33Å; Y2810-N2813 PolarHBondContact O-N 2.84Å; Y2810-T2814 WeakPolarHBondContact O-CB 3.13Å; Y2810-T2814 PolarHBondContact O-N 2.95Å; Y2810-T2814 PolarHBondContact O-OG1 2.73Å
2811	T	46.8	Very low	49	Very low	82 Å²	82	100.8 Å²	100.8	50%	0.503	55%	0.545	S	S	.	.	H	α-helix	trans	-57.7	-47.2	175.4	-59.1	0	0	0	0	111.5	A2807 V2808 N2813 T2814 T2815	A2807-T2811 PolarHBondContact O-N 3.11Å; A2807-T2811 PolarHBondContact O-OG1 3.1Å; A2807-T2811 VanDerWaalsContact O-OG1 3.1Å; V2808-T2811 PolarHBondContact O-N 3.02Å; T2811-N2813 PolarHBondContact O-N 3.39Å; T2811-T2814 PolarHBondContact O-N 3.3Å; T2811-T2815 WeakPolarHBondContact O-CG2 3.46Å; T2811-T2815 PolarHBondContact O-N 3.5Å; T2811-T2815 PolarHBondContact O-OG1 3.49Å; T2811-T2815 VanDerWaalsContact O-OG1 3.07Å
2812	M	44.3	Very low	47.8	Very low	95 Å²	95	105.1 Å²	105.1	47%	0.468	56%	0.563	S	S	.	*	H	α-helix	trans	-57.5	-49.9	175.1	-76.8	179.2	173	0	0	111.5	V2808 Y2810 T2814 T2815 M2816	V2808-M2812 HydrophobicContact CG1-CE 3.79Å; V2808-M2812 HydrophobicContact CG1-CG 4.35Å; V2808-M2812 HydrophobicContact CG1-SD 3.95Å; V2808-M2812 VanDerWaalsContact O-CB 3.32Å; V2808-M2812 WeakPolarHBondContact O-CB 3.4Å; V2808-M2812 VanDerWaalsContact O-CG 3.27Å; V2808-M2812 WeakPolarHBondContact O-CG 3.4Å; V2808-M2812 PolarHBondContact O-N 3.09Å; Y2810-M2812 PolarHBondContact O-N 3.33Å; M2812-T2814 PolarHBondContact O-N 2.68Å; M2812-T2815 WeakPolarHBondContact CA-OG1 3.43Å; M2812-T2815 PolarHBondContact O-N 3.06Å; M2812-T2815 PolarHBondContact O-OG1 2.98Å; M2812-M2816 WeakPolarHBondContact O-CB 3.49Å; M2812-M2816 WeakPolarHBondContact O-CG 3.49Å; M2812-M2816 PolarHBondContact O-N 3.18Å
2813	N	50.3	Low	46.6	Very low	88 Å²	88	105 Å²	105	47%	0.471	57%	0.566	S	S	.	*	H	α-helix	trans	-61.9	-44.8	179.2	-74.4	-25.3	0	0	0	111.8	L2809 Y2810 T2811 T2815 M2816 T2817	L2809-N2813 WeakPolarHBondContact O-CB 3.44Å; L2809-N2813 PolarHBondContact O-N 2.93Å; L2809-N2813 PolarHBondContact O-ND2 3.28Å; L2809-N2813 VanDerWaalsContact O-ND2 3.16Å; Y2810-N2813 PolarHBondContact O-N 2.84Å; T2811-N2813 PolarHBondContact O-N 3.39Å; N2813-T2815 VanDerWaalsContact C-N 3.32Å; N2813-T2815 PolarHBondContact O-N 3.41Å; N2813-M2816 CarbonylContact O-C 3.55Å; N2813-M2816 PolarHBondContact O-N 2.89Å; N2813-T2817 WeakPolarHBondContact O-CG2 3.49Å; N2813-T2817 PolarHBondContact O-N 3.3Å; N2813-T2817 PolarHBondContact O-OG1 3.09Å
2814	T	48.9	Very low	45.9	Very low	55 Å²	55	104 Å²	104	34%	0.337	57%	0.573	S	S	.	*	H	α-helix	trans	-62.1	-37.6	175.8	-55.3	0	0	0	0	111.9	Y2810 T2811 M2812 M2816 T2817	Y2810-T2814 WeakPolarHBondContact O-CB 3.13Å; Y2810-T2814 PolarHBondContact O-N 2.95Å; Y2810-T2814 PolarHBondContact O-OG1 2.73Å; T2811-T2814 PolarHBondContact O-N 3.3Å; M2812-T2814 PolarHBondContact O-N 2.68Å; T2814-M2816 VanDerWaalsContact C-N 3.26Å; T2814-M2816 PolarHBondContact O-N 3.28Å; T2814-T2817 PolarHBondContact O-OG1 2.66Å
2815	T	45.9	Very low	45.2	Very low	63 Å²	63	105.6 Å²	105.6	39%	0.387	58%	0.583	S	S	.	*	H	α-helix	trans	-72.2	-16.8	172.7	54.9	0	0	0	0	114.1	T2811 M2812 N2813	T2811-T2815 WeakPolarHBondContact O-CG2 3.46Å; T2811-T2815 PolarHBondContact O-N 3.5Å; T2811-T2815 PolarHBondContact O-OG1 3.49Å; T2811-T2815 VanDerWaalsContact O-OG1 3.07Å; M2812-T2815 WeakPolarHBondContact CA-OG1 3.43Å; M2812-T2815 PolarHBondContact O-N 3.06Å; M2812-T2815 PolarHBondContact O-OG1 2.98Å; N2813-T2815 VanDerWaalsContact C-N 3.32Å; N2813-T2815 PolarHBondContact O-N 3.41Å
2816	M	40.1	Very low	44.1	Very low	96 Å²	96	106.6 Å²	106.6	47%	0.473	58%	0.582	S	S	.	*	H	α-helix	trans	-99	-18.1	-179.2	-68.7	-79.8	173.7	0	0	113.3	M2812 N2813 T2814	M2812-M2816 WeakPolarHBondContact O-CB 3.49Å; M2812-M2816 WeakPolarHBondContact O-CG 3.49Å; M2812-M2816 PolarHBondContact O-N 3.18Å; N2813-M2816 CarbonylContact O-C 3.55Å; N2813-M2816 PolarHBondContact O-N 2.89Å; T2814-M2816 VanDerWaalsContact C-N 3.26Å; T2814-M2816 PolarHBondContact O-N 3.28Å
2817	T	43.3	Very low	43.2	Very low	104 Å²	104	102.2 Å²	102.2	64%	0.638	57%	0.568	S	S	*	*	H	α-helix	trans	-80.1	-22.2	179.4	45.8	0	0	0	0	114.4	N2813 T2814	N2813-T2817 WeakPolarHBondContact O-CG2 3.49Å; N2813-T2817 PolarHBondContact O-N 3.3Å; N2813-T2817 PolarHBondContact O-OG1 3.09Å; T2814-T2817 PolarHBondContact O-OG1 2.66Å
2818	D	39.5	Very low	42.7	Very low	146 Å²	146	105.1 Å²	105.1	78%	0.781	58%	0.576	S	S	*	*	S	Bend	trans	-95.3	7.4	-171.8	-72.8	1.6	0	0	0	113.9
2819	S	33.7	Very low	42.1	Very low	75 Å²	75	107 Å²	107	52%	0.524	58%	0.583	S	S	.	*	S	Bend	trans	-125.9	129.3	179.7	65	0	0	0	0	113.7
2820	N	34.5	Very low	41.6	Very low	146 Å²	146	106.1 Å²	106.1	78%	0.781	58%	0.578	S	S	*	*			trans	-63.5	132.7	-178.7	-158.9	20.3	0	0	0	111.5	Q2822	N2820-Q2822 PolarHBondContact O-N 2.97Å
2821	P	31.4	Very low	41.1	Very low	121 Å²	121	101 Å²	101	79%	0.786	56%	0.562	S	S	*	*	S	Bend	trans	-79	82.1	-166.4	31	-37.1	0	0	0	113.6
2822	Q	33.2	Very low	41.1	Very low	162 Å²	162	101.8 Å²	101.8	76%	0.757	56%	0.563	S	S	*	*			trans	-138.1	142.5	167.6	-68.9	-167.2	-22.8	0	0	112.2	N2820	N2820-Q2822 PolarHBondContact O-N 2.97Å
2823	T	37.3	Very low	41.3	Very low	101 Å²	101	101.8 Å²	101.8	62%	0.62	57%	0.565	S	S	*	*			trans	69.8	96	177.4	69.2	0	0	0	0	116.8	N2825	T2823-N2825 PolarHBondContact O-N 2.9Å
2824	N	38.8	Very low	41.2	Very low	150 Å²	150	100.9 Å²	100.9	80%	0.802	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	0.6	-175.3	-64.6	-2.6	0	0	0	115.8
2825	N	42.5	Very low	41	Very low	135 Å²	135	102.7 Å²	102.7	72%	0.722	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-23.9	-173.3	-66.6	1.9	0	0	0	113.1	T2823	T2823-N2825 PolarHBondContact O-N 2.9Å
2826	N	39.9	Very low	41.1	Very low	95 Å²	95	102.5 Å²	102.5	51%	0.508	57%	0.571	S	S	.	*	S	Bend	trans	-79.5	-19.4	-175	-66.4	-0	0	0	0	113.3	N2828 L2829 I2830	N2826-N2828 VanDerWaalsContact C-N 3.3Å; N2826-N2828 PolarHBondContact O-N 2.68Å; N2826-L2829 WeakPolarHBondContact O-CB 3.43Å; N2826-L2829 PolarHBondContact O-N 3.26Å; N2826-L2829 VanDerWaalsContact O-N 3.1Å; N2826-I2830 WeakPolarHBondContact O-CG1 3.39Å; N2826-I2830 PolarHBondContact O-N 3.4Å
2827	A	38	Very low	41.5	Very low	37 Å²	37	100 Å²	100	31%	0.306	57%	0.566	S	S	.	*	H	α-helix	trans	-59.4	-38.9	-179.3	0	0	0	0	0	112.8	L2829 I2830 I2831	A2827-L2829 VanDerWaalsContact C-N 3.35Å; A2827-I2830 PolarHBondContact O-N 3.04Å; A2827-I2831 WeakPolarHBondContact O-CB 3.5Å; A2827-I2831 WeakPolarHBondContact O-CD1 3.29Å; A2827-I2831 VanDerWaalsContact O-CG1 3.25Å; A2827-I2831 WeakPolarHBondContact O-CG1 3.49Å; A2827-I2831 PolarHBondContact O-N 3.42Å
2828	N	39.3	Very low	41.4	Very low	113 Å²	113	100.6 Å²	100.6	60%	0.604	56%	0.56	S	S	*	*	H	α-helix	trans	-70.6	-28.8	177.5	-73.6	-18.2	0	0	0	113	N2826 N2832	N2826-N2828 VanDerWaalsContact C-N 3.3Å; N2826-N2828 PolarHBondContact O-N 2.68Å; N2828-N2832 WeakPolarHBondContact O-CB 3.32Å; N2828-N2832 PolarHBondContact O-N 3.35Å; N2828-N2832 VanDerWaalsContact O-N 3.09Å
2829	L	44.3	Very low	41.9	Very low	112 Å²	112	99.9 Å²	99.9	59%	0.586	55%	0.554	S	S	*	*	H	α-helix	trans	-66.4	-55.1	169.8	-111.1	75.4	0	0	0	109.5	N2826 A2827 I2831 N2832 D2833	N2826-L2829 WeakPolarHBondContact O-CB 3.43Å; N2826-L2829 PolarHBondContact O-N 3.26Å; N2826-L2829 VanDerWaalsContact O-N 3.1Å; A2827-L2829 VanDerWaalsContact C-N 3.35Å; L2829-I2831 VanDerWaalsContact C-N 3.26Å; L2829-I2831 PolarHBondContact O-N 2.98Å; L2829-N2832 CarbonylContact O-C 3.52Å; L2829-N2832 WeakPolarHBondContact O-CA 3.12Å; L2829-N2832 PolarHBondContact O-N 3.19Å; L2829-D2833 WeakPolarHBondContact O-CB 3.25Å; L2829-D2833 PolarHBondContact O-N 3.04Å
2830	I	46.1	Very low	42.6	Very low	83 Å²	83	101.2 Å²	101.2	43%	0.426	56%	0.56	S	S	.	*	H	α-helix	trans	-57.2	-38.6	-177.9	-62.6	164.9	0	0	0	111.8	N2826 A2827 T2834	N2826-I2830 WeakPolarHBondContact O-CG1 3.39Å; N2826-I2830 PolarHBondContact O-N 3.4Å; A2827-I2830 PolarHBondContact O-N 3.04Å; I2830-T2834 WeakPolarHBondContact O-CB 3.44Å; I2830-T2834 WeakPolarHBondContact O-CG2 3.47Å; I2830-T2834 PolarHBondContact O-N 2.91Å; I2830-T2834 PolarHBondContact O-OG1 3.24Å
2831	I	44.4	Very low	42.9	Very low	62 Å²	62	98.7 Å²	98.7	32%	0.318	55%	0.546	S	S	.	.	H	α-helix	trans	-67.7	-44.6	174.9	-69.5	165.5	0	0	0	111.6	A2827 L2829 T2834 L2835	A2827-I2831 WeakPolarHBondContact O-CB 3.5Å; A2827-I2831 WeakPolarHBondContact O-CD1 3.29Å; A2827-I2831 VanDerWaalsContact O-CG1 3.25Å; A2827-I2831 WeakPolarHBondContact O-CG1 3.49Å; A2827-I2831 PolarHBondContact O-N 3.42Å; L2829-I2831 VanDerWaalsContact C-N 3.26Å; L2829-I2831 PolarHBondContact O-N 2.98Å; I2831-T2834 PolarHBondContact O-OG1 3.44Å; I2831-L2835 HydrophobicContact CG2-CD1 3.96Å; I2831-L2835 VanDerWaalsContact O-CB 3.32Å; I2831-L2835 WeakPolarHBondContact O-CB 3.31Å; I2831-L2835 WeakPolarHBondContact O-CG 3.49Å; I2831-L2835 PolarHBondContact O-N 3.02Å
2832	N	46.3	Very low	43	Very low	99 Å²	99	95.1 Å²	95.1	53%	0.529	53%	0.532	S	S	.	.	H	α-helix	trans	-68.5	-34.3	176.3	-79.5	-10.9	0	0	0	112.6	N2828 L2829 S2836	N2828-N2832 WeakPolarHBondContact O-CB 3.32Å; N2828-N2832 PolarHBondContact O-N 3.35Å; N2828-N2832 VanDerWaalsContact O-N 3.09Å; L2829-N2832 CarbonylContact O-C 3.52Å; L2829-N2832 WeakPolarHBondContact O-CA 3.12Å; L2829-N2832 PolarHBondContact O-N 3.19Å; N2832-S2836 WeakPolarHBondContact O-CA 3.48Å; N2832-S2836 WeakPolarHBondContact O-CB 3.43Å; N2832-S2836 PolarHBondContact O-N 3.12Å; N2832-S2836 PolarHBondContact O-OG 3.2Å
2833	D	50.3	Low	43.1	Very low	94 Å²	94	94.4 Å²	94.4	50%	0.503	52%	0.523	S	S	.	.	H	α-helix	trans	-73.9	-38.5	179.6	-66.5	-28.7	0	0	0	110.8	L2829 A2837	L2829-D2833 WeakPolarHBondContact O-CB 3.25Å; L2829-D2833 PolarHBondContact O-N 3.04Å; D2833-A2837 VanDerWaalsContact O-CB 3.22Å; D2833-A2837 WeakPolarHBondContact O-CB 3.25Å; D2833-A2837 PolarHBondContact O-N 3.03Å
2834	T	48	Very low	43	Very low	69 Å²	69	97 Å²	97	42%	0.423	53%	0.525	S	S	.	.	H	α-helix	trans	-72.1	-37.7	172.9	49.1	0	0	0	0	112.9	I2830 I2831 A2837 F2838	I2830-T2834 WeakPolarHBondContact O-CB 3.44Å; I2830-T2834 WeakPolarHBondContact O-CG2 3.47Å; I2830-T2834 PolarHBondContact O-N 2.91Å; I2830-T2834 PolarHBondContact O-OG1 3.24Å; I2831-T2834 PolarHBondContact O-OG1 3.44Å; T2834-A2837 PolarHBondContact O-N 3.1Å; T2834-F2838 PolarHBondContact O-N 3Å
2835	L	43.7	Very low	43.3	Very low	93 Å²	93	95 Å²	95	49%	0.487	52%	0.519	S	S	.	.	H	α-helix	trans	-66.5	-41.8	170.5	-77.9	168.7	0	0	0	111.7	I2831 A2837 F2838 I2839	I2831-L2835 HydrophobicContact CG2-CD1 3.96Å; I2831-L2835 VanDerWaalsContact O-CB 3.32Å; I2831-L2835 WeakPolarHBondContact O-CB 3.31Å; I2831-L2835 WeakPolarHBondContact O-CG 3.49Å; I2831-L2835 PolarHBondContact O-N 3.02Å; L2835-A2837 VanDerWaalsContact C-N 3.32Å; L2835-A2837 PolarHBondContact O-N 3.33Å; L2835-F2838 WeakPolarHBondContact O-CB 3.45Å; L2835-F2838 PolarHBondContact O-N 2.95Å; L2835-F2838 VanDerWaalsContact O-N 3.15Å; L2835-I2839 WeakPolarHBondContact O-CB 3.43Å; L2835-I2839 VanDerWaalsContact O-CG1 3.26Å; L2835-I2839 WeakPolarHBondContact O-CG1 3.46Å; L2835-I2839 PolarHBondContact O-N 3.29Å
2836	S	49.1	Very low	43	Very low	59 Å²	59	95.3 Å²	95.3	41%	0.413	51%	0.51	S	S	.	.	H	α-helix	trans	-65	-37.1	174.7	-61.8	0	0	0	0	111.1	N2832 I2839 T2840	N2832-S2836 WeakPolarHBondContact O-CA 3.48Å; N2832-S2836 WeakPolarHBondContact O-CB 3.43Å; N2832-S2836 PolarHBondContact O-N 3.12Å; N2832-S2836 PolarHBondContact O-OG 3.2Å; S2836-I2839 PolarHBondContact O-N 3.46Å; S2836-T2840 WeakPolarHBondContact O-CA 3.47Å; S2836-T2840 WeakPolarHBondContact O-CB 3.3Å; S2836-T2840 PolarHBondContact O-N 2.83Å; S2836-T2840 PolarHBondContact O-OG1 3.28Å
2837	A	46.9	Very low	43	Very low	44 Å²	44	94.7 Å²	94.7	36%	0.364	51%	0.513	S	S	.	.	H	α-helix	trans	-63.4	-40.8	171.2	0	0	0	0	0	111.6	D2833 T2834 L2835 N2841	D2833-A2837 VanDerWaalsContact O-CB 3.22Å; D2833-A2837 WeakPolarHBondContact O-CB 3.25Å; D2833-A2837 PolarHBondContact O-N 3.03Å; T2834-A2837 PolarHBondContact O-N 3.1Å; L2835-A2837 VanDerWaalsContact C-N 3.32Å; L2835-A2837 PolarHBondContact O-N 3.33Å; A2837-N2841 WeakPolarHBondContact O-CA 3.02Å; A2837-N2841 WeakPolarHBondContact O-CB 3.42Å; A2837-N2841 PolarHBondContact O-N 3.02Å; A2837-N2841 PolarHBondContact O-ND2 2.98Å
2838	F	41.9	Very low	43.1	Very low	117 Å²	117	98.4 Å²	98.4	51%	0.513	53%	0.527	S	S	.	.	H	α-helix	trans	-67.9	-31.1	176.1	-106.8	-88.8	0	0	0	114.2	T2834 L2835 Y2843	T2834-F2838 PolarHBondContact O-N 3Å; L2835-F2838 WeakPolarHBondContact O-CB 3.45Å; L2835-F2838 PolarHBondContact O-N 2.95Å; L2835-F2838 VanDerWaalsContact O-N 3.15Å; F2838-Y2843 AromaticContact CD1-CD2 3.91Å; F2838-Y2843 HydrophobicContact CD1-CD2 3.91Å; F2838-Y2843 AromaticContact CD1-CE2 3.47Å; F2838-Y2843 HydrophobicContact CD1-CE2 3.47Å; F2838-Y2843 VanDerWaalsContact CD1-CE2 3.47Å; F2838-Y2843 HydrophobicContact CE1-CD2 4.1Å; F2838-Y2843 AromaticContact CE1-CE2 3.34Å; F2838-Y2843 HydrophobicContact CE1-CE2 3.34Å; F2838-Y2843 AromaticContact CE1-CZ 3.73Å; F2838-Y2843 HydrophobicContact CG-CE2 4.27Å; F2838-Y2843 HydrophobicContact CZ-CE2 4.05Å
2839	I	50.5	Low	43.5	Very low	130 Å²	130	98.1 Å²	98.1	67%	0.667	52%	0.521	S	S	*	.	H	α-helix	trans	-88.2	-39.7	-178.9	-67.3	165	0	0	0	111.1	L2835 S2836	L2835-I2839 WeakPolarHBondContact O-CB 3.43Å; L2835-I2839 VanDerWaalsContact O-CG1 3.26Å; L2835-I2839 WeakPolarHBondContact O-CG1 3.46Å; L2835-I2839 PolarHBondContact O-N 3.29Å; S2836-I2839 PolarHBondContact O-N 3.46Å
2840	T	47.7	Very low	43.7	Very low	104 Å²	104	100.2 Å²	100.2	64%	0.638	53%	0.525	S	S	*	.	H	α-helix	trans	-83.3	-39.9	-176.3	-46.1	0	0	0	0	111.7	S2836 G2842	S2836-T2840 WeakPolarHBondContact O-CA 3.47Å; S2836-T2840 WeakPolarHBondContact O-CB 3.3Å; S2836-T2840 PolarHBondContact O-N 2.83Å; S2836-T2840 PolarHBondContact O-OG1 3.28Å; T2840-G2842 PolarHBondContact O-N 3.39Å
2841	N	40.9	Very low	43.5	Very low	92 Å²	92	98.3 Å²	98.3	49%	0.492	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	69.1	159.1	-63.6	-70.8	0	0	0	108.4	A2837 Y2843	A2837-N2841 WeakPolarHBondContact O-CA 3.02Å; A2837-N2841 WeakPolarHBondContact O-CB 3.42Å; A2837-N2841 PolarHBondContact O-N 3.02Å; A2837-N2841 PolarHBondContact O-ND2 2.98Å; N2841-Y2843 PolarHBondContact O-N 3.18Å
2842	G	34.3	Very low	43.4	Very low	47 Å²	47	100.8 Å²	100.8	49%	0.485	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	104.6	-176.6	0	0	0	0	0	110.5	T2840 K2844	T2840-G2842 PolarHBondContact O-N 3.39Å; G2842-K2844 PolarHBondContact O-N 2.59Å
2843	Y	34	Very low	43.5	Very low	147 Å²	147	100.3 Å²	100.3	58%	0.576	52%	0.523	S	S	*	.			trans	-53.7	98.6	178.2	-96.2	-101	0	0	0	108.5	F2838 N2841 T2845	F2838-Y2843 AromaticContact CD1-CD2 3.91Å; F2838-Y2843 HydrophobicContact CD1-CD2 3.91Å; F2838-Y2843 AromaticContact CD1-CE2 3.47Å; F2838-Y2843 HydrophobicContact CD1-CE2 3.47Å; F2838-Y2843 VanDerWaalsContact CD1-CE2 3.47Å; F2838-Y2843 HydrophobicContact CE1-CD2 4.1Å; F2838-Y2843 AromaticContact CE1-CE2 3.34Å; F2838-Y2843 HydrophobicContact CE1-CE2 3.34Å; F2838-Y2843 AromaticContact CE1-CZ 3.73Å; F2838-Y2843 HydrophobicContact CG-CE2 4.27Å; F2838-Y2843 HydrophobicContact CZ-CE2 4.05Å; N2841-Y2843 PolarHBondContact O-N 3.18Å; Y2843-T2845 PolarHBondContact O-N 3.44Å
2844	K	37.2	Very low	43.5	Very low	154 Å²	154	98.7 Å²	98.7	67%	0.67	52%	0.516	S	S	*	.			trans	-51.3	120.2	-166.4	-76.7	-174.2	176.4	179.5	0	108.9	G2842 R2846 S2847	G2842-K2844 PolarHBondContact O-N 2.59Å; K2844-R2846 PolarHBondContact O-N 2.89Å; K2844-S2847 PolarHBondContact O-N 2.86Å
2845	T	44.5	Very low	43.1	Very low	110 Å²	110	100.5 Å²	100.5	68%	0.675	52%	0.519	S	S	*	.	H	α-helix	trans	-53.9	-22.3	-172.2	50.8	0	0	0	0	113.1	Y2843 S2847 L2848 K2849	Y2843-T2845 PolarHBondContact O-N 3.44Å; T2845-S2847 PolarHBondContact O-N 2.94Å; T2845-L2848 PolarHBondContact O-N 3.18Å; T2845-K2849 WeakPolarHBondContact O-CB 3.38Å; T2845-K2849 PolarHBondContact O-N 2.88Å
2846	R	36.7	Very low	43.2	Very low	140 Å²	140	100.8 Å²	100.8	53%	0.528	52%	0.521	S	S	.	.	H	α-helix	trans	-50.8	-44.1	166.7	-140.4	177.8	-160.3	-176.6	8.7	114	K2844 K2850	K2844-R2846 PolarHBondContact O-N 2.89Å; R2846-K2850 VanDerWaalsContact O-CB 3.3Å; R2846-K2850 WeakPolarHBondContact O-CB 3.28Å; R2846-K2850 PolarHBondContact O-N 3.48Å
2847	S	38.1	Very low	43	Very low	82 Å²	82	102.3 Å²	102.3	57%	0.573	52%	0.522	S	S	*	.	H	α-helix	trans	-72.5	-40.7	-179.1	-60.3	0	0	0	0	112.2	K2844 T2845 K2850 A2851	K2844-S2847 PolarHBondContact O-N 2.86Å; T2845-S2847 PolarHBondContact O-N 2.94Å; S2847-K2850 PolarHBondContact O-N 3.26Å; S2847-A2851 PolarHBondContact O-N 2.98Å
2848	L	41.7	Very low	42.9	Very low	115 Å²	115	104.7 Å²	104.7	60%	0.602	53%	0.532	S	S	*	.	H	α-helix	trans	-66	-44.5	172.8	-88.3	159.7	0	0	0	111.4	T2845 K2850 A2851 E2852	T2845-L2848 PolarHBondContact O-N 3.18Å; L2848-K2850 PolarHBondContact O-N 2.85Å; L2848-A2851 PolarHBondContact O-N 3.47Å; L2848-E2852 VanDerWaalsContact O-CB 3.31Å; L2848-E2852 WeakPolarHBondContact O-CB 3.39Å; L2848-E2852 PolarHBondContact O-N 3.27Å
2849	K	47.7	Very low	42.6	Very low	107 Å²	107	106.1 Å²	106.1	47%	0.465	54%	0.539	S	S	.	.	H	α-helix	trans	-59.1	-31.1	169.7	-87	-171.8	169.3	-176.4	0	113.2	T2845 R2853	T2845-K2849 WeakPolarHBondContact O-CB 3.38Å; T2845-K2849 PolarHBondContact O-N 2.88Å; K2849-R2853 VanDerWaalsContact O-CB 3.29Å; K2849-R2853 WeakPolarHBondContact O-CB 3.35Å; K2849-R2853 VanDerWaalsContact O-CG 3.3Å; K2849-R2853 WeakPolarHBondContact O-CG 3.13Å; K2849-R2853 PolarHBondContact O-N 3.48Å
2850	K	47.2	Very low	41.9	Very low	156 Å²	156	112.1 Å²	112.1	68%	0.678	56%	0.56	S	S	*	*	H	α-helix	trans	-74.5	-39.9	177.4	-161.6	169.2	-173.7	177.1	0	111.5	R2846 S2847 L2848 R2853 V2854	R2846-K2850 VanDerWaalsContact O-CB 3.3Å; R2846-K2850 WeakPolarHBondContact O-CB 3.28Å; R2846-K2850 PolarHBondContact O-N 3.48Å; S2847-K2850 PolarHBondContact O-N 3.26Å; L2848-K2850 PolarHBondContact O-N 2.85Å; K2850-R2853 PolarHBondContact O-N 3.37Å; K2850-V2854 WeakPolarHBondContact O-CG2 3.33Å; K2850-V2854 PolarHBondContact O-N 3.42Å
2851	A	42	Very low	41.7	Very low	44 Å²	44	112.5 Å²	112.5	36%	0.364	56%	0.556	S	S	.	*	H	α-helix	trans	-63	-46.2	169.4	0	0	0	0	0	111.6	S2847 L2848 R2853 V2854 F2855	S2847-A2851 PolarHBondContact O-N 2.98Å; L2848-A2851 PolarHBondContact O-N 3.47Å; A2851-R2853 PolarHBondContact O-N 2.93Å; A2851-V2854 PolarHBondContact O-N 3.16Å; A2851-F2855 WeakPolarHBondContact O-CD2 3.47Å; A2851-F2855 PolarHBondContact O-N 3.34Å
2852	E	43.5	Very low	41.7	Very low	114 Å²	114	113.6 Å²	113.6	53%	0.533	56%	0.559	S	S	.	*	H	α-helix	trans	-61.1	-40.1	176.1	-176.2	179.2	-146.5	0	0	112.5	L2848 F2855 N2856	L2848-E2852 VanDerWaalsContact O-CB 3.31Å; L2848-E2852 WeakPolarHBondContact O-CB 3.39Å; L2848-E2852 PolarHBondContact O-N 3.27Å; E2852-F2855 PolarHBondContact O-N 3.3Å; E2852-N2856 WeakPolarHBondContact O-CB 3.41Å; E2852-N2856 PolarHBondContact O-N 2.96Å; E2852-N2856 PolarHBondContact O-ND2 3.38Å
2853	R	48.5	Very low	42.1	Very low	89 Å²	89	117.3 Å²	117.3	34%	0.336	56%	0.563	S	S	.	*	H	α-helix	trans	-61	-47.9	170.8	-83.5	175.4	169.9	156.4	-1	111.5	K2849 K2850 A2851 F2855 N2856 M2857	K2849-R2853 VanDerWaalsContact O-CB 3.29Å; K2849-R2853 WeakPolarHBondContact O-CB 3.35Å; K2849-R2853 VanDerWaalsContact O-CG 3.3Å; K2849-R2853 WeakPolarHBondContact O-CG 3.13Å; K2849-R2853 PolarHBondContact O-N 3.48Å; K2850-R2853 PolarHBondContact O-N 3.37Å; A2851-R2853 PolarHBondContact O-N 2.93Å; R2853-F2855 VanDerWaalsContact C-N 3.35Å; R2853-F2855 PolarHBondContact O-N 2.88Å; R2853-N2856 PolarHBondContact O-N 3.43Å; R2853-M2857 WeakPolarHBondContact O-CG 3.38Å; R2853-M2857 PolarHBondContact O-N 3.22Å
2854	V	49.9	Very low	42.6	Very low	59 Å²	59	115.5 Å²	115.5	36%	0.358	56%	0.563	S	S	.	*	H	α-helix	trans	-61.9	-40.5	177.4	170.1	0	0	0	0	111.7	K2850 A2851 M2857 T2858	K2850-V2854 WeakPolarHBondContact O-CG2 3.33Å; K2850-V2854 PolarHBondContact O-N 3.42Å; A2851-V2854 PolarHBondContact O-N 3.16Å; V2854-M2857 PolarHBondContact O-N 3.04Å; V2854-T2858 PolarHBondContact O-N 3.43Å; V2854-T2858 PolarHBondContact O-OG1 3.45Å
2855	F	39.6	Very low	42.9	Very low	108 Å²	108	113.1 Å²	113.1	47%	0.474	56%	0.556	S	S	.	*	H	α-helix	trans	-65.3	-39.2	174.3	-76.1	-59.4	0	0	0	112.7	L2800 A2851 E2852 R2853 T2858 F2859	L2800-F2855 HydrophobicContact CD1-CE2 4.12Å; L2800-F2855 HydrophobicContact CD1-CZ 4.01Å; A2851-F2855 WeakPolarHBondContact O-CD2 3.47Å; A2851-F2855 PolarHBondContact O-N 3.34Å; E2852-F2855 PolarHBondContact O-N 3.3Å; R2853-F2855 VanDerWaalsContact C-N 3.35Å; R2853-F2855 PolarHBondContact O-N 2.88Å; F2855-T2858 WeakPolarHBondContact CA-OG1 3.22Å; F2855-T2858 PolarHBondContact O-N 3.36Å; F2855-T2858 PolarHBondContact O-OG1 3.13Å; F2855-F2859 PolarHBondContact O-N 3.49Å
2856	N	46.2	Very low	42.8	Very low	99 Å²	99	113.3 Å²	113.3	53%	0.529	55%	0.548	S	S	.	.	H	α-helix	trans	-69	-31.3	174.8	-76.5	-48.8	0	0	0	113.1	E2852 R2853 T2858 F2859	E2852-N2856 WeakPolarHBondContact O-CB 3.41Å; E2852-N2856 PolarHBondContact O-N 2.96Å; E2852-N2856 PolarHBondContact O-ND2 3.38Å; R2853-N2856 PolarHBondContact O-N 3.43Å; N2856-T2858 VanDerWaalsContact C-N 3.29Å; N2856-T2858 PolarHBondContact O-N 3.43Å; N2856-F2859 PolarHBondContact O-N 3.34Å
2857	M	43.8	Very low	43.2	Very low	90 Å²	90	111.4 Å²	111.4	44%	0.443	55%	0.549	S	S	.	.	H	α-helix	trans	-65.4	-30.8	170.8	-70.1	174.1	-168.7	0	0	112.5	R2853 V2854 F2859	R2853-M2857 WeakPolarHBondContact O-CG 3.38Å; R2853-M2857 PolarHBondContact O-N 3.22Å; V2854-M2857 PolarHBondContact O-N 3.04Å; M2857-F2859 VanDerWaalsContact C-N 3.27Å; M2857-F2859 PolarHBondContact O-N 3.3Å
2858	T	45	Very low	43.6	Very low	95 Å²	95	113.7 Å²	113.7	58%	0.583	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	10.4	173.9	46	0	0	0	0	114.4	V2854 F2855 N2856	V2854-T2858 PolarHBondContact O-N 3.43Å; V2854-T2858 PolarHBondContact O-OG1 3.45Å; F2855-T2858 WeakPolarHBondContact CA-OG1 3.22Å; F2855-T2858 PolarHBondContact O-N 3.36Å; F2855-T2858 PolarHBondContact O-OG1 3.13Å; N2856-T2858 VanDerWaalsContact C-N 3.29Å; N2856-T2858 PolarHBondContact O-N 3.43Å
2859	F	36.3	Very low	43.8	Very low	147 Å²	147	113.6 Å²	113.6	65%	0.645	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	8	178	-105.7	-82.1	0	0	0	113.4	L2796 F2855 N2856 M2857	L2796-F2859 HydrophobicContact CD1-CE2 4.18Å; L2796-F2859 HydrophobicContact CD1-CZ 3.62Å; F2855-F2859 PolarHBondContact O-N 3.49Å; N2856-F2859 PolarHBondContact O-N 3.34Å; M2857-F2859 VanDerWaalsContact C-N 3.27Å; M2857-F2859 PolarHBondContact O-N 3.3Å
2860	K	35.9	Very low	43.4	Very low	255 Å²	255	114.2 Å²	114.2	100%	1.109	55%	0.55	S	S	*	*			trans	-117.4	0	168.1	-88	-171.2	169.2	-171.9	0	110

Retrieved 2,860 of 2,860 residues in 894.2 ms (Link to these results)

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