A0A3Q0KVK7_SCHMA Loading...

DNA-directed DNA polymerase

AlphaFold DB , UniProt , Accession A0A3Q0KVK7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,582 aa.

						>A0A3Q0KVK7_SCHMA|A0A3Q0KVK7
MSRSFNYTRKGFPLKSFKKEFDYAKNESDAQISGVKNDIEQPLDAESALNESNEHRYLRAKANEITDRRYGFEAFVGPGERIGWLVNMHPTDLLDDSKRLVSGIDLYFLQTDGNRFKVSRPYLPYFYVLVRGGQAAERDANSYLLKRFSGRLAGIEIVSKNDLDLPNHLVGAKATYLKMLFYSVDELVRVRKELAVRIRANRELASSGSSYTDILAEHFRNDDYGIVTNQLSVKQNRSDPLDNLFDLRESDVPYLTRVCIDLNIFAGCWYVTTCKPGCPPEFKHHEDTVAWPEPVVLAFDIETTKMPLKFPDPTNDQIIMISYMLDGAGHLICNREILSEDIEDFDYTPRPEFPGHFTVHNLKTELDCITFFFEHIQRVRPNILVTYNGDHFDWPFIEVRAASYGLSMSEETGFSRQKGTVGPGRDGSSGEYLSRPAVHIDCLCWVKRDSYLPVGARGLKAVAKAKLRYDPIEVDPELMCRMAHESPRELANYSVSDAVATYYLYMKYVHPFVFALCTILPLNPDDVLRKGSGTLCEALLMVQAYAANVIFPHKQTDGESGPNNLLLSDSGISGKFTEDGHLIDSQTYVGGHVEALEAGVFRADIPVRFRLVPAALEALRADVKRCISRALQAEIGAEDEDALFSVIAKDNFNKICGQVENTLQQLASTPNRIECPVIYHLDVGAMYPNIILTNRLQPSAVDSGSAAKCADCEFYKPGISCQRFMPWTWRAELWTASRPEVYRIHAQLSQERFPIKLTDANEKFPKTVMKSFHELSREEQAAVEKKRITDYCRRAYKRIHLTRTEERIAMVCQRENSFYVDTVKAFRDRRYKFKGLTKTWKRHYDDACAALSAGTGDSNAVKEANAMLVLYDSLQLAHKCILNSFYGYVMRRGARWYSMEMAGIVCHTGANIITKSREIVEQIGRALELDTDGIWCILPASFPQNIEFTAVASKPSRISISYPGALLNIMVQDFFTNHQYHELVDQETLTYKIRSENSIYFEVDGPYKAMVLPAAKEEGKRLKKRYAVFNFDGSLAELKGFEIKRNGELQLIKIFQSSVFEAFLRGDSLVEAYSSVASVADHWLDVLYSKGADMPDSELFDLISENRSMSRKLEDYGSQKSTSLSTARRMAEFLGDQIVKDAGLSCRYIIARQPDGAPVTERAIPLAIFQAEGSIKRHYLQKWLKDSNLDEHTDIREILDWSYYIERLSSAIQKIITIPAALQQVSNPVPRVSHPDWLLRKLAEKMDTCKQRKLTEVFVLKNPVTNKLQEQTTDLPDLETLCSRNDEKVKSTTPIVTRHFPVKRFRSPNGPFKSWREQLGEPPNLDDANTSKKLTEWLAFHQAKWHFQLEQRQYFTKSMGNAKINGDSDHGYSFLPSAKRQRGLARYLNQTRVNLFTAVWQVIEIVPDPGQIGHYTLWVLINSPESGLVPSLNAVDITVSRNFYVNMRTPKPKDSGPLFRKVSGNVSMGNETRSASGLILPRNHTVYHLYEYNVPESVYTEHASEIATDLARPDVEGVYELGVPSLFRILMKVGCLCTVDREAFRNNQHGSVSDEGSFNLDQLCFCSLAQHPYLSGRSLRHLFLFHYQLPSVGQAMTRKDSQRQLYLLIVPWTRCGYVCVIDSARINQLPDLNVLYLRQCAKCFPHFENEEFPPDTLNFEVRIESDAVIGRRIVQRWITSLCKSMGAREQNSKEENITSSQSAAPIVILLHSSLSATQQDISSGPNEVNWPLNDEIIGRRRNPQLPVLSGFPVIQLGGTMDEGESQIGDLEYSTDAYSLLNWQQTAVKRGIRYFLQSEARLERQLELARYLHIPVGNIPVSEAPLPVLLTAPSQDIQPPASSINAIELGCDLFYARHLVKHNHVLWCSSSGRPDLGGKETDDQRLLLEMEESGVVEINRPGLYPYVNVELEFTNLAVNTLIIANRIPELEGATLLSFDRLSAADRTLEEQLNQGVNLGTHITSYDETAACSAAFRILRNMVLAWVRDVTQYQNPLADEQIIYFYQWLRSPRSLFYDPALRRTVQKLMKKVFLKLVDEITHFHVDVIYANFSRLIMSTHRIELPEALARVDYFTQLLRTRQGTLFTHLDLQYVTSWRQLIWMDSANYAGVKASVENLVDGKDVEWGKVLTIQHQSHLHTEDKENNIEEQQPNLPDPELDMHWHLARYLPETRGLRSKFQSLLAGYLLAIYNAVRNEHRRLIESIKCSLNEPHGSLEFDVDVNKDPNCVHEAETTPYKSDATVSPGVREYEERLFRDQLAPELYNLIIRLQRKAAWIDPELMRKTDPSIDNNRTCQLNNGSNICRNNDLVSAYLAEKSVGSHIEFDVANNNKNSNPNLVLPLLPAHQAIYTLNFTPLLDFIKSLCEVLSLEPSAKLHIESIRHDLLRLINVGEFSPEAIWISPHMIRDCPLNQDPNKYTFETTAIRSLLIYLPEVACPTCNFTRDIDVCRDIHVVWIMASMDSMHAETRQSGCWAWVCPHCRTVYPRDKLEEALVQQLEQFSLQHCLQDLQCPKCTVGGGIQELLIANGGSVAQCADCSTKLTLTVPTGHAVYRRLDVYRHIGVHFGFEYLEQIAYWLIQGLQQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE 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	26.5	Very low	25.1	Very low	250 Å²	250	175.5 Å²	175.5	100%	1.232	86%	0.864	S	S	*	*				0	147.8	0	-72	176.1	175.8	0	0	108.9
2	S	25.5	Very low	25.2	Very low	120 Å²	120	178.3 Å²	178.3	84%	0.839	87%	0.869	S	S	*	*			trans	-97.1	117.4	177.9	39.6	0	0	0	0	111.6
3	R	25.6	Very low	25.8	Very low	239 Å²	239	173.1 Å²	173.1	90%	0.902	86%	0.857	S	S	*	*			trans	-138.6	111.1	157.5	-82.9	-164.6	170.7	175.1	-1.6	110.2
4	S	26.2	Very low	25.6	Very low	101 Å²	101	173.8 Å²	173.8	71%	0.706	86%	0.864	S	S	*	*			trans	-71.1	140.9	169.9	51.3	0	0	0	0	111.4
5	F	25.8	Very low	25.6	Very low	200 Å²	200	174.7 Å²	174.7	88%	0.877	86%	0.861	S	S	*	*			trans	-137.4	127	148.4	-100.3	-79.1	0	0	0	110.1
6	N	24	Very low	25.6	Very low	142 Å²	142	170.2 Å²	170.2	76%	0.759	85%	0.852	S	S	*	*			trans	-81.6	138	173.4	-66.6	-50.6	0	0	0	109.3
7	Y	25.1	Very low	25.5	Very low	232 Å²	232	173.2 Å²	173.2	91%	0.91	86%	0.859	S	S	*	*			trans	-129.9	129.7	151.9	-109.3	-90.6	0	0	0	110.1
8	T	24.3	Very low	25.5	Very low	122 Å²	122	174.8 Å²	174.8	75%	0.748	86%	0.86	S	S	*	*			trans	-89.4	128.9	-164.9	44.7	0	0	0	0	112.6	K10	T8-K10 PolarHBondContact O-N 3.12Å
9	R	23.4	Very low	25.5	Very low	250 Å²	250	174.8 Å²	174.8	94%	0.943	86%	0.855	S	S	*	*			trans	-55.3	125	169.9	-80.4	178	165.2	170.5	-5.7	111.8
10	K	26.6	Very low	25.5	Very low	207 Å²	207	173.6 Å²	173.6	90%	0.9	85%	0.847	S	S	*	*			trans	-111.9	142.8	144.4	-62.1	177.5	-177.3	175.7	0	106.8	T8	T8-K10 PolarHBondContact O-N 3.12Å
11	G	23.3	Very low	25.6	Very low	67 Å²	67	175.7 Å²	175.7	69%	0.691	85%	0.852	S	S	*	*			cis	144.9	56.7	-4.1	0	0	0	0	0	113.6
12	F	25.6	Very low	25.6	Very low	210 Å²	210	170.4 Å²	170.4	92%	0.921	83%	0.829	S	S	*	*			trans	-130.6	150.2	169.3	-94.8	-90.3	0	0	0	111.2
13	P	33.4	Very low	25.6	Very low	110 Å²	110	174.2 Å²	174.2	71%	0.714	83%	0.826	S	S	*	*			trans	-115.7	145.2	-153.8	38.3	-27	0	0	0	115.1
14	L	23.1	Very low	25.6	Very low	183 Å²	183	166.8 Å²	166.8	96%	0.958	82%	0.816	S	S	*	*			trans	-107.5	125	163.3	-78.6	162.5	0	0	0	109.9
15	K	25.5	Very low	25.5	Very low	188 Å²	188	171 Å²	171	82%	0.817	82%	0.822	S	S	*	*			trans	-124	105.8	173.5	-94.3	-173.2	176.8	-177.8	0	107.3
16	S	25.2	Very low	25.6	Very low	102 Å²	102	168.3 Å²	168.3	71%	0.713	82%	0.817	S	S	*	*				92.4	90.1	82.6	71	0	0	0	0	112.4
17	F	25	Very low	25.6	Very low	221 Å²	221	169.2 Å²	169.2	97%	0.969	82%	0.816	S	S	*	*			trans	-121.7	123.6	159.5	-101.1	-94.3	0	0	0	108.7
18	K	24.6	Very low	25.5	Very low	202 Å²	202	162.9 Å²	162.9	88%	0.878	81%	0.806	S	S	*	*			trans	-163.9	114.6	-177.9	-162.9	-169.9	-169.8	-165.6	0	108.8
19	K	26.1	Very low	25.4	Very low	176 Å²	176	164.7 Å²	164.7	77%	0.765	81%	0.811	S	S	*	*			trans	-168.1	120.3	159	-95	-157.7	169.2	-168.2	0	107.2
20	E	25	Very low	25.5	Very low	150 Å²	150	157.7 Å²	157.7	70%	0.701	81%	0.807	S	S	*	*				70.4	97.3	78.3	-70.9	173.9	177.3	0	0	112.5
21	F	27.4	Very low	25.4	Very low	218 Å²	218	157.3 Å²	157.3	96%	0.956	81%	0.808	S	S	*	*			trans	-149.6	147.3	150.2	-98.8	-72.8	0	0	0	108.8
22	D	26.7	Very low	25.5	Very low	138 Å²	138	162.4 Å²	162.4	74%	0.738	82%	0.818	S	S	*	*			trans	-156.1	169.4	-161.3	-152.4	-15.2	0	0	0	110.8
23	Y	25.6	Very low	25.3	Very low	200 Å²	200	158.1 Å²	158.1	78%	0.784	81%	0.814	S	S	*	*			trans	68.9	92.5	172	-75.1	-84	0	0	0	121.7
24	A	25.1	Very low	25	Very low	84 Å²	84	156.7 Å²	156.7	69%	0.694	82%	0.819	S	S	*	*				63.1	129.7	105.3	0	0	0	0	0	124.9
25	K	25.5	Very low	25.1	Very low	190 Å²	190	154.3 Å²	154.3	83%	0.826	81%	0.812	S	S	*	*			trans	66.7	127.1	134.8	-76.7	-164.7	173.9	-162.4	0	123
26	N	26.8	Very low	25.1	Very low	142 Å²	142	154.7 Å²	154.7	76%	0.759	81%	0.813	S	S	*	*			trans	147	163.1	130.5	-77.9	-3.2	0	0	0	110.8
27	E	24	Very low	25.1	Very low	162 Å²	162	156.1 Å²	156.1	76%	0.757	81%	0.813	S	S	*	*			cis	-170.5	149.2	-46.3	-158.8	161.9	-128.5	0	0	107.7
28	S	23.2	Very low	25.3	Very low	99 Å²	99	152.7 Å²	152.7	69%	0.692	81%	0.805	S	S	*	*			trans	60.5	136.1	162.2	59.4	0	0	0	0	123.5
29	D	23.5	Very low	25.5	Very low	160 Å²	160	150.2 Å²	150.2	86%	0.856	80%	0.8	S	S	*	*			trans	52.9	121.7	141.2	-56	-13.1	0	0	0	124.1
30	A	25.3	Very low	25.7	Very low	103 Å²	103	150.6 Å²	150.6	85%	0.851	80%	0.804	S	S	*	*				-175.6	153.1	106.8	0	0	0	0	0	114.4
31	Q	23.2	Very low	25.8	Very low	198 Å²	198	152.5 Å²	152.5	93%	0.925	81%	0.813	S	S	*	*			trans	-67.2	156.2	-168	-66	168.8	-20.8	0	0	117.6
32	I	25.2	Very low	26.2	Very low	175 Å²	175	148.3 Å²	148.3	90%	0.897	81%	0.808	S	S	*	*			trans	-87.8	123.9	173.8	-61.3	165.7	0	0	0	111.5
33	S	22.9	Very low	26.3	Very low	120 Å²	120	150.4 Å²	150.4	84%	0.839	82%	0.818	S	S	*	*			trans	-165	144.5	151.9	66.4	0	0	0	0	111.8
34	G	25.4	Very low	26.8	Very low	80 Å²	80	145.8 Å²	145.8	83%	0.825	81%	0.807	S	S	*	*			trans	129.7	88.2	168.2	0	0	0	0	0	116.2
35	V	26	Very low	27.4	Very low	132 Å²	132	145.5 Å²	145.5	80%	0.8	80%	0.804	S	S	*	*			trans	-79.3	129.9	175.4	179.3	0	0	0	0	111.5
36	K	24.4	Very low	28.2	Very low	196 Å²	196	144 Å²	144	85%	0.852	80%	0.8	S	S	*	*				-178.2	155.4	129.2	-101.2	164.2	-173	-179.2	0	115.1
37	N	26.5	Very low	28.9	Very low	132 Å²	132	141.3 Å²	141.3	71%	0.706	79%	0.792	S	S	*	*			trans	-63.6	162.7	175.8	-39	-16	0	0	0	111.2
38	D	28.8	Very low	29.7	Very low	149 Å²	149	136.6 Å²	136.6	80%	0.797	78%	0.781	S	S	*	*				-154	-168.9	68.1	-91.2	-40	0	0	0	114.2
39	I	28.7	Very low	30.2	Very low	150 Å²	150	139.3 Å²	139.3	77%	0.769	79%	0.787	S	S	*	*			trans	-110.4	168.3	-150.8	-61.8	163.1	0	0	0	112.2
40	E	30.2	Very low	31.7	Very low	185 Å²	185	135.4 Å²	135.4	86%	0.864	77%	0.766	S	S	*	*			trans	95.1	93.7	172	-54.4	-168.2	172.8	0	0	116.3
41	Q	28	Very low	33.5	Very low	190 Å²	190	137.6 Å²	137.6	89%	0.888	76%	0.759	S	S	*	*			trans	-129.4	150.6	155.9	-74.2	-170.7	-12.9	0	0	110.1
42	P	35.3	Very low	35.8	Very low	129 Å²	129	130.5 Å²	130.5	84%	0.838	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-82.8	170.6	-167.7	-11.4	30.6	0	0	0	114.4
43	L	29.8	Very low	38.1	Very low	182 Å²	182	124.8 Å²	124.8	95%	0.953	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-62.4	136.9	179.9	-75.2	151.6	0	0	0	113.1
44	D	34	Very low	40.5	Very low	104 Å²	104	125 Å²	125	56%	0.556	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-77.4	125	-178	-179.9	7	0	0	0	112.9	E46 S47	D44-E46 PolarHBondContact OD1-N 2.89Å; D44-S47 PolarHBondContact O-OG 2.66Å
45	A	39.3	Very low	43	Very low	77 Å²	77	127 Å²	127	64%	0.636	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-75.2	-22.7	-177.5	0	0	0	0	0	113.9	S47 A48	A45-S47 PolarHBondContact O-N 2.87Å; A45-A48 PolarHBondContact O-N 3.07Å
46	E	41.3	Very low	45.7	Very low	160 Å²	160	122 Å²	122	75%	0.748	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-63.1	-29.1	-179.8	-64.7	-162.8	153.1	0	0	111.7	D44 A48 L49	D44-E46 PolarHBondContact OD1-N 2.89Å; E46-A48 PolarHBondContact O-N 3.43Å; E46-L49 PolarHBondContact O-N 2.8Å; E46-L49 VanDerWaalsContact O-N 3.14Å
47	S	41.8	Very low	48.4	Very low	84 Å²	84	116.6 Å²	116.6	59%	0.587	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-56.8	-23.8	177.1	68.9	0	0	0	0	114.7	D44 A45 N50	D44-S47 PolarHBondContact O-OG 2.66Å; A45-S47 PolarHBondContact O-N 2.87Å; S47-N50 PolarHBondContact O-ND2 3.12Å
48	A	40.3	Very low	51.1	Low	63 Å²	63	114.5 Å²	114.5	52%	0.521	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-81.1	-28.5	-180	0	0	0	0	0	113.9	A45 E46 N50 N53	A45-A48 PolarHBondContact O-N 3.07Å; E46-A48 PolarHBondContact O-N 3.43Å; A48-N50 PolarHBondContact O-N 3.13Å; A48-N50 VanDerWaalsContact O-N 3.13Å; A48-N53 PolarHBondContact O-ND2 3.13Å
49	L	34.3	Very low	53.7	Low	157 Å²	157	115.4 Å²	115.4	82%	0.822	60%	0.6	S	S	*	*			trans	-86.2	34.9	-173.1	-97.2	94.9	0	0	0	114.2	E46 E51	E46-L49 PolarHBondContact O-N 2.8Å; E46-L49 VanDerWaalsContact O-N 3.14Å; L49-E51 PolarHBondContact O-N 2.71Å
50	N	55.5	Low	56.3	Low	77 Å²	77	108.8 Å²	108.8	41%	0.412	57%	0.567	S	S	.	*			trans	-66.7	125.6	174.1	-88.5	-95.6	0	0	0	111.3	S47 A48 S52 N53	S47-N50 PolarHBondContact O-ND2 3.12Å; A48-N50 PolarHBondContact O-N 3.13Å; A48-N50 VanDerWaalsContact O-N 3.13Å; N50-S52 PolarHBondContact O-N 3.05Å; N50-N53 WeakPolarHBondContact O-CB 3.26Å; N50-N53 PolarHBondContact O-N 3.07Å
51	E	63.2	Low	58.9	Low	150 Å²	150	104.4 Å²	104.4	70%	0.701	55%	0.545	S	S	*	.	H	α-helix	trans	-49.1	-34.9	175.9	-59.7	175.7	141.3	0	0	112.8	L49 N53 E54 H55	L49-E51 PolarHBondContact O-N 2.71Å; E51-N53 VanDerWaalsContact C-N 3.26Å; E51-N53 PolarHBondContact O-N 2.87Å; E51-E54 PolarHBondContact O-N 3.16Å; E51-E54 VanDerWaalsContact O-N 3.16Å; E51-H55 PolarHBondContact O-CD2 2.9Å; E51-H55 VanDerWaalsContact O-CD2 3.31Å; E51-H55 PolarHBondContact O-N 3.4Å
52	S	71.2	Confident	61.6	Low	48 Å²	48	97.8 Å²	97.8	34%	0.336	52%	0.523	S	S	.	.	H	α-helix	trans	-58.4	-32.3	175.6	-173.3	0	0	0	0	113.8	N50 R56	N50-S52 PolarHBondContact O-N 3.05Å; S52-R56 WeakPolarHBondContact O-CG 3.44Å; S52-R56 PolarHBondContact O-N 2.86Å
53	N	72.3	Confident	64.1	Low	55 Å²	55	93.1 Å²	93.1	29%	0.294	49%	0.491	S	S	.	.	H	α-helix	trans	-76.4	-40.7	176.4	-67.2	-14.1	0	0	0	110.3	A48 N50 E51 R56 Y57	A48-N53 PolarHBondContact O-ND2 3.13Å; N50-N53 WeakPolarHBondContact O-CB 3.26Å; N50-N53 PolarHBondContact O-N 3.07Å; E51-N53 VanDerWaalsContact C-N 3.26Å; E51-N53 PolarHBondContact O-N 2.87Å; N53-R56 PolarHBondContact O-N 2.98Å; N53-Y57 WeakPolarHBondContact O-CB 3.49Å; N53-Y57 PolarHBondContact O-N 3.18Å
54	E	74.2	Confident	66.8	Low	124 Å²	124	87.9 Å²	87.9	58%	0.579	46%	0.462	S	S	*	.	H	α-helix	trans	-63	-47.4	175.9	-176.9	168.5	-166.4	0	0	111.1	E51 R56 Y57 L58	E51-E54 PolarHBondContact O-N 3.16Å; E51-E54 VanDerWaalsContact O-N 3.16Å; E54-R56 VanDerWaalsContact C-N 3.33Å; E54-R56 PolarHBondContact O-N 3.48Å; E54-Y57 PolarHBondContact O-N 3.12Å; E54-L58 HydrophobicContact CG-CD1 3.81Å; E54-L58 HydrophobicContact CG-CG 4.15Å; E54-L58 WeakPolarHBondContact O-CB 2.98Å; E54-L58 VanDerWaalsContact O-CG 3.29Å; E54-L58 WeakPolarHBondContact O-CG 3.46Å; E54-L58 PolarHBondContact O-N 3.01Å
55	H	78.7	Confident	69.3	Low	123 Å²	123	87.7 Å²	87.7	57%	0.569	46%	0.46	S	S	*	.	H	α-helix	trans	-59.9	-38.4	175.2	-75	-52.7	0	0	0	113.4	E51 R59	E51-H55 PolarHBondContact O-CD2 2.9Å; E51-H55 VanDerWaalsContact O-CD2 3.31Å; E51-H55 PolarHBondContact O-N 3.4Å; H55-R59 VanDerWaalsContact O-CB 3.31Å; H55-R59 WeakPolarHBondContact O-CB 3.46Å; H55-R59 PolarHBondContact O-N 2.97Å
56	R	82.3	Confident	71.5	Confident	26 Å²	26	85.8 Å²	85.8	10%	0.098	44%	0.44	C	S	.	.	H	α-helix	trans	-66.8	-42.4	174.5	-76.7	170.7	60.1	-154.4	-12.6	111.6	S52 N53 E54 R59 A60 D92 L100 D185	S52-R56 WeakPolarHBondContact O-CG 3.44Å; S52-R56 PolarHBondContact O-N 2.86Å; N53-R56 PolarHBondContact O-N 2.98Å; E54-R56 VanDerWaalsContact C-N 3.33Å; E54-R56 PolarHBondContact O-N 3.48Å; R56-R59 PolarHBondContact O-N 2.82Å; R56-A60 PolarHBondContact O-N 3.46Å; R56-D92 IonicContact CZ-OD1 2.72Å; R56-D92 IonicContact CZ-OD2 2.77Å; R56-D92 IonicContact NE-OD1 2.7Å; R56-D92 IonicContact NE-OD2 3.26Å; R56-D92 PolarHBondContact NE-OD2 3Å; R56-D92 IonicContact NH2-OD1 3.89Å; R56-D92 PolarHBondContact NH2-OD1 2.97Å; R56-D92 IonicContact NH2-OD2 2.71Å; R56-D92 PolarHBondContact NH2-OD2 3.09Å; R56-L100 HydrophobicContact CB-CD2 3.61Å; R56-D185 VanDerWaalsContact CD-OD2 3.29Å; R56-D185 WeakPolarHBondContact CD-OD2 3.37Å; R56-D185 IonicContact CZ-OD2 3.1Å; R56-D185 IonicContact NE-OD2 2.84Å; R56-D185 IonicContact NH1-OD2 2.98Å; R56-D185 PolarHBondContact NH1-OD2 3.37Å
57	Y	81	Confident	73.9	Confident	83 Å²	83	78.2 Å²	78.2	33%	0.325	41%	0.405	S	S	.	.	H	α-helix	trans	-67.2	-41.2	176.5	-179.4	-120.5	0	0	0	113.3	N53 E54 A60 K61 L94 L100	N53-Y57 WeakPolarHBondContact O-CB 3.49Å; N53-Y57 PolarHBondContact O-N 3.18Å; E54-Y57 PolarHBondContact O-N 3.12Å; Y57-A60 PolarHBondContact O-N 3.23Å; Y57-K61 HydrophobicContact CE1-CD 4.25Å; Y57-K61 PolarHBondContact O-N 3.41Å; Y57-K61 WeakPolarHBondContact OH-CE 3.47Å; Y57-K61 PolarHBondContact OH-NZ 3.45Å; Y57-L94 HydrophobicContact CD2-CD1 4.12Å; Y57-L94 HydrophobicContact CD2-CG 4.23Å; Y57-L94 HydrophobicContact CE2-CD1 3.44Å; Y57-L94 VanDerWaalsContact CE2-CD1 3.44Å; Y57-L94 HydrophobicContact CE2-CG 3.96Å; Y57-L100 HydrophobicContact CD2-CD1 4.36Å
58	L	82.6	Confident	76	Confident	88 Å²	88	81.4 Å²	81.4	46%	0.461	40%	0.404	S	S	.	.	H	α-helix	trans	-63.4	-40.6	173.7	-71.3	173.7	0	0	0	111.2	E54 K61 A62	E54-L58 HydrophobicContact CG-CD1 3.81Å; E54-L58 HydrophobicContact CG-CG 4.15Å; E54-L58 WeakPolarHBondContact O-CB 2.98Å; E54-L58 VanDerWaalsContact O-CG 3.29Å; E54-L58 WeakPolarHBondContact O-CG 3.46Å; E54-L58 PolarHBondContact O-N 3.01Å; L58-K61 PolarHBondContact O-N 3.08Å; L58-A62 PolarHBondContact O-N 3.06Å
59	R	83.7	Confident	78.2	Confident	169 Å²	169	83.4 Å²	83.4	64%	0.638	40%	0.398	S	S	*	.	H	α-helix	trans	-62.2	-43.3	172.4	-176.9	-179.5	-68.7	161.5	-0.8	111.9	H55 R56 K61 A62 N63	H55-R59 VanDerWaalsContact O-CB 3.31Å; H55-R59 WeakPolarHBondContact O-CB 3.46Å; H55-R59 PolarHBondContact O-N 2.97Å; R56-R59 PolarHBondContact O-N 2.82Å; R59-K61 VanDerWaalsContact C-N 3.32Å; R59-K61 PolarHBondContact O-N 3.49Å; R59-A62 PolarHBondContact O-N 3.01Å; R59-N63 PolarHBondContact O-N 3.48Å; R59-N63 PolarHBondContact O-ND2 3.36Å; R59-N63 PolarHBondContact O-OD1 3.19Å
60	A	84	Confident	80.8	Confident	10 Å²	10	76.4 Å²	76.4	8%	0.083	36%	0.361	C	S	.	.	H	α-helix	trans	-59.9	-41.6	175.4	0	0	0	0	0	112	R56 Y57 N63 E64 D92	R56-A60 PolarHBondContact O-N 3.46Å; Y57-A60 PolarHBondContact O-N 3.23Å; A60-N63 WeakPolarHBondContact O-CB 3.31Å; A60-N63 PolarHBondContact O-N 3.36Å; A60-E64 PolarHBondContact O-N 2.89Å; A60-D92 WeakPolarHBondContact CB-O 3.38Å
61	K	84.8	Confident	82.3	Confident	93 Å²	93	73.6 Å²	73.6	40%	0.404	35%	0.351	S	S	.	.	H	α-helix	trans	-65.5	-40.7	173.1	-80.7	-174.6	171.9	169.4	0	113.9	Y57 L58 R59 N63 E64 I65	Y57-K61 HydrophobicContact CE1-CD 4.25Å; Y57-K61 PolarHBondContact O-N 3.41Å; Y57-K61 WeakPolarHBondContact OH-CE 3.47Å; Y57-K61 PolarHBondContact OH-NZ 3.45Å; L58-K61 PolarHBondContact O-N 3.08Å; R59-K61 VanDerWaalsContact C-N 3.32Å; R59-K61 PolarHBondContact O-N 3.49Å; K61-N63 VanDerWaalsContact C-N 3.31Å; K61-N63 PolarHBondContact O-N 2.74Å; K61-E64 PolarHBondContact O-N 2.88Å; K61-I65 WeakPolarHBondContact O-CG1 3.2Å; K61-I65 PolarHBondContact O-N 3.45Å
62	A	84.3	Confident	83.6	Confident	52 Å²	52	66.6 Å²	66.6	43%	0.43	32%	0.318	S	S	.	.	H	α-helix	trans	-62.4	-40.9	175.6	0	0	0	0	0	111.5	L58 R59 I65 T66	L58-A62 PolarHBondContact O-N 3.06Å; R59-A62 PolarHBondContact O-N 3.01Å; A62-I65 PolarHBondContact O-N 3.38Å; A62-T66 PolarHBondContact O-N 2.89Å; A62-T66 VanDerWaalsContact O-N 3.13Å; A62-T66 PolarHBondContact O-OG1 3.39Å
63	N	87.8	Confident	84.3	Confident	31 Å²	31	71 Å²	71	17%	0.166	33%	0.333	C	S	.	.	H	α-helix	trans	-58.8	-50.8	171.9	-64.3	-22.4	0	0	0	110.9	R59 A60 K61 I65 T66 D67 R435	R59-N63 PolarHBondContact O-N 3.48Å; R59-N63 PolarHBondContact O-ND2 3.36Å; R59-N63 PolarHBondContact O-OD1 3.19Å; A60-N63 WeakPolarHBondContact O-CB 3.31Å; A60-N63 PolarHBondContact O-N 3.36Å; K61-N63 VanDerWaalsContact C-N 3.31Å; K61-N63 PolarHBondContact O-N 2.74Å; N63-I65 VanDerWaalsContact C-N 3.29Å; N63-I65 PolarHBondContact O-N 2.95Å; N63-T66 WeakPolarHBondContact O-CB 3.31Å; N63-T66 PolarHBondContact O-N 3.02Å; N63-D67 PolarHBondContact O-N 3.5Å; N63-R435 WeakPolarHBondContact OD1-CD 3.49Å
64	E	86.5	Confident	85	Confident	72 Å²	72	71.1 Å²	71.1	34%	0.336	34%	0.342	S	S	.	.	H	α-helix	trans	-57.4	-38	178	-82.1	-169.8	-132.9	0	0	113.7	A60 K61 T66 R68	A60-E64 PolarHBondContact O-N 2.89Å; K61-E64 PolarHBondContact O-N 2.88Å; E64-T66 VanDerWaalsContact C-N 3.34Å; E64-R68 WeakPolarHBondContact O-CB 3.36Å; E64-R68 WeakPolarHBondContact O-CG 3.46Å; E64-R68 PolarHBondContact O-N 3.03Å; E64-R68 VanDerWaalsContact O-N 3.09Å; E64-R68 IonicContact OE2-CZ 2.68Å; E64-R68 IonicContact OE2-NE 2.67Å; E64-R68 IonicContact OE2-NH2 2.75Å; E64-R68 PolarHBondContact OE2-NH2 3.5Å
65	I	86	Confident	85.6	Confident	99 Å²	99	66.4 Å²	66.4	51%	0.508	32%	0.319	S	S	.	.	H	α-helix	trans	-64.4	-42.7	176.6	-68.6	163.8	0	0	0	110.1	K61 A62 N63 R68 R69	K61-I65 WeakPolarHBondContact O-CG1 3.2Å; K61-I65 PolarHBondContact O-N 3.45Å; A62-I65 PolarHBondContact O-N 3.38Å; N63-I65 VanDerWaalsContact C-N 3.29Å; N63-I65 PolarHBondContact O-N 2.95Å; I65-R68 PolarHBondContact O-N 3.38Å; I65-R69 WeakPolarHBondContact O-CG 3.48Å; I65-R69 PolarHBondContact O-N 3.28Å; I65-R69 VanDerWaalsContact O-N 3.08Å
66	T	86.8	Confident	85.5	Confident	37 Å²	37	66.3 Å²	66.3	23%	0.227	33%	0.327	C	S	.	.	H	α-helix	trans	-68.2	-43.7	178.5	-50.3	0	0	0	0	111.8	A62 N63 E64 R68 R69 Y70	A62-T66 PolarHBondContact O-N 2.89Å; A62-T66 VanDerWaalsContact O-N 3.13Å; A62-T66 PolarHBondContact O-OG1 3.39Å; N63-T66 WeakPolarHBondContact O-CB 3.31Å; N63-T66 PolarHBondContact O-N 3.02Å; E64-T66 VanDerWaalsContact C-N 3.34Å; T66-R68 VanDerWaalsContact C-N 3.3Å; T66-R68 PolarHBondContact O-N 3.49Å; T66-R69 WeakPolarHBondContact O-CB 3.48Å; T66-R69 PolarHBondContact O-N 2.96Å; T66-R69 VanDerWaalsContact O-N 3.13Å; T66-Y70 PolarHBondContact O-N 3.07Å
67	D	90.2	Very high	84.9	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-56.7	-44.2	175.7	-62.3	-31.9	0	0	0	111	N63 Y70 G71 F72 Y107 K117	N63-D67 PolarHBondContact O-N 3.5Å; D67-Y70 CarbonylContact O-C 3.29Å; D67-Y70 PolarHBondContact O-N 3.4Å; D67-G71 PolarHBondContact O-N 3.11Å; D67-F72 HydrophobicContact CB-CB 4.42Å; D67-F72 PolarHBondContact O-N 2.89Å; D67-Y107 HydrophobicContact CB-CE1 4.34Å; D67-Y107 VanDerWaalsContact CG-OH 3.26Å; D67-Y107 WeakPolarHBondContact OD1-CE1 3.38Å; D67-Y107 PolarHBondContact OD1-OH 3.08Å; D67-Y107 PolarHBondContact OD2-OH 3.32Å; D67-K117 HydrophobicContact CB-CD 4.38Å; D67-K117 WeakPolarHBondContact OD2-CD 3.48Å; D67-K117 WeakPolarHBondContact OD2-CE 3.37Å; D67-K117 IonicContact OD2-NZ 2.88Å; D67-K117 PolarHBondContact OD2-NZ 3.42Å
68	R	86.6	Confident	84.5	Confident	151 Å²	151	67.8 Å²	67.8	57%	0.57	36%	0.357	S	S	*	.	H	α-helix	trans	-67.8	-34.2	176.9	-68.7	173.8	-153.6	-164.2	7.4	113	E64 I65 T66 Y70 G71	E64-R68 WeakPolarHBondContact O-CB 3.36Å; E64-R68 WeakPolarHBondContact O-CG 3.46Å; E64-R68 PolarHBondContact O-N 3.03Å; E64-R68 VanDerWaalsContact O-N 3.09Å; E64-R68 IonicContact OE2-CZ 2.68Å; E64-R68 IonicContact OE2-NE 2.67Å; E64-R68 IonicContact OE2-NH2 2.75Å; E64-R68 PolarHBondContact OE2-NH2 3.5Å; I65-R68 PolarHBondContact O-N 3.38Å; T66-R68 VanDerWaalsContact C-N 3.3Å; T66-R68 PolarHBondContact O-N 3.49Å; R68-Y70 PolarHBondContact O-N 3.44Å; R68-G71 PolarHBondContact O-N 3.22Å
69	R	86.3	Confident	84.5	Confident	106 Å²	106	65.1 Å²	65.1	40%	0.4	35%	0.351	S	S	.	.	H	α-helix	trans	-59.3	-36.8	172.7	-74	-179	-177.2	-154.4	0.7	111.5	I65 T66 G71 R380 E410	I65-R69 WeakPolarHBondContact O-CG 3.48Å; I65-R69 PolarHBondContact O-N 3.28Å; I65-R69 VanDerWaalsContact O-N 3.08Å; T66-R69 WeakPolarHBondContact O-CB 3.48Å; T66-R69 PolarHBondContact O-N 2.96Å; T66-R69 VanDerWaalsContact O-N 3.13Å; R69-G71 VanDerWaalsContact C-N 3.29Å; R69-G71 PolarHBondContact O-N 3.48Å; R69-R380 WeakPolarHBondContact O-CD 3.28Å; R69-R380 PolarHBondContact O-NE 2.63Å; R69-E410 PolarHBondContact NH1-O 3.44Å
70	Y	89.4	Confident	84.7	Confident	9 Å²	9	63 Å²	63	4%	0.035	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	0.9	173.4	-83.6	-96.4	0	0	0	114.8	T66 D67 R68 R115 R380 P381 T412 P436 A437	T66-Y70 PolarHBondContact O-N 3.07Å; D67-Y70 CarbonylContact O-C 3.29Å; D67-Y70 PolarHBondContact O-N 3.4Å; R68-Y70 PolarHBondContact O-N 3.44Å; Y70-R115 PolarHBondContact O-NH1 3.07Å; Y70-R380 HydrophobicContact CD1-CB 4.25Å; Y70-P381 HydrophobicContact CE1-CG 4.48Å; Y70-P381 WeakPolarHBondContact CE1-O 3.44Å; Y70-T412 WeakPolarHBondContact CE2-O 3.35Å; Y70-T412 PolarHBondContact OH-O 2.93Å; Y70-P436 HydrophobicContact CD1-CB 4.47Å; Y70-P436 HydrophobicContact CD1-CG 4.31Å; Y70-P436 HydrophobicContact CD2-CB 4.28Å; Y70-P436 HydrophobicContact CD2-CG 3.46Å; Y70-P436 VanDerWaalsContact CD2-CG 3.46Å; Y70-P436 HydrophobicContact CE2-CG 4.1Å; Y70-P436 HydrophobicContact CG-CB 3.89Å; Y70-P436 HydrophobicContact CG-CG 3.58Å; Y70-A437 HydrophobicContact CD1-CB 4.24Å; Y70-A437 HydrophobicContact CE1-CB 3.78Å
71	G	87	Confident	84.9	Confident	19 Å²	19	66.6 Å²	66.6	20%	0.196	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	11.4	178	0	0	0	0	0	115.6	D67 R68 R69 E73	D67-G71 PolarHBondContact O-N 3.11Å; R68-G71 PolarHBondContact O-N 3.22Å; R69-G71 VanDerWaalsContact C-N 3.29Å; R69-G71 PolarHBondContact O-N 3.48Å; G71-E73 PolarHBondContact O-N 3.35Å; G71-E73 VanDerWaalsContact O-N 3.13Å
72	F	91.1	Very high	85.1	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.009	36%	0.362	C	S	.	.			trans	-83.8	84.3	177.4	-73.6	-83.8	0	0	0	111.3	D67 V86 Y107 L109 R115 K117 P436	D67-F72 HydrophobicContact CB-CB 4.42Å; D67-F72 PolarHBondContact O-N 2.89Å; F72-V86 HydrophobicContact CZ-CG1 4.34Å; F72-Y107 HydrophobicContact CB-CD1 4.19Å; F72-Y107 HydrophobicContact CB-CE1 4.49Å; F72-Y107 AromaticContact CD1-CD1 3.86Å; F72-Y107 HydrophobicContact CD1-CD1 3.86Å; F72-Y107 HydrophobicContact CD2-CD1 4.12Å; F72-Y107 HydrophobicContact CE1-CD1 4.21Å; F72-Y107 HydrophobicContact CE2-CD1 4.45Å; F72-Y107 AromaticContact CG-CD1 3.8Å; F72-Y107 HydrophobicContact CG-CD1 3.8Å; F72-Y107 HydrophobicContact CG-CE1 4.47Å; F72-Y107 HydrophobicContact CZ-CD1 4.48Å; F72-L109 HydrophobicContact CE1-CD2 4.18Å; F72-L109 HydrophobicContact CZ-CD2 4.06Å; F72-R115 HydrophobicContact CD1-CB 3.89Å; F72-R115 HydrophobicContact CE1-CB 3.96Å; F72-R115 HydrophobicContact CE1-CG 4.46Å; F72-R115 HydrophobicContact CG-CB 4.35Å; F72-R115 HydrophobicContact CZ-CB 4.47Å; F72-K117 HydrophobicContact CB-CB 4.3Å; F72-P436 HydrophobicContact CD2-CB 3.5Å; F72-P436 HydrophobicContact CE2-CB 3.69Å; F72-P436 VanDerWaalsContact CE2-O 3.24Å; F72-P436 WeakPolarHBondContact CE2-O 3.46Å
73	E	85.5	Confident	85.5	Confident	140 Å²	140	64 Å²	64	65%	0.654	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.8	141.7	175.9	-63.3	-165.8	158.8	0	0	112.4	G71 F75 F116 K117	G71-E73 PolarHBondContact O-N 3.35Å; G71-E73 VanDerWaalsContact O-N 3.13Å; E73-F75 PolarHBondContact O-N 3.24Å; E73-F116 CarbonylContact O-C 3.23Å; E73-F116 WeakPolarHBondContact O-CA 3.5Å; E73-K117 PolarHBondContact O-N 3.23Å
74	A	87.2	Confident	85.6	Confident	59 Å²	59	62.5 Å²	62.5	49%	0.488	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	117.6	-179.3	0	0	0	0	0	111.9	V76 K117	A74-V76 HydrophobicContact CB-CG2 4.23Å; A74-V76 PolarHBondContact O-N 3.08Å; A74-K117 WeakPolarHBondContact CA-O 3.32Å
75	F	86.3	Confident	85.9	Confident	24 Å²	24	59.1 Å²	59.1	11%	0.105	32%	0.318	C	S	.	.			trans	-84.5	97.7	177.8	179.7	-125.6	0	0	0	111.1	E73 R81 F116 K117 V118 C274	E73-F75 PolarHBondContact O-N 3.24Å; F75-R81 HydrophobicContact CD1-CG 4.31Å; F75-R81 HydrophobicContact CD2-CG 4.4Å; F75-R81 HydrophobicContact CE1-CB 4.29Å; F75-R81 HydrophobicContact CE1-CG 3.99Å; F75-R81 HydrophobicContact CE2-CG 4.11Å; F75-R81 HydrophobicContact CZ-CG 3.9Å; F75-F116 HydrophobicContact CB-CB 4.4Å; F75-F116 HydrophobicContact CB-CD2 3.86Å; F75-F116 HydrophobicContact CD1-CD2 4.4Å; F75-F116 HydrophobicContact CD1-CE2 4.42Å; F75-F116 HydrophobicContact CG-CD2 4.39Å; F75-K117 PolarHBondContact N-O 3.42Å; F75-V118 HydrophobicContact CB-CG2 4.4Å; F75-C274 HydrophobicContact CD1-CB 4.32Å; F75-C274 VanDerWaalsContact CD1-SG 3.58Å; F75-C274 HydrophobicContact CE1-CB 3.78Å; F75-C274 VanDerWaalsContact CE1-SG 3.54Å; F75-C274 HydrophobicContact CZ-CB 4.09Å
76	V	75.6	Confident	86.1	Confident	122 Å²	122	54.4 Å²	54.4	74%	0.739	29%	0.294	S	S	*	.			trans	-113	-13	-178.2	-168.6	0	0	0	0	112.6	A74	A74-V76 HydrophobicContact CB-CG2 4.23Å; A74-V76 PolarHBondContact O-N 3.08Å
77	G	70	Confident	86.4	Confident	35 Å²	35	52.7 Å²	52.7	36%	0.361	28%	0.283	S	S	.	.	S	Bend	trans	-76.5	160.9	-173.7	0	0	0	0	0	114.7	G79 C274	G77-G79 PolarHBondContact O-N 3.36Å; G77-C274 WeakPolarHBondContact O-CB 3.45Å
78	P	73.3	Confident	86.5	Confident	104 Å²	104	52.6 Å²	52.6	68%	0.675	28%	0.283	S	S	*	.	S	Bend	trans	-64.3	126.9	172.2	27.2	-33.6	0	0	0	111.1	C274 P276	P78-C274 WeakPolarHBondContact CA-O 3.46Å; P78-P276 HydrophobicContact CB-CG 4.11Å
79	G	82.9	Confident	86.8	Confident	33 Å²	33	46.3 Å²	46.3	34%	0.34	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	151.5	-173.4	175	0	0	0	0	0	113.9	G77 C274	G77-G79 PolarHBondContact O-N 3.36Å; G79-C274 PolarHBondContact N-O 2.95Å; G79-C274 VanDerWaalsContact N-O 3.11Å; G79-C274 PolarHBondContact O-N 3.42Å
80	E	87.2	Confident	87	Confident	124 Å²	124	44.2 Å²	44.2	58%	0.579	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	138.6	176.5	-53.9	-160.8	137.4	0	0	110.3	V271 T272 T273	E80-V271 HydrophobicContact CB-CG1 4.32Å; E80-T272 CarbonylContact C-O 3.59Å; E80-T272 VanDerWaalsContact CA-O 3.29Å; E80-T272 WeakPolarHBondContact CA-O 3.35Å; E80-T273 HydrophobicContact CG-CG2 3.91Å; E80-T273 VanDerWaalsContact OE1-CG2 3.32Å; E80-T273 WeakPolarHBondContact OE1-CG2 3.06Å; E80-T273 PolarHBondContact OE1-OG1 3.27Å
81	R	88.7	Confident	87.1	Confident	85 Å²	85	44.4 Å²	44.4	32%	0.321	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	136.6	170.3	-70.7	-169.4	-178.4	-154.4	8.3	110.1	F75 F116 T272	F75-R81 HydrophobicContact CD1-CG 4.31Å; F75-R81 HydrophobicContact CD2-CG 4.4Å; F75-R81 HydrophobicContact CE1-CB 4.29Å; F75-R81 HydrophobicContact CE1-CG 3.99Å; F75-R81 HydrophobicContact CE2-CG 4.11Å; F75-R81 HydrophobicContact CZ-CG 3.9Å; R81-F116 HydrophobicContact CB-CE1 3.96Å; R81-F116 HydrophobicContact CB-CE2 4.06Å; R81-F116 HydrophobicContact CB-CZ 3.62Å; R81-T272 PolarHBondContact N-O 3.07Å; R81-T272 PolarHBondContact O-N 3.44Å
82	I	89.4	Confident	87.1	Confident	90 Å²	90	44.9 Å²	44.9	46%	0.462	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	130.1	173.4	-54.9	177.1	0	0	0	107.8	W269 Y270 V271	I82-W269 HydrophobicContact CG2-CE3 4.17Å; I82-Y270 WeakPolarHBondContact CA-O 3.42Å; I82-V271 HydrophobicContact CG1-CG1 4.43Å; I82-V271 HydrophobicContact CG1-CG2 4.27Å
83	G	90.8	Very high	86.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	155.8	179	0	0	0	0	0	113.9	L109 W269 Y270	G83-L109 CarbonylContact C-O 3.44Å; G83-L109 VanDerWaalsContact CA-O 3.25Å; G83-L109 WeakPolarHBondContact CA-O 3.47Å; G83-W269 VanDerWaalsContact C-CE3 3.4Å; G83-Y270 PolarHBondContact N-O 3.02Å; G83-Y270 PolarHBondContact O-N 3.26Å
84	W	91.4	Very high	86.8	Confident	1 Å²	1	44 Å²	44	0%	0.004	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127.4	176.7	-173.6	77.3	0	0	0	110.3	V86 F108 L109 G267 W269 W291 P292 F514	W84-V86 HydrophobicContact CE3-CB 3.88Å; W84-V86 HydrophobicContact CE3-CG2 4.47Å; W84-V86 HydrophobicContact CZ3-CB 3.7Å; W84-V86 HydrophobicContact CZ3-CG2 3.8Å; W84-V86 PolarHBondContact O-N 3.24Å; W84-F108 WeakPolarHBondContact O-CA 3.31Å; W84-L109 HydrophobicContact CE3-CD1 4.07Å; W84-L109 HydrophobicContact CZ3-CD1 4.25Å; W84-L109 PolarHBondContact N-O 3.24Å; W84-L109 PolarHBondContact O-N 2.86Å; W84-G267 PolarHBondContact NE1-O 3.4Å; W84-W269 HydrophobicContact CB-CD2 3.77Å; W84-W269 HydrophobicContact CB-CE3 3.81Å; W84-W269 HydrophobicContact CB-CG 4.44Å; W84-W269 HydrophobicContact CB-CH2 3.89Å; W84-W269 HydrophobicContact CB-CZ2 3.88Å; W84-W269 HydrophobicContact CB-CZ3 3.86Å; W84-W269 AromaticContact CD1-CD1 3.68Å; W84-W269 AromaticContact CD1-CE2 3.76Å; W84-W269 AromaticContact CD1-CG 3.99Å; W84-W269 AromaticContact CD1-NE1 3.52Å; W84-W269 HydrophobicContact CG-CD2 4.32Å; W84-W269 HydrophobicContact CG-CZ2 4.35Å; W84-W291 AromaticContact CZ2-CD1 3.81Å; W84-W291 HydrophobicContact CZ2-CG 4.38Å; W84-W291 AromaticContact NE1-CD1 4Å; W84-P292 HydrophobicContact CB-CG 3.9Å; W84-P292 VanDerWaalsContact CD2-CD 3.43Å; W84-P292 HydrophobicContact CD2-CG 3.6Å; W84-P292 HydrophobicContact CE3-CG 3.54Å; W84-P292 HydrophobicContact CG-CG 3.8Å; W84-P292 HydrophobicContact CZ3-CG 4.18Å; W84-F514 AromaticContact CH2-CD1 3.56Å; W84-F514 HydrophobicContact CH2-CD1 3.56Å; W84-F514 HydrophobicContact CH2-CD2 4.04Å; W84-F514 AromaticContact CH2-CE1 3.47Å; W84-F514 HydrophobicContact CH2-CE1 3.47Å; W84-F514 VanDerWaalsContact CH2-CE1 3.47Å; W84-F514 AromaticContact CH2-CE2 3.98Å; W84-F514 HydrophobicContact CH2-CE2 3.98Å; W84-F514 AromaticContact CH2-CG 3.85Å; W84-F514 HydrophobicContact CH2-CG 3.85Å; W84-F514 AromaticContact CH2-CZ 3.7Å; W84-F514 HydrophobicContact CH2-CZ 3.7Å; W84-F514 HydrophobicContact CZ2-CB 4.37Å; W84-F514 AromaticContact CZ2-CD1 3.73Å; W84-F514 HydrophobicContact CZ2-CD1 3.73Å; W84-F514 HydrophobicContact CZ2-CD2 4.47Å; W84-F514 HydrophobicContact CZ2-CE1 4.11Å; W84-F514 AromaticContact CZ2-CG 3.94Å; W84-F514 HydrophobicContact CZ2-CG 3.94Å; W84-F514 HydrophobicContact CZ3-CE1 4.17Å; W84-F514 HydrophobicContact CZ3-CZ 4.31Å
85	L	92.4	Very high	86.4	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	99.1	-174	-177.6	54.3	0	0	0	111.2	N87 M88 L106 Y107 F108 I264 G267 C268 Y270	L85-N87 WeakPolarHBondContact CD1-O 3.43Å; L85-M88 HydrophobicContact CD2-CE 3.72Å; L85-M88 HydrophobicContact CG-CE 4.31Å; L85-L106 HydrophobicContact CD1-CB 3.93Å; L85-L106 HydrophobicContact CD1-CD2 3.79Å; L85-L106 HydrophobicContact CD2-CD2 3.72Å; L85-L106 HydrophobicContact CG-CD2 4.43Å; L85-Y107 WeakPolarHBondContact CD1-O 3.35Å; L85-F108 HydrophobicContact CB-CD1 4.15Å; L85-F108 HydrophobicContact CB-CE1 3.83Å; L85-F108 HydrophobicContact CD1-CD1 4.35Å; L85-F108 HydrophobicContact CD1-CE1 4.02Å; L85-F108 HydrophobicContact CD1-CE2 4.46Å; L85-F108 HydrophobicContact CD1-CZ 4.09Å; L85-F108 HydrophobicContact CG-CE1 4.39Å; L85-I264 HydrophobicContact CD2-CG2 3.47Å; L85-I264 VanDerWaalsContact CD2-CG2 3.47Å; L85-G267 PolarHBondContact O-N 3.07Å; L85-C268 PolarHBondContact N-O 2.97Å; L85-Y270 HydrophobicContact CB-CD2 4.26Å; L85-Y270 HydrophobicContact CB-CE2 4.37Å; L85-Y270 HydrophobicContact CD2-CE2 4.23Å
86	V	91.1	Very high	85.8	Confident	1 Å²	1	50 Å²	50	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-44.3	-175.8	60.7	0	0	0	0	113.1	F72 W84 Y107 L109 V438 F514 P524	F72-V86 HydrophobicContact CZ-CG1 4.34Å; W84-V86 HydrophobicContact CE3-CB 3.88Å; W84-V86 HydrophobicContact CE3-CG2 4.47Å; W84-V86 HydrophobicContact CZ3-CB 3.7Å; W84-V86 HydrophobicContact CZ3-CG2 3.8Å; W84-V86 PolarHBondContact O-N 3.24Å; V86-Y107 WeakPolarHBondContact CG1-O 3.39Å; V86-Y107 PolarHBondContact N-O 2.86Å; V86-L109 HydrophobicContact CB-CD1 4.09Å; V86-L109 HydrophobicContact CB-CG 4.09Å; V86-L109 HydrophobicContact CG1-CD1 4.26Å; V86-L109 HydrophobicContact CG1-CD2 4.09Å; V86-L109 HydrophobicContact CG1-CG 3.84Å; V86-L109 HydrophobicContact CG2-CD1 4.33Å; V86-V438 HydrophobicContact CG2-CG2 4.22Å; V86-F514 HydrophobicContact CG2-CZ 4.41Å; V86-P524 VanDerWaalsContact O-CG 3.3Å; V86-P524 WeakPolarHBondContact O-CG 3.34Å
87	N	92.6	Very high	85.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	163.2	176.1	-151.6	-14.7	0	0	0	111	L85 H89 Y107 V438 N523 D525	L85-N87 WeakPolarHBondContact CD1-O 3.43Å; N87-H89 PolarHBondContact ND2-NE2 3.03Å; N87-H89 PolarHBondContact OD1-NE2 2.91Å; N87-Y107 WeakPolarHBondContact O-CB 3.44Å; N87-Y107 WeakPolarHBondContact O-CD2 3.4Å; N87-Y107 PolarHBondContact O-N 3.31Å; N87-V438 HydrophobicContact CB-CG2 3.96Å; N87-N523 WeakPolarHBondContact OD1-CB 3.35Å; N87-D525 PolarHBondContact ND2-OD2 3.07Å
88	M	92.8	Very high	86.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	140.5	176.4	62.9	176.6	102.7	0	0	111.6	L85 D105 L106 L255 C259 A266 N523	L85-M88 HydrophobicContact CD2-CE 3.72Å; L85-M88 HydrophobicContact CG-CE 4.31Å; M88-D105 VanDerWaalsContact CA-O 3.27Å; M88-D105 WeakPolarHBondContact CA-O 3.41Å; M88-L106 HydrophobicContact CB-CD2 3.89Å; M88-L106 HydrophobicContact SD-CD2 4.45Å; M88-L255 HydrophobicContact CB-CD1 4.44Å; M88-L255 HydrophobicContact CG-CD1 4.05Å; M88-L255 HydrophobicContact CG-CD2 4.32Å; M88-L255 HydrophobicContact SD-CD1 4.04Å; M88-C259 PolarHBondContact SD-SG 2.93Å; M88-A266 HydrophobicContact CE-CB 3.61Å; M88-N523 HydrophobicContact CG-CB 3.88Å; M88-N523 PolarHBondContact O-ND2 2.85Å
89	H	91.7	Very high	86.5	Confident	18 Å²	18	54.6 Å²	54.6	8%	0.083	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	147.6	-175.3	-74.2	-81.6	0	0	0	112.2	N87 D105 S434 R435 N523	N87-H89 PolarHBondContact ND2-NE2 3.03Å; N87-H89 PolarHBondContact OD1-NE2 2.91Å; H89-D105 PolarHBondContact N-O 3.3Å; H89-D105 PolarHBondContact O-N 3.01Å; H89-S434 PolarHBondContact NE2-O 3.35Å; H89-R435 PolarHBondContact CD2-O 3.15Å; H89-N523 PolarHBondContact CE1-ND2 2.73Å
90	P	90.7	Very high	86.6	Confident	62 Å²	62	54.1 Å²	54.1	40%	0.403	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	150.8	171.4	29.5	-35.2	0	0	0	111.4	Y254 R435	P90-Y254 HydrophobicContact CB-CD1 4.32Å; P90-R435 PolarHBondContact O-NH1 3.5Å; P90-R435 PolarHBondContact O-NH2 3.28Å
91	T	90.6	Very high	86.6	Confident	14 Å²	14	48.8 Å²	48.8	9%	0.086	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	168.8	-178.3	-148.1	0	0	0	0	110.6	L93 G103 D105 R435	T91-L93 HydrophobicContact CG2-CD1 4.49Å; T91-L93 HydrophobicContact CG2-CD2 3.82Å; T91-L93 HydrophobicContact CG2-CG 4Å; T91-G103 PolarHBondContact N-O 3.09Å; T91-G103 PolarHBondContact O-N 3.08Å; T91-D105 WeakPolarHBondContact CB-OD2 3.32Å; T91-D105 PolarHBondContact OG1-OD2 3.1Å; T91-R435 PolarHBondContact OG1-NH2 3.12Å
92	D	88.7	Confident	86.8	Confident	29 Å²	29	45 Å²	45	16%	0.155	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.9	173.5	-73.5	-51.6	0	0	0	109.6	R56 A60 L100 S102	R56-D92 IonicContact CZ-OD1 2.72Å; R56-D92 IonicContact CZ-OD2 2.77Å; R56-D92 IonicContact NE-OD1 2.7Å; R56-D92 IonicContact NE-OD2 3.26Å; R56-D92 PolarHBondContact NE-OD2 3Å; R56-D92 IonicContact NH2-OD1 3.89Å; R56-D92 PolarHBondContact NH2-OD1 2.97Å; R56-D92 IonicContact NH2-OD2 2.71Å; R56-D92 PolarHBondContact NH2-OD2 3.09Å; A60-D92 WeakPolarHBondContact CB-O 3.38Å; D92-L100 HydrophobicContact CB-CD1 4.3Å; D92-L100 HydrophobicContact CB-CD2 4.19Å; D92-L100 HydrophobicContact CB-CG 4.1Å; D92-S102 PolarHBondContact OD1-OG 3.17Å
93	L	86.1	Confident	86.9	Confident	38 Å²	38	40.7 Å²	40.7	20%	0.199	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	161.1	-171.9	-55.5	173.7	0	0	0	109.6	T91 L100 V101 P121	T91-L93 HydrophobicContact CG2-CD1 4.49Å; T91-L93 HydrophobicContact CG2-CD2 3.82Å; T91-L93 HydrophobicContact CG2-CG 4Å; L93-L100 CarbonylContact O-C 3.59Å; L93-L100 WeakPolarHBondContact O-CA 3.49Å; L93-V101 HydrophobicContact CB-CG2 4.12Å; L93-V101 PolarHBondContact N-O 3.25Å; L93-V101 PolarHBondContact O-N 2.95Å; L93-P121 HydrophobicContact CD1-CB 4.18Å
94	L	83	Confident	86.9	Confident	84 Å²	84	40.7 Å²	40.7	44%	0.44	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.8	166.7	-70.4	172.3	0	0	0	109.6	Y57 R99 L100	Y57-L94 HydrophobicContact CD2-CD1 4.12Å; Y57-L94 HydrophobicContact CD2-CG 4.23Å; Y57-L94 HydrophobicContact CE2-CD1 3.44Å; Y57-L94 VanDerWaalsContact CE2-CD1 3.44Å; Y57-L94 HydrophobicContact CE2-CG 3.96Å; L94-R99 WeakPolarHBondContact CA-O 3.19Å; L94-L100 HydrophobicContact CD2-CD1 3.99Å; L94-L100 HydrophobicContact CG-CD1 4.48Å
95	D	79.4	Confident	87	Confident	38 Å²	38	40.7 Å²	40.7	20%	0.203	21%	0.211	C	C	.	.			trans	-77.5	172.8	167.4	81.6	-11.3	0	0	0	111.6	S97 K98 R99 V101	D95-S97 PolarHBondContact O-N 3.44Å; D95-S97 VanDerWaalsContact O-N 3.09Å; D95-S97 WeakPolarHBondContact OD1-CA 3.42Å; D95-S97 WeakPolarHBondContact OD1-CB 3.35Å; D95-S97 PolarHBondContact OD1-N 3.45Å; D95-K98 WeakPolarHBondContact O-CA 3.49Å; D95-K98 PolarHBondContact O-N 3.18Å; D95-K98 PolarHBondContact OD1-N 3.02Å; D95-R99 PolarHBondContact N-O 3.17Å; D95-R99 WeakPolarHBondContact OD1-CB 3.16Å; D95-R99 PolarHBondContact OD1-N 3.5Å; D95-R99 IonicContact OD1-NE 3.41Å; D95-R99 IonicContact OD2-CZ 2.75Å; D95-R99 IonicContact OD2-NE 3.73Å; D95-R99 PolarHBondContact OD2-NE 3.32Å; D95-R99 IonicContact OD2-NH2 3.77Å; D95-R99 PolarHBondContact OD2-NH2 3.3Å; D95-V101 HydrophobicContact CB-CG1 3.98Å; D95-V101 HydrophobicContact CB-CG2 4.35Å
96	D	73.7	Confident	87.1	Confident	173 Å²	173	40.7 Å²	40.7	93%	0.925	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-17.8	175.9	-60.4	-55.8	0	0	0	113.2	K98	D96-K98 VanDerWaalsContact C-N 3.34Å
97	S	74.8	Confident	87.2	Confident	74 Å²	74	40.7 Å²	40.7	52%	0.517	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	3.7	174	-47.1	0	0	0	0	113	D95 R99	D95-S97 PolarHBondContact O-N 3.44Å; D95-S97 VanDerWaalsContact O-N 3.09Å; D95-S97 WeakPolarHBondContact OD1-CA 3.42Å; D95-S97 WeakPolarHBondContact OD1-CB 3.35Å; D95-S97 PolarHBondContact OD1-N 3.45Å; S97-R99 VanDerWaalsContact C-N 3.26Å; S97-R99 PolarHBondContact O-N 2.99Å; S97-R99 PolarHBondContact OG-NH2 3.16Å
98	K	78.5	Confident	87.2	Confident	178 Å²	178	40.7 Å²	40.7	77%	0.774	21%	0.21	S	C	*	.	S	Bend	trans	61	24.8	-173.6	-53.4	178.7	-178.2	176.3	0	114.8	D95 D96	D95-K98 WeakPolarHBondContact O-CA 3.49Å; D95-K98 PolarHBondContact O-N 3.18Å; D95-K98 PolarHBondContact OD1-N 3.02Å; D96-K98 VanDerWaalsContact C-N 3.34Å
99	R	80.7	Confident	87.1	Confident	105 Å²	105	41 Å²	41	40%	0.396	21%	0.212	S	C	.	.			trans	-86.9	146.7	169.8	-64.6	175.4	-67.9	-165.5	-5.6	110.1	L94 D95 S97 V101 Y182	L94-R99 WeakPolarHBondContact CA-O 3.19Å; D95-R99 PolarHBondContact N-O 3.17Å; D95-R99 WeakPolarHBondContact OD1-CB 3.16Å; D95-R99 PolarHBondContact OD1-N 3.5Å; D95-R99 IonicContact OD1-NE 3.41Å; D95-R99 IonicContact OD2-CZ 2.75Å; D95-R99 IonicContact OD2-NE 3.73Å; D95-R99 PolarHBondContact OD2-NE 3.32Å; D95-R99 IonicContact OD2-NH2 3.77Å; D95-R99 PolarHBondContact OD2-NH2 3.3Å; S97-R99 VanDerWaalsContact C-N 3.26Å; S97-R99 PolarHBondContact O-N 2.99Å; S97-R99 PolarHBondContact OG-NH2 3.16Å; R99-V101 PolarHBondContact O-N 2.97Å; R99-Y182 PolarHBondContact NH1-OH 3.1Å
100	L	83.3	Confident	87	Confident	22 Å²	22	41.8 Å²	41.8	12%	0.115	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	104.2	179.8	-159.3	77.8	0	0	0	110.4	R56 Y57 D92 L93 L94	R56-L100 HydrophobicContact CB-CD2 3.61Å; Y57-L100 HydrophobicContact CD2-CD1 4.36Å; D92-L100 HydrophobicContact CB-CD1 4.3Å; D92-L100 HydrophobicContact CB-CD2 4.19Å; D92-L100 HydrophobicContact CB-CG 4.1Å; L93-L100 CarbonylContact O-C 3.59Å; L93-L100 WeakPolarHBondContact O-CA 3.49Å; L94-L100 HydrophobicContact CD2-CD1 3.99Å; L94-L100 HydrophobicContact CG-CD1 4.48Å
101	V	88.9	Confident	86.4	Confident	13 Å²	13	44.9 Å²	44.9	8%	0.079	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	146	179.8	-61.3	0	0	0	0	110.9	L93 D95 R99 P121 Y182	L93-V101 HydrophobicContact CB-CG2 4.12Å; L93-V101 PolarHBondContact N-O 3.25Å; L93-V101 PolarHBondContact O-N 2.95Å; D95-V101 HydrophobicContact CB-CG1 3.98Å; D95-V101 HydrophobicContact CB-CG2 4.35Å; R99-V101 PolarHBondContact O-N 2.97Å; V101-P121 HydrophobicContact CG2-CB 4.41Å; V101-Y182 VanDerWaalsContact CA-O 3.31Å; V101-Y182 WeakPolarHBondContact CA-O 3.37Å; V101-Y182 HydrophobicContact CG1-CD1 4.33Å
102	S	91.9	Very high	85.8	Confident	5 Å²	5	48.9 Å²	48.9	4%	0.035	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	147.9	175.8	-63.7	0	0	0	0	112	D92 Y122 Y182 S183 V184 Y254	D92-S102 PolarHBondContact OD1-OG 3.17Å; S102-Y122 PolarHBondContact O-N 3.36Å; S102-Y182 PolarHBondContact N-O 3.03Å; S102-S183 WeakPolarHBondContact OG-CA 3.28Å; S102-V184 PolarHBondContact OG-N 3.28Å; S102-Y254 PolarHBondContact O-OH 2.87Å; S102-Y254 VanDerWaalsContact O-OH 3.08Å
103	G	91	Very high	85.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	-178.8	178.5	0	0	0	0	0	112.4	T91 R120 Y254	T91-G103 PolarHBondContact N-O 3.09Å; T91-G103 PolarHBondContact O-N 3.08Å; G103-R120 CarbonylContact C-O 3.58Å; G103-R120 WeakPolarHBondContact CA-O 3.4Å; G103-Y254 VanDerWaalsContact CA-OH 3.25Å; G103-Y254 WeakPolarHBondContact CA-OH 3.22Å; G103-Y254 PolarHBondContact N-OH 3.28Å; G103-Y254 WeakPolarHBondContact O-CE1 3.48Å
104	I	92.6	Very high	85	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	140.6	171	63.1	169.5	0	0	0	110.7	L106 S119 R120 Y254 L255 V258	I104-L106 HydrophobicContact CD1-CD1 4.09Å; I104-L106 HydrophobicContact CD1-CD2 3.88Å; I104-L106 HydrophobicContact CD1-CG 4Å; I104-L106 HydrophobicContact CG1-CD1 4.36Å; I104-L106 HydrophobicContact CG1-CG 4.23Å; I104-S119 CarbonylContact O-C 3.54Å; I104-S119 WeakPolarHBondContact O-CA 3.19Å; I104-R120 HydrophobicContact CG1-CB 4.12Å; I104-R120 PolarHBondContact N-O 3.27Å; I104-R120 PolarHBondContact O-N 3.37Å; I104-Y254 HydrophobicContact CG2-CE1 3.96Å; I104-L255 HydrophobicContact CB-CD1 4.36Å; I104-L255 HydrophobicContact CG2-CD1 3.81Å; I104-V258 HydrophobicContact CD1-CB 4.26Å; I104-V258 HydrophobicContact CD1-CG1 3.57Å; I104-V258 HydrophobicContact CG1-CG1 4.08Å; I104-V258 HydrophobicContact CG2-CB 4.25Å; I104-V258 HydrophobicContact CG2-CG1 4.37Å; I104-V258 HydrophobicContact CG2-CG2 4.3Å
105	D	93.4	Very high	85.4	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	125.9	166.5	-81	-36.8	0	0	0	109.1	M88 H89 T91 Y107 K117 S119 R435	M88-D105 VanDerWaalsContact CA-O 3.27Å; M88-D105 WeakPolarHBondContact CA-O 3.41Å; H89-D105 PolarHBondContact N-O 3.3Å; H89-D105 PolarHBondContact O-N 3.01Å; T91-D105 WeakPolarHBondContact CB-OD2 3.32Å; T91-D105 PolarHBondContact OG1-OD2 3.1Å; D105-Y107 HydrophobicContact CB-CD2 4.5Å; D105-Y107 HydrophobicContact CB-CE2 3.66Å; D105-K117 HydrophobicContact CB-CD 3.94Å; D105-K117 HydrophobicContact CB-CG 4.32Å; D105-K117 WeakPolarHBondContact OD1-CE 3.33Å; D105-K117 IonicContact OD1-NZ 2.68Å; D105-K117 PolarHBondContact OD1-NZ 3.17Å; D105-K117 IonicContact OD2-NZ 2.68Å; D105-K117 PolarHBondContact OD2-NZ 2.84Å; D105-S119 WeakPolarHBondContact OD1-CB 3.39Å; D105-S119 PolarHBondContact OD1-OG 3.4Å; D105-R435 IonicContact OD2-CZ 3.87Å; D105-R435 IonicContact OD2-NH2 3.95Å; D105-R435 PolarHBondContact OD2-NH2 2.85Å
106	L	93.6	Very high	86	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.4	178.8	-65.9	159.9	0	0	0	108.9	L85 M88 I104 F108 K117 V118 R120 I264 F282	L85-L106 HydrophobicContact CD1-CB 3.93Å; L85-L106 HydrophobicContact CD1-CD2 3.79Å; L85-L106 HydrophobicContact CD2-CD2 3.72Å; L85-L106 HydrophobicContact CG-CD2 4.43Å; M88-L106 HydrophobicContact CB-CD2 3.89Å; M88-L106 HydrophobicContact SD-CD2 4.45Å; I104-L106 HydrophobicContact CD1-CD1 4.09Å; I104-L106 HydrophobicContact CD1-CD2 3.88Å; I104-L106 HydrophobicContact CD1-CG 4Å; I104-L106 HydrophobicContact CG1-CD1 4.36Å; I104-L106 HydrophobicContact CG1-CG 4.23Å; L106-F108 HydrophobicContact CB-CD2 4.35Å; L106-F108 HydrophobicContact CB-CE2 3.55Å; L106-F108 HydrophobicContact CB-CZ 4.03Å; L106-K117 CarbonylContact O-C 3.58Å; L106-K117 WeakPolarHBondContact O-CA 3.29Å; L106-V118 WeakPolarHBondContact CB-O 3.36Å; L106-V118 PolarHBondContact N-O 3.4Å; L106-V118 PolarHBondContact O-N 3.15Å; L106-R120 HydrophobicContact CD1-CB 4.42Å; L106-I264 HydrophobicContact CD1-CD1 4.45Å; L106-I264 HydrophobicContact CD2-CG2 4.08Å; L106-F282 HydrophobicContact CD1-CE1 3.76Å; L106-F282 HydrophobicContact CD1-CE2 3.78Å; L106-F282 HydrophobicContact CD1-CZ 3.3Å
107	Y	93.9	Very high	86.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	118.2	-173	-63.2	-99.2	0	0	0	110.1	D67 F72 L85 V86 N87 D105 K117 R435 P436	D67-Y107 HydrophobicContact CB-CE1 4.34Å; D67-Y107 VanDerWaalsContact CG-OH 3.26Å; D67-Y107 WeakPolarHBondContact OD1-CE1 3.38Å; D67-Y107 PolarHBondContact OD1-OH 3.08Å; D67-Y107 PolarHBondContact OD2-OH 3.32Å; F72-Y107 HydrophobicContact CB-CD1 4.19Å; F72-Y107 HydrophobicContact CB-CE1 4.49Å; F72-Y107 AromaticContact CD1-CD1 3.86Å; F72-Y107 HydrophobicContact CD1-CD1 3.86Å; F72-Y107 HydrophobicContact CD2-CD1 4.12Å; F72-Y107 HydrophobicContact CE1-CD1 4.21Å; F72-Y107 HydrophobicContact CE2-CD1 4.45Å; F72-Y107 AromaticContact CG-CD1 3.8Å; F72-Y107 HydrophobicContact CG-CD1 3.8Å; F72-Y107 HydrophobicContact CG-CE1 4.47Å; F72-Y107 HydrophobicContact CZ-CD1 4.48Å; L85-Y107 WeakPolarHBondContact CD1-O 3.35Å; V86-Y107 WeakPolarHBondContact CG1-O 3.39Å; V86-Y107 PolarHBondContact N-O 2.86Å; N87-Y107 WeakPolarHBondContact O-CB 3.44Å; N87-Y107 WeakPolarHBondContact O-CD2 3.4Å; N87-Y107 PolarHBondContact O-N 3.31Å; D105-Y107 HydrophobicContact CB-CD2 4.5Å; D105-Y107 HydrophobicContact CB-CE2 3.66Å; Y107-K117 HydrophobicContact CD1-CD 4.24Å; Y107-K117 HydrophobicContact CD1-CG 4.16Å; Y107-K117 HydrophobicContact CE1-CD 3.61Å; Y107-K117 HydrophobicContact CE1-CG 4.04Å; Y107-K117 HydrophobicContact CE2-CD 4.38Å; Y107-R435 WeakPolarHBondContact OH-CB 3.27Å; Y107-R435 PolarHBondContact OH-NE 3.12Å; Y107-P436 HydrophobicContact CD1-CB 4.26Å; Y107-P436 HydrophobicContact CE1-CB 4.03Å
108	F	92.8	Very high	87.7	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	140.2	-172.2	-67	-82.6	0	0	0	113.4	W84 L85 L106 R115 F116 V118 Y270 F282	W84-F108 WeakPolarHBondContact O-CA 3.31Å; L85-F108 HydrophobicContact CB-CD1 4.15Å; L85-F108 HydrophobicContact CB-CE1 3.83Å; L85-F108 HydrophobicContact CD1-CD1 4.35Å; L85-F108 HydrophobicContact CD1-CE1 4.02Å; L85-F108 HydrophobicContact CD1-CE2 4.46Å; L85-F108 HydrophobicContact CD1-CZ 4.09Å; L85-F108 HydrophobicContact CG-CE1 4.39Å; L106-F108 HydrophobicContact CB-CD2 4.35Å; L106-F108 HydrophobicContact CB-CE2 3.55Å; L106-F108 HydrophobicContact CB-CZ 4.03Å; F108-R115 WeakPolarHBondContact O-CA 3.35Å; F108-F116 HydrophobicContact CB-CD1 3.86Å; F108-F116 HydrophobicContact CB-CD2 4.22Å; F108-F116 HydrophobicContact CB-CE1 3.5Å; F108-F116 HydrophobicContact CB-CE2 3.9Å; F108-F116 HydrophobicContact CB-CG 4.21Å; F108-F116 HydrophobicContact CB-CZ 3.52Å; F108-F116 HydrophobicContact CD1-CZ 4.45Å; F108-F116 HydrophobicContact CD2-CD2 4.08Å; F108-F116 AromaticContact CD2-CE2 3.59Å; F108-F116 HydrophobicContact CD2-CE2 3.59Å; F108-F116 AromaticContact CD2-CZ 3.96Å; F108-F116 HydrophobicContact CD2-CZ 3.96Å; F108-F116 HydrophobicContact CE2-CE2 4.32Å; F108-F116 HydrophobicContact CG-CD2 4.5Å; F108-F116 HydrophobicContact CG-CE1 4.25Å; F108-F116 AromaticContact CG-CE2 3.89Å; F108-F116 HydrophobicContact CG-CE2 3.89Å; F108-F116 AromaticContact CG-CZ 3.74Å; F108-F116 HydrophobicContact CG-CZ 3.74Å; F108-F116 PolarHBondContact N-O 3.48Å; F108-F116 PolarHBondContact O-N 3.36Å; F108-F116 VanDerWaalsContact O-N 3.14Å; F108-V118 HydrophobicContact CD2-CG2 3.87Å; F108-V118 HydrophobicContact CE2-CB 4.07Å; F108-V118 HydrophobicContact CE2-CG2 3.71Å; F108-Y270 HydrophobicContact CE1-CD2 4.19Å; F108-Y270 HydrophobicContact CE1-CG 4.5Å; F108-F282 HydrophobicContact CE2-CE1 4.02Å; F108-F282 HydrophobicContact CZ-CD1 4.09Å; F108-F282 AromaticContact CZ-CE1 3.87Å; F108-F282 HydrophobicContact CZ-CE1 3.87Å
109	L	90.7	Very high	88.3	Confident	8 Å²	8	30.6 Å²	30.6	4%	0.042	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.4	168.4	-53.4	-177.2	0	0	0	110	F72 G83 W84 V86 R115 P292 P294 N382	F72-L109 HydrophobicContact CE1-CD2 4.18Å; F72-L109 HydrophobicContact CZ-CD2 4.06Å; G83-L109 CarbonylContact C-O 3.44Å; G83-L109 VanDerWaalsContact CA-O 3.25Å; G83-L109 WeakPolarHBondContact CA-O 3.47Å; W84-L109 HydrophobicContact CE3-CD1 4.07Å; W84-L109 HydrophobicContact CZ3-CD1 4.25Å; W84-L109 PolarHBondContact N-O 3.24Å; W84-L109 PolarHBondContact O-N 2.86Å; V86-L109 HydrophobicContact CB-CD1 4.09Å; V86-L109 HydrophobicContact CB-CG 4.09Å; V86-L109 HydrophobicContact CG1-CD1 4.26Å; V86-L109 HydrophobicContact CG1-CD2 4.09Å; V86-L109 HydrophobicContact CG1-CG 3.84Å; V86-L109 HydrophobicContact CG2-CD1 4.33Å; L109-R115 HydrophobicContact CD2-CG 4.1Å; L109-P292 HydrophobicContact CB-CG 4.44Å; L109-P292 HydrophobicContact CD1-CG 4.36Å; L109-P294 HydrophobicContact CD1-CB 4.06Å; L109-N382 HydrophobicContact CD1-CB 4.45Å; L109-N382 WeakPolarHBondContact CD2-ND2 3.21Å
110	Q	87.7	Confident	88.8	Confident	33 Å²	33	27.7 Å²	27.7	15%	0.154	16%	0.163	C	C	.	.			trans	-98.1	159.5	174.8	-65.2	-176.4	-143.6	0	0	110.9	D112 G113 N114 F116	Q110-D112 WeakPolarHBondContact CB-OD1 3.44Å; Q110-D112 PolarHBondContact NE2-OD1 3.13Å; Q110-D112 PolarHBondContact O-N 3.04Å; Q110-G113 PolarHBondContact O-N 3.24Å; Q110-G113 VanDerWaalsContact O-N 3.1Å; Q110-N114 HydrophobicContact CB-CB 4.21Å; Q110-N114 WeakPolarHBondContact CB-O 3.44Å; Q110-N114 HydrophobicContact CG-CB 4.39Å; Q110-N114 PolarHBondContact N-O 3.45Å; Q110-F116 HydrophobicContact CG-CD1 3.85Å; Q110-F116 HydrophobicContact CG-CE1 3.65Å; Q110-F116 VanDerWaalsContact OE1-CD1 3.25Å
111	T	79.1	Confident	89.1	Confident	128 Å²	128	29 Å²	29	79%	0.785	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-13.6	178.7	45	0	0	0	0	114.6	W269	T111-W269 HydrophobicContact CG2-CH2 3.5Å; T111-W269 HydrophobicContact CG2-CZ2 4.28Å; T111-W269 HydrophobicContact CG2-CZ3 3.98Å
112	D	77.9	Confident	89.2	Confident	97 Å²	97	30.4 Å²	30.4	52%	0.519	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	8.7	175.3	61.8	-5.1	0	0	0	112.8	Q110 N114	Q110-D112 WeakPolarHBondContact CB-OD1 3.44Å; Q110-D112 PolarHBondContact NE2-OD1 3.13Å; Q110-D112 PolarHBondContact O-N 3.04Å; D112-N114 PolarHBondContact O-N 2.68Å; D112-N114 VanDerWaalsContact OD1-CB 3.29Å; D112-N114 WeakPolarHBondContact OD1-CB 3.28Å; D112-N114 PolarHBondContact OD1-N 3.16Å; D112-N114 VanDerWaalsContact OD1-N 3.07Å; D112-N114 PolarHBondContact OD1-ND2 2.99Å; D112-N114 PolarHBondContact OD2-ND2 3.44Å
113	G	74.5	Confident	89.2	Confident	58 Å²	58	33.4 Å²	33.4	60%	0.598	19%	0.191	S	C	*	.	S	Bend	trans	79.6	-4.4	-176.4	0	0	0	0	0	114.7	Q110	Q110-G113 PolarHBondContact O-N 3.24Å; Q110-G113 VanDerWaalsContact O-N 3.1Å
114	N	84.6	Confident	89.4	Confident	90 Å²	90	33.5 Å²	33.5	48%	0.481	19%	0.192	S	C	.	.			trans	-68.3	155.8	175.2	-75.9	-55.4	0	0	0	111.8	Q110 D112	Q110-N114 HydrophobicContact CB-CB 4.21Å; Q110-N114 WeakPolarHBondContact CB-O 3.44Å; Q110-N114 HydrophobicContact CG-CB 4.39Å; Q110-N114 PolarHBondContact N-O 3.45Å; D112-N114 PolarHBondContact O-N 2.68Å; D112-N114 VanDerWaalsContact OD1-CB 3.29Å; D112-N114 WeakPolarHBondContact OD1-CB 3.28Å; D112-N114 PolarHBondContact OD1-N 3.16Å; D112-N114 VanDerWaalsContact OD1-N 3.07Å; D112-N114 PolarHBondContact OD1-ND2 2.99Å; D112-N114 PolarHBondContact OD2-ND2 3.44Å
115	R	90.4	Very high	89.5	Confident	38 Å²	38	33.9 Å²	33.9	14%	0.143	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	140	-171.4	-56.2	176.5	-173.4	-174.4	-3.3	109.7	Y70 F72 F108 L109 R380 N382	Y70-R115 PolarHBondContact O-NH1 3.07Å; F72-R115 HydrophobicContact CD1-CB 3.89Å; F72-R115 HydrophobicContact CE1-CB 3.96Å; F72-R115 HydrophobicContact CE1-CG 4.46Å; F72-R115 HydrophobicContact CG-CB 4.35Å; F72-R115 HydrophobicContact CZ-CB 4.47Å; F108-R115 WeakPolarHBondContact O-CA 3.35Å; L109-R115 HydrophobicContact CD2-CG 4.1Å; R115-R380 VanDerWaalsContact CZ-O 3.22Å; R115-R380 VanDerWaalsContact NH1-CB 3.26Å; R115-R380 PolarHBondContact NH1-O 2.87Å; R115-R380 PolarHBondContact NH2-O 3.23Å; R115-N382 VanDerWaalsContact CZ-ND2 3.33Å; R115-N382 PolarHBondContact NE-ND2 2.71Å; R115-N382 PolarHBondContact NH2-OD1 2.95Å
116	F	92.6	Very high	89.6	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	150.3	174.5	67.5	-81.3	0	0	0	112.4	E73 F75 R81 F108 Q110 V118	E73-F116 CarbonylContact O-C 3.23Å; E73-F116 WeakPolarHBondContact O-CA 3.5Å; F75-F116 HydrophobicContact CB-CB 4.4Å; F75-F116 HydrophobicContact CB-CD2 3.86Å; F75-F116 HydrophobicContact CD1-CD2 4.4Å; F75-F116 HydrophobicContact CD1-CE2 4.42Å; F75-F116 HydrophobicContact CG-CD2 4.39Å; R81-F116 HydrophobicContact CB-CE1 3.96Å; R81-F116 HydrophobicContact CB-CE2 4.06Å; R81-F116 HydrophobicContact CB-CZ 3.62Å; F108-F116 HydrophobicContact CB-CD1 3.86Å; F108-F116 HydrophobicContact CB-CD2 4.22Å; F108-F116 HydrophobicContact CB-CE1 3.5Å; F108-F116 HydrophobicContact CB-CE2 3.9Å; F108-F116 HydrophobicContact CB-CG 4.21Å; F108-F116 HydrophobicContact CB-CZ 3.52Å; F108-F116 HydrophobicContact CD1-CZ 4.45Å; F108-F116 HydrophobicContact CD2-CD2 4.08Å; F108-F116 AromaticContact CD2-CE2 3.59Å; F108-F116 HydrophobicContact CD2-CE2 3.59Å; F108-F116 AromaticContact CD2-CZ 3.96Å; F108-F116 HydrophobicContact CD2-CZ 3.96Å; F108-F116 HydrophobicContact CE2-CE2 4.32Å; F108-F116 HydrophobicContact CG-CD2 4.5Å; F108-F116 HydrophobicContact CG-CE1 4.25Å; F108-F116 AromaticContact CG-CE2 3.89Å; F108-F116 HydrophobicContact CG-CE2 3.89Å; F108-F116 AromaticContact CG-CZ 3.74Å; F108-F116 HydrophobicContact CG-CZ 3.74Å; F108-F116 PolarHBondContact N-O 3.48Å; F108-F116 PolarHBondContact O-N 3.36Å; F108-F116 VanDerWaalsContact O-N 3.14Å; Q110-F116 HydrophobicContact CG-CD1 3.85Å; Q110-F116 HydrophobicContact CG-CE1 3.65Å; Q110-F116 VanDerWaalsContact OE1-CD1 3.25Å; F116-V118 HydrophobicContact CD2-CG2 3.62Å; F116-V118 HydrophobicContact CE2-CG2 3.57Å
117	K	92.7	Very high	89.6	Confident	7 Å²	7	34.2 Å²	34.2	3%	0.03	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	143	173	-159.5	178.1	76.4	158	0	109.8	D67 F72 E73 A74 F75 D105 L106 Y107	D67-K117 HydrophobicContact CB-CD 4.38Å; D67-K117 WeakPolarHBondContact OD2-CD 3.48Å; D67-K117 WeakPolarHBondContact OD2-CE 3.37Å; D67-K117 IonicContact OD2-NZ 2.88Å; D67-K117 PolarHBondContact OD2-NZ 3.42Å; F72-K117 HydrophobicContact CB-CB 4.3Å; E73-K117 PolarHBondContact O-N 3.23Å; A74-K117 WeakPolarHBondContact CA-O 3.32Å; F75-K117 PolarHBondContact N-O 3.42Å; D105-K117 HydrophobicContact CB-CD 3.94Å; D105-K117 HydrophobicContact CB-CG 4.32Å; D105-K117 WeakPolarHBondContact OD1-CE 3.33Å; D105-K117 IonicContact OD1-NZ 2.68Å; D105-K117 PolarHBondContact OD1-NZ 3.17Å; D105-K117 IonicContact OD2-NZ 2.68Å; D105-K117 PolarHBondContact OD2-NZ 2.84Å; L106-K117 CarbonylContact O-C 3.58Å; L106-K117 WeakPolarHBondContact O-CA 3.29Å; Y107-K117 HydrophobicContact CD1-CD 4.24Å; Y107-K117 HydrophobicContact CD1-CG 4.16Å; Y107-K117 HydrophobicContact CE1-CD 3.61Å; Y107-K117 HydrophobicContact CE1-CG 4.04Å; Y107-K117 HydrophobicContact CE2-CD 4.38Å
118	V	91.9	Very high	89.5	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	119.3	171.7	-170.3	0	0	0	0	108.6	F75 L106 F108 F116 T272 P280 F282	F75-V118 HydrophobicContact CB-CG2 4.4Å; L106-V118 WeakPolarHBondContact CB-O 3.36Å; L106-V118 PolarHBondContact N-O 3.4Å; L106-V118 PolarHBondContact O-N 3.15Å; F108-V118 HydrophobicContact CD2-CG2 3.87Å; F108-V118 HydrophobicContact CE2-CB 4.07Å; F108-V118 HydrophobicContact CE2-CG2 3.71Å; F116-V118 HydrophobicContact CD2-CG2 3.62Å; F116-V118 HydrophobicContact CE2-CG2 3.57Å; V118-T272 HydrophobicContact CG1-CG2 4.18Å; V118-T272 HydrophobicContact CG2-CG2 4.08Å; V118-P280 HydrophobicContact CG1-CB 3.63Å; V118-P280 HydrophobicContact CG1-CG 3.66Å; V118-F282 HydrophobicContact CB-CE1 4.23Å; V118-F282 HydrophobicContact CB-CZ 4.21Å; V118-F282 HydrophobicContact CG1-CE1 3.99Å; V118-F282 HydrophobicContact CG1-CZ 3.67Å
119	S	90.8	Very high	89.3	Confident	36 Å²	36	36 Å²	36	25%	0.252	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	112.2	178.1	-52.4	0	0	0	0	109.4	I104 D105 P121	I104-S119 CarbonylContact O-C 3.54Å; I104-S119 WeakPolarHBondContact O-CA 3.19Å; D105-S119 WeakPolarHBondContact OD1-CB 3.39Å; D105-S119 PolarHBondContact OD1-OG 3.4Å; S119-P121 WeakPolarHBondContact O-CD 3.45Å
120	R	90.1	Very high	89.1	Confident	45 Å²	45	36.2 Å²	36.2	17%	0.17	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	109.7	-178.7	176.2	65.5	-162.9	-144.3	1.5	110	G103 I104 L106 L262 P279 P280 F282	G103-R120 CarbonylContact C-O 3.58Å; G103-R120 WeakPolarHBondContact CA-O 3.4Å; I104-R120 HydrophobicContact CG1-CB 4.12Å; I104-R120 PolarHBondContact N-O 3.27Å; I104-R120 PolarHBondContact O-N 3.37Å; L106-R120 HydrophobicContact CD1-CB 4.42Å; R120-L262 HydrophobicContact CG-CD1 4.06Å; R120-P279 PolarHBondContact NH1-O 3.32Å; R120-P280 PolarHBondContact NH1-O 3.41Å; R120-F282 HydrophobicContact CB-CE2 4.11Å; R120-F282 HydrophobicContact CB-CZ 4.4Å; R120-F282 HydrophobicContact CG-CE2 4.12Å
121	P	89.7	Confident	88.8	Confident	48 Å²	48	42 Å²	42	31%	0.312	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	142.8	169.5	27.8	-33.4	0	0	0	110.7	L93 V101 S119 P279	L93-P121 HydrophobicContact CD1-CB 4.18Å; V101-P121 HydrophobicContact CG2-CB 4.41Å; S119-P121 WeakPolarHBondContact O-CD 3.45Å; P121-P279 HydrophobicContact CG-CB 4.48Å
122	Y	91.9	Very high	88.5	Confident	44 Å²	44	38.8 Å²	38.8	17%	0.173	22%	0.219	C	C	.	.			trans	-153.8	124.5	176.3	-168.1	-76.3	0	0	0	110.5	S102 P124 Y125 Y254 V258 D261 L262	S102-Y122 PolarHBondContact O-N 3.36Å; Y122-P124 VanDerWaalsContact O-CD 3.31Å; Y122-P124 WeakPolarHBondContact O-CD 3.47Å; Y122-Y125 HydrophobicContact CE1-CD1 4.32Å; Y122-Y125 HydrophobicContact CE1-CE1 4.2Å; Y122-Y254 WeakPolarHBondContact O-CE2 3.47Å; Y122-Y254 PolarHBondContact O-OH 3.02Å; Y122-V258 HydrophobicContact CD1-CG2 3.8Å; Y122-V258 HydrophobicContact CD2-CG1 4.18Å; Y122-V258 HydrophobicContact CG-CG1 4.15Å; Y122-V258 HydrophobicContact CG-CG2 3.78Å; Y122-D261 HydrophobicContact CE2-CB 4.36Å; Y122-D261 WeakPolarHBondContact OH-CB 3.44Å; Y122-D261 PolarHBondContact OH-OD2 3.4Å; Y122-D261 VanDerWaalsContact OH-OD2 3.05Å; Y122-L262 HydrophobicContact CD2-CD1 4.11Å; Y122-L262 HydrophobicContact CD2-CD2 4.12Å; Y122-L262 HydrophobicContact CD2-CG 4.14Å; Y122-L262 HydrophobicContact CE2-CD2 3.82Å; Y122-L262 HydrophobicContact CE2-CG 4.07Å
123	L	92.1	Very high	88.4	Confident	67 Å²	67	35.9 Å²	35.9	35%	0.351	21%	0.212	S	C	.	.			trans	-68.5	119	-177.4	-60.3	176.7	0	0	0	111.2	A153 L180 F181 Y182	L123-A153 HydrophobicContact CD1-CB 3.97Å; L123-A153 HydrophobicContact CD2-CB 4.23Å; L123-L180 HydrophobicContact CB-CD2 4.02Å; L123-L180 HydrophobicContact CD1-CD2 4.29Å; L123-F181 WeakPolarHBondContact CB-O 3.26Å; L123-F181 WeakPolarHBondContact CD2-O 3.37Å; L123-Y182 HydrophobicContact CD2-CD1 4.43Å
124	P	93.9	Very high	88.5	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.013	21%	0.212	C	C	.	.			trans	-61.2	147.2	172.1	-19.4	31.6	0	0	0	111.4	Y122 F181 V184 L187 Y254	Y122-P124 VanDerWaalsContact O-CD 3.31Å; Y122-P124 WeakPolarHBondContact O-CD 3.47Å; P124-F181 WeakPolarHBondContact CD-O 3.29Å; P124-F181 WeakPolarHBondContact O-CD2 3.37Å; P124-F181 PolarHBondContact O-N 3.09Å; P124-V184 HydrophobicContact CB-CG2 4.29Å; P124-V184 HydrophobicContact CG-CG2 3.69Å; P124-L187 HydrophobicContact CB-CB 4.35Å; P124-L187 HydrophobicContact CB-CD1 3.49Å; P124-L187 VanDerWaalsContact CB-CD1 3.49Å; P124-Y254 HydrophobicContact CB-CD2 4.12Å; P124-Y254 HydrophobicContact CB-CE2 4.21Å; P124-Y254 HydrophobicContact CG-CD2 3.88Å; P124-Y254 HydrophobicContact CG-CE2 3.63Å
125	Y	95.3	Very high	88	Confident	8 Å²	8	38.1 Å²	38.1	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	166	175.9	71	-96.9	0	0	0	114.1	Y122 Y127 K178 M179 R257 D261	Y122-Y125 HydrophobicContact CE1-CD1 4.32Å; Y122-Y125 HydrophobicContact CE1-CE1 4.2Å; Y125-Y127 HydrophobicContact CE2-CD2 4.42Å; Y125-Y127 HydrophobicContact CE2-CE1 4.35Å; Y125-Y127 AromaticContact CE2-CE2 3.77Å; Y125-Y127 HydrophobicContact CE2-CE2 3.77Å; Y125-Y127 AromaticContact CE2-CZ 3.72Å; Y125-K178 HydrophobicContact CD2-CD 4.17Å; Y125-K178 HydrophobicContact CD2-CG 3.75Å; Y125-K178 HydrophobicContact CE2-CD 4.37Å; Y125-K178 HydrophobicContact CE2-CG 4.35Å; Y125-K178 HydrophobicContact CG-CD 4.37Å; Y125-K178 HydrophobicContact CG-CG 4.03Å; Y125-M179 WeakPolarHBondContact CA-O 3.36Å; Y125-M179 WeakPolarHBondContact CB-O 3.41Å; Y125-R257 PolarHBondContact OH-NH1 3.37Å; Y125-D261 WeakPolarHBondContact CE1-OD2 3.17Å; Y125-D261 PolarHBondContact OH-OD1 3.06Å; Y125-D261 PolarHBondContact OH-OD2 2.8Å; Y125-D261 VanDerWaalsContact OH-OD2 3.13Å
126	F	94.5	Very high	87.6	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	171.7	160.4	57.5	-105.4	0	0	0	110.6	V128 K178 M179 F181 L187 R191 L194 L247	F126-V128 HydrophobicContact CD2-CG2 3.91Å; F126-V128 HydrophobicContact CE2-CG2 3.65Å; F126-K178 WeakPolarHBondContact O-CA 3.48Å; F126-M179 HydrophobicContact CE2-CB 4.4Å; F126-M179 HydrophobicContact CE2-SD 4.02Å; F126-M179 HydrophobicContact CZ-SD 4.48Å; F126-M179 PolarHBondContact N-O 2.79Å; F126-M179 PolarHBondContact O-N 3.09Å; F126-F181 AromaticContact CD1-CE2 3.83Å; F126-F181 HydrophobicContact CD1-CE2 3.83Å; F126-F181 HydrophobicContact CD1-CZ 4.38Å; F126-F181 AromaticContact CE1-CE2 3.43Å; F126-F181 HydrophobicContact CE1-CE2 3.43Å; F126-F181 VanDerWaalsContact CE1-CE2 3.43Å; F126-F181 AromaticContact CE1-CZ 3.54Å; F126-F181 HydrophobicContact CE1-CZ 3.54Å; F126-F181 AromaticContact CZ-CE2 3.93Å; F126-F181 HydrophobicContact CZ-CE2 3.93Å; F126-F181 AromaticContact CZ-CZ 3.68Å; F126-F181 HydrophobicContact CZ-CZ 3.68Å; F126-L187 HydrophobicContact CD1-CD1 4.12Å; F126-L187 HydrophobicContact CD1-CD2 3.9Å; F126-L187 HydrophobicContact CD1-CG 3.69Å; F126-L187 HydrophobicContact CE1-CD2 4.2Å; F126-L187 HydrophobicContact CE1-CG 3.9Å; F126-R191 HydrophobicContact CD1-CB 4.49Å; F126-R191 HydrophobicContact CE1-CB 3.83Å; F126-R191 HydrophobicContact CE1-CG 4.42Å; F126-R191 HydrophobicContact CZ-CB 4.32Å; F126-L194 HydrophobicContact CE2-CD1 4.13Å; F126-L194 HydrophobicContact CZ-CD1 4.13Å; F126-L247 HydrophobicContact CD2-CD2 4.03Å; F126-L247 HydrophobicContact CE2-CD2 3.71Å
127	Y	94.4	Very high	87.1	Confident	8 Å²	8	37.6 Å²	37.6	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	140.1	-179.4	-64.3	-70	0	0	0	111.7	Y125 V158 K160 L177 K178 L247 R248 E249 I550	Y125-Y127 HydrophobicContact CE2-CD2 4.42Å; Y125-Y127 HydrophobicContact CE2-CE1 4.35Å; Y125-Y127 AromaticContact CE2-CE2 3.77Å; Y125-Y127 HydrophobicContact CE2-CE2 3.77Å; Y125-Y127 AromaticContact CE2-CZ 3.72Å; Y127-V158 HydrophobicContact CE1-CB 4.33Å; Y127-V158 HydrophobicContact CE1-CG1 4.43Å; Y127-V158 HydrophobicContact CE1-CG2 4.45Å; Y127-K160 VanDerWaalsContact OH-CE 3.29Å; Y127-K160 WeakPolarHBondContact OH-CE 3.4Å; Y127-L177 CarbonylContact C-O 3.58Å; Y127-L177 WeakPolarHBondContact CA-O 3.44Å; Y127-K178 HydrophobicContact CD1-CB 3.71Å; Y127-K178 HydrophobicContact CD1-CG 4.13Å; Y127-K178 HydrophobicContact CE1-CB 3.67Å; Y127-K178 HydrophobicContact CE1-CD 3.96Å; Y127-K178 HydrophobicContact CE1-CG 3.81Å; Y127-L247 CarbonylContact O-C 3.48Å; Y127-L247 WeakPolarHBondContact O-CA 3.32Å; Y127-R248 PolarHBondContact N-O 3.33Å; Y127-R248 PolarHBondContact O-N 2.78Å; Y127-E249 HydrophobicContact CD2-CB 4.09Å; Y127-E249 HydrophobicContact CD2-CG 4.43Å; Y127-I550 HydrophobicContact CD2-CD1 3.5Å; Y127-I550 HydrophobicContact CE2-CD1 3.96Å; Y127-I550 HydrophobicContact CG-CD1 4.06Å
128	V	91.6	Very high	86.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.4	176.5	-170.4	0	0	0	0	110.6	F126 Y176 L177 M179 I198 L244 D246 L247	F126-V128 HydrophobicContact CD2-CG2 3.91Å; F126-V128 HydrophobicContact CE2-CG2 3.65Å; V128-Y176 WeakPolarHBondContact O-CA 3.47Å; V128-L177 HydrophobicContact CB-CB 4.34Å; V128-L177 PolarHBondContact N-O 3.45Å; V128-L177 PolarHBondContact O-N 3.05Å; V128-M179 HydrophobicContact CG2-CG 4.05Å; V128-M179 HydrophobicContact CG2-SD 3.5Å; V128-M179 WeakPolarHBondContact CG2-SD 3.44Å; V128-I198 HydrophobicContact CG1-CD1 4.06Å; V128-L244 HydrophobicContact CG1-CB 4.5Å; V128-L244 HydrophobicContact CG1-CD2 4.1Å; V128-D246 VanDerWaalsContact CA-O 3.3Å; V128-D246 WeakPolarHBondContact CA-O 3.44Å; V128-D246 WeakPolarHBondContact CG1-O 3.4Å; V128-L247 HydrophobicContact CB-CD2 4.42Å; V128-L247 HydrophobicContact CG1-CD2 4.26Å; V128-L247 HydrophobicContact CG2-CD2 3.68Å
129	L	89.8	Confident	86.1	Confident	39 Å²	39	49 Å²	49	20%	0.204	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	138	175.1	-172.4	57.5	0	0	0	110.5	T175 Y176 F245 D246	L129-T175 WeakPolarHBondContact CD1-O 3.15Å; L129-Y176 HydrophobicContact CB-CD1 4.11Å; L129-Y176 HydrophobicContact CB-CE1 3.73Å; L129-Y176 HydrophobicContact CD1-CD1 4.4Å; L129-Y176 HydrophobicContact CD1-CE1 4.13Å; L129-Y176 HydrophobicContact CG-CE1 4.37Å; L129-F245 HydrophobicContact CD2-CD1 4.24Å; L129-F245 PolarHBondContact O-N 3.01Å; L129-D246 HydrophobicContact CB-CB 3.68Å; L129-D246 HydrophobicContact CD2-CB 4.26Å; L129-D246 PolarHBondContact N-O 3.22Å
130	V	86.5	Confident	85.8	Confident	12 Å²	12	47.3 Å²	47.3	7%	0.073	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.2	-179.8	-169.7	0	0	0	0	110.3	A136 E137 A140 L177 N243 L244	V130-A136 HydrophobicContact CG1-CB 4.11Å; V130-E137 HydrophobicContact CB-CG 4.25Å; V130-A140 HydrophobicContact CG1-CB 4.05Å; V130-A140 HydrophobicContact CG2-CB 4.32Å; V130-L177 HydrophobicContact CG2-CD1 3.68Å; V130-L177 HydrophobicContact CG2-CG 3.87Å; V130-N243 CarbonylContact C-O 3.56Å; V130-N243 WeakPolarHBondContact CA-O 3.45Å; V130-N243 HydrophobicContact CG1-CB 3.85Å; V130-L244 HydrophobicContact CG2-CD2 4.02Å
131	R	79.7	Confident	85.5	Confident	154 Å²	154	46.7 Å²	46.7	58%	0.581	25%	0.254	S	S	*	.	S	Bend	trans	-89.4	147.4	175.8	-164.7	174	-178.3	-173.9	-1	109.7	A136 N243	R131-A136 WeakPolarHBondContact O-CB 3.18Å; R131-N243 PolarHBondContact N-O 2.92Å; R131-N243 WeakPolarHBondContact O-CB 3.39Å
132	G	73.2	Confident	85.3	Confident	61 Å²	61	48.1 Å²	48.1	63%	0.629	27%	0.265	S	S	*	.	S	Bend	trans	101.2	4.1	-179.8	0	0	0	0	0	115.8
133	G	76.1	Confident	85.1	Confident	36 Å²	36	49.4 Å²	49.4	37%	0.371	27%	0.27	S	S	.	.	H	α-helix	trans	70.2	-165.1	172.4	0	0	0	0	0	114.7	A135 A136 E137	G133-A135 PolarHBondContact O-N 2.88Å; G133-A136 PolarHBondContact O-N 2.85Å; G133-E137 WeakPolarHBondContact O-CG 3.44Å; G133-E137 PolarHBondContact O-N 3.45Å
134	Q	75.8	Confident	84.9	Confident	128 Å²	128	46.3 Å²	46.3	60%	0.598	25%	0.253	S	S	*	.	H	α-helix	trans	-57.9	-23.5	-166.1	-65.8	-170.3	10.2	0	0	116.1	E137 R138	Q134-E137 WeakPolarHBondContact CA-OE2 3.45Å; Q134-R138 WeakPolarHBondContact O-CD 3.38Å; Q134-R138 VanDerWaalsContact O-CG 3.22Å; Q134-R138 WeakPolarHBondContact O-CG 3.29Å; Q134-R138 PolarHBondContact O-N 3.18Å
135	A	75.5	Confident	84.5	Confident	67 Å²	67	49.8 Å²	49.8	55%	0.554	27%	0.272	S	S	*	.	H	α-helix	trans	-71.3	-54	172.8	0	0	0	0	0	110.5	G133 E137 R138 D139	G133-A135 PolarHBondContact O-N 2.88Å; A135-E137 VanDerWaalsContact C-N 3.3Å; A135-E137 PolarHBondContact O-N 3.18Å; A135-R138 PolarHBondContact O-N 3.15Å; A135-R138 VanDerWaalsContact O-N 3.13Å; A135-D139 PolarHBondContact O-N 2.84Å
136	A	81.6	Confident	84	Confident	7 Å²	7	57.7 Å²	57.7	6%	0.058	31%	0.306	C	S	.	.	H	α-helix	trans	-60.2	-37.5	176.6	0	0	0	0	0	112.6	V130 R131 G133 R138 D139 A140 N243	V130-A136 HydrophobicContact CG1-CB 4.11Å; R131-A136 WeakPolarHBondContact O-CB 3.18Å; G133-A136 PolarHBondContact O-N 2.85Å; A136-R138 PolarHBondContact O-N 3.32Å; A136-D139 PolarHBondContact O-N 2.91Å; A136-A140 WeakPolarHBondContact O-CB 3.21Å; A136-A140 PolarHBondContact O-N 3.4Å; A136-N243 HydrophobicContact CB-CB 4.15Å
137	E	81	Confident	83.5	Confident	19 Å²	19	64.3 Å²	64.3	9%	0.089	33%	0.331	C	S	.	.	H	α-helix	trans	-58.7	-44.5	173.5	-70.4	172	174.7	0	0	112.4	V130 G133 Q134 A135 N141 T175	V130-E137 HydrophobicContact CB-CG 4.25Å; G133-E137 WeakPolarHBondContact O-CG 3.44Å; G133-E137 PolarHBondContact O-N 3.45Å; Q134-E137 WeakPolarHBondContact CA-OE2 3.45Å; A135-E137 VanDerWaalsContact C-N 3.3Å; A135-E137 PolarHBondContact O-N 3.18Å; E137-N141 WeakPolarHBondContact O-CB 3.48Å; E137-N141 PolarHBondContact O-N 2.83Å; E137-T175 VanDerWaalsContact OE1-CB 3.24Å; E137-T175 WeakPolarHBondContact OE1-CB 3.48Å; E137-T175 PolarHBondContact OE1-OG1 3.43Å
138	R	80.8	Confident	83.2	Confident	154 Å²	154	64.2 Å²	64.2	58%	0.581	33%	0.331	S	S	*	.	H	α-helix	trans	-71.2	-41.3	179.7	-70.7	171.5	-164.4	-175.6	8.2	112	Q134 A135 A136 S142	Q134-R138 WeakPolarHBondContact O-CD 3.38Å; Q134-R138 VanDerWaalsContact O-CG 3.22Å; Q134-R138 WeakPolarHBondContact O-CG 3.29Å; Q134-R138 PolarHBondContact O-N 3.18Å; A135-R138 PolarHBondContact O-N 3.15Å; A135-R138 VanDerWaalsContact O-N 3.13Å; A136-R138 PolarHBondContact O-N 3.32Å; R138-S142 VanDerWaalsContact O-CB 3.31Å; R138-S142 WeakPolarHBondContact O-CB 2.95Å; R138-S142 PolarHBondContact O-N 3.19Å; R138-S142 PolarHBondContact O-OG 3.09Å
139	D	83.3	Confident	82.5	Confident	94 Å²	94	68.4 Å²	68.4	50%	0.503	36%	0.361	S	S	.	.	H	α-helix	trans	-66.9	-43.3	177.5	-71.4	-20.5	0	0	0	111	A135 A136 S142 Y143 P240	A135-D139 PolarHBondContact O-N 2.84Å; A136-D139 PolarHBondContact O-N 2.91Å; D139-S142 PolarHBondContact O-N 2.94Å; D139-Y143 VanDerWaalsContact O-CB 3.3Å; D139-Y143 WeakPolarHBondContact O-CB 3.46Å; D139-Y143 PolarHBondContact O-N 3.3Å; D139-P240 HydrophobicContact CB-CB 4.39Å; D139-P240 HydrophobicContact CB-CG 4.32Å
140	A	85.1	Confident	81.9	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.008	38%	0.382	C	S	.	.	H	α-helix	trans	-63.3	-46.5	174.8	0	0	0	0	0	112	V130 A136 S142 Y143 L144 L177 L244	V130-A140 HydrophobicContact CG1-CB 4.05Å; V130-A140 HydrophobicContact CG2-CB 4.32Å; A136-A140 WeakPolarHBondContact O-CB 3.21Å; A136-A140 PolarHBondContact O-N 3.4Å; A140-S142 PolarHBondContact O-N 3.47Å; A140-Y143 PolarHBondContact O-N 3.33Å; A140-L144 WeakPolarHBondContact O-CB 3.31Å; A140-L144 WeakPolarHBondContact O-CG 3.43Å; A140-L144 PolarHBondContact O-N 3.29Å; A140-L177 HydrophobicContact CB-CD1 4.38Å; A140-L244 HydrophobicContact CB-CD2 4.02Å
141	N	84.7	Confident	81.6	Confident	31 Å²	31	74.2 Å²	74.2	17%	0.166	40%	0.398	C	S	.	.	H	α-helix	trans	-58.5	-48.7	175.8	-176	16.7	0	0	0	111.5	E137 Y143 L144 L145 I155 L177	E137-N141 WeakPolarHBondContact O-CB 3.48Å; E137-N141 PolarHBondContact O-N 2.83Å; N141-Y143 VanDerWaalsContact C-N 3.31Å; N141-Y143 PolarHBondContact O-N 2.6Å; N141-L144 PolarHBondContact O-N 3.18Å; N141-L145 WeakPolarHBondContact O-CB 3.19Å; N141-L145 WeakPolarHBondContact O-CG 3.27Å; N141-L145 PolarHBondContact O-N 3.25Å; N141-L145 WeakPolarHBondContact OD1-CD1 3.37Å; N141-I155 WeakPolarHBondContact OD1-CB 3.43Å; N141-L177 HydrophobicContact CB-CD1 4.41Å
142	S	84.6	Confident	81.8	Confident	78 Å²	78	67.5 Å²	67.5	55%	0.545	37%	0.374	S	S	.	.	H	α-helix	trans	-61.4	-38.6	178	-56.2	0	0	0	0	112.5	R138 D139 A140 K146	R138-S142 VanDerWaalsContact O-CB 3.31Å; R138-S142 WeakPolarHBondContact O-CB 2.95Å; R138-S142 PolarHBondContact O-N 3.19Å; R138-S142 PolarHBondContact O-OG 3.09Å; D139-S142 PolarHBondContact O-N 2.94Å; A140-S142 PolarHBondContact O-N 3.47Å; S142-K146 PolarHBondContact O-N 3.21Å
143	Y	87.5	Confident	82.4	Confident	72 Å²	72	66.3 Å²	66.3	28%	0.282	36%	0.358	S	S	.	.	H	α-helix	trans	-66.7	-50.9	174.8	-175.6	-77.3	0	0	0	111.6	D139 A140 N141 L145 K146 R147 P240 L241	D139-Y143 VanDerWaalsContact O-CB 3.3Å; D139-Y143 WeakPolarHBondContact O-CB 3.46Å; D139-Y143 PolarHBondContact O-N 3.3Å; A140-Y143 PolarHBondContact O-N 3.33Å; N141-Y143 VanDerWaalsContact C-N 3.31Å; N141-Y143 PolarHBondContact O-N 2.6Å; Y143-L145 PolarHBondContact O-N 3.23Å; Y143-K146 PolarHBondContact O-N 3.19Å; Y143-K146 VanDerWaalsContact O-N 3.15Å; Y143-R147 HydrophobicContact CD1-CB 4.02Å; Y143-R147 HydrophobicContact CE1-CB 3.72Å; Y143-R147 HydrophobicContact CE1-CG 3.93Å; Y143-R147 VanDerWaalsContact O-CB 3.31Å; Y143-R147 WeakPolarHBondContact O-CB 3.44Å; Y143-R147 PolarHBondContact O-N 2.78Å; Y143-P240 HydrophobicContact CD2-CB 4.1Å; Y143-P240 HydrophobicContact CD2-CG 4.01Å; Y143-P240 HydrophobicContact CG-CB 4.09Å; Y143-P240 HydrophobicContact CG-CG 4.43Å; Y143-L241 HydrophobicContact CD1-CD2 3.91Å; Y143-L241 HydrophobicContact CD1-CG 4.1Å; Y143-L241 HydrophobicContact CE1-CD1 3.8Å; Y143-L241 HydrophobicContact CE1-CD2 3.59Å; Y143-L241 HydrophobicContact CE1-CG 3.55Å; Y143-L241 HydrophobicContact CE2-CG 4.49Å; Y143-L241 WeakPolarHBondContact OH-CD1 3.17Å
144	L	87.9	Confident	83	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-63.3	-43.3	-174.9	-71.6	169.9	0	0	0	111.9	A140 N141 K146 R147 F148 I155 L177 M179 L194 L244	A140-L144 WeakPolarHBondContact O-CB 3.31Å; A140-L144 WeakPolarHBondContact O-CG 3.43Å; A140-L144 PolarHBondContact O-N 3.29Å; N141-L144 PolarHBondContact O-N 3.18Å; L144-K146 VanDerWaalsContact C-N 3.3Å; L144-K146 PolarHBondContact O-N 3.23Å; L144-R147 PolarHBondContact O-N 3.49Å; L144-F148 HydrophobicContact CD2-CD2 4.03Å; L144-F148 HydrophobicContact CD2-CE2 3.71Å; L144-F148 PolarHBondContact O-N 2.99Å; L144-I155 HydrophobicContact CB-CD1 3.6Å; L144-I155 HydrophobicContact CD1-CD1 4.25Å; L144-L177 HydrophobicContact CD1-CD1 4.08Å; L144-M179 HydrophobicContact CB-CE 4.47Å; L144-M179 HydrophobicContact CD1-CE 4.4Å; L144-M179 HydrophobicContact CD1-SD 4.08Å; L144-M179 HydrophobicContact CD2-CE 4.33Å; L144-L194 HydrophobicContact CD2-CD2 3.94Å; L144-L244 HydrophobicContact CD1-CD2 4.41Å; L144-L244 HydrophobicContact CD2-CD1 4.3Å
145	L	84.6	Confident	83.8	Confident	76 Å²	76	60.5 Å²	60.5	40%	0.398	33%	0.326	S	S	.	.	H	α-helix	trans	-60	-38.3	174.1	-72.9	172.2	0	0	0	112.3	N141 Y143 S149 I155	N141-L145 WeakPolarHBondContact O-CB 3.19Å; N141-L145 WeakPolarHBondContact O-CG 3.27Å; N141-L145 PolarHBondContact O-N 3.25Å; N141-L145 WeakPolarHBondContact OD1-CD1 3.37Å; Y143-L145 PolarHBondContact O-N 3.23Å; L145-S149 WeakPolarHBondContact O-CA 3.4Å; L145-S149 WeakPolarHBondContact O-CB 3.18Å; L145-S149 PolarHBondContact O-N 3.21Å; L145-I155 HydrophobicContact CD2-CB 4.44Å; L145-I155 HydrophobicContact CD2-CD1 4.14Å; L145-I155 HydrophobicContact CD2-CG1 3.89Å; L145-I155 HydrophobicContact CG-CD1 4.04Å; L145-I155 HydrophobicContact CG-CG1 4.27Å
146	K	84.8	Confident	84.5	Confident	173 Å²	173	61.5 Å²	61.5	75%	0.752	32%	0.319	S	S	*	.	H	α-helix	trans	-73	-47.5	177.1	-169.3	176.6	-177.2	178.1	0	111.8	S142 Y143 L144 S149	S142-K146 PolarHBondContact O-N 3.21Å; Y143-K146 PolarHBondContact O-N 3.19Å; Y143-K146 VanDerWaalsContact O-N 3.15Å; L144-K146 VanDerWaalsContact C-N 3.3Å; L144-K146 PolarHBondContact O-N 3.23Å; K146-S149 PolarHBondContact O-OG 3.32Å
147	R	86	Confident	84.9	Confident	139 Å²	139	65.5 Å²	65.5	53%	0.525	34%	0.339	S	S	.	.	H	α-helix	trans	-63.4	-39.3	-177.5	173.9	62	-178.8	-175.7	0.8	112.9	Y143 L144 E193	Y143-R147 HydrophobicContact CD1-CB 4.02Å; Y143-R147 HydrophobicContact CE1-CB 3.72Å; Y143-R147 HydrophobicContact CE1-CG 3.93Å; Y143-R147 VanDerWaalsContact O-CB 3.31Å; Y143-R147 WeakPolarHBondContact O-CB 3.44Å; Y143-R147 PolarHBondContact O-N 2.78Å; L144-R147 PolarHBondContact O-N 3.49Å; R147-E193 IonicContact CZ-OE1 3.76Å; R147-E193 VanDerWaalsContact CZ-OE1 3.32Å; R147-E193 IonicContact NE-OE1 3.7Å; R147-E193 PolarHBondContact NE-OE1 2.84Å; R147-E193 VanDerWaalsContact NE-OE1 3.08Å; R147-E193 IonicContact NH2-OE1 2.65Å; R147-E193 PolarHBondContact NH2-OE1 3.16Å
148	F	86.7	Confident	85.4	Confident	6 Å²	6	66.2 Å²	66.2	3%	0.026	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	27.6	-177.5	-57.5	-64.9	0	0	0	112.7	L144 G150 R151 L152 M179 V190 E193 L194	L144-F148 HydrophobicContact CD2-CD2 4.03Å; L144-F148 HydrophobicContact CD2-CE2 3.71Å; L144-F148 PolarHBondContact O-N 2.99Å; F148-G150 PolarHBondContact O-N 3.1Å; F148-R151 PolarHBondContact O-N 3.01Å; F148-L152 HydrophobicContact CB-CD1 3.72Å; F148-L152 HydrophobicContact CB-CG 3.83Å; F148-L152 PolarHBondContact O-N 2.7Å; F148-L152 VanDerWaalsContact O-N 3.07Å; F148-M179 HydrophobicContact CD2-CE 4.45Å; F148-V190 HydrophobicContact CD1-CG1 4.26Å; F148-V190 HydrophobicContact CD1-CG2 3.85Å; F148-V190 HydrophobicContact CD2-CG1 4.17Å; F148-V190 HydrophobicContact CE1-CG1 4.19Å; F148-V190 HydrophobicContact CE1-CG2 4.19Å; F148-V190 HydrophobicContact CE2-CG1 4.09Å; F148-V190 HydrophobicContact CG-CG1 4.25Å; F148-V190 HydrophobicContact CG-CG2 4.28Å; F148-V190 HydrophobicContact CZ-CG1 4.1Å; F148-E193 HydrophobicContact CE1-CG 4.47Å; F148-E193 WeakPolarHBondContact CE1-OE1 3.5Å; F148-E193 WeakPolarHBondContact CE1-OE2 3.31Å; F148-E193 HydrophobicContact CZ-CG 4.3Å; F148-L194 HydrophobicContact CE2-CD2 4.02Å; F148-L194 HydrophobicContact CE2-CG 4.44Å; F148-L194 HydrophobicContact CZ-CD2 4.29Å
149	S	78	Confident	85.8	Confident	89 Å²	89	61.9 Å²	61.9	62%	0.622	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	136.9	171.9	45.5	0	0	0	0	110.7	L145 K146 R151	L145-S149 WeakPolarHBondContact O-CA 3.4Å; L145-S149 WeakPolarHBondContact O-CB 3.18Å; L145-S149 PolarHBondContact O-N 3.21Å; K146-S149 PolarHBondContact O-OG 3.32Å; S149-R151 VanDerWaalsContact C-N 3.25Å; S149-R151 PolarHBondContact O-N 3.05Å
150	G	76.3	Confident	86.2	Confident	64 Å²	64	57.7 Å²	57.7	66%	0.66	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-30.5	-172.4	0	0	0	0	0	115.7	F148	F148-G150 PolarHBondContact O-N 3.1Å
151	R	81.1	Confident	86.3	Confident	108 Å²	108	59.3 Å²	59.3	41%	0.408	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-23.8	178.7	-61.6	-178.1	-175	169.3	3	114	F148 S149	F148-R151 PolarHBondContact O-N 3.01Å; S149-R151 VanDerWaalsContact C-N 3.25Å; S149-R151 PolarHBondContact O-N 3.05Å
152	L	83.9	Confident	86.5	Confident	14 Å²	14	58.1 Å²	58.1	7%	0.073	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	136.5	172.4	-71.4	172.6	0	0	0	110.8	F148 I155 M179 L180 F181 Y182	F148-L152 HydrophobicContact CB-CD1 3.72Å; F148-L152 HydrophobicContact CB-CG 3.83Å; F148-L152 PolarHBondContact O-N 2.7Å; F148-L152 VanDerWaalsContact O-N 3.07Å; L152-I155 HydrophobicContact CD1-CD1 3.98Å; L152-I155 HydrophobicContact CD1-CG1 4.13Å; L152-M179 HydrophobicContact CD1-CE 3.83Å; L152-M179 HydrophobicContact CD2-CB 4.18Å; L152-M179 HydrophobicContact CD2-CE 3.71Å; L152-M179 HydrophobicContact CG-CE 4.35Å; L152-L180 WeakPolarHBondContact CA-O 3.41Å; L152-L180 WeakPolarHBondContact CD2-O 3.42Å; L152-F181 HydrophobicContact CD2-CD1 3.87Å; L152-F181 HydrophobicContact CD2-CE1 3.41Å; L152-F181 VanDerWaalsContact CD2-CE1 3.41Å; L152-F181 HydrophobicContact CD2-CE2 4.49Å; L152-F181 HydrophobicContact CD2-CZ 3.78Å; L152-F181 HydrophobicContact CG-CE1 4.47Å; L152-Y182 WeakPolarHBondContact O-CE2 3.18Å
153	A	85.3	Confident	86.6	Confident	36 Å²	36	55.6 Å²	55.6	30%	0.298	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-27.7	164.5	0	0	0	0	0	111.6	L123 L180 Y182	L123-A153 HydrophobicContact CD1-CB 3.97Å; L123-A153 HydrophobicContact CD2-CB 4.23Å; A153-L180 HydrophobicContact CB-CB 4.15Å; A153-L180 PolarHBondContact N-O 3.06Å; A153-Y182 HydrophobicContact CB-CD1 4.03Å; A153-Y182 HydrophobicContact CB-CD2 4.38Å; A153-Y182 HydrophobicContact CB-CE1 3.78Å; A153-Y182 HydrophobicContact CB-CE2 4.14Å; A153-Y182 HydrophobicContact CB-CG 4.32Å
154	G	88.6	Confident	86.3	Confident	17 Å²	17	57.2 Å²	57.2	18%	0.175	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171	178.6	175.8	0	0	0	0	0	113.5	L180	G154-L180 PolarHBondContact N-O 3.16Å; G154-L180 PolarHBondContact O-N 3.47Å
155	I	91.6	Very high	85.9	Confident	24 Å²	24	59.9 Å²	59.9	12%	0.123	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	127.9	170	-57	-176.4	0	0	0	108.5	N141 L144 L145 L152 L177 K178 M179	N141-I155 WeakPolarHBondContact OD1-CB 3.43Å; L144-I155 HydrophobicContact CB-CD1 3.6Å; L144-I155 HydrophobicContact CD1-CD1 4.25Å; L145-I155 HydrophobicContact CD2-CB 4.44Å; L145-I155 HydrophobicContact CD2-CD1 4.14Å; L145-I155 HydrophobicContact CD2-CG1 3.89Å; L145-I155 HydrophobicContact CG-CD1 4.04Å; L145-I155 HydrophobicContact CG-CG1 4.27Å; L152-I155 HydrophobicContact CD1-CD1 3.98Å; L152-I155 HydrophobicContact CD1-CG1 4.13Å; I155-L177 HydrophobicContact CG2-CB 3.88Å; I155-L177 HydrophobicContact CG2-CD2 4.24Å; I155-L177 HydrophobicContact CG2-CG 4.44Å; I155-K178 WeakPolarHBondContact CA-O 3.33Å; I155-M179 HydrophobicContact CD1-CE 4.35Å; I155-M179 HydrophobicContact CD1-CG 4.24Å; I155-M179 HydrophobicContact CG1-CG 4.22Å
156	E	91.6	Very high	85.5	Confident	88 Å²	88	60.5 Å²	60.5	41%	0.411	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	141.7	175.4	-62.9	169.9	172.9	0	0	109.9	V158 K178 L180	E156-V158 HydrophobicContact CB-CG2 4.2Å; E156-K178 HydrophobicContact CB-CB 4.26Å; E156-K178 PolarHBondContact N-O 3.01Å; E156-K178 PolarHBondContact O-N 3.38Å; E156-K178 IonicContact OE1-NZ 2.73Å; E156-K178 WeakPolarHBondContact OE2-CD 3.48Å; E156-K178 WeakPolarHBondContact OE2-CE 3.4Å; E156-K178 IonicContact OE2-NZ 3.15Å; E156-K178 PolarHBondContact OE2-NZ 2.86Å; E156-L180 HydrophobicContact CG-CD1 4.04Å
157	I	89.7	Confident	85.2	Confident	91 Å²	91	53.9 Å²	53.9	47%	0.467	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	120.3	171.9	-52.3	-179.2	0	0	0	108	L177	I157-L177 HydrophobicContact CD1-CD2 4.5Å; I157-L177 HydrophobicContact CG1-CD2 3.83Å
158	V	90.9	Very high	85	Confident	34 Å²	34	48.7 Å²	48.7	21%	0.206	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.2	-173.2	-175.7	0	0	0	0	110.1	Y127 E156 Y176 K178	Y127-V158 HydrophobicContact CE1-CB 4.33Å; Y127-V158 HydrophobicContact CE1-CG1 4.43Å; Y127-V158 HydrophobicContact CE1-CG2 4.45Å; E156-V158 HydrophobicContact CB-CG2 4.2Å; V158-Y176 PolarHBondContact N-O 3.38Å; V158-Y176 PolarHBondContact O-N 2.66Å; V158-K178 HydrophobicContact CG2-CB 3.95Å; V158-K178 HydrophobicContact CG2-CD 4.2Å
159	S	89.7	Confident	84.8	Confident	63 Å²	63	49.6 Å²	49.6	44%	0.441	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.4	172.3	54.4	0	0	0	0	111.6	A174 N548	S159-A174 WeakPolarHBondContact CA-O 3.49Å; S159-N548 PolarHBondContact O-ND2 2.84Å; S159-N548 VanDerWaalsContact O-ND2 3.14Å
160	K	91.2	Very high	85	Confident	7 Å²	7	47.4 Å²	47.4	3%	0.03	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	149.1	-178.1	-77.6	-77	178.7	-174	0	111.2	Y127 D162 K173 A174 Y176 N548 I550	Y127-K160 VanDerWaalsContact OH-CE 3.29Å; Y127-K160 WeakPolarHBondContact OH-CE 3.4Å; K160-D162 PolarHBondContact O-N 3.13Å; K160-K173 WeakPolarHBondContact O-CA 2.83Å; K160-K173 WeakPolarHBondContact O-CB 3.32Å; K160-A174 PolarHBondContact N-O 3.29Å; K160-A174 PolarHBondContact O-N 2.98Å; K160-A174 VanDerWaalsContact O-N 3.07Å; K160-Y176 HydrophobicContact CB-CD2 4.04Å; K160-Y176 HydrophobicContact CB-CE2 4.27Å; K160-Y176 HydrophobicContact CG-CD2 4.39Å; K160-N548 WeakPolarHBondContact CD-O 3.46Å; K160-N548 WeakPolarHBondContact CD-OD1 3.2Å; K160-N548 WeakPolarHBondContact CE-OD1 3.47Å; K160-N548 PolarHBondContact NZ-OD1 3.06Å; K160-I550 HydrophobicContact CB-CB 4.21Å; K160-I550 HydrophobicContact CB-CD1 4.38Å; K160-I550 HydrophobicContact CD-CD1 4.49Å; K160-I550 HydrophobicContact CG-CD1 4.02Å
161	N	88	Confident	84.9	Confident	34 Å²	34	46.5 Å²	46.5	18%	0.182	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-72.5	114.8	165.7	-57.8	-26.1	0	0	0	106.6	K173 A547 N548 V549 I550	N161-K173 WeakPolarHBondContact OD1-CE 3.43Å; N161-A547 PolarHBondContact ND2-O 2.95Å; N161-N548 WeakPolarHBondContact CB-O 3.42Å; N161-N548 PolarHBondContact N-O 2.86Å; N161-V549 HydrophobicContact CB-CG2 4.28Å; N161-V549 WeakPolarHBondContact O-CA 3.43Å; N161-I550 PolarHBondContact O-N 2.81Å
162	D	88.4	Confident	84.7	Confident	7 Å²	7	43.4 Å²	43.4	4%	0.037	26%	0.264	C	S	.	.			trans	-116.3	114.7	177.6	-168.2	-25.6	0	0	0	108.5	K160 D164 L165 A174 Y176 R248 I550	K160-D162 PolarHBondContact O-N 3.13Å; D162-D164 VanDerWaalsContact C-N 3.28Å; D162-D164 WeakPolarHBondContact OD1-CB 3.43Å; D162-D164 PolarHBondContact OD1-N 3.38Å; D162-L165 HydrophobicContact CB-CD1 4.07Å; D162-L165 HydrophobicContact CB-CG 4.02Å; D162-L165 WeakPolarHBondContact O-CB 3.47Å; D162-L165 PolarHBondContact O-N 3.41Å; D162-A174 HydrophobicContact CB-CB 3.96Å; D162-Y176 PolarHBondContact OD2-OH 2.88Å; D162-R248 VanDerWaalsContact CG-NH2 3.28Å; D162-R248 IonicContact OD1-NH2 2.75Å; D162-R248 PolarHBondContact OD1-NH2 2.93Å; D162-R248 IonicContact OD2-CZ 3.49Å; D162-R248 IonicContact OD2-NE 3.79Å; D162-R248 IonicContact OD2-NH2 2.72Å; D162-R248 PolarHBondContact OD2-NH2 3.15Å; D162-I550 HydrophobicContact CB-CG2 3.88Å
163	L	86.2	Confident	84.6	Confident	24 Å²	24	48.2 Å²	48.2	13%	0.126	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-10.4	-174.7	-52.4	-179.1	0	0	0	112.1	L165 H168 V549 N816 F818	L163-L165 VanDerWaalsContact C-N 3.29Å; L163-H168 PolarHBondContact O-CE1 3.48Å; L163-H168 VanDerWaalsContact O-CE1 3.3Å; L163-H168 PolarHBondContact O-ND1 3.38Å; L163-V549 HydrophobicContact CD1-CG1 4.02Å; L163-V549 HydrophobicContact CG-CG1 4.14Å; L163-N816 HydrophobicContact CD1-CB 4.3Å; L163-N816 HydrophobicContact CD2-CB 3.64Å; L163-F818 HydrophobicContact CD1-CD1 4.29Å; L163-F818 HydrophobicContact CD1-CE1 3.84Å
164	D	81.5	Confident	84.7	Confident	107 Å²	107	46.9 Å²	46.9	57%	0.572	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-9.8	172.1	-58.9	-30.5	0	0	0	111.8	D162 R248	D162-D164 VanDerWaalsContact C-N 3.28Å; D162-D164 WeakPolarHBondContact OD1-CB 3.43Å; D162-D164 PolarHBondContact OD1-N 3.38Å; D164-R248 IonicContact OD2-CZ 3.69Å; D164-R248 VanDerWaalsContact OD2-CZ 3.25Å; D164-R248 IonicContact OD2-NH1 3.4Å; D164-R248 PolarHBondContact OD2-NH1 3.34Å; D164-R248 IonicContact OD2-NH2 3.95Å; D164-R248 PolarHBondContact OD2-NH2 2.86Å
165	L	79.8	Confident	84.7	Confident	57 Å²	57	48.7 Å²	48.7	30%	0.298	28%	0.282	S	S	.	.	S	Bend	trans	-68.3	136.5	174.8	-78.9	174.3	0	0	0	111.6	D162 L163 H168 A174	D162-L165 HydrophobicContact CB-CD1 4.07Å; D162-L165 HydrophobicContact CB-CG 4.02Å; D162-L165 WeakPolarHBondContact O-CB 3.47Å; D162-L165 PolarHBondContact O-N 3.41Å; L163-L165 VanDerWaalsContact C-N 3.29Å; L165-H168 HydrophobicContact CB-CB 4Å; L165-H168 PolarHBondContact O-ND1 3.07Å; L165-A174 HydrophobicContact CD1-CB 3.98Å
166	P	76.6	Confident	84.6	Confident	89 Å²	89	47.6 Å²	47.6	58%	0.578	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	141.2	162.5	-23.1	33.9	0	0	0	111.2	H168 D711	P166-H168 PolarHBondContact O-N 3.45Å; P166-D711 HydrophobicContact CB-CB 4.34Å
167	N	78.8	Confident	84.7	Confident	33 Å²	33	43.5 Å²	43.5	18%	0.176	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	18.7	176.6	-161.4	31.9	0	0	0	116.3	L169 V170 D711 C712 E713	N167-L169 PolarHBondContact O-N 2.87Å; N167-V170 WeakPolarHBondContact O-CG2 3.42Å; N167-V170 PolarHBondContact O-N 3Å; N167-V170 VanDerWaalsContact O-N 3.16Å; N167-D711 WeakPolarHBondContact CB-O 3.43Å; N167-C712 WeakPolarHBondContact OD1-CA 3.38Å; N167-E713 PolarHBondContact ND2-OE1 2.96Å; N167-E713 PolarHBondContact OD1-N 3.47Å
168	H	81.6	Confident	84.9	Confident	31 Å²	31	40.6 Å²	40.6	14%	0.144	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-55.8	-20.2	-174.9	67.8	-104.5	0	0	0	115	L163 L165 P166 V170 G171 E815	L163-H168 PolarHBondContact O-CE1 3.48Å; L163-H168 VanDerWaalsContact O-CE1 3.3Å; L163-H168 PolarHBondContact O-ND1 3.38Å; L165-H168 HydrophobicContact CB-CB 4Å; L165-H168 PolarHBondContact O-ND1 3.07Å; P166-H168 PolarHBondContact O-N 3.45Å; H168-V170 PolarHBondContact O-N 2.91Å; H168-V170 VanDerWaalsContact O-N 3.15Å; H168-G171 PolarHBondContact O-N 3.02Å; H168-E815 IonicContact CE1-OE1 2.95Å; H168-E815 IonicContact CE1-OE2 2.71Å; H168-E815 IonicContact NE2-OE1 3.43Å; H168-E815 PolarHBondContact NE2-OE1 2.88Å; H168-E815 IonicContact NE2-OE2 3.91Å; H168-E815 PolarHBondContact NE2-OE2 3.16Å
169	L	82.6	Confident	85	Confident	24 Å²	24	39 Å²	39	13%	0.126	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-60.8	-18	177.9	-58.1	179.5	0	0	0	114.3	N167 G171 F714 R814	N167-L169 PolarHBondContact O-N 2.87Å; L169-G171 PolarHBondContact O-N 2.97Å; L169-F714 HydrophobicContact CB-CD2 4.06Å; L169-F714 HydrophobicContact CB-CE2 3.81Å; L169-R814 HydrophobicContact CD1-CB 4.37Å
170	V	81.3	Confident	85.2	Confident	43 Å²	43	36.9 Å²	36.9	26%	0.261	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-81.1	8.6	171.9	-53.4	0	0	0	0	113.5	N167 H168 A172 E713 F714 L989	N167-V170 WeakPolarHBondContact O-CG2 3.42Å; N167-V170 PolarHBondContact O-N 3Å; N167-V170 VanDerWaalsContact O-N 3.16Å; H168-V170 PolarHBondContact O-N 2.91Å; H168-V170 VanDerWaalsContact O-N 3.15Å; V170-A172 HydrophobicContact CG2-CB 4.27Å; V170-E713 HydrophobicContact CG1-CB 3.93Å; V170-E713 HydrophobicContact CG1-CG 4.45Å; V170-F714 HydrophobicContact CG1-CE2 4.16Å; V170-L989 HydrophobicContact CB-CD1 4.48Å
171	G	73.5	Confident	85.3	Confident	46 Å²	46	36.5 Å²	36.5	47%	0.474	21%	0.213	S	C	.	.			trans	82.2	14.8	-177.2	0	0	0	0	0	114	H168 L169	H168-G171 PolarHBondContact O-N 3.02Å; L169-G171 PolarHBondContact O-N 2.97Å
172	A	77	Confident	85.3	Confident	43 Å²	43	37 Å²	37	36%	0.355	21%	0.212	S	C	.	.			trans	-63.5	132.2	173.4	0	0	0	0	0	110.7	V170	V170-A172 HydrophobicContact CG2-CB 4.27Å
173	K	83.2	Confident	85.3	Confident	114 Å²	114	36.8 Å²	36.8	50%	0.496	21%	0.212	S	C	.	.			trans	-124.1	137.8	-175.2	-68.6	173.2	-168.1	177.8	0	110.2	K160 N161	K160-K173 WeakPolarHBondContact O-CA 2.83Å; K160-K173 WeakPolarHBondContact O-CB 3.32Å; N161-K173 WeakPolarHBondContact OD1-CE 3.43Å
174	A	86.9	Confident	85.3	Confident	8 Å²	8	37.9 Å²	37.9	7%	0.066	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	137.7	173.8	0	0	0	0	0	110.4	S159 K160 D162 L165 Y176	S159-A174 WeakPolarHBondContact CA-O 3.49Å; K160-A174 PolarHBondContact N-O 3.29Å; K160-A174 PolarHBondContact O-N 2.98Å; K160-A174 VanDerWaalsContact O-N 3.07Å; D162-A174 HydrophobicContact CB-CB 3.96Å; L165-A174 HydrophobicContact CD1-CB 3.98Å; A174-Y176 HydrophobicContact CB-CD2 3.95Å; A174-Y176 HydrophobicContact CB-CE2 3.44Å; A174-Y176 VanDerWaalsContact CB-CE2 3.44Å
175	T	87.8	Confident	85.5	Confident	56 Å²	56	35.4 Å²	35.4	34%	0.344	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	128.2	169.3	39	0	0	0	0	110.3	L129 E137	L129-T175 WeakPolarHBondContact CD1-O 3.15Å; E137-T175 VanDerWaalsContact OE1-CB 3.24Å; E137-T175 WeakPolarHBondContact OE1-CB 3.48Å; E137-T175 PolarHBondContact OE1-OG1 3.43Å
176	Y	91.5	Very high	85.8	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	137.4	-177.3	-79.7	-81.2	0	0	0	110.6	V128 L129 V158 K160 D162 A174 K178 R248 I550	V128-Y176 WeakPolarHBondContact O-CA 3.47Å; L129-Y176 HydrophobicContact CB-CD1 4.11Å; L129-Y176 HydrophobicContact CB-CE1 3.73Å; L129-Y176 HydrophobicContact CD1-CD1 4.4Å; L129-Y176 HydrophobicContact CD1-CE1 4.13Å; L129-Y176 HydrophobicContact CG-CE1 4.37Å; V158-Y176 PolarHBondContact N-O 3.38Å; V158-Y176 PolarHBondContact O-N 2.66Å; K160-Y176 HydrophobicContact CB-CD2 4.04Å; K160-Y176 HydrophobicContact CB-CE2 4.27Å; K160-Y176 HydrophobicContact CG-CD2 4.39Å; D162-Y176 PolarHBondContact OD2-OH 2.88Å; A174-Y176 HydrophobicContact CB-CD2 3.95Å; A174-Y176 HydrophobicContact CB-CE2 3.44Å; A174-Y176 VanDerWaalsContact CB-CE2 3.44Å; Y176-K178 PolarHBondContact O-N 3.41Å; Y176-R248 HydrophobicContact CE1-CB 4.18Å; Y176-R248 HydrophobicContact CE1-CG 3.54Å; Y176-R248 WeakPolarHBondContact OH-CG 3.22Å; Y176-R248 PolarHBondContact OH-NE 2.91Å; Y176-R248 VanDerWaalsContact OH-NE 3.13Å; Y176-I550 HydrophobicContact CD2-CD1 4.36Å; Y176-I550 HydrophobicContact CE2-CD1 4.16Å; Y176-I550 HydrophobicContact CE2-CG1 4.27Å
177	L	91.8	Very high	86.5	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	108.7	167.2	-59.9	-173.1	0	0	0	109	Y127 V128 V130 A140 N141 L144 I155 I157 M179	Y127-L177 CarbonylContact C-O 3.58Å; Y127-L177 WeakPolarHBondContact CA-O 3.44Å; V128-L177 HydrophobicContact CB-CB 4.34Å; V128-L177 PolarHBondContact N-O 3.45Å; V128-L177 PolarHBondContact O-N 3.05Å; V130-L177 HydrophobicContact CG2-CD1 3.68Å; V130-L177 HydrophobicContact CG2-CG 3.87Å; A140-L177 HydrophobicContact CB-CD1 4.38Å; N141-L177 HydrophobicContact CB-CD1 4.41Å; L144-L177 HydrophobicContact CD1-CD1 4.08Å; I155-L177 HydrophobicContact CG2-CB 3.88Å; I155-L177 HydrophobicContact CG2-CD2 4.24Å; I155-L177 HydrophobicContact CG2-CG 4.44Å; I157-L177 HydrophobicContact CD1-CD2 4.5Å; I157-L177 HydrophobicContact CG1-CD2 3.83Å; L177-M179 PolarHBondContact O-N 2.96Å
178	K	94.1	Very high	86.8	Confident	31 Å²	31	31.5 Å²	31.5	14%	0.135	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	107	172.8	-179.6	-177.6	156.5	-151.3	0	108.8	Y125 F126 Y127 I155 E156 V158 Y176	Y125-K178 HydrophobicContact CD2-CD 4.17Å; Y125-K178 HydrophobicContact CD2-CG 3.75Å; Y125-K178 HydrophobicContact CE2-CD 4.37Å; Y125-K178 HydrophobicContact CE2-CG 4.35Å; Y125-K178 HydrophobicContact CG-CD 4.37Å; Y125-K178 HydrophobicContact CG-CG 4.03Å; F126-K178 WeakPolarHBondContact O-CA 3.48Å; Y127-K178 HydrophobicContact CD1-CB 3.71Å; Y127-K178 HydrophobicContact CD1-CG 4.13Å; Y127-K178 HydrophobicContact CE1-CB 3.67Å; Y127-K178 HydrophobicContact CE1-CD 3.96Å; Y127-K178 HydrophobicContact CE1-CG 3.81Å; I155-K178 WeakPolarHBondContact CA-O 3.33Å; E156-K178 HydrophobicContact CB-CB 4.26Å; E156-K178 PolarHBondContact N-O 3.01Å; E156-K178 PolarHBondContact O-N 3.38Å; E156-K178 IonicContact OE1-NZ 2.73Å; E156-K178 WeakPolarHBondContact OE2-CD 3.48Å; E156-K178 WeakPolarHBondContact OE2-CE 3.4Å; E156-K178 IonicContact OE2-NZ 3.15Å; E156-K178 PolarHBondContact OE2-NZ 2.86Å; V158-K178 HydrophobicContact CG2-CB 3.95Å; V158-K178 HydrophobicContact CG2-CD 4.2Å; Y176-K178 PolarHBondContact O-N 3.41Å
179	M	93.9	Very high	87	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.9	-178.5	-63.7	-175.5	64	0	0	110.4	Y125 F126 V128 L144 F148 L152 I155 L177 F181 V190 L194	Y125-M179 WeakPolarHBondContact CA-O 3.36Å; Y125-M179 WeakPolarHBondContact CB-O 3.41Å; F126-M179 HydrophobicContact CE2-CB 4.4Å; F126-M179 HydrophobicContact CE2-SD 4.02Å; F126-M179 HydrophobicContact CZ-SD 4.48Å; F126-M179 PolarHBondContact N-O 2.79Å; F126-M179 PolarHBondContact O-N 3.09Å; V128-M179 HydrophobicContact CG2-CG 4.05Å; V128-M179 HydrophobicContact CG2-SD 3.5Å; V128-M179 WeakPolarHBondContact CG2-SD 3.44Å; L144-M179 HydrophobicContact CB-CE 4.47Å; L144-M179 HydrophobicContact CD1-CE 4.4Å; L144-M179 HydrophobicContact CD1-SD 4.08Å; L144-M179 HydrophobicContact CD2-CE 4.33Å; F148-M179 HydrophobicContact CD2-CE 4.45Å; L152-M179 HydrophobicContact CD1-CE 3.83Å; L152-M179 HydrophobicContact CD2-CB 4.18Å; L152-M179 HydrophobicContact CD2-CE 3.71Å; L152-M179 HydrophobicContact CG-CE 4.35Å; I155-M179 HydrophobicContact CD1-CE 4.35Å; I155-M179 HydrophobicContact CD1-CG 4.24Å; I155-M179 HydrophobicContact CG1-CG 4.22Å; L177-M179 PolarHBondContact O-N 2.96Å; M179-F181 HydrophobicContact CB-CE2 3.96Å; M179-F181 HydrophobicContact CB-CZ 4Å; M179-F181 HydrophobicContact CE-CZ 4.41Å; M179-F181 WeakPolarHBondContact O-CD2 3.31Å; M179-F181 VanDerWaalsContact O-CE2 3.27Å; M179-F181 WeakPolarHBondContact O-CE2 3.49Å; M179-V190 HydrophobicContact CE-CG1 4.2Å; M179-L194 HydrophobicContact CE-CD1 3.94Å; M179-L194 HydrophobicContact SD-CD1 3.66Å
180	L	93.3	Very high	87.2	Confident	18 Å²	18	34.2 Å²	34.2	9%	0.094	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	136	-177.2	-67.7	154.3	0	0	0	110.9	L123 L152 A153 G154 E156	L123-L180 HydrophobicContact CB-CD2 4.02Å; L123-L180 HydrophobicContact CD1-CD2 4.29Å; L152-L180 WeakPolarHBondContact CA-O 3.41Å; L152-L180 WeakPolarHBondContact CD2-O 3.42Å; A153-L180 HydrophobicContact CB-CB 4.15Å; A153-L180 PolarHBondContact N-O 3.06Å; G154-L180 PolarHBondContact N-O 3.16Å; G154-L180 PolarHBondContact O-N 3.47Å; E156-L180 HydrophobicContact CG-CD1 4.04Å
181	F	94.1	Very high	87.5	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	158.4	-179.5	-58.1	-85	0	0	0	110.8	L123 P124 F126 L152 M179 E186 L187 V190	L123-F181 WeakPolarHBondContact CB-O 3.26Å; L123-F181 WeakPolarHBondContact CD2-O 3.37Å; P124-F181 WeakPolarHBondContact CD-O 3.29Å; P124-F181 WeakPolarHBondContact O-CD2 3.37Å; P124-F181 PolarHBondContact O-N 3.09Å; F126-F181 AromaticContact CD1-CE2 3.83Å; F126-F181 HydrophobicContact CD1-CE2 3.83Å; F126-F181 HydrophobicContact CD1-CZ 4.38Å; F126-F181 AromaticContact CE1-CE2 3.43Å; F126-F181 HydrophobicContact CE1-CE2 3.43Å; F126-F181 VanDerWaalsContact CE1-CE2 3.43Å; F126-F181 AromaticContact CE1-CZ 3.54Å; F126-F181 HydrophobicContact CE1-CZ 3.54Å; F126-F181 AromaticContact CZ-CE2 3.93Å; F126-F181 HydrophobicContact CZ-CE2 3.93Å; F126-F181 AromaticContact CZ-CZ 3.68Å; F126-F181 HydrophobicContact CZ-CZ 3.68Å; L152-F181 HydrophobicContact CD2-CD1 3.87Å; L152-F181 HydrophobicContact CD2-CE1 3.41Å; L152-F181 VanDerWaalsContact CD2-CE1 3.41Å; L152-F181 HydrophobicContact CD2-CE2 4.49Å; L152-F181 HydrophobicContact CD2-CZ 3.78Å; L152-F181 HydrophobicContact CG-CE1 4.47Å; M179-F181 HydrophobicContact CB-CE2 3.96Å; M179-F181 HydrophobicContact CB-CZ 4Å; M179-F181 HydrophobicContact CE-CZ 4.41Å; M179-F181 WeakPolarHBondContact O-CD2 3.31Å; M179-F181 VanDerWaalsContact O-CE2 3.27Å; M179-F181 WeakPolarHBondContact O-CE2 3.49Å; F181-E186 HydrophobicContact CB-CB 4.39Å; F181-E186 HydrophobicContact CD1-CB 4.15Å; F181-L187 HydrophobicContact CB-CB 4.16Å; F181-L187 HydrophobicContact CD1-CB 4.4Å; F181-L187 HydrophobicContact CD2-CB 3.62Å; F181-L187 HydrophobicContact CD2-CD1 3.91Å; F181-L187 HydrophobicContact CD2-CG 3.76Å; F181-L187 HydrophobicContact CE2-CB 4.12Å; F181-L187 HydrophobicContact CE2-CD1 4.32Å; F181-L187 HydrophobicContact CE2-CG 3.92Å; F181-L187 HydrophobicContact CG-CB 3.78Å; F181-L187 HydrophobicContact CG-CG 4.43Å; F181-V190 HydrophobicContact CE1-CB 3.61Å; F181-V190 HydrophobicContact CE1-CG1 3.9Å; F181-V190 HydrophobicContact CE1-CG2 3.82Å; F181-V190 HydrophobicContact CZ-CB 4.02Å; F181-V190 HydrophobicContact CZ-CG1 4.02Å
182	Y	88	Confident	88	Confident	43 Å²	43	40.7 Å²	40.7	17%	0.169	20%	0.198	C	C	.	.	S	Bend	trans	-77.4	-36.6	173.5	-62.1	-77.7	0	0	0	111.5	R99 V101 S102 L123 L152 A153 E186	R99-Y182 PolarHBondContact NH1-OH 3.1Å; V101-Y182 VanDerWaalsContact CA-O 3.31Å; V101-Y182 WeakPolarHBondContact CA-O 3.37Å; V101-Y182 HydrophobicContact CG1-CD1 4.33Å; S102-Y182 PolarHBondContact N-O 3.03Å; L123-Y182 HydrophobicContact CD2-CD1 4.43Å; L152-Y182 WeakPolarHBondContact O-CE2 3.18Å; A153-Y182 HydrophobicContact CB-CD1 4.03Å; A153-Y182 HydrophobicContact CB-CD2 4.38Å; A153-Y182 HydrophobicContact CB-CE1 3.78Å; A153-Y182 HydrophobicContact CB-CE2 4.14Å; A153-Y182 HydrophobicContact CB-CG 4.32Å; Y182-E186 WeakPolarHBondContact CB-OE2 3.48Å; Y182-E186 PolarHBondContact N-OE2 3.33Å
183	S	88.2	Confident	88.3	Confident	4 Å²	4	42 Å²	42	3%	0.028	20%	0.196	C	C	.	.	S	Bend	trans	-140.6	161.1	-178.9	68.3	0	0	0	0	114.5	S102 D185 E186 L187	S102-S183 WeakPolarHBondContact OG-CA 3.28Å; S183-D185 VanDerWaalsContact C-N 3.28Å; S183-D185 PolarHBondContact O-N 2.67Å; S183-E186 PolarHBondContact N-OE2 3.24Å; S183-E186 PolarHBondContact O-N 3.05Å; S183-E186 PolarHBondContact OG-OE2 3.13Å; S183-L187 PolarHBondContact O-N 3.22Å
184	V	86.2	Confident	88.5	Confident	47 Å²	47	36.7 Å²	36.7	29%	0.285	17%	0.174	S	C	.	.	H	α-helix	trans	-64.1	-32.1	-177.8	179.4	0	0	0	0	112	S102 P124 E186 L187 V188 Y254	S102-V184 PolarHBondContact OG-N 3.28Å; P124-V184 HydrophobicContact CB-CG2 4.29Å; P124-V184 HydrophobicContact CG-CG2 3.69Å; V184-E186 PolarHBondContact O-N 3.19Å; V184-L187 WeakPolarHBondContact O-CB 3.4Å; V184-L187 PolarHBondContact O-N 3.06Å; V184-V188 HydrophobicContact CG1-CG2 4.35Å; V184-V188 WeakPolarHBondContact O-CG2 3.42Å; V184-V188 PolarHBondContact O-N 3.3Å; V184-Y254 HydrophobicContact CG2-CD1 4.14Å; V184-Y254 HydrophobicContact CG2-CD2 3.8Å; V184-Y254 HydrophobicContact CG2-CE2 4.39Å; V184-Y254 HydrophobicContact CG2-CG 3.65Å
185	D	84.8	Confident	88.4	Confident	54 Å²	54	38.3 Å²	38.3	29%	0.289	19%	0.187	S	C	.	.	H	α-helix	trans	-62.7	-40.1	175.9	-78.6	-14.4	0	0	0	112.4	R56 S183 V188 R189	R56-D185 VanDerWaalsContact CD-OD2 3.29Å; R56-D185 WeakPolarHBondContact CD-OD2 3.37Å; R56-D185 IonicContact CZ-OD2 3.1Å; R56-D185 IonicContact NE-OD2 2.84Å; R56-D185 IonicContact NH1-OD2 2.98Å; R56-D185 PolarHBondContact NH1-OD2 3.37Å; S183-D185 VanDerWaalsContact C-N 3.28Å; S183-D185 PolarHBondContact O-N 2.67Å; D185-V188 PolarHBondContact O-N 2.77Å; D185-R189 WeakPolarHBondContact O-CB 3.33Å; D185-R189 WeakPolarHBondContact O-CD 3.37Å; D185-R189 WeakPolarHBondContact O-CG 3.38Å; D185-R189 PolarHBondContact O-N 2.78Å
186	E	86.5	Confident	88.1	Confident	35 Å²	35	40.8 Å²	40.8	16%	0.164	20%	0.201	C	C	.	.	H	α-helix	trans	-68.9	-42.3	178.1	-66.2	163.3	121.5	0	0	111.1	F181 Y182 S183 V184 V188 R189 V190	F181-E186 HydrophobicContact CB-CB 4.39Å; F181-E186 HydrophobicContact CD1-CB 4.15Å; Y182-E186 WeakPolarHBondContact CB-OE2 3.48Å; Y182-E186 PolarHBondContact N-OE2 3.33Å; S183-E186 PolarHBondContact N-OE2 3.24Å; S183-E186 PolarHBondContact O-N 3.05Å; S183-E186 PolarHBondContact OG-OE2 3.13Å; V184-E186 PolarHBondContact O-N 3.19Å; E186-V188 VanDerWaalsContact C-N 3.32Å; E186-V188 PolarHBondContact O-N 3.49Å; E186-R189 PolarHBondContact O-N 3.22Å; E186-V190 PolarHBondContact O-N 2.76Å
187	L	90.5	Very high	87.6	Confident	17 Å²	17	43.5 Å²	43.5	9%	0.089	21%	0.212	C	C	.	.	H	α-helix	trans	-54.9	-49.6	171.8	-176.8	158.9	0	0	0	110.3	P124 F126 F181 S183 V184 R189 V190 R191	P124-L187 HydrophobicContact CB-CB 4.35Å; P124-L187 HydrophobicContact CB-CD1 3.49Å; P124-L187 VanDerWaalsContact CB-CD1 3.49Å; F126-L187 HydrophobicContact CD1-CD1 4.12Å; F126-L187 HydrophobicContact CD1-CD2 3.9Å; F126-L187 HydrophobicContact CD1-CG 3.69Å; F126-L187 HydrophobicContact CE1-CD2 4.2Å; F126-L187 HydrophobicContact CE1-CG 3.9Å; F181-L187 HydrophobicContact CB-CB 4.16Å; F181-L187 HydrophobicContact CD1-CB 4.4Å; F181-L187 HydrophobicContact CD2-CB 3.62Å; F181-L187 HydrophobicContact CD2-CD1 3.91Å; F181-L187 HydrophobicContact CD2-CG 3.76Å; F181-L187 HydrophobicContact CE2-CB 4.12Å; F181-L187 HydrophobicContact CE2-CD1 4.32Å; F181-L187 HydrophobicContact CE2-CG 3.92Å; F181-L187 HydrophobicContact CG-CB 3.78Å; F181-L187 HydrophobicContact CG-CG 4.43Å; S183-L187 PolarHBondContact O-N 3.22Å; V184-L187 WeakPolarHBondContact O-CB 3.4Å; V184-L187 PolarHBondContact O-N 3.06Å; L187-R189 PolarHBondContact O-N 2.89Å; L187-V190 PolarHBondContact O-N 2.89Å; L187-R191 WeakPolarHBondContact O-CB 3.46Å; L187-R191 PolarHBondContact O-N 3.43Å
188	V	86.4	Confident	87.2	Confident	45 Å²	45	43.8 Å²	43.8	27%	0.273	21%	0.213	S	C	.	.	H	α-helix	trans	-65.3	-37.1	180	170.5	0	0	0	0	112	V184 D185 E186 K192	V184-V188 HydrophobicContact CG1-CG2 4.35Å; V184-V188 WeakPolarHBondContact O-CG2 3.42Å; V184-V188 PolarHBondContact O-N 3.3Å; D185-V188 PolarHBondContact O-N 2.77Å; E186-V188 VanDerWaalsContact C-N 3.32Å; E186-V188 PolarHBondContact O-N 3.49Å; V188-K192 WeakPolarHBondContact O-CG 3.36Å; V188-K192 PolarHBondContact O-N 2.83Å
189	R	84.7	Confident	86.3	Confident	113 Å²	113	48.1 Å²	48.1	43%	0.426	23%	0.229	S	C	.	.	H	α-helix	trans	-64.7	-50.4	175.3	-72.2	166.1	-168	-157.7	4.1	111.5	D185 E186 L187 K192 E193	D185-R189 WeakPolarHBondContact O-CB 3.33Å; D185-R189 WeakPolarHBondContact O-CD 3.37Å; D185-R189 WeakPolarHBondContact O-CG 3.38Å; D185-R189 PolarHBondContact O-N 2.78Å; E186-R189 PolarHBondContact O-N 3.22Å; L187-R189 PolarHBondContact O-N 2.89Å; R189-K192 PolarHBondContact O-N 3.49Å; R189-E193 PolarHBondContact O-N 2.83Å
190	V	87.5	Confident	85.6	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-72.9	-35.4	-178.5	176.5	0	0	0	0	111.8	F148 M179 F181 E186 L187 K192 E193 L194	F148-V190 HydrophobicContact CD1-CG1 4.26Å; F148-V190 HydrophobicContact CD1-CG2 3.85Å; F148-V190 HydrophobicContact CD2-CG1 4.17Å; F148-V190 HydrophobicContact CE1-CG1 4.19Å; F148-V190 HydrophobicContact CE1-CG2 4.19Å; F148-V190 HydrophobicContact CE2-CG1 4.09Å; F148-V190 HydrophobicContact CG-CG1 4.25Å; F148-V190 HydrophobicContact CG-CG2 4.28Å; F148-V190 HydrophobicContact CZ-CG1 4.1Å; M179-V190 HydrophobicContact CE-CG1 4.2Å; F181-V190 HydrophobicContact CE1-CB 3.61Å; F181-V190 HydrophobicContact CE1-CG1 3.9Å; F181-V190 HydrophobicContact CE1-CG2 3.82Å; F181-V190 HydrophobicContact CZ-CB 4.02Å; F181-V190 HydrophobicContact CZ-CG1 4.02Å; E186-V190 PolarHBondContact O-N 2.76Å; L187-V190 PolarHBondContact O-N 2.89Å; V190-K192 VanDerWaalsContact C-N 3.29Å; V190-K192 PolarHBondContact O-N 2.79Å; V190-E193 PolarHBondContact O-N 3.16Å; V190-E193 VanDerWaalsContact O-N 3.16Å; V190-L194 HydrophobicContact CG1-CD1 3.9Å; V190-L194 HydrophobicContact CG1-CG 4.12Å; V190-L194 PolarHBondContact O-N 3.5Å
191	R	87.5	Confident	84.9	Confident	80 Å²	80	49.3 Å²	49.3	30%	0.302	24%	0.24	S	C	.	.	H	α-helix	trans	-56.6	-41.7	171.1	-173.1	-173.6	70.2	175.4	3.8	111.5	F126 L187 A195 L247 S250	F126-R191 HydrophobicContact CD1-CB 4.49Å; F126-R191 HydrophobicContact CE1-CB 3.83Å; F126-R191 HydrophobicContact CE1-CG 4.42Å; F126-R191 HydrophobicContact CZ-CB 4.32Å; L187-R191 WeakPolarHBondContact O-CB 3.46Å; L187-R191 PolarHBondContact O-N 3.43Å; R191-A195 WeakPolarHBondContact O-CB 3.12Å; R191-A195 PolarHBondContact O-N 3.24Å; R191-L247 HydrophobicContact CG-CD1 4.14Å; R191-S250 WeakPolarHBondContact CD-O 3.49Å; R191-S250 PolarHBondContact NH1-O 3.31Å
192	K	83.1	Confident	83.9	Confident	145 Å²	145	53.1 Å²	53.1	63%	0.63	25%	0.254	S	S	*	.	H	α-helix	trans	-62.8	-42.2	175.8	-79.8	178.8	175.1	-174.9	0	112.3	V188 R189 V190 V196	V188-K192 WeakPolarHBondContact O-CG 3.36Å; V188-K192 PolarHBondContact O-N 2.83Å; R189-K192 PolarHBondContact O-N 3.49Å; V190-K192 VanDerWaalsContact C-N 3.29Å; V190-K192 PolarHBondContact O-N 2.79Å; K192-V196 WeakPolarHBondContact O-CG2 3.34Å
193	E	85.2	Confident	82.9	Confident	70 Å²	70	55.9 Å²	55.9	33%	0.327	27%	0.269	S	S	.	.	H	α-helix	trans	-68.9	-45.7	179.5	-166.4	172.2	148.4	0	0	111.8	R147 F148 R189 V190	R147-E193 IonicContact CZ-OE1 3.76Å; R147-E193 VanDerWaalsContact CZ-OE1 3.32Å; R147-E193 IonicContact NE-OE1 3.7Å; R147-E193 PolarHBondContact NE-OE1 2.84Å; R147-E193 VanDerWaalsContact NE-OE1 3.08Å; R147-E193 IonicContact NH2-OE1 2.65Å; R147-E193 PolarHBondContact NH2-OE1 3.16Å; F148-E193 HydrophobicContact CE1-CG 4.47Å; F148-E193 WeakPolarHBondContact CE1-OE1 3.5Å; F148-E193 WeakPolarHBondContact CE1-OE2 3.31Å; F148-E193 HydrophobicContact CZ-CG 4.3Å; R189-E193 PolarHBondContact O-N 2.83Å; V190-E193 PolarHBondContact O-N 3.16Å; V190-E193 VanDerWaalsContact O-N 3.16Å
194	L	87.6	Confident	82.1	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-71.6	-36.5	-179.5	-67.6	-178.6	0	0	0	113.6	F126 L144 F148 M179 V190 V196 R197 I198 L244 L247	F126-L194 HydrophobicContact CE2-CD1 4.13Å; F126-L194 HydrophobicContact CZ-CD1 4.13Å; L144-L194 HydrophobicContact CD2-CD2 3.94Å; F148-L194 HydrophobicContact CE2-CD2 4.02Å; F148-L194 HydrophobicContact CE2-CG 4.44Å; F148-L194 HydrophobicContact CZ-CD2 4.29Å; M179-L194 HydrophobicContact CE-CD1 3.94Å; M179-L194 HydrophobicContact SD-CD1 3.66Å; V190-L194 HydrophobicContact CG1-CD1 3.9Å; V190-L194 HydrophobicContact CG1-CG 4.12Å; V190-L194 PolarHBondContact O-N 3.5Å; L194-V196 VanDerWaalsContact C-N 3.26Å; L194-V196 PolarHBondContact O-N 2.66Å; L194-R197 PolarHBondContact O-N 2.77Å; L194-I198 HydrophobicContact CB-CD1 4.33Å; L194-I198 WeakPolarHBondContact O-CB 3.29Å; L194-I198 WeakPolarHBondContact O-CG1 3.29Å; L194-I198 PolarHBondContact O-N 2.96Å; L194-L244 HydrophobicContact CD2-CD1 3.93Å; L194-L247 HydrophobicContact CB-CD1 4.29Å; L194-L247 HydrophobicContact CB-CD2 4.26Å
195	A	83.5	Confident	80.9	Confident	41 Å²	41	60.5 Å²	60.5	34%	0.339	30%	0.296	S	S	.	.	H	α-helix	trans	-61.2	-34.9	-179.4	0	0	0	0	0	112.6	R191 R199 L247	R191-A195 WeakPolarHBondContact O-CB 3.12Å; R191-A195 PolarHBondContact O-N 3.24Å; A195-R199 WeakPolarHBondContact O-CB 3.48Å; A195-R199 PolarHBondContact O-N 3.17Å; A195-L247 HydrophobicContact CB-CD1 3.86Å
196	V	81.5	Confident	79.5	Confident	108 Å²	108	60.3 Å²	60.3	66%	0.655	30%	0.299	S	S	*	.	H	α-helix	trans	-66.1	-47	175.8	174.6	0	0	0	0	110.9	K192 L194 R199 A200	K192-V196 WeakPolarHBondContact O-CG2 3.34Å; L194-V196 VanDerWaalsContact C-N 3.26Å; L194-V196 PolarHBondContact O-N 2.66Å; V196-R199 PolarHBondContact O-N 3.09Å; V196-A200 PolarHBondContact O-N 2.99Å; V196-A200 VanDerWaalsContact O-N 3.13Å
197	R	80.9	Confident	78	Confident	57 Å²	57	63 Å²	63	22%	0.215	32%	0.322	C	S	.	.	H	α-helix	trans	-67.2	-41.9	179.4	-171.5	57.1	154.5	118	-5.4	112	L194 R199 A200 N201 D239 L241 D242	L194-R197 PolarHBondContact O-N 2.77Å; R197-R199 VanDerWaalsContact C-N 3.35Å; R197-R199 PolarHBondContact O-N 2.86Å; R197-A200 PolarHBondContact O-N 2.88Å; R197-N201 PolarHBondContact NH1-OD1 2.87Å; R197-N201 WeakPolarHBondContact O-CB 3.37Å; R197-N201 PolarHBondContact O-N 3.42Å; R197-N201 PolarHBondContact O-ND2 2.76Å; R197-N201 PolarHBondContact O-OD1 3.13Å; R197-N201 VanDerWaalsContact O-OD1 3.08Å; R197-D239 IonicContact CZ-OD2 2.73Å; R197-D239 IonicContact NH2-OD2 2.84Å; R197-D239 PolarHBondContact NH2-OD2 2.69Å; R197-L241 HydrophobicContact CG-CB 4.07Å; R197-D242 IonicContact CZ-OD1 3.19Å; R197-D242 IonicContact NH1-OD1 3.56Å; R197-D242 PolarHBondContact NH1-OD1 2.79Å; R197-D242 IonicContact NH2-OD1 3.57Å; R197-D242 PolarHBondContact NH2-OD1 2.86Å
198	I	83	Confident	75.5	Confident	8 Å²	8	64.2 Å²	64.2	4%	0.041	34%	0.339	C	S	.	.	H	α-helix	trans	-66.4	-35.7	178.7	-76.5	163.8	0	0	0	111.9	V128 L194 N201 R202 L244 L247	V128-I198 HydrophobicContact CG1-CD1 4.06Å; L194-I198 HydrophobicContact CB-CD1 4.33Å; L194-I198 WeakPolarHBondContact O-CB 3.29Å; L194-I198 WeakPolarHBondContact O-CG1 3.29Å; L194-I198 PolarHBondContact O-N 2.96Å; I198-N201 PolarHBondContact O-N 3.44Å; I198-R202 WeakPolarHBondContact O-CG 3.23Å; I198-R202 PolarHBondContact O-N 2.99Å; I198-L244 HydrophobicContact CD1-CB 4.06Å; I198-L244 HydrophobicContact CG1-CB 3.67Å; I198-L247 HydrophobicContact CD1-CD1 4.4Å; I198-L247 HydrophobicContact CD1-CD2 3.39Å; I198-L247 HydrophobicContact CD1-CG 3.55Å
199	R	75.8	Confident	73.4	Confident	122 Å²	122	64.6 Å²	64.6	46%	0.46	34%	0.343	S	S	.	.	H	α-helix	trans	-60.2	-53.1	169.7	176.1	177.2	-63.2	170.2	-0.2	111.2	A195 V196 R197 N201 R202 E203	A195-R199 WeakPolarHBondContact O-CB 3.48Å; A195-R199 PolarHBondContact O-N 3.17Å; V196-R199 PolarHBondContact O-N 3.09Å; R197-R199 VanDerWaalsContact C-N 3.35Å; R197-R199 PolarHBondContact O-N 2.86Å; R199-N201 VanDerWaalsContact C-N 3.25Å; R199-N201 PolarHBondContact O-N 3.46Å; R199-R202 WeakPolarHBondContact O-CB 3.22Å; R199-R202 PolarHBondContact O-N 3.45Å; R199-E203 WeakPolarHBondContact CD-OE1 3.29Å; R199-E203 HydrophobicContact CG-CG 4.48Å; R199-E203 WeakPolarHBondContact CG-OE1 3.28Å; R199-E203 WeakPolarHBondContact O-CG 3.5Å; R199-E203 PolarHBondContact O-N 2.94Å
200	A	78.4	Confident	71.6	Confident	34 Å²	34	63.3 Å²	63.3	28%	0.281	35%	0.352	S	S	.	.	H	α-helix	trans	-58.6	-36.1	178.1	0	0	0	0	0	112.8	V196 R197 E203 L204	V196-A200 PolarHBondContact O-N 2.99Å; V196-A200 VanDerWaalsContact O-N 3.13Å; R197-A200 PolarHBondContact O-N 2.88Å; A200-E203 PolarHBondContact O-N 3.13Å; A200-L204 WeakPolarHBondContact O-CB 3.47Å; A200-L204 WeakPolarHBondContact O-CG 3.44Å; A200-L204 PolarHBondContact O-N 3.19Å
201	N	79.1	Confident	69.5	Low	9 Å²	9	70.9 Å²	70.9	5%	0.048	38%	0.381	C	S	.	.	H	α-helix	trans	-69.7	-35.8	176.7	-64.1	-5.9	0	0	0	112.6	R197 I198 R199 A205 L241 D242 L244	R197-N201 PolarHBondContact NH1-OD1 2.87Å; R197-N201 WeakPolarHBondContact O-CB 3.37Å; R197-N201 PolarHBondContact O-N 3.42Å; R197-N201 PolarHBondContact O-ND2 2.76Å; R197-N201 PolarHBondContact O-OD1 3.13Å; R197-N201 VanDerWaalsContact O-OD1 3.08Å; I198-N201 PolarHBondContact O-N 3.44Å; R199-N201 VanDerWaalsContact C-N 3.25Å; R199-N201 PolarHBondContact O-N 3.46Å; N201-A205 WeakPolarHBondContact O-CB 3.24Å; N201-A205 PolarHBondContact O-N 3.24Å; N201-L241 PolarHBondContact ND2-O 2.81Å; N201-D242 PolarHBondContact ND2-O 3.44Å; N201-L244 WeakPolarHBondContact CB-O 3.35Å; N201-L244 PolarHBondContact ND2-O 3.01Å
202	R	72.5	Confident	67.6	Low	80 Å²	80	70.2 Å²	70.2	30%	0.302	39%	0.386	S	S	.	.	H	α-helix	trans	-66.9	-43.6	172.2	-75.6	174.1	168.3	-162.1	-11.1	111.4	I198 R199 A205 S206 F245 D246	I198-R202 WeakPolarHBondContact O-CG 3.23Å; I198-R202 PolarHBondContact O-N 2.99Å; R199-R202 WeakPolarHBondContact O-CB 3.22Å; R199-R202 PolarHBondContact O-N 3.45Å; R202-A205 PolarHBondContact O-N 3.13Å; R202-S206 WeakPolarHBondContact O-CB 3.41Å; R202-S206 PolarHBondContact O-N 3.05Å; R202-S206 PolarHBondContact O-OG 3.47Å; R202-F245 HydrophobicContact CG-CD2 4.47Å; R202-F245 HydrophobicContact CG-CE2 4.24Å; R202-F245 HydrophobicContact CG-CZ 4.47Å; R202-F245 PolarHBondContact NE-O 3.45Å; R202-D246 IonicContact CZ-OD1 3.84Å; R202-D246 IonicContact NH2-OD1 2.76Å; R202-D246 PolarHBondContact NH2-OD1 2.79Å; R202-D246 IonicContact NH2-OD2 3.6Å; R202-D246 PolarHBondContact NH2-OD2 3.46Å; R202-D246 VanDerWaalsContact NH2-OD2 3.1Å
203	E	68.9	Low	66.1	Low	102 Å²	102	68.5 Å²	68.5	48%	0.477	38%	0.384	S	S	.	.	H	α-helix	trans	-61	-48.6	175.7	-70.9	159.6	-178.4	0	0	111	R199 A200 A205 S206 S207	R199-E203 WeakPolarHBondContact CD-OE1 3.29Å; R199-E203 HydrophobicContact CG-CG 4.48Å; R199-E203 WeakPolarHBondContact CG-OE1 3.28Å; R199-E203 WeakPolarHBondContact O-CG 3.5Å; R199-E203 PolarHBondContact O-N 2.94Å; A200-E203 PolarHBondContact O-N 3.13Å; E203-A205 PolarHBondContact O-N 2.87Å; E203-S206 PolarHBondContact O-N 3.49Å; E203-S206 PolarHBondContact O-OG 3.39Å; E203-S207 PolarHBondContact O-N 3.49Å
204	L	69.7	Low	64.3	Low	108 Å²	108	69.9 Å²	69.9	57%	0.565	39%	0.393	S	S	*	.	H	α-helix	trans	-56.9	-50.5	172.5	-79.6	163.8	0	0	0	112	A200 S206 S207	A200-L204 WeakPolarHBondContact O-CB 3.47Å; A200-L204 WeakPolarHBondContact O-CG 3.44Å; A200-L204 PolarHBondContact O-N 3.19Å; L204-S206 PolarHBondContact O-N 3.09Å; L204-S207 PolarHBondContact O-N 3.48Å; L204-S207 VanDerWaalsContact O-N 3.13Å; L204-S207 PolarHBondContact O-OG 2.85Å
205	A	62.6	Low	62.1	Low	39 Å²	39	72.1 Å²	72.1	32%	0.322	40%	0.404	S	S	.	.	H	α-helix	trans	-61.7	-27.6	178.6	0	0	0	0	0	113.4	N201 R202 E203 F245	N201-A205 WeakPolarHBondContact O-CB 3.24Å; N201-A205 PolarHBondContact O-N 3.24Å; R202-A205 PolarHBondContact O-N 3.13Å; E203-A205 PolarHBondContact O-N 2.87Å; A205-F245 HydrophobicContact CB-CE2 3.94Å
206	S	54.5	Low	60.4	Low	51 Å²	51	73.1 Å²	73.1	36%	0.357	41%	0.413	S	S	.	.	H	α-helix	trans	-77.3	-24.7	176.7	73.5	0	0	0	0	114.4	R202 E203 L204 G208 L565	R202-S206 WeakPolarHBondContact O-CB 3.41Å; R202-S206 PolarHBondContact O-N 3.05Å; R202-S206 PolarHBondContact O-OG 3.47Å; E203-S206 PolarHBondContact O-N 3.49Å; E203-S206 PolarHBondContact O-OG 3.39Å; L204-S206 PolarHBondContact O-N 3.09Å; S206-G208 VanDerWaalsContact C-N 3.29Å; S206-G208 PolarHBondContact O-N 2.92Å; S206-L565 VanDerWaalsContact CB-CD1 3.45Å
207	S	54.3	Low	58.9	Low	91 Å²	91	75.3 Å²	75.3	64%	0.636	42%	0.416	S	S	*	.	H	α-helix	trans	-75.2	-18.4	177.7	71.9	0	0	0	0	113.4	E203 L204 S209	E203-S207 PolarHBondContact O-N 3.49Å; L204-S207 PolarHBondContact O-N 3.48Å; L204-S207 VanDerWaalsContact O-N 3.13Å; L204-S207 PolarHBondContact O-OG 2.85Å; S207-S209 PolarHBondContact O-N 2.96Å; S207-S209 VanDerWaalsContact O-N 3.12Å
208	G	39.6	Very low	57.1	Low	43 Å²	43	79.8 Å²	79.8	44%	0.443	44%	0.439	S	S	.	.			trans	-73.8	96.3	175	0	0	0	0	0	111.7	S206	S206-G208 VanDerWaalsContact C-N 3.29Å; S206-G208 PolarHBondContact O-N 2.92Å
209	S	41.3	Very low	55	Low	52 Å²	52	87.5 Å²	87.5	36%	0.364	47%	0.472	S	S	.	.			trans	-74.4	146.6	169.3	75.8	0	0	0	0	110.8	S207 Y211 T212 D213	S207-S209 PolarHBondContact O-N 2.96Å; S207-S209 VanDerWaalsContact O-N 3.12Å; S209-Y211 PolarHBondContact O-N 2.85Å; S209-Y211 VanDerWaalsContact O-N 3.12Å; S209-T212 PolarHBondContact N-OG1 2.66Å; S209-T212 PolarHBondContact O-N 2.77Å; S209-T212 PolarHBondContact O-OG1 3.15Å; S209-T212 PolarHBondContact OG-N 3.4Å; S209-T212 PolarHBondContact OG-OG1 2.93Å; S209-D213 PolarHBondContact O-N 3.09Å
210	S	47.8	Very low	53.3	Low	87 Å²	87	91.4 Å²	91.4	61%	0.608	49%	0.487	S	S	*	.	H	α-helix	trans	-57.6	-27.9	171.8	171.2	0	0	0	0	112.2	D213 I214	S210-D213 PolarHBondContact O-N 2.95Å; S210-I214 WeakPolarHBondContact O-CD1 3.22Å; S210-I214 VanDerWaalsContact O-CG1 3.28Å; S210-I214 WeakPolarHBondContact O-CG1 3.24Å; S210-I214 PolarHBondContact O-N 3.22Å; S210-I214 VanDerWaalsContact O-N 3.11Å
211	Y	43.5	Very low	51.1	Low	158 Å²	158	96.4 Å²	96.4	62%	0.62	51%	0.509	S	S	*	.	H	α-helix	trans	-66	-38.6	173.2	-177	-117.4	0	0	0	112.8	S209 I214 L215	S209-Y211 PolarHBondContact O-N 2.85Å; S209-Y211 VanDerWaalsContact O-N 3.12Å; Y211-I214 PolarHBondContact O-N 2.86Å; Y211-L215 HydrophobicContact CD1-CD1 3.94Å; Y211-L215 HydrophobicContact CD1-CG 4.42Å; Y211-L215 HydrophobicContact CD2-CG 4.43Å; Y211-L215 HydrophobicContact CE1-CD1 3.46Å; Y211-L215 VanDerWaalsContact CE1-CD1 3.46Å; Y211-L215 HydrophobicContact CE1-CG 4.12Å; Y211-L215 HydrophobicContact CE2-CD1 4.33Å; Y211-L215 HydrophobicContact CE2-CD2 4.2Å; Y211-L215 HydrophobicContact CE2-CG 4.12Å; Y211-L215 WeakPolarHBondContact O-CB 3.36Å; Y211-L215 WeakPolarHBondContact O-CG 3.4Å; Y211-L215 PolarHBondContact O-N 2.86Å
212	T	47.9	Very low	48.8	Very low	66 Å²	66	104.1 Å²	104.1	41%	0.405	55%	0.55	S	S	.	*	H	α-helix	trans	-68.1	-34.3	176.1	29.8	0	0	0	0	113	S209 A216	S209-T212 PolarHBondContact N-OG1 2.66Å; S209-T212 PolarHBondContact O-N 2.77Å; S209-T212 PolarHBondContact O-OG1 3.15Å; S209-T212 PolarHBondContact OG-N 3.4Å; S209-T212 PolarHBondContact OG-OG1 2.93Å; T212-A216 VanDerWaalsContact O-CB 3.29Å; T212-A216 WeakPolarHBondContact O-CB 3.38Å; T212-A216 PolarHBondContact O-N 2.93Å
213	D	50.3	Low	46.8	Very low	110 Å²	110	107.8 Å²	107.8	59%	0.588	58%	0.576	S	S	*	*	H	α-helix	trans	-67.4	-45.4	173.1	-66.9	-33.7	0	0	0	111	S209 S210 L215 A216 E217	S209-D213 PolarHBondContact O-N 3.09Å; S210-D213 PolarHBondContact O-N 2.95Å; D213-L215 VanDerWaalsContact C-N 3.35Å; D213-L215 PolarHBondContact O-N 2.94Å; D213-A216 PolarHBondContact O-N 3.35Å; D213-E217 PolarHBondContact O-N 3.3Å
214	I	48.7	Very low	44.9	Very low	98 Å²	98	114.1 Å²	114.1	50%	0.503	60%	0.597	S	S	.	*	H	α-helix	trans	-60.2	-42.9	175.7	-68.4	165.3	0	0	0	111.1	S210 Y211 E217 H218	S210-I214 WeakPolarHBondContact O-CD1 3.22Å; S210-I214 VanDerWaalsContact O-CG1 3.28Å; S210-I214 WeakPolarHBondContact O-CG1 3.24Å; S210-I214 PolarHBondContact O-N 3.22Å; S210-I214 VanDerWaalsContact O-N 3.11Å; Y211-I214 PolarHBondContact O-N 2.86Å; I214-E217 PolarHBondContact O-N 3.43Å; I214-H218 WeakPolarHBondContact O-CB 3.39Å; I214-H218 PolarHBondContact O-N 2.86Å
215	L	39.4	Very low	42.9	Very low	50 Å²	50	112.7 Å²	112.7	26%	0.262	61%	0.608	S	S	.	*	H	α-helix	trans	-66.4	-40	175.6	-74.5	-176.6	0	0	0	112.7	Y211 D213 E217 H218 F219	Y211-L215 HydrophobicContact CD1-CD1 3.94Å; Y211-L215 HydrophobicContact CD1-CG 4.42Å; Y211-L215 HydrophobicContact CD2-CG 4.43Å; Y211-L215 HydrophobicContact CE1-CD1 3.46Å; Y211-L215 VanDerWaalsContact CE1-CD1 3.46Å; Y211-L215 HydrophobicContact CE1-CG 4.12Å; Y211-L215 HydrophobicContact CE2-CD1 4.33Å; Y211-L215 HydrophobicContact CE2-CD2 4.2Å; Y211-L215 HydrophobicContact CE2-CG 4.12Å; Y211-L215 WeakPolarHBondContact O-CB 3.36Å; Y211-L215 WeakPolarHBondContact O-CG 3.4Å; Y211-L215 PolarHBondContact O-N 2.86Å; D213-L215 VanDerWaalsContact C-N 3.35Å; D213-L215 PolarHBondContact O-N 2.94Å; L215-E217 PolarHBondContact O-N 2.86Å; L215-H218 PolarHBondContact O-N 2.75Å; L215-F219 HydrophobicContact CB-CD2 4.15Å; L215-F219 HydrophobicContact CB-CE2 4.16Å; L215-F219 HydrophobicContact CD1-CE2 4.41Å; L215-F219 HydrophobicContact CD2-CD2 4.49Å; L215-F219 HydrophobicContact CD2-CE2 3.86Å; L215-F219 HydrophobicContact CD2-CZ 4.46Å; L215-F219 HydrophobicContact CG-CE2 4.37Å; L215-F219 VanDerWaalsContact O-CD2 3.24Å; L215-F219 WeakPolarHBondContact O-CD2 3.42Å; L215-F219 PolarHBondContact O-N 3.06Å
216	A	49	Very low	41.3	Very low	62 Å²	62	118.4 Å²	118.4	51%	0.512	63%	0.632	S	S	.	*	H	α-helix	trans	-65.3	-27.3	177.7	0	0	0	0	0	112.6	T212 D213	T212-A216 VanDerWaalsContact O-CB 3.29Å; T212-A216 WeakPolarHBondContact O-CB 3.38Å; T212-A216 PolarHBondContact O-N 2.93Å; D213-A216 PolarHBondContact O-N 3.35Å
217	E	49.5	Very low	40	Very low	154 Å²	154	122.7 Å²	122.7	72%	0.72	66%	0.655	S	S	*	*	H	α-helix	trans	-83	-34.3	172.3	-163.3	149.7	-119	0	0	112.4	D213 I214 L215	D213-E217 PolarHBondContact O-N 3.3Å; I214-E217 PolarHBondContact O-N 3.43Å; L215-E217 PolarHBondContact O-N 2.86Å
218	H	43.8	Very low	38.7	Very low	151 Å²	151	123.7 Å²	123.7	70%	0.699	66%	0.658	S	S	*	*	H	α-helix	trans	-69.2	-44.6	176.1	-130	71	0	0	0	113.2	I214 L215 R220	I214-H218 WeakPolarHBondContact O-CB 3.39Å; I214-H218 PolarHBondContact O-N 2.86Å; L215-H218 PolarHBondContact O-N 2.75Å; H218-R220 PolarHBondContact O-N 2.85Å; H218-R220 VanDerWaalsContact O-N 3.08Å
219	F	37.6	Very low	38	Very low	170 Å²	170	129 Å²	129	75%	0.746	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	12.7	-178.1	-71	-57.7	0	0	0	114.6	L215	L215-F219 HydrophobicContact CB-CD2 4.15Å; L215-F219 HydrophobicContact CB-CE2 4.16Å; L215-F219 HydrophobicContact CD1-CE2 4.41Å; L215-F219 HydrophobicContact CD2-CD2 4.49Å; L215-F219 HydrophobicContact CD2-CE2 3.86Å; L215-F219 HydrophobicContact CD2-CZ 4.46Å; L215-F219 HydrophobicContact CG-CE2 4.37Å; L215-F219 VanDerWaalsContact O-CD2 3.24Å; L215-F219 WeakPolarHBondContact O-CD2 3.42Å; L215-F219 PolarHBondContact O-N 3.06Å
220	R	40.3	Very low	37.2	Very low	204 Å²	204	135.9 Å²	135.9	77%	0.77	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-12.5	176	-92	-178.4	169.5	-175.9	-0	115.1	H218	H218-R220 PolarHBondContact O-N 2.85Å; H218-R220 VanDerWaalsContact O-N 3.08Å
221	N	33.2	Very low	36.4	Very low	139 Å²	139	139.3 Å²	139.3	74%	0.743	71%	0.713	S	S	*	*			trans	-122.2	109.1	175.6	-69.6	-20	0	0	0	110.5
222	D	30.1	Very low	35.7	Very low	171 Å²	171	136.3 Å²	136.3	91%	0.914	72%	0.716	S	S	*	*				-166.7	140.2	128.4	-106.4	-20.5	0	0	0	111.1	Y224	D222-Y224 PolarHBondContact O-N 3.22Å
223	D	31.6	Very low	34.8	Very low	158 Å²	158	140.1 Å²	140.1	85%	0.845	74%	0.738	S	S	*	*			trans	-79.4	114.2	-179.4	-90	-50.6	0	0	0	111.5
224	Y	28.7	Very low	33.9	Very low	235 Å²	235	143.5 Å²	143.5	92%	0.922	75%	0.748	S	S	*	*			trans	-145	114.9	148.8	-103.8	-74.3	0	0	0	111.9	D222	D222-Y224 PolarHBondContact O-N 3.22Å
225	G	27.9	Very low	33.2	Very low	77 Å²	77	147.8 Å²	147.8	79%	0.794	77%	0.766	S	S	*	*			trans	-80.6	125.6	-171.8	0	0	0	0	0	114.2
226	I	27.7	Very low	33.2	Very low	160 Å²	160	153.3 Å²	153.3	82%	0.821	80%	0.795	S	S	*	*			trans	-112.3	122.1	156.7	-64.1	-179.4	0	0	0	107.7	T228	I226-T228 PolarHBondContact O-N 3.04Å
227	V	28.7	Very low	32.8	Very low	140 Å²	140	161.8 Å²	161.8	85%	0.848	81%	0.814	S	S	*	*			trans	-83.2	109.1	-175.9	178.1	0	0	0	0	110.4
228	T	25.8	Very low	33.1	Very low	113 Å²	113	158.5 Å²	158.5	69%	0.693	81%	0.808	S	S	*	*			trans	-156.7	124.6	154.7	1.8	0	0	0	0	112.3	I226	I226-T228 PolarHBondContact O-N 3.04Å
229	N	24.9	Very low	34.5	Very low	154 Å²	154	153.8 Å²	153.8	82%	0.824	79%	0.788	S	S	*	*			trans	43	91.1	159.1	-62.2	-6.5	0	0	0	119	L231	N229-L231 PolarHBondContact O-N 2.91Å
230	Q	25.9	Very low	36.4	Very low	197 Å²	197	147.2 Å²	147.2	92%	0.921	76%	0.762	S	S	*	*			trans	-62.7	119.5	157.2	-64	172.3	-15.7	0	0	110.8
231	L	29.1	Very low	38.4	Very low	158 Å²	158	138.8 Å²	138.8	83%	0.827	73%	0.732	S	S	*	*			trans	-155.9	83.9	155.7	-117	171.9	0	0	0	113.3	N229	N229-L231 PolarHBondContact O-N 2.91Å
232	S	30.1	Very low	40.6	Very low	96 Å²	96	135.5 Å²	135.5	67%	0.671	72%	0.715	S	S	*	*			trans	50.8	98.9	158.5	61.1	0	0	0	0	119.4
233	V	27.7	Very low	43.2	Very low	145 Å²	145	129 Å²	129	88%	0.879	68%	0.68	S	S	*	*			trans	-62.2	137.3	155.4	177.4	0	0	0	0	110
234	K	32.4	Very low	45.7	Very low	182 Å²	182	121.5 Å²	121.5	79%	0.791	64%	0.64	S	S	*	*			trans	-116.5	144.4	160.9	-80.8	-176.2	175.6	176.8	0	109.5	N236	K234-N236 PolarHBondContact O-N 2.79Å
235	Q	34.4	Very low	48.3	Very low	188 Å²	188	113.5 Å²	113.5	88%	0.879	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-65.3	126.9	-173	-66.7	162.3	-35.3	0	0	111.6	R237	Q235-R237 PolarHBondContact O-N 2.85Å
236	N	38.1	Very low	51.1	Low	165 Å²	165	110.2 Å²	110.2	88%	0.882	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-66.3	122.1	167.9	-72.9	-15.3	0	0	0	109.1	K234	K234-N236 PolarHBondContact O-N 2.79Å
237	R	42	Very low	54	Low	241 Å²	241	103.2 Å²	103.2	91%	0.909	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-80.9	130.3	163.7	-69.3	178.1	171.6	179.3	-5.6	108	Q235	Q235-R237 PolarHBondContact O-N 2.85Å
238	S	54.6	Low	56.9	Low	84 Å²	84	97.1 Å²	97.1	59%	0.587	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-66.2	155.8	167	39.3	0	0	0	0	111.1
239	D	74.7	Confident	59.9	Low	53 Å²	53	92 Å²	92	28%	0.283	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-75.3	127.1	172.7	174.8	8.9	0	0	0	108.3	R197 L241 D242	R197-D239 IonicContact CZ-OD2 2.73Å; R197-D239 IonicContact NH2-OD2 2.84Å; R197-D239 PolarHBondContact NH2-OD2 2.69Å; D239-L241 PolarHBondContact O-N 2.83Å; D239-L241 PolarHBondContact OD1-N 2.92Å; D239-L241 WeakPolarHBondContact OD2-CB 3.46Å; D239-D242 WeakPolarHBondContact CB-OD2 3.32Å; D239-D242 PolarHBondContact N-OD2 3.28Å; D239-D242 WeakPolarHBondContact O-CB 3.21Å; D239-D242 PolarHBondContact O-N 2.9Å
240	P	76.6	Confident	62.9	Low	32 Å²	32	85.8 Å²	85.8	21%	0.208	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-54	-22.6	175.4	-28.3	36.7	0	0	0	114.2	D139 Y143	D139-P240 HydrophobicContact CB-CB 4.39Å; D139-P240 HydrophobicContact CB-CG 4.32Å; Y143-P240 HydrophobicContact CD2-CB 4.1Å; Y143-P240 HydrophobicContact CD2-CG 4.01Å; Y143-P240 HydrophobicContact CG-CB 4.09Å; Y143-P240 HydrophobicContact CG-CG 4.43Å
241	L	81.5	Confident	65.6	Low	26 Å²	26	79.1 Å²	79.1	14%	0.136	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-70.6	-24.4	172.4	-67.3	177.3	0	0	0	114.5	Y143 R197 N201 D239 N243 L244	Y143-L241 HydrophobicContact CD1-CD2 3.91Å; Y143-L241 HydrophobicContact CD1-CG 4.1Å; Y143-L241 HydrophobicContact CE1-CD1 3.8Å; Y143-L241 HydrophobicContact CE1-CD2 3.59Å; Y143-L241 HydrophobicContact CE1-CG 3.55Å; Y143-L241 HydrophobicContact CE2-CG 4.49Å; Y143-L241 WeakPolarHBondContact OH-CD1 3.17Å; R197-L241 HydrophobicContact CG-CB 4.07Å; N201-L241 PolarHBondContact ND2-O 2.81Å; D239-L241 PolarHBondContact O-N 2.83Å; D239-L241 PolarHBondContact OD1-N 2.92Å; D239-L241 WeakPolarHBondContact OD2-CB 3.46Å; L241-N243 PolarHBondContact O-N 2.9Å; L241-L244 HydrophobicContact CD2-CD1 3.76Å; L241-L244 PolarHBondContact O-N 2.95Å
242	D	81	Confident	68.5	Low	70 Å²	70	72.5 Å²	72.5	37%	0.374	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-62.5	-26	176.3	-66.2	-39.2	0	0	0	111.6	R197 N201 D239 L244	R197-D242 IonicContact CZ-OD1 3.19Å; R197-D242 IonicContact NH1-OD1 3.56Å; R197-D242 PolarHBondContact NH1-OD1 2.79Å; R197-D242 IonicContact NH2-OD1 3.57Å; R197-D242 PolarHBondContact NH2-OD1 2.86Å; N201-D242 PolarHBondContact ND2-O 3.44Å; D239-D242 WeakPolarHBondContact CB-OD2 3.32Å; D239-D242 PolarHBondContact N-OD2 3.28Å; D239-D242 WeakPolarHBondContact O-CB 3.21Å; D239-D242 PolarHBondContact O-N 2.9Å; D242-L244 VanDerWaalsContact C-N 3.35Å; D242-L244 PolarHBondContact O-N 3.39Å
243	N	83	Confident	71.3	Confident	34 Å²	34	71.7 Å²	71.7	18%	0.182	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-79.2	-11.4	-176.6	-63.3	-42.1	0	0	0	114	V130 R131 A136 L241	V130-N243 CarbonylContact C-O 3.56Å; V130-N243 WeakPolarHBondContact CA-O 3.45Å; V130-N243 HydrophobicContact CG1-CB 3.85Å; R131-N243 PolarHBondContact N-O 2.92Å; R131-N243 WeakPolarHBondContact O-CB 3.39Å; A136-N243 HydrophobicContact CB-CB 4.15Å; L241-N243 PolarHBondContact O-N 2.9Å
244	L	84.8	Confident	74.4	Confident	1 Å²	1	66 Å²	66	1%	0.005	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	125.5	-177	-54.2	-176	0	0	0	111	V128 V130 A140 L144 L194 I198 N201 L241 D242	V128-L244 HydrophobicContact CG1-CB 4.5Å; V128-L244 HydrophobicContact CG1-CD2 4.1Å; V130-L244 HydrophobicContact CG2-CD2 4.02Å; A140-L244 HydrophobicContact CB-CD2 4.02Å; L144-L244 HydrophobicContact CD1-CD2 4.41Å; L144-L244 HydrophobicContact CD2-CD1 4.3Å; L194-L244 HydrophobicContact CD2-CD1 3.93Å; I198-L244 HydrophobicContact CD1-CB 4.06Å; I198-L244 HydrophobicContact CG1-CB 3.67Å; N201-L244 WeakPolarHBondContact CB-O 3.35Å; N201-L244 PolarHBondContact ND2-O 3.01Å; L241-L244 HydrophobicContact CD2-CD1 3.76Å; L241-L244 PolarHBondContact O-N 2.95Å; D242-L244 VanDerWaalsContact C-N 3.35Å; D242-L244 PolarHBondContact O-N 3.39Å
245	F	83.6	Confident	77.1	Confident	67 Å²	67	58.3 Å²	58.3	29%	0.294	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	-19.6	-167	-163.7	-102.9	0	0	0	115.9	L129 R202 A205	L129-F245 HydrophobicContact CD2-CD1 4.24Å; L129-F245 PolarHBondContact O-N 3.01Å; R202-F245 HydrophobicContact CG-CD2 4.47Å; R202-F245 HydrophobicContact CG-CE2 4.24Å; R202-F245 HydrophobicContact CG-CZ 4.47Å; R202-F245 PolarHBondContact NE-O 3.45Å; A205-F245 HydrophobicContact CB-CE2 3.94Å
246	D	86.8	Confident	79.8	Confident	9 Å²	9	49.9 Å²	49.9	5%	0.048	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	154.2	178.9	-157.6	-8.1	0	0	0	113.1	V128 L129 R202 R248 H553	V128-D246 VanDerWaalsContact CA-O 3.3Å; V128-D246 WeakPolarHBondContact CA-O 3.44Å; V128-D246 WeakPolarHBondContact CG1-O 3.4Å; L129-D246 HydrophobicContact CB-CB 3.68Å; L129-D246 HydrophobicContact CD2-CB 4.26Å; L129-D246 PolarHBondContact N-O 3.22Å; R202-D246 IonicContact CZ-OD1 3.84Å; R202-D246 IonicContact NH2-OD1 2.76Å; R202-D246 PolarHBondContact NH2-OD1 2.79Å; R202-D246 IonicContact NH2-OD2 3.6Å; R202-D246 PolarHBondContact NH2-OD2 3.46Å; R202-D246 VanDerWaalsContact NH2-OD2 3.1Å; D246-R248 IonicContact OD2-CZ 3.45Å; D246-R248 IonicContact OD2-NE 2.73Å; D246-R248 PolarHBondContact OD2-NE 3.45Å; D246-H553 IonicContact OD1-CE1 2.98Å; D246-H553 PolarHBondContact OD1-CE1 2.94Å; D246-H553 IonicContact OD1-NE2 2.7Å; D246-H553 PolarHBondContact OD1-NE2 2.88Å; D246-H553 IonicContact OD2-CE1 3.29Å; D246-H553 PolarHBondContact OD2-CE1 3.13Å; D246-H553 VanDerWaalsContact OD2-CE1 3.28Å; D246-H553 IonicContact OD2-NE2 3.66Å
247	L	88.2	Confident	82.4	Confident	13 Å²	13	42.3 Å²	42.3	7%	0.068	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	95.4	163.5	-63.6	-174.7	0	0	0	109.6	F126 Y127 V128 R191 L194 A195 I198 H553	F126-L247 HydrophobicContact CD2-CD2 4.03Å; F126-L247 HydrophobicContact CE2-CD2 3.71Å; Y127-L247 CarbonylContact O-C 3.48Å; Y127-L247 WeakPolarHBondContact O-CA 3.32Å; V128-L247 HydrophobicContact CB-CD2 4.42Å; V128-L247 HydrophobicContact CG1-CD2 4.26Å; V128-L247 HydrophobicContact CG2-CD2 3.68Å; R191-L247 HydrophobicContact CG-CD1 4.14Å; L194-L247 HydrophobicContact CB-CD1 4.29Å; L194-L247 HydrophobicContact CB-CD2 4.26Å; A195-L247 HydrophobicContact CB-CD1 3.86Å; I198-L247 HydrophobicContact CD1-CD1 4.4Å; I198-L247 HydrophobicContact CD1-CD2 3.39Å; I198-L247 HydrophobicContact CD1-CG 3.55Å; L247-H553 PolarHBondContact O-NE2 2.86Å
248	R	89.2	Confident	84.8	Confident	12 Å²	12	30.8 Å²	30.8	5%	0.045	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	152.2	173.7	-66.7	-78	-159.6	-177.2	17.3	110.9	Y127 D162 D164 Y176 D246 S250 I550 H553	Y127-R248 PolarHBondContact N-O 3.33Å; Y127-R248 PolarHBondContact O-N 2.78Å; D162-R248 VanDerWaalsContact CG-NH2 3.28Å; D162-R248 IonicContact OD1-NH2 2.75Å; D162-R248 PolarHBondContact OD1-NH2 2.93Å; D162-R248 IonicContact OD2-CZ 3.49Å; D162-R248 IonicContact OD2-NE 3.79Å; D162-R248 IonicContact OD2-NH2 2.72Å; D162-R248 PolarHBondContact OD2-NH2 3.15Å; D164-R248 IonicContact OD2-CZ 3.69Å; D164-R248 VanDerWaalsContact OD2-CZ 3.25Å; D164-R248 IonicContact OD2-NH1 3.4Å; D164-R248 PolarHBondContact OD2-NH1 3.34Å; D164-R248 IonicContact OD2-NH2 3.95Å; D164-R248 PolarHBondContact OD2-NH2 2.86Å; Y176-R248 HydrophobicContact CE1-CB 4.18Å; Y176-R248 HydrophobicContact CE1-CG 3.54Å; Y176-R248 WeakPolarHBondContact OH-CG 3.22Å; Y176-R248 PolarHBondContact OH-NE 2.91Å; Y176-R248 VanDerWaalsContact OH-NE 3.13Å; D246-R248 IonicContact OD2-CZ 3.45Å; D246-R248 IonicContact OD2-NE 2.73Å; D246-R248 PolarHBondContact OD2-NE 3.45Å; R248-S250 PolarHBondContact O-N 3.07Å; R248-I550 HydrophobicContact CB-CD1 3.88Å; R248-I550 HydrophobicContact CB-CG1 3.78Å; R248-I550 HydrophobicContact CG-CD1 4.3Å; R248-I550 HydrophobicContact CG-CG1 3.82Å; R248-H553 PolarHBondContact NH1-ND1 2.65Å
249	E	90.3	Very high	86.6	Confident	5 Å²	5	26.8 Å²	26.8	2%	0.023	15%	0.145	C	C	.	.	S	Bend	trans	59.7	6.3	170.6	-80.4	-177.7	-129.6	0	0	117.3	Y127 D251 V252 R257 I550 F551	Y127-E249 HydrophobicContact CD2-CB 4.09Å; Y127-E249 HydrophobicContact CD2-CG 4.43Å; E249-D251 PolarHBondContact O-N 3.39Å; E249-D251 VanDerWaalsContact O-N 3.16Å; E249-V252 PolarHBondContact O-N 3.16Å; E249-R257 IonicContact OE2-CZ 3.99Å; E249-R257 VanDerWaalsContact OE2-CZ 3.25Å; E249-R257 IonicContact OE2-NH1 2.77Å; E249-R257 PolarHBondContact OE2-NH1 3.25Å; E249-R257 IonicContact OE2-NH2 3Å; E249-R257 PolarHBondContact OE2-NH2 3.43Å; E249-I550 WeakPolarHBondContact OE1-CD1 3.32Å; E249-F551 HydrophobicContact CG-CB 3.61Å; E249-F551 HydrophobicContact CG-CD2 3.59Å; E249-F551 HydrophobicContact CG-CE2 4.4Å; E249-F551 HydrophobicContact CG-CG 3.73Å; E249-F551 PolarHBondContact OE1-N 3.18Å
250	S	86.3	Confident	87.5	Confident	23 Å²	23	24.5 Å²	24.5	16%	0.161	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-0.1	-175.1	74.8	0	0	0	0	115.2	R191 R248	R191-S250 WeakPolarHBondContact CD-O 3.49Å; R191-S250 PolarHBondContact NH1-O 3.31Å; R248-S250 PolarHBondContact O-N 3.07Å
251	D	84.4	Confident	88.2	Confident	57 Å²	57	23.9 Å²	23.9	31%	0.305	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-4.4	178.8	76.8	-57.1	0	0	0	113.9	E249 K554 R895	E249-D251 PolarHBondContact O-N 3.39Å; E249-D251 VanDerWaalsContact O-N 3.16Å; D251-K554 WeakPolarHBondContact OD2-CD 3.39Å; D251-K554 WeakPolarHBondContact OD2-CE 3.05Å; D251-R895 IonicContact OD1-CZ 2.59Å; D251-R895 IonicContact OD1-NH1 2.65Å; D251-R895 PolarHBondContact OD1-NH1 2.86Å; D251-R895 IonicContact OD1-NH2 3.06Å; D251-R895 PolarHBondContact OD1-NH2 3.05Å; D251-R895 IonicContact OD2-CZ 2.76Å; D251-R895 IonicContact OD2-NH1 3.35Å; D251-R895 PolarHBondContact OD2-NH1 3.34Å; D251-R895 IonicContact OD2-NH2 2.75Å; D251-R895 PolarHBondContact OD2-NH2 2.89Å
252	V	89.4	Confident	88.6	Confident	20 Å²	20	25.1 Å²	25.1	12%	0.121	14%	0.135	C	C	.	.	S	Bend	trans	-69	125.7	-178.1	177.1	0	0	0	0	110.9	E249 R257 M541 F551	E249-V252 PolarHBondContact O-N 3.16Å; V252-R257 HydrophobicContact CG1-CB 4.02Å; V252-M541 HydrophobicContact CB-CE 4.33Å; V252-M541 HydrophobicContact CG1-CE 3.7Å; V252-M541 HydrophobicContact CG2-CE 3.74Å; V252-F551 HydrophobicContact CG2-CD2 3.87Å; V252-F551 HydrophobicContact CG2-CE2 4.11Å
253	P	89.1	Confident	89.1	Confident	78 Å²	78	26.2 Å²	26.2	51%	0.506	14%	0.141	S	C	.	.			trans	-59.8	137.6	177.4	-24.9	34.8	0	0	0	112.4	L255 T256 R257	P253-L255 PolarHBondContact O-N 2.96Å; P253-T256 PolarHBondContact O-N 2.85Å; P253-T256 VanDerWaalsContact O-N 3.16Å; P253-R257 PolarHBondContact O-N 2.92Å
254	Y	91.4	Very high	89.5	Confident	27 Å²	27	24.8 Å²	24.8	11%	0.106	13%	0.133	C	C	.	.	H	α-helix	trans	-58.6	-41.6	-171.8	175.8	-105.2	0	0	0	114.2	P90 S102 G103 I104 Y122 P124 V184 R257 V258	P90-Y254 HydrophobicContact CB-CD1 4.32Å; S102-Y254 PolarHBondContact O-OH 2.87Å; S102-Y254 VanDerWaalsContact O-OH 3.08Å; G103-Y254 VanDerWaalsContact CA-OH 3.25Å; G103-Y254 WeakPolarHBondContact CA-OH 3.22Å; G103-Y254 PolarHBondContact N-OH 3.28Å; G103-Y254 WeakPolarHBondContact O-CE1 3.48Å; I104-Y254 HydrophobicContact CG2-CE1 3.96Å; Y122-Y254 WeakPolarHBondContact O-CE2 3.47Å; Y122-Y254 PolarHBondContact O-OH 3.02Å; P124-Y254 HydrophobicContact CB-CD2 4.12Å; P124-Y254 HydrophobicContact CB-CE2 4.21Å; P124-Y254 HydrophobicContact CG-CD2 3.88Å; P124-Y254 HydrophobicContact CG-CE2 3.63Å; V184-Y254 HydrophobicContact CG2-CD1 4.14Å; V184-Y254 HydrophobicContact CG2-CD2 3.8Å; V184-Y254 HydrophobicContact CG2-CE2 4.39Å; V184-Y254 HydrophobicContact CG2-CG 3.65Å; Y254-R257 WeakPolarHBondContact O-CB 3.41Å; Y254-R257 PolarHBondContact O-N 3.44Å; Y254-V258 HydrophobicContact CD2-CG2 4.22Å; Y254-V258 HydrophobicContact CE1-CG2 4.19Å; Y254-V258 HydrophobicContact CE2-CG2 3.73Å; Y254-V258 WeakPolarHBondContact O-CG2 3.34Å; Y254-V258 PolarHBondContact O-N 3.27Å
255	L	90.7	Very high	89.9	Confident	20 Å²	20	25.7 Å²	25.7	11%	0.105	14%	0.137	C	C	.	.	H	α-helix	trans	-59.2	-53.1	175.3	-178.9	62.1	0	0	0	110.9	M88 I104 P253 R257 V258 C259	M88-L255 HydrophobicContact CB-CD1 4.44Å; M88-L255 HydrophobicContact CG-CD1 4.05Å; M88-L255 HydrophobicContact CG-CD2 4.32Å; M88-L255 HydrophobicContact SD-CD1 4.04Å; I104-L255 HydrophobicContact CB-CD1 4.36Å; I104-L255 HydrophobicContact CG2-CD1 3.81Å; P253-L255 PolarHBondContact O-N 2.96Å; L255-R257 VanDerWaalsContact C-N 3.29Å; L255-R257 PolarHBondContact O-N 3.03Å; L255-V258 PolarHBondContact O-N 3Å; L255-V258 VanDerWaalsContact O-N 3.16Å; L255-C259 PolarHBondContact O-N 3.35Å; L255-C259 PolarHBondContact O-SG 2.69Å
256	T	91.3	Very high	90.2	Very high	10 Å²	10	22.5 Å²	22.5	6%	0.061	12%	0.123	C	C	.	.	H	α-helix	trans	-58.7	-36.8	177.1	-63.3	0	0	0	0	112.8	P253 I260 P521 M541	P253-T256 PolarHBondContact O-N 2.85Å; P253-T256 VanDerWaalsContact O-N 3.16Å; T256-I260 HydrophobicContact CG2-CD1 3.75Å; T256-I260 HydrophobicContact CG2-CG1 4.45Å; T256-I260 WeakPolarHBondContact O-CB 3.33Å; T256-I260 WeakPolarHBondContact O-CD1 3.49Å; T256-I260 VanDerWaalsContact O-CG1 3.24Å; T256-I260 WeakPolarHBondContact O-CG1 3.3Å; T256-I260 PolarHBondContact O-N 2.96Å; T256-P521 HydrophobicContact CG2-CB 4.24Å; T256-P521 HydrophobicContact CG2-CG 3.93Å; T256-P521 PolarHBondContact OG1-O 2.86Å; T256-P521 VanDerWaalsContact OG1-O 3.1Å; T256-M541 HydrophobicContact CG2-CE 4.18Å
257	R	92.6	Very high	90.3	Very high	6 Å²	6	22.3 Å²	22.3	2%	0.023	12%	0.123	C	C	.	.	H	α-helix	trans	-57.6	-55.5	172.2	173.1	58.9	61.4	-172.4	7	111.1	Y125 E249 V252 P253 Y254 L255 C259 I260 D261	Y125-R257 PolarHBondContact OH-NH1 3.37Å; E249-R257 IonicContact OE2-CZ 3.99Å; E249-R257 VanDerWaalsContact OE2-CZ 3.25Å; E249-R257 IonicContact OE2-NH1 2.77Å; E249-R257 PolarHBondContact OE2-NH1 3.25Å; E249-R257 IonicContact OE2-NH2 3Å; E249-R257 PolarHBondContact OE2-NH2 3.43Å; V252-R257 HydrophobicContact CG1-CB 4.02Å; P253-R257 PolarHBondContact O-N 2.92Å; Y254-R257 WeakPolarHBondContact O-CB 3.41Å; Y254-R257 PolarHBondContact O-N 3.44Å; L255-R257 VanDerWaalsContact C-N 3.29Å; L255-R257 PolarHBondContact O-N 3.03Å; R257-C259 VanDerWaalsContact C-N 3.32Å; R257-C259 PolarHBondContact O-N 3.36Å; R257-I260 PolarHBondContact O-N 3.27Å; R257-D261 VanDerWaalsContact CD-CG 3.46Å; R257-D261 WeakPolarHBondContact CD-OD1 3.46Å; R257-D261 WeakPolarHBondContact CD-OD2 3.42Å; R257-D261 IonicContact NH1-OD1 2.6Å; R257-D261 PolarHBondContact NH1-OD1 3.34Å; R257-D261 WeakPolarHBondContact O-CB 3.39Å; R257-D261 PolarHBondContact O-N 2.78Å
258	V	91.9	Very high	90.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.4	-37.6	-178	-176.9	0	0	0	0	111.5	I104 Y122 Y254 L255 L262	I104-V258 HydrophobicContact CD1-CB 4.26Å; I104-V258 HydrophobicContact CD1-CG1 3.57Å; I104-V258 HydrophobicContact CG1-CG1 4.08Å; I104-V258 HydrophobicContact CG2-CB 4.25Å; I104-V258 HydrophobicContact CG2-CG1 4.37Å; I104-V258 HydrophobicContact CG2-CG2 4.3Å; Y122-V258 HydrophobicContact CD1-CG2 3.8Å; Y122-V258 HydrophobicContact CD2-CG1 4.18Å; Y122-V258 HydrophobicContact CG-CG1 4.15Å; Y122-V258 HydrophobicContact CG-CG2 3.78Å; Y254-V258 HydrophobicContact CD2-CG2 4.22Å; Y254-V258 HydrophobicContact CE1-CG2 4.19Å; Y254-V258 HydrophobicContact CE2-CG2 3.73Å; Y254-V258 WeakPolarHBondContact O-CG2 3.34Å; Y254-V258 PolarHBondContact O-N 3.27Å; L255-V258 PolarHBondContact O-N 3Å; L255-V258 VanDerWaalsContact O-N 3.16Å; V258-L262 HydrophobicContact CG1-CD1 3.6Å; V258-L262 HydrophobicContact CG1-CG 4.11Å; V258-L262 VanDerWaalsContact O-CB 3.3Å; V258-L262 WeakPolarHBondContact O-CB 3.5Å; V258-L262 WeakPolarHBondContact O-CG 3.36Å; V258-L262 PolarHBondContact O-N 3.47Å
259	C	92.4	Very high	90.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.4	-42.4	174.4	-66.3	0	0	0	0	113.2	M88 L255 R257 N263 I264 P521	M88-C259 PolarHBondContact SD-SG 2.93Å; L255-C259 PolarHBondContact O-N 3.35Å; L255-C259 PolarHBondContact O-SG 2.69Å; R257-C259 VanDerWaalsContact C-N 3.32Å; R257-C259 PolarHBondContact O-N 3.36Å; C259-N263 CarbonylContact O-C 3.42Å; C259-N263 VanDerWaalsContact O-CA 3.25Å; C259-N263 WeakPolarHBondContact O-CA 3.07Å; C259-N263 PolarHBondContact O-N 3.32Å; C259-I264 WeakPolarHBondContact CB-O 3.38Å; C259-I264 PolarHBondContact O-N 3.36Å; C259-P521 HydrophobicContact CB-CB 3.55Å
260	I	92.1	Very high	90.5	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-66.1	-53.9	175.3	-71	163.8	0	0	0	110.1	T256 R257 L262 N263 P521 M541 V542 Y545 F551	T256-I260 HydrophobicContact CG2-CD1 3.75Å; T256-I260 HydrophobicContact CG2-CG1 4.45Å; T256-I260 WeakPolarHBondContact O-CB 3.33Å; T256-I260 WeakPolarHBondContact O-CD1 3.49Å; T256-I260 VanDerWaalsContact O-CG1 3.24Å; T256-I260 WeakPolarHBondContact O-CG1 3.3Å; T256-I260 PolarHBondContact O-N 2.96Å; R257-I260 PolarHBondContact O-N 3.27Å; I260-L262 VanDerWaalsContact C-N 3.31Å; I260-L262 PolarHBondContact O-N 3.28Å; I260-N263 PolarHBondContact O-N 2.8Å; I260-N263 VanDerWaalsContact O-N 3.17Å; I260-P521 HydrophobicContact CD1-CG 4.29Å; I260-P521 HydrophobicContact CG1-CB 3.89Å; I260-P521 HydrophobicContact CG1-CG 3.94Å; I260-M541 HydrophobicContact CD1-CB 3.82Å; I260-M541 HydrophobicContact CD1-CE 3.93Å; I260-V542 HydrophobicContact CG1-CG2 3.92Å; I260-Y545 HydrophobicContact CG2-CD1 3.79Å; I260-Y545 HydrophobicContact CG2-CD2 3.94Å; I260-Y545 HydrophobicContact CG2-CE1 4.46Å; I260-Y545 HydrophobicContact CG2-CG 3.48Å; I260-Y545 VanDerWaalsContact CG2-CG 3.48Å; I260-F551 HydrophobicContact CD1-CE2 4.45Å; I260-F551 HydrophobicContact CD1-CZ 4.4Å
261	D	92	Very high	90.8	Very high	20 Å²	20	22.6 Å²	22.6	11%	0.107	12%	0.124	C	C	.	.	H	α-helix	trans	-70.3	-26.6	-169.8	-60.4	-9.5	0	0	0	113.3	Y122 Y125 R257 Y545	Y122-D261 HydrophobicContact CE2-CB 4.36Å; Y122-D261 WeakPolarHBondContact OH-CB 3.44Å; Y122-D261 PolarHBondContact OH-OD2 3.4Å; Y122-D261 VanDerWaalsContact OH-OD2 3.05Å; Y125-D261 WeakPolarHBondContact CE1-OD2 3.17Å; Y125-D261 PolarHBondContact OH-OD1 3.06Å; Y125-D261 PolarHBondContact OH-OD2 2.8Å; Y125-D261 VanDerWaalsContact OH-OD2 3.13Å; R257-D261 VanDerWaalsContact CD-CG 3.46Å; R257-D261 WeakPolarHBondContact CD-OD1 3.46Å; R257-D261 WeakPolarHBondContact CD-OD2 3.42Å; R257-D261 IonicContact NH1-OD1 2.6Å; R257-D261 PolarHBondContact NH1-OD1 3.34Å; R257-D261 WeakPolarHBondContact O-CB 3.39Å; R257-D261 PolarHBondContact O-N 2.78Å; D261-Y545 WeakPolarHBondContact OD1-CE2 3.34Å
262	L	90.5	Very high	91	Very high	52 Å²	52	19.9 Å²	19.9	27%	0.272	11%	0.11	S	C	.	.	H	α-helix	trans	-100.9	-2.6	174.3	-58.9	-175.9	0	0	0	113.6	R120 Y122 V258 I260 I264	R120-L262 HydrophobicContact CG-CD1 4.06Å; Y122-L262 HydrophobicContact CD2-CD1 4.11Å; Y122-L262 HydrophobicContact CD2-CD2 4.12Å; Y122-L262 HydrophobicContact CD2-CG 4.14Å; Y122-L262 HydrophobicContact CE2-CD2 3.82Å; Y122-L262 HydrophobicContact CE2-CG 4.07Å; V258-L262 HydrophobicContact CG1-CD1 3.6Å; V258-L262 HydrophobicContact CG1-CG 4.11Å; V258-L262 VanDerWaalsContact O-CB 3.3Å; V258-L262 WeakPolarHBondContact O-CB 3.5Å; V258-L262 WeakPolarHBondContact O-CG 3.36Å; V258-L262 PolarHBondContact O-N 3.47Å; I260-L262 VanDerWaalsContact C-N 3.31Å; I260-L262 PolarHBondContact O-N 3.28Å; L262-I264 HydrophobicContact CB-CD1 3.71Å; L262-I264 HydrophobicContact CB-CG1 3.85Å; L262-I264 HydrophobicContact CD1-CD1 3.97Å
263	N	90.7	Very high	91	Very high	93 Å²	93	19.4 Å²	19.4	50%	0.497	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	49.5	-176.6	-165	72.8	0	0	0	113.4	C259 I260	C259-N263 CarbonylContact O-C 3.42Å; C259-N263 VanDerWaalsContact O-CA 3.25Å; C259-N263 WeakPolarHBondContact O-CA 3.07Å; C259-N263 PolarHBondContact O-N 3.32Å; I260-N263 PolarHBondContact O-N 2.8Å; I260-N263 VanDerWaalsContact O-N 3.17Å
264	I	91.6	Very high	90.7	Very high	3 Å²	3	16 Å²	16	2%	0.015	9%	0.086	C	C	.	.			trans	-110.6	129.2	-176.8	-60	176.9	0	0	0	111.2	L85 L106 C259 L262 Y270 F282	L85-I264 HydrophobicContact CD2-CG2 3.47Å; L85-I264 VanDerWaalsContact CD2-CG2 3.47Å; L106-I264 HydrophobicContact CD1-CD1 4.45Å; L106-I264 HydrophobicContact CD2-CG2 4.08Å; C259-I264 WeakPolarHBondContact CB-O 3.38Å; C259-I264 PolarHBondContact O-N 3.36Å; L262-I264 HydrophobicContact CB-CD1 3.71Å; L262-I264 HydrophobicContact CB-CG1 3.85Å; L262-I264 HydrophobicContact CD1-CD1 3.97Å; I264-Y270 WeakPolarHBondContact CA-OH 3.31Å; I264-Y270 HydrophobicContact CG2-CE2 4.44Å; I264-F282 HydrophobicContact CD1-CB 4.49Å; I264-F282 HydrophobicContact CD1-CD2 3.76Å; I264-F282 HydrophobicContact CD1-CE2 4.26Å; I264-F282 HydrophobicContact CD1-CG 4.19Å
265	F	92.5	Very high	90.2	Very high	20 Å²	20	19 Å²	19	9%	0.088	10%	0.099	C	C	.	.			trans	-132.8	138.8	-174.9	-61.2	-80.2	0	0	0	111.5	Y270 L520 P521 V542	F265-Y270 PolarHBondContact N-OH 2.74Å; F265-L520 WeakPolarHBondContact CD1-O 3.47Å; F265-P521 HydrophobicContact CE1-CB 4.38Å; F265-V542 HydrophobicContact CE1-CG2 4.23Å; F265-V542 HydrophobicContact CZ-CG1 4.13Å; F265-V542 HydrophobicContact CZ-CG2 4.25Å
266	A	91.1	Very high	89.4	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	152.8	172.5	0	0	0	0	0	110.4	M88 C268 C517 T518 P524	M88-A266 HydrophobicContact CE-CB 3.61Å; A266-C268 VanDerWaalsContact C-N 3.27Å; A266-C268 PolarHBondContact O-N 3.03Å; A266-C517 HydrophobicContact CB-CB 3.92Å; A266-C517 CarbonylContact O-C 3.58Å; A266-C517 WeakPolarHBondContact O-CB 3.47Å; A266-T518 PolarHBondContact O-N 3.43Å; A266-P524 HydrophobicContact CB-CG 4.4Å
267	G	88.5	Confident	88.4	Confident	6 Å²	6	26.6 Å²	26.6	6%	0.062	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	80	1.6	-175.3	0	0	0	0	0	115.2	W84 L85	W84-G267 PolarHBondContact NE1-O 3.4Å; L85-G267 PolarHBondContact O-N 3.07Å
268	C	89.9	Confident	87.7	Confident	13 Å²	13	29.5 Å²	29.5	9%	0.088	19%	0.186	C	C	.	.			trans	-103.7	153.9	174.5	-71.5	0	0	0	0	112.5	L85 A266 Y270 H284	L85-C268 PolarHBondContact N-O 2.97Å; A266-C268 VanDerWaalsContact C-N 3.27Å; A266-C268 PolarHBondContact O-N 3.03Å; C268-Y270 HydrophobicContact CB-CD2 4.39Å; C268-Y270 HydrophobicContact CB-CE2 3.61Å; C268-H284 PolarHBondContact SG-NE2 3.15Å
269	W	91.3	Very high	87.2	Confident	11 Å²	11	32.5 Å²	32.5	4%	0.042	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	137.5	171.9	-71.6	92.8	0	0	0	111.5	I82 G83 W84 T111 H284 H285 T288 A290 P292	I82-W269 HydrophobicContact CG2-CE3 4.17Å; G83-W269 VanDerWaalsContact C-CE3 3.4Å; W84-W269 HydrophobicContact CB-CD2 3.77Å; W84-W269 HydrophobicContact CB-CE3 3.81Å; W84-W269 HydrophobicContact CB-CG 4.44Å; W84-W269 HydrophobicContact CB-CH2 3.89Å; W84-W269 HydrophobicContact CB-CZ2 3.88Å; W84-W269 HydrophobicContact CB-CZ3 3.86Å; W84-W269 AromaticContact CD1-CD1 3.68Å; W84-W269 AromaticContact CD1-CE2 3.76Å; W84-W269 AromaticContact CD1-CG 3.99Å; W84-W269 AromaticContact CD1-NE1 3.52Å; W84-W269 HydrophobicContact CG-CD2 4.32Å; W84-W269 HydrophobicContact CG-CZ2 4.35Å; T111-W269 HydrophobicContact CG2-CH2 3.5Å; T111-W269 HydrophobicContact CG2-CZ2 4.28Å; T111-W269 HydrophobicContact CG2-CZ3 3.98Å; W269-H284 PolarHBondContact O-CD2 2.97Å; W269-H285 HydrophobicContact CB-CB 4.21Å; W269-H285 PolarHBondContact O-N 3.49Å; W269-T288 HydrophobicContact CD2-CG2 4.12Å; W269-T288 HydrophobicContact CG-CG2 4.09Å; W269-T288 HydrophobicContact CZ2-CG2 4.35Å; W269-A290 PolarHBondContact NE1-O 2.93Å; W269-P292 HydrophobicContact CH2-CB 4.14Å; W269-P292 HydrophobicContact CH2-CG 4.48Å; W269-P292 HydrophobicContact CZ2-CB 4.06Å; W269-P292 HydrophobicContact CZ2-CG 4.22Å
270	Y	91.8	Very high	86.8	Confident	5 Å²	5	33.4 Å²	33.4	2%	0.02	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	137.9	177.7	-68.4	-87.6	0	0	0	112.1	I82 G83 L85 F108 I264 F265 C268 F282 K283 H284	I82-Y270 WeakPolarHBondContact CA-O 3.42Å; G83-Y270 PolarHBondContact N-O 3.02Å; G83-Y270 PolarHBondContact O-N 3.26Å; L85-Y270 HydrophobicContact CB-CD2 4.26Å; L85-Y270 HydrophobicContact CB-CE2 4.37Å; L85-Y270 HydrophobicContact CD2-CE2 4.23Å; F108-Y270 HydrophobicContact CE1-CD2 4.19Å; F108-Y270 HydrophobicContact CE1-CG 4.5Å; I264-Y270 WeakPolarHBondContact CA-OH 3.31Å; I264-Y270 HydrophobicContact CG2-CE2 4.44Å; F265-Y270 PolarHBondContact N-OH 2.74Å; C268-Y270 HydrophobicContact CB-CD2 4.39Å; C268-Y270 HydrophobicContact CB-CE2 3.61Å; Y270-F282 HydrophobicContact CD1-CB 4.11Å; Y270-K283 CarbonylContact C-O 3.54Å; Y270-K283 VanDerWaalsContact CA-O 3.27Å; Y270-K283 WeakPolarHBondContact CA-O 3.28Å; Y270-H284 HydrophobicContact CD1-CB 4.43Å; Y270-H284 HydrophobicContact CE1-CB 4.06Å
271	V	91.1	Very high	86.6	Confident	29 Å²	29	36.6 Å²	36.6	18%	0.176	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	117.9	157.6	-167.3	0	0	0	0	107.1	E80 I82 F282 K283 H285	E80-V271 HydrophobicContact CB-CG1 4.32Å; I82-V271 HydrophobicContact CG1-CG1 4.43Å; I82-V271 HydrophobicContact CG1-CG2 4.27Å; V271-F282 WeakPolarHBondContact O-CA 3.37Å; V271-K283 HydrophobicContact CB-CB 4.46Å; V271-K283 PolarHBondContact N-O 3.46Å; V271-K283 PolarHBondContact O-N 2.86Å; V271-H285 HydrophobicContact CG2-CB 4.45Å
272	T	89.7	Confident	86.5	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	119.9	174.5	-53.9	0	0	0	0	110	E80 R81 V118 P280 E281 F282	E80-T272 CarbonylContact C-O 3.59Å; E80-T272 VanDerWaalsContact CA-O 3.29Å; E80-T272 WeakPolarHBondContact CA-O 3.35Å; R81-T272 PolarHBondContact N-O 3.07Å; R81-T272 PolarHBondContact O-N 3.44Å; V118-T272 HydrophobicContact CG1-CG2 4.18Å; V118-T272 HydrophobicContact CG2-CG2 4.08Å; T272-P280 HydrophobicContact CG2-CB 4.34Å; T272-E281 CarbonylContact C-O 3.57Å; T272-E281 WeakPolarHBondContact CA-O 3.49Å; T272-F282 HydrophobicContact CG2-CD1 3.8Å; T272-F282 HydrophobicContact CG2-CE1 3.5Å; T272-F282 VanDerWaalsContact CG2-CE1 3.5Å; T272-F282 HydrophobicContact CG2-CZ 4.28Å; T272-F282 WeakPolarHBondContact OG1-CD1 3.44Å; T272-F282 WeakPolarHBondContact OG1-CE1 3.41Å
273	T	88.6	Confident	86.3	Confident	11 Å²	11	40.9 Å²	40.9	7%	0.067	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	115.8	178.6	-50.8	0	0	0	0	109.6	E80 K275 E281	E80-T273 HydrophobicContact CG-CG2 3.91Å; E80-T273 VanDerWaalsContact OE1-CG2 3.32Å; E80-T273 WeakPolarHBondContact OE1-CG2 3.06Å; E80-T273 PolarHBondContact OE1-OG1 3.27Å; T273-K275 HydrophobicContact CG2-CG 4.29Å; T273-E281 PolarHBondContact N-O 3.07Å; T273-E281 PolarHBondContact O-N 3Å
274	C	83.1	Confident	86	Confident	7 Å²	7	40.2 Å²	40.2	5%	0.047	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.4	175.3	-73	0	0	0	0	110.4	F75 G77 P78 G79	F75-C274 HydrophobicContact CD1-CB 4.32Å; F75-C274 VanDerWaalsContact CD1-SG 3.58Å; F75-C274 HydrophobicContact CE1-CB 3.78Å; F75-C274 VanDerWaalsContact CE1-SG 3.54Å; F75-C274 HydrophobicContact CZ-CB 4.09Å; G77-C274 WeakPolarHBondContact O-CB 3.45Å; P78-C274 WeakPolarHBondContact CA-O 3.46Å; G79-C274 PolarHBondContact N-O 2.95Å; G79-C274 VanDerWaalsContact N-O 3.11Å; G79-C274 PolarHBondContact O-N 3.42Å
275	K	80.5	Confident	85.5	Confident	90 Å²	90	42.4 Å²	42.4	39%	0.391	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.4	-178.9	-59.9	169.9	-165.6	163.4	0	108.5	T273 G277 C278 E281	T273-K275 HydrophobicContact CG2-CG 4.29Å; K275-G277 PolarHBondContact O-N 2.88Å; K275-C278 HydrophobicContact CB-CB 4.13Å; K275-C278 PolarHBondContact O-N 3.37Å; K275-C278 VanDerWaalsContact O-O 3.11Å; K275-E281 IonicContact NZ-OE1 2.76Å; K275-E281 PolarHBondContact NZ-OE1 2.82Å; K275-E281 IonicContact NZ-OE2 3.15Å; K275-E281 PolarHBondContact NZ-OE2 3.45Å
276	P	73.7	Confident	84.5	Confident	101 Å²	101	48.4 Å²	48.4	66%	0.656	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	127.2	-178.4	-25.7	35.2	0	0	0	111.9	P78 C278	P78-P276 HydrophobicContact CB-CG 4.11Å; P276-C278 VanDerWaalsContact C-N 3.32Å; P276-C278 PolarHBondContact O-N 3.14Å
277	G	71.8	Confident	83.3	Confident	87 Å²	87	55 Å²	55	90%	0.897	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	7.2	-177.4	0	0	0	0	0	115.6	K275	K275-G277 PolarHBondContact O-N 2.88Å
278	C	77.3	Confident	82.2	Confident	67 Å²	67	57.2 Å²	57.2	45%	0.453	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	144.7	172.2	-57.2	0	0	0	0	111	K275 P276	K275-C278 HydrophobicContact CB-CB 4.13Å; K275-C278 PolarHBondContact O-N 3.37Å; K275-C278 VanDerWaalsContact O-O 3.11Å; P276-C278 VanDerWaalsContact C-N 3.32Å; P276-C278 PolarHBondContact O-N 3.14Å
279	P	80.3	Confident	81	Confident	63 Å²	63	60 Å²	60	41%	0.409	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	143.2	-179.1	31.7	-36	0	0	0	111.1	R120 P121 E281	R120-P279 PolarHBondContact NH1-O 3.32Å; P121-P279 HydrophobicContact CG-CB 4.48Å; P279-E281 PolarHBondContact O-N 2.73Å
280	P	85.7	Confident	79.8	Confident	19 Å²	19	62 Å²	62	12%	0.123	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	129.2	-170.1	-29.4	35.2	0	0	0	114.7	V118 R120 T272 F282	V118-P280 HydrophobicContact CG1-CB 3.63Å; V118-P280 HydrophobicContact CG1-CG 3.66Å; R120-P280 PolarHBondContact NH1-O 3.41Å; T272-P280 HydrophobicContact CG2-CB 4.34Å; P280-F282 HydrophobicContact CB-CE2 4.21Å; P280-F282 HydrophobicContact CB-CZ 3.97Å; P280-F282 WeakPolarHBondContact O-CE2 3.46Å
281	E	86.4	Confident	78.9	Confident	72 Å²	72	64.7 Å²	64.7	34%	0.336	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	137.2	176.5	-75.9	164.5	-145.5	0	0	110.4	T272 T273 K275 P279	T272-E281 CarbonylContact C-O 3.57Å; T272-E281 WeakPolarHBondContact CA-O 3.49Å; T273-E281 PolarHBondContact N-O 3.07Å; T273-E281 PolarHBondContact O-N 3Å; K275-E281 IonicContact NZ-OE1 2.76Å; K275-E281 PolarHBondContact NZ-OE1 2.82Å; K275-E281 IonicContact NZ-OE2 3.15Å; K275-E281 PolarHBondContact NZ-OE2 3.45Å; P279-E281 PolarHBondContact O-N 2.73Å
282	F	89.5	Confident	78.2	Confident	39 Å²	39	64.2 Å²	64.2	17%	0.171	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133.2	177.8	-55.2	-82.5	0	0	0	109.9	L106 F108 V118 R120 I264 Y270 V271 T272 P280	L106-F282 HydrophobicContact CD1-CE1 3.76Å; L106-F282 HydrophobicContact CD1-CE2 3.78Å; L106-F282 HydrophobicContact CD1-CZ 3.3Å; F108-F282 HydrophobicContact CE2-CE1 4.02Å; F108-F282 HydrophobicContact CZ-CD1 4.09Å; F108-F282 AromaticContact CZ-CE1 3.87Å; F108-F282 HydrophobicContact CZ-CE1 3.87Å; V118-F282 HydrophobicContact CB-CE1 4.23Å; V118-F282 HydrophobicContact CB-CZ 4.21Å; V118-F282 HydrophobicContact CG1-CE1 3.99Å; V118-F282 HydrophobicContact CG1-CZ 3.67Å; R120-F282 HydrophobicContact CB-CE2 4.11Å; R120-F282 HydrophobicContact CB-CZ 4.4Å; R120-F282 HydrophobicContact CG-CE2 4.12Å; I264-F282 HydrophobicContact CD1-CB 4.49Å; I264-F282 HydrophobicContact CD1-CD2 3.76Å; I264-F282 HydrophobicContact CD1-CE2 4.26Å; I264-F282 HydrophobicContact CD1-CG 4.19Å; Y270-F282 HydrophobicContact CD1-CB 4.11Å; V271-F282 WeakPolarHBondContact O-CA 3.37Å; T272-F282 HydrophobicContact CG2-CD1 3.8Å; T272-F282 HydrophobicContact CG2-CE1 3.5Å; T272-F282 VanDerWaalsContact CG2-CE1 3.5Å; T272-F282 HydrophobicContact CG2-CZ 4.28Å; T272-F282 WeakPolarHBondContact OG1-CD1 3.44Å; T272-F282 WeakPolarHBondContact OG1-CE1 3.41Å; P280-F282 HydrophobicContact CB-CE2 4.21Å; P280-F282 HydrophobicContact CB-CZ 3.97Å; P280-F282 WeakPolarHBondContact O-CE2 3.46Å
283	K	86.7	Confident	77.4	Confident	122 Å²	122	73.7 Å²	73.7	53%	0.53	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	126.8	172.8	-68.3	173.9	-176.5	165.1	0	109.7	Y270 V271	Y270-K283 CarbonylContact C-O 3.54Å; Y270-K283 VanDerWaalsContact CA-O 3.27Å; Y270-K283 WeakPolarHBondContact CA-O 3.28Å; V271-K283 HydrophobicContact CB-CB 4.46Å; V271-K283 PolarHBondContact N-O 3.46Å; V271-K283 PolarHBondContact O-N 2.86Å
284	H	84.6	Confident	77.4	Confident	79 Å²	79	73.6 Å²	73.6	37%	0.366	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	137.2	175.7	-171.7	-132.1	0	0	0	110.5	C268 W269 Y270 E286	C268-H284 PolarHBondContact SG-NE2 3.15Å; W269-H284 PolarHBondContact O-CD2 2.97Å; Y270-H284 HydrophobicContact CD1-CB 4.43Å; Y270-H284 HydrophobicContact CE1-CB 4.06Å; H284-E286 IonicContact CE1-OE1 3.82Å; H284-E286 WeakPolarHBondContact ND1-CG 3.4Å; H284-E286 IonicContact ND1-OE1 2.75Å; H284-E286 PolarHBondContact ND1-OE1 3.21Å
285	H	82.4	Confident	77.7	Confident	49 Å²	49	74.8 Å²	74.8	23%	0.227	42%	0.415	C	S	.	.			trans	-112.9	92.7	-179.3	-179	34.9	0	0	0	110.5	W269 V271 D287 T288	W269-H285 HydrophobicContact CB-CB 4.21Å; W269-H285 PolarHBondContact O-N 3.49Å; V271-H285 HydrophobicContact CG2-CB 4.45Å; H285-D287 VanDerWaalsContact C-N 3.34Å; H285-D287 IonicContact CE1-OD2 2.95Å; H285-D287 PolarHBondContact CE1-OD2 2.8Å; H285-D287 IonicContact ND1-OD2 2.95Å; H285-D287 PolarHBondContact ND1-OD2 2.98Å; H285-D287 PolarHBondContact O-N 3.39Å; H285-T288 PolarHBondContact CD2-OG1 3.27Å; H285-T288 PolarHBondContact NE2-OG1 2.92Å
286	E	71.5	Confident	78.3	Confident	147 Å²	147	70.5 Å²	70.5	69%	0.687	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-18.7	-167.6	-68	-174.3	177.7	0	0	115	H284 T288	H284-E286 IonicContact CE1-OE1 3.82Å; H284-E286 WeakPolarHBondContact ND1-CG 3.4Å; H284-E286 IonicContact ND1-OE1 2.75Å; H284-E286 PolarHBondContact ND1-OE1 3.21Å; E286-T288 VanDerWaalsContact C-N 3.34Å
287	D	64.6	Low	79.4	Confident	137 Å²	137	65.7 Å²	65.7	73%	0.733	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-27.3	-177.5	-46.5	-76.4	0	0	0	112.7	H285	H285-D287 VanDerWaalsContact C-N 3.34Å; H285-D287 IonicContact CE1-OD2 2.95Å; H285-D287 PolarHBondContact CE1-OD2 2.8Å; H285-D287 IonicContact ND1-OD2 2.95Å; H285-D287 PolarHBondContact ND1-OD2 2.98Å; H285-D287 PolarHBondContact O-N 3.39Å
288	T	64.7	Low	80.5	Confident	54 Å²	54	61.6 Å²	61.6	33%	0.331	32%	0.323	S	S	.	.			trans	-97.3	94.8	-177.8	-56.5	0	0	0	0	110.2	W269 H285 E286	W269-T288 HydrophobicContact CD2-CG2 4.12Å; W269-T288 HydrophobicContact CG-CG2 4.09Å; W269-T288 HydrophobicContact CZ2-CG2 4.35Å; H285-T288 PolarHBondContact CD2-OG1 3.27Å; H285-T288 PolarHBondContact NE2-OG1 2.92Å; E286-T288 VanDerWaalsContact C-N 3.34Å
289	V	66.6	Low	81.4	Confident	70 Å²	70	58.4 Å²	58.4	42%	0.424	30%	0.301	S	S	.	.			trans	-93.2	-20.6	-178.4	-158.9	0	0	0	0	113	L870	V289-L870 HydrophobicContact CG1-CD2 4.18Å
290	A	65.4	Low	82.1	Confident	53 Å²	53	56.2 Å²	56.2	44%	0.438	29%	0.286	S	S	.	.	S	Bend	trans	-70.6	145.3	177.7	0	0	0	0	0	111.7	W269	W269-A290 PolarHBondContact NE1-O 2.93Å
291	W	72.1	Confident	82.6	Confident	62 Å²	62	55.5 Å²	55.5	24%	0.235	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-74.6	151.7	170.5	-52.8	-52	0	0	0	110.5	W84 H510 P511 L870	W84-W291 AromaticContact CZ2-CD1 3.81Å; W84-W291 HydrophobicContact CZ2-CG 4.38Å; W84-W291 AromaticContact NE1-CD1 4Å; W291-H510 AromaticContact CD2-NE2 3.96Å; W291-H510 AromaticContact CE3-CD2 3.98Å; W291-P511 HydrophobicContact CH2-CB 3.19Å; W291-P511 HydrophobicContact CZ2-CB 4.09Å; W291-P511 HydrophobicContact CZ3-CB 3.59Å; W291-L870 HydrophobicContact CH2-CB 4.06Å; W291-L870 HydrophobicContact CH2-CD1 3.63Å; W291-L870 HydrophobicContact CH2-CG 4.45Å; W291-L870 HydrophobicContact CZ2-CD1 3.29Å; W291-L870 HydrophobicContact CZ3-CD1 4.49Å
292	P	76	Confident	82.9	Confident	20 Å²	20	52.7 Å²	52.7	13%	0.13	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-66.8	170	161.8	33.6	-36.2	0	0	0	110	W84 L109 W269 P294	W84-P292 HydrophobicContact CB-CG 3.9Å; W84-P292 VanDerWaalsContact CD2-CD 3.43Å; W84-P292 HydrophobicContact CD2-CG 3.6Å; W84-P292 HydrophobicContact CE3-CG 3.54Å; W84-P292 HydrophobicContact CG-CG 3.8Å; W84-P292 HydrophobicContact CZ3-CG 4.18Å; L109-P292 HydrophobicContact CB-CG 4.44Å; L109-P292 HydrophobicContact CD1-CG 4.36Å; W269-P292 HydrophobicContact CH2-CB 4.14Å; W269-P292 HydrophobicContact CH2-CG 4.48Å; W269-P292 HydrophobicContact CZ2-CB 4.06Å; W269-P292 HydrophobicContact CZ2-CG 4.22Å; P292-P294 WeakPolarHBondContact O-CD 3.01Å
293	E	74.8	Confident	83.1	Confident	198 Å²	198	51 Å²	51	93%	0.925	26%	0.261	S	S	*	.			trans	-89.3	101.6	166.6	-65.3	-179	157.2	0	0	108.6
294	P	86.9	Confident	83.3	Confident	10 Å²	10	46.3 Å²	46.3	7%	0.065	24%	0.243	C	C	.	.			trans	-74.7	152.4	172.7	31.6	-34.9	0	0	0	110.5	L109 P292 V296 N382 I383	L109-P294 HydrophobicContact CD1-CB 4.06Å; P292-P294 WeakPolarHBondContact O-CD 3.01Å; P294-V296 HydrophobicContact CB-CG2 4.45Å; P294-V296 HydrophobicContact CG-CG2 3.9Å; P294-V296 PolarHBondContact O-N 3.4Å; P294-N382 HydrophobicContact CB-CB 4.01Å; P294-I383 HydrophobicContact CB-CD1 4.21Å; P294-I383 HydrophobicContact CB-CG1 4.45Å; P294-I383 HydrophobicContact CG-CD1 4.02Å
295	V	90.5	Very high	83.2	Confident	31 Å²	31	43.9 Å²	43.9	19%	0.188	23%	0.231	C	C	.	.			trans	-71	114.9	167.4	-179.1	0	0	0	0	108.5	L325 D326 P381 N382 I383	V295-L325 HydrophobicContact CG1-CD1 3.76Å; V295-D326 WeakPolarHBondContact CA-OD1 3.38Å; V295-P381 HydrophobicContact CG1-CB 4.34Å; V295-N382 PolarHBondContact N-OD1 2.79Å; V295-N382 VanDerWaalsContact N-OD1 3.07Å; V295-N382 PolarHBondContact O-N 3.25Å; V295-I383 PolarHBondContact O-N 2.88Å
296	V	93.2	Very high	82.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122	-177	179.2	0	0	0	0	109.9	P294 L325 D326 I383 V385 Y502 Y505 M506	P294-V296 HydrophobicContact CB-CG2 4.45Å; P294-V296 HydrophobicContact CG-CG2 3.9Å; P294-V296 PolarHBondContact O-N 3.4Å; V296-L325 WeakPolarHBondContact O-CA 3.46Å; V296-D326 PolarHBondContact N-OD1 3.44Å; V296-D326 PolarHBondContact O-N 3.43Å; V296-D326 VanDerWaalsContact O-N 3.16Å; V296-I383 HydrophobicContact CG2-CB 4.44Å; V296-V385 HydrophobicContact CG1-CG2 3.72Å; V296-Y502 HydrophobicContact CB-CE2 4.29Å; V296-Y502 HydrophobicContact CG1-CD2 4.31Å; V296-Y502 HydrophobicContact CG1-CE2 4.1Å; V296-Y505 HydrophobicContact CG1-CD1 3.89Å; V296-Y505 HydrophobicContact CG1-CE1 3.84Å; V296-Y505 HydrophobicContact CG2-CE1 4.02Å; V296-M506 HydrophobicContact CB-CE 3.78Å; V296-M506 HydrophobicContact CG1-CE 4.23Å; V296-M506 HydrophobicContact CG2-CE 3.55Å; V296-M506 HydrophobicContact CG2-SD 4.29Å
297	L	96	Very high	82.4	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	109.9	171.3	-170.7	159.9	0	0	0	108.7	F299 Y323 M324 L325 F372 I376 V379 P381 I383 L384 V385	L297-F299 HydrophobicContact CD2-CB 3.88Å; L297-F299 HydrophobicContact CD2-CD1 3.92Å; L297-F299 HydrophobicContact CD2-CG 4.32Å; L297-Y323 HydrophobicContact CD1-CD2 4.13Å; L297-Y323 HydrophobicContact CD2-CD2 4.43Å; L297-Y323 HydrophobicContact CG-CD2 4.09Å; L297-M324 WeakPolarHBondContact CA-O 3.46Å; L297-L325 HydrophobicContact CB-CD1 4.18Å; L297-F372 HydrophobicContact CD2-CE2 4.39Å; L297-F372 HydrophobicContact CD2-CZ 4.48Å; L297-I376 HydrophobicContact CD1-CG1 4.06Å; L297-V379 HydrophobicContact CD1-CG2 4.47Å; L297-P381 HydrophobicContact CB-CB 3.8Å; L297-P381 HydrophobicContact CB-CG 4.23Å; L297-P381 HydrophobicContact CD1-CG 4.44Å; L297-I383 PolarHBondContact N-O 3.38Å; L297-L384 CarbonylContact O-C 3.59Å; L297-L384 VanDerWaalsContact O-CA 3.3Å; L297-L384 WeakPolarHBondContact O-CA 3.5Å; L297-V385 PolarHBondContact O-N 3.35Å
298	A	96.1	Very high	82.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.1	173.3	0	0	0	0	0	109.4	Y323 M324 V385 T501 Y502	A298-Y323 CarbonylContact O-C 3.6Å; A298-Y323 WeakPolarHBondContact O-CA 3.45Å; A298-Y323 VanDerWaalsContact O-CB 3.31Å; A298-Y323 WeakPolarHBondContact O-CB 3.45Å; A298-M324 PolarHBondContact N-O 3.11Å; A298-M324 PolarHBondContact O-N 3.17Å; A298-V385 WeakPolarHBondContact CA-O 3.25Å; A298-V385 HydrophobicContact CB-CB 3.83Å; A298-V385 HydrophobicContact CB-CG1 4.37Å; A298-T501 HydrophobicContact CB-CG2 4.31Å; A298-Y502 HydrophobicContact CB-CD2 3.93Å; A298-Y502 HydrophobicContact CB-CG 4.38Å
299	F	95.8	Very high	82.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	159.9	-176.1	80.5	-88.4	0	0	0	113.6	L297 I301 S322 F372 L384 V385 T386 D393 W394 I397	L297-F299 HydrophobicContact CD2-CB 3.88Å; L297-F299 HydrophobicContact CD2-CD1 3.92Å; L297-F299 HydrophobicContact CD2-CG 4.32Å; F299-I301 HydrophobicContact CD2-CG2 4.11Å; F299-I301 HydrophobicContact CE2-CG2 4.22Å; F299-S322 VanDerWaalsContact CA-O 3.29Å; F299-S322 WeakPolarHBondContact CA-O 3.39Å; F299-F372 HydrophobicContact CB-CE2 4.47Å; F299-F372 HydrophobicContact CB-CZ 4.17Å; F299-F372 HydrophobicContact CD1-CZ 4.06Å; F299-F372 HydrophobicContact CD2-CE1 4.45Å; F299-F372 AromaticContact CD2-CZ 3.93Å; F299-F372 HydrophobicContact CD2-CZ 3.93Å; F299-F372 HydrophobicContact CE1-CZ 4.4Å; F299-F372 HydrophobicContact CE2-CE1 4.42Å; F299-F372 HydrophobicContact CE2-CZ 4.3Å; F299-F372 AromaticContact CG-CZ 3.8Å; F299-F372 HydrophobicContact CG-CZ 3.8Å; F299-L384 HydrophobicContact CE1-CD2 4.3Å; F299-V385 PolarHBondContact N-O 2.82Å; F299-T386 HydrophobicContact CD1-CG2 3.84Å; F299-T386 HydrophobicContact CE1-CG2 3.37Å; F299-T386 HydrophobicContact CE2-CG2 4.25Å; F299-T386 HydrophobicContact CG-CG2 4.46Å; F299-T386 HydrophobicContact CZ-CG2 3.61Å; F299-D393 HydrophobicContact CE2-CB 3.86Å; F299-D393 HydrophobicContact CZ-CB 4.27Å; F299-W394 HydrophobicContact CE1-CH2 4.32Å; F299-W394 AromaticContact CE1-CZ2 3.88Å; F299-W394 HydrophobicContact CE1-CZ2 3.88Å; F299-W394 HydrophobicContact CZ-CD2 4.16Å; F299-W394 AromaticContact CZ-CE2 3.98Å; F299-W394 HydrophobicContact CZ-CE3 4.46Å; F299-W394 HydrophobicContact CZ-CH2 4.47Å; F299-W394 HydrophobicContact CZ-CZ2 4.16Å; F299-I397 HydrophobicContact CE2-CD1 3.63Å; F299-I397 HydrophobicContact CZ-CD1 4.14Å
300	D	95.4	Very high	82.9	Confident	18 Å²	18	38.1 Å²	38.1	10%	0.096	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	148.8	178.6	-166.4	97.7	0	0	0	108.6	S322 D497	D300-S322 PolarHBondContact N-O 3.07Å; D300-S322 PolarHBondContact O-N 3.4Å; D300-D497 HydrophobicContact CB-CB 4.37Å
301	I	94.8	Very high	83.7	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.015	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.4	-176.7	66.3	175.7	0	0	0	112.2	F299 T303 I321 F392 D393 F396 I397	F299-I301 HydrophobicContact CD2-CG2 4.11Å; F299-I301 HydrophobicContact CE2-CG2 4.22Å; I301-T303 HydrophobicContact CD1-CG2 4.23Å; I301-T303 HydrophobicContact CG1-CG2 4.38Å; I301-I321 HydrophobicContact CG2-CB 4.4Å; I301-I321 HydrophobicContact CG2-CG1 4.04Å; I301-I321 HydrophobicContact CG2-CG2 4.11Å; I301-F392 HydrophobicContact CG1-CE1 4.23Å; I301-D393 HydrophobicContact CD1-CB 4.32Å; I301-D393 HydrophobicContact CG1-CB 4.37Å; I301-F396 HydrophobicContact CD1-CB 3.91Å; I301-F396 HydrophobicContact CD1-CD1 4.23Å; I301-F396 HydrophobicContact CD1-CG 4.23Å; I301-I397 HydrophobicContact CD1-CD1 4.38Å; I301-I397 HydrophobicContact CD1-CG1 4.1Å; I301-I397 HydrophobicContact CG2-CD1 4.08Å
302	E	93.6	Very high	84.2	Confident	14 Å²	14	36.1 Å²	36.1	7%	0.065	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134.5	171.2	-74	-62.6	175.9	0	0	110.7	I319 M320 M479 Y493	E302-I319 PolarHBondContact O-N 2.92Å; E302-M320 HydrophobicContact CB-CE 4.46Å; E302-M320 PolarHBondContact N-O 2.81Å; E302-M320 PolarHBondContact O-N 2.91Å; E302-M320 VanDerWaalsContact O-N 3.14Å; E302-M479 WeakPolarHBondContact OE2-CE 3.47Å; E302-Y493 HydrophobicContact CG-CE1 4.19Å; E302-Y493 WeakPolarHBondContact OE1-CE1 3.44Å; E302-Y493 VanDerWaalsContact OE1-CZ 3.23Å; E302-Y493 PolarHBondContact OE1-OH 2.97Å
303	T	93.9	Very high	84.7	Confident	3 Å²	3	36.6 Å²	36.6	2%	0.018	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	152.8	-164.9	48.7	0	0	0	0	111.2	I301 P311 Q317 I318 I319 F396	I301-T303 HydrophobicContact CD1-CG2 4.23Å; I301-T303 HydrophobicContact CG1-CG2 4.38Å; T303-P311 WeakPolarHBondContact OG1-CB 3.48Å; T303-P311 VanDerWaalsContact OG1-CG 3.25Å; T303-P311 WeakPolarHBondContact OG1-CG 3.48Å; T303-Q317 CarbonylContact C-O 3.41Å; T303-Q317 WeakPolarHBondContact CA-O 3.47Å; T303-I318 HydrophobicContact CG2-CG1 4.21Å; T303-I319 WeakPolarHBondContact O-CD1 3.38Å; T303-F396 HydrophobicContact CG2-CD1 3.79Å; T303-F396 HydrophobicContact CG2-CD2 4.36Å; T303-F396 HydrophobicContact CG2-CE1 3.45Å; T303-F396 VanDerWaalsContact CG2-CE1 3.45Å; T303-F396 HydrophobicContact CG2-CE2 4.07Å; T303-F396 HydrophobicContact CG2-CG 4.25Å; T303-F396 HydrophobicContact CG2-CZ 3.61Å
304	T	89.8	Confident	85.2	Confident	24 Å²	24	31.6 Å²	31.6	15%	0.147	17%	0.172	C	C	.	.			trans	-65.5	160.7	167.9	69	0	0	0	0	109.5	D316 Q317 I319 I337	T304-D316 VanDerWaalsContact C-OD1 3.22Å; T304-D316 VanDerWaalsContact O-CB 3.28Å; T304-D316 WeakPolarHBondContact O-CB 3.49Å; T304-D316 VanDerWaalsContact OG1-CA 3.24Å; T304-D316 WeakPolarHBondContact OG1-CA 3.25Å; T304-D316 VanDerWaalsContact OG1-CB 3.25Å; T304-D316 WeakPolarHBondContact OG1-CB 3.47Å; T304-D316 PolarHBondContact OG1-OD1 2.89Å; T304-Q317 HydrophobicContact CG2-CB 4.35Å; T304-Q317 PolarHBondContact N-O 3.37Å; T304-Q317 PolarHBondContact OG1-N 3.47Å; T304-I319 HydrophobicContact CG2-CD1 4.28Å; T304-I319 HydrophobicContact CG2-CG1 3.9Å; T304-I337 HydrophobicContact CG2-CD1 3.74Å; T304-I337 HydrophobicContact CG2-CG1 4.32Å; T304-I337 HydrophobicContact CG2-CG2 4.25Å
305	K	83.5	Confident	85.1	Confident	27 Å²	27	36.3 Å²	36.3	12%	0.117	20%	0.197	C	C	.	.			trans	-150.1	149.7	166.9	60.9	-176.3	-138.9	150.8	0	110.6	K309 P311 D316 P476 E477	K305-K309 PolarHBondContact NZ-O 3.35Å; K305-P311 HydrophobicContact CB-CG 4.15Å; K305-D316 WeakPolarHBondContact CA-OD1 3.41Å; K305-D316 PolarHBondContact N-OD1 3.48Å; K305-P476 VanDerWaalsContact CE-O 3.31Å; K305-P476 WeakPolarHBondContact CE-O 3.32Å; K305-E477 WeakPolarHBondContact CE-OE1 3.31Å; K305-E477 WeakPolarHBondContact CE-OE2 3.38Å; K305-E477 IonicContact NZ-OE1 3.53Å; K305-E477 PolarHBondContact NZ-OE1 3.33Å; K305-E477 IonicContact NZ-OE2 2.71Å
306	M	70.1	Confident	85.2	Confident	62 Å²	62	35.4 Å²	35.4	31%	0.305	19%	0.191	S	C	.	.			trans	-59.1	137.5	156.2	-76.1	176.6	-90	0	0	109.7	L308 K309	M306-L308 PolarHBondContact O-N 3.45Å; M306-K309 HydrophobicContact CB-CB 4.36Å; M306-K309 HydrophobicContact CB-CD 4.18Å; M306-K309 HydrophobicContact CB-CG 4.32Å; M306-K309 HydrophobicContact CE-CD 4.21Å; M306-K309 WeakPolarHBondContact O-CB 3.43Å; M306-K309 PolarHBondContact O-N 3.15Å; M306-K309 VanDerWaalsContact O-N 3.17Å; M306-K309 HydrophobicContact SD-CD 4.44Å
307	P	66.3	Low	85.1	Confident	88 Å²	88	37.8 Å²	37.8	57%	0.571	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.2	136.6	179.2	-29.5	35.7	0	0	0	112.8	K309 E477	P307-K309 PolarHBondContact O-N 3.17Å; P307-K309 VanDerWaalsContact O-N 3.11Å; P307-E477 WeakPolarHBondContact CA-OE2 3.28Å
308	L	65.2	Low	85.1	Confident	32 Å²	32	37.8 Å²	37.8	17%	0.168	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	8.1	177.3	-57.9	157	0	0	0	115.3	M306 E477 M1130 L1134 L1144 A1167	M306-L308 PolarHBondContact O-N 3.45Å; L308-E477 VanDerWaalsContact CA-OE1 3.28Å; L308-E477 WeakPolarHBondContact CA-OE1 3.32Å; L308-E477 HydrophobicContact CD2-CG 4.15Å; L308-E477 PolarHBondContact N-OE1 3.07Å; L308-E477 PolarHBondContact N-OE2 3.1Å; L308-M1130 HydrophobicContact CB-CE 3.8Å; L308-M1130 HydrophobicContact CD1-CE 4.08Å; L308-M1130 HydrophobicContact CD2-CE 4.04Å; L308-M1130 HydrophobicContact CG-CE 4.18Å; L308-L1134 HydrophobicContact CD1-CD1 3.35Å; L308-L1134 HydrophobicContact CD1-CD2 4.38Å; L308-L1134 HydrophobicContact CD1-CG 4.49Å; L308-L1144 WeakPolarHBondContact O-CD1 3.42Å; L308-A1167 HydrophobicContact CD1-CB 3.67Å; L308-A1167 HydrophobicContact CD2-CB 4.25Å
309	K	66.5	Low	85	Confident	30 Å²	30	37.8 Å²	37.8	13%	0.13	20%	0.203	C	C	.	.	S	Bend	trans	-96.4	170.7	166.6	-71	-160.1	172.4	-163.8	0	112.5	K305 M306 P307 Q1137 I1138 D1141	K305-K309 PolarHBondContact NZ-O 3.35Å; M306-K309 HydrophobicContact CB-CB 4.36Å; M306-K309 HydrophobicContact CB-CD 4.18Å; M306-K309 HydrophobicContact CB-CG 4.32Å; M306-K309 HydrophobicContact CE-CD 4.21Å; M306-K309 WeakPolarHBondContact O-CB 3.43Å; M306-K309 PolarHBondContact O-N 3.15Å; M306-K309 VanDerWaalsContact O-N 3.17Å; M306-K309 HydrophobicContact SD-CD 4.44Å; P307-K309 PolarHBondContact O-N 3.17Å; P307-K309 VanDerWaalsContact O-N 3.11Å; K309-Q1137 WeakPolarHBondContact CE-O 3.27Å; K309-Q1137 PolarHBondContact NZ-O 3.21Å; K309-I1138 HydrophobicContact CG-CG1 4.43Å; K309-D1141 IonicContact NZ-OD2 2.95Å; K309-D1141 PolarHBondContact NZ-OD2 3.38Å
310	F	76.1	Confident	84.9	Confident	124 Å²	124	37.9 Å²	37.9	54%	0.544	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-82	151.3	154.2	-84.7	-89.2	0	0	0	109.7	G1143	F310-G1143 WeakPolarHBondContact CE2-O 3.42Å
311	P	80.6	Confident	85	Confident	25 Å²	25	37 Å²	37	16%	0.162	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-56.5	135.3	175.9	-24.4	33.9	0	0	0	112.8	T303 K305 F392 F396	T303-P311 WeakPolarHBondContact OG1-CB 3.48Å; T303-P311 VanDerWaalsContact OG1-CG 3.25Å; T303-P311 WeakPolarHBondContact OG1-CG 3.48Å; K305-P311 HydrophobicContact CB-CG 4.15Å; P311-F392 HydrophobicContact CB-CE2 4.19Å; P311-F392 HydrophobicContact CB-CZ 4.19Å; P311-F392 HydrophobicContact CG-CE2 4.2Å; P311-F392 HydrophobicContact CG-CZ 3.97Å; P311-F396 HydrophobicContact CB-CD2 4.41Å; P311-F396 HydrophobicContact CB-CE2 3.61Å; P311-F396 HydrophobicContact CB-CZ 4.31Å
312	D	83	Confident	85	Confident	49 Å²	49	36.9 Å²	36.9	26%	0.262	20%	0.198	S	C	.	.			trans	-112.7	107.9	176.4	166.5	12.8	0	0	0	110.1	T314 N315 D316	D312-T314 PolarHBondContact O-N 2.66Å; D312-T314 WeakPolarHBondContact OD1-CB 3.43Å; D312-T314 PolarHBondContact OD1-N 3.14Å; D312-T314 PolarHBondContact OD1-OG1 3.04Å; D312-T314 PolarHBondContact OD2-OG1 3.26Å; D312-N315 PolarHBondContact O-N 3.12Å; D312-N315 PolarHBondContact OD2-ND2 2.97Å; D312-D316 PolarHBondContact N-OD2 3.42Å; D312-D316 WeakPolarHBondContact O-CB 3.44Å; D312-D316 PolarHBondContact O-N 2.86Å
313	P	86.4	Confident	85.1	Confident	29 Å²	29	36.3 Å²	36.3	19%	0.188	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-9.2	-174	26.3	-34.3	0	0	0	114.6	N315 F396 V399 R400	P313-N315 VanDerWaalsContact C-N 3.31Å; P313-F396 HydrophobicContact CB-CB 4.43Å; P313-F396 HydrophobicContact CB-CD1 4.08Å; P313-F396 HydrophobicContact CB-CD2 3.59Å; P313-F396 HydrophobicContact CB-CE1 4.16Å; P313-F396 HydrophobicContact CB-CE2 3.66Å; P313-F396 HydrophobicContact CB-CG 3.79Å; P313-F396 HydrophobicContact CB-CZ 3.96Å; P313-F396 HydrophobicContact CG-CD2 3.99Å; P313-F396 HydrophobicContact CG-CE2 4.24Å; P313-F396 HydrophobicContact CG-CG 4.48Å; P313-V399 HydrophobicContact CB-CB 3.91Å; P313-V399 HydrophobicContact CB-CG1 3.84Å; P313-V399 HydrophobicContact CG-CB 4.18Å; P313-V399 HydrophobicContact CG-CG1 4.13Å; P313-R400 WeakPolarHBondContact O-CD 3.43Å; P313-R400 PolarHBondContact O-NH1 3.22Å
314	T	86.1	Confident	85.2	Confident	93 Å²	93	36.1 Å²	36.1	57%	0.571	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-27.6	171.3	65.3	0	0	0	0	112.4	D312 V399	D312-T314 PolarHBondContact O-N 2.66Å; D312-T314 WeakPolarHBondContact OD1-CB 3.43Å; D312-T314 PolarHBondContact OD1-N 3.14Å; D312-T314 PolarHBondContact OD1-OG1 3.04Å; D312-T314 PolarHBondContact OD2-OG1 3.26Å; T314-V399 HydrophobicContact CG2-CG1 4.44Å
315	N	84.2	Confident	85.3	Confident	109 Å²	109	36.1 Å²	36.1	58%	0.583	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-120.9	-43.1	-173.6	-64.8	-68.2	0	0	0	113.1	D312 P313	D312-N315 PolarHBondContact O-N 3.12Å; D312-N315 PolarHBondContact OD2-ND2 2.97Å; P313-N315 VanDerWaalsContact C-N 3.31Å
316	D	91.8	Very high	85.5	Confident	13 Å²	13	38.7 Å²	38.7	7%	0.07	21%	0.208	C	C	.	.			trans	-77.6	147.1	-176.9	-76	-56.2	0	0	0	112.6	T304 K305 D312 F396 R400	T304-D316 VanDerWaalsContact C-OD1 3.22Å; T304-D316 VanDerWaalsContact O-CB 3.28Å; T304-D316 WeakPolarHBondContact O-CB 3.49Å; T304-D316 VanDerWaalsContact OG1-CA 3.24Å; T304-D316 WeakPolarHBondContact OG1-CA 3.25Å; T304-D316 VanDerWaalsContact OG1-CB 3.25Å; T304-D316 WeakPolarHBondContact OG1-CB 3.47Å; T304-D316 PolarHBondContact OG1-OD1 2.89Å; K305-D316 WeakPolarHBondContact CA-OD1 3.41Å; K305-D316 PolarHBondContact N-OD1 3.48Å; D312-D316 PolarHBondContact N-OD2 3.42Å; D312-D316 WeakPolarHBondContact O-CB 3.44Å; D312-D316 PolarHBondContact O-N 2.86Å; D316-F396 HydrophobicContact CB-CZ 3.97Å; D316-R400 VanDerWaalsContact O-CD 3.23Å; D316-R400 WeakPolarHBondContact O-CD 3.49Å; D316-R400 VanDerWaalsContact O-CZ 3.23Å; D316-R400 PolarHBondContact O-NE 3.4Å; D316-R400 VanDerWaalsContact O-NE 3.13Å; D316-R400 PolarHBondContact O-NH1 3.28Å
317	Q	92.3	Very high	86.1	Confident	50 Å²	50	36.7 Å²	36.7	23%	0.234	20%	0.203	C	C	.	.			trans	-106.5	156.4	-177.6	-64.2	-169.4	-18.8	0	0	112.1	T303 T304 I337 E365	T303-Q317 CarbonylContact C-O 3.41Å; T303-Q317 WeakPolarHBondContact CA-O 3.47Å; T304-Q317 HydrophobicContact CG2-CB 4.35Å; T304-Q317 PolarHBondContact N-O 3.37Å; T304-Q317 PolarHBondContact OG1-N 3.47Å; Q317-I337 HydrophobicContact CB-CD1 3.87Å; Q317-E365 WeakPolarHBondContact CA-OE1 3.34Å; Q317-E365 HydrophobicContact CB-CG 4.5Å; Q317-E365 WeakPolarHBondContact CG-OE2 3.43Å
318	I	94.9	Very high	87.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	125.1	167	-58.9	170.4	0	0	0	109.8	T303 M320 I321 N334 I337 E365 I369 F396 I397 R400	T303-I318 HydrophobicContact CG2-CG1 4.21Å; I318-M320 WeakPolarHBondContact CG2-O 3.06Å; I318-I321 HydrophobicContact CG2-CD1 4.34Å; I318-I321 HydrophobicContact CG2-CG1 3.68Å; I318-N334 WeakPolarHBondContact O-CB 3.25Å; I318-N334 PolarHBondContact O-ND2 3.32Å; I318-I337 WeakPolarHBondContact O-CD1 3.25Å; I318-E365 HydrophobicContact CB-CG 4.25Å; I318-E365 PolarHBondContact N-OE1 3.25Å; I318-I369 HydrophobicContact CD1-CD1 4.24Å; I318-I369 HydrophobicContact CD1-CG1 4.11Å; I318-F396 HydrophobicContact CG1-CD1 4.05Å; I318-F396 HydrophobicContact CG1-CE1 3.97Å; I318-I397 HydrophobicContact CD1-CG1 4.1Å; I318-R400 HydrophobicContact CD1-CG 4.37Å; I318-R400 HydrophobicContact CG1-CG 4.37Å
319	I	93.9	Very high	88.4	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-48.7	172.9	-46.5	177.4	0	0	0	109.5	E302 T303 T304 N334 I337 L338 A483	E302-I319 PolarHBondContact O-N 2.92Å; T303-I319 WeakPolarHBondContact O-CD1 3.38Å; T304-I319 HydrophobicContact CG2-CD1 4.28Å; T304-I319 HydrophobicContact CG2-CG1 3.9Å; I319-N334 WeakPolarHBondContact O-CB 3.41Å; I319-N334 PolarHBondContact O-N 2.98Å; I319-I337 HydrophobicContact CB-CD1 4.42Å; I319-I337 HydrophobicContact CG1-CD1 4.1Å; I319-I337 HydrophobicContact CG1-CG2 4.19Å; I319-I337 HydrophobicContact CG2-CB 4.39Å; I319-I337 HydrophobicContact CG2-CG2 4.05Å; I319-L338 HydrophobicContact CG2-CD2 4.05Å; I319-L338 HydrophobicContact CG2-CG 4.11Å; I319-A483 HydrophobicContact CG2-CB 4.4Å
320	M	95	Very high	89.9	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	151	-178.4	-65.1	-177.2	-65.9	0	0	112	E302 I318 L331 I332 L338 L490 A491	E302-M320 HydrophobicContact CB-CE 4.46Å; E302-M320 PolarHBondContact N-O 2.81Å; E302-M320 PolarHBondContact O-N 2.91Å; E302-M320 VanDerWaalsContact O-N 3.14Å; I318-M320 WeakPolarHBondContact CG2-O 3.06Å; M320-L331 HydrophobicContact CB-CD1 4.05Å; M320-L331 HydrophobicContact CG-CD1 4.39Å; M320-L331 HydrophobicContact SD-CD1 3.97Å; M320-L331 HydrophobicContact SD-CD2 4.07Å; M320-L331 HydrophobicContact SD-CG 4.33Å; M320-I332 WeakPolarHBondContact CA-O 3.34Å; M320-I332 WeakPolarHBondContact CB-O 3.49Å; M320-L338 HydrophobicContact CG-CD1 4.25Å; M320-L490 HydrophobicContact CE-CB 4.4Å; M320-L490 HydrophobicContact CE-CD2 3.94Å; M320-L490 HydrophobicContact CE-CG 3.71Å; M320-A491 HydrophobicContact SD-CB 4.34Å
321	I	96.6	Very high	90.8	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	112.4	166	-53.4	175.8	0	0	0	106.5	I301 I318 Y323 I332 F372	I301-I321 HydrophobicContact CG2-CB 4.4Å; I301-I321 HydrophobicContact CG2-CG1 4.04Å; I301-I321 HydrophobicContact CG2-CG2 4.11Å; I318-I321 HydrophobicContact CG2-CD1 4.34Å; I318-I321 HydrophobicContact CG2-CG1 3.68Å; I321-Y323 HydrophobicContact CG2-CD1 4.2Å; I321-I332 HydrophobicContact CB-CB 4.23Å; I321-I332 HydrophobicContact CB-CD1 4.26Å; I321-I332 PolarHBondContact N-O 2.94Å; I321-I332 PolarHBondContact O-N 2.67Å; I321-F372 HydrophobicContact CD1-CB 3.98Å; I321-F372 HydrophobicContact CD1-CD1 4.1Å; I321-F372 HydrophobicContact CD1-CG 3.99Å; I321-F372 HydrophobicContact CG2-CD2 3.88Å; I321-F372 HydrophobicContact CG2-CE1 4.41Å; I321-F372 HydrophobicContact CG2-CE2 3.75Å; I321-F372 HydrophobicContact CG2-CG 4.28Å; I321-F372 HydrophobicContact CG2-CZ 4.02Å
322	S	95.7	Very high	91.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	137.8	175.1	77.7	0	0	0	0	109.7	F299 D300 S494 A498	F299-S322 VanDerWaalsContact CA-O 3.29Å; F299-S322 WeakPolarHBondContact CA-O 3.39Å; D300-S322 PolarHBondContact N-O 3.07Å; D300-S322 PolarHBondContact O-N 3.4Å; S322-S494 PolarHBondContact OG-O 2.94Å; S322-S494 VanDerWaalsContact OG-O 3.11Å; S322-A498 VanDerWaalsContact OG-CB 3.32Å; S322-A498 WeakPolarHBondContact OG-CB 3.46Å
323	Y	95.9	Very high	92.2	Very high	1 Å²	1	23.8 Å²	23.8	0%	0.004	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	147.8	177.1	57.3	-76.6	0	0	0	113.4	L297 A298 I321 H330 I332 F372 H375	L297-Y323 HydrophobicContact CD1-CD2 4.13Å; L297-Y323 HydrophobicContact CD2-CD2 4.43Å; L297-Y323 HydrophobicContact CG-CD2 4.09Å; A298-Y323 CarbonylContact O-C 3.6Å; A298-Y323 WeakPolarHBondContact O-CA 3.45Å; A298-Y323 VanDerWaalsContact O-CB 3.31Å; A298-Y323 WeakPolarHBondContact O-CB 3.45Å; I321-Y323 HydrophobicContact CG2-CD1 4.2Å; Y323-H330 HydrophobicContact CD1-CB 4.09Å; Y323-H330 HydrophobicContact CD2-CB 3.97Å; Y323-H330 HydrophobicContact CE1-CB 3.6Å; Y323-H330 HydrophobicContact CE2-CB 3.48Å; Y323-H330 VanDerWaalsContact CE2-CB 3.48Å; Y323-H330 AromaticContact CE2-CD2 3.57Å; Y323-H330 AromaticContact CE2-CG 3.77Å; Y323-H330 HydrophobicContact CG-CB 4.24Å; Y323-H330 AromaticContact CZ-CG 3.84Å; Y323-H330 PolarHBondContact N-O 2.83Å; Y323-H330 PolarHBondContact O-N 3.02Å; Y323-H330 WeakPolarHBondContact OH-CB 3.43Å; Y323-I332 HydrophobicContact CE1-CD1 3.65Å; Y323-I332 HydrophobicContact CE1-CG1 3.98Å; Y323-F372 HydrophobicContact CD1-CD2 4.3Å; Y323-F372 HydrophobicContact CD1-CE2 4.04Å; Y323-F372 HydrophobicContact CE1-CD2 4.14Å; Y323-F372 HydrophobicContact CE1-CE2 4.32Å; Y323-F372 HydrophobicContact CG-CE2 4.32Å; Y323-H375 AromaticContact CE2-ND1 3.69Å; Y323-H375 AromaticContact CZ-ND1 3.65Å; Y323-H375 PolarHBondContact OH-ND1 2.92Å
324	M	94.8	Very high	92.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126	171.1	-68.6	-70.6	-77.1	0	0	108.8	L297 A298 G327 A328 F357 A498 V499 Y502 Y503	L297-M324 WeakPolarHBondContact CA-O 3.46Å; A298-M324 PolarHBondContact N-O 3.11Å; A298-M324 PolarHBondContact O-N 3.17Å; M324-G327 WeakPolarHBondContact CE-O 3.45Å; M324-A328 CarbonylContact C-O 3.24Å; M324-A328 WeakPolarHBondContact CA-O 3.39Å; M324-F357 HydrophobicContact CG-CZ 4.28Å; M324-F357 HydrophobicContact SD-CE1 4.29Å; M324-F357 HydrophobicContact SD-CE2 3.97Å; M324-F357 HydrophobicContact SD-CZ 3.46Å; M324-F357 WeakPolarHBondContact SD-CZ 3.32Å; M324-A498 HydrophobicContact CG-CB 4.25Å; M324-V499 HydrophobicContact CE-CG2 4.17Å; M324-V499 HydrophobicContact CG-CG2 4.15Å; M324-V499 HydrophobicContact SD-CG2 3.76Å; M324-Y502 HydrophobicContact CB-CD1 4.35Å; M324-Y502 HydrophobicContact CB-CD2 3.75Å; M324-Y502 HydrophobicContact CB-CE2 4.48Å; M324-Y502 HydrophobicContact CB-CG 3.68Å; M324-Y502 HydrophobicContact CE-CD1 4.11Å; M324-Y502 HydrophobicContact CG-CG 4.2Å; M324-Y503 HydrophobicContact CE-CE2 4.26Å
325	L	92.3	Very high	93	Very high	24 Å²	24	20.9 Å²	20.9	13%	0.126	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	108.1	173.4	-178.7	71.5	0	0	0	108.5	V295 V296 L297 G327 A328 V379	V295-L325 HydrophobicContact CG1-CD1 3.76Å; V296-L325 WeakPolarHBondContact O-CA 3.46Å; L297-L325 HydrophobicContact CB-CD1 4.18Å; L325-G327 PolarHBondContact O-N 2.76Å; L325-A328 PolarHBondContact N-O 3.22Å; L325-A328 PolarHBondContact O-N 2.81Å; L325-V379 HydrophobicContact CD1-CB 4.35Å; L325-V379 HydrophobicContact CD1-CG2 3.8Å; L325-V379 HydrophobicContact CD2-CB 4.05Å; L325-V379 HydrophobicContact CD2-CG1 3.75Å; L325-V379 HydrophobicContact CD2-CG2 4.11Å
326	D	86.8	Confident	93.2	Very high	80 Å²	80	20.5 Å²	20.5	43%	0.428	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	24.5	179.1	-57.4	-27.1	0	0	0	115.4	V295 V296 Y502	V295-D326 WeakPolarHBondContact CA-OD1 3.38Å; V296-D326 PolarHBondContact N-OD1 3.44Å; V296-D326 PolarHBondContact O-N 3.43Å; V296-D326 VanDerWaalsContact O-N 3.16Å; D326-Y502 WeakPolarHBondContact CA-OH 3.47Å
327	G	83.5	Confident	93.2	Very high	21 Å²	21	21.6 Å²	21.6	22%	0.216	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.9	-8.4	-178.8	0	0	0	0	0	115.1	M324 L325 Y502	M324-G327 WeakPolarHBondContact CE-O 3.45Å; L325-G327 PolarHBondContact O-N 2.76Å; G327-Y502 PolarHBondContact N-OH 3.25Å; G327-Y502 VanDerWaalsContact N-OH 3.17Å
328	A	88	Confident	93.1	Very high	50 Å²	50	19.5 Å²	19.5	41%	0.413	11%	0.107	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	135.8	167.4	0	0	0	0	0	110.2	M324 L325	M324-A328 CarbonylContact C-O 3.24Å; M324-A328 WeakPolarHBondContact CA-O 3.39Å; L325-A328 PolarHBondContact N-O 3.22Å; L325-A328 PolarHBondContact O-N 2.81Å
329	G	92.9	Very high	92.8	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	144.5	179.1	0	0	0	0	0	112.6	H356 F357 T358	G329-H356 VanDerWaalsContact CA-O 3.24Å; G329-H356 WeakPolarHBondContact CA-O 3.42Å; G329-H356 PolarHBondContact N-O 2.89Å; G329-F357 VanDerWaalsContact C-CD1 3.42Å; G329-F357 VanDerWaalsContact CA-CD1 3.49Å; G329-F357 WeakPolarHBondContact O-CA 3.45Å; G329-T358 PolarHBondContact O-N 3.25Å
330	H	96.4	Very high	92.6	Very high	25 Å²	25	25.5 Å²	25.5	12%	0.116	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	141.7	169.1	-68.5	-67.9	0	0	0	110.6	Y323 F357 T358 H375	Y323-H330 HydrophobicContact CD1-CB 4.09Å; Y323-H330 HydrophobicContact CD2-CB 3.97Å; Y323-H330 HydrophobicContact CE1-CB 3.6Å; Y323-H330 HydrophobicContact CE2-CB 3.48Å; Y323-H330 VanDerWaalsContact CE2-CB 3.48Å; Y323-H330 AromaticContact CE2-CD2 3.57Å; Y323-H330 AromaticContact CE2-CG 3.77Å; Y323-H330 HydrophobicContact CG-CB 4.24Å; Y323-H330 AromaticContact CZ-CG 3.84Å; Y323-H330 PolarHBondContact N-O 2.83Å; Y323-H330 PolarHBondContact O-N 3.02Å; Y323-H330 WeakPolarHBondContact OH-CB 3.43Å; H330-F357 VanDerWaalsContact N-CD1 3.29Å; H330-T358 WeakPolarHBondContact CA-O 3.47Å; H330-H375 AromaticContact CD2-CE1 4Å; H330-H375 AromaticContact NE2-CE1 3.82Å
331	L	96.6	Very high	92.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	115.9	175.8	-177.5	67.5	0	0	0	109.4	M320 F345 F357 T358 V359 H360 A491 V495	M320-L331 HydrophobicContact CB-CD1 4.05Å; M320-L331 HydrophobicContact CG-CD1 4.39Å; M320-L331 HydrophobicContact SD-CD1 3.97Å; M320-L331 HydrophobicContact SD-CD2 4.07Å; M320-L331 HydrophobicContact SD-CG 4.33Å; L331-F345 HydrophobicContact CD2-CE1 4.09Å; L331-F345 HydrophobicContact CD2-CZ 4.41Å; L331-F357 HydrophobicContact CB-CD1 4.3Å; L331-T358 PolarHBondContact N-O 2.71Å; L331-V359 HydrophobicContact CB-CG2 4.33Å; L331-V359 HydrophobicContact CD2-CG1 4.45Å; L331-V359 HydrophobicContact CD2-CG2 4.46Å; L331-V359 CarbonylContact O-C 3.6Å; L331-V359 WeakPolarHBondContact O-CA 3.41Å; L331-H360 PolarHBondContact O-N 3.49Å; L331-A491 HydrophobicContact CD2-CB 3.62Å; L331-V495 HydrophobicContact CB-CG1 4.24Å; L331-V495 HydrophobicContact CD1-CG1 3.99Å; L331-V495 HydrophobicContact CD2-CG1 4.13Å; L331-V495 HydrophobicContact CG-CG1 4.35Å
332	I	97	Very high	92.1	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	130.2	171.5	-62.4	160.9	0	0	0	107.9	M320 I321 Y323 H360 L362 C368 F371 F372	M320-I332 WeakPolarHBondContact CA-O 3.34Å; M320-I332 WeakPolarHBondContact CB-O 3.49Å; I321-I332 HydrophobicContact CB-CB 4.23Å; I321-I332 HydrophobicContact CB-CD1 4.26Å; I321-I332 PolarHBondContact N-O 2.94Å; I321-I332 PolarHBondContact O-N 2.67Å; Y323-I332 HydrophobicContact CE1-CD1 3.65Å; Y323-I332 HydrophobicContact CE1-CG1 3.98Å; I332-H360 HydrophobicContact CG1-CB 4.37Å; I332-L362 HydrophobicContact CG2-CD1 3.93Å; I332-C368 HydrophobicContact CG2-CB 3.6Å; I332-F371 HydrophobicContact CD1-CD1 3.63Å; I332-F371 HydrophobicContact CD1-CE1 4.13Å; I332-F371 HydrophobicContact CG1-CD1 3.8Å; I332-F371 HydrophobicContact CG1-CE1 4Å; I332-F372 HydrophobicContact CD1-CB 3.83Å; I332-F372 HydrophobicContact CD1-CD2 4.03Å; I332-F372 HydrophobicContact CD1-CG 4.35Å
333	C	95.9	Very high	91.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	121.7	-173.8	-76.3	0	0	0	0	111.2	L338 H360 L362	C333-L338 HydrophobicContact CB-CD1 3.52Å; C333-H360 PolarHBondContact N-O 2.74Å; C333-L362 PolarHBondContact O-N 2.86Å
334	N	95.6	Very high	91.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	113.4	176.7	-176	1.5	0	0	0	111.5	I318 I319 E336 I337 L338 E365	I318-N334 WeakPolarHBondContact O-CB 3.25Å; I318-N334 PolarHBondContact O-ND2 3.32Å; I319-N334 WeakPolarHBondContact O-CB 3.41Å; I319-N334 PolarHBondContact O-N 2.98Å; N334-E336 VanDerWaalsContact C-N 3.33Å; N334-E336 PolarHBondContact O-N 2.93Å; N334-E336 WeakPolarHBondContact OD1-CB 3.3Å; N334-E336 PolarHBondContact OD1-N 3.31Å; N334-I337 HydrophobicContact CB-CD1 4.36Å; N334-I337 WeakPolarHBondContact ND2-CD1 3.28Å; N334-I337 PolarHBondContact O-N 3.1Å; N334-L338 PolarHBondContact O-N 2.99Å; N334-L338 VanDerWaalsContact O-N 3.14Å; N334-E365 PolarHBondContact ND2-N 3.26Å; N334-E365 PolarHBondContact OD1-N 2.93Å
335	R	93.7	Very high	91.7	Very high	61 Å²	61	43.6 Å²	43.6	23%	0.23	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	1.4	-177.8	-56.7	-67.1	-70.7	103.6	-1.8	114.3	I337 L338 S339 E340 D341 N361 L362	R335-I337 VanDerWaalsContact C-N 3.25Å; R335-L338 VanDerWaalsContact NH1-C 3.31Å; R335-L338 PolarHBondContact NH1-O 3.4Å; R335-S339 VanDerWaalsContact NH1-C 3.35Å; R335-S339 PolarHBondContact NH1-O 3.04Å; R335-S339 VanDerWaalsContact NH1-O 3.08Å; R335-S339 PolarHBondContact NH2-O 2.9Å; R335-E340 VanDerWaalsContact CZ-O 3.31Å; R335-D341 IonicContact CZ-OD1 3.41Å; R335-D341 IonicContact NE-OD1 2.72Å; R335-D341 PolarHBondContact NE-OD1 2.83Å; R335-D341 IonicContact NH2-OD1 2.79Å; R335-D341 PolarHBondContact NH2-OD1 2.69Å; R335-N361 HydrophobicContact CG-CB 4.16Å; R335-L362 VanDerWaalsContact CB-O 3.27Å; R335-L362 WeakPolarHBondContact CB-O 3.31Å; R335-L362 WeakPolarHBondContact CG-O 3.36Å; R335-L362 PolarHBondContact N-O 3.49Å
336	E	88.4	Confident	91.4	Very high	102 Å²	102	46.6 Å²	46.6	48%	0.477	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-23.7	161.8	-77.8	170.6	140.2	0	0	112.3	N334 K363 T364 E365	N334-E336 VanDerWaalsContact C-N 3.33Å; N334-E336 PolarHBondContact O-N 2.93Å; N334-E336 WeakPolarHBondContact OD1-CB 3.3Å; N334-E336 PolarHBondContact OD1-N 3.31Å; E336-K363 WeakPolarHBondContact CG-O 3.46Å; E336-K363 PolarHBondContact N-O 2.94Å; E336-T364 HydrophobicContact CG-CG2 4.26Å; E336-T364 WeakPolarHBondContact OE2-CA 3.25Å; E336-T364 WeakPolarHBondContact OE2-CB 3.41Å; E336-E365 PolarHBondContact OE2-N 2.79Å
337	I	90.1	Very high	91.5	Very high	35 Å²	35	43.9 Å²	43.9	18%	0.179	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-44.3	-169.7	-55.3	159.7	0	0	0	112	T304 Q317 I318 I319 N334 R335 A483	T304-I337 HydrophobicContact CG2-CD1 3.74Å; T304-I337 HydrophobicContact CG2-CG1 4.32Å; T304-I337 HydrophobicContact CG2-CG2 4.25Å; Q317-I337 HydrophobicContact CB-CD1 3.87Å; I318-I337 WeakPolarHBondContact O-CD1 3.25Å; I319-I337 HydrophobicContact CB-CD1 4.42Å; I319-I337 HydrophobicContact CG1-CD1 4.1Å; I319-I337 HydrophobicContact CG1-CG2 4.19Å; I319-I337 HydrophobicContact CG2-CB 4.39Å; I319-I337 HydrophobicContact CG2-CG2 4.05Å; N334-I337 HydrophobicContact CB-CD1 4.36Å; N334-I337 WeakPolarHBondContact ND2-CD1 3.28Å; N334-I337 PolarHBondContact O-N 3.1Å; R335-I337 VanDerWaalsContact C-N 3.25Å; I337-A483 HydrophobicContact CG2-CB 4.25Å
338	L	91.1	Very high	91.7	Very high	7 Å²	7	45.2 Å²	45.2	4%	0.037	24%	0.235	C	C	.	.			trans	-69.5	151.5	177.6	-65.8	163.4	0	0	0	110.8	I319 M320 C333 N334 R335 I342 A483 P487	I319-L338 HydrophobicContact CG2-CD2 4.05Å; I319-L338 HydrophobicContact CG2-CG 4.11Å; M320-L338 HydrophobicContact CG-CD1 4.25Å; C333-L338 HydrophobicContact CB-CD1 3.52Å; N334-L338 PolarHBondContact O-N 2.99Å; N334-L338 VanDerWaalsContact O-N 3.14Å; R335-L338 VanDerWaalsContact NH1-C 3.31Å; R335-L338 PolarHBondContact NH1-O 3.4Å; L338-I342 HydrophobicContact CD1-CD1 4.43Å; L338-A483 CarbonylContact C-O 3.45Å; L338-A483 WeakPolarHBondContact CA-O 3.38Å; L338-A483 HydrophobicContact CD2-CB 3.96Å; L338-P487 HydrophobicContact CD2-CB 3.82Å
339	S	88.6	Confident	91.4	Very high	49 Å²	49	44.8 Å²	44.8	34%	0.343	23%	0.228	S	C	.	.	S	Bend	trans	-82.6	-56.8	178	54.5	0	0	0	0	113.5	R335 A483 H484	R335-S339 VanDerWaalsContact NH1-C 3.35Å; R335-S339 PolarHBondContact NH1-O 3.04Å; R335-S339 VanDerWaalsContact NH1-O 3.08Å; R335-S339 PolarHBondContact NH2-O 2.9Å; S339-A483 PolarHBondContact N-O 3.28Å; S339-H484 VanDerWaalsContact CB-O 3.27Å; S339-H484 WeakPolarHBondContact CB-O 3.42Å; S339-H484 PolarHBondContact OG-O 3.2Å
340	E	89.4	Confident	90.9	Very high	77 Å²	77	48.7 Å²	48.7	36%	0.36	24%	0.243	S	C	.	.	S	Bend	trans	-106.8	163.6	179.3	58.9	166.9	-147.3	0	0	114.2	R335 P487 R488	R335-E340 VanDerWaalsContact CZ-O 3.31Å; E340-P487 HydrophobicContact CG-CG 3.54Å; E340-R488 IonicContact OE1-CZ 2.68Å; E340-R488 VanDerWaalsContact OE1-CZ 3.29Å; E340-R488 IonicContact OE1-NE 3.96Å; E340-R488 PolarHBondContact OE1-NE 3.13Å; E340-R488 IonicContact OE1-NH2 3.46Å; E340-R488 PolarHBondContact OE1-NH2 3Å; E340-R488 IonicContact OE2-NH2 3.16Å
341	D	91.3	Very high	89.8	Confident	99 Å²	99	53.9 Å²	53.9	53%	0.529	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-73.8	134.2	171.5	-66.9	12.3	0	0	0	108.7	R335	R335-D341 IonicContact CZ-OD1 3.41Å; R335-D341 IonicContact NE-OD1 2.72Å; R335-D341 PolarHBondContact NE-OD1 2.83Å; R335-D341 IonicContact NH2-OD1 2.79Å; R335-D341 PolarHBondContact NH2-OD1 2.69Å
342	I	91	Very high	88.7	Confident	7 Å²	7	58.7 Å²	58.7	4%	0.036	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-97.4	130.5	-179.3	-54.6	-178.3	0	0	0	109.7	L338 V359 N361 P487 A491	L338-I342 HydrophobicContact CD1-CD1 4.43Å; I342-V359 HydrophobicContact CB-CG1 4.07Å; I342-V359 HydrophobicContact CG2-CG1 4.36Å; I342-V359 HydrophobicContact CG2-CG2 4.46Å; I342-V359 WeakPolarHBondContact O-CG1 3.33Å; I342-N361 PolarHBondContact N-OD1 3.13Å; I342-N361 PolarHBondContact O-ND2 3.47Å; I342-P487 HydrophobicContact CD1-CB 4.05Å; I342-P487 HydrophobicContact CG1-CB 4.47Å; I342-A491 HydrophobicContact CD1-CB 3.76Å; I342-A491 HydrophobicContact CG2-CB 4.24Å
343	E	90.3	Very high	88.1	Confident	132 Å²	132	58.9 Å²	58.9	62%	0.617	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-83.4	156.4	179.7	-63.7	168.5	143.3	0	0	111.9	F345 R488	E343-F345 WeakPolarHBondContact O-CD1 3.29Å; E343-R488 IonicContact OE2-CZ 3.67Å; E343-R488 IonicContact OE2-NH1 2.71Å; E343-R488 PolarHBondContact OE2-NH1 2.89Å
344	D	93	Very high	87.5	Confident	104 Å²	104	61.3 Å²	61.3	56%	0.556	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-56	137.2	174.3	-74.9	5	0	0	0	112.1	F357 T358 V359	D344-F357 WeakPolarHBondContact CA-O 3.35Å; D344-T358 WeakPolarHBondContact OD1-CA 3.39Å; D344-V359 PolarHBondContact OD1-N 2.76Å
345	F	93.1	Very high	87.1	Confident	41 Å²	41	61.3 Å²	61.3	18%	0.18	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	166.7	-174.6	70	-80.6	0	0	0	113.6	L331 E343 F357 V359 A491 N492 V495	L331-F345 HydrophobicContact CD2-CE1 4.09Å; L331-F345 HydrophobicContact CD2-CZ 4.41Å; E343-F345 WeakPolarHBondContact O-CD1 3.29Å; F345-F357 HydrophobicContact CD1-CB 4.38Å; F345-F357 HydrophobicContact CE1-CB 4.21Å; F345-F357 HydrophobicContact CZ-CB 4.44Å; F345-F357 PolarHBondContact N-O 2.87Å; F345-F357 PolarHBondContact O-N 3.09Å; F345-V359 HydrophobicContact CD1-CG2 4Å; F345-V359 HydrophobicContact CE1-CG2 3.99Å; F345-A491 HydrophobicContact CE1-CB 4.21Å; F345-A491 HydrophobicContact CZ-CB 4.09Å; F345-N492 WeakPolarHBondContact CE2-OD1 3.43Å; F345-V495 HydrophobicContact CE2-CG2 3.74Å; F345-V495 HydrophobicContact CZ-CB 4.44Å; F345-V495 HydrophobicContact CZ-CG1 3.8Å; F345-V495 HydrophobicContact CZ-CG2 3.8Å
346	D	87.4	Confident	86.8	Confident	87 Å²	87	64 Å²	64	47%	0.465	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.3	175.3	175.1	33.1	0	0	0	110.7	T348 H356	D346-T348 PolarHBondContact OD1-OG1 3.2Å; D346-T348 PolarHBondContact OD2-OG1 2.96Å; D346-H356 IonicContact OD1-CE1 2.75Å; D346-H356 IonicContact OD1-ND1 3.75Å; D346-H356 PolarHBondContact OD1-ND1 2.86Å
347	Y	88.4	Confident	87.1	Confident	23 Å²	23	59.4 Å²	59.4	9%	0.09	31%	0.311	C	S	.	.			trans	-118.8	85.1	171.6	-177.7	-102.8	0	0	0	109.7	P349 G355 I472 V495 S496 V499	Y347-P349 HydrophobicContact CE1-CB 4.31Å; Y347-P349 HydrophobicContact CE1-CG 3.94Å; Y347-P349 WeakPolarHBondContact O-CD 3.47Å; Y347-G355 PolarHBondContact N-O 2.66Å; Y347-G355 WeakPolarHBondContact O-CA 3.49Å; Y347-I472 HydrophobicContact CE2-CD1 3.67Å; Y347-I472 HydrophobicContact CE2-CG1 4.26Å; Y347-V495 HydrophobicContact CD1-CG2 4.05Å; Y347-V495 HydrophobicContact CG-CG2 3.89Å; Y347-S496 VanDerWaalsContact CE1-CA 3.47Å; Y347-S496 VanDerWaalsContact CE1-CB 3.49Å; Y347-S496 WeakPolarHBondContact CE1-OG 3.31Å; Y347-S496 WeakPolarHBondContact OH-CB 3.45Å; Y347-S496 PolarHBondContact OH-OG 3.35Å; Y347-V499 HydrophobicContact CD1-CB 4.43Å; Y347-V499 HydrophobicContact CD1-CG2 4.17Å; Y347-V499 HydrophobicContact CE1-CG1 4.5Å
348	T	87.3	Confident	87.3	Confident	50 Å²	50	60.3 Å²	60.3	31%	0.307	32%	0.318	S	S	.	.			trans	-109.3	86.2	179.6	-69.4	0	0	0	0	110.3	D346 R350 P354 G355	D346-T348 PolarHBondContact OD1-OG1 3.2Å; D346-T348 PolarHBondContact OD2-OG1 2.96Å; T348-R350 VanDerWaalsContact CG2-O 3.27Å; T348-R350 WeakPolarHBondContact CG2-O 3.46Å; T348-R350 PolarHBondContact O-N 2.93Å; T348-P354 VanDerWaalsContact OG1-CA 3.32Å; T348-P354 WeakPolarHBondContact OG1-CA 3.47Å; T348-G355 PolarHBondContact OG1-N 3.45Å; T348-G355 VanDerWaalsContact OG1-N 3.14Å
349	P	82.8	Confident	87.5	Confident	40 Å²	40	60.5 Å²	60.5	26%	0.26	32%	0.32	S	S	.	.	S	Bend	trans	-69.5	-17.5	-174.5	26.7	-36	0	0	0	114.3	Y347 F353 Y469 V499	Y347-P349 HydrophobicContact CE1-CB 4.31Å; Y347-P349 HydrophobicContact CE1-CG 3.94Å; Y347-P349 WeakPolarHBondContact O-CD 3.47Å; P349-F353 HydrophobicContact CG-CB 4.49Å; P349-Y469 HydrophobicContact CB-CD2 3.72Å; P349-Y469 HydrophobicContact CB-CE2 3.79Å; P349-Y469 HydrophobicContact CB-CG 4.26Å; P349-Y469 HydrophobicContact CG-CD2 4.17Å; P349-Y469 HydrophobicContact CG-CE1 4.39Å; P349-Y469 HydrophobicContact CG-CE2 3.79Å; P349-V499 HydrophobicContact CG-CG1 4.14Å
350	R	81.4	Confident	87.8	Confident	82 Å²	82	61.2 Å²	61.2	31%	0.309	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-147	151.4	168.2	-75.6	179.5	159.8	-101.3	-10	108.6	T348 E352 F353 R468	T348-R350 VanDerWaalsContact CG2-O 3.27Å; T348-R350 WeakPolarHBondContact CG2-O 3.46Å; T348-R350 PolarHBondContact O-N 2.93Å; R350-E352 HydrophobicContact CB-CB 4.43Å; R350-E352 IonicContact NH1-OE1 3.61Å; R350-E352 PolarHBondContact NH1-OE1 3.48Å; R350-E352 PolarHBondContact O-N 3.37Å; R350-F353 HydrophobicContact CB-CB 4.45Å; R350-F353 HydrophobicContact CB-CD2 3.84Å; R350-F353 HydrophobicContact CB-CG 4.41Å; R350-F353 HydrophobicContact CG-CD2 4.21Å; R350-F353 CarbonylContact O-C 3.37Å; R350-F353 WeakPolarHBondContact O-CA 3.47Å; R350-F353 PolarHBondContact O-N 3.07Å; R350-R468 PolarHBondContact NE-O 3.2Å; R350-R468 VanDerWaalsContact NE-O 3.16Å; R350-R468 PolarHBondContact NH2-O 2.87Å
351	P	72.6	Confident	88.1	Confident	134 Å²	134	59.9 Å²	59.9	87%	0.87	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-18.3	171.4	-25.3	35.2	0	0	0	114.8	F353	P351-F353 VanDerWaalsContact C-N 3.32Å
352	E	73.6	Confident	88.3	Confident	102 Å²	102	57 Å²	57	48%	0.477	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-18.5	171.2	-65.4	171.8	-108	0	0	113.8	R350 K507	R350-E352 HydrophobicContact CB-CB 4.43Å; R350-E352 IonicContact NH1-OE1 3.61Å; R350-E352 PolarHBondContact NH1-OE1 3.48Å; R350-E352 PolarHBondContact O-N 3.37Å; E352-K507 IonicContact OE2-NZ 3.77Å; E352-K507 PolarHBondContact OE2-NZ 3.13Å
353	F	85.8	Confident	88.4	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.018	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-132.8	68	-165.7	-58.1	-38	0	0	0	111	P349 R350 P351 L467 Y469 Y503 K507	P349-F353 HydrophobicContact CG-CB 4.49Å; R350-F353 HydrophobicContact CB-CB 4.45Å; R350-F353 HydrophobicContact CB-CD2 3.84Å; R350-F353 HydrophobicContact CB-CG 4.41Å; R350-F353 HydrophobicContact CG-CD2 4.21Å; R350-F353 CarbonylContact O-C 3.37Å; R350-F353 WeakPolarHBondContact O-CA 3.47Å; R350-F353 PolarHBondContact O-N 3.07Å; P351-F353 VanDerWaalsContact C-N 3.32Å; F353-L467 HydrophobicContact CE1-CD2 4.46Å; F353-L467 HydrophobicContact CE2-CB 3.91Å; F353-L467 HydrophobicContact CE2-CD2 4.47Å; F353-L467 WeakPolarHBondContact CE2-O 3.29Å; F353-L467 HydrophobicContact CZ-CB 4.12Å; F353-L467 HydrophobicContact CZ-CD2 3.89Å; F353-Y469 AromaticContact CD2-CD1 3.85Å; F353-Y469 HydrophobicContact CD2-CD1 3.85Å; F353-Y469 AromaticContact CD2-CE1 3.71Å; F353-Y469 HydrophobicContact CD2-CE1 3.71Å; F353-Y469 AromaticContact CE2-CD1 3.83Å; F353-Y469 HydrophobicContact CE2-CD1 3.83Å; F353-Y469 AromaticContact CE2-CE1 3.86Å; F353-Y469 HydrophobicContact CE2-CE1 3.86Å; F353-Y503 HydrophobicContact CB-CD2 3.75Å; F353-Y503 HydrophobicContact CB-CE2 3.67Å; F353-Y503 HydrophobicContact CB-CG 4.32Å; F353-Y503 AromaticContact CD1-CD1 3.48Å; F353-Y503 HydrophobicContact CD1-CD1 3.48Å; F353-Y503 VanDerWaalsContact CD1-CD1 3.48Å; F353-Y503 AromaticContact CD1-CD2 3.79Å; F353-Y503 HydrophobicContact CD1-CD2 3.79Å; F353-Y503 AromaticContact CD1-CE1 3.89Å; F353-Y503 HydrophobicContact CD1-CE1 3.89Å; F353-Y503 HydrophobicContact CD1-CE2 4.17Å; F353-Y503 AromaticContact CD1-CG 3.44Å; F353-Y503 HydrophobicContact CD1-CG 3.44Å; F353-Y503 VanDerWaalsContact CD1-CG 3.44Å; F353-Y503 AromaticContact CE1-CD1 3.93Å; F353-Y503 HydrophobicContact CE1-CD1 3.93Å; F353-Y503 AromaticContact CE1-CG 3.95Å; F353-Y503 HydrophobicContact CE1-CG 3.95Å; F353-Y503 HydrophobicContact CG-CD1 4.43Å; F353-Y503 AromaticContact CG-CD2 3.95Å; F353-Y503 HydrophobicContact CG-CD2 3.95Å; F353-Y503 HydrophobicContact CG-CE2 4.28Å; F353-Y503 HydrophobicContact CG-CG 4.04Å; F353-K507 HydrophobicContact CE1-CD 4Å; F353-K507 HydrophobicContact CZ-CD 4.04Å
354	P	83.6	Confident	88.5	Confident	52 Å²	52	60.3 Å²	60.3	34%	0.338	31%	0.313	S	S	.	.			trans	-63.7	145.9	176	27	-35.5	0	0	0	112.8	T348 Y503	T348-P354 VanDerWaalsContact OG1-CA 3.32Å; T348-P354 WeakPolarHBondContact OG1-CA 3.47Å; P354-Y503 VanDerWaalsContact CD-OH 3.32Å; P354-Y503 WeakPolarHBondContact CD-OH 3.36Å; P354-Y503 PolarHBondContact O-OH 2.94Å; P354-Y503 VanDerWaalsContact O-OH 3.05Å
355	G	86.1	Confident	88.6	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.287	C	S	.	.			trans	-149.3	77.5	179	0	0	0	0	0	112.3	Y347 T348 F357	Y347-G355 PolarHBondContact N-O 2.66Å; Y347-G355 WeakPolarHBondContact O-CA 3.49Å; T348-G355 PolarHBondContact OG1-N 3.45Å; T348-G355 VanDerWaalsContact OG1-N 3.14Å; G355-F357 WeakPolarHBondContact O-CD2 3.23Å
356	H	88.2	Confident	88.7	Confident	117 Å²	117	56.3 Å²	56.3	54%	0.542	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	117.6	179.1	-61	48.2	0	0	0	109.2	G329 D346	G329-H356 VanDerWaalsContact CA-O 3.24Å; G329-H356 WeakPolarHBondContact CA-O 3.42Å; G329-H356 PolarHBondContact N-O 2.89Å; D346-H356 IonicContact OD1-CE1 2.75Å; D346-H356 IonicContact OD1-ND1 3.75Å; D346-H356 PolarHBondContact OD1-ND1 2.86Å
357	F	94	Very high	89.2	Confident	5 Å²	5	55.4 Å²	55.4	2%	0.022	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.1	-172.4	-80.1	-91	0	0	0	113.4	M324 G329 H330 L331 D344 F345 G355 V495 V499	M324-F357 HydrophobicContact CG-CZ 4.28Å; M324-F357 HydrophobicContact SD-CE1 4.29Å; M324-F357 HydrophobicContact SD-CE2 3.97Å; M324-F357 HydrophobicContact SD-CZ 3.46Å; M324-F357 WeakPolarHBondContact SD-CZ 3.32Å; G329-F357 VanDerWaalsContact C-CD1 3.42Å; G329-F357 VanDerWaalsContact CA-CD1 3.49Å; G329-F357 WeakPolarHBondContact O-CA 3.45Å; H330-F357 VanDerWaalsContact N-CD1 3.29Å; L331-F357 HydrophobicContact CB-CD1 4.3Å; D344-F357 WeakPolarHBondContact CA-O 3.35Å; F345-F357 HydrophobicContact CD1-CB 4.38Å; F345-F357 HydrophobicContact CE1-CB 4.21Å; F345-F357 HydrophobicContact CZ-CB 4.44Å; F345-F357 PolarHBondContact N-O 2.87Å; F345-F357 PolarHBondContact O-N 3.09Å; G355-F357 WeakPolarHBondContact O-CD2 3.23Å; F357-V495 HydrophobicContact CD1-CB 4.05Å; F357-V495 HydrophobicContact CD1-CG1 3.45Å; F357-V495 VanDerWaalsContact CD1-CG1 3.45Å; F357-V495 HydrophobicContact CD2-CB 3.98Å; F357-V495 HydrophobicContact CD2-CG1 4.06Å; F357-V495 HydrophobicContact CD2-CG2 4.2Å; F357-V495 HydrophobicContact CE1-CB 3.73Å; F357-V495 HydrophobicContact CE1-CG1 3.54Å; F357-V495 HydrophobicContact CE2-CB 3.68Å; F357-V495 HydrophobicContact CE2-CG1 4.16Å; F357-V495 HydrophobicContact CE2-CG2 4.11Å; F357-V495 HydrophobicContact CG-CB 4.19Å; F357-V495 HydrophobicContact CG-CG1 3.75Å; F357-V495 HydrophobicContact CZ-CB 3.56Å; F357-V495 HydrophobicContact CZ-CG1 3.92Å; F357-V495 HydrophobicContact CZ-CG2 4.48Å; F357-V499 HydrophobicContact CE2-CG2 3.75Å; F357-V499 HydrophobicContact CZ-CG2 3.83Å
358	T	94.3	Very high	89.5	Confident	54 Å²	54	54.4 Å²	54.4	33%	0.331	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	127.8	163.6	-51.4	0	0	0	0	109.9	G329 H330 L331 D344	G329-T358 PolarHBondContact O-N 3.25Å; H330-T358 WeakPolarHBondContact CA-O 3.47Å; L331-T358 PolarHBondContact N-O 2.71Å; D344-T358 WeakPolarHBondContact OD1-CA 3.39Å
359	V	94.9	Very high	89.9	Confident	12 Å²	12	52 Å²	52	7%	0.073	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	129.9	-171.2	-173.5	0	0	0	0	111.8	L331 I342 D344 F345	L331-V359 HydrophobicContact CB-CG2 4.33Å; L331-V359 HydrophobicContact CD2-CG1 4.45Å; L331-V359 HydrophobicContact CD2-CG2 4.46Å; L331-V359 CarbonylContact O-C 3.6Å; L331-V359 WeakPolarHBondContact O-CA 3.41Å; I342-V359 HydrophobicContact CB-CG1 4.07Å; I342-V359 HydrophobicContact CG2-CG1 4.36Å; I342-V359 HydrophobicContact CG2-CG2 4.46Å; I342-V359 WeakPolarHBondContact O-CG1 3.33Å; D344-V359 PolarHBondContact OD1-N 2.76Å; F345-V359 HydrophobicContact CD1-CG2 4Å; F345-V359 HydrophobicContact CE1-CG2 3.99Å
360	H	95.7	Very high	90.5	Very high	64 Å²	64	52.4 Å²	52.4	30%	0.296	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	88.5	-178.1	-56	-71.4	0	0	0	109.8	L331 I332 C333 L362 F371	L331-H360 PolarHBondContact O-N 3.49Å; I332-H360 HydrophobicContact CG1-CB 4.37Å; C333-H360 PolarHBondContact N-O 2.74Å; H360-L362 PolarHBondContact O-N 2.87Å; H360-F371 HydrophobicContact CB-CE1 4.19Å; H360-F371 HydrophobicContact CB-CZ 4.33Å; H360-F371 AromaticContact CD2-CE1 3.81Å; H360-F371 AromaticContact CD2-CZ 3.96Å; H360-F371 AromaticContact CG-CE1 3.79Å; H360-F371 AromaticContact CG-CZ 3.7Å; H360-F371 AromaticContact ND1-CZ 3.65Å
361	N	95.1	Very high	91.2	Very high	49 Å²	49	51 Å²	51	26%	0.262	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	106.5	174.2	-63.9	-77.8	0	0	0	109.8	R335 I342	R335-N361 HydrophobicContact CG-CB 4.16Å; I342-N361 PolarHBondContact N-OD1 3.13Å; I342-N361 PolarHBondContact O-ND2 3.47Å
362	L	96.3	Very high	92.4	Very high	38 Å²	38	44.6 Å²	44.6	20%	0.199	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150	-175.3	-63.8	179.5	0	0	0	111	I332 C333 R335 H360 D367 F371	I332-L362 HydrophobicContact CG2-CD1 3.93Å; C333-L362 PolarHBondContact O-N 2.86Å; R335-L362 VanDerWaalsContact CB-O 3.27Å; R335-L362 WeakPolarHBondContact CB-O 3.31Å; R335-L362 WeakPolarHBondContact CG-O 3.36Å; R335-L362 PolarHBondContact N-O 3.49Å; H360-L362 PolarHBondContact O-N 2.87Å; L362-D367 HydrophobicContact CB-CB 3.98Å; L362-D367 HydrophobicContact CD1-CB 4.48Å; L362-F371 HydrophobicContact CD1-CB 3.55Å; L362-F371 HydrophobicContact CD1-CD1 4.2Å; L362-F371 HydrophobicContact CD1-CD2 4.34Å; L362-F371 HydrophobicContact CD1-CG 3.79Å
363	K	91.7	Very high	93.4	Very high	169 Å²	169	40 Å²	40	74%	0.735	21%	0.205	S	C	*	.	S	Bend	trans	-73.4	-34.6	-162.3	-68.6	179.4	-178.5	173.6	0	114.1	E336 D367	E336-K363 WeakPolarHBondContact CG-O 3.46Å; E336-K363 PolarHBondContact N-O 2.94Å; K363-D367 WeakPolarHBondContact CB-OD2 3.37Å
364	T	93.9	Very high	93.8	Very high	40 Å²	40	45.5 Å²	45.5	25%	0.245	23%	0.231	C	C	.	.	S	Bend	trans	-140.6	162.3	-173.7	66.7	0	0	0	0	111.8	E336 L366 D367 C368	E336-T364 HydrophobicContact CG-CG2 4.26Å; E336-T364 WeakPolarHBondContact OE2-CA 3.25Å; E336-T364 WeakPolarHBondContact OE2-CB 3.41Å; T364-L366 PolarHBondContact O-N 3.09Å; T364-D367 WeakPolarHBondContact CB-OD2 3.49Å; T364-D367 PolarHBondContact N-OD2 3.11Å; T364-D367 WeakPolarHBondContact O-CB 3.12Å; T364-D367 PolarHBondContact O-N 3.19Å; T364-D367 VanDerWaalsContact O-N 3.1Å; T364-D367 VanDerWaalsContact OG1-CG 3.25Å; T364-D367 PolarHBondContact OG1-N 2.82Å; T364-D367 PolarHBondContact OG1-OD2 2.81Å; T364-C368 PolarHBondContact O-N 3.41Å; T364-C368 VanDerWaalsContact O-N 3.14Å; T364-C368 PolarHBondContact O-SG 2.92Å; T364-C368 VanDerWaalsContact O-SG 3.36Å
365	E	95.2	Very high	94.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-55.6	-37.6	174.5	-169.5	-173.5	-164.3	0	0	112.2	Q317 I318 N334 E336 C368 I369 R400 Y404	Q317-E365 WeakPolarHBondContact CA-OE1 3.34Å; Q317-E365 HydrophobicContact CB-CG 4.5Å; Q317-E365 WeakPolarHBondContact CG-OE2 3.43Å; I318-E365 HydrophobicContact CB-CG 4.25Å; I318-E365 PolarHBondContact N-OE1 3.25Å; N334-E365 PolarHBondContact ND2-N 3.26Å; N334-E365 PolarHBondContact OD1-N 2.93Å; E336-E365 PolarHBondContact OE2-N 2.79Å; E365-C368 WeakPolarHBondContact O-CB 3.43Å; E365-C368 PolarHBondContact O-N 2.84Å; E365-C368 VanDerWaalsContact O-N 3.17Å; E365-I369 HydrophobicContact CG-CD1 4.05Å; E365-I369 WeakPolarHBondContact O-CG1 3.49Å; E365-I369 PolarHBondContact O-N 2.83Å; E365-R400 WeakPolarHBondContact OE1-CG 3.16Å; E365-R400 IonicContact OE1-CZ 2.7Å; E365-R400 IonicContact OE1-NE 2.68Å; E365-R400 PolarHBondContact OE1-NE 3.09Å; E365-R400 IonicContact OE1-NH2 3.41Å; E365-R400 IonicContact OE2-CZ 3.31Å; E365-R400 IonicContact OE2-NE 3.97Å; E365-R400 PolarHBondContact OE2-NE 2.9Å; E365-R400 VanDerWaalsContact OE2-NE 3.13Å; E365-R400 IonicContact OE2-NH2 3.43Å; E365-R400 PolarHBondContact OE2-NH2 2.96Å; E365-Y404 HydrophobicContact CB-CE2 4.39Å; E365-Y404 HydrophobicContact CG-CE2 4.35Å; E365-Y404 PolarHBondContact OE2-OH 2.99Å; E365-Y404 VanDerWaalsContact OE2-OH 3.09Å
366	L	95.3	Very high	94.6	Very high	61 Å²	61	44.3 Å²	44.3	32%	0.319	22%	0.22	S	C	.	.	H	α-helix	trans	-63.7	-41.5	177.8	176.6	54.9	0	0	0	112.1	T364 C368 T370 Y404 L406	T364-L366 PolarHBondContact O-N 3.09Å; L366-C368 VanDerWaalsContact C-N 3.29Å; L366-C368 PolarHBondContact O-N 2.81Å; L366-T370 VanDerWaalsContact O-CB 3.29Å; L366-T370 WeakPolarHBondContact O-CB 3.35Å; L366-T370 PolarHBondContact O-N 3.4Å; L366-T370 PolarHBondContact O-OG1 2.97Å; L366-Y404 HydrophobicContact CB-CD1 4.11Å; L366-Y404 HydrophobicContact CB-CD2 4.45Å; L366-Y404 HydrophobicContact CB-CE1 4.17Å; L366-Y404 HydrophobicContact CB-CG 4.26Å; L366-Y404 HydrophobicContact CD1-CD1 4.31Å; L366-Y404 HydrophobicContact CD1-CD2 4.33Å; L366-Y404 HydrophobicContact CD1-CG 3.87Å; L366-Y404 HydrophobicContact CD2-CD1 4.1Å; L366-Y404 HydrophobicContact CD2-CG 4.47Å; L366-Y404 HydrophobicContact CG-CD1 4.41Å; L366-Y404 HydrophobicContact CG-CG 4.42Å; L366-L406 HydrophobicContact CD1-CD1 3.72Å; L366-L406 HydrophobicContact CD1-CG 4.42Å
367	D	96.1	Very high	94.7	Very high	67 Å²	67	41.8 Å²	41.8	36%	0.358	21%	0.209	S	C	.	.	H	α-helix	trans	-61.3	-41.1	173.6	-59.9	-59.9	0	0	0	110.5	L362 K363 T364 F371	L362-D367 HydrophobicContact CB-CB 3.98Å; L362-D367 HydrophobicContact CD1-CB 4.48Å; K363-D367 WeakPolarHBondContact CB-OD2 3.37Å; T364-D367 WeakPolarHBondContact CB-OD2 3.49Å; T364-D367 PolarHBondContact N-OD2 3.11Å; T364-D367 WeakPolarHBondContact O-CB 3.12Å; T364-D367 PolarHBondContact O-N 3.19Å; T364-D367 VanDerWaalsContact O-N 3.1Å; T364-D367 VanDerWaalsContact OG1-CG 3.25Å; T364-D367 PolarHBondContact OG1-N 2.82Å; T364-D367 PolarHBondContact OG1-OD2 2.81Å; D367-F371 VanDerWaalsContact O-CB 3.26Å; D367-F371 WeakPolarHBondContact O-CB 3.13Å; D367-F371 PolarHBondContact O-N 3.31Å
368	C	95.6	Very high	94.5	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.014	24%	0.244	C	C	.	.	H	α-helix	trans	-62.1	-49.4	178.7	-62.3	0	0	0	0	113.1	I332 T364 E365 L366 F372	I332-C368 HydrophobicContact CG2-CB 3.6Å; T364-C368 PolarHBondContact O-N 3.41Å; T364-C368 VanDerWaalsContact O-N 3.14Å; T364-C368 PolarHBondContact O-SG 2.92Å; T364-C368 VanDerWaalsContact O-SG 3.36Å; E365-C368 WeakPolarHBondContact O-CB 3.43Å; E365-C368 PolarHBondContact O-N 2.84Å; E365-C368 VanDerWaalsContact O-N 3.17Å; L366-C368 VanDerWaalsContact C-N 3.29Å; L366-C368 PolarHBondContact O-N 2.81Å; C368-F372 WeakPolarHBondContact O-CB 3.47Å; C368-F372 PolarHBondContact O-N 2.93Å
369	I	96	Very high	94.4	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-64.9	-43.7	179.2	-65.4	170.2	0	0	0	110.4	I318 E365 F372 F373 R400 A401 Y404 L406	I318-I369 HydrophobicContact CD1-CD1 4.24Å; I318-I369 HydrophobicContact CD1-CG1 4.11Å; E365-I369 HydrophobicContact CG-CD1 4.05Å; E365-I369 WeakPolarHBondContact O-CG1 3.49Å; E365-I369 PolarHBondContact O-N 2.83Å; I369-F372 PolarHBondContact O-N 2.84Å; I369-F373 HydrophobicContact CG2-CD2 4.13Å; I369-F373 HydrophobicContact CG2-CE1 4.18Å; I369-F373 HydrophobicContact CG2-CE2 3.69Å; I369-F373 HydrophobicContact CG2-CZ 3.71Å; I369-F373 WeakPolarHBondContact O-CG 3.36Å; I369-F373 PolarHBondContact O-N 3.04Å; I369-R400 HydrophobicContact CD1-CB 3.64Å; I369-A401 HydrophobicContact CG2-CB 4.14Å; I369-Y404 HydrophobicContact CD1-CD2 4.39Å; I369-Y404 HydrophobicContact CD1-CE2 4.47Å; I369-L406 HydrophobicContact CG2-CD1 4.04Å
370	T	95.2	Very high	94.2	Very high	47 Å²	47	54.6 Å²	54.6	29%	0.288	25%	0.253	S	S	.	.	H	α-helix	trans	-62	-49.1	179.4	-54.7	0	0	0	0	111	L366 F372 F373 E374	L366-T370 VanDerWaalsContact O-CB 3.29Å; L366-T370 WeakPolarHBondContact O-CB 3.35Å; L366-T370 PolarHBondContact O-N 3.4Å; L366-T370 PolarHBondContact O-OG1 2.97Å; T370-F372 VanDerWaalsContact C-N 3.34Å; T370-F372 PolarHBondContact O-N 2.92Å; T370-F373 PolarHBondContact O-N 2.69Å; T370-E374 HydrophobicContact CG2-CG 4.48Å; T370-E374 WeakPolarHBondContact O-CG 3.33Å; T370-E374 PolarHBondContact O-N 2.85Å
371	F	96.3	Very high	94	Very high	52 Å²	52	51.5 Å²	51.5	23%	0.228	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-39.6	177.7	-179.8	-89	0	0	0	112.3	I332 H360 L362 D367 H375	I332-F371 HydrophobicContact CD1-CD1 3.63Å; I332-F371 HydrophobicContact CD1-CE1 4.13Å; I332-F371 HydrophobicContact CG1-CD1 3.8Å; I332-F371 HydrophobicContact CG1-CE1 4Å; H360-F371 HydrophobicContact CB-CE1 4.19Å; H360-F371 HydrophobicContact CB-CZ 4.33Å; H360-F371 AromaticContact CD2-CE1 3.81Å; H360-F371 AromaticContact CD2-CZ 3.96Å; H360-F371 AromaticContact CG-CE1 3.79Å; H360-F371 AromaticContact CG-CZ 3.7Å; H360-F371 AromaticContact ND1-CZ 3.65Å; L362-F371 HydrophobicContact CD1-CB 3.55Å; L362-F371 HydrophobicContact CD1-CD1 4.2Å; L362-F371 HydrophobicContact CD1-CD2 4.34Å; L362-F371 HydrophobicContact CD1-CG 3.79Å; D367-F371 VanDerWaalsContact O-CB 3.26Å; D367-F371 WeakPolarHBondContact O-CB 3.13Å; D367-F371 PolarHBondContact O-N 3.31Å; F371-H375 VanDerWaalsContact O-CB 3.28Å; F371-H375 WeakPolarHBondContact O-CB 3.3Å; F371-H375 PolarHBondContact O-N 2.79Å
372	F	96.5	Very high	93.9	Very high	1 Å²	1	49.5 Å²	49.5	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-45.2	176.3	-174.4	-124.1	0	0	0	111.9	L297 F299 I321 Y323 I332 C368 I369 T370 H375 I376 I397	L297-F372 HydrophobicContact CD2-CE2 4.39Å; L297-F372 HydrophobicContact CD2-CZ 4.48Å; F299-F372 HydrophobicContact CB-CE2 4.47Å; F299-F372 HydrophobicContact CB-CZ 4.17Å; F299-F372 HydrophobicContact CD1-CZ 4.06Å; F299-F372 HydrophobicContact CD2-CE1 4.45Å; F299-F372 AromaticContact CD2-CZ 3.93Å; F299-F372 HydrophobicContact CD2-CZ 3.93Å; F299-F372 HydrophobicContact CE1-CZ 4.4Å; F299-F372 HydrophobicContact CE2-CE1 4.42Å; F299-F372 HydrophobicContact CE2-CZ 4.3Å; F299-F372 AromaticContact CG-CZ 3.8Å; F299-F372 HydrophobicContact CG-CZ 3.8Å; I321-F372 HydrophobicContact CD1-CB 3.98Å; I321-F372 HydrophobicContact CD1-CD1 4.1Å; I321-F372 HydrophobicContact CD1-CG 3.99Å; I321-F372 HydrophobicContact CG2-CD2 3.88Å; I321-F372 HydrophobicContact CG2-CE1 4.41Å; I321-F372 HydrophobicContact CG2-CE2 3.75Å; I321-F372 HydrophobicContact CG2-CG 4.28Å; I321-F372 HydrophobicContact CG2-CZ 4.02Å; Y323-F372 HydrophobicContact CD1-CD2 4.3Å; Y323-F372 HydrophobicContact CD1-CE2 4.04Å; Y323-F372 HydrophobicContact CE1-CD2 4.14Å; Y323-F372 HydrophobicContact CE1-CE2 4.32Å; Y323-F372 HydrophobicContact CG-CE2 4.32Å; I332-F372 HydrophobicContact CD1-CB 3.83Å; I332-F372 HydrophobicContact CD1-CD2 4.03Å; I332-F372 HydrophobicContact CD1-CG 4.35Å; C368-F372 WeakPolarHBondContact O-CB 3.47Å; C368-F372 PolarHBondContact O-N 2.93Å; I369-F372 PolarHBondContact O-N 2.84Å; T370-F372 VanDerWaalsContact C-N 3.34Å; T370-F372 PolarHBondContact O-N 2.92Å; F372-H375 PolarHBondContact O-N 2.9Å; F372-I376 HydrophobicContact CD1-CD1 3.98Å; F372-I376 HydrophobicContact CD2-CD1 4.42Å; F372-I376 HydrophobicContact CE1-CD1 3.71Å; F372-I376 HydrophobicContact CE2-CD1 4.17Å; F372-I376 HydrophobicContact CG-CD1 4.34Å; F372-I376 HydrophobicContact CZ-CD1 3.81Å; F372-I376 WeakPolarHBondContact O-CG1 3.41Å; F372-I376 PolarHBondContact O-N 2.76Å; F372-I397 HydrophobicContact CE1-CD1 4.22Å
373	F	95.5	Very high	93.8	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.018	22%	0.219	C	C	.	.	H	α-helix	trans	-66	-45.1	177	-68.8	-4.2	0	0	0	112.4	I369 T370 H375 I376 Q377 I397 A401 M408 E411 T412	I369-F373 HydrophobicContact CG2-CD2 4.13Å; I369-F373 HydrophobicContact CG2-CE1 4.18Å; I369-F373 HydrophobicContact CG2-CE2 3.69Å; I369-F373 HydrophobicContact CG2-CZ 3.71Å; I369-F373 WeakPolarHBondContact O-CG 3.36Å; I369-F373 PolarHBondContact O-N 3.04Å; T370-F373 PolarHBondContact O-N 2.69Å; F373-H375 VanDerWaalsContact C-N 3.28Å; F373-H375 PolarHBondContact O-N 3.06Å; F373-I376 PolarHBondContact O-N 2.91Å; F373-Q377 WeakPolarHBondContact O-CG 3.45Å; F373-Q377 PolarHBondContact O-N 2.85Å; F373-I397 HydrophobicContact CE1-CG2 3.68Å; F373-I397 HydrophobicContact CZ-CG2 3.73Å; F373-A401 HydrophobicContact CE2-CB 3.93Å; F373-A401 HydrophobicContact CZ-CB 3.94Å; F373-M408 HydrophobicContact CE1-CG 4.22Å; F373-M408 HydrophobicContact CE2-CB 4.41Å; F373-M408 HydrophobicContact CE2-CG 4.47Å; F373-M408 HydrophobicContact CZ-CB 4.07Å; F373-M408 HydrophobicContact CZ-CG 3.75Å; F373-E411 HydrophobicContact CB-CB 4.14Å; F373-E411 HydrophobicContact CD2-CB 3.67Å; F373-E411 HydrophobicContact CD2-CG 4.07Å; F373-E411 HydrophobicContact CE2-CB 4.37Å; F373-E411 HydrophobicContact CG-CB 4.15Å; F373-T412 HydrophobicContact CB-CG2 4.42Å; F373-T412 HydrophobicContact CD1-CG2 3.35Å; F373-T412 HydrophobicContact CD2-CG2 4.39Å; F373-T412 HydrophobicContact CE1-CG2 3.56Å; F373-T412 HydrophobicContact CG-CG2 3.81Å; F373-T412 HydrophobicContact CZ-CG2 4.18Å
374	E	93.6	Very high	93.9	Very high	121 Å²	121	39.6 Å²	39.6	57%	0.565	18%	0.184	S	C	*	.	H	α-helix	trans	-58.4	-40.5	173.4	-75.4	-171.6	170	0	0	111.6	T370 Q377 R378	T370-E374 HydrophobicContact CG2-CG 4.48Å; T370-E374 WeakPolarHBondContact O-CG 3.33Å; T370-E374 PolarHBondContact O-N 2.85Å; E374-Q377 PolarHBondContact O-N 2.93Å; E374-R378 VanDerWaalsContact O-CB 3.32Å; E374-R378 WeakPolarHBondContact O-CB 3.26Å; E374-R378 PolarHBondContact O-N 2.93Å
375	H	94.2	Very high	94	Very high	27 Å²	27	37.7 Å²	37.7	13%	0.125	17%	0.172	C	C	.	.	H	α-helix	trans	-69.5	-40.5	-179.8	-158.3	-169.8	0	0	0	111.8	Y323 H330 F371 F372 F373 Q377 R378 V379	Y323-H375 AromaticContact CE2-ND1 3.69Å; Y323-H375 AromaticContact CZ-ND1 3.65Å; Y323-H375 PolarHBondContact OH-ND1 2.92Å; H330-H375 AromaticContact CD2-CE1 4Å; H330-H375 AromaticContact NE2-CE1 3.82Å; F371-H375 VanDerWaalsContact O-CB 3.28Å; F371-H375 WeakPolarHBondContact O-CB 3.3Å; F371-H375 PolarHBondContact O-N 2.79Å; F372-H375 PolarHBondContact O-N 2.9Å; F373-H375 VanDerWaalsContact C-N 3.28Å; F373-H375 PolarHBondContact O-N 3.06Å; H375-Q377 PolarHBondContact O-N 3.32Å; H375-R378 PolarHBondContact O-N 2.89Å; H375-R378 VanDerWaalsContact O-N 3.13Å; H375-V379 WeakPolarHBondContact NE2-CG1 3.38Å; H375-V379 WeakPolarHBondContact O-CG2 3.38Å; H375-V379 PolarHBondContact O-N 3.26Å
376	I	93	Very high	94	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57	-47.1	170.7	-71.6	165.5	0	0	0	110.8	L297 F372 F373 R378 R380 P381 L384 T412	L297-I376 HydrophobicContact CD1-CG1 4.06Å; F372-I376 HydrophobicContact CD1-CD1 3.98Å; F372-I376 HydrophobicContact CD2-CD1 4.42Å; F372-I376 HydrophobicContact CE1-CD1 3.71Å; F372-I376 HydrophobicContact CE2-CD1 4.17Å; F372-I376 HydrophobicContact CG-CD1 4.34Å; F372-I376 HydrophobicContact CZ-CD1 3.81Å; F372-I376 WeakPolarHBondContact O-CG1 3.41Å; F372-I376 PolarHBondContact O-N 2.76Å; F373-I376 PolarHBondContact O-N 2.91Å; I376-R378 VanDerWaalsContact C-N 3.26Å; I376-R378 PolarHBondContact O-N 2.98Å; I376-R380 VanDerWaalsContact O-CA 3.31Å; I376-R380 WeakPolarHBondContact O-CA 3.44Å; I376-R380 PolarHBondContact O-N 3.12Å; I376-P381 HydrophobicContact CG2-CG 4.29Å; I376-P381 WeakPolarHBondContact O-CD 3.21Å; I376-L384 HydrophobicContact CD1-CD2 4.41Å; I376-T412 HydrophobicContact CD1-CG2 4.39Å
377	Q	89.7	Confident	94	Very high	63 Å²	63	35.7 Å²	35.7	29%	0.294	16%	0.16	S	C	.	.	H	α-helix	trans	-63.3	-30.6	176.7	-71.6	-177.5	26.5	0	0	113.4	F373 E374 H375 R380 E411	F373-Q377 WeakPolarHBondContact O-CG 3.45Å; F373-Q377 PolarHBondContact O-N 2.85Å; E374-Q377 PolarHBondContact O-N 2.93Å; H375-Q377 PolarHBondContact O-N 3.32Å; Q377-R380 WeakPolarHBondContact O-CG 3.2Å; Q377-R380 PolarHBondContact O-NE 3.28Å; Q377-E411 VanDerWaalsContact CG-O 3.32Å; Q377-E411 WeakPolarHBondContact CG-O 3.45Å; Q377-E411 PolarHBondContact NE2-O 2.98Å; Q377-E411 PolarHBondContact NE2-OE2 3.34Å
378	R	90.9	Very high	93.7	Very high	203 Å²	203	35.1 Å²	35.1	77%	0.766	16%	0.157	S	C	*	.	H	α-helix	trans	-78	-48.5	-178.8	179.9	177.5	175.8	175.6	-3.5	112.8	E374 H375 I376	E374-R378 VanDerWaalsContact O-CB 3.32Å; E374-R378 WeakPolarHBondContact O-CB 3.26Å; E374-R378 PolarHBondContact O-N 2.93Å; H375-R378 PolarHBondContact O-N 2.89Å; H375-R378 VanDerWaalsContact O-N 3.13Å; I376-R378 VanDerWaalsContact C-N 3.26Å; I376-R378 PolarHBondContact O-N 2.98Å
379	V	90.8	Very high	93.5	Very high	34 Å²	34	35 Å²	35	21%	0.206	16%	0.156	C	C	.	.	H	α-helix	trans	-86.2	-20.6	-178.2	-52.1	0	0	0	0	112.4	L297 L325 H375	L297-V379 HydrophobicContact CD1-CG2 4.47Å; L325-V379 HydrophobicContact CD1-CB 4.35Å; L325-V379 HydrophobicContact CD1-CG2 3.8Å; L325-V379 HydrophobicContact CD2-CB 4.05Å; L325-V379 HydrophobicContact CD2-CG1 3.75Å; L325-V379 HydrophobicContact CD2-CG2 4.11Å; H375-V379 WeakPolarHBondContact NE2-CG1 3.38Å; H375-V379 WeakPolarHBondContact O-CG2 3.38Å; H375-V379 PolarHBondContact O-N 3.26Å
380	R	91.3	Very high	93.1	Very high	103 Å²	103	35.4 Å²	35.4	39%	0.389	16%	0.158	S	C	.	.			trans	52.1	62.6	174.2	-55.5	168.3	172.3	-177.5	-9.4	110.7	R69 Y70 R115 I376 Q377 N382	R69-R380 WeakPolarHBondContact O-CD 3.28Å; R69-R380 PolarHBondContact O-NE 2.63Å; Y70-R380 HydrophobicContact CD1-CB 4.25Å; R115-R380 VanDerWaalsContact CZ-O 3.22Å; R115-R380 VanDerWaalsContact NH1-CB 3.26Å; R115-R380 PolarHBondContact NH1-O 2.87Å; R115-R380 PolarHBondContact NH2-O 3.23Å; I376-R380 VanDerWaalsContact O-CA 3.31Å; I376-R380 WeakPolarHBondContact O-CA 3.44Å; I376-R380 PolarHBondContact O-N 3.12Å; Q377-R380 WeakPolarHBondContact O-CG 3.2Å; Q377-R380 PolarHBondContact O-NE 3.28Å; R380-N382 PolarHBondContact O-N 2.83Å
381	P	92.4	Very high	92.7	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.167	C	C	.	.			trans	-57	140.8	-178.5	28.1	-36.8	0	0	0	110.9	Y70 V295 L297 I376 L384	Y70-P381 HydrophobicContact CE1-CG 4.48Å; Y70-P381 WeakPolarHBondContact CE1-O 3.44Å; V295-P381 HydrophobicContact CG1-CB 4.34Å; L297-P381 HydrophobicContact CB-CB 3.8Å; L297-P381 HydrophobicContact CB-CG 4.23Å; L297-P381 HydrophobicContact CD1-CG 4.44Å; I376-P381 HydrophobicContact CG2-CG 4.29Å; I376-P381 WeakPolarHBondContact O-CD 3.21Å; P381-L384 HydrophobicContact CB-CD1 3.86Å; P381-L384 HydrophobicContact CG-CD1 3.35Å; P381-L384 HydrophobicContact CG-CG 4.12Å
382	N	92.1	Very high	92.4	Very high	6 Å²	6	38.2 Å²	38.2	3%	0.032	17%	0.168	C	C	.	.	S	Bend	trans	-80.5	-27.7	174.2	-62.8	119	0	0	0	111.3	L109 R115 P294 V295 R380 A437 V438	L109-N382 HydrophobicContact CD1-CB 4.45Å; L109-N382 WeakPolarHBondContact CD2-ND2 3.21Å; R115-N382 VanDerWaalsContact CZ-ND2 3.33Å; R115-N382 PolarHBondContact NE-ND2 2.71Å; R115-N382 PolarHBondContact NH2-OD1 2.95Å; P294-N382 HydrophobicContact CB-CB 4.01Å; V295-N382 PolarHBondContact N-OD1 2.79Å; V295-N382 VanDerWaalsContact N-OD1 3.07Å; V295-N382 PolarHBondContact O-N 3.25Å; R380-N382 PolarHBondContact O-N 2.83Å; N382-A437 WeakPolarHBondContact O-CA 3.28Å; N382-V438 PolarHBondContact O-N 3.13Å
383	I	93.8	Very high	92.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	127	-179.8	-48.5	-179.3	0	0	0	108.4	P294 V295 V296 L297 V385 V438 I440 Y505 F514	P294-I383 HydrophobicContact CB-CD1 4.21Å; P294-I383 HydrophobicContact CB-CG1 4.45Å; P294-I383 HydrophobicContact CG-CD1 4.02Å; V295-I383 PolarHBondContact O-N 2.88Å; V296-I383 HydrophobicContact CG2-CB 4.44Å; L297-I383 PolarHBondContact N-O 3.38Å; I383-V385 HydrophobicContact CG2-CG2 4.18Å; I383-V438 WeakPolarHBondContact CA-O 3.28Å; I383-V438 HydrophobicContact CG1-CB 4.31Å; I383-V438 HydrophobicContact CG2-CB 4.23Å; I383-V438 HydrophobicContact CG2-CG1 4.44Å; I383-I440 HydrophobicContact CG2-CG1 3.75Å; I383-Y505 WeakPolarHBondContact CD1-OH 3.19Å; I383-F514 HydrophobicContact CD1-CE2 3.84Å; I383-F514 HydrophobicContact CD1-CZ 4.01Å
384	L	95	Very high	92.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	139.8	165.1	-76.1	75.7	0	0	0	109.5	L297 F299 I376 P381 W394 F414 A437 V438 H439 I440	L297-L384 CarbonylContact O-C 3.59Å; L297-L384 VanDerWaalsContact O-CA 3.3Å; L297-L384 WeakPolarHBondContact O-CA 3.5Å; F299-L384 HydrophobicContact CE1-CD2 4.3Å; I376-L384 HydrophobicContact CD1-CD2 4.41Å; P381-L384 HydrophobicContact CB-CD1 3.86Å; P381-L384 HydrophobicContact CG-CD1 3.35Å; P381-L384 HydrophobicContact CG-CG 4.12Å; L384-W394 HydrophobicContact CB-CZ2 4.42Å; L384-W394 HydrophobicContact CD2-CH2 3.57Å; L384-W394 HydrophobicContact CD2-CZ2 3.53Å; L384-F414 HydrophobicContact CB-CZ 4.43Å; L384-F414 HydrophobicContact CD1-CE2 3.53Å; L384-F414 HydrophobicContact CD1-CZ 3.69Å; L384-F414 HydrophobicContact CD2-CD2 4.33Å; L384-F414 HydrophobicContact CD2-CE2 3.9Å; L384-F414 HydrophobicContact CD2-CZ 4.4Å; L384-F414 HydrophobicContact CG-CE2 4.26Å; L384-F414 HydrophobicContact CG-CZ 4.4Å; L384-A437 HydrophobicContact CD1-CB 4.33Å; L384-V438 PolarHBondContact N-O 2.88Å; L384-H439 WeakPolarHBondContact O-CA 3.49Å; L384-I440 PolarHBondContact O-N 3.41Å
385	V	96.2	Very high	92.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.7	-176.7	-173	0	0	0	0	108.9	V296 L297 A298 F299 I383 I440 C442 T501 Y505	V296-V385 HydrophobicContact CG1-CG2 3.72Å; L297-V385 PolarHBondContact O-N 3.35Å; A298-V385 WeakPolarHBondContact CA-O 3.25Å; A298-V385 HydrophobicContact CB-CB 3.83Å; A298-V385 HydrophobicContact CB-CG1 4.37Å; F299-V385 PolarHBondContact N-O 2.82Å; I383-V385 HydrophobicContact CG2-CG2 4.18Å; V385-I440 WeakPolarHBondContact CA-O 3.38Å; V385-C442 VanDerWaalsContact CG1-SG 3.57Å; V385-T501 HydrophobicContact CB-CG2 4.5Å; V385-T501 HydrophobicContact CG1-CG2 3.68Å; V385-Y505 HydrophobicContact CB-CG 4.37Å; V385-Y505 HydrophobicContact CG1-CD2 3.97Å; V385-Y505 HydrophobicContact CG1-CG 3.81Å; V385-Y505 HydrophobicContact CG2-CD1 3.65Å; V385-Y505 HydrophobicContact CG2-CD2 3.84Å; V385-Y505 HydrophobicContact CG2-CE1 3.9Å; V385-Y505 HydrophobicContact CG2-CE2 4.13Å; V385-Y505 HydrophobicContact CG2-CG 3.61Å
386	T	95.5	Very high	92.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	172.2	174.5	62.5	0	0	0	0	110.3	F299 G389 D393 H439 I440 C442	F299-T386 HydrophobicContact CD1-CG2 3.84Å; F299-T386 HydrophobicContact CE1-CG2 3.37Å; F299-T386 HydrophobicContact CE2-CG2 4.25Å; F299-T386 HydrophobicContact CG-CG2 4.46Å; F299-T386 HydrophobicContact CZ-CG2 3.61Å; T386-G389 VanDerWaalsContact OG1-CA 3.31Å; T386-G389 WeakPolarHBondContact OG1-CA 3.38Å; T386-G389 PolarHBondContact OG1-N 3.37Å; T386-D393 WeakPolarHBondContact CB-OD2 3.33Å; T386-H439 PolarHBondContact OG1-NE2 3Å; T386-I440 PolarHBondContact N-O 2.68Å; T386-I440 VanDerWaalsContact N-O 3.07Å; T386-C442 PolarHBondContact O-N 3.1Å
387	Y	93.6	Very high	92.2	Very high	19 Å²	19	32.6 Å²	32.6	8%	0.075	15%	0.145	C	C	.	.	S	Bend	trans	-125.4	102.2	170.3	-162.7	-79.4	0	0	0	110	C442 L443 V446 R457 L459 V462 L504	Y387-C442 HydrophobicContact CD2-CB 3.78Å; Y387-C442 HydrophobicContact CE2-CB 4.3Å; Y387-L443 HydrophobicContact CD1-CB 4.44Å; Y387-L443 HydrophobicContact CE1-CB 4.24Å; Y387-L443 HydrophobicContact CE1-CD1 3.95Å; Y387-L443 HydrophobicContact CE1-CG 4.49Å; Y387-V446 HydrophobicContact CE2-CG2 4.04Å; Y387-R457 PolarHBondContact OH-O 3.48Å; Y387-L459 HydrophobicContact CD1-CB 3.87Å; Y387-L459 HydrophobicContact CD2-CB 4.3Å; Y387-L459 HydrophobicContact CD2-CD1 3.72Å; Y387-L459 HydrophobicContact CD2-CG 4.45Å; Y387-L459 HydrophobicContact CE1-CB 3.98Å; Y387-L459 HydrophobicContact CE2-CB 4.38Å; Y387-L459 HydrophobicContact CE2-CD1 4.01Å; Y387-L459 HydrophobicContact CG-CB 4.04Å; Y387-L459 HydrophobicContact CG-CD1 4.12Å; Y387-L459 HydrophobicContact CG-CD2 4.31Å; Y387-L459 HydrophobicContact CG-CG 4.39Å; Y387-V462 VanDerWaalsContact OH-CG2 3.28Å; Y387-V462 WeakPolarHBondContact OH-CG2 3.25Å; Y387-L504 HydrophobicContact CD2-CD2 4.01Å; Y387-L504 HydrophobicContact CE2-CD2 3.72Å
388	N	90.7	Very high	92.4	Very high	54 Å²	54	32.1 Å²	32.1	29%	0.289	14%	0.142	S	C	.	.	S	Bend	trans	78.5	8.5	-168	-163.5	64.9	0	0	0	115.2	D390 H391 F392 D441 L443	N388-D390 VanDerWaalsContact C-N 3.3Å; N388-D390 PolarHBondContact O-N 3.41Å; N388-H391 WeakPolarHBondContact O-CA 3.19Å; N388-H391 PolarHBondContact O-N 3.2Å; N388-F392 PolarHBondContact O-N 2.81Å; N388-D441 VanDerWaalsContact C-OD2 3.28Å; N388-D441 VanDerWaalsContact CA-OD2 3.27Å; N388-D441 WeakPolarHBondContact CA-OD2 3.41Å; N388-D441 PolarHBondContact N-OD1 2.87Å; N388-L443 HydrophobicContact CB-CD2 3.76Å; N388-L443 WeakPolarHBondContact OD1-CD2 3.44Å
389	G	90.6	Very high	92.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.4	-174.1	0	0	0	0	0	117.3	T386 H391 D393 W394 P395 D441	T386-G389 VanDerWaalsContact OG1-CA 3.31Å; T386-G389 WeakPolarHBondContact OG1-CA 3.38Å; T386-G389 PolarHBondContact OG1-N 3.37Å; G389-H391 PolarHBondContact O-N 2.76Å; G389-D393 WeakPolarHBondContact CA-OD2 3.22Å; G389-D393 PolarHBondContact N-OD2 3.19Å; G389-W394 WeakPolarHBondContact O-CB 3.4Å; G389-W394 PolarHBondContact O-N 2.95Å; G389-W394 VanDerWaalsContact O-N 3.16Å; G389-P395 WeakPolarHBondContact O-CD 3.37Å; G389-D441 PolarHBondContact N-OD2 2.95Å
390	D	89.2	Confident	92.7	Very high	9 Å²	9	24.1 Å²	24.1	5%	0.048	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.8	166.9	-88.1	-26.2	0	0	0	111.7	N388 Y432 H439 D441 R529	N388-D390 VanDerWaalsContact C-N 3.3Å; N388-D390 PolarHBondContact O-N 3.41Å; D390-Y432 PolarHBondContact OD1-N 3.38Å; D390-H439 IonicContact OD1-CE1 3.77Å; D390-H439 PolarHBondContact OD1-CE1 2.89Å; D390-H439 IonicContact OD1-ND1 2.67Å; D390-H439 PolarHBondContact OD1-ND1 3.22Å; D390-D441 PolarHBondContact N-OD2 2.93Å; D390-R529 VanDerWaalsContact CG-NH2 3.29Å; D390-R529 IonicContact OD1-CZ 3.94Å; D390-R529 IonicContact OD1-NH2 3.94Å; D390-R529 PolarHBondContact OD1-NH2 2.8Å; D390-R529 IonicContact OD2-CZ 3.17Å; D390-R529 VanDerWaalsContact OD2-CZ 3.24Å; D390-R529 IonicContact OD2-NE 2.82Å; D390-R529 PolarHBondContact OD2-NE 2.71Å; D390-R529 IonicContact OD2-NH2 3.86Å; D390-R529 PolarHBondContact OD2-NH2 3.37Å
391	H	85.3	Confident	92.8	Very high	102 Å²	102	19.2 Å²	19.2	47%	0.472	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-20.2	-169.7	-61.5	68.2	0	0	0	114.4	N388 G389	N388-H391 WeakPolarHBondContact O-CA 3.19Å; N388-H391 PolarHBondContact O-N 3.2Å; G389-H391 PolarHBondContact O-N 2.76Å
392	F	90.9	Very high	92.8	Very high	57 Å²	57	22.3 Å²	22.3	25%	0.25	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.9	-71.5	179.1	-173.8	-114.2	0	0	0	112.6	I301 P311 N388 W394 P395 F396	I301-F392 HydrophobicContact CG1-CE1 4.23Å; P311-F392 HydrophobicContact CB-CE2 4.19Å; P311-F392 HydrophobicContact CB-CZ 4.19Å; P311-F392 HydrophobicContact CG-CE2 4.2Å; P311-F392 HydrophobicContact CG-CZ 3.97Å; N388-F392 PolarHBondContact O-N 2.81Å; F392-W394 PolarHBondContact O-N 2.99Å; F392-P395 VanDerWaalsContact O-CD 3.23Å; F392-P395 WeakPolarHBondContact O-CD 3.23Å; F392-F396 AromaticContact CE2-CD2 3.98Å; F392-F396 HydrophobicContact CE2-CD2 3.98Å; F392-F396 HydrophobicContact CZ-CD2 4.2Å; F392-F396 WeakPolarHBondContact O-CB 3.32Å; F392-F396 PolarHBondContact O-N 2.78Å
393	D	93.7	Very high	92.7	Very high	5 Å²	5	25.4 Å²	25.4	3%	0.027	14%	0.144	C	C	.	.	H	α-helix	trans	-55.1	-54.7	-168.4	-36	-39.5	0	0	0	113.7	F299 I301 T386 G389 F396 I397	F299-D393 HydrophobicContact CE2-CB 3.86Å; F299-D393 HydrophobicContact CZ-CB 4.27Å; I301-D393 HydrophobicContact CD1-CB 4.32Å; I301-D393 HydrophobicContact CG1-CB 4.37Å; T386-D393 WeakPolarHBondContact CB-OD2 3.33Å; G389-D393 WeakPolarHBondContact CA-OD2 3.22Å; G389-D393 PolarHBondContact N-OD2 3.19Å; D393-F396 PolarHBondContact O-N 3.38Å; D393-I397 WeakPolarHBondContact O-CG1 3.2Å; D393-I397 PolarHBondContact O-N 3.06Å
394	W	93.8	Very high	92.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-67.8	-46.2	179.9	-70.5	118.6	0	0	0	113.1	F299 L384 G389 F392 F396 I397 E398 M408 F414 Y432 H439	F299-W394 HydrophobicContact CE1-CH2 4.32Å; F299-W394 AromaticContact CE1-CZ2 3.88Å; F299-W394 HydrophobicContact CE1-CZ2 3.88Å; F299-W394 HydrophobicContact CZ-CD2 4.16Å; F299-W394 AromaticContact CZ-CE2 3.98Å; F299-W394 HydrophobicContact CZ-CE3 4.46Å; F299-W394 HydrophobicContact CZ-CH2 4.47Å; F299-W394 HydrophobicContact CZ-CZ2 4.16Å; L384-W394 HydrophobicContact CB-CZ2 4.42Å; L384-W394 HydrophobicContact CD2-CH2 3.57Å; L384-W394 HydrophobicContact CD2-CZ2 3.53Å; G389-W394 WeakPolarHBondContact O-CB 3.4Å; G389-W394 PolarHBondContact O-N 2.95Å; G389-W394 VanDerWaalsContact O-N 3.16Å; F392-W394 PolarHBondContact O-N 2.99Å; W394-F396 VanDerWaalsContact C-N 3.26Å; W394-F396 PolarHBondContact O-N 2.97Å; W394-I397 PolarHBondContact O-N 3.02Å; W394-E398 VanDerWaalsContact O-CB 3.29Å; W394-E398 WeakPolarHBondContact O-CB 3.44Å; W394-E398 PolarHBondContact O-N 2.9Å; W394-M408 HydrophobicContact CE3-CE 3.93Å; W394-M408 HydrophobicContact CE3-SD 3.67Å; W394-M408 HydrophobicContact CZ3-CE 4.44Å; W394-M408 HydrophobicContact CZ3-SD 3.97Å; W394-F414 HydrophobicContact CH2-CB 3.85Å; W394-F414 HydrophobicContact CH2-CD1 4.38Å; W394-F414 AromaticContact CH2-CD2 3.68Å; W394-F414 HydrophobicContact CH2-CD2 3.68Å; W394-F414 HydrophobicContact CH2-CE2 4.41Å; W394-F414 AromaticContact CH2-CG 3.67Å; W394-F414 HydrophobicContact CH2-CG 3.67Å; W394-F414 HydrophobicContact CZ2-CB 4.26Å; W394-F414 HydrophobicContact CZ2-CD1 4.07Å; W394-F414 HydrophobicContact CZ2-CD2 4.06Å; W394-F414 AromaticContact CZ2-CG 3.82Å; W394-F414 HydrophobicContact CZ2-CG 3.82Å; W394-F414 HydrophobicContact CZ3-CB 4Å; W394-F414 HydrophobicContact CZ3-CG 4.33Å; W394-Y432 HydrophobicContact CB-CD1 3.54Å; W394-Y432 HydrophobicContact CB-CD2 3.61Å; W394-Y432 HydrophobicContact CB-CE1 3.87Å; W394-Y432 HydrophobicContact CB-CE2 3.94Å; W394-Y432 HydrophobicContact CB-CG 3.38Å; W394-Y432 HydrophobicContact CG-CD1 4.11Å; W394-Y432 HydrophobicContact CG-CD2 4.29Å; W394-Y432 AromaticContact CG-CG 3.77Å; W394-Y432 HydrophobicContact CG-CG 3.77Å; W394-H439 AromaticContact CD1-CE1 3.65Å; W394-H439 AromaticContact CD1-NE2 3.73Å; W394-H439 AromaticContact NE1-CD2 3.44Å; W394-H439 PolarHBondContact NE1-CD2 3.1Å; W394-H439 AromaticContact NE1-CE1 3.49Å; W394-H439 PolarHBondContact NE1-CE1 2.9Å; W394-H439 AromaticContact NE1-CG 3.85Å; W394-H439 AromaticContact NE1-ND1 3.9Å; W394-H439 AromaticContact NE1-NE2 3.21Å; W394-H439 PolarHBondContact NE1-NE2 2.69Å
395	P	91.9	Very high	92.3	Very high	27 Å²	27	32.7 Å²	32.7	18%	0.175	19%	0.193	C	C	.	.	H	α-helix	trans	-53.5	-39.3	170.5	-27.2	31.7	0	0	0	114.6	G389 F392 V399 Y432	G389-P395 WeakPolarHBondContact O-CD 3.37Å; F392-P395 VanDerWaalsContact O-CD 3.23Å; F392-P395 WeakPolarHBondContact O-CD 3.23Å; P395-V399 WeakPolarHBondContact O-CG2 3.35Å; P395-V399 PolarHBondContact O-N 2.66Å; P395-Y432 WeakPolarHBondContact CA-OH 3.4Å; P395-Y432 VanDerWaalsContact CD-CE2 3.5Å; P395-Y432 HydrophobicContact CG-CE2 3.66Å
396	F	94.9	Very high	92	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.009	20%	0.203	C	C	.	.	H	α-helix	trans	-68.2	-52.4	-179.6	-156.8	-77.9	0	0	0	110	I301 T303 P311 P313 D316 I318 F392 D393 W394 E398 V399 R400	I301-F396 HydrophobicContact CD1-CB 3.91Å; I301-F396 HydrophobicContact CD1-CD1 4.23Å; I301-F396 HydrophobicContact CD1-CG 4.23Å; T303-F396 HydrophobicContact CG2-CD1 3.79Å; T303-F396 HydrophobicContact CG2-CD2 4.36Å; T303-F396 HydrophobicContact CG2-CE1 3.45Å; T303-F396 VanDerWaalsContact CG2-CE1 3.45Å; T303-F396 HydrophobicContact CG2-CE2 4.07Å; T303-F396 HydrophobicContact CG2-CG 4.25Å; T303-F396 HydrophobicContact CG2-CZ 3.61Å; P311-F396 HydrophobicContact CB-CD2 4.41Å; P311-F396 HydrophobicContact CB-CE2 3.61Å; P311-F396 HydrophobicContact CB-CZ 4.31Å; P313-F396 HydrophobicContact CB-CB 4.43Å; P313-F396 HydrophobicContact CB-CD1 4.08Å; P313-F396 HydrophobicContact CB-CD2 3.59Å; P313-F396 HydrophobicContact CB-CE1 4.16Å; P313-F396 HydrophobicContact CB-CE2 3.66Å; P313-F396 HydrophobicContact CB-CG 3.79Å; P313-F396 HydrophobicContact CB-CZ 3.96Å; P313-F396 HydrophobicContact CG-CD2 3.99Å; P313-F396 HydrophobicContact CG-CE2 4.24Å; P313-F396 HydrophobicContact CG-CG 4.48Å; D316-F396 HydrophobicContact CB-CZ 3.97Å; I318-F396 HydrophobicContact CG1-CD1 4.05Å; I318-F396 HydrophobicContact CG1-CE1 3.97Å; F392-F396 AromaticContact CE2-CD2 3.98Å; F392-F396 HydrophobicContact CE2-CD2 3.98Å; F392-F396 HydrophobicContact CZ-CD2 4.2Å; F392-F396 WeakPolarHBondContact O-CB 3.32Å; F392-F396 PolarHBondContact O-N 2.78Å; D393-F396 PolarHBondContact O-N 3.38Å; W394-F396 VanDerWaalsContact C-N 3.26Å; W394-F396 PolarHBondContact O-N 2.97Å; F396-E398 PolarHBondContact O-N 2.8Å; F396-V399 PolarHBondContact O-N 3.33Å; F396-R400 HydrophobicContact CD1-CG 3.61Å; F396-R400 HydrophobicContact CE1-CG 3.52Å; F396-R400 WeakPolarHBondContact O-CG 3.22Å; F396-R400 PolarHBondContact O-N 2.72Å
397	I	94.5	Very high	91.8	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-60.4	-41.7	178.2	-66.4	165.7	0	0	0	111.8	F299 I301 I318 F372 F373 D393 W394 V399 R400 A401 M408	F299-I397 HydrophobicContact CE2-CD1 3.63Å; F299-I397 HydrophobicContact CZ-CD1 4.14Å; I301-I397 HydrophobicContact CD1-CD1 4.38Å; I301-I397 HydrophobicContact CD1-CG1 4.1Å; I301-I397 HydrophobicContact CG2-CD1 4.08Å; I318-I397 HydrophobicContact CD1-CG1 4.1Å; F372-I397 HydrophobicContact CE1-CD1 4.22Å; F373-I397 HydrophobicContact CE1-CG2 3.68Å; F373-I397 HydrophobicContact CZ-CG2 3.73Å; D393-I397 WeakPolarHBondContact O-CG1 3.2Å; D393-I397 PolarHBondContact O-N 3.06Å; W394-I397 PolarHBondContact O-N 3.02Å; I397-V399 VanDerWaalsContact C-N 3.32Å; I397-V399 PolarHBondContact O-N 3.31Å; I397-R400 PolarHBondContact O-N 2.79Å; I397-A401 WeakPolarHBondContact O-CB 3.36Å; I397-A401 PolarHBondContact O-N 3.17Å; I397-M408 HydrophobicContact CB-SD 4.39Å; I397-M408 HydrophobicContact CG2-SD 3.89Å
398	E	93.4	Very high	91.7	Very high	52 Å²	52	35.9 Å²	35.9	24%	0.243	21%	0.214	C	C	.	.	H	α-helix	trans	-58.4	-43.8	178.5	-172.1	173.3	-106.4	0	0	111.2	W394 F396 A402 M408 Y432	W394-E398 VanDerWaalsContact O-CB 3.29Å; W394-E398 WeakPolarHBondContact O-CB 3.44Å; W394-E398 PolarHBondContact O-N 2.9Å; F396-E398 PolarHBondContact O-N 2.8Å; E398-A402 VanDerWaalsContact O-CB 3.25Å; E398-A402 WeakPolarHBondContact O-CB 3.35Å; E398-A402 PolarHBondContact O-N 3.29Å; E398-M408 HydrophobicContact CB-CE 3.72Å; E398-M408 HydrophobicContact CB-SD 3.93Å; E398-M408 HydrophobicContact CG-CE 3.98Å; E398-Y432 HydrophobicContact CB-CE1 4.47Å; E398-Y432 PolarHBondContact OE2-OH 3.35Å
399	V	93.3	Very high	91.5	Very high	56 Å²	56	35.9 Å²	35.9	34%	0.339	22%	0.219	S	C	.	.	H	α-helix	trans	-75.3	-41.3	-179.9	173.1	0	0	0	0	112.1	P313 T314 P395 F396 I397 A402 S403	P313-V399 HydrophobicContact CB-CB 3.91Å; P313-V399 HydrophobicContact CB-CG1 3.84Å; P313-V399 HydrophobicContact CG-CB 4.18Å; P313-V399 HydrophobicContact CG-CG1 4.13Å; T314-V399 HydrophobicContact CG2-CG1 4.44Å; P395-V399 WeakPolarHBondContact O-CG2 3.35Å; P395-V399 PolarHBondContact O-N 2.66Å; F396-V399 PolarHBondContact O-N 3.33Å; I397-V399 VanDerWaalsContact C-N 3.32Å; I397-V399 PolarHBondContact O-N 3.31Å; V399-A402 PolarHBondContact O-N 2.91Å; V399-S403 PolarHBondContact O-N 2.72Å
400	R	94.3	Very high	91.3	Very high	13 Å²	13	42 Å²	42	5%	0.049	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-48.7	174.7	-63.4	-47.6	-62.6	161.4	0.1	111.4	P313 D316 I318 E365 I369 F396 I397 A402 S403 Y404	P313-R400 WeakPolarHBondContact O-CD 3.43Å; P313-R400 PolarHBondContact O-NH1 3.22Å; D316-R400 VanDerWaalsContact O-CD 3.23Å; D316-R400 WeakPolarHBondContact O-CD 3.49Å; D316-R400 VanDerWaalsContact O-CZ 3.23Å; D316-R400 PolarHBondContact O-NE 3.4Å; D316-R400 VanDerWaalsContact O-NE 3.13Å; D316-R400 PolarHBondContact O-NH1 3.28Å; I318-R400 HydrophobicContact CD1-CG 4.37Å; I318-R400 HydrophobicContact CG1-CG 4.37Å; E365-R400 WeakPolarHBondContact OE1-CG 3.16Å; E365-R400 IonicContact OE1-CZ 2.7Å; E365-R400 IonicContact OE1-NE 2.68Å; E365-R400 PolarHBondContact OE1-NE 3.09Å; E365-R400 IonicContact OE1-NH2 3.41Å; E365-R400 IonicContact OE2-CZ 3.31Å; E365-R400 IonicContact OE2-NE 3.97Å; E365-R400 PolarHBondContact OE2-NE 2.9Å; E365-R400 VanDerWaalsContact OE2-NE 3.13Å; E365-R400 IonicContact OE2-NH2 3.43Å; E365-R400 PolarHBondContact OE2-NH2 2.96Å; I369-R400 HydrophobicContact CD1-CB 3.64Å; F396-R400 HydrophobicContact CD1-CG 3.61Å; F396-R400 HydrophobicContact CE1-CG 3.52Å; F396-R400 WeakPolarHBondContact O-CG 3.22Å; F396-R400 PolarHBondContact O-N 2.72Å; I397-R400 PolarHBondContact O-N 2.79Å; R400-A402 VanDerWaalsContact C-N 3.34Å; R400-A402 PolarHBondContact O-N 3.14Å; R400-S403 WeakPolarHBondContact O-CB 3.46Å; R400-S403 PolarHBondContact O-N 2.69Å; R400-S403 VanDerWaalsContact O-N 3.11Å; R400-S403 PolarHBondContact O-OG 3Å; R400-Y404 VanDerWaalsContact O-CD2 3.27Å; R400-Y404 WeakPolarHBondContact O-CD2 3.38Å; R400-Y404 PolarHBondContact O-N 3Å
401	A	93.5	Very high	91.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-56.7	-46.8	176.2	0	0	0	0	0	111.6	I369 F373 I397 S403 Y404 G405 L406	I369-A401 HydrophobicContact CG2-CB 4.14Å; F373-A401 HydrophobicContact CE2-CB 3.93Å; F373-A401 HydrophobicContact CZ-CB 3.94Å; I397-A401 WeakPolarHBondContact O-CB 3.36Å; I397-A401 PolarHBondContact O-N 3.17Å; A401-S403 VanDerWaalsContact C-N 3.29Å; A401-S403 PolarHBondContact O-N 2.83Å; A401-Y404 CarbonylContact O-C 3.56Å; A401-Y404 PolarHBondContact O-N 3.12Å; A401-Y404 VanDerWaalsContact O-N 3.13Å; A401-G405 PolarHBondContact O-N 2.85Å; A401-L406 CarbonylContact C-O 3.54Å; A401-L406 HydrophobicContact CB-CB 4.05Å; A401-L406 PolarHBondContact O-N 2.93Å
402	A	92.1	Very high	91.4	Very high	65 Å²	65	40 Å²	40	54%	0.537	24%	0.238	S	C	.	.	H	α-helix	trans	-61.5	-34.3	177	0	0	0	0	0	113.2	E398 V399 R400 Y404 G405	E398-A402 VanDerWaalsContact O-CB 3.25Å; E398-A402 WeakPolarHBondContact O-CB 3.35Å; E398-A402 PolarHBondContact O-N 3.29Å; V399-A402 PolarHBondContact O-N 2.91Å; R400-A402 VanDerWaalsContact C-N 3.34Å; R400-A402 PolarHBondContact O-N 3.14Å; A402-Y404 PolarHBondContact O-N 3.08Å; A402-G405 PolarHBondContact O-N 3.12Å
403	S	90.5	Very high	91.2	Very high	72 Å²	72	37.8 Å²	37.8	50%	0.503	23%	0.231	S	C	.	.	H	α-helix	trans	-63.5	-28.2	176.7	81.3	0	0	0	0	113.3	V399 R400 A401	V399-S403 PolarHBondContact O-N 2.72Å; R400-S403 WeakPolarHBondContact O-CB 3.46Å; R400-S403 PolarHBondContact O-N 2.69Å; R400-S403 VanDerWaalsContact O-N 3.11Å; R400-S403 PolarHBondContact O-OG 3Å; A401-S403 VanDerWaalsContact C-N 3.29Å; A401-S403 PolarHBondContact O-N 2.83Å
404	Y	91.8	Very high	91.1	Very high	84 Å²	84	37.6 Å²	37.6	33%	0.329	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	2.2	172.7	-63.4	-70.9	0	0	0	113.8	E365 L366 I369 R400 A401 A402	E365-Y404 HydrophobicContact CB-CE2 4.39Å; E365-Y404 HydrophobicContact CG-CE2 4.35Å; E365-Y404 PolarHBondContact OE2-OH 2.99Å; E365-Y404 VanDerWaalsContact OE2-OH 3.09Å; L366-Y404 HydrophobicContact CB-CD1 4.11Å; L366-Y404 HydrophobicContact CB-CD2 4.45Å; L366-Y404 HydrophobicContact CB-CE1 4.17Å; L366-Y404 HydrophobicContact CB-CG 4.26Å; L366-Y404 HydrophobicContact CD1-CD1 4.31Å; L366-Y404 HydrophobicContact CD1-CD2 4.33Å; L366-Y404 HydrophobicContact CD1-CG 3.87Å; L366-Y404 HydrophobicContact CD2-CD1 4.1Å; L366-Y404 HydrophobicContact CD2-CG 4.47Å; L366-Y404 HydrophobicContact CG-CD1 4.41Å; L366-Y404 HydrophobicContact CG-CG 4.42Å; I369-Y404 HydrophobicContact CD1-CD2 4.39Å; I369-Y404 HydrophobicContact CD1-CE2 4.47Å; R400-Y404 VanDerWaalsContact O-CD2 3.27Å; R400-Y404 WeakPolarHBondContact O-CD2 3.38Å; R400-Y404 PolarHBondContact O-N 3Å; A401-Y404 CarbonylContact O-C 3.56Å; A401-Y404 PolarHBondContact O-N 3.12Å; A401-Y404 VanDerWaalsContact O-N 3.13Å; A402-Y404 PolarHBondContact O-N 3.08Å
405	G	89.6	Confident	90.7	Very high	68 Å²	68	39.5 Å²	39.5	70%	0.701	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.2	13.6	-178.9	0	0	0	0	0	115.4	A401 A402	A401-G405 PolarHBondContact O-N 2.85Å; A402-G405 PolarHBondContact O-N 3.12Å
406	L	90	Very high	90.5	Very high	42 Å²	42	45.2 Å²	45.2	22%	0.22	26%	0.261	C	S	.	.			trans	-87.5	125.1	176	-63.7	174.5	0	0	0	111	L366 I369 A401 M408	L366-L406 HydrophobicContact CD1-CD1 3.72Å; L366-L406 HydrophobicContact CD1-CG 4.42Å; I369-L406 HydrophobicContact CG2-CD1 4.04Å; A401-L406 CarbonylContact C-O 3.54Å; A401-L406 HydrophobicContact CB-CB 4.05Å; A401-L406 PolarHBondContact O-N 2.93Å; L406-M408 PolarHBondContact O-N 2.6Å
407	S	90	Very high	89.7	Confident	39 Å²	39	48.8 Å²	48.8	27%	0.273	28%	0.278	S	S	.	.			trans	-85.1	97.3	175.7	178.2	0	0	0	0	110.1	S409 E410 E411	S407-S409 PolarHBondContact O-N 3.09Å; S407-S409 VanDerWaalsContact O-N 3.1Å; S407-S409 PolarHBondContact OG-OG 3.48Å; S407-E410 VanDerWaalsContact CB-OE1 3.25Å; S407-E410 WeakPolarHBondContact CB-OE1 3.49Å; S407-E410 PolarHBondContact O-N 3.08Å; S407-E410 VanDerWaalsContact OG-CD 3.3Å; S407-E410 WeakPolarHBondContact OG-CG 3.42Å; S407-E410 PolarHBondContact OG-OE1 3.13Å; S407-E411 PolarHBondContact O-N 3.12Å
408	M	91	Very high	88.1	Confident	5 Å²	5	57.7 Å²	57.7	3%	0.025	32%	0.317	C	S	.	.	H	α-helix	trans	-52.5	-35.5	-179.4	-174.3	-179.4	80.1	0	0	112.6	F373 W394 I397 E398 L406 T412 Y432	F373-M408 HydrophobicContact CE1-CG 4.22Å; F373-M408 HydrophobicContact CE2-CB 4.41Å; F373-M408 HydrophobicContact CE2-CG 4.47Å; F373-M408 HydrophobicContact CZ-CB 4.07Å; F373-M408 HydrophobicContact CZ-CG 3.75Å; W394-M408 HydrophobicContact CE3-CE 3.93Å; W394-M408 HydrophobicContact CE3-SD 3.67Å; W394-M408 HydrophobicContact CZ3-CE 4.44Å; W394-M408 HydrophobicContact CZ3-SD 3.97Å; I397-M408 HydrophobicContact CB-SD 4.39Å; I397-M408 HydrophobicContact CG2-SD 3.89Å; E398-M408 HydrophobicContact CB-CE 3.72Å; E398-M408 HydrophobicContact CB-SD 3.93Å; E398-M408 HydrophobicContact CG-CE 3.98Å; L406-M408 PolarHBondContact O-N 2.6Å; M408-T412 HydrophobicContact CG-CG2 4.16Å; M408-T412 WeakPolarHBondContact O-CB 3.46Å; M408-T412 PolarHBondContact O-N 3.46Å; M408-T412 PolarHBondContact O-OG1 3.2Å; M408-Y432 HydrophobicContact CE-CD1 3.84Å; M408-Y432 HydrophobicContact CE-CE1 3.86Å
409	S	87.7	Confident	86.3	Confident	55 Å²	55	55.5 Å²	55.5	39%	0.385	31%	0.308	S	S	.	.	H	α-helix	trans	-71.6	-28.9	177.7	56.9	0	0	0	0	114.5	S407 G413 F414	S407-S409 PolarHBondContact O-N 3.09Å; S407-S409 VanDerWaalsContact O-N 3.1Å; S407-S409 PolarHBondContact OG-OG 3.48Å; S409-G413 VanDerWaalsContact O-CA 3.31Å; S409-G413 WeakPolarHBondContact O-CA 3.42Å; S409-G413 PolarHBondContact O-N 2.9Å; S409-F414 VanDerWaalsContact CA-O 3.24Å; S409-F414 WeakPolarHBondContact CA-O 3.48Å
410	E	86.3	Confident	84.2	Confident	127 Å²	127	57.2 Å²	57.2	59%	0.593	32%	0.319	S	S	*	.	H	α-helix	trans	-80.6	-39	174.8	-72.8	164.9	-118.7	0	0	111	R69 S407	R69-E410 PolarHBondContact NH1-O 3.44Å; S407-E410 VanDerWaalsContact CB-OE1 3.25Å; S407-E410 WeakPolarHBondContact CB-OE1 3.49Å; S407-E410 PolarHBondContact O-N 3.08Å; S407-E410 VanDerWaalsContact OG-CD 3.3Å; S407-E410 WeakPolarHBondContact OG-CG 3.42Å; S407-E410 PolarHBondContact OG-OE1 3.13Å
411	E	87.2	Confident	81.6	Confident	69 Å²	69	63 Å²	63	32%	0.322	36%	0.355	S	S	.	.	H	α-helix	trans	-77.9	-47.9	-178.7	-62.1	-51.7	147.9	0	0	113.3	F373 Q377 S407	F373-E411 HydrophobicContact CB-CB 4.14Å; F373-E411 HydrophobicContact CD2-CB 3.67Å; F373-E411 HydrophobicContact CD2-CG 4.07Å; F373-E411 HydrophobicContact CE2-CB 4.37Å; F373-E411 HydrophobicContact CG-CB 4.15Å; Q377-E411 VanDerWaalsContact CG-O 3.32Å; Q377-E411 WeakPolarHBondContact CG-O 3.45Å; Q377-E411 PolarHBondContact NE2-O 2.98Å; Q377-E411 PolarHBondContact NE2-OE2 3.34Å; S407-E411 PolarHBondContact O-N 3.12Å
412	T	88.6	Confident	79.1	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.006	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-20.7	-175.4	70.7	0	0	0	0	113.7	Y70 F373 I376 M408 F414	Y70-T412 WeakPolarHBondContact CE2-O 3.35Å; Y70-T412 PolarHBondContact OH-O 2.93Å; F373-T412 HydrophobicContact CB-CG2 4.42Å; F373-T412 HydrophobicContact CD1-CG2 3.35Å; F373-T412 HydrophobicContact CD2-CG2 4.39Å; F373-T412 HydrophobicContact CE1-CG2 3.56Å; F373-T412 HydrophobicContact CG-CG2 3.81Å; F373-T412 HydrophobicContact CZ-CG2 4.18Å; I376-T412 HydrophobicContact CD1-CG2 4.39Å; M408-T412 HydrophobicContact CG-CG2 4.16Å; M408-T412 WeakPolarHBondContact O-CB 3.46Å; M408-T412 PolarHBondContact O-N 3.46Å; M408-T412 PolarHBondContact O-OG1 3.2Å; T412-F414 PolarHBondContact O-N 3.5Å; T412-F414 PolarHBondContact OG1-N 2.82Å
413	G	87.6	Confident	76.7	Confident	11 Å²	11	64.1 Å²	64.1	11%	0.113	36%	0.363	C	S	.	.	S	Bend	trans	72.6	2.2	-168.3	0	0	0	0	0	114.8	S409 S434	S409-G413 VanDerWaalsContact O-CA 3.31Å; S409-G413 WeakPolarHBondContact O-CA 3.42Å; S409-G413 PolarHBondContact O-N 2.9Å; G413-S434 VanDerWaalsContact O-CB 3.24Å; G413-S434 WeakPolarHBondContact O-CB 3.46Å; G413-S434 PolarHBondContact O-OG 3.38Å
414	F	90.9	Very high	74.3	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	37%	0.368	C	S	.	.			trans	-90.7	138.7	170.1	-77.1	-85.5	0	0	0	110.7	L384 W394 S409 T412 S434 A437 H439	L384-F414 HydrophobicContact CB-CZ 4.43Å; L384-F414 HydrophobicContact CD1-CE2 3.53Å; L384-F414 HydrophobicContact CD1-CZ 3.69Å; L384-F414 HydrophobicContact CD2-CD2 4.33Å; L384-F414 HydrophobicContact CD2-CE2 3.9Å; L384-F414 HydrophobicContact CD2-CZ 4.4Å; L384-F414 HydrophobicContact CG-CE2 4.26Å; L384-F414 HydrophobicContact CG-CZ 4.4Å; W394-F414 HydrophobicContact CH2-CB 3.85Å; W394-F414 HydrophobicContact CH2-CD1 4.38Å; W394-F414 AromaticContact CH2-CD2 3.68Å; W394-F414 HydrophobicContact CH2-CD2 3.68Å; W394-F414 HydrophobicContact CH2-CE2 4.41Å; W394-F414 AromaticContact CH2-CG 3.67Å; W394-F414 HydrophobicContact CH2-CG 3.67Å; W394-F414 HydrophobicContact CZ2-CB 4.26Å; W394-F414 HydrophobicContact CZ2-CD1 4.07Å; W394-F414 HydrophobicContact CZ2-CD2 4.06Å; W394-F414 AromaticContact CZ2-CG 3.82Å; W394-F414 HydrophobicContact CZ2-CG 3.82Å; W394-F414 HydrophobicContact CZ3-CB 4Å; W394-F414 HydrophobicContact CZ3-CG 4.33Å; S409-F414 VanDerWaalsContact CA-O 3.24Å; S409-F414 WeakPolarHBondContact CA-O 3.48Å; T412-F414 PolarHBondContact O-N 3.5Å; T412-F414 PolarHBondContact OG1-N 2.82Å; F414-S434 VanDerWaalsContact CE1-CB 3.43Å; F414-A437 HydrophobicContact CE2-CB 4.04Å; F414-A437 HydrophobicContact CZ-CB 3.66Å; F414-H439 HydrophobicContact CD1-CB 4.42Å; F414-H439 HydrophobicContact CE1-CB 3.8Å
415	S	86.9	Confident	72	Confident	41 Å²	41	60.9 Å²	60.9	29%	0.287	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	148.2	-178.1	57	0	0	0	0	111.2	Q417 L433	S415-Q417 PolarHBondContact O-N 2.82Å; S415-L433 PolarHBondContact N-O 3.26Å; S415-L433 VanDerWaalsContact N-O 3.15Å; S415-L433 PolarHBondContact O-N 2.67Å; S415-L433 VanDerWaalsContact O-N 3.11Å
416	R	86.1	Confident	69.9	Low	146 Å²	146	62.5 Å²	62.5	55%	0.551	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	99.2	175.6	-168	-178.6	-176.9	157	0.1	111.6	Y432	R416-Y432 HydrophobicContact CB-CD1 4.11Å; R416-Y432 HydrophobicContact CB-CE1 3.55Å; R416-Y432 HydrophobicContact CB-CE2 4.42Å; R416-Y432 WeakPolarHBondContact CD-OH 3.19Å; R416-Y432 HydrophobicContact CG-CE1 4.06Å; R416-Y432 HydrophobicContact CG-CE2 4.04Å
417	Q	78.1	Confident	67.9	Low	78 Å²	78	62.3 Å²	62.3	36%	0.364	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	140.1	173	-57.9	-167.7	24.6	0	0	109.9	S415 G419 E431 L433	S415-Q417 PolarHBondContact O-N 2.82Å; Q417-G419 PolarHBondContact O-N 3.21Å; Q417-E431 PolarHBondContact N-O 2.89Å; Q417-E431 PolarHBondContact O-N 3.42Å; Q417-L433 HydrophobicContact CB-CD1 4.41Å; Q417-L433 HydrophobicContact CG-CB 4.24Å
418	K	62.4	Low	65.9	Low	188 Å²	188	65.1 Å²	65.1	82%	0.817	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	122.3	168.7	-69.4	-172.6	177.6	-176	0	108.1	T420	K418-T420 PolarHBondContact O-N 3.36Å
419	G	54.3	Low	64.3	Low	5 Å²	5	66.4 Å²	66.4	5%	0.052	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-51.3	129.7	178.3	0	0	0	0	0	111.1	Q417 V421 S429	Q417-G419 PolarHBondContact O-N 3.21Å; G419-V421 PolarHBondContact O-N 3.02Å; G419-V421 VanDerWaalsContact O-N 3.11Å; G419-S429 PolarHBondContact N-O 3.43Å
420	T	48.6	Very low	63.4	Low	92 Å²	92	64.2 Å²	64.2	56%	0.564	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-62.2	117.5	-177.2	37.4	0	0	0	0	110.3	K418 G422 R425	K418-T420 PolarHBondContact O-N 3.36Å; T420-G422 PolarHBondContact O-N 2.85Å; T420-R425 VanDerWaalsContact O-CD 3.23Å; T420-R425 WeakPolarHBondContact O-CD 3.3Å; T420-R425 PolarHBondContact OG1-NH1 3.34Å
421	V	39.6	Very low	63.4	Low	135 Å²	135	58.7 Å²	58.7	82%	0.818	35%	0.347	S	S	*	.			trans	-57.8	111.2	-178.2	-177.5	0	0	0	0	109.1	G419	G419-V421 PolarHBondContact O-N 3.02Å; G419-V421 VanDerWaalsContact O-N 3.11Å
422	G	42.5	Very low	63.5	Low	32 Å²	32	55.4 Å²	55.4	33%	0.33	33%	0.332	S	S	.	.			trans	-165.2	160	-174	0	0	0	0	0	111.3	T420 G424 R425	T420-G422 PolarHBondContact O-N 2.85Å; G422-G424 PolarHBondContact O-N 2.98Å; G422-R425 PolarHBondContact O-N 3.15Å
423	P	40.2	Very low	63.6	Low	57 Å²	57	55.9 Å²	55.9	37%	0.37	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	107.5	-168.8	-27.6	36.6	0	0	0	113.2	T534 R891	P423-T534 PolarHBondContact O-OG1 3.39Å; P423-R891 PolarHBondContact O-NH2 2.9Å
424	G	40.7	Very low	63.8	Low	58 Å²	58	55.5 Å²	55.5	60%	0.598	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.8	8.1	179.3	0	0	0	0	0	115.9	G422	G422-G424 PolarHBondContact O-N 2.98Å
425	R	43.8	Very low	63.7	Low	29 Å²	29	57.2 Å²	57.2	11%	0.109	34%	0.337	C	S	.	.			trans	-98	143	157	-95.4	-176.7	164.3	126.5	2.7	109	T420 G422 E431 D526 K530	T420-R425 VanDerWaalsContact O-CD 3.23Å; T420-R425 WeakPolarHBondContact O-CD 3.3Å; T420-R425 PolarHBondContact OG1-NH1 3.34Å; G422-R425 PolarHBondContact O-N 3.15Å; R425-E431 IonicContact CZ-OE1 2.7Å; R425-E431 IonicContact CZ-OE2 3.36Å; R425-E431 IonicContact NE-OE1 2.75Å; R425-E431 PolarHBondContact NE-OE1 2.92Å; R425-E431 IonicContact NE-OE2 3.69Å; R425-E431 PolarHBondContact NE-OE2 3.45Å; R425-E431 IonicContact NH2-OE1 3.86Å; R425-E431 PolarHBondContact NH2-OE1 2.95Å; R425-E431 IonicContact NH2-OE2 2.95Å; R425-E431 PolarHBondContact NH2-OE2 2.65Å; R425-D526 IonicContact CZ-OD1 2.74Å; R425-D526 VanDerWaalsContact CZ-OD1 3.23Å; R425-D526 IonicContact NH1-OD1 3.73Å; R425-D526 PolarHBondContact NH1-OD1 3.45Å; R425-D526 IonicContact NH2-OD1 3.38Å; R425-D526 PolarHBondContact NH2-OD1 2.8Å; R425-K530 VanDerWaalsContact NH1-CE 3.29Å
426	D	44.9	Very low	63.7	Low	102 Å²	102	55.3 Å²	55.3	55%	0.545	32%	0.323	S	S	.	.			trans	-87.9	122	166.6	-162.4	-45.9	0	0	0	108.5	S428 S429	D426-S428 VanDerWaalsContact CG-OG 3.28Å; D426-S428 PolarHBondContact O-N 2.84Å; D426-S428 VanDerWaalsContact O-N 3.16Å; D426-S428 WeakPolarHBondContact OD1-CB 3.44Å; D426-S428 PolarHBondContact OD1-N 2.94Å; D426-S428 PolarHBondContact OD1-OG 2.93Å; D426-S429 PolarHBondContact O-N 3.43Å; D426-S429 PolarHBondContact O-OG 3.18Å
427	G	48.1	Very low	64	Low	38 Å²	38	48.4 Å²	48.4	39%	0.392	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-7.1	-178.3	0	0	0	0	0	114.1
428	S	48.6	Very low	64.7	Low	98 Å²	98	44.7 Å²	44.7	69%	0.685	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-25.9	178.3	67.3	0	0	0	0	114.1	D426	D426-S428 VanDerWaalsContact CG-OG 3.28Å; D426-S428 PolarHBondContact O-N 2.84Å; D426-S428 VanDerWaalsContact O-N 3.16Å; D426-S428 WeakPolarHBondContact OD1-CB 3.44Å; D426-S428 PolarHBondContact OD1-N 2.94Å; D426-S428 PolarHBondContact OD1-OG 2.93Å
429	S	57.9	Low	66.2	Low	33 Å²	33	35.7 Å²	35.7	23%	0.231	24%	0.241	C	C	.	.	S	Bend	trans	-73.8	134.3	178.5	48.6	0	0	0	0	111.8	G419 D426	G419-S429 PolarHBondContact N-O 3.43Å; D426-S429 PolarHBondContact O-N 3.43Å; D426-S429 PolarHBondContact O-OG 3.18Å
430	G	69.2	Low	68.1	Low	9 Å²	9	35.5 Å²	35.5	9%	0.093	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	136.4	167.6	0	0	0	0	0	110.1
431	E	84.5	Confident	70.3	Confident	10 Å²	10	31.1 Å²	31.1	5%	0.047	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124.9	173.1	-58	-179.5	-178	0	0	107.1	Q417 R425 L433 R529	Q417-E431 PolarHBondContact N-O 2.89Å; Q417-E431 PolarHBondContact O-N 3.42Å; R425-E431 IonicContact CZ-OE1 2.7Å; R425-E431 IonicContact CZ-OE2 3.36Å; R425-E431 IonicContact NE-OE1 2.75Å; R425-E431 PolarHBondContact NE-OE1 2.92Å; R425-E431 IonicContact NE-OE2 3.69Å; R425-E431 PolarHBondContact NE-OE2 3.45Å; R425-E431 IonicContact NH2-OE1 3.86Å; R425-E431 PolarHBondContact NH2-OE1 2.95Å; R425-E431 IonicContact NH2-OE2 2.95Å; R425-E431 PolarHBondContact NH2-OE2 2.65Å; E431-L433 HydrophobicContact CB-CD1 4.08Å; E431-L433 HydrophobicContact CB-CD2 4.37Å; E431-L433 HydrophobicContact CB-CG 3.99Å; E431-L433 PolarHBondContact O-N 3.44Å; E431-R529 WeakPolarHBondContact OE2-CD 3.35Å
432	Y	90.6	Very high	72.8	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	104.2	-179.4	-75.6	-95.2	0	0	0	110	D390 W394 P395 E398 M408 R416 H439	D390-Y432 PolarHBondContact OD1-N 3.38Å; W394-Y432 HydrophobicContact CB-CD1 3.54Å; W394-Y432 HydrophobicContact CB-CD2 3.61Å; W394-Y432 HydrophobicContact CB-CE1 3.87Å; W394-Y432 HydrophobicContact CB-CE2 3.94Å; W394-Y432 HydrophobicContact CB-CG 3.38Å; W394-Y432 HydrophobicContact CG-CD1 4.11Å; W394-Y432 HydrophobicContact CG-CD2 4.29Å; W394-Y432 AromaticContact CG-CG 3.77Å; W394-Y432 HydrophobicContact CG-CG 3.77Å; P395-Y432 WeakPolarHBondContact CA-OH 3.4Å; P395-Y432 VanDerWaalsContact CD-CE2 3.5Å; P395-Y432 HydrophobicContact CG-CE2 3.66Å; E398-Y432 HydrophobicContact CB-CE1 4.47Å; E398-Y432 PolarHBondContact OE2-OH 3.35Å; M408-Y432 HydrophobicContact CE-CD1 3.84Å; M408-Y432 HydrophobicContact CE-CE1 3.86Å; R416-Y432 HydrophobicContact CB-CD1 4.11Å; R416-Y432 HydrophobicContact CB-CE1 3.55Å; R416-Y432 HydrophobicContact CB-CE2 4.42Å; R416-Y432 WeakPolarHBondContact CD-OH 3.19Å; R416-Y432 HydrophobicContact CG-CE1 4.06Å; R416-Y432 HydrophobicContact CG-CE2 4.04Å; Y432-H439 VanDerWaalsContact O-CB 3.24Å; Y432-H439 WeakPolarHBondContact O-CB 3.46Å; Y432-H439 PolarHBondContact O-ND1 2.93Å; Y432-H439 VanDerWaalsContact O-ND1 3.13Å
433	L	90.6	Very high	75.2	Confident	12 Å²	12	23.8 Å²	23.8	6%	0.063	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	149.8	-167.6	-58.1	179.5	0	0	0	111.3	S415 Q417 E431 D525	S415-L433 PolarHBondContact N-O 3.26Å; S415-L433 VanDerWaalsContact N-O 3.15Å; S415-L433 PolarHBondContact O-N 2.67Å; S415-L433 VanDerWaalsContact O-N 3.11Å; Q417-L433 HydrophobicContact CB-CD1 4.41Å; Q417-L433 HydrophobicContact CG-CB 4.24Å; E431-L433 HydrophobicContact CB-CD1 4.08Å; E431-L433 HydrophobicContact CB-CD2 4.37Å; E431-L433 HydrophobicContact CB-CG 3.99Å; E431-L433 PolarHBondContact O-N 3.44Å; L433-D525 HydrophobicContact CD2-CB 3.89Å
434	S	90.4	Very high	77.5	Confident	3 Å²	3	22.1 Å²	22.1	2%	0.021	15%	0.15	C	C	.	.			trans	-123.4	171.4	167.6	-163.4	0	0	0	0	110.7	H89 G413 F414	H89-S434 PolarHBondContact NE2-O 3.35Å; G413-S434 VanDerWaalsContact O-CB 3.24Å; G413-S434 WeakPolarHBondContact O-CB 3.46Å; G413-S434 PolarHBondContact O-OG 3.38Å; F414-S434 VanDerWaalsContact CE1-CB 3.43Å
435	R	88.8	Confident	79.9	Confident	36 Å²	36	19.9 Å²	19.9	14%	0.136	12%	0.123	C	C	.	.	S	Bend	trans	-90.3	-55	176	-65	177.6	67	94.1	-6.5	112.6	N63 H89 P90 T91 D105 Y107	N63-R435 WeakPolarHBondContact OD1-CD 3.49Å; H89-R435 PolarHBondContact CD2-O 3.15Å; P90-R435 PolarHBondContact O-NH1 3.5Å; P90-R435 PolarHBondContact O-NH2 3.28Å; T91-R435 PolarHBondContact OG1-NH2 3.12Å; D105-R435 IonicContact OD2-CZ 3.87Å; D105-R435 IonicContact OD2-NH2 3.95Å; D105-R435 PolarHBondContact OD2-NH2 2.85Å; Y107-R435 WeakPolarHBondContact OH-CB 3.27Å; Y107-R435 PolarHBondContact OH-NE 3.12Å
436	P	88	Confident	82	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.006	12%	0.118	C	C	.	.	S	Bend	trans	-76.3	-19.4	179.3	29.6	-37.9	0	0	0	114.7	Y70 F72 Y107	Y70-P436 HydrophobicContact CD1-CB 4.47Å; Y70-P436 HydrophobicContact CD1-CG 4.31Å; Y70-P436 HydrophobicContact CD2-CB 4.28Å; Y70-P436 HydrophobicContact CD2-CG 3.46Å; Y70-P436 VanDerWaalsContact CD2-CG 3.46Å; Y70-P436 HydrophobicContact CE2-CG 4.1Å; Y70-P436 HydrophobicContact CG-CB 3.89Å; Y70-P436 HydrophobicContact CG-CG 3.58Å; F72-P436 HydrophobicContact CD2-CB 3.5Å; F72-P436 HydrophobicContact CE2-CB 3.69Å; F72-P436 VanDerWaalsContact CE2-O 3.24Å; F72-P436 WeakPolarHBondContact CE2-O 3.46Å; Y107-P436 HydrophobicContact CD1-CB 4.26Å; Y107-P436 HydrophobicContact CE1-CB 4.03Å
437	A	91.6	Very high	83.7	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.11	C	C	.	.	S	Bend	trans	-124	138.9	-178.4	0	0	0	0	0	111.2	Y70 N382 L384 F414	Y70-A437 HydrophobicContact CD1-CB 4.24Å; Y70-A437 HydrophobicContact CE1-CB 3.78Å; N382-A437 WeakPolarHBondContact O-CA 3.28Å; L384-A437 HydrophobicContact CD1-CB 4.33Å; F414-A437 HydrophobicContact CE2-CB 4.04Å; F414-A437 HydrophobicContact CZ-CB 3.66Å
438	V	93.1	Very high	85.5	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	142.5	178.2	178.2	0	0	0	0	109.5	V86 N87 N382 I383 L384 I440 P524	V86-V438 HydrophobicContact CG2-CG2 4.22Å; N87-V438 HydrophobicContact CB-CG2 3.96Å; N382-V438 PolarHBondContact O-N 3.13Å; I383-V438 WeakPolarHBondContact CA-O 3.28Å; I383-V438 HydrophobicContact CG1-CB 4.31Å; I383-V438 HydrophobicContact CG2-CB 4.23Å; I383-V438 HydrophobicContact CG2-CG1 4.44Å; L384-V438 PolarHBondContact N-O 2.88Å; V438-I440 HydrophobicContact CG1-CD1 3.62Å; V438-I440 HydrophobicContact CG1-CG1 3.95Å; V438-P524 HydrophobicContact CG1-CB 3.86Å; V438-P524 HydrophobicContact CG2-CB 4.41Å; V438-P524 HydrophobicContact CG2-CG 4.23Å
439	H	94.3	Very high	87.1	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	118.8	169.6	174.7	-122.9	0	0	0	112.1	L384 T386 D390 W394 F414 Y432 D525 R529	L384-H439 WeakPolarHBondContact O-CA 3.49Å; T386-H439 PolarHBondContact OG1-NE2 3Å; D390-H439 IonicContact OD1-CE1 3.77Å; D390-H439 PolarHBondContact OD1-CE1 2.89Å; D390-H439 IonicContact OD1-ND1 2.67Å; D390-H439 PolarHBondContact OD1-ND1 3.22Å; W394-H439 AromaticContact CD1-CE1 3.65Å; W394-H439 AromaticContact CD1-NE2 3.73Å; W394-H439 AromaticContact NE1-CD2 3.44Å; W394-H439 PolarHBondContact NE1-CD2 3.1Å; W394-H439 AromaticContact NE1-CE1 3.49Å; W394-H439 PolarHBondContact NE1-CE1 2.9Å; W394-H439 AromaticContact NE1-CG 3.85Å; W394-H439 AromaticContact NE1-ND1 3.9Å; W394-H439 AromaticContact NE1-NE2 3.21Å; W394-H439 PolarHBondContact NE1-NE2 2.69Å; F414-H439 HydrophobicContact CD1-CB 4.42Å; F414-H439 HydrophobicContact CE1-CB 3.8Å; Y432-H439 VanDerWaalsContact O-CB 3.24Å; Y432-H439 WeakPolarHBondContact O-CB 3.46Å; Y432-H439 PolarHBondContact O-ND1 2.93Å; Y432-H439 VanDerWaalsContact O-ND1 3.13Å; H439-D525 PolarHBondContact N-OD1 2.86Å; H439-R529 PolarHBondContact ND1-NH2 2.63Å; H439-R529 PolarHBondContact O-NH1 3.45Å; H439-R529 PolarHBondContact O-NH2 2.95Å
440	I	94.3	Very high	87.9	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	95.3	178.6	-54	-65.5	0	0	0	110	I383 L384 V385 T386 V438 C442 Y505 V509 V513 L528	I383-I440 HydrophobicContact CG2-CG1 3.75Å; L384-I440 PolarHBondContact O-N 3.41Å; V385-I440 WeakPolarHBondContact CA-O 3.38Å; T386-I440 PolarHBondContact N-O 2.68Å; T386-I440 VanDerWaalsContact N-O 3.07Å; V438-I440 HydrophobicContact CG1-CD1 3.62Å; V438-I440 HydrophobicContact CG1-CG1 3.95Å; I440-C442 PolarHBondContact O-N 3.4Å; I440-Y505 HydrophobicContact CB-CD2 4.24Å; I440-Y505 HydrophobicContact CB-CE2 3.94Å; I440-Y505 HydrophobicContact CG1-CE2 3.76Å; I440-Y505 HydrophobicContact CG2-CD2 3.77Å; I440-Y505 HydrophobicContact CG2-CE2 3.74Å; I440-V509 HydrophobicContact CG2-CG1 3.72Å; I440-V513 HydrophobicContact CD1-CG1 4.46Å; I440-L528 HydrophobicContact CB-CD2 4.35Å; I440-L528 HydrophobicContact CD1-CD2 3.97Å; I440-L528 HydrophobicContact CG2-CD2 4.04Å
441	D	94	Very high	87.8	Confident	0 Å²	0	20 Å²	20	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	104.9	158.6	-173.6	-18.6	0	0	0	108.7	N388 G389 D390 L443 C444	N388-D441 VanDerWaalsContact C-OD2 3.28Å; N388-D441 VanDerWaalsContact CA-OD2 3.27Å; N388-D441 WeakPolarHBondContact CA-OD2 3.41Å; N388-D441 PolarHBondContact N-OD1 2.87Å; G389-D441 PolarHBondContact N-OD2 2.95Å; D390-D441 PolarHBondContact N-OD2 2.93Å; D441-L443 PolarHBondContact O-N 2.84Å; D441-L443 VanDerWaalsContact O-N 3.13Å; D441-L443 WeakPolarHBondContact OD1-CB 3.49Å; D441-L443 PolarHBondContact OD1-N 3.37Å; D441-C444 WeakPolarHBondContact O-CB 3.42Å; D441-C444 PolarHBondContact O-N 2.85Å
442	C	93.9	Very high	87.1	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.8	-24.1	179.3	-79.9	0	0	0	0	113	V385 T386 Y387 I440 C444 W445 V446 L504 V509	V385-C442 VanDerWaalsContact CG1-SG 3.57Å; T386-C442 PolarHBondContact O-N 3.1Å; Y387-C442 HydrophobicContact CD2-CB 3.78Å; Y387-C442 HydrophobicContact CE2-CB 4.3Å; I440-C442 PolarHBondContact O-N 3.4Å; C442-C444 VanDerWaalsContact C-N 3.26Å; C442-C444 PolarHBondContact O-N 3.37Å; C442-W445 PolarHBondContact O-N 3.38Å; C442-V446 WeakPolarHBondContact O-CG2 3.49Å; C442-V446 PolarHBondContact O-N 3.02Å; C442-L504 HydrophobicContact CB-CD2 4.19Å; C442-V509 HydrophobicContact CB-CG2 4.46Å
443	L	91.9	Very high	85.5	Confident	14 Å²	14	23 Å²	23	7%	0.073	10%	0.104	C	C	.	.	H	α-helix	trans	-66.1	-27.9	177.5	-176.9	59.2	0	0	0	112	Y387 N388 D441 V446 K447 R457	Y387-L443 HydrophobicContact CD1-CB 4.44Å; Y387-L443 HydrophobicContact CE1-CB 4.24Å; Y387-L443 HydrophobicContact CE1-CD1 3.95Å; Y387-L443 HydrophobicContact CE1-CG 4.49Å; N388-L443 HydrophobicContact CB-CD2 3.76Å; N388-L443 WeakPolarHBondContact OD1-CD2 3.44Å; D441-L443 PolarHBondContact O-N 2.84Å; D441-L443 VanDerWaalsContact O-N 3.13Å; D441-L443 WeakPolarHBondContact OD1-CB 3.49Å; D441-L443 PolarHBondContact OD1-N 3.37Å; L443-V446 HydrophobicContact CD1-CB 4.35Å; L443-V446 HydrophobicContact CD1-CG1 4.32Å; L443-V446 PolarHBondContact O-N 3.09Å; L443-K447 HydrophobicContact CD1-CD 4.46Å; L443-K447 HydrophobicContact CD1-CG 4.23Å; L443-K447 HydrophobicContact CG-CD 4Å; L443-K447 HydrophobicContact CG-CG 4.28Å; L443-K447 WeakPolarHBondContact O-CB 3.24Å; L443-K447 WeakPolarHBondContact O-CD 3.49Å; L443-K447 WeakPolarHBondContact O-CG 3.36Å; L443-K447 PolarHBondContact O-N 2.85Å; L443-R457 HydrophobicContact CD1-CB 4.44Å
444	C	89.1	Confident	83.9	Confident	22 Å²	22	27.8 Å²	27.8	15%	0.149	13%	0.134	C	C	.	.	H	α-helix	trans	-65.2	-46.2	174.8	-74.5	0	0	0	0	111.7	D441 C442 K447 R448 L528	D441-C444 WeakPolarHBondContact O-CB 3.42Å; D441-C444 PolarHBondContact O-N 2.85Å; C442-C444 VanDerWaalsContact C-N 3.26Å; C442-C444 PolarHBondContact O-N 3.37Å; C444-K447 PolarHBondContact O-N 2.85Å; C444-R448 PolarHBondContact O-N 3.07Å; C444-L528 HydrophobicContact CB-CD1 3.86Å; C444-L528 HydrophobicContact CB-CD2 4.32Å; C444-L528 HydrophobicContact CB-CG 3.8Å
445	W	91	Very high	82.3	Confident	11 Å²	11	28.8 Å²	28.8	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-63.8	-40.7	171.6	-179.8	89.8	0	0	0	111.7	C442 K447 R448 D449 S450 L504 Y508 V509 F512 L528	C442-W445 PolarHBondContact O-N 3.38Å; W445-K447 VanDerWaalsContact C-N 3.32Å; W445-K447 PolarHBondContact O-N 3.19Å; W445-R448 PolarHBondContact O-N 3.23Å; W445-D449 HydrophobicContact CD2-CB 4.44Å; W445-D449 HydrophobicContact CG-CB 4.33Å; W445-D449 PolarHBondContact O-N 3.39Å; W445-S450 PolarHBondContact O-N 3.18Å; W445-L504 HydrophobicContact CZ3-CD1 4.38Å; W445-Y508 HydrophobicContact CH2-CG 4.4Å; W445-V509 HydrophobicContact CB-CG1 3.76Å; W445-V509 HydrophobicContact CB-CG2 4.2Å; W445-V509 HydrophobicContact CD2-CG2 3.76Å; W445-V509 HydrophobicContact CE3-CG2 3.72Å; W445-V509 HydrophobicContact CG-CB 4.36Å; W445-V509 HydrophobicContact CG-CG1 3.88Å; W445-V509 HydrophobicContact CG-CG2 3.97Å; W445-V509 HydrophobicContact CZ3-CG2 4.35Å; W445-F512 AromaticContact CD1-CD1 3.5Å; W445-F512 VanDerWaalsContact CD1-CD1 3.5Å; W445-F512 AromaticContact CD1-CE1 3.99Å; W445-F512 AromaticContact NE1-CD1 3.15Å; W445-F512 AromaticContact NE1-CE1 3.74Å; W445-F512 AromaticContact NE1-CG 3.42Å; W445-L528 HydrophobicContact CB-CD1 3.98Å
446	V	86.6	Confident	81	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.4	-40.5	176.1	169.3	0	0	0	0	111.8	Y387 C442 L443 R448 S450 R457 V462 L504	Y387-V446 HydrophobicContact CE2-CG2 4.04Å; C442-V446 WeakPolarHBondContact O-CG2 3.49Å; C442-V446 PolarHBondContact O-N 3.02Å; L443-V446 HydrophobicContact CD1-CB 4.35Å; L443-V446 HydrophobicContact CD1-CG1 4.32Å; L443-V446 PolarHBondContact O-N 3.09Å; V446-R448 PolarHBondContact O-N 2.8Å; V446-S450 PolarHBondContact O-OG 2.91Å; V446-R457 HydrophobicContact CG1-CB 3.86Å; V446-R457 HydrophobicContact CG1-CG 3.76Å; V446-V462 HydrophobicContact CG1-CG2 3.89Å; V446-V462 HydrophobicContact CG2-CG1 4.06Å; V446-V462 HydrophobicContact CG2-CG2 4.11Å; V446-L504 HydrophobicContact CG2-CD2 4.38Å
447	K	82	Confident	80.5	Confident	88 Å²	88	31.3 Å²	31.3	38%	0.383	16%	0.158	S	C	.	.	H	α-helix	trans	-64.3	-36.7	178.4	-77.9	162.2	177.2	160	0	112.7	L443 C444 W445 R457	L443-K447 HydrophobicContact CD1-CD 4.46Å; L443-K447 HydrophobicContact CD1-CG 4.23Å; L443-K447 HydrophobicContact CG-CD 4Å; L443-K447 HydrophobicContact CG-CG 4.28Å; L443-K447 WeakPolarHBondContact O-CB 3.24Å; L443-K447 WeakPolarHBondContact O-CD 3.49Å; L443-K447 WeakPolarHBondContact O-CG 3.36Å; L443-K447 PolarHBondContact O-N 2.85Å; C444-K447 PolarHBondContact O-N 2.85Å; W445-K447 VanDerWaalsContact C-N 3.32Å; W445-K447 PolarHBondContact O-N 3.19Å; K447-R457 PolarHBondContact O-NH1 3.27Å; K447-R457 PolarHBondContact O-NH2 3.39Å
448	R	84.7	Confident	79.9	Confident	60 Å²	60	33.2 Å²	33.2	23%	0.226	18%	0.178	C	C	.	.	H	α-helix	trans	-98.2	-53.9	-173.7	-166.4	-177.3	67.7	-157.6	-11.1	114.6	C444 W445 V446 V527 L528 K530	C444-R448 PolarHBondContact O-N 3.07Å; W445-R448 PolarHBondContact O-N 3.23Å; V446-R448 PolarHBondContact O-N 2.8Å; R448-V527 PolarHBondContact NH1-O 2.7Å; R448-V527 PolarHBondContact NH2-O 2.93Å; R448-L528 PolarHBondContact NH1-O 3.42Å; R448-K530 PolarHBondContact NH1-O 3.28Å
449	D	81.8	Confident	79.4	Confident	9 Å²	9	34 Å²	34	5%	0.048	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-17.2	-159.5	-53.4	-54.7	0	0	0	114.6	W445 Y451 F512	W445-D449 HydrophobicContact CD2-CB 4.44Å; W445-D449 HydrophobicContact CG-CB 4.33Å; W445-D449 PolarHBondContact O-N 3.39Å; D449-Y451 WeakPolarHBondContact O-CD2 3.41Å; D449-Y451 WeakPolarHBondContact O-CE2 3.08Å; D449-Y451 PolarHBondContact O-N 2.93Å; D449-Y451 VanDerWaalsContact O-N 3.1Å; D449-F512 HydrophobicContact CB-CD1 4.42Å; D449-F512 HydrophobicContact CB-CE1 3.7Å; D449-F512 HydrophobicContact CB-CZ 3.75Å; D449-F512 VanDerWaalsContact OD2-CE1 3.27Å; D449-F512 WeakPolarHBondContact OD2-CE1 3.36Å
450	S	75.1	Confident	78.8	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.014	19%	0.188	C	C	.	.	S	Bend	trans	-65.7	-15.9	-177.1	71.7	0	0	0	0	115	W445 V446 L452 K466	W445-S450 PolarHBondContact O-N 3.18Å; V446-S450 PolarHBondContact O-OG 2.91Å; S450-L452 PolarHBondContact O-N 3.08Å; S450-L452 WeakPolarHBondContact OG-CB 3.11Å; S450-L452 PolarHBondContact OG-N 3.25Å; S450-L452 VanDerWaalsContact OG-N 3.13Å; S450-K466 WeakPolarHBondContact O-CE 3.49Å; S450-K466 PolarHBondContact O-NZ 3.41Å
451	Y	68.5	Low	77.9	Confident	153 Å²	153	37.1 Å²	37.1	60%	0.6	20%	0.203	S	C	*	.			trans	56.2	16.1	-167	-61.2	-81.6	0	0	0	115.1	D449	D449-Y451 WeakPolarHBondContact O-CD2 3.41Å; D449-Y451 WeakPolarHBondContact O-CE2 3.08Å; D449-Y451 PolarHBondContact O-N 2.93Å; D449-Y451 VanDerWaalsContact O-N 3.1Å
452	L	67.8	Low	77.2	Confident	24 Å²	24	37.1 Å²	37.1	13%	0.126	20%	0.203	C	C	.	.			trans	-79.4	138	177.1	-64.5	173.5	0	0	0	111.8	S450 A456 R457 V462 A465 K466	S450-L452 PolarHBondContact O-N 3.08Å; S450-L452 WeakPolarHBondContact OG-CB 3.11Å; S450-L452 PolarHBondContact OG-N 3.25Å; S450-L452 VanDerWaalsContact OG-N 3.13Å; L452-A456 HydrophobicContact CB-CB 4.4Å; L452-A456 WeakPolarHBondContact CD1-O 3.43Å; L452-R457 PolarHBondContact O-NE 2.9Å; L452-R457 VanDerWaalsContact O-NE 3.15Å; L452-R457 PolarHBondContact O-NH2 3.08Å; L452-V462 HydrophobicContact CD1-CB 4.27Å; L452-V462 HydrophobicContact CD1-CG1 4.07Å; L452-V462 HydrophobicContact CD1-CG2 3.79Å; L452-A465 HydrophobicContact CD1-CB 4.39Å; L452-A465 HydrophobicContact CD2-CB 3.88Å; L452-K466 HydrophobicContact CD1-CG 4.39Å
453	P	57.5	Low	76.7	Confident	47 Å²	47	37.1 Å²	37.1	31%	0.305	20%	0.203	S	C	.	.			trans	-62.4	154.6	175.8	30.3	-37.4	0	0	0	110	G455 A456 R457 K1044	P453-G455 PolarHBondContact O-N 3.22Å; P453-A456 HydrophobicContact CG-CB 3.9Å; P453-A456 PolarHBondContact O-N 3.4Å; P453-R457 WeakPolarHBondContact O-CG 3.43Å; P453-K1044 HydrophobicContact CB-CB 4.49Å; P453-K1044 HydrophobicContact CG-CB 4.01Å; P453-K1044 HydrophobicContact CG-CD 4.23Å; P453-K1044 HydrophobicContact CG-CG 4.27Å
454	V	58.2	Low	76.1	Confident	114 Å²	114	42 Å²	42	69%	0.691	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-51.5	-33.4	-172.2	-177.2	0	0	0	0	113.6	R457	V454-R457 WeakPolarHBondContact O-CG 3.39Å
455	G	55.2	Low	75.3	Confident	23 Å²	23	43.5 Å²	43.5	24%	0.237	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-74.2	-27.4	177.4	0	0	0	0	0	116	P453 R457 N1046	P453-G455 PolarHBondContact O-N 3.22Å; G455-R457 PolarHBondContact O-N 2.92Å; G455-N1046 WeakPolarHBondContact CA-OD1 3.46Å
456	A	62.3	Low	74.8	Confident	21 Å²	21	45.1 Å²	45.1	17%	0.174	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-91.8	42.1	177.7	0	0	0	0	0	111.6	L452 P453 A461 V462	L452-A456 HydrophobicContact CB-CB 4.4Å; L452-A456 WeakPolarHBondContact CD1-O 3.43Å; P453-A456 HydrophobicContact CG-CB 3.9Å; P453-A456 PolarHBondContact O-N 3.4Å; A456-A461 HydrophobicContact CB-CB 4.4Å; A456-V462 WeakPolarHBondContact O-CG2 3.37Å
457	R	77.7	Confident	74.6	Confident	69 Å²	69	45.3 Å²	45.3	26%	0.26	25%	0.246	S	C	.	.			trans	-122.6	15.1	-177.8	-57.6	-175.2	178	-168.1	-15.6	113.8	Y387 L443 V446 K447 L452 P453 V454 G455	Y387-R457 PolarHBondContact OH-O 3.48Å; L443-R457 HydrophobicContact CD1-CB 4.44Å; V446-R457 HydrophobicContact CG1-CB 3.86Å; V446-R457 HydrophobicContact CG1-CG 3.76Å; K447-R457 PolarHBondContact O-NH1 3.27Å; K447-R457 PolarHBondContact O-NH2 3.39Å; L452-R457 PolarHBondContact O-NE 2.9Å; L452-R457 VanDerWaalsContact O-NE 3.15Å; L452-R457 PolarHBondContact O-NH2 3.08Å; P453-R457 WeakPolarHBondContact O-CG 3.43Å; V454-R457 WeakPolarHBondContact O-CG 3.39Å; G455-R457 PolarHBondContact O-N 2.92Å
458	G	78.9	Confident	74.5	Confident	40 Å²	40	50.1 Å²	50.1	41%	0.412	26%	0.262	S	S	.	.	S	Bend	trans	-86.4	148	159	0	0	0	0	0	109.5	K460 A461 V462	G458-K460 VanDerWaalsContact C-N 3.33Å; G458-K460 PolarHBondContact O-N 3.02Å; G458-A461 PolarHBondContact O-N 3.23Å; G458-V462 WeakPolarHBondContact O-CG2 3.2Å; G458-V462 PolarHBondContact O-N 3.37Å
459	L	83.5	Confident	74.2	Confident	16 Å²	16	48 Å²	48	8%	0.084	25%	0.254	C	S	.	.	H	α-helix	trans	-51.4	-48	-173.4	177.9	54	0	0	0	112.6	Y387 A461 V462 A463 D497 A500 T501 L504	Y387-L459 HydrophobicContact CD1-CB 3.87Å; Y387-L459 HydrophobicContact CD2-CB 4.3Å; Y387-L459 HydrophobicContact CD2-CD1 3.72Å; Y387-L459 HydrophobicContact CD2-CG 4.45Å; Y387-L459 HydrophobicContact CE1-CB 3.98Å; Y387-L459 HydrophobicContact CE2-CB 4.38Å; Y387-L459 HydrophobicContact CE2-CD1 4.01Å; Y387-L459 HydrophobicContact CG-CB 4.04Å; Y387-L459 HydrophobicContact CG-CD1 4.12Å; Y387-L459 HydrophobicContact CG-CD2 4.31Å; Y387-L459 HydrophobicContact CG-CG 4.39Å; L459-A461 VanDerWaalsContact C-N 3.35Å; L459-A461 PolarHBondContact O-N 3.02Å; L459-V462 PolarHBondContact O-N 2.79Å; L459-V462 VanDerWaalsContact O-N 3.07Å; L459-A463 PolarHBondContact O-N 3.07Å; L459-D497 HydrophobicContact CD2-CB 3.59Å; L459-D497 WeakPolarHBondContact CD2-OD1 3.31Å; L459-A500 HydrophobicContact CD1-CB 3.84Å; L459-A500 HydrophobicContact CD2-CB 4.25Å; L459-A500 HydrophobicContact CG-CB 4Å; L459-T501 VanDerWaalsContact CD2-OG1 3.25Å; L459-T501 WeakPolarHBondContact CD2-OG1 3.25Å; L459-L504 HydrophobicContact CD1-CD2 4.29Å
460	K	81.3	Confident	73.9	Confident	28 Å²	28	52.6 Å²	52.6	12%	0.122	28%	0.279	C	S	.	.	H	α-helix	trans	-52.3	-48.7	176.4	-46.9	-66.3	179.1	-174.6	0	112.6	G458 V462 A463 K464 P471 I472 E473 D497	G458-K460 VanDerWaalsContact C-N 3.33Å; G458-K460 PolarHBondContact O-N 3.02Å; K460-V462 PolarHBondContact O-N 3.34Å; K460-A463 PolarHBondContact O-N 3.39Å; K460-K464 PolarHBondContact O-N 3.32Å; K460-P471 HydrophobicContact CB-CG 3.96Å; K460-P471 HydrophobicContact CD-CB 4.01Å; K460-P471 HydrophobicContact CD-CG 3.62Å; K460-P471 HydrophobicContact CG-CG 4.37Å; K460-I472 VanDerWaalsContact CE-O 3.29Å; K460-I472 WeakPolarHBondContact CE-O 3.17Å; K460-I472 PolarHBondContact NZ-O 2.96Å; K460-E473 HydrophobicContact CG-CG 4.44Å; K460-D497 VanDerWaalsContact CE-OD1 3.29Å; K460-D497 WeakPolarHBondContact CE-OD1 3.37Å; K460-D497 WeakPolarHBondContact CE-OD2 3.46Å; K460-D497 IonicContact NZ-OD1 3.17Å; K460-D497 PolarHBondContact NZ-OD1 2.7Å; K460-D497 IonicContact NZ-OD2 3.88Å; K460-D497 PolarHBondContact NZ-OD2 3.13Å
461	A	73.9	Confident	74	Confident	38 Å²	38	53 Å²	53	31%	0.314	28%	0.281	S	S	.	.	H	α-helix	trans	-69.4	-32.2	179.1	0	0	0	0	0	113.1	A456 G458 L459 A465	A456-A461 HydrophobicContact CB-CB 4.4Å; G458-A461 PolarHBondContact O-N 3.23Å; L459-A461 VanDerWaalsContact C-N 3.35Å; L459-A461 PolarHBondContact O-N 3.02Å; A461-A465 VanDerWaalsContact O-CB 3.25Å; A461-A465 WeakPolarHBondContact O-CB 3.29Å; A461-A465 PolarHBondContact O-N 2.88Å
462	V	81.3	Confident	74.4	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-71	-42.5	173.4	-179.3	0	0	0	0	110.9	Y387 V446 L452 A456 G458 L459 K460 A465 K466 L504	Y387-V462 VanDerWaalsContact OH-CG2 3.28Å; Y387-V462 WeakPolarHBondContact OH-CG2 3.25Å; V446-V462 HydrophobicContact CG1-CG2 3.89Å; V446-V462 HydrophobicContact CG2-CG1 4.06Å; V446-V462 HydrophobicContact CG2-CG2 4.11Å; L452-V462 HydrophobicContact CD1-CB 4.27Å; L452-V462 HydrophobicContact CD1-CG1 4.07Å; L452-V462 HydrophobicContact CD1-CG2 3.79Å; A456-V462 WeakPolarHBondContact O-CG2 3.37Å; G458-V462 WeakPolarHBondContact O-CG2 3.2Å; G458-V462 PolarHBondContact O-N 3.37Å; L459-V462 PolarHBondContact O-N 2.79Å; L459-V462 VanDerWaalsContact O-N 3.07Å; K460-V462 PolarHBondContact O-N 3.34Å; V462-A465 PolarHBondContact O-N 3.37Å; V462-K466 HydrophobicContact CG1-CG 3.98Å; V462-K466 VanDerWaalsContact O-CB 3.26Å; V462-K466 WeakPolarHBondContact O-CB 3.47Å; V462-K466 WeakPolarHBondContact O-CG 3Å; V462-K466 PolarHBondContact O-N 3.27Å; V462-L504 HydrophobicContact CB-CD2 4.49Å; V462-L504 HydrophobicContact CG1-CD1 3.65Å; V462-L504 HydrophobicContact CG1-CD2 3.68Å; V462-L504 HydrophobicContact CG1-CG 4.33Å
463	A	83.1	Confident	74.6	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.008	30%	0.297	C	S	.	.	I	π-helix	trans	-58.2	-49.1	173.7	0	0	0	0	0	110.8	L459 K460 A465 K466 L467 R468 P471 A500	L459-A463 PolarHBondContact O-N 3.07Å; K460-A463 PolarHBondContact O-N 3.39Å; A463-A465 VanDerWaalsContact C-N 3.33Å; A463-A465 PolarHBondContact O-N 2.95Å; A463-K466 PolarHBondContact O-N 2.94Å; A463-L467 HydrophobicContact CB-CD1 4.18Å; A463-L467 CarbonylContact O-C 3.22Å; A463-L467 VanDerWaalsContact O-CA 3.27Å; A463-L467 WeakPolarHBondContact O-CA 3.4Å; A463-L467 WeakPolarHBondContact O-CB 3.36Å; A463-L467 PolarHBondContact O-N 2.96Å; A463-R468 PolarHBondContact O-N 3.39Å; A463-P471 HydrophobicContact CB-CG 3.96Å; A463-A500 HydrophobicContact CB-CB 4.24Å
464	K	78	Confident	75.3	Confident	115 Å²	115	53.9 Å²	53.9	50%	0.5	29%	0.289	S	S	.	.	I	π-helix	trans	-56.5	-43.4	174.5	-162.5	177	-159.8	138.9	0	112.9	K460 Y469 D470	K460-K464 PolarHBondContact O-N 3.32Å; K464-Y469 VanDerWaalsContact CA-O 3.29Å; K464-Y469 WeakPolarHBondContact CA-O 3.46Å; K464-Y469 PolarHBondContact N-O 2.95Å; K464-D470 WeakPolarHBondContact CD-OD1 3.45Å; K464-D470 WeakPolarHBondContact CE-OD1 3.03Å; K464-D470 VanDerWaalsContact CE-OD2 3.24Å; K464-D470 WeakPolarHBondContact CE-OD2 3.49Å; K464-D470 IonicContact NZ-OD1 3.06Å; K464-D470 PolarHBondContact NZ-OD1 3.04Å; K464-D470 IonicContact NZ-OD2 3.31Å; K464-D470 PolarHBondContact NZ-OD2 2.62Å
465	A	73.4	Confident	76	Confident	54 Å²	54	51.5 Å²	51.5	45%	0.446	27%	0.272	S	S	.	.	I	π-helix	trans	-81.6	-22.2	-176.8	0	0	0	0	0	115.4	L452 A461 V462 A463	L452-A465 HydrophobicContact CD1-CB 4.39Å; L452-A465 HydrophobicContact CD2-CB 3.88Å; A461-A465 VanDerWaalsContact O-CB 3.25Å; A461-A465 WeakPolarHBondContact O-CB 3.29Å; A461-A465 PolarHBondContact O-N 2.88Å; V462-A465 PolarHBondContact O-N 3.37Å; A463-A465 VanDerWaalsContact C-N 3.33Å; A463-A465 PolarHBondContact O-N 2.95Å
466	K	80.2	Confident	76.8	Confident	46 Å²	46	53.3 Å²	53.3	20%	0.2	28%	0.28	C	S	.	.	I	π-helix	trans	-117.8	-51.3	-174.9	-60.9	-66.6	-174.7	175.8	0	112.5	S450 L452 V462 A463 L504 Y508	S450-K466 WeakPolarHBondContact O-CE 3.49Å; S450-K466 PolarHBondContact O-NZ 3.41Å; L452-K466 HydrophobicContact CD1-CG 4.39Å; V462-K466 HydrophobicContact CG1-CG 3.98Å; V462-K466 VanDerWaalsContact O-CB 3.26Å; V462-K466 WeakPolarHBondContact O-CB 3.47Å; V462-K466 WeakPolarHBondContact O-CG 3Å; V462-K466 PolarHBondContact O-N 3.27Å; A463-K466 PolarHBondContact O-N 2.94Å; K466-L504 HydrophobicContact CB-CD1 4.45Å; K466-Y508 HydrophobicContact CB-CD2 4.04Å; K466-Y508 HydrophobicContact CB-CE2 3.73Å; K466-Y508 PolarHBondContact O-OH 3.01Å
467	L	83.3	Confident	77.5	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.021	28%	0.284	C	S	.	.	I	π-helix	trans	-82.8	-15.2	178.9	-54.6	178.5	0	0	0	113.3	F353 A463 Y469 A500 L504 K507 Y508	F353-L467 HydrophobicContact CE1-CD2 4.46Å; F353-L467 HydrophobicContact CE2-CB 3.91Å; F353-L467 HydrophobicContact CE2-CD2 4.47Å; F353-L467 WeakPolarHBondContact CE2-O 3.29Å; F353-L467 HydrophobicContact CZ-CB 4.12Å; F353-L467 HydrophobicContact CZ-CD2 3.89Å; A463-L467 HydrophobicContact CB-CD1 4.18Å; A463-L467 CarbonylContact O-C 3.22Å; A463-L467 VanDerWaalsContact O-CA 3.27Å; A463-L467 WeakPolarHBondContact O-CA 3.4Å; A463-L467 WeakPolarHBondContact O-CB 3.36Å; A463-L467 PolarHBondContact O-N 2.96Å; L467-Y469 HydrophobicContact CB-CD1 3.76Å; L467-Y469 HydrophobicContact CB-CE1 3.6Å; L467-Y469 HydrophobicContact CD1-CE1 3.81Å; L467-Y469 HydrophobicContact CG-CE1 4.36Å; L467-Y469 PolarHBondContact O-N 3.29Å; L467-A500 WeakPolarHBondContact CD1-O 3.34Å; L467-L504 HydrophobicContact CD1-CB 4.4Å; L467-K507 HydrophobicContact CD2-CB 4.45Å; L467-K507 HydrophobicContact CD2-CD 4.29Å; L467-Y508 HydrophobicContact CD2-CD2 4.45Å; L467-Y508 HydrophobicContact CD2-CE2 4.19Å
468	R	78	Confident	77.5	Confident	188 Å²	188	55 Å²	55	71%	0.709	29%	0.289	S	S	*	.			trans	63.6	32.6	173.2	-50.5	-177.9	179.6	-166.1	-1.1	114.9	R350 A463	R350-R468 PolarHBondContact NE-O 3.2Å; R350-R468 VanDerWaalsContact NE-O 3.16Å; R350-R468 PolarHBondContact NH2-O 2.87Å; A463-R468 PolarHBondContact O-N 3.39Å
469	Y	79.4	Confident	77.7	Confident	15 Å²	15	53.5 Å²	53.5	6%	0.059	27%	0.271	C	S	.	.	S	Bend	trans	-129.4	158.3	164.2	69.8	-87.5	0	0	0	109.6	P349 F353 K464 L467 P471 A500	P349-Y469 HydrophobicContact CB-CD2 3.72Å; P349-Y469 HydrophobicContact CB-CE2 3.79Å; P349-Y469 HydrophobicContact CB-CG 4.26Å; P349-Y469 HydrophobicContact CG-CD2 4.17Å; P349-Y469 HydrophobicContact CG-CE1 4.39Å; P349-Y469 HydrophobicContact CG-CE2 3.79Å; F353-Y469 AromaticContact CD2-CD1 3.85Å; F353-Y469 HydrophobicContact CD2-CD1 3.85Å; F353-Y469 AromaticContact CD2-CE1 3.71Å; F353-Y469 HydrophobicContact CD2-CE1 3.71Å; F353-Y469 AromaticContact CE2-CD1 3.83Å; F353-Y469 HydrophobicContact CE2-CD1 3.83Å; F353-Y469 AromaticContact CE2-CE1 3.86Å; F353-Y469 HydrophobicContact CE2-CE1 3.86Å; K464-Y469 VanDerWaalsContact CA-O 3.29Å; K464-Y469 WeakPolarHBondContact CA-O 3.46Å; K464-Y469 PolarHBondContact N-O 2.95Å; L467-Y469 HydrophobicContact CB-CD1 3.76Å; L467-Y469 HydrophobicContact CB-CE1 3.6Å; L467-Y469 HydrophobicContact CD1-CE1 3.81Å; L467-Y469 HydrophobicContact CG-CE1 4.36Å; L467-Y469 PolarHBondContact O-N 3.29Å; Y469-P471 HydrophobicContact CD2-CB 4.42Å; Y469-P471 HydrophobicContact CE2-CB 3.84Å; Y469-P471 HydrophobicContact CE2-CG 4.45Å; Y469-P471 VanDerWaalsContact O-CD 3.3Å; Y469-P471 WeakPolarHBondContact O-CD 3.31Å; Y469-A500 WeakPolarHBondContact OH-CA 3.35Å
470	D	74.9	Confident	77.7	Confident	107 Å²	107	55.2 Å²	55.2	57%	0.572	28%	0.284	S	S	*	.			trans	-87.5	111.7	166.4	-96.1	-38.7	0	0	0	108.6	K464	K464-D470 WeakPolarHBondContact CD-OD1 3.45Å; K464-D470 WeakPolarHBondContact CE-OD1 3.03Å; K464-D470 VanDerWaalsContact CE-OD2 3.24Å; K464-D470 WeakPolarHBondContact CE-OD2 3.49Å; K464-D470 IonicContact NZ-OD1 3.06Å; K464-D470 PolarHBondContact NZ-OD1 3.04Å; K464-D470 IonicContact NZ-OD2 3.31Å; K464-D470 PolarHBondContact NZ-OD2 2.62Å
471	P	78.7	Confident	77.7	Confident	10 Å²	10	60.7 Å²	60.7	7%	0.065	30%	0.304	C	S	.	.			trans	-68.7	155.8	166.6	27	-31.7	0	0	0	110.8	K460 A463 Y469 E473 S496	K460-P471 HydrophobicContact CB-CG 3.96Å; K460-P471 HydrophobicContact CD-CB 4.01Å; K460-P471 HydrophobicContact CD-CG 3.62Å; K460-P471 HydrophobicContact CG-CG 4.37Å; A463-P471 HydrophobicContact CB-CG 3.96Å; Y469-P471 HydrophobicContact CD2-CB 4.42Å; Y469-P471 HydrophobicContact CE2-CB 3.84Å; Y469-P471 HydrophobicContact CE2-CG 4.45Å; Y469-P471 VanDerWaalsContact O-CD 3.3Å; Y469-P471 WeakPolarHBondContact O-CD 3.31Å; P471-E473 PolarHBondContact O-N 3.48Å; P471-S496 VanDerWaalsContact CB-OG 3.22Å; P471-S496 WeakPolarHBondContact CB-OG 3.36Å
472	I	75.5	Confident	78.2	Confident	64 Å²	64	60.1 Å²	60.1	33%	0.328	30%	0.295	S	S	.	.			trans	-59.9	134.4	174	-60.7	173.4	0	0	0	109.2	Y347 K460 V474 N492 Y493	Y347-I472 HydrophobicContact CE2-CD1 3.67Å; Y347-I472 HydrophobicContact CE2-CG1 4.26Å; K460-I472 VanDerWaalsContact CE-O 3.29Å; K460-I472 WeakPolarHBondContact CE-O 3.17Å; K460-I472 PolarHBondContact NZ-O 2.96Å; I472-V474 HydrophobicContact CG2-CG2 4.33Å; I472-N492 HydrophobicContact CD1-CB 4.09Å; I472-Y493 HydrophobicContact CG2-CD2 4.26Å
473	E	73.5	Confident	78.5	Confident	157 Å²	157	60.1 Å²	60.1	73%	0.734	30%	0.295	S	S	*	.			trans	-124.4	125.8	176.7	-172.6	167.3	-152.8	0	0	108.7	K460 P471	K460-E473 HydrophobicContact CG-CG 4.44Å; P471-E473 PolarHBondContact O-N 3.48Å
474	V	72.3	Confident	78.5	Confident	21 Å²	21	66.3 Å²	66.3	13%	0.127	32%	0.324	C	S	.	.			trans	-117.4	141.6	179.2	169.5	0	0	0	0	107.9	I472 P476 L478 M479 M482 Y493	I472-V474 HydrophobicContact CG2-CG2 4.33Å; V474-P476 WeakPolarHBondContact O-CD 3.46Å; V474-L478 HydrophobicContact CG1-CB 4.32Å; V474-M479 HydrophobicContact CG1-CG 4Å; V474-M482 HydrophobicContact CG1-SD 3.6Å; V474-M482 VanDerWaalsContact CG1-SD 3.6Å; V474-M482 HydrophobicContact CG2-CE 4.3Å; V474-M482 HydrophobicContact CG2-SD 4.35Å; V474-Y493 HydrophobicContact CB-CD1 4.07Å; V474-Y493 HydrophobicContact CB-CD2 3.74Å; V474-Y493 HydrophobicContact CB-CE1 4.29Å; V474-Y493 HydrophobicContact CB-CE2 3.99Å; V474-Y493 HydrophobicContact CB-CG 3.82Å; V474-Y493 HydrophobicContact CG2-CD1 4.09Å; V474-Y493 HydrophobicContact CG2-CD2 3.64Å; V474-Y493 HydrophobicContact CG2-CE2 4.39Å; V474-Y493 HydrophobicContact CG2-CG 3.49Å; V474-Y493 VanDerWaalsContact CG2-CG 3.49Å
475	D	70.8	Confident	79	Confident	64 Å²	64	67.4 Å²	67.4	34%	0.342	33%	0.331	S	S	.	.			trans	-68.9	125.6	173.4	-170.3	-48.2	0	0	0	109.3	E477 L478	D475-E477 PolarHBondContact O-N 3.1Å; D475-E477 PolarHBondContact OD1-N 2.97Å; D475-L478 HydrophobicContact CB-CD1 4.09Å; D475-L478 HydrophobicContact CB-CG 4.18Å; D475-L478 WeakPolarHBondContact O-CB 3.45Å; D475-L478 PolarHBondContact O-N 3.37Å
476	P	73.5	Confident	79.7	Confident	61 Å²	61	66.2 Å²	66.2	40%	0.396	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-23.6	-179.9	-30.4	37.7	0	0	0	115.4	K305 V474 L478 M479	K305-P476 VanDerWaalsContact CE-O 3.31Å; K305-P476 WeakPolarHBondContact CE-O 3.32Å; V474-P476 WeakPolarHBondContact O-CD 3.46Å; P476-L478 VanDerWaalsContact C-N 3.31Å; P476-M479 HydrophobicContact CB-CE 4.19Å
477	E	76.5	Confident	80.1	Confident	55 Å²	55	64.2 Å²	64.2	26%	0.257	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-21.2	174.5	-55.3	-51.6	146.5	0	0	113.5	K305 P307 L308 D475	K305-E477 WeakPolarHBondContact CE-OE1 3.31Å; K305-E477 WeakPolarHBondContact CE-OE2 3.38Å; K305-E477 IonicContact NZ-OE1 3.53Å; K305-E477 PolarHBondContact NZ-OE1 3.33Å; K305-E477 IonicContact NZ-OE2 2.71Å; P307-E477 WeakPolarHBondContact CA-OE2 3.28Å; L308-E477 VanDerWaalsContact CA-OE1 3.28Å; L308-E477 WeakPolarHBondContact CA-OE1 3.32Å; L308-E477 HydrophobicContact CD2-CG 4.15Å; L308-E477 PolarHBondContact N-OE1 3.07Å; L308-E477 PolarHBondContact N-OE2 3.1Å; D475-E477 PolarHBondContact O-N 3.1Å; D475-E477 PolarHBondContact OD1-N 2.97Å
478	L	77.9	Confident	80.3	Confident	72 Å²	72	69.2 Å²	69.2	38%	0.377	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-21.7	178.8	-64.6	176.2	0	0	0	112.8	V474 D475 P476 C480 R481 M482	V474-L478 HydrophobicContact CG1-CB 4.32Å; D475-L478 HydrophobicContact CB-CD1 4.09Å; D475-L478 HydrophobicContact CB-CG 4.18Å; D475-L478 WeakPolarHBondContact O-CB 3.45Å; D475-L478 PolarHBondContact O-N 3.37Å; P476-L478 VanDerWaalsContact C-N 3.31Å; L478-C480 PolarHBondContact O-N 3.34Å; L478-R481 CarbonylContact O-C 3.19Å; L478-R481 WeakPolarHBondContact O-CA 3.24Å; L478-R481 WeakPolarHBondContact O-CB 3.44Å; L478-R481 PolarHBondContact O-N 3.15Å; L478-M482 HydrophobicContact CB-CG 4.33Å; L478-M482 HydrophobicContact CB-SD 4.06Å; L478-M482 WeakPolarHBondContact O-CG 3.44Å; L478-M482 PolarHBondContact O-N 3Å
479	M	82.7	Confident	80.7	Confident	8 Å²	8	65.9 Å²	65.9	4%	0.039	32%	0.322	C	S	.	.	H	α-helix	trans	-58.6	-47.6	-167.6	-58.4	-171.5	-43.5	0	0	113.3	E302 V474 P476 R481 M482 A483 L490 Y493	E302-M479 WeakPolarHBondContact OE2-CE 3.47Å; V474-M479 HydrophobicContact CG1-CG 4Å; P476-M479 HydrophobicContact CB-CE 4.19Å; M479-R481 PolarHBondContact O-N 2.82Å; M479-M482 PolarHBondContact O-N 2.91Å; M479-A483 WeakPolarHBondContact O-CB 3.4Å; M479-A483 PolarHBondContact O-N 3.21Å; M479-L490 HydrophobicContact CB-CD1 3.89Å; M479-L490 HydrophobicContact CG-CD1 4Å; M479-Y493 HydrophobicContact SD-CE1 3.84Å
480	C	83.8	Confident	81.1	Confident	52 Å²	52	65.2 Å²	65.2	35%	0.351	32%	0.32	S	S	.	.	H	α-helix	trans	-67.3	-22.2	177.2	-59.6	0	0	0	0	113.4	L478	L478-C480 PolarHBondContact O-N 3.34Å
481	R	81.5	Confident	81.9	Confident	143 Å²	143	60.1 Å²	60.1	54%	0.54	29%	0.292	S	S	.	.	H	α-helix	trans	-80.9	-46.5	172.8	-170.1	-174.7	-56.8	178.2	3.1	111	L478 M479 A483 H484 E485	L478-R481 CarbonylContact O-C 3.19Å; L478-R481 WeakPolarHBondContact O-CA 3.24Å; L478-R481 WeakPolarHBondContact O-CB 3.44Å; L478-R481 PolarHBondContact O-N 3.15Å; M479-R481 PolarHBondContact O-N 2.82Å; R481-A483 PolarHBondContact O-N 3.43Å; R481-H484 WeakPolarHBondContact O-CA 3.34Å; R481-H484 PolarHBondContact O-N 3.25Å; R481-E485 WeakPolarHBondContact CD-OE1 3.43Å; R481-E485 VanDerWaalsContact CD-OE2 3.26Å; R481-E485 WeakPolarHBondContact CD-OE2 3.15Å; R481-E485 HydrophobicContact CG-CG 4.08Å; R481-E485 VanDerWaalsContact CG-OE1 3.27Å; R481-E485 WeakPolarHBondContact CG-OE1 3.39Å; R481-E485 WeakPolarHBondContact CG-OE2 3.37Å; R481-E485 PolarHBondContact O-N 2.97Å
482	M	83.8	Confident	82.3	Confident	25 Å²	25	62.1 Å²	62.1	12%	0.123	30%	0.302	C	S	.	.	H	α-helix	trans	-60.7	-33.2	176.1	-67.9	176.6	69.6	0	0	111.7	V474 L478 M479 H484 E485 S486 P487 E489 L490	V474-M482 HydrophobicContact CG1-SD 3.6Å; V474-M482 VanDerWaalsContact CG1-SD 3.6Å; V474-M482 HydrophobicContact CG2-CE 4.3Å; V474-M482 HydrophobicContact CG2-SD 4.35Å; L478-M482 HydrophobicContact CB-CG 4.33Å; L478-M482 HydrophobicContact CB-SD 4.06Å; L478-M482 WeakPolarHBondContact O-CG 3.44Å; L478-M482 PolarHBondContact O-N 3Å; M479-M482 PolarHBondContact O-N 2.91Å; M482-H484 PolarHBondContact O-N 3.45Å; M482-H484 VanDerWaalsContact O-N 3.16Å; M482-E485 PolarHBondContact O-N 2.98Å; M482-S486 CarbonylContact O-C 3.6Å; M482-S486 WeakPolarHBondContact O-CA 3.43Å; M482-S486 PolarHBondContact O-N 2.97Å; M482-P487 WeakPolarHBondContact O-CA 3.44Å; M482-P487 WeakPolarHBondContact O-CD 3.24Å; M482-E489 HydrophobicContact CE-CB 3.56Å; M482-L490 HydrophobicContact CB-CB 4.13Å; M482-L490 HydrophobicContact CB-CD1 4.27Å
483	A	86.9	Confident	82.9	Confident	1 Å²	1	60 Å²	60	1%	0.008	29%	0.29	C	S	.	.	H	α-helix	trans	-56	-29.8	171.5	0	0	0	0	0	113.2	I319 I337 L338 S339 M479 R481 L490	I319-A483 HydrophobicContact CG2-CB 4.4Å; I337-A483 HydrophobicContact CG2-CB 4.25Å; L338-A483 CarbonylContact C-O 3.45Å; L338-A483 WeakPolarHBondContact CA-O 3.38Å; L338-A483 HydrophobicContact CD2-CB 3.96Å; S339-A483 PolarHBondContact N-O 3.28Å; M479-A483 WeakPolarHBondContact O-CB 3.4Å; M479-A483 PolarHBondContact O-N 3.21Å; R481-A483 PolarHBondContact O-N 3.43Å; A483-L490 HydrophobicContact CB-CD2 3.86Å
484	H	84.1	Confident	83.7	Confident	130 Å²	130	52.5 Å²	52.5	60%	0.602	26%	0.255	S	S	*	.	H	α-helix	trans	-95.8	-43.2	177.2	-164.3	76.6	0	0	0	113.2	S339 R481 M482	S339-H484 VanDerWaalsContact CB-O 3.27Å; S339-H484 WeakPolarHBondContact CB-O 3.42Å; S339-H484 PolarHBondContact OG-O 3.2Å; R481-H484 WeakPolarHBondContact O-CA 3.34Å; R481-H484 PolarHBondContact O-N 3.25Å; M482-H484 PolarHBondContact O-N 3.45Å; M482-H484 VanDerWaalsContact O-N 3.16Å
485	E	89.1	Confident	84.6	Confident	138 Å²	138	51.5 Å²	51.5	65%	0.645	25%	0.249	S	C	*	.	H	α-helix	trans	-92.5	-34.9	-171	-68.3	176.3	-169	0	0	114.3	R481 M482	R481-E485 WeakPolarHBondContact CD-OE1 3.43Å; R481-E485 VanDerWaalsContact CD-OE2 3.26Å; R481-E485 WeakPolarHBondContact CD-OE2 3.15Å; R481-E485 HydrophobicContact CG-CG 4.08Å; R481-E485 VanDerWaalsContact CG-OE1 3.27Å; R481-E485 WeakPolarHBondContact CG-OE1 3.39Å; R481-E485 WeakPolarHBondContact CG-OE2 3.37Å; R481-E485 PolarHBondContact O-N 2.97Å; M482-E485 PolarHBondContact O-N 2.98Å
486	S	87.5	Confident	85.5	Confident	29 Å²	29	48.5 Å²	48.5	20%	0.203	23%	0.233	C	C	.	.			trans	-147.6	57.4	-177.8	65.3	0	0	0	0	113.6	M482 R488 E489 L490	M482-S486 CarbonylContact O-C 3.6Å; M482-S486 WeakPolarHBondContact O-CA 3.43Å; M482-S486 PolarHBondContact O-N 2.97Å; S486-R488 PolarHBondContact O-N 2.87Å; S486-E489 WeakPolarHBondContact CB-OE2 3.44Å; S486-E489 WeakPolarHBondContact O-CB 3.32Å; S486-E489 PolarHBondContact O-N 3.36Å; S486-E489 PolarHBondContact OG-OE2 3.3Å; S486-L490 PolarHBondContact O-N 3.08Å
487	P	89.1	Confident	86.3	Confident	5 Å²	5	46 Å²	46	3%	0.032	22%	0.217	C	C	.	.	H	α-helix	trans	-59.4	-28.2	-170.6	21.5	-34	0	0	0	114.5	L338 E340 I342 M482 E489 L490 A491	L338-P487 HydrophobicContact CD2-CB 3.82Å; E340-P487 HydrophobicContact CG-CG 3.54Å; I342-P487 HydrophobicContact CD1-CB 4.05Å; I342-P487 HydrophobicContact CG1-CB 4.47Å; M482-P487 WeakPolarHBondContact O-CA 3.44Å; M482-P487 WeakPolarHBondContact O-CD 3.24Å; P487-E489 VanDerWaalsContact C-N 3.31Å; P487-E489 PolarHBondContact O-N 2.88Å; P487-L490 PolarHBondContact O-N 3.26Å; P487-A491 PolarHBondContact O-N 3.31Å
488	R	87	Confident	86.9	Confident	109 Å²	109	43.4 Å²	43.4	41%	0.411	21%	0.205	S	C	.	.	H	α-helix	trans	-62.6	-33.8	173.7	-57.2	-174.2	-166.9	-125.9	-9.3	113	E340 E343 S486 N492	E340-R488 IonicContact OE1-CZ 2.68Å; E340-R488 VanDerWaalsContact OE1-CZ 3.29Å; E340-R488 IonicContact OE1-NE 3.96Å; E340-R488 PolarHBondContact OE1-NE 3.13Å; E340-R488 IonicContact OE1-NH2 3.46Å; E340-R488 PolarHBondContact OE1-NH2 3Å; E340-R488 IonicContact OE2-NH2 3.16Å; E343-R488 IonicContact OE2-CZ 3.67Å; E343-R488 IonicContact OE2-NH1 2.71Å; E343-R488 PolarHBondContact OE2-NH1 2.89Å; S486-R488 PolarHBondContact O-N 2.87Å; R488-N492 PolarHBondContact O-N 3.4Å; R488-N492 PolarHBondContact O-ND2 2.87Å
489	E	85.9	Confident	87.6	Confident	118 Å²	118	40 Å²	40	55%	0.551	19%	0.187	S	C	*	.	H	α-helix	trans	-74	-40.5	176.9	-61.1	-179.3	148.2	0	0	110.7	M482 S486 P487 A491 N492 Y493	M482-E489 HydrophobicContact CE-CB 3.56Å; S486-E489 WeakPolarHBondContact CB-OE2 3.44Å; S486-E489 WeakPolarHBondContact O-CB 3.32Å; S486-E489 PolarHBondContact O-N 3.36Å; S486-E489 PolarHBondContact OG-OE2 3.3Å; P487-E489 VanDerWaalsContact C-N 3.31Å; P487-E489 PolarHBondContact O-N 2.88Å; E489-A491 VanDerWaalsContact C-N 3.34Å; E489-A491 PolarHBondContact O-N 3.47Å; E489-N492 PolarHBondContact O-N 2.92Å; E489-Y493 PolarHBondContact O-N 2.87Å
490	L	89.2	Confident	88.1	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-63.1	-40	175.4	-168.7	69.5	0	0	0	111.7	M320 M479 M482 A483 S486 P487 Y493 S494	M320-L490 HydrophobicContact CE-CB 4.4Å; M320-L490 HydrophobicContact CE-CD2 3.94Å; M320-L490 HydrophobicContact CE-CG 3.71Å; M479-L490 HydrophobicContact CB-CD1 3.89Å; M479-L490 HydrophobicContact CG-CD1 4Å; M482-L490 HydrophobicContact CB-CB 4.13Å; M482-L490 HydrophobicContact CB-CD1 4.27Å; A483-L490 HydrophobicContact CB-CD2 3.86Å; S486-L490 PolarHBondContact O-N 3.08Å; P487-L490 PolarHBondContact O-N 3.26Å; L490-Y493 HydrophobicContact CD1-CD1 4.04Å; L490-Y493 PolarHBondContact O-N 3.45Å; L490-S494 PolarHBondContact O-N 3.07Å
491	A	89.8	Confident	88.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.8	-46.5	173.9	0	0	0	0	0	112.3	M320 L331 I342 F345 P487 E489 Y493 S494 V495	M320-A491 HydrophobicContact SD-CB 4.34Å; L331-A491 HydrophobicContact CD2-CB 3.62Å; I342-A491 HydrophobicContact CD1-CB 3.76Å; I342-A491 HydrophobicContact CG2-CB 4.24Å; F345-A491 HydrophobicContact CE1-CB 4.21Å; F345-A491 HydrophobicContact CZ-CB 4.09Å; P487-A491 PolarHBondContact O-N 3.31Å; E489-A491 VanDerWaalsContact C-N 3.34Å; E489-A491 PolarHBondContact O-N 3.47Å; A491-Y493 VanDerWaalsContact C-N 3.28Å; A491-Y493 PolarHBondContact O-N 2.88Å; A491-S494 PolarHBondContact O-N 2.83Å; A491-V495 WeakPolarHBondContact O-CG1 3.36Å; A491-V495 WeakPolarHBondContact O-CG2 3.02Å; A491-V495 PolarHBondContact O-N 2.88Å
492	N	87.7	Confident	89.2	Confident	52 Å²	52	31 Å²	31	28%	0.278	15%	0.145	S	C	.	.	H	α-helix	trans	-59.5	-37.7	175.4	-85.2	-80.2	0	0	0	112.6	F345 I472 R488 E489 V495 S496	F345-N492 WeakPolarHBondContact CE2-OD1 3.43Å; I472-N492 HydrophobicContact CD1-CB 4.09Å; R488-N492 PolarHBondContact O-N 3.4Å; R488-N492 PolarHBondContact O-ND2 2.87Å; E489-N492 PolarHBondContact O-N 2.92Å; N492-V495 WeakPolarHBondContact O-CG2 3.4Å; N492-S496 PolarHBondContact O-N 3Å
493	Y	88.5	Confident	89.6	Confident	19 Å²	19	31.2 Å²	31.2	8%	0.075	15%	0.145	C	C	.	.	H	α-helix	trans	-66.2	-51.1	173.8	157.1	-101.9	0	0	0	112.1	E302 I472 V474 M479 E489 L490 A491 V495 S496	E302-Y493 HydrophobicContact CG-CE1 4.19Å; E302-Y493 WeakPolarHBondContact OE1-CE1 3.44Å; E302-Y493 VanDerWaalsContact OE1-CZ 3.23Å; E302-Y493 PolarHBondContact OE1-OH 2.97Å; I472-Y493 HydrophobicContact CG2-CD2 4.26Å; V474-Y493 HydrophobicContact CB-CD1 4.07Å; V474-Y493 HydrophobicContact CB-CD2 3.74Å; V474-Y493 HydrophobicContact CB-CE1 4.29Å; V474-Y493 HydrophobicContact CB-CE2 3.99Å; V474-Y493 HydrophobicContact CB-CG 3.82Å; V474-Y493 HydrophobicContact CG2-CD1 4.09Å; V474-Y493 HydrophobicContact CG2-CD2 3.64Å; V474-Y493 HydrophobicContact CG2-CE2 4.39Å; V474-Y493 HydrophobicContact CG2-CG 3.49Å; V474-Y493 VanDerWaalsContact CG2-CG 3.49Å; M479-Y493 HydrophobicContact SD-CE1 3.84Å; E489-Y493 PolarHBondContact O-N 2.87Å; L490-Y493 HydrophobicContact CD1-CD1 4.04Å; L490-Y493 PolarHBondContact O-N 3.45Å; A491-Y493 VanDerWaalsContact C-N 3.28Å; A491-Y493 PolarHBondContact O-N 2.88Å; Y493-V495 PolarHBondContact O-N 3.46Å; Y493-S496 WeakPolarHBondContact O-CB 3.38Å; Y493-S496 PolarHBondContact O-N 2.9Å; Y493-S496 VanDerWaalsContact O-N 3.08Å
494	S	89.4	Confident	89.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.3	-47.4	-176.9	-177.8	0	0	0	0	112.2	S322 L490 A491 S496 D497	S322-S494 PolarHBondContact OG-O 2.94Å; S322-S494 VanDerWaalsContact OG-O 3.11Å; L490-S494 PolarHBondContact O-N 3.07Å; A491-S494 PolarHBondContact O-N 2.83Å; S494-S496 PolarHBondContact O-N 3.24Å; S494-S496 VanDerWaalsContact O-N 3.11Å; S494-D497 PolarHBondContact O-N 2.84Å; S494-D497 VanDerWaalsContact O-N 3.12Å
495	V	92.3	Very high	90.2	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.5	-23	177.8	-59.1	0	0	0	0	113	L331 F345 Y347 F357 A491 N492 Y493 D497 V499	L331-V495 HydrophobicContact CB-CG1 4.24Å; L331-V495 HydrophobicContact CD1-CG1 3.99Å; L331-V495 HydrophobicContact CD2-CG1 4.13Å; L331-V495 HydrophobicContact CG-CG1 4.35Å; F345-V495 HydrophobicContact CE2-CG2 3.74Å; F345-V495 HydrophobicContact CZ-CB 4.44Å; F345-V495 HydrophobicContact CZ-CG1 3.8Å; F345-V495 HydrophobicContact CZ-CG2 3.8Å; Y347-V495 HydrophobicContact CD1-CG2 4.05Å; Y347-V495 HydrophobicContact CG-CG2 3.89Å; F357-V495 HydrophobicContact CD1-CB 4.05Å; F357-V495 HydrophobicContact CD1-CG1 3.45Å; F357-V495 VanDerWaalsContact CD1-CG1 3.45Å; F357-V495 HydrophobicContact CD2-CB 3.98Å; F357-V495 HydrophobicContact CD2-CG1 4.06Å; F357-V495 HydrophobicContact CD2-CG2 4.2Å; F357-V495 HydrophobicContact CE1-CB 3.73Å; F357-V495 HydrophobicContact CE1-CG1 3.54Å; F357-V495 HydrophobicContact CE2-CB 3.68Å; F357-V495 HydrophobicContact CE2-CG1 4.16Å; F357-V495 HydrophobicContact CE2-CG2 4.11Å; F357-V495 HydrophobicContact CG-CB 4.19Å; F357-V495 HydrophobicContact CG-CG1 3.75Å; F357-V495 HydrophobicContact CZ-CB 3.56Å; F357-V495 HydrophobicContact CZ-CG1 3.92Å; F357-V495 HydrophobicContact CZ-CG2 4.48Å; A491-V495 WeakPolarHBondContact O-CG1 3.36Å; A491-V495 WeakPolarHBondContact O-CG2 3.02Å; A491-V495 PolarHBondContact O-N 2.88Å; N492-V495 WeakPolarHBondContact O-CG2 3.4Å; Y493-V495 PolarHBondContact O-N 3.46Å; V495-D497 PolarHBondContact O-N 3.48Å; V495-V499 WeakPolarHBondContact O-CB 3.33Å; V495-V499 WeakPolarHBondContact O-CG2 3.14Å; V495-V499 PolarHBondContact O-N 2.89Å
496	S	89.4	Confident	90.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.9	-26.3	177.7	-172.5	0	0	0	0	113.3	Y347 P471 N492 Y493 S494 A500	Y347-S496 VanDerWaalsContact CE1-CA 3.47Å; Y347-S496 VanDerWaalsContact CE1-CB 3.49Å; Y347-S496 WeakPolarHBondContact CE1-OG 3.31Å; Y347-S496 WeakPolarHBondContact OH-CB 3.45Å; Y347-S496 PolarHBondContact OH-OG 3.35Å; P471-S496 VanDerWaalsContact CB-OG 3.22Å; P471-S496 WeakPolarHBondContact CB-OG 3.36Å; N492-S496 PolarHBondContact O-N 3Å; Y493-S496 WeakPolarHBondContact O-CB 3.38Å; Y493-S496 PolarHBondContact O-N 2.9Å; Y493-S496 VanDerWaalsContact O-N 3.08Å; S494-S496 PolarHBondContact O-N 3.24Å; S494-S496 VanDerWaalsContact O-N 3.11Å; S496-A500 WeakPolarHBondContact O-CB 3.47Å; S496-A500 PolarHBondContact O-N 2.87Å
497	D	89.3	Confident	90	Very high	10 Å²	10	23.2 Å²	23.2	5%	0.053	10%	0.104	C	C	.	.	H	α-helix	trans	-89	-32.2	180	-76.7	-25.7	0	0	0	112.9	D300 L459 K460 S494 V495 A500 T501	D300-D497 HydrophobicContact CB-CB 4.37Å; L459-D497 HydrophobicContact CD2-CB 3.59Å; L459-D497 WeakPolarHBondContact CD2-OD1 3.31Å; K460-D497 VanDerWaalsContact CE-OD1 3.29Å; K460-D497 WeakPolarHBondContact CE-OD1 3.37Å; K460-D497 WeakPolarHBondContact CE-OD2 3.46Å; K460-D497 IonicContact NZ-OD1 3.17Å; K460-D497 PolarHBondContact NZ-OD1 2.7Å; K460-D497 IonicContact NZ-OD2 3.88Å; K460-D497 PolarHBondContact NZ-OD2 3.13Å; S494-D497 PolarHBondContact O-N 2.84Å; S494-D497 VanDerWaalsContact O-N 3.12Å; V495-D497 PolarHBondContact O-N 3.48Å; D497-A500 PolarHBondContact O-N 2.84Å; D497-T501 WeakPolarHBondContact O-CB 3.43Å; D497-T501 PolarHBondContact O-N 2.81Å; D497-T501 PolarHBondContact O-OG1 3.07Å
498	A	91.1	Very high	89.8	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.1	-44.9	163.6	0	0	0	0	0	111.6	S322 M324 T501 Y502	S322-A498 VanDerWaalsContact OG-CB 3.32Å; S322-A498 WeakPolarHBondContact OG-CB 3.46Å; M324-A498 HydrophobicContact CG-CB 4.25Å; A498-T501 PolarHBondContact O-N 3.26Å; A498-Y502 VanDerWaalsContact O-CB 3.23Å; A498-Y502 WeakPolarHBondContact O-CB 3.44Å; A498-Y502 PolarHBondContact O-N 2.64Å
499	V	92.5	Very high	89.9	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.8	-45.2	174.8	169.2	0	0	0	0	111.7	M324 Y347 P349 F357 V495 Y503	M324-V499 HydrophobicContact CE-CG2 4.17Å; M324-V499 HydrophobicContact CG-CG2 4.15Å; M324-V499 HydrophobicContact SD-CG2 3.76Å; Y347-V499 HydrophobicContact CD1-CB 4.43Å; Y347-V499 HydrophobicContact CD1-CG2 4.17Å; Y347-V499 HydrophobicContact CE1-CG1 4.5Å; P349-V499 HydrophobicContact CG-CG1 4.14Å; F357-V499 HydrophobicContact CE2-CG2 3.75Å; F357-V499 HydrophobicContact CZ-CG2 3.83Å; V495-V499 WeakPolarHBondContact O-CB 3.33Å; V495-V499 WeakPolarHBondContact O-CG2 3.14Å; V495-V499 PolarHBondContact O-N 2.89Å; V499-Y503 HydrophobicContact CG1-CD2 3.85Å; V499-Y503 HydrophobicContact CG1-CE2 4.1Å; V499-Y503 WeakPolarHBondContact O-CD2 3.48Å; V499-Y503 PolarHBondContact O-N 2.66Å; V499-Y503 VanDerWaalsContact O-N 3.08Å
500	A	92	Very high	90.1	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-63.9	-42.9	177.9	0	0	0	0	0	112.3	L459 A463 L467 Y469 S496 D497 L504	L459-A500 HydrophobicContact CD1-CB 3.84Å; L459-A500 HydrophobicContact CD2-CB 4.25Å; L459-A500 HydrophobicContact CG-CB 4Å; A463-A500 HydrophobicContact CB-CB 4.24Å; L467-A500 WeakPolarHBondContact CD1-O 3.34Å; Y469-A500 WeakPolarHBondContact OH-CA 3.35Å; S496-A500 WeakPolarHBondContact O-CB 3.47Å; S496-A500 PolarHBondContact O-N 2.87Å; D497-A500 PolarHBondContact O-N 2.84Å; A500-L504 WeakPolarHBondContact O-CB 3.33Å; A500-L504 PolarHBondContact O-N 3.06Å
501	T	93.4	Very high	90	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-66	-46.1	178.3	-65.4	0	0	0	0	111.3	A298 V385 L459 D497 A498 L504 Y505	A298-T501 HydrophobicContact CB-CG2 4.31Å; V385-T501 HydrophobicContact CB-CG2 4.5Å; V385-T501 HydrophobicContact CG1-CG2 3.68Å; L459-T501 VanDerWaalsContact CD2-OG1 3.25Å; L459-T501 WeakPolarHBondContact CD2-OG1 3.25Å; D497-T501 WeakPolarHBondContact O-CB 3.43Å; D497-T501 PolarHBondContact O-N 2.81Å; D497-T501 PolarHBondContact O-OG1 3.07Å; A498-T501 PolarHBondContact O-N 3.26Å; T501-L504 PolarHBondContact O-N 2.73Å; T501-Y505 WeakPolarHBondContact O-CB 3.1Å; T501-Y505 PolarHBondContact O-N 2.72Å
502	Y	94.4	Very high	89.9	Confident	15 Å²	15	16.5 Å²	16.5	6%	0.059	7%	0.074	C	C	.	.	H	α-helix	trans	-57.7	-51.9	176.9	-176.9	-103.5	0	0	0	112.4	V296 A298 M324 D326 G327 A498 Y505 M506	V296-Y502 HydrophobicContact CB-CE2 4.29Å; V296-Y502 HydrophobicContact CG1-CD2 4.31Å; V296-Y502 HydrophobicContact CG1-CE2 4.1Å; A298-Y502 HydrophobicContact CB-CD2 3.93Å; A298-Y502 HydrophobicContact CB-CG 4.38Å; M324-Y502 HydrophobicContact CB-CD1 4.35Å; M324-Y502 HydrophobicContact CB-CD2 3.75Å; M324-Y502 HydrophobicContact CB-CE2 4.48Å; M324-Y502 HydrophobicContact CB-CG 3.68Å; M324-Y502 HydrophobicContact CE-CD1 4.11Å; M324-Y502 HydrophobicContact CG-CG 4.2Å; D326-Y502 WeakPolarHBondContact CA-OH 3.47Å; G327-Y502 PolarHBondContact N-OH 3.25Å; G327-Y502 VanDerWaalsContact N-OH 3.17Å; A498-Y502 VanDerWaalsContact O-CB 3.23Å; A498-Y502 WeakPolarHBondContact O-CB 3.44Å; A498-Y502 PolarHBondContact O-N 2.64Å; Y502-Y505 WeakPolarHBondContact O-CB 3.24Å; Y502-Y505 PolarHBondContact O-N 2.94Å; Y502-M506 HydrophobicContact CE1-CG 4.18Å; Y502-M506 HydrophobicContact CE2-CE 3.84Å; Y502-M506 HydrophobicContact CE2-CG 4.16Å; Y502-M506 PolarHBondContact O-N 3.44Å; Y502-M506 VanDerWaalsContact OH-CE 3.32Å; Y502-M506 WeakPolarHBondContact OH-CE 3.48Å
503	Y	92.5	Very high	90	Very high	29 Å²	29	14.1 Å²	14.1	11%	0.114	6%	0.061	C	C	.	.	H	α-helix	trans	-75.9	-28.7	-177.8	-74	-62.7	0	0	0	113.6	M324 F353 P354 V499 Y505 K507	M324-Y503 HydrophobicContact CE-CE2 4.26Å; F353-Y503 HydrophobicContact CB-CD2 3.75Å; F353-Y503 HydrophobicContact CB-CE2 3.67Å; F353-Y503 HydrophobicContact CB-CG 4.32Å; F353-Y503 AromaticContact CD1-CD1 3.48Å; F353-Y503 HydrophobicContact CD1-CD1 3.48Å; F353-Y503 VanDerWaalsContact CD1-CD1 3.48Å; F353-Y503 AromaticContact CD1-CD2 3.79Å; F353-Y503 HydrophobicContact CD1-CD2 3.79Å; F353-Y503 AromaticContact CD1-CE1 3.89Å; F353-Y503 HydrophobicContact CD1-CE1 3.89Å; F353-Y503 HydrophobicContact CD1-CE2 4.17Å; F353-Y503 AromaticContact CD1-CG 3.44Å; F353-Y503 HydrophobicContact CD1-CG 3.44Å; F353-Y503 VanDerWaalsContact CD1-CG 3.44Å; F353-Y503 AromaticContact CE1-CD1 3.93Å; F353-Y503 HydrophobicContact CE1-CD1 3.93Å; F353-Y503 AromaticContact CE1-CG 3.95Å; F353-Y503 HydrophobicContact CE1-CG 3.95Å; F353-Y503 HydrophobicContact CG-CD1 4.43Å; F353-Y503 AromaticContact CG-CD2 3.95Å; F353-Y503 HydrophobicContact CG-CD2 3.95Å; F353-Y503 HydrophobicContact CG-CE2 4.28Å; F353-Y503 HydrophobicContact CG-CG 4.04Å; P354-Y503 VanDerWaalsContact CD-OH 3.32Å; P354-Y503 WeakPolarHBondContact CD-OH 3.36Å; P354-Y503 PolarHBondContact O-OH 2.94Å; P354-Y503 VanDerWaalsContact O-OH 3.05Å; V499-Y503 HydrophobicContact CG1-CD2 3.85Å; V499-Y503 HydrophobicContact CG1-CE2 4.1Å; V499-Y503 WeakPolarHBondContact O-CD2 3.48Å; V499-Y503 PolarHBondContact O-N 2.66Å; V499-Y503 VanDerWaalsContact O-N 3.08Å; Y503-Y505 VanDerWaalsContact C-N 3.31Å; Y503-K507 WeakPolarHBondContact O-CB 3.37Å; Y503-K507 PolarHBondContact O-N 3.33Å
504	L	91.3	Very high	90.1	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-61.1	-44	167.7	175.6	60.8	0	0	0	110.6	Y387 C442 W445 V446 L459 V462 K466 L467 A500 T501 Y508 V509	Y387-L504 HydrophobicContact CD2-CD2 4.01Å; Y387-L504 HydrophobicContact CE2-CD2 3.72Å; C442-L504 HydrophobicContact CB-CD2 4.19Å; W445-L504 HydrophobicContact CZ3-CD1 4.38Å; V446-L504 HydrophobicContact CG2-CD2 4.38Å; L459-L504 HydrophobicContact CD1-CD2 4.29Å; V462-L504 HydrophobicContact CB-CD2 4.49Å; V462-L504 HydrophobicContact CG1-CD1 3.65Å; V462-L504 HydrophobicContact CG1-CD2 3.68Å; V462-L504 HydrophobicContact CG1-CG 4.33Å; K466-L504 HydrophobicContact CB-CD1 4.45Å; L467-L504 HydrophobicContact CD1-CB 4.4Å; A500-L504 WeakPolarHBondContact O-CB 3.33Å; A500-L504 PolarHBondContact O-N 3.06Å; T501-L504 PolarHBondContact O-N 2.73Å; L504-Y508 HydrophobicContact CD1-CD2 4.26Å; L504-Y508 WeakPolarHBondContact O-CB 3.01Å; L504-Y508 PolarHBondContact O-N 2.78Å; L504-Y508 VanDerWaalsContact O-N 3.14Å; L504-V509 HydrophobicContact CG-CG2 4.35Å; L504-V509 PolarHBondContact O-N 2.86Å
505	Y	92.6	Very high	90	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.058	C	C	.	.	I	π-helix	trans	-63.1	-59	177.9	175.5	-103.5	0	0	0	112.1	V296 I383 V385 I440 T501 Y502 Y503 K507 Y508 V509 H510	V296-Y505 HydrophobicContact CG1-CD1 3.89Å; V296-Y505 HydrophobicContact CG1-CE1 3.84Å; V296-Y505 HydrophobicContact CG2-CE1 4.02Å; I383-Y505 WeakPolarHBondContact CD1-OH 3.19Å; V385-Y505 HydrophobicContact CB-CG 4.37Å; V385-Y505 HydrophobicContact CG1-CD2 3.97Å; V385-Y505 HydrophobicContact CG1-CG 3.81Å; V385-Y505 HydrophobicContact CG2-CD1 3.65Å; V385-Y505 HydrophobicContact CG2-CD2 3.84Å; V385-Y505 HydrophobicContact CG2-CE1 3.9Å; V385-Y505 HydrophobicContact CG2-CE2 4.13Å; V385-Y505 HydrophobicContact CG2-CG 3.61Å; I440-Y505 HydrophobicContact CB-CD2 4.24Å; I440-Y505 HydrophobicContact CB-CE2 3.94Å; I440-Y505 HydrophobicContact CG1-CE2 3.76Å; I440-Y505 HydrophobicContact CG2-CD2 3.77Å; I440-Y505 HydrophobicContact CG2-CE2 3.74Å; T501-Y505 WeakPolarHBondContact O-CB 3.1Å; T501-Y505 PolarHBondContact O-N 2.72Å; Y502-Y505 WeakPolarHBondContact O-CB 3.24Å; Y502-Y505 PolarHBondContact O-N 2.94Å; Y503-Y505 VanDerWaalsContact C-N 3.31Å; Y505-K507 PolarHBondContact O-N 3.24Å; Y505-Y508 PolarHBondContact O-N 3.07Å; Y505-V509 HydrophobicContact CD2-CB 3.88Å; Y505-V509 HydrophobicContact CD2-CG1 4.19Å; Y505-V509 HydrophobicContact CE2-CB 4.48Å; Y505-V509 PolarHBondContact O-N 3.45Å; Y505-H510 HydrophobicContact CD1-CB 4.2Å; Y505-H510 HydrophobicContact CD2-CB 4.38Å; Y505-H510 HydrophobicContact CE1-CB 3.69Å; Y505-H510 AromaticContact CE1-ND1 3.81Å; Y505-H510 HydrophobicContact CE2-CB 3.84Å; Y505-H510 VanDerWaalsContact CZ-CB 3.48Å; Y505-H510 AromaticContact CZ-CG 3.93Å; Y505-H510 AromaticContact CZ-ND1 3.56Å; Y505-H510 PolarHBondContact O-N 2.79Å; Y505-H510 PolarHBondContact OH-ND1 3.28Å
506	M	87.7	Confident	89.8	Confident	60 Å²	60	13.2 Å²	13.2	30%	0.296	6%	0.058	S	C	.	.	I	π-helix	trans	-62.5	-38.5	-176	-69.5	-59.8	-149.7	0	0	112.9	V296 Y502	V296-M506 HydrophobicContact CB-CE 3.78Å; V296-M506 HydrophobicContact CG1-CE 4.23Å; V296-M506 HydrophobicContact CG2-CE 3.55Å; V296-M506 HydrophobicContact CG2-SD 4.29Å; Y502-M506 HydrophobicContact CE1-CG 4.18Å; Y502-M506 HydrophobicContact CE2-CE 3.84Å; Y502-M506 HydrophobicContact CE2-CG 4.16Å; Y502-M506 PolarHBondContact O-N 3.44Å; Y502-M506 VanDerWaalsContact OH-CE 3.32Å; Y502-M506 WeakPolarHBondContact OH-CE 3.48Å
507	K	84.1	Confident	89.9	Confident	69 Å²	69	13.2 Å²	13.2	30%	0.3	6%	0.058	S	C	.	.	I	π-helix	trans	-85.2	-18.9	-174.8	-156.4	164	-170.6	164.8	0	113.9	E352 F353 L467 Y503 Y505	E352-K507 IonicContact OE2-NZ 3.77Å; E352-K507 PolarHBondContact OE2-NZ 3.13Å; F353-K507 HydrophobicContact CE1-CD 4Å; F353-K507 HydrophobicContact CZ-CD 4.04Å; L467-K507 HydrophobicContact CD2-CB 4.45Å; L467-K507 HydrophobicContact CD2-CD 4.29Å; Y503-K507 WeakPolarHBondContact O-CB 3.37Å; Y503-K507 PolarHBondContact O-N 3.33Å; Y505-K507 PolarHBondContact O-N 3.24Å
508	Y	85.6	Confident	89.7	Confident	71 Å²	71	14.8 Å²	14.8	28%	0.278	7%	0.068	S	C	.	.	I	π-helix	trans	-141.3	-39.8	-174.1	-65.6	-71.8	0	0	0	116.7	W445 K466 L467 L504 Y505 F512	W445-Y508 HydrophobicContact CH2-CG 4.4Å; K466-Y508 HydrophobicContact CB-CD2 4.04Å; K466-Y508 HydrophobicContact CB-CE2 3.73Å; K466-Y508 PolarHBondContact O-OH 3.01Å; L467-Y508 HydrophobicContact CD2-CD2 4.45Å; L467-Y508 HydrophobicContact CD2-CE2 4.19Å; L504-Y508 HydrophobicContact CD1-CD2 4.26Å; L504-Y508 WeakPolarHBondContact O-CB 3.01Å; L504-Y508 PolarHBondContact O-N 2.78Å; L504-Y508 VanDerWaalsContact O-N 3.14Å; Y505-Y508 PolarHBondContact O-N 3.07Å; Y508-F512 WeakPolarHBondContact O-CB 3.42Å
509	V	90.1	Very high	89.4	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.071	C	C	.	.	I	π-helix	trans	-87.8	-50.1	-171.9	-171.7	0	0	0	0	112.3	I440 C442 W445 L504 Y505 F512 V513	I440-V509 HydrophobicContact CG2-CG1 3.72Å; C442-V509 HydrophobicContact CB-CG2 4.46Å; W445-V509 HydrophobicContact CB-CG1 3.76Å; W445-V509 HydrophobicContact CB-CG2 4.2Å; W445-V509 HydrophobicContact CD2-CG2 3.76Å; W445-V509 HydrophobicContact CE3-CG2 3.72Å; W445-V509 HydrophobicContact CG-CB 4.36Å; W445-V509 HydrophobicContact CG-CG1 3.88Å; W445-V509 HydrophobicContact CG-CG2 3.97Å; W445-V509 HydrophobicContact CZ3-CG2 4.35Å; L504-V509 HydrophobicContact CG-CG2 4.35Å; L504-V509 PolarHBondContact O-N 2.86Å; Y505-V509 HydrophobicContact CD2-CB 3.88Å; Y505-V509 HydrophobicContact CD2-CG1 4.19Å; Y505-V509 HydrophobicContact CE2-CB 4.48Å; Y505-V509 PolarHBondContact O-N 3.45Å; V509-F512 PolarHBondContact O-N 3.3Å; V509-V513 HydrophobicContact CG1-CG2 3.88Å; V509-V513 WeakPolarHBondContact O-CB 3.27Å; V509-V513 WeakPolarHBondContact O-CG2 3.23Å; V509-V513 PolarHBondContact O-N 3.46Å
510	H	90.1	Very high	89.4	Confident	11 Å²	11	15.4 Å²	15.4	5%	0.051	7%	0.071	C	C	.	.	H	α-helix	trans	-47.5	-58.1	172.3	-178.3	96.1	0	0	0	112.2	W291 Y505 F512 V513 F514	W291-H510 AromaticContact CD2-NE2 3.96Å; W291-H510 AromaticContact CE3-CD2 3.98Å; Y505-H510 HydrophobicContact CD1-CB 4.2Å; Y505-H510 HydrophobicContact CD2-CB 4.38Å; Y505-H510 HydrophobicContact CE1-CB 3.69Å; Y505-H510 AromaticContact CE1-ND1 3.81Å; Y505-H510 HydrophobicContact CE2-CB 3.84Å; Y505-H510 VanDerWaalsContact CZ-CB 3.48Å; Y505-H510 AromaticContact CZ-CG 3.93Å; Y505-H510 AromaticContact CZ-ND1 3.56Å; Y505-H510 PolarHBondContact O-N 2.79Å; Y505-H510 PolarHBondContact OH-ND1 3.28Å; H510-F512 VanDerWaalsContact C-N 3.26Å; H510-F512 PolarHBondContact O-N 2.77Å; H510-V513 PolarHBondContact O-N 3.5Å; H510-F514 AromaticContact CE1-CD2 3.63Å; H510-F514 AromaticContact CE1-CE2 3.66Å; H510-F514 AromaticContact ND1-CD2 3.84Å; H510-F514 AromaticContact ND1-CE2 3.75Å; H510-F514 AromaticContact NE2-CD2 3.88Å; H510-F514 PolarHBondContact O-N 2.87Å
511	P	85.3	Confident	89.4	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.006	7%	0.071	C	C	.	.	H	α-helix	trans	-66.4	-29.8	-172.6	29.9	-40.4	0	0	0	112.6	W291 A515 V869 S873	W291-P511 HydrophobicContact CH2-CB 3.19Å; W291-P511 HydrophobicContact CZ2-CB 4.09Å; W291-P511 HydrophobicContact CZ3-CB 3.59Å; P511-A515 WeakPolarHBondContact O-CB 3.46Å; P511-A515 PolarHBondContact O-N 3.47Å; P511-V869 HydrophobicContact CB-CG1 4.06Å; P511-V869 HydrophobicContact CG-CG1 4.03Å; P511-S873 WeakPolarHBondContact CB-OG 3.43Å; P511-S873 WeakPolarHBondContact O-CB 3.41Å
512	F	88.3	Confident	89.3	Confident	10 Å²	10	15.6 Å²	15.6	4%	0.044	7%	0.072	C	C	.	.	H	α-helix	trans	-80.5	-41.6	179.7	-178.1	-86.3	0	0	0	113.2	W445 D449 Y508 V509 H510 A515 L516 L876 A877 C880	W445-F512 AromaticContact CD1-CD1 3.5Å; W445-F512 VanDerWaalsContact CD1-CD1 3.5Å; W445-F512 AromaticContact CD1-CE1 3.99Å; W445-F512 AromaticContact NE1-CD1 3.15Å; W445-F512 AromaticContact NE1-CE1 3.74Å; W445-F512 AromaticContact NE1-CG 3.42Å; D449-F512 HydrophobicContact CB-CD1 4.42Å; D449-F512 HydrophobicContact CB-CE1 3.7Å; D449-F512 HydrophobicContact CB-CZ 3.75Å; D449-F512 VanDerWaalsContact OD2-CE1 3.27Å; D449-F512 WeakPolarHBondContact OD2-CE1 3.36Å; Y508-F512 WeakPolarHBondContact O-CB 3.42Å; V509-F512 PolarHBondContact O-N 3.3Å; H510-F512 VanDerWaalsContact C-N 3.26Å; H510-F512 PolarHBondContact O-N 2.77Å; F512-A515 PolarHBondContact O-N 3.48Å; F512-L516 HydrophobicContact CD1-CD1 4.01Å; F512-L516 HydrophobicContact CE1-CD1 3.38Å; F512-L516 HydrophobicContact CE1-CG 4.18Å; F512-L516 HydrophobicContact CZ-CD1 3.95Å; F512-L516 HydrophobicContact CZ-CG 4.49Å; F512-L516 PolarHBondContact O-N 3.11Å; F512-L516 VanDerWaalsContact O-N 3.11Å; F512-L876 HydrophobicContact CD2-CB 4.06Å; F512-L876 HydrophobicContact CE2-CB 3.93Å; F512-A877 HydrophobicContact CE2-CB 4.49Å; F512-C880 HydrophobicContact CZ-CB 4.28Å
513	V	90.5	Very high	89.2	Confident	1 Å²	1	15.2 Å²	15.2	1%	0.006	7%	0.071	C	C	.	.	H	α-helix	trans	-66.2	-48.3	-178.9	171.8	0	0	0	0	110.4	I440 V509 H510 A515 L516 C517 P524 V527 L528	I440-V513 HydrophobicContact CD1-CG1 4.46Å; V509-V513 HydrophobicContact CG1-CG2 3.88Å; V509-V513 WeakPolarHBondContact O-CB 3.27Å; V509-V513 WeakPolarHBondContact O-CG2 3.23Å; V509-V513 PolarHBondContact O-N 3.46Å; H510-V513 PolarHBondContact O-N 3.5Å; V513-A515 VanDerWaalsContact C-N 3.35Å; V513-A515 PolarHBondContact O-N 2.62Å; V513-L516 WeakPolarHBondContact O-CB 3.17Å; V513-L516 PolarHBondContact O-N 2.95Å; V513-L516 VanDerWaalsContact O-N 3.11Å; V513-C517 PolarHBondContact O-N 3Å; V513-C517 PolarHBondContact O-SG 2.86Å; V513-C517 VanDerWaalsContact O-SG 3.34Å; V513-P524 HydrophobicContact CG1-CB 4.19Å; V513-V527 HydrophobicContact CG1-CG1 4.32Å; V513-L528 HydrophobicContact CG2-CD1 4.23Å
514	F	90.3	Very high	89.1	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-68.9	-31.7	177	-73.1	-73.8	0	0	0	112.6	W84 V86 I383 H510 L516 C517 T518 P524	W84-F514 AromaticContact CH2-CD1 3.56Å; W84-F514 HydrophobicContact CH2-CD1 3.56Å; W84-F514 HydrophobicContact CH2-CD2 4.04Å; W84-F514 AromaticContact CH2-CE1 3.47Å; W84-F514 HydrophobicContact CH2-CE1 3.47Å; W84-F514 VanDerWaalsContact CH2-CE1 3.47Å; W84-F514 AromaticContact CH2-CE2 3.98Å; W84-F514 HydrophobicContact CH2-CE2 3.98Å; W84-F514 AromaticContact CH2-CG 3.85Å; W84-F514 HydrophobicContact CH2-CG 3.85Å; W84-F514 AromaticContact CH2-CZ 3.7Å; W84-F514 HydrophobicContact CH2-CZ 3.7Å; W84-F514 HydrophobicContact CZ2-CB 4.37Å; W84-F514 AromaticContact CZ2-CD1 3.73Å; W84-F514 HydrophobicContact CZ2-CD1 3.73Å; W84-F514 HydrophobicContact CZ2-CD2 4.47Å; W84-F514 HydrophobicContact CZ2-CE1 4.11Å; W84-F514 AromaticContact CZ2-CG 3.94Å; W84-F514 HydrophobicContact CZ2-CG 3.94Å; W84-F514 HydrophobicContact CZ3-CE1 4.17Å; W84-F514 HydrophobicContact CZ3-CZ 4.31Å; V86-F514 HydrophobicContact CG2-CZ 4.41Å; I383-F514 HydrophobicContact CD1-CE2 3.84Å; I383-F514 HydrophobicContact CD1-CZ 4.01Å; H510-F514 AromaticContact CE1-CD2 3.63Å; H510-F514 AromaticContact CE1-CE2 3.66Å; H510-F514 AromaticContact ND1-CD2 3.84Å; H510-F514 AromaticContact ND1-CE2 3.75Å; H510-F514 AromaticContact NE2-CD2 3.88Å; H510-F514 PolarHBondContact O-N 2.87Å; F514-L516 PolarHBondContact O-N 2.91Å; F514-C517 WeakPolarHBondContact O-CB 3.3Å; F514-C517 PolarHBondContact O-N 3.48Å; F514-C517 VanDerWaalsContact O-N 3.11Å; F514-T518 WeakPolarHBondContact O-CG2 3.42Å; F514-T518 PolarHBondContact O-N 3.03Å; F514-T518 VanDerWaalsContact O-N 3.16Å; F514-P524 HydrophobicContact CD1-CG 4.26Å; F514-P524 HydrophobicContact CE1-CB 4.19Å; F514-P524 HydrophobicContact CE1-CG 3.47Å; F514-P524 VanDerWaalsContact CE1-CG 3.47Å; F514-P524 HydrophobicContact CZ-CB 4.3Å; F514-P524 HydrophobicContact CZ-CG 3.95Å
515	A	87.2	Confident	89	Confident	1 Å²	1	14 Å²	14	1%	0.008	7%	0.066	C	C	.	.	H	α-helix	trans	-64.8	-20.5	170.7	0	0	0	0	0	114.4	P511 F512 V513 T518 I519 L874 A877	P511-A515 WeakPolarHBondContact O-CB 3.46Å; P511-A515 PolarHBondContact O-N 3.47Å; F512-A515 PolarHBondContact O-N 3.48Å; V513-A515 VanDerWaalsContact C-N 3.35Å; V513-A515 PolarHBondContact O-N 2.62Å; A515-T518 PolarHBondContact O-OG1 2.77Å; A515-I519 WeakPolarHBondContact O-CG1 3.18Å; A515-L874 HydrophobicContact CB-CD2 3.87Å; A515-L874 HydrophobicContact CB-CG 4.18Å; A515-A877 HydrophobicContact CB-CB 4.03Å
516	L	88.5	Confident	88.7	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-83.3	-38.3	167.3	-79	173.6	0	0	0	111.8	F512 V513 F514 T518 I519 L520 V527 L535 A877 I881	F512-L516 HydrophobicContact CD1-CD1 4.01Å; F512-L516 HydrophobicContact CE1-CD1 3.38Å; F512-L516 HydrophobicContact CE1-CG 4.18Å; F512-L516 HydrophobicContact CZ-CD1 3.95Å; F512-L516 HydrophobicContact CZ-CG 4.49Å; F512-L516 PolarHBondContact O-N 3.11Å; F512-L516 VanDerWaalsContact O-N 3.11Å; V513-L516 WeakPolarHBondContact O-CB 3.17Å; V513-L516 PolarHBondContact O-N 2.95Å; V513-L516 VanDerWaalsContact O-N 3.11Å; F514-L516 PolarHBondContact O-N 2.91Å; L516-T518 VanDerWaalsContact C-N 3.32Å; L516-T518 PolarHBondContact O-N 3.11Å; L516-I519 PolarHBondContact O-N 3.25Å; L516-L520 HydrophobicContact CB-CD1 4.05Å; L516-L520 HydrophobicContact CD2-CD1 4.24Å; L516-L520 WeakPolarHBondContact O-CB 3.25Å; L516-L520 WeakPolarHBondContact O-CD1 3.41Å; L516-L520 VanDerWaalsContact O-CG 3.25Å; L516-L520 WeakPolarHBondContact O-CG 3.45Å; L516-L520 PolarHBondContact O-N 3.42Å; L516-V527 HydrophobicContact CB-CG1 3.48Å; L516-V527 VanDerWaalsContact CB-CG1 3.48Å; L516-V527 HydrophobicContact CD1-CG1 4.08Å; L516-V527 HydrophobicContact CG-CG1 4.45Å; L516-L535 HydrophobicContact CD1-CD1 4.29Å; L516-A877 HydrophobicContact CD2-CB 3.79Å; L516-A877 HydrophobicContact CG-CB 3.87Å; L516-I881 HydrophobicContact CD2-CD1 4.11Å; L516-I881 HydrophobicContact CD2-CG1 3.97Å
517	C	90.6	Very high	88.9	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-58.7	-38.3	178.4	-67.3	0	0	0	0	113.3	A266 V513 F514 I519 L520	A266-C517 HydrophobicContact CB-CB 3.92Å; A266-C517 CarbonylContact O-C 3.58Å; A266-C517 WeakPolarHBondContact O-CB 3.47Å; V513-C517 PolarHBondContact O-N 3Å; V513-C517 PolarHBondContact O-SG 2.86Å; V513-C517 VanDerWaalsContact O-SG 3.34Å; F514-C517 WeakPolarHBondContact O-CB 3.3Å; F514-C517 PolarHBondContact O-N 3.48Å; F514-C517 VanDerWaalsContact O-N 3.11Å; C517-I519 PolarHBondContact O-N 3.45Å; C517-L520 PolarHBondContact O-N 3.17Å; C517-L520 VanDerWaalsContact O-O 3.13Å
518	T	86.7	Confident	89.1	Confident	43 Å²	43	9.2 Å²	9.2	26%	0.264	5%	0.045	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-8.7	179.4	59	0	0	0	0	114.6	A266 F514 A515 L516	A266-T518 PolarHBondContact O-N 3.43Å; F514-T518 WeakPolarHBondContact O-CG2 3.42Å; F514-T518 PolarHBondContact O-N 3.03Å; F514-T518 VanDerWaalsContact O-N 3.16Å; A515-T518 PolarHBondContact O-OG1 2.77Å; L516-T518 VanDerWaalsContact C-N 3.32Å; L516-T518 PolarHBondContact O-N 3.11Å
519	I	84.3	Confident	89.1	Confident	13 Å²	13	7.1 Å²	7.1	7%	0.067	4%	0.037	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.7	0.7	-178.5	3.2	163.6	0	0	0	113.5	A515 L516 C517 F826 H878	A515-I519 WeakPolarHBondContact O-CG1 3.18Å; L516-I519 PolarHBondContact O-N 3.25Å; C517-I519 PolarHBondContact O-N 3.45Å; I519-F826 HydrophobicContact CB-CZ 4.13Å; I519-F826 HydrophobicContact CD1-CE1 4.12Å; I519-F826 HydrophobicContact CD1-CZ 4.23Å; I519-F826 HydrophobicContact CG2-CE1 4.45Å; I519-F826 HydrophobicContact CG2-CE2 4.12Å; I519-F826 HydrophobicContact CG2-CZ 3.53Å; I519-H878 VanDerWaalsContact CD1-CE1 3.45Å; I519-H878 WeakPolarHBondContact CD1-CE1 3.33Å
520	L	91.2	Very high	88.9	Confident	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.044	C	C	.	.	S	Bend	trans	-132.8	129.5	-170.9	-64.1	173.2	0	0	0	111.4	F265 L516 C517 L522 V527 L535 L539	F265-L520 WeakPolarHBondContact CD1-O 3.47Å; L516-L520 HydrophobicContact CB-CD1 4.05Å; L516-L520 HydrophobicContact CD2-CD1 4.24Å; L516-L520 WeakPolarHBondContact O-CB 3.25Å; L516-L520 WeakPolarHBondContact O-CD1 3.41Å; L516-L520 VanDerWaalsContact O-CG 3.25Å; L516-L520 WeakPolarHBondContact O-CG 3.45Å; L516-L520 PolarHBondContact O-N 3.42Å; C517-L520 PolarHBondContact O-N 3.17Å; C517-L520 VanDerWaalsContact O-O 3.13Å; L520-L522 PolarHBondContact O-N 3.2Å; L520-V527 HydrophobicContact CB-CG2 4.45Å; L520-V527 HydrophobicContact CD1-CG2 4.29Å; L520-L535 HydrophobicContact CD1-CB 3.82Å; L520-L535 HydrophobicContact CD1-CD1 3.96Å; L520-L535 HydrophobicContact CD1-CD2 4.1Å; L520-L535 HydrophobicContact CD1-CG 4.15Å; L520-L535 HydrophobicContact CD2-CB 4.1Å; L520-L535 VanDerWaalsContact CD2-O 3.23Å; L520-L535 WeakPolarHBondContact CD2-O 3.33Å; L520-L539 HydrophobicContact CD2-CB 4.2Å
521	P	92.4	Very high	88.6	Confident	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.054	C	C	.	.	S	Bend	trans	-77.1	61	-177.1	33.7	-38.4	0	0	0	112	T256 C259 I260 F265 A538 V542	T256-P521 HydrophobicContact CG2-CB 4.24Å; T256-P521 HydrophobicContact CG2-CG 3.93Å; T256-P521 PolarHBondContact OG1-O 2.86Å; T256-P521 VanDerWaalsContact OG1-O 3.1Å; C259-P521 HydrophobicContact CB-CB 3.55Å; I260-P521 HydrophobicContact CD1-CG 4.29Å; I260-P521 HydrophobicContact CG1-CB 3.89Å; I260-P521 HydrophobicContact CG1-CG 3.94Å; F265-P521 HydrophobicContact CE1-CB 4.38Å; P521-A538 HydrophobicContact CG-CB 4.1Å; P521-V542 HydrophobicContact CB-CG2 4.24Å; P521-V542 HydrophobicContact CG-CG2 3.73Å
522	L	91.9	Very high	88.5	Confident	3 Å²	3	11.1 Å²	11.1	2%	0.016	7%	0.066	C	C	.	.	S	Bend	trans	-150.2	155.2	-169.4	-67.9	178.2	0	0	0	110.5	L520 D526 V527 K530 L535 A538	L520-L522 PolarHBondContact O-N 3.2Å; L522-D526 HydrophobicContact CB-CB 4.28Å; L522-D526 HydrophobicContact CD2-CB 4.29Å; L522-V527 HydrophobicContact CB-CG2 3.66Å; L522-V527 HydrophobicContact CD1-CG2 4.28Å; L522-K530 HydrophobicContact CD1-CD 4.09Å; L522-K530 VanDerWaalsContact CD2-NZ 3.28Å; L522-L535 HydrophobicContact CD1-CD2 3.87Å; L522-A538 HydrophobicContact CD1-CB 4.42Å
523	N	91.2	Very high	88.4	Confident	8 Å²	8	11.3 Å²	11.3	4%	0.043	7%	0.07	C	C	.	.			trans	-84.4	165.7	172.2	70.3	7.9	0	0	0	112.1	N87 M88 H89 D525 D526 V527	N87-N523 WeakPolarHBondContact OD1-CB 3.35Å; M88-N523 HydrophobicContact CG-CB 3.88Å; M88-N523 PolarHBondContact O-ND2 2.85Å; H89-N523 PolarHBondContact CE1-ND2 2.73Å; N523-D525 VanDerWaalsContact C-N 3.3Å; N523-D525 PolarHBondContact O-N 3.03Å; N523-D526 PolarHBondContact O-N 2.78Å; N523-D526 VanDerWaalsContact OD1-CB 3.29Å; N523-D526 WeakPolarHBondContact OD1-CB 3.13Å; N523-D526 PolarHBondContact OD1-N 3.26Å; N523-V527 WeakPolarHBondContact O-CG2 3.39Å; N523-V527 PolarHBondContact O-N 2.7Å
524	P	90.9	Very high	88.1	Confident	0 Å²	0	12 Å²	12	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-61	-36.4	-176	-24.3	35.1	0	0	0	113.7	V86 A266 V438 V513 F514 D526 V527 L528	V86-P524 VanDerWaalsContact O-CG 3.3Å; V86-P524 WeakPolarHBondContact O-CG 3.34Å; A266-P524 HydrophobicContact CB-CG 4.4Å; V438-P524 HydrophobicContact CG1-CB 3.86Å; V438-P524 HydrophobicContact CG2-CB 4.41Å; V438-P524 HydrophobicContact CG2-CG 4.23Å; V513-P524 HydrophobicContact CG1-CB 4.19Å; F514-P524 HydrophobicContact CD1-CG 4.26Å; F514-P524 HydrophobicContact CE1-CB 4.19Å; F514-P524 HydrophobicContact CE1-CG 3.47Å; F514-P524 VanDerWaalsContact CE1-CG 3.47Å; F514-P524 HydrophobicContact CZ-CB 4.3Å; F514-P524 HydrophobicContact CZ-CG 3.95Å; P524-D526 VanDerWaalsContact C-N 3.34Å; P524-D526 PolarHBondContact O-N 3.29Å; P524-V527 PolarHBondContact O-N 3.34Å; P524-L528 WeakPolarHBondContact O-CB 3.39Å; P524-L528 PolarHBondContact O-N 2.78Å
525	D	89.2	Confident	88.1	Confident	2 Å²	2	12 Å²	12	1%	0.011	8%	0.075	C	C	.	.	H	α-helix	trans	-61.2	-41.4	179.1	-55.2	-74	0	0	0	111.7	N87 L433 H439 N523 R529	N87-D525 PolarHBondContact ND2-OD2 3.07Å; L433-D525 HydrophobicContact CD2-CB 3.89Å; H439-D525 PolarHBondContact N-OD1 2.86Å; N523-D525 VanDerWaalsContact C-N 3.3Å; N523-D525 PolarHBondContact O-N 3.03Å; D525-R529 WeakPolarHBondContact O-CG 3.45Å; D525-R529 PolarHBondContact O-N 2.74Å; D525-R529 IonicContact OD1-NH1 3.93Å
526	D	87.5	Confident	88.2	Confident	26 Å²	26	12 Å²	12	14%	0.139	8%	0.075	C	C	.	.	H	α-helix	trans	-71.4	-39	172	-90.1	-12.6	0	0	0	113.2	R425 L522 N523 P524 L528 R529 K530	R425-D526 IonicContact CZ-OD1 2.74Å; R425-D526 VanDerWaalsContact CZ-OD1 3.23Å; R425-D526 IonicContact NH1-OD1 3.73Å; R425-D526 PolarHBondContact NH1-OD1 3.45Å; R425-D526 IonicContact NH2-OD1 3.38Å; R425-D526 PolarHBondContact NH2-OD1 2.8Å; L522-D526 HydrophobicContact CB-CB 4.28Å; L522-D526 HydrophobicContact CD2-CB 4.29Å; N523-D526 PolarHBondContact O-N 2.78Å; N523-D526 VanDerWaalsContact OD1-CB 3.29Å; N523-D526 WeakPolarHBondContact OD1-CB 3.13Å; N523-D526 PolarHBondContact OD1-N 3.26Å; P524-D526 VanDerWaalsContact C-N 3.34Å; P524-D526 PolarHBondContact O-N 3.29Å; D526-L528 VanDerWaalsContact C-N 3.31Å; D526-L528 PolarHBondContact O-N 2.87Å; D526-R529 PolarHBondContact O-N 2.86Å; D526-K530 HydrophobicContact CB-CD 4.17Å; D526-K530 WeakPolarHBondContact O-CB 3.41Å; D526-K530 WeakPolarHBondContact O-CG 3.23Å; D526-K530 PolarHBondContact O-N 3.49Å; D526-K530 WeakPolarHBondContact OD1-CE 3.09Å; D526-K530 IonicContact OD1-NZ 2.86Å; D526-K530 VanDerWaalsContact OD2-CE 3.31Å; D526-K530 WeakPolarHBondContact OD2-CE 3.37Å; D526-K530 IonicContact OD2-NZ 3.7Å; D526-K530 PolarHBondContact OD2-NZ 2.78Å
527	V	90.5	Very high	88.4	Confident	0 Å²	0	12.7 Å²	12.7	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-68.8	-29.7	-179.9	169	0	0	0	0	111.8	R448 V513 L516 L520 L522 N523 P524	R448-V527 PolarHBondContact NH1-O 2.7Å; R448-V527 PolarHBondContact NH2-O 2.93Å; V513-V527 HydrophobicContact CG1-CG1 4.32Å; L516-V527 HydrophobicContact CB-CG1 3.48Å; L516-V527 VanDerWaalsContact CB-CG1 3.48Å; L516-V527 HydrophobicContact CD1-CG1 4.08Å; L516-V527 HydrophobicContact CG-CG1 4.45Å; L520-V527 HydrophobicContact CB-CG2 4.45Å; L520-V527 HydrophobicContact CD1-CG2 4.29Å; L522-V527 HydrophobicContact CB-CG2 3.66Å; L522-V527 HydrophobicContact CD1-CG2 4.28Å; N523-V527 WeakPolarHBondContact O-CG2 3.39Å; N523-V527 PolarHBondContact O-N 2.7Å; P524-V527 PolarHBondContact O-N 3.34Å
528	L	88.7	Confident	88.4	Confident	3 Å²	3	13 Å²	13	2%	0.016	8%	0.081	C	C	.	.	H	α-helix	trans	-69.8	-42.9	171.9	179.3	63.1	0	0	0	112.1	I440 C444 W445 R448 V513 P524 D526	I440-L528 HydrophobicContact CB-CD2 4.35Å; I440-L528 HydrophobicContact CD1-CD2 3.97Å; I440-L528 HydrophobicContact CG2-CD2 4.04Å; C444-L528 HydrophobicContact CB-CD1 3.86Å; C444-L528 HydrophobicContact CB-CD2 4.32Å; C444-L528 HydrophobicContact CB-CG 3.8Å; W445-L528 HydrophobicContact CB-CD1 3.98Å; R448-L528 PolarHBondContact NH1-O 3.42Å; V513-L528 HydrophobicContact CG2-CD1 4.23Å; P524-L528 WeakPolarHBondContact O-CB 3.39Å; P524-L528 PolarHBondContact O-N 2.78Å; D526-L528 VanDerWaalsContact C-N 3.31Å; D526-L528 PolarHBondContact O-N 2.87Å
529	R	86.2	Confident	88.7	Confident	27 Å²	27	11 Å²	11	10%	0.102	7%	0.069	C	C	.	.	H	α-helix	trans	-97.9	-19.7	-164.7	-63.5	-179.9	174.6	87.3	-10	115.2	D390 E431 H439 D525 D526	D390-R529 VanDerWaalsContact CG-NH2 3.29Å; D390-R529 IonicContact OD1-CZ 3.94Å; D390-R529 IonicContact OD1-NH2 3.94Å; D390-R529 PolarHBondContact OD1-NH2 2.8Å; D390-R529 IonicContact OD2-CZ 3.17Å; D390-R529 VanDerWaalsContact OD2-CZ 3.24Å; D390-R529 IonicContact OD2-NE 2.82Å; D390-R529 PolarHBondContact OD2-NE 2.71Å; D390-R529 IonicContact OD2-NH2 3.86Å; D390-R529 PolarHBondContact OD2-NH2 3.37Å; E431-R529 WeakPolarHBondContact OE2-CD 3.35Å; H439-R529 PolarHBondContact ND1-NH2 2.63Å; H439-R529 PolarHBondContact O-NH1 3.45Å; H439-R529 PolarHBondContact O-NH2 2.95Å; D525-R529 WeakPolarHBondContact O-CG 3.45Å; D525-R529 PolarHBondContact O-N 2.74Å; D525-R529 IonicContact OD1-NH1 3.93Å; D526-R529 PolarHBondContact O-N 2.86Å
530	K	85.2	Confident	89.1	Confident	34 Å²	34	10.4 Å²	10.4	15%	0.148	7%	0.066	C	C	.	.	S	Bend	trans	-82.6	142.8	178.7	-69.3	174.1	-172.8	174	0	113.5	R425 R448 L522 D526 T534 L535	R425-K530 VanDerWaalsContact NH1-CE 3.29Å; R448-K530 PolarHBondContact NH1-O 3.28Å; L522-K530 HydrophobicContact CD1-CD 4.09Å; L522-K530 VanDerWaalsContact CD2-NZ 3.28Å; D526-K530 HydrophobicContact CB-CD 4.17Å; D526-K530 WeakPolarHBondContact O-CB 3.41Å; D526-K530 WeakPolarHBondContact O-CG 3.23Å; D526-K530 PolarHBondContact O-N 3.49Å; D526-K530 WeakPolarHBondContact OD1-CE 3.09Å; D526-K530 IonicContact OD1-NZ 2.86Å; D526-K530 VanDerWaalsContact OD2-CE 3.31Å; D526-K530 WeakPolarHBondContact OD2-CE 3.37Å; D526-K530 IonicContact OD2-NZ 3.7Å; D526-K530 PolarHBondContact OD2-NZ 2.78Å; K530-T534 HydrophobicContact CD-CG2 4.29Å; K530-L535 HydrophobicContact CB-CD2 3.9Å
531	G	84.4	Confident	89.2	Confident	25 Å²	25	10.7 Å²	10.7	26%	0.258	7%	0.067	S	C	.	.			trans	-67	149.4	175	0	0	0	0	0	113.8	G533 T534 L535	G531-G533 VanDerWaalsContact C-N 3.29Å; G531-G533 PolarHBondContact O-N 3.45Å; G531-G533 VanDerWaalsContact O-N 3.16Å; G531-T534 WeakPolarHBondContact O-CA 3.28Å; G531-T534 WeakPolarHBondContact O-CB 3.5Å; G531-T534 PolarHBondContact O-N 2.85Å; G531-L535 PolarHBondContact O-N 3.22Å
532	S	83.4	Confident	89.2	Confident	37 Å²	37	11.1 Å²	11.1	26%	0.259	7%	0.07	S	C	.	.	H	α-helix	trans	-57.5	-34.3	-170.6	68.4	0	0	0	0	114.6	T534 L535 C536 S884	S532-T534 VanDerWaalsContact C-N 3.26Å; S532-T534 PolarHBondContact O-N 3.46Å; S532-L535 WeakPolarHBondContact O-CB 3.37Å; S532-L535 PolarHBondContact O-N 2.97Å; S532-L535 VanDerWaalsContact O-N 3.13Å; S532-C536 PolarHBondContact O-N 3.02Å; S532-S884 VanDerWaalsContact CB-OG 3.3Å; S532-S884 WeakPolarHBondContact CB-OG 3.46Å; S532-S884 PolarHBondContact OG-OG 3Å
533	G	85.2	Confident	89.2	Confident	14 Å²	14	13.7 Å²	13.7	14%	0.144	8%	0.081	C	C	.	.	H	α-helix	trans	-65	-25.1	174	0	0	0	0	0	114.2	G531 E537 Y888	G531-G533 VanDerWaalsContact C-N 3.29Å; G531-G533 PolarHBondContact O-N 3.45Å; G531-G533 VanDerWaalsContact O-N 3.16Å; G533-E537 PolarHBondContact O-N 3.33Å; G533-Y888 VanDerWaalsContact O-CD2 3.27Å; G533-Y888 WeakPolarHBondContact O-CD2 3.4Å
534	T	85.5	Confident	89.3	Confident	17 Å²	17	13.3 Å²	13.3	10%	0.104	8%	0.079	C	C	.	.	H	α-helix	trans	-79.2	-32.1	172.2	-49.7	0	0	0	0	111	P423 K530 G531 S532 E537 A538 R891	P423-T534 PolarHBondContact O-OG1 3.39Å; K530-T534 HydrophobicContact CD-CG2 4.29Å; G531-T534 WeakPolarHBondContact O-CA 3.28Å; G531-T534 WeakPolarHBondContact O-CB 3.5Å; G531-T534 PolarHBondContact O-N 2.85Å; S532-T534 VanDerWaalsContact C-N 3.26Å; S532-T534 PolarHBondContact O-N 3.46Å; T534-E537 PolarHBondContact O-N 3.18Å; T534-A538 PolarHBondContact O-N 3.47Å; T534-A538 VanDerWaalsContact O-N 3.14Å; T534-R891 PolarHBondContact OG1-NH1 3.04Å; T534-R891 PolarHBondContact OG1-NH2 3.43Å
535	L	89.3	Confident	89.4	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-67.5	-39.9	171.6	-49.9	-174.1	0	0	0	110.8	L516 L520 L522 K530 G531 S532 E537 A538 L539 I881	L516-L535 HydrophobicContact CD1-CD1 4.29Å; L520-L535 HydrophobicContact CD1-CB 3.82Å; L520-L535 HydrophobicContact CD1-CD1 3.96Å; L520-L535 HydrophobicContact CD1-CD2 4.1Å; L520-L535 HydrophobicContact CD1-CG 4.15Å; L520-L535 HydrophobicContact CD2-CB 4.1Å; L520-L535 VanDerWaalsContact CD2-O 3.23Å; L520-L535 WeakPolarHBondContact CD2-O 3.33Å; L522-L535 HydrophobicContact CD1-CD2 3.87Å; K530-L535 HydrophobicContact CB-CD2 3.9Å; G531-L535 PolarHBondContact O-N 3.22Å; S532-L535 WeakPolarHBondContact O-CB 3.37Å; S532-L535 PolarHBondContact O-N 2.97Å; S532-L535 VanDerWaalsContact O-N 3.13Å; L535-E537 VanDerWaalsContact C-N 3.34Å; L535-E537 PolarHBondContact O-N 3.07Å; L535-A538 PolarHBondContact O-N 3.25Å; L535-L539 PolarHBondContact O-N 2.86Å; L535-I881 HydrophobicContact CB-CD1 3.52Å; L535-I881 HydrophobicContact CD1-CD1 4.2Å
536	C	90.1	Very high	89.4	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.7	-38.5	173.8	-168.3	0	0	0	0	112.9	S532 L540 F885 Y888	S532-C536 PolarHBondContact O-N 3.02Å; C536-L540 WeakPolarHBondContact O-CG 3.09Å; C536-L540 PolarHBondContact O-N 2.75Å; C536-L540 VanDerWaalsContact O-N 3.11Å; C536-F885 VanDerWaalsContact SG-CD1 3.54Å; C536-Y888 HydrophobicContact CB-CG 4.41Å
537	E	91.3	Very high	89.4	Confident	14 Å²	14	20.5 Å²	20.5	7%	0.065	13%	0.129	C	C	.	.	H	α-helix	trans	-63.3	-47.6	172.5	-177.5	178.8	-113.3	0	0	111.9	G533 T534 L535 L539 L540 M541 K554 Y888	G533-E537 PolarHBondContact O-N 3.33Å; T534-E537 PolarHBondContact O-N 3.18Å; L535-E537 VanDerWaalsContact C-N 3.34Å; L535-E537 PolarHBondContact O-N 3.07Å; E537-L539 VanDerWaalsContact C-N 3.3Å; E537-L539 PolarHBondContact O-N 3.5Å; E537-L540 PolarHBondContact O-N 3.11Å; E537-L540 VanDerWaalsContact O-N 3.13Å; E537-M541 HydrophobicContact CG-SD 4.04Å; E537-M541 WeakPolarHBondContact O-CG 3.48Å; E537-M541 PolarHBondContact O-N 3.4Å; E537-K554 IonicContact OE1-NZ 2.92Å; E537-K554 PolarHBondContact OE1-NZ 2.89Å; E537-K554 IonicContact OE2-NZ 3.85Å; E537-K554 PolarHBondContact OE2-NZ 2.88Å; E537-Y888 HydrophobicContact CB-CD2 4.45Å; E537-Y888 HydrophobicContact CB-CE2 3.65Å; E537-Y888 HydrophobicContact CG-CE2 4.18Å
538	A	91.5	Very high	89.5	Confident	8 Å²	8	23.2 Å²	23.2	7%	0.066	14%	0.143	C	C	.	.	H	α-helix	trans	-61.3	-39	-179	0	0	0	0	0	112	P521 L522 T534 L535 V542	P521-A538 HydrophobicContact CG-CB 4.1Å; L522-A538 HydrophobicContact CD1-CB 4.42Å; T534-A538 PolarHBondContact O-N 3.47Å; T534-A538 VanDerWaalsContact O-N 3.14Å; L535-A538 PolarHBondContact O-N 3.25Å; A538-V542 PolarHBondContact O-N 3.04Å
539	L	91.8	Very high	89.6	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-59.5	-52.8	169.7	167.1	62.4	0	0	0	112.1	L520 L535 E537 M541 V542 Q543 T822 F826 I881 F885	L520-L539 HydrophobicContact CD2-CB 4.2Å; L535-L539 PolarHBondContact O-N 2.86Å; E537-L539 VanDerWaalsContact C-N 3.3Å; E537-L539 PolarHBondContact O-N 3.5Å; L539-M541 PolarHBondContact O-N 3.02Å; L539-V542 WeakPolarHBondContact O-CB 3.25Å; L539-V542 PolarHBondContact O-N 3.27Å; L539-Q543 HydrophobicContact CD1-CG 3.98Å; L539-Q543 PolarHBondContact O-N 2.9Å; L539-Q543 VanDerWaalsContact O-N 3.12Å; L539-T822 HydrophobicContact CD1-CG2 4.46Å; L539-T822 HydrophobicContact CD2-CG2 4.05Å; L539-T822 HydrophobicContact CG-CG2 4.12Å; L539-F826 HydrophobicContact CD1-CD2 4.34Å; L539-F826 HydrophobicContact CD1-CE2 3.39Å; L539-F826 HydrophobicContact CD1-CZ 3.6Å; L539-F826 HydrophobicContact CD2-CD1 4.09Å; L539-F826 HydrophobicContact CD2-CD2 3.85Å; L539-F826 HydrophobicContact CD2-CE1 3.7Å; L539-F826 HydrophobicContact CD2-CE2 3.47Å; L539-F826 VanDerWaalsContact CD2-CE2 3.47Å; L539-F826 HydrophobicContact CD2-CG 4.15Å; L539-F826 HydrophobicContact CD2-CZ 3.37Å; L539-F826 HydrophobicContact CG-CE2 4.07Å; L539-F826 HydrophobicContact CG-CZ 4.1Å; L539-I881 HydrophobicContact CD2-CG2 3.66Å; L539-F885 HydrophobicContact CD2-CE1 4.4Å; L539-F885 HydrophobicContact CD2-CZ 3.78Å
540	L	93.3	Very high	89.9	Confident	0 Å²	0	22 Å²	22	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62	-30.3	-176.7	-76.8	165.6	0	0	0	111.9	C536 E537 Q543 A544 Y819 T822 F885 Y888 W896	C536-L540 WeakPolarHBondContact O-CG 3.09Å; C536-L540 PolarHBondContact O-N 2.75Å; C536-L540 VanDerWaalsContact O-N 3.11Å; E537-L540 PolarHBondContact O-N 3.11Å; E537-L540 VanDerWaalsContact O-N 3.13Å; L540-Q543 PolarHBondContact O-N 3.01Å; L540-A544 WeakPolarHBondContact O-CB 3.3Å; L540-A544 PolarHBondContact O-N 3.32Å; L540-Y819 HydrophobicContact CD1-CD2 4.11Å; L540-Y819 HydrophobicContact CD1-CE2 3.68Å; L540-Y819 HydrophobicContact CD2-CD2 3.61Å; L540-Y819 HydrophobicContact CD2-CE2 3.94Å; L540-Y819 HydrophobicContact CD2-CG 4.31Å; L540-T822 HydrophobicContact CD2-CG2 4.05Å; L540-F885 HydrophobicContact CD1-CD1 4.4Å; L540-F885 HydrophobicContact CD1-CE1 4.33Å; L540-F885 HydrophobicContact CD2-CE1 4.09Å; L540-F885 HydrophobicContact CG-CE1 4.18Å; L540-Y888 HydrophobicContact CD1-CD1 3.8Å; L540-Y888 HydrophobicContact CD1-CE1 3.49Å; L540-Y888 VanDerWaalsContact CD1-CE1 3.49Å; L540-W896 HydrophobicContact CB-CE3 3.69Å; L540-W896 HydrophobicContact CB-CH2 4.01Å; L540-W896 HydrophobicContact CB-CZ3 3.34Å; L540-W896 HydrophobicContact CD1-CE3 4.03Å; L540-W896 HydrophobicContact CD1-CZ3 4.49Å; L540-W896 HydrophobicContact CG-CE3 4.45Å
541	M	94	Very high	90.2	Very high	5 Å²	5	20.4 Å²	20.4	3%	0.025	13%	0.132	C	C	.	.	H	α-helix	trans	-65.8	-40.6	171.1	-71.9	169.4	50.5	0	0	113.1	V252 T256 I260 E537 L539 Q543 Y545 F551 R895 W896	V252-M541 HydrophobicContact CB-CE 4.33Å; V252-M541 HydrophobicContact CG1-CE 3.7Å; V252-M541 HydrophobicContact CG2-CE 3.74Å; T256-M541 HydrophobicContact CG2-CE 4.18Å; I260-M541 HydrophobicContact CD1-CB 3.82Å; I260-M541 HydrophobicContact CD1-CE 3.93Å; E537-M541 HydrophobicContact CG-SD 4.04Å; E537-M541 WeakPolarHBondContact O-CG 3.48Å; E537-M541 PolarHBondContact O-N 3.4Å; L539-M541 PolarHBondContact O-N 3.02Å; M541-Q543 PolarHBondContact O-N 2.96Å; M541-Y545 WeakPolarHBondContact O-CB 3.41Å; M541-Y545 PolarHBondContact O-N 2.93Å; M541-Y545 VanDerWaalsContact O-N 3.08Å; M541-F551 HydrophobicContact CB-CD2 4.44Å; M541-F551 HydrophobicContact CB-CE1 4.3Å; M541-F551 HydrophobicContact CB-CE2 3.9Å; M541-F551 HydrophobicContact CB-CZ 3.82Å; M541-F551 HydrophobicContact CE-CD2 4.01Å; M541-F551 HydrophobicContact CE-CE2 3.71Å; M541-F551 HydrophobicContact CG-CD2 4.02Å; M541-F551 HydrophobicContact CG-CE2 3.97Å; M541-F551 HydrophobicContact CG-CG 4.4Å; M541-F551 HydrophobicContact CG-CZ 4.28Å; M541-F551 WeakPolarHBondContact O-CE1 3.35Å; M541-F551 WeakPolarHBondContact O-CZ 3.45Å; M541-R895 PolarHBondContact SD-NE 2.88Å; M541-R895 VanDerWaalsContact SD-NE 3.42Å; M541-W896 HydrophobicContact CG-CH2 3.83Å; M541-W896 HydrophobicContact CG-CZ3 4.08Å
542	V	91.9	Very high	90.4	Very high	10 Å²	10	20.2 Å²	20.2	6%	0.061	13%	0.126	C	C	.	.	H	α-helix	trans	-58.8	-48.1	172.3	179.4	0	0	0	0	110.5	I260 F265 P521 A538 L539 Y545 A546	I260-V542 HydrophobicContact CG1-CG2 3.92Å; F265-V542 HydrophobicContact CE1-CG2 4.23Å; F265-V542 HydrophobicContact CZ-CG1 4.13Å; F265-V542 HydrophobicContact CZ-CG2 4.25Å; P521-V542 HydrophobicContact CB-CG2 4.24Å; P521-V542 HydrophobicContact CG-CG2 3.73Å; A538-V542 PolarHBondContact O-N 3.04Å; L539-V542 WeakPolarHBondContact O-CB 3.25Å; L539-V542 PolarHBondContact O-N 3.27Å; V542-Y545 PolarHBondContact O-N 3.26Å; V542-A546 PolarHBondContact O-N 2.99Å; V542-A546 VanDerWaalsContact O-N 3.13Å
543	Q	91.9	Very high	90.3	Very high	57 Å²	57	21.2 Å²	21.2	27%	0.266	13%	0.127	S	C	.	.	H	α-helix	trans	-73	-37.4	-174.5	-56.6	-54.1	-64.2	0	0	112.6	L539 L540 M541 Y545 A546 A547 T822	L539-Q543 HydrophobicContact CD1-CG 3.98Å; L539-Q543 PolarHBondContact O-N 2.9Å; L539-Q543 VanDerWaalsContact O-N 3.12Å; L540-Q543 PolarHBondContact O-N 3.01Å; M541-Q543 PolarHBondContact O-N 2.96Å; Q543-Y545 VanDerWaalsContact C-N 3.33Å; Q543-Y545 PolarHBondContact O-N 3.24Å; Q543-A546 PolarHBondContact O-N 2.97Å; Q543-A547 WeakPolarHBondContact O-CB 3.49Å; Q543-A547 PolarHBondContact O-N 2.93Å; Q543-T822 HydrophobicContact CB-CG2 4.42Å; Q543-T822 VanDerWaalsContact CB-OG1 3.25Å; Q543-T822 WeakPolarHBondContact CB-OG1 3.43Å; Q543-T822 HydrophobicContact CG-CG2 3.81Å; Q543-T822 WeakPolarHBondContact CG-OG1 3.45Å
544	A	92.5	Very high	90.1	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62	-40.3	172.8	0	0	0	0	0	111.9	L540 A547 N548 V549 F551 F818 W896	L540-A544 WeakPolarHBondContact O-CB 3.3Å; L540-A544 PolarHBondContact O-N 3.32Å; A544-A547 CarbonylContact O-C 3.4Å; A544-A547 PolarHBondContact O-N 3.05Å; A544-N548 PolarHBondContact O-N 3.09Å; A544-V549 HydrophobicContact CB-CB 4.23Å; A544-V549 PolarHBondContact O-N 3.15Å; A544-F551 HydrophobicContact CB-CD1 3.87Å; A544-F551 HydrophobicContact CB-CE1 3.82Å; A544-F818 HydrophobicContact CB-CD2 4.17Å; A544-F818 HydrophobicContact CB-CE2 3.87Å; A544-W896 HydrophobicContact CB-CH2 4.11Å; A544-W896 HydrophobicContact CB-CZ2 3.75Å
545	Y	93.1	Very high	89.1	Confident	66 Å²	66	24.6 Å²	24.6	26%	0.259	14%	0.137	S	C	.	.	H	α-helix	trans	-62.5	-47.5	176.6	-177.8	-95.5	0	0	0	111.4	I260 D261 M541 V542 Q543 A547 N548	I260-Y545 HydrophobicContact CG2-CD1 3.79Å; I260-Y545 HydrophobicContact CG2-CD2 3.94Å; I260-Y545 HydrophobicContact CG2-CE1 4.46Å; I260-Y545 HydrophobicContact CG2-CG 3.48Å; I260-Y545 VanDerWaalsContact CG2-CG 3.48Å; D261-Y545 WeakPolarHBondContact OD1-CE2 3.34Å; M541-Y545 WeakPolarHBondContact O-CB 3.41Å; M541-Y545 PolarHBondContact O-N 2.93Å; M541-Y545 VanDerWaalsContact O-N 3.08Å; V542-Y545 PolarHBondContact O-N 3.26Å; Q543-Y545 VanDerWaalsContact C-N 3.33Å; Q543-Y545 PolarHBondContact O-N 3.24Å; Y545-A547 VanDerWaalsContact C-N 3.29Å; Y545-A547 PolarHBondContact O-N 3.31Å; Y545-N548 WeakPolarHBondContact O-CA 3.41Å; Y545-N548 PolarHBondContact O-N 2.82Å
546	A	89.5	Confident	87.5	Confident	80 Å²	80	28.1 Å²	28.1	66%	0.661	16%	0.159	S	C	*	.	H	α-helix	trans	-60.9	-35.4	175.6	0	0	0	0	0	112.8	V542 Q543 N548	V542-A546 PolarHBondContact O-N 2.99Å; V542-A546 VanDerWaalsContact O-N 3.13Å; Q543-A546 PolarHBondContact O-N 2.97Å; A546-N548 PolarHBondContact O-N 3.4Å
547	A	88.5	Confident	85.7	Confident	33 Å²	33	32.3 Å²	32.3	27%	0.273	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	4.7	173.9	0	0	0	0	0	114.3	N161 Q543 A544 Y545 V549 F818	N161-A547 PolarHBondContact ND2-O 2.95Å; Q543-A547 WeakPolarHBondContact O-CB 3.49Å; Q543-A547 PolarHBondContact O-N 2.93Å; A544-A547 CarbonylContact O-C 3.4Å; A544-A547 PolarHBondContact O-N 3.05Å; Y545-A547 VanDerWaalsContact C-N 3.29Å; Y545-A547 PolarHBondContact O-N 3.31Å; A547-V549 HydrophobicContact CB-CG2 3.89Å; A547-V549 PolarHBondContact O-N 3.16Å; A547-V549 VanDerWaalsContact O-N 3.16Å; A547-F818 HydrophobicContact CB-CB 3.83Å
548	N	91.5	Very high	83.7	Confident	56 Å²	56	33.6 Å²	33.6	30%	0.299	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	27.7	-172.6	-162	51.7	0	0	0	114.8	S159 K160 N161 A544 Y545 A546	S159-N548 PolarHBondContact O-ND2 2.84Å; S159-N548 VanDerWaalsContact O-ND2 3.14Å; K160-N548 WeakPolarHBondContact CD-O 3.46Å; K160-N548 WeakPolarHBondContact CD-OD1 3.2Å; K160-N548 WeakPolarHBondContact CE-OD1 3.47Å; K160-N548 PolarHBondContact NZ-OD1 3.06Å; N161-N548 WeakPolarHBondContact CB-O 3.42Å; N161-N548 PolarHBondContact N-O 2.86Å; A544-N548 PolarHBondContact O-N 3.09Å; Y545-N548 WeakPolarHBondContact O-CA 3.41Å; Y545-N548 PolarHBondContact O-N 2.82Å; A546-N548 PolarHBondContact O-N 3.4Å
549	V	91.8	Very high	81.2	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.012	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-83.2	131.2	174.2	179.6	0	0	0	0	108.7	N161 L163 A544 A547 F818	N161-V549 HydrophobicContact CB-CG2 4.28Å; N161-V549 WeakPolarHBondContact O-CA 3.43Å; L163-V549 HydrophobicContact CD1-CG1 4.02Å; L163-V549 HydrophobicContact CG-CG1 4.14Å; A544-V549 HydrophobicContact CB-CB 4.23Å; A544-V549 PolarHBondContact O-N 3.15Å; A547-V549 HydrophobicContact CB-CG2 3.89Å; A547-V549 PolarHBondContact O-N 3.16Å; A547-V549 VanDerWaalsContact O-N 3.16Å; V549-F818 HydrophobicContact CG2-CD1 4.3Å; V549-F818 HydrophobicContact CG2-CG 4.43Å
550	I	92.5	Very high	78.3	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.015	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-64.2	140.5	170.4	-164.1	78.1	0	0	0	109.4	Y127 K160 N161 D162 Y176 R248 E249 P552	Y127-I550 HydrophobicContact CD2-CD1 3.5Å; Y127-I550 HydrophobicContact CE2-CD1 3.96Å; Y127-I550 HydrophobicContact CG-CD1 4.06Å; K160-I550 HydrophobicContact CB-CB 4.21Å; K160-I550 HydrophobicContact CB-CD1 4.38Å; K160-I550 HydrophobicContact CD-CD1 4.49Å; K160-I550 HydrophobicContact CG-CD1 4.02Å; N161-I550 PolarHBondContact O-N 2.81Å; D162-I550 HydrophobicContact CB-CG2 3.88Å; Y176-I550 HydrophobicContact CD2-CD1 4.36Å; Y176-I550 HydrophobicContact CE2-CD1 4.16Å; Y176-I550 HydrophobicContact CE2-CG1 4.27Å; R248-I550 HydrophobicContact CB-CD1 3.88Å; R248-I550 HydrophobicContact CB-CG1 3.78Å; R248-I550 HydrophobicContact CG-CD1 4.3Å; R248-I550 HydrophobicContact CG-CG1 3.82Å; E249-I550 WeakPolarHBondContact OE1-CD1 3.32Å; I550-P552 WeakPolarHBondContact O-CD 3.35Å
551	F	92.4	Very high	75.5	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-75.4	127.3	174.3	-50	-19.5	0	0	0	109.9	E249 V252 I260 M541 A544 W896	E249-F551 HydrophobicContact CG-CB 3.61Å; E249-F551 HydrophobicContact CG-CD2 3.59Å; E249-F551 HydrophobicContact CG-CE2 4.4Å; E249-F551 HydrophobicContact CG-CG 3.73Å; E249-F551 PolarHBondContact OE1-N 3.18Å; V252-F551 HydrophobicContact CG2-CD2 3.87Å; V252-F551 HydrophobicContact CG2-CE2 4.11Å; I260-F551 HydrophobicContact CD1-CE2 4.45Å; I260-F551 HydrophobicContact CD1-CZ 4.4Å; M541-F551 HydrophobicContact CB-CD2 4.44Å; M541-F551 HydrophobicContact CB-CE1 4.3Å; M541-F551 HydrophobicContact CB-CE2 3.9Å; M541-F551 HydrophobicContact CB-CZ 3.82Å; M541-F551 HydrophobicContact CE-CD2 4.01Å; M541-F551 HydrophobicContact CE-CE2 3.71Å; M541-F551 HydrophobicContact CG-CD2 4.02Å; M541-F551 HydrophobicContact CG-CE2 3.97Å; M541-F551 HydrophobicContact CG-CG 4.4Å; M541-F551 HydrophobicContact CG-CZ 4.28Å; M541-F551 WeakPolarHBondContact O-CE1 3.35Å; M541-F551 WeakPolarHBondContact O-CZ 3.45Å; A544-F551 HydrophobicContact CB-CD1 3.87Å; A544-F551 HydrophobicContact CB-CE1 3.82Å; F551-W896 HydrophobicContact CD1-CH2 4.5Å; F551-W896 HydrophobicContact CD1-CZ2 4.46Å
552	P	86.7	Confident	72.6	Confident	21 Å²	21	47.9 Å²	47.9	14%	0.136	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-63	158.1	168.4	19.3	-22.4	0	0	0	110.8	I550 R895 W896	I550-P552 WeakPolarHBondContact O-CD 3.35Å; P552-R895 HydrophobicContact CG-CB 4.12Å; P552-R895 WeakPolarHBondContact CG-O 3.41Å; P552-R895 WeakPolarHBondContact O-CD 3.32Å; P552-R895 WeakPolarHBondContact O-CG 3.46Å; P552-R895 PolarHBondContact O-NH1 3.47Å; P552-W896 HydrophobicContact CG-CD2 4.42Å; P552-W896 HydrophobicContact CG-CG 4.29Å; P552-W896 HydrophobicContact CG-CZ2 4.48Å
553	H	81.7	Confident	69.6	Low	58 Å²	58	54.6 Å²	54.6	27%	0.269	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-59	151.6	171.4	-54.7	79.6	0	0	0	109.5	D246 L247 R248 Q555	D246-H553 IonicContact OD1-CE1 2.98Å; D246-H553 PolarHBondContact OD1-CE1 2.94Å; D246-H553 IonicContact OD1-NE2 2.7Å; D246-H553 PolarHBondContact OD1-NE2 2.88Å; D246-H553 IonicContact OD2-CE1 3.29Å; D246-H553 PolarHBondContact OD2-CE1 3.13Å; D246-H553 VanDerWaalsContact OD2-CE1 3.28Å; D246-H553 IonicContact OD2-NE2 3.66Å; L247-H553 PolarHBondContact O-NE2 2.86Å; R248-H553 PolarHBondContact NH1-ND1 2.65Å; H553-Q555 PolarHBondContact O-N 3.24Å
554	K	80.6	Confident	66.6	Low	53 Å²	53	56.9 Å²	56.9	23%	0.23	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-62.5	129.5	166.5	-72.7	173.9	169.3	-70.3	0	108.1	D251 E537 T556 R895	D251-K554 WeakPolarHBondContact OD2-CD 3.39Å; D251-K554 WeakPolarHBondContact OD2-CE 3.05Å; E537-K554 IonicContact OE1-NZ 2.92Å; E537-K554 PolarHBondContact OE1-NZ 2.89Å; E537-K554 IonicContact OE2-NZ 3.85Å; E537-K554 PolarHBondContact OE2-NZ 2.88Å; K554-T556 PolarHBondContact O-N 2.81Å; K554-R895 HydrophobicContact CG-CG 3.89Å
555	Q	65.7	Low	63.5	Low	49 Å²	49	62 Å²	62	23%	0.229	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-53.6	136	166.3	-163.2	66.7	46.3	0	0	107.9	H553 R892 G893 A894 Y897	H553-Q555 PolarHBondContact O-N 3.24Å; Q555-R892 CarbonylContact C-O 3.57Å; Q555-R892 VanDerWaalsContact C-O 3.22Å; Q555-R892 WeakPolarHBondContact CB-O 3.4Å; Q555-G893 WeakPolarHBondContact O-CA 3.46Å; Q555-A894 WeakPolarHBondContact CB-O 3.43Å; Q555-A894 PolarHBondContact N-O 2.78Å; Q555-Y897 HydrophobicContact CB-CG 4.29Å; Q555-Y897 HydrophobicContact CG-CD1 4.25Å; Q555-Y897 HydrophobicContact CG-CD2 4.43Å; Q555-Y897 HydrophobicContact CG-CG 4.03Å
556	T	56	Low	60.3	Low	75 Å²	75	63.7 Å²	63.7	46%	0.46	38%	0.38	S	S	.	.			trans	-138.1	156.8	172.6	49.5	0	0	0	0	106.9	K554 G558 E559	K554-T556 PolarHBondContact O-N 2.81Å; T556-G558 PolarHBondContact O-N 2.79Å; T556-E559 PolarHBondContact O-N 3.39Å
557	D	51.7	Low	57.2	Low	88 Å²	88	67.7 Å²	67.7	47%	0.471	39%	0.39	S	S	.	.	S	Bend	trans	-70.4	16.1	-168.3	-70.8	-14	0	0	0	114.4	S573 R892	D557-S573 WeakPolarHBondContact O-CB 3.4Å; D557-R892 WeakPolarHBondContact OD1-CD 3.25Å; D557-R892 IonicContact OD1-NH1 2.86Å; D557-R892 IonicContact OD2-CZ 2.65Å; D557-R892 IonicContact OD2-NH1 3.32Å; D557-R892 PolarHBondContact OD2-NH1 2.95Å
558	G	49	Very low	54.6	Low	41 Å²	41	68.6 Å²	68.6	42%	0.423	39%	0.394	S	S	.	.	S	Bend	trans	-122	-41.6	176.5	0	0	0	0	0	116.1	T556 S560 S573	T556-G558 PolarHBondContact O-N 2.79Å; G558-S560 PolarHBondContact O-N 2.91Å; G558-S560 VanDerWaalsContact O-N 3.14Å; G558-S573 PolarHBondContact O-OG 3.35Å
559	E	38.4	Very low	51.9	Low	112 Å²	112	71.8 Å²	71.8	52%	0.523	41%	0.411	S	S	.	.			trans	-93.9	53.4	-163.2	-62.1	-168.5	-177.5	0	0	114.1	T556 G561	T556-E559 PolarHBondContact O-N 3.39Å; E559-G561 VanDerWaalsContact C-N 3.32Å; E559-G561 PolarHBondContact O-N 2.77Å
560	S	31.4	Very low	49.5	Very low	40 Å²	40	72.3 Å²	72.3	28%	0.28	42%	0.415	S	S	.	.			trans	-81.9	55.4	-177.5	-74.8	0	0	0	0	115.6	G558	G558-S560 PolarHBondContact O-N 2.91Å; G558-S560 VanDerWaalsContact O-N 3.14Å
561	G	34.1	Very low	47.2	Very low	50 Å²	50	73.5 Å²	73.5	52%	0.515	43%	0.427	S	S	.	.			trans	79.3	161.2	164.5	0	0	0	0	0	117.2	E559 N563	E559-G561 VanDerWaalsContact C-N 3.32Å; E559-G561 PolarHBondContact O-N 2.77Å; G561-N563 VanDerWaalsContact C-N 3.28Å; G561-N563 PolarHBondContact O-N 2.93Å; G561-N563 VanDerWaalsContact O-N 3.11Å
562	P	33.1	Very low	44.8	Very low	111 Å²	111	75.1 Å²	75.1	72%	0.721	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	3.3	-164.5	30.8	-37.6	0	0	0	116.4	L565	P562-L565 WeakPolarHBondContact O-CD1 3.47Å
563	N	29.1	Very low	42.8	Very low	152 Å²	152	76.8 Å²	76.8	81%	0.813	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	1.2	-175.4	-70.8	7.2	0	0	0	114.5	G561	G561-N563 VanDerWaalsContact C-N 3.28Å; G561-N563 PolarHBondContact O-N 2.93Å; G561-N563 VanDerWaalsContact O-N 3.11Å
564	N	29.5	Very low	41.4	Very low	105 Å²	105	74.9 Å²	74.9	56%	0.561	44%	0.444	S	S	*	.			trans	-106.6	32.6	-178	-92.3	-1.3	0	0	0	113.9	L566	N564-L566 VanDerWaalsContact C-N 3.3Å; N564-L566 PolarHBondContact O-N 3.01Å
565	L	28.3	Very low	40.5	Very low	106 Å²	106	76.7 Å²	76.7	56%	0.555	45%	0.452	S	S	*	.			trans	-78.5	69.3	-178.4	-82.7	144.3	0	0	0	113.4	S206 P562	S206-L565 VanDerWaalsContact CB-CD1 3.45Å; P562-L565 WeakPolarHBondContact O-CD1 3.47Å
566	L	25.1	Very low	40.9	Very low	102 Å²	102	76.6 Å²	76.6	53%	0.534	45%	0.451	S	S	.	.	S	Bend	trans	-132	72.4	167.4	-88.5	171.7	0	0	0	112.1	N564 Y742	N564-L566 VanDerWaalsContact C-N 3.3Å; N564-L566 PolarHBondContact O-N 3.01Å; L566-Y742 PolarHBondContact O-OH 2.72Å
567	L	25.1	Very low	41.9	Very low	165 Å²	165	73.7 Å²	73.7	86%	0.864	43%	0.433	S	S	*	.	S	Bend	trans	44.3	76.8	145.3	-64.5	171.4	0	0	0	118.4
568	S	32.1	Very low	42.8	Very low	52 Å²	52	79.3 Å²	79.3	36%	0.364	46%	0.457	S	S	.	.			trans	-147.3	125	138.7	40.4	0	0	0	0	108.4	S570	S568-S570 PolarHBondContact O-N 2.98Å
569	D	36	Very low	44.1	Very low	122 Å²	122	81 Å²	81	65%	0.652	46%	0.456	S	S	*	.			trans	-90.9	29.2	-174.8	-168.1	13	0	0	0	112.3	R777	D569-R777 IonicContact OD1-CZ 3.83Å; D569-R777 IonicContact OD1-NH2 2.7Å; D569-R777 PolarHBondContact OD1-NH2 2.84Å
570	S	40.5	Very low	46	Very low	14 Å²	14	76.2 Å²	76.2	10%	0.098	44%	0.437	C	S	.	.	S	Bend	trans	-114.2	166.3	-165.6	60.2	0	0	0	0	111.5	S568 I572 E784	S568-S570 PolarHBondContact O-N 2.98Å; S570-I572 PolarHBondContact O-N 2.87Å; S570-I572 VanDerWaalsContact O-N 3.12Å; S570-E784 WeakPolarHBondContact CB-OE1 3.3Å; S570-E784 WeakPolarHBondContact CB-OE2 3.45Å; S570-E784 PolarHBondContact OG-OE1 2.84Å; S570-E784 PolarHBondContact OG-OE2 3.48Å
571	G	44.9	Very low	48.4	Very low	27 Å²	27	76.6 Å²	76.6	28%	0.278	43%	0.434	S	S	.	.	S	Bend	trans	-70.2	-8.2	-165.8	0	0	0	0	0	116.1
572	I	41.3	Very low	50.6	Low	35 Å²	35	74.4 Å²	74.4	18%	0.179	41%	0.411	C	S	.	.			trans	-108.1	81.5	175.3	-57.4	-148.7	0	0	0	110.8	S570 G574 A781 E784 K785	S570-I572 PolarHBondContact O-N 2.87Å; S570-I572 VanDerWaalsContact O-N 3.12Å; I572-G574 PolarHBondContact O-N 3.26Å; I572-A781 HydrophobicContact CG1-CB 4.5Å; I572-E784 HydrophobicContact CB-CB 4.3Å; I572-E784 HydrophobicContact CD1-CB 4.26Å; I572-E784 WeakPolarHBondContact CD1-O 3.29Å; I572-E784 HydrophobicContact CG1-CB 3.89Å; I572-E784 PolarHBondContact N-OE2 3.12Å; I572-K785 HydrophobicContact CD1-CB 4.17Å
573	S	44.5	Very low	52.8	Low	55 Å²	55	70 Å²	70	39%	0.385	38%	0.381	S	S	.	.			trans	-74.3	51.8	163.1	-164.7	0	0	0	0	110.5	D557 G558 K575	D557-S573 WeakPolarHBondContact O-CB 3.4Å; G558-S573 PolarHBondContact O-OG 3.35Å; S573-K575 PolarHBondContact O-N 3.34Å
574	G	54	Low	55.2	Low	19 Å²	19	64 Å²	64	20%	0.196	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-70.4	121.8	179.1	0	0	0	0	0	109.9	I572 F576 L582	I572-G574 PolarHBondContact O-N 3.26Å; G574-F576 PolarHBondContact O-N 3.19Å; G574-L582 VanDerWaalsContact O-CD1 3.28Å; G574-L582 WeakPolarHBondContact O-CD1 3.33Å
575	K	61.6	Low	57.5	Low	91 Å²	91	60.5 Å²	60.5	40%	0.396	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-65.4	134.7	173.7	-68.2	-176.9	-179.6	-176.4	0	109.1	S573 I583	S573-K575 PolarHBondContact O-N 3.34Å; K575-I583 HydrophobicContact CB-CD1 4.15Å; K575-I583 WeakPolarHBondContact O-CB 3.47Å; K575-I583 WeakPolarHBondContact O-CD1 3.45Å; K575-I583 VanDerWaalsContact O-CG1 3.23Å; K575-I583 WeakPolarHBondContact O-CG1 3.4Å; K575-I583 PolarHBondContact O-N 2.81Å; K575-I583 VanDerWaalsContact O-N 3.1Å
576	F	74	Confident	60	Low	46 Å²	46	58.4 Å²	58.4	20%	0.202	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-82.1	152.1	166.8	-64.8	-83	0	0	0	110.3	G574 G580 H581 L582 R738 V741 Y742	G574-F576 PolarHBondContact O-N 3.19Å; F576-G580 WeakPolarHBondContact CD1-O 3.29Å; F576-H581 CarbonylContact C-O 3.56Å; F576-H581 VanDerWaalsContact CA-O 3.29Å; F576-H581 WeakPolarHBondContact CA-O 3.49Å; F576-L582 HydrophobicContact CD1-CB 4.01Å; F576-L582 HydrophobicContact CD1-CD1 4.01Å; F576-L582 HydrophobicContact CE1-CB 3.79Å; F576-L582 HydrophobicContact CE1-CD1 3.67Å; F576-L582 HydrophobicContact CE1-CG 4.29Å; F576-L582 HydrophobicContact CE2-CD1 4.2Å; F576-L582 HydrophobicContact CG-CD1 4.43Å; F576-L582 HydrophobicContact CZ-CD1 3.78Å; F576-R738 HydrophobicContact CD1-CB 3.6Å; F576-R738 HydrophobicContact CD1-CG 3.91Å; F576-R738 HydrophobicContact CD2-CB 4.49Å; F576-R738 HydrophobicContact CD2-CG 3.91Å; F576-R738 VanDerWaalsContact CE1-CA 3.48Å; F576-R738 HydrophobicContact CE1-CB 3.63Å; F576-R738 HydrophobicContact CE1-CG 3.81Å; F576-R738 HydrophobicContact CE2-CG 3.81Å; F576-R738 HydrophobicContact CG-CB 4.04Å; F576-R738 HydrophobicContact CG-CG 3.95Å; F576-R738 HydrophobicContact CZ-CB 4.11Å; F576-R738 HydrophobicContact CZ-CG 3.75Å; F576-V741 HydrophobicContact CE1-CB 3.85Å; F576-V741 HydrophobicContact CE1-CG1 4.01Å; F576-V741 HydrophobicContact CE1-CG2 4Å; F576-V741 HydrophobicContact CZ-CB 3.86Å; F576-V741 HydrophobicContact CZ-CG1 3.62Å; F576-V741 HydrophobicContact CZ-CG2 4.46Å; F576-Y742 HydrophobicContact CE2-CE1 4.36Å
577	T	77.4	Confident	62.9	Low	14 Å²	14	56.1 Å²	56.1	9%	0.086	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-73.6	169.1	164.8	65.3	0	0	0	0	111.1	D579 G580 H581 I583 W729 L733	T577-D579 VanDerWaalsContact C-N 3.28Å; T577-D579 WeakPolarHBondContact CB-OD1 3.39Å; T577-D579 PolarHBondContact O-N 2.91Å; T577-D579 VanDerWaalsContact OG1-CG 3.24Å; T577-D579 PolarHBondContact OG1-OD1 3.38Å; T577-G580 WeakPolarHBondContact O-CA 3.49Å; T577-G580 PolarHBondContact O-N 2.94Å; T577-G580 PolarHBondContact OG1-N 2.78Å; T577-H581 PolarHBondContact N-O 3.48Å; T577-H581 PolarHBondContact OG1-N 2.85Å; T577-I583 HydrophobicContact CG2-CD1 4.38Å; T577-I583 HydrophobicContact CG2-CG1 4.21Å; T577-W729 HydrophobicContact CG2-CH2 3.94Å; T577-L733 HydrophobicContact CG2-CD1 4.08Å; T577-L733 HydrophobicContact CG2-CD2 3.74Å
578	E	69.9	Low	65.8	Low	207 Å²	207	49.9 Å²	49.9	97%	0.967	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-34.7	178.6	-63.5	179.1	173.5	0	0	112.3	G580	E578-G580 PolarHBondContact O-N 3.38Å
579	D	75.9	Confident	68.1	Low	76 Å²	76	49 Å²	49	41%	0.406	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	1.9	169.8	61.3	-62.3	0	0	0	113.8	T577 H581 R803	T577-D579 VanDerWaalsContact C-N 3.28Å; T577-D579 WeakPolarHBondContact CB-OD1 3.39Å; T577-D579 PolarHBondContact O-N 2.91Å; T577-D579 VanDerWaalsContact OG1-CG 3.24Å; T577-D579 PolarHBondContact OG1-OD1 3.38Å; D579-H581 IonicContact OD2-CE1 2.72Å; D579-H581 PolarHBondContact OD2-CE1 3.16Å; D579-H581 IonicContact OD2-CG 3.11Å; D579-H581 IonicContact OD2-ND1 3.37Å; D579-H581 PolarHBondContact OD2-ND1 2.85Å; D579-R803 IonicContact OD1-CZ 2.69Å; D579-R803 IonicContact OD1-NH1 2.65Å; D579-R803 PolarHBondContact OD1-NH1 3.25Å; D579-R803 IonicContact OD1-NH2 3.53Å; D579-R803 PolarHBondContact OD1-NH2 3.16Å; D579-R803 IonicContact OD2-CZ 3.51Å; D579-R803 IonicContact OD2-NH1 2.65Å; D579-R803 PolarHBondContact OD2-NH1 2.79Å
580	G	78.4	Confident	69.9	Low	12 Å²	12	44.4 Å²	44.4	12%	0.124	25%	0.249	C	C	.	.			trans	91.2	11.9	166.3	0	0	0	0	0	117.1	F576 T577 E578 S737 R738	F576-G580 WeakPolarHBondContact CD1-O 3.29Å; T577-G580 WeakPolarHBondContact O-CA 3.49Å; T577-G580 PolarHBondContact O-N 2.94Å; T577-G580 PolarHBondContact OG1-N 2.78Å; E578-G580 PolarHBondContact O-N 3.38Å; G580-S737 CarbonylContact O-C 3.52Å; G580-S737 WeakPolarHBondContact O-CA 3.34Å; G580-R738 WeakPolarHBondContact O-CB 3.49Å; G580-R738 PolarHBondContact O-N 3.25Å
581	H	81.1	Confident	71.4	Confident	48 Å²	48	46.2 Å²	46.2	22%	0.222	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	140.8	177.8	-68.8	95.3	0	0	0	112	F576 T577 D579 L733 T735	F576-H581 CarbonylContact C-O 3.56Å; F576-H581 VanDerWaalsContact CA-O 3.29Å; F576-H581 WeakPolarHBondContact CA-O 3.49Å; T577-H581 PolarHBondContact N-O 3.48Å; T577-H581 PolarHBondContact OG1-N 2.85Å; D579-H581 IonicContact OD2-CE1 2.72Å; D579-H581 PolarHBondContact OD2-CE1 3.16Å; D579-H581 IonicContact OD2-CG 3.11Å; D579-H581 IonicContact OD2-ND1 3.37Å; D579-H581 PolarHBondContact OD2-ND1 2.85Å; H581-L733 HydrophobicContact CB-CB 4.41Å; H581-L733 HydrophobicContact CB-CD1 4.07Å; H581-T735 PolarHBondContact CD2-O 3.24Å
582	L	80.6	Confident	72.8	Confident	4 Å²	4	51 Å²	51	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	133.8	-179.6	-173.6	70.4	0	0	0	111.5	G574 F576 L733 W734 A736 V741 I788	G574-L582 VanDerWaalsContact O-CD1 3.28Å; G574-L582 WeakPolarHBondContact O-CD1 3.33Å; F576-L582 HydrophobicContact CD1-CB 4.01Å; F576-L582 HydrophobicContact CD1-CD1 4.01Å; F576-L582 HydrophobicContact CE1-CB 3.79Å; F576-L582 HydrophobicContact CE1-CD1 3.67Å; F576-L582 HydrophobicContact CE1-CG 4.29Å; F576-L582 HydrophobicContact CE2-CD1 4.2Å; F576-L582 HydrophobicContact CG-CD1 4.43Å; F576-L582 HydrophobicContact CZ-CD1 3.78Å; L582-L733 CarbonylContact O-C 3.55Å; L582-L733 WeakPolarHBondContact O-CA 3.33Å; L582-W734 HydrophobicContact CB-CB 4.28Å; L582-W734 HydrophobicContact CB-CG 4.4Å; L582-W734 HydrophobicContact CD2-CG 4.37Å; L582-W734 PolarHBondContact O-N 3.3Å; L582-A736 PolarHBondContact N-O 3.29Å; L582-V741 HydrophobicContact CB-CG2 4.2Å; L582-V741 HydrophobicContact CD2-CG1 4.17Å; L582-V741 HydrophobicContact CD2-CG2 4.24Å; L582-I788 HydrophobicContact CD2-CD1 3.65Å
583	I	79.5	Confident	74.7	Confident	19 Å²	19	50.2 Å²	50.2	10%	0.097	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	119.9	176.9	-60.5	164.9	0	0	0	110.3	K575 T577 Q586 W729 A731 L733	K575-I583 HydrophobicContact CB-CD1 4.15Å; K575-I583 WeakPolarHBondContact O-CB 3.47Å; K575-I583 WeakPolarHBondContact O-CD1 3.45Å; K575-I583 VanDerWaalsContact O-CG1 3.23Å; K575-I583 WeakPolarHBondContact O-CG1 3.4Å; K575-I583 PolarHBondContact O-N 2.81Å; K575-I583 VanDerWaalsContact O-N 3.1Å; T577-I583 HydrophobicContact CG2-CD1 4.38Å; T577-I583 HydrophobicContact CG2-CG1 4.21Å; I583-Q586 HydrophobicContact CG2-CB 3.76Å; I583-Q586 HydrophobicContact CG2-CG 3.77Å; I583-W729 HydrophobicContact CD1-CZ2 3.9Å; I583-W729 HydrophobicContact CG1-CZ2 4.29Å; I583-A731 HydrophobicContact CG2-CB 4.28Å; I583-L733 HydrophobicContact CB-CD2 4.23Å; I583-L733 HydrophobicContact CG1-CD2 3.49Å; I583-L733 VanDerWaalsContact CG1-CD2 3.49Å
584	D	78.7	Confident	76.5	Confident	26 Å²	26	49.2 Å²	49.2	14%	0.139	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-48.4	170.3	-173.5	45.4	0	0	0	111.9	E732 W734 K785 H800	D584-E732 WeakPolarHBondContact CB-O 3.25Å; D584-E732 PolarHBondContact N-O 3.16Å; D584-W734 HydrophobicContact CB-CD2 4.18Å; D584-W734 HydrophobicContact CB-CG 4.39Å; D584-W734 HydrophobicContact CB-CZ2 3.99Å; D584-W734 VanDerWaalsContact OD1-CZ2 3.22Å; D584-W734 WeakPolarHBondContact OD1-CZ2 3.17Å; D584-K785 WeakPolarHBondContact OD1-CE 3.1Å; D584-K785 IonicContact OD1-NZ 3.75Å; D584-K785 PolarHBondContact OD1-NZ 2.88Å; D584-K785 IonicContact OD2-NZ 3.54Å; D584-K785 PolarHBondContact OD2-NZ 2.76Å; D584-H800 IonicContact OD2-CE1 2.68Å; D584-H800 PolarHBondContact OD2-CE1 3.03Å; D584-H800 VanDerWaalsContact OD2-CE1 3.28Å; D584-H800 IonicContact OD2-NE2 3.6Å
585	S	78.9	Confident	78	Confident	31 Å²	31	48.7 Å²	48.7	22%	0.217	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	135.6	-176.9	130.2	0	0	0	0	107.7	A731 E732	S585-A731 CarbonylContact O-C 3.56Å; S585-A731 WeakPolarHBondContact O-CA 3.43Å; S585-A731 WeakPolarHBondContact O-CB 3.48Å; S585-E732 WeakPolarHBondContact CB-OE2 3.25Å; S585-E732 PolarHBondContact N-O 3.35Å; S585-E732 PolarHBondContact O-N 2.91Å; S585-E732 PolarHBondContact OG-OE2 2.91Å
586	Q	80.5	Confident	79.3	Confident	62 Å²	62	45.8 Å²	45.8	29%	0.29	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	146.6	171.3	53.4	167.2	1.5	0	0	110.9	I583 R730 A731 M899	I583-Q586 HydrophobicContact CG2-CB 3.76Å; I583-Q586 HydrophobicContact CG2-CG 3.77Å; Q586-R730 WeakPolarHBondContact CA-O 3.37Å; Q586-A731 HydrophobicContact CB-CB 4.04Å; Q586-M899 HydrophobicContact CB-SD 4.09Å; Q586-M899 HydrophobicContact CG-CE 3.97Å; Q586-M899 HydrophobicContact CG-SD 3.78Å; Q586-M899 WeakPolarHBondContact O-CE 3.32Å
587	T	85.5	Confident	80	Confident	54 Å²	54	46 Å²	46	33%	0.331	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	-177.6	-177.1	-173	0	0	0	0	108.6	R730	T587-R730 HydrophobicContact CG2-CB 4.18Å; T587-R730 HydrophobicContact CG2-CG 4.29Å; T587-R730 PolarHBondContact N-O 3.38Å; T587-R730 PolarHBondContact O-N 3.02Å
588	Y	86.4	Confident	80.7	Confident	33 Å²	33	46 Å²	46	13%	0.129	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	166.6	165.8	55.3	-94.9	0	0	0	111.2	T728 M890 A902 C906	Y588-T728 CarbonylContact C-O 3.46Å; Y588-T728 WeakPolarHBondContact CA-O 3.49Å; Y588-T728 WeakPolarHBondContact CB-O 3.38Å; Y588-M890 HydrophobicContact CE1-CB 4.33Å; Y588-M890 HydrophobicContact CE1-CG 4.49Å; Y588-M890 HydrophobicContact CE1-SD 3.53Å; Y588-M890 VanDerWaalsContact CE1-SD 3.53Å; Y588-M890 PolarHBondContact OH-SD 3.02Å; Y588-A902 HydrophobicContact CD1-CB 3.92Å; Y588-A902 HydrophobicContact CE1-CB 3.4Å; Y588-C906 HydrophobicContact CD2-CB 3.66Å; Y588-C906 HydrophobicContact CE2-CB 3.46Å; Y588-C906 VanDerWaalsContact CE2-CB 3.46Å; Y588-C906 WeakPolarHBondContact CE2-SG 3.46Å
589	V	79.5	Confident	81.8	Confident	35 Å²	35	36.2 Å²	36.2	21%	0.212	21%	0.211	C	C	.	.			trans	-103.2	127.7	170.3	-172.6	0	0	0	0	109.6	T728 R730 T804	V589-T728 HydrophobicContact CB-CG2 3.8Å; V589-T728 HydrophobicContact CG2-CG2 3.83Å; V589-T728 PolarHBondContact N-O 3.07Å; V589-R730 HydrophobicContact CG2-CB 3.66Å; V589-R730 HydrophobicContact CG2-CG 4.46Å; V589-T804 HydrophobicContact CG2-CG2 3.83Å
590	G	75.5	Confident	82.6	Confident	25 Å²	25	32.8 Å²	32.8	26%	0.258	19%	0.193	S	C	.	.			trans	-108.8	-169.3	173.4	0	0	0	0	0	113	H592	G590-H592 PolarHBondContact O-ND1 3.28Å
591	G	71	Confident	83.3	Confident	52 Å²	52	32.3 Å²	32.3	54%	0.536	19%	0.187	S	C	.	.			trans	-61.1	146.3	179.1	0	0	0	0	0	113.4
592	H	74.2	Confident	84	Confident	127 Å²	127	30.3 Å²	30.3	59%	0.588	18%	0.178	S	C	*	.			trans	-95.8	103.4	177.8	-76.6	62.2	0	0	0	110.5	G590 E594	G590-H592 PolarHBondContact O-ND1 3.28Å; H592-E594 PolarHBondContact O-N 3.31Å
593	V	80.8	Confident	84.5	Confident	19 Å²	19	31 Å²	31	12%	0.115	18%	0.184	C	C	.	.			trans	-60	124.9	167.2	176.1	0	0	0	0	109.2	L929 K1023 K1024	V593-L929 VanDerWaalsContact CA-O 3.29Å; V593-L929 WeakPolarHBondContact CA-O 3.49Å; V593-L929 WeakPolarHBondContact CG1-O 3.26Å; V593-K1023 HydrophobicContact CB-CD 4.48Å; V593-K1023 HydrophobicContact CG1-CB 4.06Å; V593-K1023 WeakPolarHBondContact O-CD 3.41Å; V593-K1023 WeakPolarHBondContact O-CE 3.41Å; V593-K1023 VanDerWaalsContact O-CG 3.3Å; V593-K1023 WeakPolarHBondContact O-CG 3.47Å; V593-K1023 PolarHBondContact O-NZ 3.33Å; V593-K1024 HydrophobicContact CG1-CG 3.71Å
594	E	83.7	Confident	85	Confident	34 Å²	34	33.5 Å²	33.5	16%	0.159	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	136.1	178.4	57.6	169.8	-164.2	0	0	113.7	H592 L596 R917 E928 L929 R1021	H592-E594 PolarHBondContact O-N 3.31Å; E594-L596 HydrophobicContact CG-CD2 3.77Å; E594-L596 PolarHBondContact O-N 3.09Å; E594-L596 WeakPolarHBondContact OE1-CD2 3.49Å; E594-R917 IonicContact OE1-NH1 3.97Å; E594-R917 PolarHBondContact OE1-NH1 3.3Å; E594-R917 VanDerWaalsContact OE1-NH1 3.1Å; E594-E928 WeakPolarHBondContact O-CA 3.4Å; E594-L929 HydrophobicContact CG-CD1 4.15Å; E594-L929 PolarHBondContact N-O 3.49Å; E594-L929 PolarHBondContact O-N 3.39Å; E594-R1021 HydrophobicContact CB-CB 4.33Å; E594-R1021 IonicContact OE1-CZ 2.72Å; E594-R1021 IonicContact OE1-NH1 2.72Å; E594-R1021 PolarHBondContact OE1-NH1 3.5Å; E594-R1021 WeakPolarHBondContact OE2-CD 3.47Å; E594-R1021 IonicContact OE2-CZ 3.76Å; E594-R1021 IonicContact OE2-NE 2.83Å; E594-R1021 IonicContact OE2-NH1 3.25Å; E594-R1021 PolarHBondContact OE2-NH1 3.39Å
595	A	85.7	Confident	85.7	Confident	8 Å²	8	32.7 Å²	32.7	7%	0.066	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	119.4	162.8	0	0	0	0	0	109.5	L1012 R1021 L1022	A595-L1012 HydrophobicContact CB-CD2 4.2Å; A595-R1021 WeakPolarHBondContact O-CD 3.43Å; A595-R1021 WeakPolarHBondContact O-CG 3.47Å; A595-L1022 PolarHBondContact N-O 3.02Å
596	L	87.6	Confident	86.2	Confident	30 Å²	30	34.8 Å²	34.8	16%	0.157	21%	0.206	C	C	.	.			trans	-84.9	-37.2	-179.3	-59.6	-178.8	0	0	0	111.5	E594 A926 L927 L929	E594-L596 HydrophobicContact CG-CD2 3.77Å; E594-L596 PolarHBondContact O-N 3.09Å; E594-L596 WeakPolarHBondContact OE1-CD2 3.49Å; L596-A926 HydrophobicContact CD1-CB 3.6Å; L596-L927 PolarHBondContact N-O 2.6Å; L596-L929 HydrophobicContact CD1-CD1 4.42Å; L596-L929 HydrophobicContact CD1-CD2 4.13Å; L596-L929 HydrophobicContact CD1-CG 4.02Å; L596-L929 HydrophobicContact CD2-CD1 4.39Å; L596-L929 HydrophobicContact CD2-CG 4.5Å; L596-L929 HydrophobicContact CG-CG 4.31Å
597	E	89.6	Confident	86.7	Confident	50 Å²	50	32.6 Å²	32.6	23%	0.234	20%	0.197	C	C	.	.			trans	-120.2	163.2	175.2	-58.2	-160.5	169.9	0	0	111.5	F601 R925 L927	E597-F601 HydrophobicContact CB-CE2 4.43Å; E597-F601 HydrophobicContact CB-CZ 3.87Å; E597-F601 VanDerWaalsContact OE2-CE1 3.23Å; E597-F601 WeakPolarHBondContact OE2-CE1 3.43Å; E597-F601 WeakPolarHBondContact OE2-CZ 3.45Å; E597-R925 IonicContact OE1-CZ 2.88Å; E597-R925 IonicContact OE1-NE 3.13Å; E597-R925 PolarHBondContact OE1-NE 2.81Å; E597-R925 IonicContact OE1-NH2 3.92Å; E597-R925 PolarHBondContact OE1-NH2 3.07Å; E597-R925 IonicContact OE2-CZ 2.69Å; E597-R925 VanDerWaalsContact OE2-CZ 3.27Å; E597-R925 IonicContact OE2-NE 3.92Å; E597-R925 IonicContact OE2-NH2 2.66Å; E597-R925 PolarHBondContact OE2-NH2 3.35Å; E597-L927 HydrophobicContact CB-CD2 4.26Å; E597-L927 HydrophobicContact CG-CD2 4.32Å; E597-L927 PolarHBondContact N-O 3.14Å; E597-L927 VanDerWaalsContact N-O 3.16Å
598	A	91	Very high	86.9	Confident	15 Å²	15	38.1 Å²	38.1	12%	0.124	21%	0.212	C	C	.	.			trans	-136.3	139.1	170.3	0	0	0	0	0	108.6	L1012 A1014 L1222	A598-L1012 CarbonylContact C-O 3.49Å; A598-L1012 WeakPolarHBondContact CA-O 3.45Å; A598-A1014 HydrophobicContact CB-CB 3.86Å; A598-L1222 HydrophobicContact CB-CD1 4.1Å
599	G	93.1	Very high	87.2	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.9	176.8	-165.6	0	0	0	0	0	114	L1012	G599-L1012 PolarHBondContact N-O 3.33Å; G599-L1012 PolarHBondContact O-N 3.13Å
600	V	93.1	Very high	87.7	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.018	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124.1	165.3	-179	0	0	0	0	107.9	R602 F1063 L1069 Y1073 Q1223	V600-R602 HydrophobicContact CG1-CG 4.4Å; V600-F1063 HydrophobicContact CB-CD1 4.44Å; V600-F1063 HydrophobicContact CG1-CD1 4.27Å; V600-F1063 HydrophobicContact CG2-CD1 3.3Å; V600-F1063 HydrophobicContact CG2-CE1 3.24Å; V600-F1063 HydrophobicContact CG2-CG 4.38Å; V600-F1063 HydrophobicContact CG2-CZ 4.26Å; V600-L1069 HydrophobicContact CB-CD2 4.13Å; V600-Y1073 HydrophobicContact CG2-CE1 3.95Å; V600-Y1073 HydrophobicContact CG2-CE2 4.36Å; V600-Y1073 PolarHBondContact N-OH 3.4Å; V600-Q1223 PolarHBondContact O-NE2 3.32Å
601	F	94.3	Very high	88.4	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.009	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126.8	176.4	-58.3	-85	0	0	0	107.8	E597 I678 L927 I937 A1009 M1010 L1012	E597-F601 HydrophobicContact CB-CE2 4.43Å; E597-F601 HydrophobicContact CB-CZ 3.87Å; E597-F601 VanDerWaalsContact OE2-CE1 3.23Å; E597-F601 WeakPolarHBondContact OE2-CE1 3.43Å; E597-F601 WeakPolarHBondContact OE2-CZ 3.45Å; F601-I678 WeakPolarHBondContact O-CD1 3.49Å; F601-L927 HydrophobicContact CB-CD1 4.06Å; F601-L927 HydrophobicContact CD1-CD1 4.18Å; F601-L927 HydrophobicContact CD1-CD2 3.85Å; F601-L927 HydrophobicContact CD2-CD1 3.94Å; F601-L927 HydrophobicContact CD2-CD2 4.27Å; F601-L927 HydrophobicContact CE1-CD2 3.62Å; F601-L927 HydrophobicContact CE2-CD1 4.49Å; F601-L927 HydrophobicContact CE2-CD2 4.08Å; F601-L927 HydrophobicContact CG-CD1 3.77Å; F601-L927 HydrophobicContact CG-CD2 4.17Å; F601-L927 HydrophobicContact CZ-CD2 3.75Å; F601-I937 HydrophobicContact CD1-CD1 4.11Å; F601-A1009 CarbonylContact O-C 3.57Å; F601-A1009 WeakPolarHBondContact O-CA 3.31Å; F601-M1010 PolarHBondContact N-O 3.07Å; F601-M1010 PolarHBondContact O-N 2.94Å; F601-L1012 HydrophobicContact CD2-CD1 4.31Å; F601-L1012 HydrophobicContact CE2-CD1 4.07Å
602	R	93.9	Very high	89.5	Confident	7 Å²	7	43.9 Å²	43.9	3%	0.026	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	129.7	-168.1	-109.3	-178.7	72.4	-175.8	-3.8	109.9	V600 D604 I605 P676 K1008 A1009 F1063 R1065 G1066	V600-R602 HydrophobicContact CG1-CG 4.4Å; R602-D604 VanDerWaalsContact CB-OD1 3.3Å; R602-D604 WeakPolarHBondContact CB-OD1 3.36Å; R602-D604 IonicContact CZ-OD1 2.77Å; R602-D604 IonicContact CZ-OD2 2.65Å; R602-D604 IonicContact NE-OD1 3.2Å; R602-D604 PolarHBondContact NE-OD1 3.32Å; R602-D604 IonicContact NE-OD2 3.63Å; R602-D604 PolarHBondContact NE-OD2 2.95Å; R602-D604 IonicContact NH2-OD1 3.63Å; R602-D604 PolarHBondContact NH2-OD1 2.95Å; R602-D604 IonicContact NH2-OD2 3.31Å; R602-D604 PolarHBondContact NH2-OD2 3.18Å; R602-D604 PolarHBondContact O-N 3.32Å; R602-I605 HydrophobicContact CB-CB 4.37Å; R602-I605 HydrophobicContact CB-CD1 3.88Å; R602-I605 HydrophobicContact CB-CG1 4.08Å; R602-I605 HydrophobicContact CG-CD1 4.49Å; R602-I605 PolarHBondContact O-N 2.87Å; R602-P676 WeakPolarHBondContact O-CD 3.2Å; R602-P676 WeakPolarHBondContact O-CG 3.1Å; R602-K1008 WeakPolarHBondContact CA-O 3.3Å; R602-A1009 HydrophobicContact CG-CB 3.61Å; R602-F1063 WeakPolarHBondContact CD-O 3.12Å; R602-F1063 PolarHBondContact NH1-O 3.37Å; R602-R1065 PolarHBondContact NH1-O 2.84Å; R602-G1066 VanDerWaalsContact CZ-O 3.26Å; R602-G1066 PolarHBondContact NH1-O 3.44Å; R602-G1066 PolarHBondContact NH2-O 3.43Å
603	A	91.8	Very high	90.2	Very high	19 Å²	19	40.7 Å²	40.7	16%	0.157	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-13.6	-173.5	0	0	0	0	0	113.9	C675 P676 K1008 F1031	A603-C675 WeakPolarHBondContact O-CB 3.32Å; A603-P676 VanDerWaalsContact CA-O 3.28Å; A603-P676 WeakPolarHBondContact CA-O 3.31Å; A603-K1008 PolarHBondContact N-O 3Å; A603-F1031 HydrophobicContact CB-CE1 4.34Å; A603-F1031 HydrophobicContact CB-CZ 4.04Å
604	D	91.1	Very high	90.6	Very high	70 Å²	70	43.4 Å²	43.4	37%	0.374	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-8.4	178.9	50.3	-8.3	0	0	0	113.9	R602	R602-D604 VanDerWaalsContact CB-OD1 3.3Å; R602-D604 WeakPolarHBondContact CB-OD1 3.36Å; R602-D604 IonicContact CZ-OD1 2.77Å; R602-D604 IonicContact CZ-OD2 2.65Å; R602-D604 IonicContact NE-OD1 3.2Å; R602-D604 PolarHBondContact NE-OD1 3.32Å; R602-D604 IonicContact NE-OD2 3.63Å; R602-D604 PolarHBondContact NE-OD2 2.95Å; R602-D604 IonicContact NH2-OD1 3.63Å; R602-D604 PolarHBondContact NH2-OD1 2.95Å; R602-D604 IonicContact NH2-OD2 3.31Å; R602-D604 PolarHBondContact NH2-OD2 3.18Å; R602-D604 PolarHBondContact O-N 3.32Å
605	I	92.4	Very high	90.9	Very high	10 Å²	10	42.5 Å²	42.5	5%	0.051	23%	0.226	C	C	.	.	S	Bend	trans	-108.7	124.8	-178.9	-56.4	171.7	0	0	0	110.8	R602 V607 P676 L1069	R602-I605 HydrophobicContact CB-CB 4.37Å; R602-I605 HydrophobicContact CB-CD1 3.88Å; R602-I605 HydrophobicContact CB-CG1 4.08Å; R602-I605 HydrophobicContact CG-CD1 4.49Å; R602-I605 PolarHBondContact O-N 2.87Å; I605-V607 PolarHBondContact O-N 3.11Å; I605-P676 WeakPolarHBondContact O-CD 3.42Å; I605-L1069 HydrophobicContact CD1-CD2 4.45Å; I605-L1069 HydrophobicContact CG2-CG 4.08Å
606	P	90.2	Very high	91.1	Very high	74 Å²	74	42.2 Å²	42.2	48%	0.481	22%	0.223	S	C	.	.			trans	-59.6	132	-179.6	-26.1	34.2	0	0	0	114.8	I673	P606-I673 HydrophobicContact CB-CG2 3.89Å
607	V	90.7	Very high	91.3	Very high	17 Å²	17	43.9 Å²	43.9	10%	0.103	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	145.6	179.2	174	0	0	0	0	110.2	I605 F609 I673 E674 P676 I937	I605-V607 PolarHBondContact O-N 3.11Å; V607-F609 HydrophobicContact CB-CE2 4.19Å; V607-F609 HydrophobicContact CG1-CE2 4.36Å; V607-F609 WeakPolarHBondContact O-CD2 3.22Å; V607-I673 WeakPolarHBondContact O-CA 3.22Å; V607-E674 PolarHBondContact N-O 3.14Å; V607-E674 PolarHBondContact O-N 2.89Å; V607-E674 VanDerWaalsContact O-O 3.11Å; V607-P676 HydrophobicContact CB-CG 4.4Å; V607-P676 HydrophobicContact CG2-CB 4.44Å; V607-P676 HydrophobicContact CG2-CG 3.86Å; V607-I937 HydrophobicContact CG1-CD1 3.98Å
608	R	89.5	Confident	91.3	Very high	170 Å²	170	44.3 Å²	44.3	64%	0.642	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	126.1	173.7	-174.6	177.2	176.6	171.1	0.2	111.1	R672 I673	R608-R672 WeakPolarHBondContact CA-O 3.44Å; R608-I673 HydrophobicContact CB-CG1 4.22Å; R608-I673 HydrophobicContact CG-CG1 4.28Å
609	F	92.3	Very high	91.2	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.009	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	149.4	171.9	-67.6	-87.8	0	0	0	111.3	V607 L611 R672 P676 R925 I937 L938 P939	V607-F609 HydrophobicContact CB-CE2 4.19Å; V607-F609 HydrophobicContact CG1-CE2 4.36Å; V607-F609 WeakPolarHBondContact O-CD2 3.22Å; F609-L611 HydrophobicContact CB-CD2 4.13Å; F609-R672 HydrophobicContact CB-CG 3.93Å; F609-R672 PolarHBondContact N-O 3.07Å; F609-R672 PolarHBondContact O-N 3.28Å; F609-R672 VanDerWaalsContact O-N 3.13Å; F609-P676 HydrophobicContact CE2-CB 4.36Å; F609-P676 HydrophobicContact CZ-CB 3.93Å; F609-R925 HydrophobicContact CD1-CG 4.46Å; F609-I937 HydrophobicContact CE1-CD1 4.35Å; F609-I937 HydrophobicContact CE1-CG1 4.29Å; F609-I937 HydrophobicContact CZ-CB 4.42Å; F609-I937 HydrophobicContact CZ-CD1 4.27Å; F609-I937 HydrophobicContact CZ-CG1 4.46Å; F609-L938 VanDerWaalsContact CZ-C 3.48Å; F609-P939 HydrophobicContact CD2-CB 3.91Å; F609-P939 HydrophobicContact CE2-CB 3.91Å; F609-P939 HydrophobicContact CG-CB 4.27Å; F609-P939 HydrophobicContact CZ-CB 4.28Å
610	R	89.9	Confident	91.1	Very high	201 Å²	201	48.2 Å²	48.2	76%	0.758	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.8	85.6	173.4	-179.6	-174.6	174.2	-176.1	-2.1	108.3
611	L	90.6	Very high	90.9	Very high	7 Å²	7	52.4 Å²	52.4	4%	0.037	29%	0.289	C	S	.	.			trans	-76	155.6	-178.8	-45.6	178.6	0	0	0	110.7	F609 P613 L616 L666 P670 Q922 I923 P939	F609-L611 HydrophobicContact CB-CD2 4.13Å; L611-P613 WeakPolarHBondContact O-CD 3.35Å; L611-L616 HydrophobicContact CB-CD1 3.73Å; L611-L616 HydrophobicContact CD1-CD1 3.92Å; L611-L616 HydrophobicContact CG-CD1 4.46Å; L611-L666 HydrophobicContact CD1-CB 4.02Å; L611-L666 HydrophobicContact CD1-CD2 4.24Å; L611-L666 HydrophobicContact CD1-CG 4.5Å; L611-P670 HydrophobicContact CB-CB 4.26Å; L611-P670 PolarHBondContact N-O 3.27Å; L611-P670 WeakPolarHBondContact O-CB 3.23Å; L611-Q922 WeakPolarHBondContact CA-O 3.34Å; L611-I923 VanDerWaalsContact CD2-C 3.5Å; L611-I923 VanDerWaalsContact CD2-O 3.22Å; L611-I923 WeakPolarHBondContact CD2-O 3.3Å; L611-P939 HydrophobicContact CD2-CG 4.47Å
612	V	93.1	Very high	90.7	Very high	56 Å²	56	54 Å²	54	34%	0.339	30%	0.298	S	S	.	.			trans	-97.3	113.1	174.1	178.7	0	0	0	0	109.6	A614 A615 L616 Q922	V612-A614 VanDerWaalsContact C-N 3.29Å; V612-A614 HydrophobicContact CG1-CB 4.32Å; V612-A614 PolarHBondContact O-N 3.32Å; V612-A615 HydrophobicContact CB-CB 4.05Å; V612-A615 HydrophobicContact CG1-CB 4.23Å; V612-A615 WeakPolarHBondContact O-CB 3.18Å; V612-A615 PolarHBondContact O-N 2.82Å; V612-A615 VanDerWaalsContact O-N 3.08Å; V612-L616 PolarHBondContact O-N 3.44Å; V612-Q922 HydrophobicContact CB-CB 4.14Å; V612-Q922 HydrophobicContact CB-CG 4.36Å; V612-Q922 HydrophobicContact CG2-CB 4.06Å; V612-Q922 HydrophobicContact CG2-CG 3.99Å; V612-Q922 PolarHBondContact N-O 2.96Å
613	P	88.8	Confident	90.6	Very high	59 Å²	59	53.7 Å²	53.7	38%	0.383	30%	0.297	S	S	.	.	H	α-helix	trans	-58	-38.7	-176.8	-27.1	35.1	0	0	0	113.8	L611 A615 L616 E617 P670	L611-P613 WeakPolarHBondContact O-CD 3.35Å; P613-A615 VanDerWaalsContact C-N 3.3Å; P613-A615 PolarHBondContact O-N 3.19Å; P613-L616 PolarHBondContact O-N 2.92Å; P613-E617 WeakPolarHBondContact O-CB 3.32Å; P613-E617 WeakPolarHBondContact O-CG 3.13Å; P613-E617 PolarHBondContact O-N 3.46Å; P613-P670 HydrophobicContact CG-CB 3.86Å; P613-P670 HydrophobicContact CG-CG 3.88Å
614	A	90.3	Very high	90.4	Very high	77 Å²	77	57.1 Å²	57.1	64%	0.636	31%	0.308	S	S	*	.	H	α-helix	trans	-63.3	-34.6	178.4	0	0	0	0	0	112.8	V612 A618	V612-A614 VanDerWaalsContact C-N 3.29Å; V612-A614 HydrophobicContact CG1-CB 4.32Å; V612-A614 PolarHBondContact O-N 3.32Å; A614-A618 WeakPolarHBondContact O-CB 3.43Å; A614-A618 PolarHBondContact O-N 3.23Å; A614-A618 VanDerWaalsContact O-N 3.08Å
615	A	89.5	Confident	90.3	Very high	15 Å²	15	57.7 Å²	57.7	12%	0.124	31%	0.305	C	S	.	.	H	α-helix	trans	-68.4	-47.4	174.9	0	0	0	0	0	110.7	V612 P613 E617 A618 L619 Q922	V612-A615 HydrophobicContact CB-CB 4.05Å; V612-A615 HydrophobicContact CG1-CB 4.23Å; V612-A615 WeakPolarHBondContact O-CB 3.18Å; V612-A615 PolarHBondContact O-N 2.82Å; V612-A615 VanDerWaalsContact O-N 3.08Å; P613-A615 VanDerWaalsContact C-N 3.3Å; P613-A615 PolarHBondContact O-N 3.19Å; A615-E617 VanDerWaalsContact C-N 3.32Å; A615-E617 PolarHBondContact O-N 3.21Å; A615-A618 WeakPolarHBondContact O-CB 3.49Å; A615-A618 PolarHBondContact O-N 3.16Å; A615-A618 VanDerWaalsContact O-N 3.16Å; A615-L619 WeakPolarHBondContact O-CG 3.23Å; A615-L619 PolarHBondContact O-N 3.2Å; A615-Q922 HydrophobicContact CB-CB 3.87Å
616	L	91.2	Very high	90	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-36	179.1	-66	170.4	0	0	0	113	L611 V612 P613 L619 R620 L663 L666 A667 I923	L611-L616 HydrophobicContact CB-CD1 3.73Å; L611-L616 HydrophobicContact CD1-CD1 3.92Å; L611-L616 HydrophobicContact CG-CD1 4.46Å; V612-L616 PolarHBondContact O-N 3.44Å; P613-L616 PolarHBondContact O-N 2.92Å; L616-L619 PolarHBondContact O-N 3.15Å; L616-R620 WeakPolarHBondContact O-CB 3.29Å; L616-R620 PolarHBondContact O-N 3.11Å; L616-L663 HydrophobicContact CD2-CD2 4.4Å; L616-L666 HydrophobicContact CD1-CB 3.65Å; L616-L666 HydrophobicContact CD2-CB 4.02Å; L616-L666 HydrophobicContact CD2-CD1 3.85Å; L616-L666 HydrophobicContact CG-CB 4.42Å; L616-A667 HydrophobicContact CB-CB 3.99Å; L616-A667 HydrophobicContact CD1-CB 4.21Å; L616-I923 HydrophobicContact CD2-CG2 4.06Å
617	E	91.1	Very high	89.9	Confident	66 Å²	66	53.7 Å²	53.7	31%	0.308	28%	0.28	S	S	.	.	H	α-helix	trans	-71	-35.5	173.9	-70.9	-66.1	174.7	0	0	112.3	P613 A615 R620 A621 Q664 A667	P613-E617 WeakPolarHBondContact O-CB 3.32Å; P613-E617 WeakPolarHBondContact O-CG 3.13Å; P613-E617 PolarHBondContact O-N 3.46Å; A615-E617 VanDerWaalsContact C-N 3.32Å; A615-E617 PolarHBondContact O-N 3.21Å; E617-R620 VanDerWaalsContact CD-NH2 3.3Å; E617-R620 PolarHBondContact O-N 3.49Å; E617-R620 IonicContact OE1-CZ 3.7Å; E617-R620 IonicContact OE1-NE 2.72Å; E617-R620 IonicContact OE1-NH2 2.66Å; E617-R620 PolarHBondContact OE1-NH2 3.37Å; E617-R620 VanDerWaalsContact OE1-NH2 3.13Å; E617-R620 IonicContact OE2-CZ 2.78Å; E617-R620 IonicContact OE2-NE 3.98Å; E617-R620 PolarHBondContact OE2-NE 3.01Å; E617-R620 IonicContact OE2-NH2 3.45Å; E617-R620 PolarHBondContact OE2-NH2 3.26Å; E617-A621 PolarHBondContact O-N 2.9Å; E617-Q664 PolarHBondContact OE1-NE2 2.99Å; E617-A667 HydrophobicContact CG-CB 4.39Å
618	A	89.6	Confident	89.6	Confident	58 Å²	58	53.2 Å²	53.2	48%	0.479	28%	0.277	S	S	.	.	H	α-helix	trans	-64.5	-44.2	170.1	0	0	0	0	0	111.7	A614 A615 R620 A621 D622	A614-A618 WeakPolarHBondContact O-CB 3.43Å; A614-A618 PolarHBondContact O-N 3.23Å; A614-A618 VanDerWaalsContact O-N 3.08Å; A615-A618 WeakPolarHBondContact O-CB 3.49Å; A615-A618 PolarHBondContact O-N 3.16Å; A615-A618 VanDerWaalsContact O-N 3.16Å; A618-R620 VanDerWaalsContact C-N 3.28Å; A618-R620 PolarHBondContact O-N 2.82Å; A618-A621 PolarHBondContact O-N 3.12Å; A618-D622 PolarHBondContact O-N 3.44Å
619	L	89.6	Confident	89.3	Confident	21 Å²	21	49.5 Å²	49.5	11%	0.11	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-41.2	173.2	-63	-158.7	0	0	0	111.6	A615 L616 D622 V623 L663 I923 F942 L966	A615-L619 WeakPolarHBondContact O-CG 3.23Å; A615-L619 PolarHBondContact O-N 3.2Å; L616-L619 PolarHBondContact O-N 3.15Å; L619-D622 PolarHBondContact O-N 2.98Å; L619-V623 WeakPolarHBondContact O-CG2 3.48Å; L619-V623 PolarHBondContact O-N 2.68Å; L619-V623 VanDerWaalsContact O-N 3.09Å; L619-L663 HydrophobicContact CB-CD1 3.95Å; L619-I923 HydrophobicContact CD1-CG2 3.98Å; L619-F942 HydrophobicContact CD1-CE2 4.32Å; L619-F942 HydrophobicContact CD1-CZ 4.34Å; L619-L966 HydrophobicContact CD1-CD1 4.45Å; L619-L966 HydrophobicContact CD1-CD2 3.65Å; L619-L966 HydrophobicContact CD2-CD1 3.47Å; L619-L966 VanDerWaalsContact CD2-CD1 3.47Å; L619-L966 HydrophobicContact CD2-CD2 4.12Å; L619-L966 HydrophobicContact CD2-CG 4.46Å
620	R	90	Very high	88.9	Confident	78 Å²	78	50.2 Å²	50.2	29%	0.294	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-39.7	179.8	-172.4	171	71.2	139	-15.1	112.4	L616 E617 A618 D622 E660 L663	L616-R620 WeakPolarHBondContact O-CB 3.29Å; L616-R620 PolarHBondContact O-N 3.11Å; E617-R620 VanDerWaalsContact CD-NH2 3.3Å; E617-R620 PolarHBondContact O-N 3.49Å; E617-R620 IonicContact OE1-CZ 3.7Å; E617-R620 IonicContact OE1-NE 2.72Å; E617-R620 IonicContact OE1-NH2 2.66Å; E617-R620 PolarHBondContact OE1-NH2 3.37Å; E617-R620 VanDerWaalsContact OE1-NH2 3.13Å; E617-R620 IonicContact OE2-CZ 2.78Å; E617-R620 IonicContact OE2-NE 3.98Å; E617-R620 PolarHBondContact OE2-NE 3.01Å; E617-R620 IonicContact OE2-NH2 3.45Å; E617-R620 PolarHBondContact OE2-NH2 3.26Å; A618-R620 VanDerWaalsContact C-N 3.28Å; A618-R620 PolarHBondContact O-N 2.82Å; R620-D622 PolarHBondContact O-N 3.03Å; R620-E660 VanDerWaalsContact CD-O 3.25Å; R620-E660 WeakPolarHBondContact CD-O 3.15Å; R620-E660 HydrophobicContact CG-CB 4.25Å; R620-E660 HydrophobicContact CG-CG 4.25Å; R620-L663 HydrophobicContact CB-CB 4.15Å; R620-L663 HydrophobicContact CB-CD1 4.24Å; R620-L663 HydrophobicContact CG-CB 4.46Å
621	A	89.8	Confident	88.5	Confident	91 Å²	91	40.7 Å²	40.7	75%	0.752	23%	0.233	S	C	*	.	H	α-helix	trans	-62.8	-27.4	173.5	0	0	0	0	0	112.3	E617 A618	E617-A621 PolarHBondContact O-N 2.9Å; A618-A621 PolarHBondContact O-N 3.12Å
622	D	89.5	Confident	88	Confident	36 Å²	36	42.3 Å²	42.3	19%	0.193	24%	0.241	C	C	.	.	H	α-helix	trans	-102.1	-6	-170.3	-150.9	38.2	0	0	0	115.6	A618 L619 R620 K624 R625 C626	A618-D622 PolarHBondContact O-N 3.44Å; L619-D622 PolarHBondContact O-N 2.98Å; R620-D622 PolarHBondContact O-N 3.03Å; D622-K624 VanDerWaalsContact C-N 3.28Å; D622-K624 PolarHBondContact O-N 3.49Å; D622-K624 VanDerWaalsContact O-N 3.13Å; D622-R625 WeakPolarHBondContact O-CB 3.29Å; D622-R625 PolarHBondContact O-N 3.17Å; D622-R625 WeakPolarHBondContact OD1-CB 3.45Å; D622-R625 IonicContact OD1-CZ 3.14Å; D622-R625 IonicContact OD1-NE 3.18Å; D622-R625 PolarHBondContact OD1-NE 2.83Å; D622-R625 IonicContact OD1-NH2 2.68Å; D622-R625 PolarHBondContact OD1-NH2 2.81Å; D622-R625 IonicContact OD2-CZ 2.92Å; D622-R625 IonicContact OD2-NE 2.93Å; D622-R625 PolarHBondContact OD2-NE 3.43Å; D622-R625 IonicContact OD2-NH2 2.63Å; D622-R625 PolarHBondContact OD2-NH2 2.9Å; D622-C626 PolarHBondContact O-N 3.47Å; D622-C626 PolarHBondContact O-SG 3.02Å
623	V	90.6	Very high	87.2	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-44.9	-49.5	-177.5	172	0	0	0	0	112.9	L619 R625 C626 I627 C656 V659 E660 L663	L619-V623 WeakPolarHBondContact O-CG2 3.48Å; L619-V623 PolarHBondContact O-N 2.68Å; L619-V623 VanDerWaalsContact O-N 3.09Å; V623-R625 VanDerWaalsContact C-N 3.35Å; V623-R625 PolarHBondContact O-N 2.89Å; V623-C626 PolarHBondContact O-N 3.08Å; V623-I627 HydrophobicContact CG1-CD1 3.68Å; V623-I627 HydrophobicContact CG1-CG1 4.43Å; V623-I627 WeakPolarHBondContact O-CB 3.06Å; V623-I627 WeakPolarHBondContact O-CG1 3.36Å; V623-I627 PolarHBondContact O-N 2.78Å; V623-C656 HydrophobicContact CG1-CB 4.16Å; V623-V659 HydrophobicContact CB-CG1 4.43Å; V623-V659 HydrophobicContact CG1-CB 3.81Å; V623-V659 HydrophobicContact CG1-CG1 3.72Å; V623-V659 HydrophobicContact CG2-CG1 3.77Å; V623-E660 HydrophobicContact CB-CG 3.95Å; V623-E660 HydrophobicContact CG1-CG 4.15Å; V623-E660 HydrophobicContact CG2-CG 3.91Å; V623-L663 HydrophobicContact CG2-CD1 3.55Å
624	K	89	Confident	86.6	Confident	91 Å²	91	46.6 Å²	46.6	40%	0.396	26%	0.264	S	S	.	.	H	α-helix	trans	-65.6	-36	-176.7	-66.3	-175.6	175.4	80.3	0	112.2	D622 S628 C656 E660	D622-K624 VanDerWaalsContact C-N 3.28Å; D622-K624 PolarHBondContact O-N 3.49Å; D622-K624 VanDerWaalsContact O-N 3.13Å; K624-S628 WeakPolarHBondContact O-CB 3.12Å; K624-S628 PolarHBondContact O-N 3.13Å; K624-C656 HydrophobicContact CG-CB 4.02Å; K624-E660 WeakPolarHBondContact CE-OE1 3.18Å; K624-E660 WeakPolarHBondContact CG-OE1 3.36Å; K624-E660 IonicContact NZ-OE1 2.8Å; K624-E660 PolarHBondContact NZ-OE1 3.25Å; K624-E660 IonicContact NZ-OE2 3.24Å; K624-E660 PolarHBondContact NZ-OE2 2.8Å
625	R	88.5	Confident	85.8	Confident	81 Å²	81	45.2 Å²	45.2	31%	0.306	25%	0.245	S	C	.	.	H	α-helix	trans	-69.6	-44.1	175.4	-172.1	173.5	67.9	127.1	4.3	111	D622 V623 R629 D973	D622-R625 WeakPolarHBondContact O-CB 3.29Å; D622-R625 PolarHBondContact O-N 3.17Å; D622-R625 WeakPolarHBondContact OD1-CB 3.45Å; D622-R625 IonicContact OD1-CZ 3.14Å; D622-R625 IonicContact OD1-NE 3.18Å; D622-R625 PolarHBondContact OD1-NE 2.83Å; D622-R625 IonicContact OD1-NH2 2.68Å; D622-R625 PolarHBondContact OD1-NH2 2.81Å; D622-R625 IonicContact OD2-CZ 2.92Å; D622-R625 IonicContact OD2-NE 2.93Å; D622-R625 PolarHBondContact OD2-NE 3.43Å; D622-R625 IonicContact OD2-NH2 2.63Å; D622-R625 PolarHBondContact OD2-NH2 2.9Å; V623-R625 VanDerWaalsContact C-N 3.35Å; V623-R625 PolarHBondContact O-N 2.89Å; R625-R629 PolarHBondContact O-N 3.09Å; R625-D973 IonicContact CZ-OD1 3.36Å; R625-D973 IonicContact CZ-OD2 3.42Å; R625-D973 VanDerWaalsContact CZ-OD2 3.24Å; R625-D973 IonicContact NH1-OD1 3.23Å; R625-D973 PolarHBondContact NH1-OD1 3.29Å; R625-D973 IonicContact NH1-OD2 3.67Å; R625-D973 PolarHBondContact NH1-OD2 3.26Å; R625-D973 IonicContact NH2-OD1 3.66Å; R625-D973 IonicContact NH2-OD2 3.27Å; R625-D973 PolarHBondContact NH2-OD2 3.44Å
626	C	87.2	Confident	84.7	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.007	27%	0.272	C	S	.	.	H	α-helix	trans	-57.5	-50.9	176.1	-59.3	0	0	0	0	112	D622 V623 A630 Y962 I969	D622-C626 PolarHBondContact O-N 3.47Å; D622-C626 PolarHBondContact O-SG 3.02Å; V623-C626 PolarHBondContact O-N 3.08Å; C626-A630 VanDerWaalsContact O-CB 3.3Å; C626-A630 WeakPolarHBondContact O-CB 3.31Å; C626-A630 PolarHBondContact O-N 3.34Å; C626-A630 VanDerWaalsContact O-N 3.08Å; C626-Y962 HydrophobicContact CB-CE2 4.28Å; C626-I969 HydrophobicContact CB-CG1 4.09Å
627	I	87.8	Confident	83.6	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-74.7	-39.6	-174.7	-65.5	177.6	0	0	0	111.5	V623 R629 A630 L631 F652 V659 I946 F948 Y962	V623-I627 HydrophobicContact CG1-CD1 3.68Å; V623-I627 HydrophobicContact CG1-CG1 4.43Å; V623-I627 WeakPolarHBondContact O-CB 3.06Å; V623-I627 WeakPolarHBondContact O-CG1 3.36Å; V623-I627 PolarHBondContact O-N 2.78Å; I627-R629 PolarHBondContact O-N 2.96Å; I627-A630 PolarHBondContact O-N 2.82Å; I627-L631 HydrophobicContact CG2-CD1 4.02Å; I627-L631 WeakPolarHBondContact O-CB 3.27Å; I627-L631 WeakPolarHBondContact O-CG 3.17Å; I627-L631 PolarHBondContact O-N 3.45Å; I627-F652 HydrophobicContact CB-CE2 4.33Å; I627-F652 HydrophobicContact CG2-CD2 4.2Å; I627-F652 HydrophobicContact CG2-CE2 3.74Å; I627-V659 HydrophobicContact CD1-CG2 4.08Å; I627-I946 HydrophobicContact CD1-CD1 4.31Å; I627-F948 HydrophobicContact CG2-CE1 3.98Å; I627-F948 HydrophobicContact CG2-CE2 4.13Å; I627-F948 HydrophobicContact CG2-CZ 3.34Å; I627-Y962 HydrophobicContact CG1-CD2 4.36Å
628	S	84.7	Confident	82.3	Confident	6 Å²	6	53.9 Å²	53.9	4%	0.042	30%	0.303	C	S	.	.	H	α-helix	trans	-58.5	-50.1	176.5	-170.8	0	0	0	0	110.9	K624 L631 Q632 E640	K624-S628 WeakPolarHBondContact O-CB 3.12Å; K624-S628 PolarHBondContact O-N 3.13Å; S628-L631 PolarHBondContact O-N 2.91Å; S628-Q632 WeakPolarHBondContact O-CG 3.47Å; S628-Q632 PolarHBondContact O-N 3.39Å; S628-E640 PolarHBondContact OG-OE1 2.96Å
629	R	82.5	Confident	81.4	Confident	93 Å²	93	56.6 Å²	56.6	35%	0.351	31%	0.31	S	S	.	.	H	α-helix	trans	-69.9	-36.1	-179.2	-69.1	-166	174.2	163.6	-0.8	114.1	R625 I627 L631 Q632 A633 I969 Q972	R625-R629 PolarHBondContact O-N 3.09Å; I627-R629 PolarHBondContact O-N 2.96Å; R629-L631 VanDerWaalsContact C-N 3.31Å; R629-L631 PolarHBondContact O-N 3.34Å; R629-Q632 PolarHBondContact O-N 3.3Å; R629-A633 PolarHBondContact O-N 3.45Å; R629-I969 HydrophobicContact CB-CD1 4.02Å; R629-I969 HydrophobicContact CG-CD1 4.34Å; R629-Q972 VanDerWaalsContact NH1-CD 3.29Å
630	A	82.8	Confident	80.5	Confident	17 Å²	17	60.2 Å²	60.2	14%	0.14	33%	0.326	C	S	.	.	H	α-helix	trans	-64	-37.9	173.8	0	0	0	0	0	111.7	C626 I627 A633 E634 I960 A965	C626-A630 VanDerWaalsContact O-CB 3.3Å; C626-A630 WeakPolarHBondContact O-CB 3.31Å; C626-A630 PolarHBondContact O-N 3.34Å; C626-A630 VanDerWaalsContact O-N 3.08Å; I627-A630 PolarHBondContact O-N 2.82Å; A630-A633 PolarHBondContact O-N 3.36Å; A630-E634 WeakPolarHBondContact O-CG 3.36Å; A630-E634 PolarHBondContact O-N 3.42Å; A630-E634 VanDerWaalsContact O-N 3.07Å; A630-I960 HydrophobicContact CB-CD1 3.73Å; A630-I960 HydrophobicContact CB-CG1 4.3Å; A630-I960 HydrophobicContact CB-CG2 4.01Å; A630-A965 HydrophobicContact CB-CB 3.8Å
631	L	82.7	Confident	79.7	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-69.7	-40.4	173.5	-75.1	171.1	0	0	0	113	I627 S628 R629 A633 E634 I635 L643 I647 F652 F948 I958 I960	I627-L631 HydrophobicContact CG2-CD1 4.02Å; I627-L631 WeakPolarHBondContact O-CB 3.27Å; I627-L631 WeakPolarHBondContact O-CG 3.17Å; I627-L631 PolarHBondContact O-N 3.45Å; S628-L631 PolarHBondContact O-N 2.91Å; R629-L631 VanDerWaalsContact C-N 3.31Å; R629-L631 PolarHBondContact O-N 3.34Å; L631-A633 VanDerWaalsContact C-N 3.27Å; L631-A633 PolarHBondContact O-N 2.82Å; L631-E634 PolarHBondContact O-N 3.04Å; L631-I635 HydrophobicContact CB-CD1 4.43Å; L631-I635 HydrophobicContact CD2-CD1 4.49Å; L631-I635 VanDerWaalsContact O-CB 3.29Å; L631-I635 WeakPolarHBondContact O-CB 3.32Å; L631-I635 VanDerWaalsContact O-CG1 3.29Å; L631-I635 WeakPolarHBondContact O-CG1 3.31Å; L631-I635 PolarHBondContact O-N 3.23Å; L631-L643 HydrophobicContact CB-CD1 3.54Å; L631-L643 HydrophobicContact CB-CD2 4.37Å; L631-L643 HydrophobicContact CD1-CD1 4.1Å; L631-L643 HydrophobicContact CG-CD1 4.38Å; L631-I647 HydrophobicContact CD1-CD1 3.82Å; L631-I647 HydrophobicContact CD2-CD1 3.4Å; L631-I647 HydrophobicContact CG-CD1 4.15Å; L631-F652 HydrophobicContact CD1-CD2 3.74Å; L631-F652 HydrophobicContact CD1-CE2 4.03Å; L631-F948 HydrophobicContact CD1-CD1 3.94Å; L631-F948 HydrophobicContact CD1-CD2 4.37Å; L631-F948 HydrophobicContact CD1-CE1 3.87Å; L631-F948 HydrophobicContact CD1-CE2 4.31Å; L631-F948 HydrophobicContact CD1-CG 4.22Å; L631-F948 HydrophobicContact CD1-CZ 4.08Å; L631-F948 HydrophobicContact CD2-CB 4.4Å; L631-F948 HydrophobicContact CD2-CD2 3.78Å; L631-F948 HydrophobicContact CD2-CE2 4.22Å; L631-F948 HydrophobicContact CD2-CG 3.98Å; L631-F948 HydrophobicContact CG-CD2 4.45Å; L631-F948 HydrophobicContact CG-CE2 4.44Å; L631-I958 HydrophobicContact CD2-CG2 4.07Å; L631-I960 HydrophobicContact CB-CD1 4.25Å; L631-I960 HydrophobicContact CD2-CD1 3.38Å; L631-I960 HydrophobicContact CD2-CG1 4.48Å; L631-I960 HydrophobicContact CG-CD1 3.45Å; L631-I960 VanDerWaalsContact CG-CD1 3.45Å
632	Q	80.5	Confident	78.8	Confident	42 Å²	42	60.5 Å²	60.5	20%	0.196	33%	0.326	C	S	.	.	H	α-helix	trans	-56.9	-42.8	173.7	-75	171.2	-36.6	0	0	111.3	S628 R629 G636 A637 L643	S628-Q632 WeakPolarHBondContact O-CG 3.47Å; S628-Q632 PolarHBondContact O-N 3.39Å; R629-Q632 PolarHBondContact O-N 3.3Å; Q632-G636 WeakPolarHBondContact O-CA 3.23Å; Q632-G636 PolarHBondContact O-N 3.45Å; Q632-A637 PolarHBondContact O-N 2.99Å; Q632-A637 VanDerWaalsContact O-N 3.08Å; Q632-L643 HydrophobicContact CG-CD2 4.28Å
633	A	76.3	Confident	78.1	Confident	70 Å²	70	58.8 Å²	58.8	58%	0.579	32%	0.317	S	S	*	.	H	α-helix	trans	-67	-46	177.4	0	0	0	0	0	113.4	R629 A630 L631 I635	R629-A633 PolarHBondContact O-N 3.45Å; A630-A633 PolarHBondContact O-N 3.36Å; L631-A633 VanDerWaalsContact C-N 3.27Å; L631-A633 PolarHBondContact O-N 2.82Å; A633-I635 PolarHBondContact O-N 3.2Å
634	E	75	Confident	77.6	Confident	134 Å²	134	60.3 Å²	60.3	63%	0.626	32%	0.324	S	S	*	.	H	α-helix	trans	-69.5	-28.8	179.1	-73.5	-69.1	151.8	0	0	113.4	A630 L631 I958 I960	A630-E634 WeakPolarHBondContact O-CG 3.36Å; A630-E634 PolarHBondContact O-N 3.42Å; A630-E634 VanDerWaalsContact O-N 3.07Å; L631-E634 PolarHBondContact O-N 3.04Å; E634-I958 HydrophobicContact CB-CG2 4.14Å; E634-I960 HydrophobicContact CG-CG1 4.29Å
635	I	73.3	Confident	76.9	Confident	48 Å²	48	59.8 Å²	59.8	25%	0.246	33%	0.332	C	S	.	.	H	α-helix	trans	-90.7	-25.4	179.8	-65	168.3	0	0	0	112	L631 A633 A637 L643 V646 I647 I958	L631-I635 HydrophobicContact CB-CD1 4.43Å; L631-I635 HydrophobicContact CD2-CD1 4.49Å; L631-I635 VanDerWaalsContact O-CB 3.29Å; L631-I635 WeakPolarHBondContact O-CB 3.32Å; L631-I635 VanDerWaalsContact O-CG1 3.29Å; L631-I635 WeakPolarHBondContact O-CG1 3.31Å; L631-I635 PolarHBondContact O-N 3.23Å; A633-I635 PolarHBondContact O-N 3.2Å; I635-A637 HydrophobicContact CB-CB 4.36Å; I635-A637 HydrophobicContact CG2-CB 3.95Å; I635-L643 HydrophobicContact CD1-CD1 3.71Å; I635-V646 HydrophobicContact CD1-CB 4.3Å; I635-V646 HydrophobicContact CD1-CG1 4.06Å; I635-V646 HydrophobicContact CG2-CB 4.46Å; I635-V646 HydrophobicContact CG2-CG1 4.42Å; I635-V646 HydrophobicContact CG2-CG2 4.14Å; I635-I647 HydrophobicContact CD1-CD1 3.75Å; I635-I647 HydrophobicContact CD1-CG1 4.31Å; I635-I958 HydrophobicContact CD1-CD1 3.88Å; I635-I958 HydrophobicContact CG1-CD1 3.68Å
636	G	66.6	Low	76.2	Confident	66 Å²	66	57.3 Å²	57.3	68%	0.68	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	32.5	-168.3	0	0	0	0	0	112.9	Q632	Q632-G636 WeakPolarHBondContact O-CA 3.23Å; Q632-G636 PolarHBondContact O-N 3.45Å
637	A	68.3	Low	75.8	Confident	12 Å²	12	57.3 Å²	57.3	10%	0.099	33%	0.325	C	S	.	.			trans	-94.1	117.9	-179	0	0	0	0	0	111.2	Q632 I635 A642	Q632-A637 PolarHBondContact O-N 2.99Å; Q632-A637 VanDerWaalsContact O-N 3.08Å; I635-A637 HydrophobicContact CB-CB 4.36Å; I635-A637 HydrophobicContact CG2-CB 3.95Å; A637-A642 HydrophobicContact CB-CB 3.98Å
638	E	64	Low	75.4	Confident	187 Å²	187	59.4 Å²	59.4	87%	0.874	34%	0.343	S	S	*	.	S	Bend	trans	-71	-39.8	-179.8	-60.6	-168.6	147.5	0	0	112.8
639	D	71.3	Confident	75.1	Confident	115 Å²	115	64.1 Å²	64.1	62%	0.615	36%	0.362	S	S	*	.	S	Bend	trans	-109.3	154.5	-178	-76.7	-46.7	0	0	0	113.4	D641 A642 L643	D639-D641 VanDerWaalsContact C-N 3.27Å; D639-D641 PolarHBondContact O-N 2.87Å; D639-A642 WeakPolarHBondContact O-CB 3.22Å; D639-A642 PolarHBondContact O-N 2.71Å; D639-L643 PolarHBondContact O-N 3.13Å; D639-L643 VanDerWaalsContact O-N 3.14Å
640	E	70.7	Confident	75.1	Confident	96 Å²	96	66 Å²	66	45%	0.449	38%	0.38	S	S	.	.	H	α-helix	trans	-62.3	-31.6	172.9	-76.3	-150	149.1	0	0	112.9	S628 A642 L643 F644	S628-E640 PolarHBondContact OG-OE1 2.96Å; E640-A642 VanDerWaalsContact C-N 3.31Å; E640-A642 PolarHBondContact O-N 3.44Å; E640-L643 WeakPolarHBondContact O-CB 3.42Å; E640-L643 PolarHBondContact O-N 3.27Å; E640-F644 HydrophobicContact CB-CD2 4.22Å; E640-F644 HydrophobicContact CB-CE2 4.02Å; E640-F644 WeakPolarHBondContact O-CD2 3.34Å; E640-F644 PolarHBondContact O-N 3.28Å
641	D	72.2	Confident	75.2	Confident	135 Å²	135	67 Å²	67	72%	0.722	38%	0.383	S	S	*	.	H	α-helix	trans	-67.2	-34.1	176.5	-72.9	-32.1	0	0	0	111.8	D639 F644 S645	D639-D641 VanDerWaalsContact C-N 3.27Å; D639-D641 PolarHBondContact O-N 2.87Å; D641-F644 PolarHBondContact O-N 2.88Å; D641-S645 PolarHBondContact O-N 3.29Å
642	A	71	Confident	75.4	Confident	40 Å²	40	67.4 Å²	67.4	33%	0.331	39%	0.385	S	S	.	.	H	α-helix	trans	-67.4	-42.9	171.9	0	0	0	0	0	111.1	A637 D639 E640 F644 S645 V646	A637-A642 HydrophobicContact CB-CB 3.98Å; D639-A642 WeakPolarHBondContact O-CB 3.22Å; D639-A642 PolarHBondContact O-N 2.71Å; E640-A642 VanDerWaalsContact C-N 3.31Å; E640-A642 PolarHBondContact O-N 3.44Å; A642-F644 PolarHBondContact O-N 2.82Å; A642-S645 WeakPolarHBondContact O-CB 3.28Å; A642-S645 PolarHBondContact O-N 2.75Å; A642-S645 PolarHBondContact O-OG 3.4Å; A642-V646 PolarHBondContact O-N 3.01Å
643	L	75.9	Confident	75.7	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-55.8	-51.1	171.7	168.5	61.8	0	0	0	111.7	L631 Q632 I635 D639 E640 S645 V646 I647	L631-L643 HydrophobicContact CB-CD1 3.54Å; L631-L643 HydrophobicContact CB-CD2 4.37Å; L631-L643 HydrophobicContact CD1-CD1 4.1Å; L631-L643 HydrophobicContact CG-CD1 4.38Å; Q632-L643 HydrophobicContact CG-CD2 4.28Å; I635-L643 HydrophobicContact CD1-CD1 3.71Å; D639-L643 PolarHBondContact O-N 3.13Å; D639-L643 VanDerWaalsContact O-N 3.14Å; E640-L643 WeakPolarHBondContact O-CB 3.42Å; E640-L643 PolarHBondContact O-N 3.27Å; L643-S645 PolarHBondContact O-N 3.43Å; L643-V646 PolarHBondContact O-N 3.37Å; L643-V646 VanDerWaalsContact O-N 3.09Å; L643-I647 HydrophobicContact CD1-CD1 4.28Å; L643-I647 PolarHBondContact O-N 3.2Å
644	F	79.1	Confident	76.3	Confident	33 Å²	33	72 Å²	72	15%	0.145	39%	0.394	C	S	.	.	H	α-helix	trans	-72.6	-13.2	-177.9	-67.3	-54.9	0	0	0	114.1	E640 D641 A642 I647 K649 F652	E640-F644 HydrophobicContact CB-CD2 4.22Å; E640-F644 HydrophobicContact CB-CE2 4.02Å; E640-F644 WeakPolarHBondContact O-CD2 3.34Å; E640-F644 PolarHBondContact O-N 3.28Å; D641-F644 PolarHBondContact O-N 2.88Å; A642-F644 PolarHBondContact O-N 2.82Å; F644-I647 WeakPolarHBondContact CA-O 3.49Å; F644-K649 HydrophobicContact CD1-CB 3.76Å; F644-K649 HydrophobicContact CD1-CD 3.97Å; F644-K649 HydrophobicContact CD1-CG 3.75Å; F644-K649 HydrophobicContact CD2-CD 4.07Å; F644-K649 HydrophobicContact CE1-CB 4.15Å; F644-K649 HydrophobicContact CE1-CD 4.06Å; F644-K649 HydrophobicContact CE1-CG 3.7Å; F644-K649 HydrophobicContact CE2-CD 4.16Å; F644-K649 VanDerWaalsContact CE2-NZ 3.34Å; F644-K649 HydrophobicContact CG-CB 4.35Å; F644-K649 HydrophobicContact CG-CD 3.99Å; F644-K649 HydrophobicContact CG-CG 4.29Å; F644-K649 HydrophobicContact CZ-CD 4.17Å; F644-K649 HydrophobicContact CZ-CG 4.19Å; F644-F652 HydrophobicContact CE1-CB 4.14Å; F644-F652 AromaticContact CE1-CD1 3.91Å; F644-F652 HydrophobicContact CE1-CD1 3.91Å; F644-F652 HydrophobicContact CE1-CD2 4.47Å; F644-F652 HydrophobicContact CE1-CE1 4.46Å; F644-F652 AromaticContact CE1-CG 3.93Å; F644-F652 HydrophobicContact CE1-CG 3.93Å; F644-F652 HydrophobicContact CZ-CD1 4.25Å; F644-F652 HydrophobicContact CZ-CE1 4.39Å
645	S	74	Confident	76.9	Confident	80 Å²	80	66.1 Å²	66.1	56%	0.559	37%	0.367	S	S	*	.	H	α-helix	trans	-73.8	-31.8	167.4	82.1	0	0	0	0	112.9	D641 A642 L643	D641-S645 PolarHBondContact O-N 3.29Å; A642-S645 WeakPolarHBondContact O-CB 3.28Å; A642-S645 PolarHBondContact O-N 2.75Å; A642-S645 PolarHBondContact O-OG 3.4Å; L643-S645 PolarHBondContact O-N 3.43Å
646	V	73.9	Confident	77.7	Confident	28 Å²	28	63.9 Å²	63.9	17%	0.17	36%	0.355	C	S	.	.	H	α-helix	trans	-90.8	-35.6	-179.5	179.9	0	0	0	0	111.7	I635 A642 L643 A950 V951	I635-V646 HydrophobicContact CD1-CB 4.3Å; I635-V646 HydrophobicContact CD1-CG1 4.06Å; I635-V646 HydrophobicContact CG2-CB 4.46Å; I635-V646 HydrophobicContact CG2-CG1 4.42Å; I635-V646 HydrophobicContact CG2-CG2 4.14Å; A642-V646 PolarHBondContact O-N 3.01Å; L643-V646 PolarHBondContact O-N 3.37Å; L643-V646 VanDerWaalsContact O-N 3.09Å; V646-A950 HydrophobicContact CG1-CB 4.28Å; V646-A950 CarbonylContact O-C 3.51Å; V646-A950 WeakPolarHBondContact O-CA 3.33Å; V646-V951 WeakPolarHBondContact O-CG2 3.27Å; V646-V951 PolarHBondContact O-N 3.33Å
647	I	78.5	Confident	78.8	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	33%	0.332	C	S	.	.	S	Bend	trans	-122.8	117.7	179.1	-67.7	171.7	0	0	0	109.8	L631 I635 L643 F644 K649 F652 F948 I958	L631-I647 HydrophobicContact CD1-CD1 3.82Å; L631-I647 HydrophobicContact CD2-CD1 3.4Å; L631-I647 HydrophobicContact CG-CD1 4.15Å; I635-I647 HydrophobicContact CD1-CD1 3.75Å; I635-I647 HydrophobicContact CD1-CG1 4.31Å; L643-I647 HydrophobicContact CD1-CD1 4.28Å; L643-I647 PolarHBondContact O-N 3.2Å; F644-I647 WeakPolarHBondContact CA-O 3.49Å; I647-K649 PolarHBondContact O-N 2.86Å; I647-F652 HydrophobicContact CG2-CB 4.32Å; I647-F948 HydrophobicContact CD1-CB 3.78Å; I647-F948 HydrophobicContact CD1-CD1 4.43Å; I647-F948 HydrophobicContact CD1-CG 4.21Å; I647-F948 HydrophobicContact CG1-CB 4.45Å; I647-F948 HydrophobicContact CG2-CD1 4.23Å; I647-I958 HydrophobicContact CD1-CD1 4.25Å
648	A	79.6	Confident	79.8	Confident	45 Å²	45	66.1 Å²	66.1	37%	0.372	35%	0.351	S	S	.	.			trans	-55.2	127.5	177.9	0	0	0	0	0	111.6	D650 N651 F652 V951	A648-D650 PolarHBondContact O-N 3.42Å; A648-D650 VanDerWaalsContact O-N 3.11Å; A648-N651 WeakPolarHBondContact O-CA 3.22Å; A648-N651 WeakPolarHBondContact O-CB 3.23Å; A648-N651 PolarHBondContact O-N 3Å; A648-F652 PolarHBondContact O-N 2.96Å; A648-V951 HydrophobicContact CB-CG2 4.24Å
649	K	79.8	Confident	81.1	Confident	104 Å²	104	57.5 Å²	57.5	45%	0.452	31%	0.311	S	S	.	.	H	α-helix	trans	-56	-31.4	-173.9	-163.9	154.5	-169.3	153.3	0	113.6	F644 I647 N653	F644-K649 HydrophobicContact CD1-CB 3.76Å; F644-K649 HydrophobicContact CD1-CD 3.97Å; F644-K649 HydrophobicContact CD1-CG 3.75Å; F644-K649 HydrophobicContact CD2-CD 4.07Å; F644-K649 HydrophobicContact CE1-CB 4.15Å; F644-K649 HydrophobicContact CE1-CD 4.06Å; F644-K649 HydrophobicContact CE1-CG 3.7Å; F644-K649 HydrophobicContact CE2-CD 4.16Å; F644-K649 VanDerWaalsContact CE2-NZ 3.34Å; F644-K649 HydrophobicContact CG-CB 4.35Å; F644-K649 HydrophobicContact CG-CD 3.99Å; F644-K649 HydrophobicContact CG-CG 4.29Å; F644-K649 HydrophobicContact CZ-CD 4.17Å; F644-K649 HydrophobicContact CZ-CG 4.19Å; I647-K649 PolarHBondContact O-N 2.86Å; K649-N653 WeakPolarHBondContact O-CB 3.39Å; K649-N653 PolarHBondContact O-N 3.27Å; K649-N653 PolarHBondContact O-ND2 3.49Å; K649-N653 VanDerWaalsContact O-ND2 3.14Å
650	D	82.5	Confident	82.1	Confident	134 Å²	134	54.1 Å²	54.1	72%	0.717	29%	0.292	S	S	*	.	H	α-helix	trans	-68.5	-36.6	174.5	-59.9	-38.8	0	0	0	112.9	A648 K654	A648-D650 PolarHBondContact O-N 3.42Å; A648-D650 VanDerWaalsContact O-N 3.11Å; D650-K654 WeakPolarHBondContact O-CB 3.43Å; D650-K654 PolarHBondContact O-N 3.22Å
651	N	83.2	Confident	83.1	Confident	38 Å²	38	54.5 Å²	54.5	20%	0.203	30%	0.297	C	S	.	.	H	α-helix	trans	-68.2	-45.8	176.4	-160.1	23.7	0	0	0	110.2	A648 K654 I655 T949	A648-N651 WeakPolarHBondContact O-CA 3.22Å; A648-N651 WeakPolarHBondContact O-CB 3.23Å; A648-N651 PolarHBondContact O-N 3Å; N651-K654 PolarHBondContact O-N 3.34Å; N651-I655 WeakPolarHBondContact O-CB 3.29Å; N651-I655 WeakPolarHBondContact O-CD1 3.15Å; N651-I655 VanDerWaalsContact O-CG1 3.3Å; N651-I655 WeakPolarHBondContact O-CG1 3.36Å; N651-I655 PolarHBondContact O-N 3.24Å; N651-T949 PolarHBondContact ND2-N 2.97Å
652	F	86.8	Confident	83.9	Confident	8 Å²	8	50.1 Å²	50.1	4%	0.035	28%	0.275	C	S	.	.	H	α-helix	trans	-54.9	-53.6	173	175.7	-91	0	0	0	111.9	I627 L631 F644 I647 A648 K654 I655 C656 F948	I627-F652 HydrophobicContact CB-CE2 4.33Å; I627-F652 HydrophobicContact CG2-CD2 4.2Å; I627-F652 HydrophobicContact CG2-CE2 3.74Å; L631-F652 HydrophobicContact CD1-CD2 3.74Å; L631-F652 HydrophobicContact CD1-CE2 4.03Å; F644-F652 HydrophobicContact CE1-CB 4.14Å; F644-F652 AromaticContact CE1-CD1 3.91Å; F644-F652 HydrophobicContact CE1-CD1 3.91Å; F644-F652 HydrophobicContact CE1-CD2 4.47Å; F644-F652 HydrophobicContact CE1-CE1 4.46Å; F644-F652 AromaticContact CE1-CG 3.93Å; F644-F652 HydrophobicContact CE1-CG 3.93Å; F644-F652 HydrophobicContact CZ-CD1 4.25Å; F644-F652 HydrophobicContact CZ-CE1 4.39Å; I647-F652 HydrophobicContact CG2-CB 4.32Å; A648-F652 PolarHBondContact O-N 2.96Å; F652-K654 PolarHBondContact O-N 3.05Å; F652-I655 PolarHBondContact O-N 3.03Å; F652-C656 WeakPolarHBondContact O-CB 3.46Å; F652-C656 PolarHBondContact O-N 2.81Å; F652-C656 PolarHBondContact O-SG 3.12Å; F652-C656 VanDerWaalsContact O-SG 3.33Å; F652-F948 HydrophobicContact CD2-CE1 4.41Å
653	N	88.3	Confident	84.9	Confident	71 Å²	71	48.2 Å²	48.2	38%	0.38	26%	0.259	S	S	.	.	H	α-helix	trans	-62.1	-41.1	-179.2	-77.1	-35.5	0	0	0	112.7	K649 G657	K649-N653 WeakPolarHBondContact O-CB 3.39Å; K649-N653 PolarHBondContact O-N 3.27Å; K649-N653 PolarHBondContact O-ND2 3.49Å; K649-N653 VanDerWaalsContact O-ND2 3.14Å; N653-G657 PolarHBondContact O-N 3.05Å
654	K	88.1	Confident	85.7	Confident	138 Å²	138	51.5 Å²	51.5	60%	0.6	28%	0.275	S	S	*	.	H	α-helix	trans	-60.2	-45.7	176.3	178.9	-174.4	176	-171.2	0	111.7	D650 N651 F652 G657 Q658	D650-K654 WeakPolarHBondContact O-CB 3.43Å; D650-K654 PolarHBondContact O-N 3.22Å; N651-K654 PolarHBondContact O-N 3.34Å; F652-K654 PolarHBondContact O-N 3.05Å; K654-G657 PolarHBondContact O-N 3.16Å; K654-Q658 WeakPolarHBondContact O-CG 3.48Å; K654-Q658 PolarHBondContact O-N 2.95Å
655	I	87.1	Confident	86.1	Confident	10 Å²	10	55.9 Å²	55.9	5%	0.051	30%	0.296	C	S	.	.	H	α-helix	trans	-69.7	-45.4	-178.6	-70.9	166.1	0	0	0	111	N651 F652 G657 Q658 V659 I946 E947 F948	N651-I655 WeakPolarHBondContact O-CB 3.29Å; N651-I655 WeakPolarHBondContact O-CD1 3.15Å; N651-I655 VanDerWaalsContact O-CG1 3.3Å; N651-I655 WeakPolarHBondContact O-CG1 3.36Å; N651-I655 PolarHBondContact O-N 3.24Å; F652-I655 PolarHBondContact O-N 3.03Å; I655-G657 VanDerWaalsContact C-N 3.26Å; I655-G657 PolarHBondContact O-N 2.83Å; I655-Q658 WeakPolarHBondContact O-CB 3.49Å; I655-Q658 PolarHBondContact O-N 3.45Å; I655-V659 PolarHBondContact O-N 3.35Å; I655-V659 VanDerWaalsContact O-N 3.13Å; I655-I946 HydrophobicContact CG2-CG2 3.23Å; I655-E947 WeakPolarHBondContact CD1-O 3.36Å; I655-F948 HydrophobicContact CB-CE1 3.84Å; I655-F948 HydrophobicContact CB-CZ 4.22Å; I655-F948 HydrophobicContact CD1-CD1 3.49Å; I655-F948 VanDerWaalsContact CD1-CD1 3.49Å; I655-F948 HydrophobicContact CD1-CE1 3.61Å; I655-F948 HydrophobicContact CD1-CG 4.1Å; I655-F948 HydrophobicContact CD1-CZ 4.3Å; I655-F948 HydrophobicContact CG1-CE1 4.32Å; I655-F948 HydrophobicContact CG2-CE1 3.61Å; I655-F948 HydrophobicContact CG2-CE2 4.32Å; I655-F948 HydrophobicContact CG2-CZ 3.46Å; I655-F948 VanDerWaalsContact CG2-CZ 3.46Å
656	C	90.3	Very high	86.9	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-55.5	-42.8	171.9	-69.6	0	0	0	0	111.4	V623 K624 F652 Q658 V659 E660	V623-C656 HydrophobicContact CG1-CB 4.16Å; K624-C656 HydrophobicContact CG-CB 4.02Å; F652-C656 WeakPolarHBondContact O-CB 3.46Å; F652-C656 PolarHBondContact O-N 2.81Å; F652-C656 PolarHBondContact O-SG 3.12Å; F652-C656 VanDerWaalsContact O-SG 3.33Å; C656-Q658 VanDerWaalsContact C-N 3.33Å; C656-Q658 PolarHBondContact O-N 3.49Å; C656-V659 PolarHBondContact O-N 3.07Å; C656-E660 WeakPolarHBondContact O-CB 3.48Å; C656-E660 WeakPolarHBondContact O-CG 3.01Å; C656-E660 PolarHBondContact O-N 3.23Å
657	G	89.3	Confident	87.6	Confident	19 Å²	19	51.4 Å²	51.4	20%	0.196	27%	0.266	C	S	.	.	H	α-helix	trans	-62.4	-32.7	174.5	0	0	0	0	0	114.3	N653 K654 I655 N661	N653-G657 PolarHBondContact O-N 3.05Å; K654-G657 PolarHBondContact O-N 3.16Å; I655-G657 VanDerWaalsContact C-N 3.26Å; I655-G657 PolarHBondContact O-N 2.83Å; G657-N661 WeakPolarHBondContact O-CB 3.28Å; G657-N661 PolarHBondContact O-N 3.32Å; G657-N661 VanDerWaalsContact O-N 3.09Å; G657-N661 PolarHBondContact O-ND2 2.93Å
658	Q	89.7	Confident	88.1	Confident	106 Å²	106	55.2 Å²	55.2	50%	0.495	29%	0.293	S	S	.	.	H	α-helix	trans	-67.4	-42.9	173.7	-71.7	172.4	-41.8	0	0	111.5	K654 I655 C656 N661 T662	K654-Q658 WeakPolarHBondContact O-CG 3.48Å; K654-Q658 PolarHBondContact O-N 2.95Å; I655-Q658 WeakPolarHBondContact O-CB 3.49Å; I655-Q658 PolarHBondContact O-N 3.45Å; C656-Q658 VanDerWaalsContact C-N 3.33Å; C656-Q658 PolarHBondContact O-N 3.49Å; Q658-N661 PolarHBondContact O-N 3.01Å; Q658-T662 WeakPolarHBondContact O-CB 3.47Å; Q658-T662 PolarHBondContact O-N 3.36Å; Q658-T662 PolarHBondContact O-OG1 3.42Å
659	V	90.9	Very high	88.5	Confident	7 Å²	7	56.6 Å²	56.6	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-65.3	-45.6	176.2	178.2	0	0	0	0	111.1	V623 I627 I655 C656 N661 T662 L663 P943 I946 Y962	V623-V659 HydrophobicContact CB-CG1 4.43Å; V623-V659 HydrophobicContact CG1-CB 3.81Å; V623-V659 HydrophobicContact CG1-CG1 3.72Å; V623-V659 HydrophobicContact CG2-CG1 3.77Å; I627-V659 HydrophobicContact CD1-CG2 4.08Å; I655-V659 PolarHBondContact O-N 3.35Å; I655-V659 VanDerWaalsContact O-N 3.13Å; C656-V659 PolarHBondContact O-N 3.07Å; V659-N661 VanDerWaalsContact C-N 3.33Å; V659-N661 PolarHBondContact O-N 3.38Å; V659-T662 WeakPolarHBondContact O-CB 3.45Å; V659-T662 PolarHBondContact O-N 3.26Å; V659-T662 VanDerWaalsContact O-N 3.13Å; V659-L663 HydrophobicContact CG1-CD1 4.19Å; V659-L663 HydrophobicContact CG1-CG 4.43Å; V659-L663 WeakPolarHBondContact O-CG 3.35Å; V659-L663 PolarHBondContact O-N 2.82Å; V659-P943 HydrophobicContact CG1-CB 4.28Å; V659-P943 HydrophobicContact CG1-CG 3.96Å; V659-P943 HydrophobicContact CG2-CB 4.46Å; V659-I946 HydrophobicContact CG2-CD1 3.51Å; V659-Y962 HydrophobicContact CG1-CD2 4.29Å; V659-Y962 HydrophobicContact CG1-CE1 4.27Å; V659-Y962 HydrophobicContact CG1-CE2 3.92Å
660	E	92.6	Very high	88.9	Confident	43 Å²	43	53.1 Å²	53.1	20%	0.201	29%	0.285	C	S	.	.	H	α-helix	trans	-57.6	-42.6	176.5	-76.6	162.9	-155.6	0	0	112.6	R620 V623 K624 C656 Q664	R620-E660 VanDerWaalsContact CD-O 3.25Å; R620-E660 WeakPolarHBondContact CD-O 3.15Å; R620-E660 HydrophobicContact CG-CB 4.25Å; R620-E660 HydrophobicContact CG-CG 4.25Å; V623-E660 HydrophobicContact CB-CG 3.95Å; V623-E660 HydrophobicContact CG1-CG 4.15Å; V623-E660 HydrophobicContact CG2-CG 3.91Å; K624-E660 WeakPolarHBondContact CE-OE1 3.18Å; K624-E660 WeakPolarHBondContact CG-OE1 3.36Å; K624-E660 IonicContact NZ-OE1 2.8Å; K624-E660 PolarHBondContact NZ-OE1 3.25Å; K624-E660 IonicContact NZ-OE2 3.24Å; K624-E660 PolarHBondContact NZ-OE2 2.8Å; C656-E660 WeakPolarHBondContact O-CB 3.48Å; C656-E660 WeakPolarHBondContact O-CG 3.01Å; C656-E660 PolarHBondContact O-N 3.23Å; E660-Q664 PolarHBondContact O-N 2.97Å
661	N	91.7	Very high	89.2	Confident	105 Å²	105	51.1 Å²	51.1	56%	0.561	27%	0.274	S	S	*	.	H	α-helix	trans	-66.9	-40.6	175.1	-80.5	-59.5	0	0	0	112.3	G657 Q658 V659 Q664 Q665	G657-N661 WeakPolarHBondContact O-CB 3.28Å; G657-N661 PolarHBondContact O-N 3.32Å; G657-N661 VanDerWaalsContact O-N 3.09Å; G657-N661 PolarHBondContact O-ND2 2.93Å; Q658-N661 PolarHBondContact O-N 3.01Å; V659-N661 VanDerWaalsContact C-N 3.33Å; V659-N661 PolarHBondContact O-N 3.38Å; N661-Q664 PolarHBondContact O-N 2.9Å; N661-Q665 WeakPolarHBondContact O-CG 3.45Å; N661-Q665 PolarHBondContact O-N 2.91Å
662	T	90.5	Very high	89.4	Confident	42 Å²	42	51.1 Å²	51.1	26%	0.258	27%	0.271	S	S	.	.	H	α-helix	trans	-63	-46.8	177.7	-56.6	0	0	0	0	110.8	Q658 V659 Q664 Q665 L666 S941 P943	Q658-T662 WeakPolarHBondContact O-CB 3.47Å; Q658-T662 PolarHBondContact O-N 3.36Å; Q658-T662 PolarHBondContact O-OG1 3.42Å; V659-T662 WeakPolarHBondContact O-CB 3.45Å; V659-T662 PolarHBondContact O-N 3.26Å; V659-T662 VanDerWaalsContact O-N 3.13Å; T662-Q664 VanDerWaalsContact C-N 3.32Å; T662-Q664 PolarHBondContact O-N 3.32Å; T662-Q665 WeakPolarHBondContact O-CB 3.34Å; T662-Q665 PolarHBondContact O-N 3.3Å; T662-Q665 VanDerWaalsContact O-N 3.1Å; T662-L666 WeakPolarHBondContact O-CG 3.47Å; T662-L666 PolarHBondContact O-N 2.76Å; T662-S941 WeakPolarHBondContact CG2-O 3.39Å; T662-P943 HydrophobicContact CG2-CG 3.94Å
663	L	92.1	Very high	89.5	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.1	-35.8	175.3	-65.4	176.8	0	0	0	112.5	L616 L619 R620 V623 V659 Q665 L666 A667 F942 P943	L616-L663 HydrophobicContact CD2-CD2 4.4Å; L619-L663 HydrophobicContact CB-CD1 3.95Å; R620-L663 HydrophobicContact CB-CB 4.15Å; R620-L663 HydrophobicContact CB-CD1 4.24Å; R620-L663 HydrophobicContact CG-CB 4.46Å; V623-L663 HydrophobicContact CG2-CD1 3.55Å; V659-L663 HydrophobicContact CG1-CD1 4.19Å; V659-L663 HydrophobicContact CG1-CG 4.43Å; V659-L663 WeakPolarHBondContact O-CG 3.35Å; V659-L663 PolarHBondContact O-N 2.82Å; L663-Q665 VanDerWaalsContact C-N 3.33Å; L663-Q665 PolarHBondContact O-N 2.66Å; L663-L666 HydrophobicContact CD2-CD1 3.99Å; L663-L666 WeakPolarHBondContact O-CB 3.49Å; L663-L666 PolarHBondContact O-N 3.47Å; L663-A667 WeakPolarHBondContact O-CB 3.17Å; L663-A667 PolarHBondContact O-N 2.95Å; L663-F942 HydrophobicContact CD2-CE2 4.22Å; L663-P943 HydrophobicContact CD2-CG 4.27Å
664	Q	91.7	Very high	89.6	Confident	69 Å²	69	55.7 Å²	55.7	32%	0.322	29%	0.293	S	S	.	.	H	α-helix	trans	-64.1	-38.6	172.8	-177.8	70.8	108.8	0	0	111.8	E617 E660 N661 T662 A667 S668	E617-Q664 PolarHBondContact OE1-NE2 2.99Å; E660-Q664 PolarHBondContact O-N 2.97Å; N661-Q664 PolarHBondContact O-N 2.9Å; T662-Q664 VanDerWaalsContact C-N 3.32Å; T662-Q664 PolarHBondContact O-N 3.32Å; Q664-A667 PolarHBondContact O-N 3.16Å; Q664-S668 WeakPolarHBondContact O-CB 3.13Å; Q664-S668 PolarHBondContact O-N 2.84Å
665	Q	88.6	Confident	89.8	Confident	126 Å²	126	51.2 Å²	51.2	59%	0.589	28%	0.279	S	S	*	.	H	α-helix	trans	-66.2	-37	173.7	-69.5	177.8	11.7	0	0	112	N661 T662 L663 S668 T669 R672	N661-Q665 WeakPolarHBondContact O-CG 3.45Å; N661-Q665 PolarHBondContact O-N 2.91Å; T662-Q665 WeakPolarHBondContact O-CB 3.34Å; T662-Q665 PolarHBondContact O-N 3.3Å; T662-Q665 VanDerWaalsContact O-N 3.1Å; L663-Q665 VanDerWaalsContact C-N 3.33Å; L663-Q665 PolarHBondContact O-N 2.66Å; Q665-S668 PolarHBondContact O-OG 2.87Å; Q665-T669 PolarHBondContact O-OG1 2.85Å; Q665-T669 VanDerWaalsContact O-OG1 3.09Å; Q665-R672 PolarHBondContact O-NH2 3.43Å
666	L	90.3	Very high	90.2	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-59.3	-48.7	169.6	-62.6	-171.3	0	0	0	111.5	L611 L616 T662 L663 S668 T669 R672 S941 F942	L611-L666 HydrophobicContact CD1-CB 4.02Å; L611-L666 HydrophobicContact CD1-CD2 4.24Å; L611-L666 HydrophobicContact CD1-CG 4.5Å; L616-L666 HydrophobicContact CD1-CB 3.65Å; L616-L666 HydrophobicContact CD2-CB 4.02Å; L616-L666 HydrophobicContact CD2-CD1 3.85Å; L616-L666 HydrophobicContact CG-CB 4.42Å; T662-L666 WeakPolarHBondContact O-CG 3.47Å; T662-L666 PolarHBondContact O-N 2.76Å; L663-L666 HydrophobicContact CD2-CD1 3.99Å; L663-L666 WeakPolarHBondContact O-CB 3.49Å; L663-L666 PolarHBondContact O-N 3.47Å; L666-S668 PolarHBondContact O-N 3.38Å; L666-T669 CarbonylContact O-C 3.37Å; L666-T669 PolarHBondContact O-N 3.49Å; L666-R672 PolarHBondContact O-NH2 3.4Å; L666-S941 WeakPolarHBondContact CD2-OG 3.27Å; L666-F942 HydrophobicContact CD1-CD2 3.6Å; L666-F942 HydrophobicContact CD1-CE2 4.26Å; L666-F942 HydrophobicContact CD1-CG 4.48Å
667	A	88.5	Confident	90.3	Very high	12 Å²	12	51.6 Å²	51.6	10%	0.099	28%	0.281	C	S	.	.	H	α-helix	trans	-68.9	-32.9	-175.1	0	0	0	0	0	113.5	L616 E617 L663 Q664 T669	L616-A667 HydrophobicContact CB-CB 3.99Å; L616-A667 HydrophobicContact CD1-CB 4.21Å; E617-A667 HydrophobicContact CG-CB 4.39Å; L663-A667 WeakPolarHBondContact O-CB 3.17Å; L663-A667 PolarHBondContact O-N 2.95Å; Q664-A667 PolarHBondContact O-N 3.16Å; A667-T669 VanDerWaalsContact C-N 3.32Å; A667-T669 PolarHBondContact O-N 3.02Å
668	S	88.8	Confident	90.5	Very high	81 Å²	81	50.7 Å²	50.7	57%	0.566	27%	0.272	S	S	*	.	H	α-helix	trans	-68.2	-28.4	177.9	70.7	0	0	0	0	113.9	Q664 Q665 L666	Q664-S668 WeakPolarHBondContact O-CB 3.13Å; Q664-S668 PolarHBondContact O-N 2.84Å; Q665-S668 PolarHBondContact O-OG 2.87Å; L666-S668 PolarHBondContact O-N 3.38Å
669	T	88	Confident	90.7	Very high	75 Å²	75	45.7 Å²	45.7	46%	0.46	25%	0.249	S	C	.	.	S	Bend	trans	-134.1	70.3	-177.6	38.2	0	0	0	0	109.8	Q665 L666 A667 N671 R672	Q665-T669 PolarHBondContact O-OG1 2.85Å; Q665-T669 VanDerWaalsContact O-OG1 3.09Å; L666-T669 CarbonylContact O-C 3.37Å; L666-T669 PolarHBondContact O-N 3.49Å; A667-T669 VanDerWaalsContact C-N 3.32Å; A667-T669 PolarHBondContact O-N 3.02Å; T669-N671 PolarHBondContact O-N 3.25Å; T669-R672 PolarHBondContact O-NE 2.84Å; T669-R672 VanDerWaalsContact O-NE 3.13Å; T669-R672 PolarHBondContact O-NH2 2.81Å; T669-R672 PolarHBondContact OG1-NH2 3.17Å
670	P	87	Confident	90.7	Very high	30 Å²	30	46.3 Å²	46.3	20%	0.195	25%	0.251	C	S	.	.			trans	-75.5	-24.7	-169.4	29.9	-36.3	0	0	0	113.5	L611 P613	L611-P670 HydrophobicContact CB-CB 4.26Å; L611-P670 PolarHBondContact N-O 3.27Å; L611-P670 WeakPolarHBondContact O-CB 3.23Å; P613-P670 HydrophobicContact CG-CB 3.86Å; P613-P670 HydrophobicContact CG-CG 3.88Å
671	N	89.6	Confident	90.6	Very high	92 Å²	92	44.4 Å²	44.4	49%	0.492	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	113.2	166	-71.1	-84.8	0	0	0	107.7	T669	T669-N671 PolarHBondContact O-N 3.25Å
672	R	87	Confident	90.5	Very high	38 Å²	38	41.5 Å²	41.5	14%	0.143	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	162.7	-178	62.6	-178.6	58.4	-139.5	-12.1	112.1	R608 F609 Q665 L666 T669 E674 S941	R608-R672 WeakPolarHBondContact CA-O 3.44Å; F609-R672 HydrophobicContact CB-CG 3.93Å; F609-R672 PolarHBondContact N-O 3.07Å; F609-R672 PolarHBondContact O-N 3.28Å; F609-R672 VanDerWaalsContact O-N 3.13Å; Q665-R672 PolarHBondContact O-NH2 3.43Å; L666-R672 PolarHBondContact O-NH2 3.4Å; T669-R672 PolarHBondContact O-NE 2.84Å; T669-R672 VanDerWaalsContact O-NE 3.13Å; T669-R672 PolarHBondContact O-NH2 2.81Å; T669-R672 PolarHBondContact OG1-NH2 3.17Å; R672-E674 WeakPolarHBondContact CD-OE2 3.18Å; R672-E674 IonicContact NH1-OE2 3.97Å; R672-E674 PolarHBondContact NH1-OE2 3.49Å; R672-S941 PolarHBondContact NH1-OG 3Å
673	I	89.3	Confident	90.4	Very high	130 Å²	130	39.6 Å²	39.6	67%	0.667	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-125.5	119.5	171.1	-59.9	172.9	0	0	0	106.1	P606 V607 R608	P606-I673 HydrophobicContact CB-CG2 3.89Å; V607-I673 WeakPolarHBondContact O-CA 3.22Å; R608-I673 HydrophobicContact CB-CG1 4.22Å; R608-I673 HydrophobicContact CG-CG1 4.28Å
674	E	90.9	Very high	89.9	Confident	46 Å²	46	39.8 Å²	39.8	22%	0.215	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	153.2	-169.1	-166.2	173.9	173.4	0	0	109.9	V607 R672 A940 S941	V607-E674 PolarHBondContact N-O 3.14Å; V607-E674 PolarHBondContact O-N 2.89Å; V607-E674 VanDerWaalsContact O-O 3.11Å; R672-E674 WeakPolarHBondContact CD-OE2 3.18Å; R672-E674 IonicContact NH1-OE2 3.97Å; R672-E674 PolarHBondContact NH1-OE2 3.49Å; E674-A940 HydrophobicContact CG-CB 4.48Å; E674-S941 WeakPolarHBondContact OE1-CA 3.42Å; E674-S941 WeakPolarHBondContact OE1-CB 3.47Å; E674-S941 PolarHBondContact OE1-N 3.04Å; E674-S941 PolarHBondContact OE1-OG 3.17Å; E674-S941 PolarHBondContact OE2-OG 2.76Å
675	C	92.1	Very high	89.4	Confident	44 Å²	44	37.4 Å²	37.4	30%	0.297	21%	0.209	S	C	.	.			trans	-61	134.4	173.1	-61.2	0	0	0	0	110.4	A603 A940	A603-C675 WeakPolarHBondContact O-CB 3.32Å; C675-A940 WeakPolarHBondContact O-CB 3.49Å; C675-A940 PolarHBondContact O-N 2.81Å
676	P	94.8	Very high	89.5	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	162.2	178.1	34.7	-35.6	0	0	0	111.2	R602 A603 I605 V607 F609 I937 L938	R602-P676 WeakPolarHBondContact O-CD 3.2Å; R602-P676 WeakPolarHBondContact O-CG 3.1Å; A603-P676 VanDerWaalsContact CA-O 3.28Å; A603-P676 WeakPolarHBondContact CA-O 3.31Å; I605-P676 WeakPolarHBondContact O-CD 3.42Å; V607-P676 HydrophobicContact CB-CG 4.4Å; V607-P676 HydrophobicContact CG2-CB 4.44Å; V607-P676 HydrophobicContact CG2-CG 3.86Å; F609-P676 HydrophobicContact CE2-CB 4.36Å; F609-P676 HydrophobicContact CZ-CB 3.93Å; P676-I937 HydrophobicContact CB-CB 3.83Å; P676-I937 HydrophobicContact CB-CD1 4.24Å; P676-I937 HydrophobicContact CB-CG2 3.81Å; P676-L938 CarbonylContact C-O 3.59Å; P676-L938 VanDerWaalsContact CA-O 3.31Å; P676-L938 WeakPolarHBondContact CA-O 3.24Å
677	V	93	Very high	89.6	Confident	16 Å²	16	33.2 Å²	33.2	10%	0.097	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	123.9	164.5	-174.5	0	0	0	0	107.8	Y679 I937 L938 A940 P1006	V677-Y679 HydrophobicContact CB-CE2 4.1Å; V677-Y679 HydrophobicContact CG1-CD2 3.94Å; V677-Y679 HydrophobicContact CG1-CE2 3.35Å; V677-I937 WeakPolarHBondContact O-CA 3.08Å; V677-L938 PolarHBondContact N-O 2.99Å; V677-L938 PolarHBondContact O-N 3.35Å; V677-L938 VanDerWaalsContact O-N 3.09Å; V677-A940 HydrophobicContact CG2-CB 4.07Å; V677-P1006 HydrophobicContact CG1-CB 3.43Å; V677-P1006 VanDerWaalsContact CG1-CB 3.43Å; V677-P1006 HydrophobicContact CG1-CG 4.33Å
678	I	94.3	Very high	89.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	121.6	-173.3	-51.5	169.6	0	0	0	108.8	F601 I937 P1006 Y1007 M1010	F601-I678 WeakPolarHBondContact O-CD1 3.49Å; I678-I937 HydrophobicContact CB-CG2 4.29Å; I678-I937 HydrophobicContact CG1-CG2 3.7Å; I678-P1006 CarbonylContact O-C 3.42Å; I678-P1006 VanDerWaalsContact O-CA 3.25Å; I678-P1006 WeakPolarHBondContact O-CA 3.29Å; I678-Y1007 PolarHBondContact O-N 3.47Å; I678-M1010 HydrophobicContact CD1-CB 4.46Å; I678-M1010 HydrophobicContact CG2-CB 4.21Å
679	Y	92.9	Very high	89.8	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.008	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	151.4	177.4	-75.7	-75.4	0	0	0	111.5	V677 C936 L938 Q944 V1003 D1004 P1006	V677-Y679 HydrophobicContact CB-CE2 4.1Å; V677-Y679 HydrophobicContact CG1-CD2 3.94Å; V677-Y679 HydrophobicContact CG1-CE2 3.35Å; Y679-C936 PolarHBondContact N-O 3.21Å; Y679-C936 PolarHBondContact O-N 2.98Å; Y679-L938 HydrophobicContact CD2-CD1 4.35Å; Y679-Q944 HydrophobicContact CE2-CG 4.35Å; Y679-Q944 PolarHBondContact OH-OE1 3Å; Y679-V1003 HydrophobicContact CD1-CG1 3.62Å; Y679-V1003 HydrophobicContact CE1-CG1 3.84Å; Y679-V1003 HydrophobicContact CG-CG1 4.45Å; Y679-D1004 WeakPolarHBondContact CD1-O 3.47Å; Y679-P1006 HydrophobicContact CD1-CB 4.46Å; Y679-P1006 HydrophobicContact CE1-CB 3.95Å; Y679-P1006 HydrophobicContact CE1-CG 4.4Å
680	H	91.6	Very high	90.1	Very high	19 Å²	19	25.6 Å²	25.6	9%	0.088	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	117.5	158.6	-176.4	-128	0	0	0	108.1	W935 D1004 Y1007	H680-W935 HydrophobicContact CB-CD2 3.96Å; H680-W935 HydrophobicContact CB-CE3 3.93Å; H680-W935 HydrophobicContact CB-CH2 3.78Å; H680-W935 HydrophobicContact CB-CZ2 3.83Å; H680-W935 HydrophobicContact CB-CZ3 3.85Å; H680-W935 AromaticContact CD2-CD1 3.54Å; H680-W935 AromaticContact CD2-CD2 3.79Å; H680-W935 AromaticContact CD2-CE2 3.43Å; H680-W935 VanDerWaalsContact CD2-CE2 3.43Å; H680-W935 AromaticContact CD2-CG 3.84Å; H680-W935 AromaticContact CD2-CZ2 3.98Å; H680-W935 AromaticContact CD2-NE1 3.26Å; H680-W935 PolarHBondContact CD2-NE1 3.13Å; H680-W935 VanDerWaalsContact CD2-NE1 3.26Å; H680-W935 AromaticContact CG-CE2 3.68Å; H680-W935 AromaticContact CG-CZ2 3.77Å; H680-W935 AromaticContact CG-NE1 3.96Å; H680-W935 AromaticContact NE2-NE1 3.61Å; H680-D1004 HydrophobicContact CB-CB 4.31Å; H680-D1004 PolarHBondContact N-O 2.89Å; H680-D1004 PolarHBondContact O-N 2.92Å; H680-Y1007 HydrophobicContact CB-CE2 4.4Å
681	L	90.8	Very high	90.4	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.021	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	96.3	-180	-56.5	179.2	0	0	0	107.4	V920 G933 I934 P963 L967 F1001 V1003	L681-V920 HydrophobicContact CD1-CG2 4.31Å; L681-G933 CarbonylContact O-C 3.55Å; L681-G933 WeakPolarHBondContact O-CA 3.3Å; L681-I934 PolarHBondContact N-O 3.1Å; L681-I934 PolarHBondContact O-N 2.78Å; L681-P963 HydrophobicContact CD2-CB 4.45Å; L681-L967 HydrophobicContact CB-CD1 4.08Å; L681-L967 HydrophobicContact CD1-CD1 3.78Å; L681-L967 HydrophobicContact CG-CD1 4.47Å; L681-F1001 HydrophobicContact CB-CD1 4.19Å; L681-F1001 HydrophobicContact CB-CE1 4.4Å; L681-F1001 WeakPolarHBondContact O-CE1 3.33Å; L681-V1003 HydrophobicContact CD2-CB 4.41Å; L681-V1003 HydrophobicContact CD2-CG1 3.94Å; L681-V1003 HydrophobicContact CD2-CG2 3.97Å
682	D	88.5	Confident	90.6	Very high	44 Å²	44	20.1 Å²	20.1	24%	0.235	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	140.8	-169.9	-173.6	25.5	0	0	0	111.7	G684 D932 F1001 E1002	D682-G684 PolarHBondContact O-N 2.97Å; D682-D932 WeakPolarHBondContact OD1-CB 3.4Å; D682-F1001 CarbonylContact O-C 3.58Å; D682-F1001 WeakPolarHBondContact O-CA 3.34Å; D682-F1001 WeakPolarHBondContact O-CD1 3.02Å; D682-E1002 PolarHBondContact N-O 2.94Å; D682-E1002 VanDerWaalsContact N-O 3.11Å; D682-E1002 PolarHBondContact O-N 3.44Å; D682-E1002 VanDerWaalsContact O-O 3.06Å
683	V	87.7	Confident	91	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.006	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	101.1	177.8	-176.3	0	0	0	0	109.7	A685 M686 I912 I913 D932 I999 Y1000 F1001	V683-A685 PolarHBondContact O-N 2.99Å; V683-M686 HydrophobicContact CB-CB 3.83Å; V683-M686 HydrophobicContact CB-CG 3.97Å; V683-M686 HydrophobicContact CB-SD 4.03Å; V683-M686 HydrophobicContact CG1-CB 3.68Å; V683-M686 HydrophobicContact CG1-CG 3.68Å; V683-M686 HydrophobicContact CG1-SD 4.26Å; V683-M686 HydrophobicContact CG2-SD 4.23Å; V683-M686 PolarHBondContact O-N 2.94Å; V683-I912 HydrophobicContact CG2-CG2 3.98Å; V683-I913 HydrophobicContact CG2-CD1 4.21Å; V683-D932 WeakPolarHBondContact CB-O 3.45Å; V683-D932 WeakPolarHBondContact CG2-O 3.45Å; V683-D932 PolarHBondContact N-O 2.64Å; V683-I999 HydrophobicContact CG1-CG2 3.59Å; V683-Y1000 CarbonylContact C-O 3.51Å; V683-F1001 HydrophobicContact CG2-CD1 3.83Å; V683-F1001 HydrophobicContact CG2-CD2 4.15Å; V683-F1001 HydrophobicContact CG2-CE1 3.37Å; V683-F1001 HydrophobicContact CG2-CE2 3.73Å; V683-F1001 HydrophobicContact CG2-CG 4.21Å; V683-F1001 HydrophobicContact CG2-CZ 3.31Å
684	G	82	Confident	91.2	Very high	5 Å²	5	12.2 Å²	12.2	5%	0.052	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	108.8	-175.7	0	0	0	0	0	112.4	D682 M686 N689 Y1000	D682-G684 PolarHBondContact O-N 2.97Å; G684-M686 VanDerWaalsContact C-N 3.35Å; G684-M686 PolarHBondContact O-N 2.78Å; G684-N689 PolarHBondContact O-ND2 3.08Å; G684-Y1000 PolarHBondContact N-O 2.91Å
685	A	82.4	Confident	91.3	Very high	18 Å²	18	10.4 Å²	10.4	15%	0.149	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	48	-175.4	0	0	0	0	0	113.8	V683 Y687 P688 N689	V683-A685 PolarHBondContact O-N 2.99Å; A685-Y687 PolarHBondContact O-N 2.94Å; A685-P688 HydrophobicContact CB-CG 4.39Å; A685-P688 VanDerWaalsContact O-CD 3.23Å; A685-P688 WeakPolarHBondContact O-CD 2.86Å; A685-N689 PolarHBondContact O-N 3.36Å
686	M	90.2	Very high	91.3	Very high	4 Å²	4	8.3 Å²	8.3	2%	0.02	5%	0.045	C	C	.	.	H	α-helix	trans	-41.2	-62.9	-174	-170.3	168.9	68.3	0	0	115.1	V683 G684 N689 I690 T931 D932	V683-M686 HydrophobicContact CB-CB 3.83Å; V683-M686 HydrophobicContact CB-CG 3.97Å; V683-M686 HydrophobicContact CB-SD 4.03Å; V683-M686 HydrophobicContact CG1-CB 3.68Å; V683-M686 HydrophobicContact CG1-CG 3.68Å; V683-M686 HydrophobicContact CG1-SD 4.26Å; V683-M686 HydrophobicContact CG2-SD 4.23Å; V683-M686 PolarHBondContact O-N 2.94Å; G684-M686 VanDerWaalsContact C-N 3.35Å; G684-M686 PolarHBondContact O-N 2.78Å; M686-N689 PolarHBondContact O-N 2.73Å; M686-N689 VanDerWaalsContact O-N 3.15Å; M686-I690 HydrophobicContact CG-CD1 3.58Å; M686-I690 HydrophobicContact CG-CG1 4.36Å; M686-I690 WeakPolarHBondContact O-CG1 3.45Å; M686-I690 PolarHBondContact O-N 2.73Å; M686-I690 HydrophobicContact SD-CD1 4.39Å; M686-T931 WeakPolarHBondContact CE-O 3.42Å; M686-D932 HydrophobicContact CB-CB 4.41Å; M686-D932 HydrophobicContact CE-CB 4.17Å
687	Y	91.4	Very high	91.2	Very high	35 Å²	35	8.3 Å²	8.3	14%	0.137	5%	0.045	C	C	.	.	H	α-helix	trans	-62.9	-47.8	-173.6	-54.7	-54.3	0	0	0	113.4	A685 N689 I690 I691 Y886 V905 T931	A685-Y687 PolarHBondContact O-N 2.94Å; Y687-N689 VanDerWaalsContact C-N 3.33Å; Y687-N689 PolarHBondContact O-N 2.69Å; Y687-I690 PolarHBondContact O-N 3.33Å; Y687-I691 WeakPolarHBondContact O-CG1 3.41Å; Y687-I691 PolarHBondContact O-N 3.06Å; Y687-Y886 AromaticContact CD2-CD1 3.69Å; Y687-Y886 HydrophobicContact CD2-CD1 3.69Å; Y687-Y886 HydrophobicContact CD2-CD2 4.39Å; Y687-Y886 AromaticContact CD2-CE1 3.34Å; Y687-Y886 HydrophobicContact CD2-CE1 3.34Å; Y687-Y886 HydrophobicContact CD2-CE2 4.08Å; Y687-Y886 HydrophobicContact CD2-CG 4.21Å; Y687-Y886 AromaticContact CD2-CZ 3.54Å; Y687-Y886 HydrophobicContact CE2-CD1 4.45Å; Y687-Y886 AromaticContact CE2-CE1 3.73Å; Y687-Y886 HydrophobicContact CE2-CE1 3.73Å; Y687-Y886 AromaticContact CE2-CE2 3.96Å; Y687-Y886 HydrophobicContact CE2-CE2 3.96Å; Y687-Y886 AromaticContact CE2-CZ 3.44Å; Y687-Y886 VanDerWaalsContact CE2-CZ 3.44Å; Y687-Y886 WeakPolarHBondContact CE2-OH 3.47Å; Y687-Y886 AromaticContact CG-CD1 3.94Å; Y687-Y886 HydrophobicContact CG-CD1 3.94Å; Y687-Y886 HydrophobicContact CG-CD2 4.33Å; Y687-Y886 HydrophobicContact CG-CE1 4.05Å; Y687-Y886 HydrophobicContact CG-CE2 4.41Å; Y687-Y886 HydrophobicContact CG-CG 4.09Å; Y687-V905 HydrophobicContact CD1-CG1 3.49Å; Y687-V905 VanDerWaalsContact CD1-CG1 3.49Å; Y687-V905 HydrophobicContact CE1-CG1 4.42Å; Y687-V905 HydrophobicContact CG-CG1 3.99Å; Y687-T931 WeakPolarHBondContact OH-CG2 3.25Å
688	P	91.1	Very high	91.1	Very high	5 Å²	5	8.5 Å²	8.5	3%	0.032	5%	0.046	C	C	.	.	H	α-helix	trans	-51.6	-45.9	168	-28.5	32.3	0	0	0	114.2	A685 I691 L692 V823 L882	A685-P688 HydrophobicContact CB-CG 4.39Å; A685-P688 VanDerWaalsContact O-CD 3.23Å; A685-P688 WeakPolarHBondContact O-CD 2.86Å; P688-I691 WeakPolarHBondContact O-CB 3.3Å; P688-I691 PolarHBondContact O-N 2.68Å; P688-L692 WeakPolarHBondContact O-CG 3.23Å; P688-L692 PolarHBondContact O-N 2.65Å; P688-V823 HydrophobicContact CB-CG1 4.13Å; P688-L882 HydrophobicContact CB-CD1 3.91Å; P688-L882 HydrophobicContact CB-CG 4.2Å; P688-L882 HydrophobicContact CG-CD1 3.82Å; P688-L882 HydrophobicContact CG-CD2 4.26Å; P688-L882 HydrophobicContact CG-CG 3.64Å
689	N	92.3	Very high	90.8	Very high	3 Å²	3	10 Å²	10	2%	0.016	6%	0.057	C	C	.	.	H	α-helix	trans	-74.4	-28.6	-175.8	-77.5	-32.6	0	0	0	113.2	G684 A685 M686 Y687 T693 R827 S998 I999	G684-N689 PolarHBondContact O-ND2 3.08Å; A685-N689 PolarHBondContact O-N 3.36Å; M686-N689 PolarHBondContact O-N 2.73Å; M686-N689 VanDerWaalsContact O-N 3.15Å; Y687-N689 VanDerWaalsContact C-N 3.33Å; Y687-N689 PolarHBondContact O-N 2.69Å; N689-T693 VanDerWaalsContact O-CB 3.24Å; N689-T693 WeakPolarHBondContact O-CB 3.09Å; N689-T693 PolarHBondContact O-N 3.2Å; N689-T693 PolarHBondContact O-OG1 3Å; N689-R827 WeakPolarHBondContact OD1-CD 3.27Å; N689-R827 PolarHBondContact OD1-NH1 2.67Å; N689-S998 VanDerWaalsContact CB-O 3.25Å; N689-S998 WeakPolarHBondContact CB-O 3.45Å; N689-S998 PolarHBondContact ND2-O 3.1Å; N689-S998 PolarHBondContact OD1-O 3.5Å; N689-I999 HydrophobicContact CB-CG1 4.12Å
690	I	93.8	Very high	90.5	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-65.2	-43.4	167.3	-68.3	165.9	0	0	0	110.8	M686 Y687 T693 N694 L696 V905 T908 I912 I999	M686-I690 HydrophobicContact CG-CD1 3.58Å; M686-I690 HydrophobicContact CG-CG1 4.36Å; M686-I690 WeakPolarHBondContact O-CG1 3.45Å; M686-I690 PolarHBondContact O-N 2.73Å; M686-I690 HydrophobicContact SD-CD1 4.39Å; Y687-I690 PolarHBondContact O-N 3.33Å; I690-T693 PolarHBondContact O-N 2.72Å; I690-N694 PolarHBondContact O-N 3.39Å; I690-N694 VanDerWaalsContact O-N 3.13Å; I690-N694 PolarHBondContact O-ND2 3.03Å; I690-L696 HydrophobicContact CG2-CD1 4.16Å; I690-V905 HydrophobicContact CG2-CG2 4.33Å; I690-T908 HydrophobicContact CD1-CG2 4.18Å; I690-T908 HydrophobicContact CG1-CG2 4.19Å; I690-T908 HydrophobicContact CG2-CG2 3.9Å; I690-I912 HydrophobicContact CD1-CD1 3.96Å; I690-I912 HydrophobicContact CG1-CD1 4.13Å; I690-I999 HydrophobicContact CB-CD1 4.45Å; I690-I999 HydrophobicContact CG1-CD1 3.72Å; I690-I999 HydrophobicContact CG1-CG1 4.11Å
691	I	93.4	Very high	90.4	Very high	1 Å²	1	9.4 Å²	9.4	1%	0.005	6%	0.055	C	C	.	.	H	α-helix	trans	-57.3	-51.7	176.1	-76.9	169.7	0	0	0	110.7	Y687 P688 R695 L696 Y819 V823 F885 M901 V905	Y687-I691 WeakPolarHBondContact O-CG1 3.41Å; Y687-I691 PolarHBondContact O-N 3.06Å; P688-I691 WeakPolarHBondContact O-CB 3.3Å; P688-I691 PolarHBondContact O-N 2.68Å; I691-R695 PolarHBondContact O-N 3.11Å; I691-R695 VanDerWaalsContact O-N 3.07Å; I691-L696 HydrophobicContact CG1-CB 4.5Å; I691-L696 WeakPolarHBondContact CG2-O 3.43Å; I691-L696 PolarHBondContact O-N 2.72Å; I691-Y819 HydrophobicContact CG2-CE1 4.43Å; I691-V823 HydrophobicContact CG2-CB 4.47Å; I691-V823 HydrophobicContact CG2-CG1 4.2Å; I691-V823 HydrophobicContact CG2-CG2 4.26Å; I691-F885 HydrophobicContact CD1-CB 4.48Å; I691-M901 HydrophobicContact CD1-CE 3.89Å; I691-M901 HydrophobicContact CG1-CE 3.92Å; I691-M901 HydrophobicContact CG2-CE 4.4Å; I691-V905 HydrophobicContact CD1-CG2 4.26Å; I691-V905 HydrophobicContact CG1-CG2 3.59Å
692	L	93.5	Very high	89.9	Confident	7 Å²	7	10.7 Å²	10.7	4%	0.037	6%	0.062	C	C	.	.	H	α-helix	trans	-63.6	-48.1	179.5	-64.9	178.8	0	0	0	111.7	P688 N694 R695 V820 V823 K824 Y980	P688-L692 WeakPolarHBondContact O-CG 3.23Å; P688-L692 PolarHBondContact O-N 2.65Å; L692-N694 VanDerWaalsContact C-N 3.34Å; L692-N694 PolarHBondContact O-N 3.43Å; L692-R695 PolarHBondContact O-N 2.65Å; L692-V820 HydrophobicContact CD2-CG1 3.8Å; L692-V820 VanDerWaalsContact CD2-O 3.26Å; L692-V820 WeakPolarHBondContact CD2-O 3.32Å; L692-V823 HydrophobicContact CD1-CG1 4.48Å; L692-V823 HydrophobicContact CD2-CB 4.06Å; L692-V823 HydrophobicContact CD2-CG1 3.96Å; L692-V823 HydrophobicContact CG-CG1 4.09Å; L692-K824 HydrophobicContact CD1-CB 4.29Å; L692-K824 HydrophobicContact CD2-CB 3.8Å; L692-Y980 WeakPolarHBondContact O-CE2 3.46Å
693	T	94.2	Very high	89.2	Confident	0 Å²	0	13 Å²	13	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-56.8	-45.1	-177.9	-63	0	0	0	0	112.8	N689 I690 F975 N977 N997 S998 I999	N689-T693 VanDerWaalsContact O-CB 3.24Å; N689-T693 WeakPolarHBondContact O-CB 3.09Å; N689-T693 PolarHBondContact O-N 3.2Å; N689-T693 PolarHBondContact O-OG1 3Å; I690-T693 PolarHBondContact O-N 2.72Å; T693-F975 WeakPolarHBondContact CG2-O 3.31Å; T693-N977 HydrophobicContact CG2-CB 4.25Å; T693-N977 WeakPolarHBondContact O-CB 3.4Å; T693-N977 PolarHBondContact O-ND2 2.65Å; T693-N997 HydrophobicContact CG2-CB 4.38Å; T693-S998 PolarHBondContact OG1-N 3.01Å; T693-I999 HydrophobicContact CG2-CD1 4.23Å
694	N	94	Very high	88.4	Confident	2 Å²	2	14.7 Å²	14.7	1%	0.011	10%	0.099	C	C	.	.	H	α-helix	trans	-97	4.5	-174.9	-65.6	-78.8	0	0	0	113.5	I690 L692 L696 R723 M725 Q813	I690-N694 PolarHBondContact O-N 3.39Å; I690-N694 VanDerWaalsContact O-N 3.13Å; I690-N694 PolarHBondContact O-ND2 3.03Å; L692-N694 VanDerWaalsContact C-N 3.34Å; L692-N694 PolarHBondContact O-N 3.43Å; N694-L696 VanDerWaalsContact C-N 3.27Å; N694-L696 HydrophobicContact CB-CD1 3.88Å; N694-L696 HydrophobicContact CB-CD2 4.33Å; N694-L696 HydrophobicContact CB-CG 3.75Å; N694-L696 PolarHBondContact O-N 3.28Å; N694-R723 PolarHBondContact OD1-NE 3.35Å; N694-R723 PolarHBondContact OD1-NH2 3.09Å; N694-M725 HydrophobicContact CB-CE 4.19Å; N694-M725 HydrophobicContact CB-SD 3.71Å; N694-M725 WeakPolarHBondContact OD1-CE 3.22Å; N694-Q813 PolarHBondContact O-NE2 2.94Å; N694-Q813 VanDerWaalsContact O-NE2 3.12Å
695	R	92.9	Very high	87.7	Confident	8 Å²	8	15.5 Å²	15.5	3%	0.03	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	37.4	-179.2	-148.9	174.5	-179.9	-71.7	7.3	112.7	I691 L692 Q697 Q813 E815 V820 Y980 H981	I691-R695 PolarHBondContact O-N 3.11Å; I691-R695 VanDerWaalsContact O-N 3.07Å; L692-R695 PolarHBondContact O-N 2.65Å; R695-Q697 PolarHBondContact O-N 2.87Å; R695-Q813 VanDerWaalsContact CD-O 3.22Å; R695-Q813 WeakPolarHBondContact CD-O 3.4Å; R695-Q813 PolarHBondContact NE-O 3.07Å; R695-Q813 PolarHBondContact NH1-O 3.32Å; R695-E815 VanDerWaalsContact CZ-O 3.24Å; R695-E815 PolarHBondContact NH1-O 2.7Å; R695-E815 PolarHBondContact NH2-O 3.5Å; R695-V820 HydrophobicContact CG-CG2 4.25Å; R695-Y980 HydrophobicContact CB-CD2 4.04Å; R695-Y980 HydrophobicContact CB-CE2 3.62Å; R695-Y980 HydrophobicContact CG-CD2 4.34Å; R695-Y980 HydrophobicContact CG-CE2 3.63Å; R695-H981 PolarHBondContact NE-O 2.83Å; R695-H981 VanDerWaalsContact NE-O 3.11Å
696	L	93.1	Very high	87.1	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	13%	0.128	C	C	.	.			trans	-77.9	119.4	-171.6	-65.9	165.8	0	0	0	111.1	I690 I691 N694 V701 M725 V811 M901 I904 V905	I690-L696 HydrophobicContact CG2-CD1 4.16Å; I691-L696 HydrophobicContact CG1-CB 4.5Å; I691-L696 WeakPolarHBondContact CG2-O 3.43Å; I691-L696 PolarHBondContact O-N 2.72Å; N694-L696 VanDerWaalsContact C-N 3.27Å; N694-L696 HydrophobicContact CB-CD1 3.88Å; N694-L696 HydrophobicContact CB-CD2 4.33Å; N694-L696 HydrophobicContact CB-CG 3.75Å; N694-L696 PolarHBondContact O-N 3.28Å; L696-V701 HydrophobicContact CD2-CG2 4.11Å; L696-M725 HydrophobicContact CD2-SD 4.38Å; L696-V811 HydrophobicContact CD2-CB 4.46Å; L696-V811 HydrophobicContact CD2-CG1 3.9Å; L696-V811 HydrophobicContact CD2-CG2 3.72Å; L696-M901 HydrophobicContact CB-CE 4.17Å; L696-M901 HydrophobicContact CB-CG 4.23Å; L696-M901 WeakPolarHBondContact O-CE 3.26Å; L696-I904 HydrophobicContact CD1-CG2 3.8Å; L696-I904 HydrophobicContact CD2-CB 4.43Å; L696-I904 HydrophobicContact CD2-CD1 4.06Å; L696-I904 HydrophobicContact CD2-CG2 3.96Å; L696-V905 HydrophobicContact CD1-CG2 3.72Å
697	Q	92	Very high	86.1	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.005	15%	0.152	C	C	.	.			trans	-157.2	150.1	177.3	53.8	-168.5	4.1	0	0	109.4	R695 S699 A700 V701 E815 N816 Y819 V820 M901	R695-Q697 PolarHBondContact O-N 2.87Å; Q697-S699 VanDerWaalsContact C-N 3.34Å; Q697-S699 PolarHBondContact O-N 3.38Å; Q697-S699 VanDerWaalsContact O-N 3.17Å; Q697-A700 HydrophobicContact CG-CB 3.69Å; Q697-A700 WeakPolarHBondContact O-CB 3.36Å; Q697-A700 PolarHBondContact O-N 2.89Å; Q697-V701 PolarHBondContact O-N 2.73Å; Q697-E815 HydrophobicContact CG-CG 4.32Å; Q697-E815 VanDerWaalsContact NE2-CG 3.28Å; Q697-N816 VanDerWaalsContact CD-O 3.29Å; Q697-N816 PolarHBondContact NE2-O 2.79Å; Q697-N816 PolarHBondContact OE1-O 3.26Å; Q697-Y819 HydrophobicContact CB-CD1 3.7Å; Q697-Y819 HydrophobicContact CB-CG 3.85Å; Q697-V820 HydrophobicContact CB-CG2 4.23Å; Q697-V820 HydrophobicContact CG-CG2 4.23Å; Q697-M901 VanDerWaalsContact CA-SD 3.6Å
698	P	90.6	Very high	85.3	Confident	19 Å²	19	25.5 Å²	25.5	12%	0.123	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-29.7	-164.7	-31.8	42.2	0	0	0	116.3	A700 V889 W896 M901	P698-A700 VanDerWaalsContact C-N 3.33Å; P698-V889 HydrophobicContact CG-CB 4.28Å; P698-V889 HydrophobicContact CG-CG1 3.8Å; P698-W896 HydrophobicContact CB-CB 4.26Å; P698-W896 HydrophobicContact CG-CB 3.93Å; P698-W896 WeakPolarHBondContact CG-O 3.27Å; P698-M901 HydrophobicContact CG-SD 3.8Å
699	S	87.6	Confident	84.8	Confident	32 Å²	32	26 Å²	26	22%	0.224	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-25	173.2	54.6	0	0	0	0	113.5	Q697 E815	Q697-S699 VanDerWaalsContact C-N 3.34Å; Q697-S699 PolarHBondContact O-N 3.38Å; Q697-S699 VanDerWaalsContact O-N 3.17Å; S699-E815 VanDerWaalsContact CB-OE1 3.25Å; S699-E815 WeakPolarHBondContact CB-OE1 3.27Å; S699-E815 WeakPolarHBondContact OG-CG 3.34Å; S699-E815 PolarHBondContact OG-OE1 2.65Å
700	A	88.3	Confident	84.2	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-27.1	-178.4	0	0	0	0	0	113.2	Q697 P698 V811 C812 E815	Q697-A700 HydrophobicContact CG-CB 3.69Å; Q697-A700 WeakPolarHBondContact O-CB 3.36Å; Q697-A700 PolarHBondContact O-N 2.89Å; P698-A700 VanDerWaalsContact C-N 3.33Å; A700-V811 HydrophobicContact CB-CG1 4.18Å; A700-V811 CarbonylContact O-C 3.52Å; A700-V811 WeakPolarHBondContact O-CA 3.32Å; A700-C812 HydrophobicContact CB-CB 4.45Å; A700-C812 PolarHBondContact O-N 2.9Å; A700-E815 HydrophobicContact CB-CB 3.73Å; A700-E815 HydrophobicContact CB-CG 3.75Å
701	V	88.7	Confident	83.3	Confident	9 Å²	9	33.9 Å²	33.9	6%	0.055	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	121.9	-170.4	-173.3	0	0	0	0	110.1	L696 Q697 A809 M810 V811 E900 M901 I904	L696-V701 HydrophobicContact CD2-CG2 4.11Å; Q697-V701 PolarHBondContact O-N 2.73Å; V701-A809 HydrophobicContact CG1-CB 3.93Å; V701-M810 CarbonylContact C-O 3.55Å; V701-M810 WeakPolarHBondContact CA-O 3.37Å; V701-V811 HydrophobicContact CG2-CG1 4.28Å; V701-V811 HydrophobicContact CG2-CG2 4.27Å; V701-E900 HydrophobicContact CG1-CB 3.59Å; V701-M901 HydrophobicContact CG2-CB 4.19Å; V701-I904 HydrophobicContact CG1-CD1 3.99Å
702	D	79.6	Confident	82.8	Confident	30 Å²	30	34.9 Å²	34.9	16%	0.16	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	140	179.4	-154.1	-30.7	0	0	0	112.2	G704 K708 M810	D702-G704 PolarHBondContact OD1-N 2.88Å; D702-K708 WeakPolarHBondContact OD2-CD 3.41Å; D702-K708 WeakPolarHBondContact OD2-CE 3.46Å; D702-K708 IonicContact OD2-NZ 3.61Å; D702-K708 PolarHBondContact OD2-NZ 3.26Å; D702-M810 PolarHBondContact N-O 2.96Å; D702-M810 WeakPolarHBondContact O-CB 3.3Å; D702-M810 PolarHBondContact O-N 2.95Å
703	S	74.6	Confident	82.3	Confident	92 Å²	92	41.1 Å²	41.1	64%	0.643	26%	0.263	S	S	*	.	S	Bend	trans	-85.6	-28	168.8	51.3	0	0	0	0	112.6	S705	S703-S705 VanDerWaalsContact C-N 3.3Å; S703-S705 PolarHBondContact O-N 2.95Å
704	G	69.9	Low	81.8	Confident	37 Å²	37	43.4 Å²	43.4	38%	0.381	27%	0.272	S	S	.	.			trans	-88.1	37	-177.1	0	0	0	0	0	114.5	D702 A706 A707	D702-G704 PolarHBondContact OD1-N 2.88Å; G704-A706 PolarHBondContact O-N 3.43Å; G704-A707 PolarHBondContact O-N 3.1Å
705	S	68.4	Low	81.1	Confident	22 Å²	22	47.9 Å²	47.9	15%	0.154	29%	0.29	C	S	.	.	H	α-helix	trans	-55.8	-28.6	-165	65.8	0	0	0	0	115.3	S703 A707 C709	S703-S705 VanDerWaalsContact C-N 3.3Å; S703-S705 PolarHBondContact O-N 2.95Å; S705-A707 VanDerWaalsContact C-N 3.31Å; S705-A707 PolarHBondContact O-N 2.79Å; S705-C709 WeakPolarHBondContact O-CB 3.21Å; S705-C709 PolarHBondContact O-N 2.92Å; S705-C709 VanDerWaalsContact O-N 3.14Å; S705-C709 PolarHBondContact O-SG 2.88Å; S705-C709 VanDerWaalsContact O-SG 3.36Å
706	A	69.5	Low	80.5	Confident	78 Å²	78	54.5 Å²	54.5	65%	0.645	32%	0.319	S	S	*	.	H	α-helix	trans	-61.9	-35.7	178.6	0	0	0	0	0	113.1	G704 A710	G704-A706 PolarHBondContact O-N 3.43Å; A706-A710 WeakPolarHBondContact O-CB 3.41Å; A706-A710 PolarHBondContact O-N 2.94Å
707	A	70.4	Confident	79.8	Confident	65 Å²	65	60.5 Å²	60.5	54%	0.537	36%	0.358	S	S	.	.	H	α-helix	trans	-75.5	-62.1	-179.2	0	0	0	0	0	111.4	G704 S705 C709 A710	G704-A707 PolarHBondContact O-N 3.1Å; S705-A707 VanDerWaalsContact C-N 3.31Å; S705-A707 PolarHBondContact O-N 2.79Å; A707-C709 PolarHBondContact O-N 3.16Å; A707-C709 VanDerWaalsContact O-N 3.13Å; A707-A710 WeakPolarHBondContact O-CB 3.49Å; A707-A710 PolarHBondContact O-N 3.28Å
708	K	72.7	Confident	79	Confident	124 Å²	124	64.4 Å²	64.4	54%	0.539	40%	0.398	S	S	.	.	H	α-helix	trans	-58.6	-29.9	-179	-78.6	-163.6	-171	145.7	0	113.8	D702	D702-K708 WeakPolarHBondContact OD2-CD 3.41Å; D702-K708 WeakPolarHBondContact OD2-CE 3.46Å; D702-K708 IonicContact OD2-NZ 3.61Å; D702-K708 PolarHBondContact OD2-NZ 3.26Å
709	C	81.2	Confident	78.6	Confident	17 Å²	17	65 Å²	65	12%	0.115	40%	0.4	C	S	.	.	H	α-helix	trans	-79.5	-26.1	175.5	-66.4	0	0	0	0	113.2	S705 A707 D711 C712 Y715 Q722	S705-C709 WeakPolarHBondContact O-CB 3.21Å; S705-C709 PolarHBondContact O-N 2.92Å; S705-C709 VanDerWaalsContact O-N 3.14Å; S705-C709 PolarHBondContact O-SG 2.88Å; S705-C709 VanDerWaalsContact O-SG 3.36Å; A707-C709 PolarHBondContact O-N 3.16Å; A707-C709 VanDerWaalsContact O-N 3.13Å; C709-D711 VanDerWaalsContact C-N 3.32Å; C709-D711 PolarHBondContact O-N 2.85Å; C709-C712 WeakPolarHBondContact O-CB 3.38Å; C709-C712 PolarHBondContact O-N 3.01Å; C709-Y715 HydrophobicContact CB-CD1 4.41Å; C709-Y715 HydrophobicContact CB-CD2 3.82Å; C709-Y715 HydrophobicContact CB-CE2 4.14Å; C709-Y715 HydrophobicContact CB-CG 3.98Å; C709-Y715 WeakPolarHBondContact O-CB 3.06Å; C709-Y715 WeakPolarHBondContact O-CD1 3.49Å; C709-Q722 PolarHBondContact SG-NE2 2.92Å
710	A	79.4	Confident	78.5	Confident	69 Å²	69	65.8 Å²	65.8	57%	0.57	41%	0.406	S	S	*	.	H	α-helix	trans	-63.6	-38	176	0	0	0	0	0	112.4	A706 A707 C712	A706-A710 WeakPolarHBondContact O-CB 3.41Å; A706-A710 PolarHBondContact O-N 2.94Å; A707-A710 WeakPolarHBondContact O-CB 3.49Å; A707-A710 PolarHBondContact O-N 3.28Å; A710-C712 VanDerWaalsContact C-N 3.29Å; A710-C712 PolarHBondContact O-N 3.33Å
711	D	75.9	Confident	78.5	Confident	99 Å²	99	66.4 Å²	66.4	53%	0.529	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-10.9	177.2	-61	-33.6	0	0	0	113.7	P166 N167 C709	P166-D711 HydrophobicContact CB-CB 4.34Å; N167-D711 WeakPolarHBondContact CB-O 3.43Å; C709-D711 VanDerWaalsContact C-N 3.32Å; C709-D711 PolarHBondContact O-N 2.85Å
712	C	83.2	Confident	78.5	Confident	21 Å²	21	67.6 Å²	67.6	14%	0.142	42%	0.415	C	S	.	.			trans	-87.7	117.8	-171.2	177.6	0	0	0	0	111.6	N167 C709 A710 F714 Y715	N167-C712 WeakPolarHBondContact OD1-CA 3.38Å; C709-C712 WeakPolarHBondContact O-CB 3.38Å; C709-C712 PolarHBondContact O-N 3.01Å; A710-C712 VanDerWaalsContact C-N 3.29Å; A710-C712 PolarHBondContact O-N 3.33Å; C712-F714 PolarHBondContact O-N 3.25Å; C712-Y715 VanDerWaalsContact O-CB 3.23Å; C712-Y715 WeakPolarHBondContact O-CB 3.09Å; C712-Y715 PolarHBondContact O-N 3.19Å
713	E	82	Confident	79	Confident	139 Å²	139	67.9 Å²	67.9	65%	0.65	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-25.9	-179.4	-85.3	175.2	-119.5	0	0	114.3	N167 V170 Y715	N167-E713 PolarHBondContact ND2-OE1 2.96Å; N167-E713 PolarHBondContact OD1-N 3.47Å; V170-E713 HydrophobicContact CG1-CB 3.93Å; V170-E713 HydrophobicContact CG1-CG 4.45Å; E713-Y715 VanDerWaalsContact C-N 3.3Å; E713-Y715 PolarHBondContact O-N 3.31Å
714	F	82.9	Confident	79.9	Confident	47 Å²	47	68.9 Å²	68.9	21%	0.206	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-19.2	173.7	-64.6	-66	0	0	0	113.9	L169 V170 C712 K716 I719 R814 L989 Y991	L169-F714 HydrophobicContact CB-CD2 4.06Å; L169-F714 HydrophobicContact CB-CE2 3.81Å; V170-F714 HydrophobicContact CG1-CE2 4.16Å; C712-F714 PolarHBondContact O-N 3.25Å; F714-K716 PolarHBondContact O-N 2.94Å; F714-I719 WeakPolarHBondContact O-CD1 3.4Å; F714-R814 VanDerWaalsContact CD1-NH1 3.25Å; F714-L989 HydrophobicContact CZ-CB 4.34Å; F714-L989 HydrophobicContact CZ-CD1 4.44Å; F714-Y991 HydrophobicContact CZ-CE2 4.25Å
715	Y	81.1	Confident	81	Confident	96 Å²	96	67.9 Å²	67.9	38%	0.376	39%	0.392	S	S	.	.			trans	-71.6	128	-170.4	176.8	-119.8	0	0	0	112.5	C709 C712 E713 I719	C709-Y715 HydrophobicContact CB-CD1 4.41Å; C709-Y715 HydrophobicContact CB-CD2 3.82Å; C709-Y715 HydrophobicContact CB-CE2 4.14Å; C709-Y715 HydrophobicContact CB-CG 3.98Å; C709-Y715 WeakPolarHBondContact O-CB 3.06Å; C709-Y715 WeakPolarHBondContact O-CD1 3.49Å; C712-Y715 VanDerWaalsContact O-CB 3.23Å; C712-Y715 WeakPolarHBondContact O-CB 3.09Å; C712-Y715 PolarHBondContact O-N 3.19Å; E713-Y715 VanDerWaalsContact C-N 3.3Å; E713-Y715 PolarHBondContact O-N 3.31Å; Y715-I719 HydrophobicContact CD2-CG2 4.11Å
716	K	79.6	Confident	82.1	Confident	147 Å²	147	69 Å²	69	64%	0.639	40%	0.399	S	S	*	.			trans	-141.9	148.2	170.6	-61.9	-176.7	-177.5	176.7	0	107.7	F714 G718 I719	F714-K716 PolarHBondContact O-N 2.94Å; K716-G718 PolarHBondContact O-N 2.69Å; K716-I719 WeakPolarHBondContact O-CB 3.43Å; K716-I719 PolarHBondContact O-N 2.84Å
717	P	78	Confident	83.2	Confident	126 Å²	126	65.9 Å²	65.9	82%	0.818	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	127.3	177.1	-27.1	35.5	0	0	0	111.7
718	G	75.7	Confident	84.1	Confident	83 Å²	83	64 Å²	64	86%	0.856	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	20	-178.8	0	0	0	0	0	116.1	K716	K716-G718 PolarHBondContact O-N 2.69Å
719	I	82.2	Confident	84.9	Confident	32 Å²	32	58.2 Å²	58.2	16%	0.164	33%	0.327	C	S	.	.			trans	-69.8	138.7	-179.3	-165.8	161.5	0	0	0	114	F714 Y715 K716 C721 Q722	F714-I719 WeakPolarHBondContact O-CD1 3.4Å; Y715-I719 HydrophobicContact CD2-CG2 4.11Å; K716-I719 WeakPolarHBondContact O-CB 3.43Å; K716-I719 PolarHBondContact O-N 2.84Å; I719-C721 VanDerWaalsContact C-N 3.33Å; I719-C721 PolarHBondContact O-N 3.23Å; I719-Q722 HydrophobicContact CG2-CG 4.19Å
720	S	84.5	Confident	85.1	Confident	49 Å²	49	62.1 Å²	62.1	34%	0.343	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-3.8	-173.6	55.3	0	0	0	0	116.1	I993	S720-I993 WeakPolarHBondContact OG-CD1 3.42Å
721	C	89.1	Confident	85.3	Confident	13 Å²	13	58.9 Å²	58.9	9%	0.088	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-8	-179.2	62.8	0	0	0	0	114.7	I719 R723 Q813 R814	I719-C721 VanDerWaalsContact C-N 3.33Å; I719-C721 PolarHBondContact O-N 3.23Å; C721-R723 PolarHBondContact O-N 2.9Å; C721-Q813 HydrophobicContact CB-CB 4.38Å; C721-Q813 WeakPolarHBondContact O-CG 3.44Å; C721-Q813 PolarHBondContact O-N 3.32Å; C721-R814 HydrophobicContact CB-CG 3.91Å
722	Q	89.2	Confident	85.7	Confident	33 Å²	33	57.3 Å²	57.3	15%	0.154	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	98.1	176.3	-69	177.1	-31.6	0	0	109.8	C709 I719 F724 M810	C709-Q722 PolarHBondContact SG-NE2 2.92Å; I719-Q722 HydrophobicContact CG2-CG 4.19Å; Q722-F724 HydrophobicContact CB-CE2 3.91Å; Q722-F724 HydrophobicContact CB-CZ 4.36Å; Q722-M810 HydrophobicContact CB-CG 4.04Å; Q722-M810 HydrophobicContact CB-SD 4.15Å; Q722-M810 HydrophobicContact CG-CG 4.23Å; Q722-M810 HydrophobicContact CG-SD 4.03Å
723	R	90.5	Very high	85.9	Confident	36 Å²	36	56.3 Å²	56.3	14%	0.136	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	102	176.4	-180	170.1	-176.5	79.8	-9.1	110.2	N694 C721 M725 V811 Q813 T976 N977 Q979	N694-R723 PolarHBondContact OD1-NE 3.35Å; N694-R723 PolarHBondContact OD1-NH2 3.09Å; C721-R723 PolarHBondContact O-N 2.9Å; R723-M725 HydrophobicContact CG-CG 4.09Å; R723-M725 HydrophobicContact CG-SD 4.48Å; R723-V811 HydrophobicContact CB-CB 4.39Å; R723-V811 PolarHBondContact N-O 2.83Å; R723-V811 PolarHBondContact O-N 2.7Å; R723-Q813 HydrophobicContact CB-CG 3.93Å; R723-T976 PolarHBondContact NH2-O 3Å; R723-N977 WeakPolarHBondContact CD-OD1 3.26Å; R723-N977 PolarHBondContact NH1-OD1 2.93Å; R723-Q979 VanDerWaalsContact CG-OE1 3.31Å; R723-Q979 VanDerWaalsContact NH1-OE1 3.14Å
724	F	91.7	Very high	86.1	Confident	113 Å²	113	49.7 Å²	49.7	50%	0.496	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	130.9	175.6	-64.4	-84.3	0	0	0	110.6	Q722 I808 A809 M810	Q722-F724 HydrophobicContact CB-CE2 3.91Å; Q722-F724 HydrophobicContact CB-CZ 4.36Å; F724-I808 HydrophobicContact CB-CG2 3.78Å; F724-I808 HydrophobicContact CD1-CG2 4.04Å; F724-I808 HydrophobicContact CG-CG2 4.38Å; F724-A809 WeakPolarHBondContact CA-O 3.5Å; F724-M810 HydrophobicContact CD1-CB 3.89Å; F724-M810 HydrophobicContact CD1-CG 4.17Å; F724-M810 HydrophobicContact CE1-CB 3.7Å; F724-M810 HydrophobicContact CE1-CG 3.78Å; F724-M810 HydrophobicContact CE2-CG 4.47Å; F724-M810 HydrophobicContact CZ-CB 4.38Å; F724-M810 HydrophobicContact CZ-CG 3.94Å
725	M	93.3	Very high	86.3	Confident	16 Å²	16	48.2 Å²	48.2	8%	0.079	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	136.1	180	-64.4	-166.5	72.2	0	0	111.8	N694 L696 R723 I808 A809 V811 I904	N694-M725 HydrophobicContact CB-CE 4.19Å; N694-M725 HydrophobicContact CB-SD 3.71Å; N694-M725 WeakPolarHBondContact OD1-CE 3.22Å; L696-M725 HydrophobicContact CD2-SD 4.38Å; R723-M725 HydrophobicContact CG-CG 4.09Å; R723-M725 HydrophobicContact CG-SD 4.48Å; M725-I808 WeakPolarHBondContact O-CA 3.4Å; M725-A809 PolarHBondContact N-O 3.06Å; M725-A809 PolarHBondContact O-N 3.38Å; M725-V811 HydrophobicContact CG-CG2 4.27Å; M725-V811 HydrophobicContact SD-CG2 4.26Å; M725-I904 HydrophobicContact CB-CD1 4.13Å; M725-I904 HydrophobicContact CB-CG1 4.16Å; M725-I904 HydrophobicContact CB-CG2 4.05Å; M725-I904 HydrophobicContact CE-CG2 3.63Å; M725-I904 HydrophobicContact SD-CG2 3.76Å
726	P	92.4	Very high	86.4	Confident	47 Å²	47	43.6 Å²	43.6	31%	0.305	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	150.6	175	32.7	-34.6	0	0	0	112	E806 R807 H907	P726-E806 HydrophobicContact CB-CG 4.03Å; P726-E806 WeakPolarHBondContact CB-OE1 3.29Å; P726-R807 CarbonylContact C-O 3.58Å; P726-R807 WeakPolarHBondContact CA-O 3.37Å; P726-H907 PolarHBondContact O-CD2 2.85Å
727	W	92.6	Very high	86.5	Confident	12 Å²	12	38 Å²	38	5%	0.045	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	148.8	169.8	64.3	-73.6	0	0	0	110.5	W729 R807 M899 E900 G903 I904 H907	W727-W729 HydrophobicContact CE3-CB 4.1Å; W727-W729 HydrophobicContact CH2-CB 3.86Å; W727-W729 AromaticContact CH2-CD1 3.61Å; W727-W729 HydrophobicContact CH2-CG 4.09Å; W727-W729 HydrophobicContact CZ2-CB 4.48Å; W727-W729 HydrophobicContact CZ3-CB 3.63Å; W727-W729 AromaticContact CZ3-CD1 3.79Å; W727-W729 HydrophobicContact CZ3-CG 4.13Å; W727-R807 HydrophobicContact CZ2-CB 4.38Å; W727-R807 PolarHBondContact N-O 3.34Å; W727-R807 PolarHBondContact O-N 3.07Å; W727-M899 HydrophobicContact CH2-CG 4.2Å; W727-M899 HydrophobicContact CZ3-CG 4.07Å; W727-E900 HydrophobicContact CH2-CG 4.43Å; W727-E900 HydrophobicContact CZ2-CB 4.22Å; W727-E900 HydrophobicContact CZ2-CG 3.83Å; W727-G903 VanDerWaalsContact CB-C 3.5Å; W727-I904 HydrophobicContact CB-CG1 4Å; W727-I904 HydrophobicContact CG-CG1 4.29Å; W727-H907 HydrophobicContact CB-CB 4.46Å
728	T	88.3	Confident	86.7	Confident	26 Å²	26	36.3 Å²	36.3	16%	0.16	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	106.1	179.7	-47.1	0	0	0	0	110.3	Y588 V589 T804 E805 H907	Y588-T728 CarbonylContact C-O 3.46Å; Y588-T728 WeakPolarHBondContact CA-O 3.49Å; Y588-T728 WeakPolarHBondContact CB-O 3.38Å; V589-T728 HydrophobicContact CB-CG2 3.8Å; V589-T728 HydrophobicContact CG2-CG2 3.83Å; V589-T728 PolarHBondContact N-O 3.07Å; T728-T804 HydrophobicContact CG2-CG2 3.54Å; T728-E805 CarbonylContact C-O 3.56Å; T728-E805 WeakPolarHBondContact CA-O 3.28Å; T728-H907 PolarHBondContact OG1-ND1 3.01Å
729	W	89.9	Confident	86.8	Confident	1 Å²	1	36.4 Å²	36.4	0%	0.004	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	142.5	171	176.1	80.7	0	0	0	110.2	T577 I583 W727 A731 L733 R803 T804 E805 R807	T577-W729 HydrophobicContact CG2-CH2 3.94Å; I583-W729 HydrophobicContact CD1-CZ2 3.9Å; I583-W729 HydrophobicContact CG1-CZ2 4.29Å; W727-W729 HydrophobicContact CE3-CB 4.1Å; W727-W729 HydrophobicContact CH2-CB 3.86Å; W727-W729 AromaticContact CH2-CD1 3.61Å; W727-W729 HydrophobicContact CH2-CG 4.09Å; W727-W729 HydrophobicContact CZ2-CB 4.48Å; W727-W729 HydrophobicContact CZ3-CB 3.63Å; W727-W729 AromaticContact CZ3-CD1 3.79Å; W727-W729 HydrophobicContact CZ3-CG 4.13Å; W729-A731 HydrophobicContact CD2-CB 4.4Å; W729-A731 HydrophobicContact CH2-CB 3.48Å; W729-A731 VanDerWaalsContact CH2-CB 3.48Å; W729-A731 HydrophobicContact CZ2-CB 3.29Å; W729-A731 HydrophobicContact CZ3-CB 4.09Å; W729-L733 HydrophobicContact CH2-CD2 4.11Å; W729-R803 HydrophobicContact CZ3-CB 4.49Å; W729-R803 HydrophobicContact CZ3-CG 4.34Å; W729-T804 CarbonylContact O-C 3.52Å; W729-T804 WeakPolarHBondContact O-CA 3.29Å; W729-E805 HydrophobicContact CE3-CB 4.22Å; W729-E805 HydrophobicContact CE3-CG 4.14Å; W729-E805 HydrophobicContact CZ3-CG 4.29Å; W729-E805 WeakPolarHBondContact CZ3-OE2 3.45Å; W729-E805 PolarHBondContact N-O 2.89Å; W729-E805 PolarHBondContact O-N 3.45Å; W729-R807 HydrophobicContact CB-CG 4.27Å; W729-R807 VanDerWaalsContact CD2-CZ 3.45Å; W729-R807 VanDerWaalsContact CE3-CZ 3.45Å; W729-R807 VanDerWaalsContact CE3-NH2 3.34Å; W729-R807 VanDerWaalsContact CH2-NH2 3.26Å
730	R	85.5	Confident	87	Confident	100 Å²	100	36.5 Å²	36.5	38%	0.377	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	125.9	171.8	168.8	175.6	167.9	153.7	-0.7	109.6	Q586 T587 V589 T802 R803 T804	Q586-R730 WeakPolarHBondContact CA-O 3.37Å; T587-R730 HydrophobicContact CG2-CB 4.18Å; T587-R730 HydrophobicContact CG2-CG 4.29Å; T587-R730 PolarHBondContact N-O 3.38Å; T587-R730 PolarHBondContact O-N 3.02Å; V589-R730 HydrophobicContact CG2-CB 3.66Å; V589-R730 HydrophobicContact CG2-CG 4.46Å; R730-T802 HydrophobicContact CG-CG2 4.14Å; R730-R803 WeakPolarHBondContact CA-O 3.38Å; R730-T804 HydrophobicContact CB-CG2 4.4Å
731	A	84	Confident	86.7	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.008	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	148.7	174.3	0	0	0	0	0	112.4	I583 S585 Q586 W729 L733 T802 R803	I583-A731 HydrophobicContact CG2-CB 4.28Å; S585-A731 CarbonylContact O-C 3.56Å; S585-A731 WeakPolarHBondContact O-CA 3.43Å; S585-A731 WeakPolarHBondContact O-CB 3.48Å; Q586-A731 HydrophobicContact CB-CB 4.04Å; W729-A731 HydrophobicContact CD2-CB 4.4Å; W729-A731 HydrophobicContact CH2-CB 3.48Å; W729-A731 VanDerWaalsContact CH2-CB 3.48Å; W729-A731 HydrophobicContact CZ2-CB 3.29Å; W729-A731 HydrophobicContact CZ3-CB 4.09Å; A731-L733 HydrophobicContact CB-CD2 3.82Å; A731-L733 HydrophobicContact CB-CG 4.23Å; A731-T802 CarbonylContact O-C 2.94Å; A731-T802 WeakPolarHBondContact O-CA 3.46Å; A731-R803 PolarHBondContact N-O 3.19Å; A731-R803 PolarHBondContact O-N 3.32Å
732	E	84.5	Confident	86.3	Confident	65 Å²	65	36.9 Å²	36.9	30%	0.304	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	96	159.9	-73.4	156.9	168.4	0	0	105.8	D584 S585 H800	D584-E732 WeakPolarHBondContact CB-O 3.25Å; D584-E732 PolarHBondContact N-O 3.16Å; S585-E732 WeakPolarHBondContact CB-OE2 3.25Å; S585-E732 PolarHBondContact N-O 3.35Å; S585-E732 PolarHBondContact O-N 2.91Å; S585-E732 PolarHBondContact OG-OE2 2.91Å; E732-H800 HydrophobicContact CB-CB 4.21Å
733	L	87	Confident	85.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	137.9	176.2	-59.4	-179.2	0	0	0	108.7	T577 H581 L582 I583 W729 A731 H800 L801 R803	T577-L733 HydrophobicContact CG2-CD1 4.08Å; T577-L733 HydrophobicContact CG2-CD2 3.74Å; H581-L733 HydrophobicContact CB-CB 4.41Å; H581-L733 HydrophobicContact CB-CD1 4.07Å; L582-L733 CarbonylContact O-C 3.55Å; L582-L733 WeakPolarHBondContact O-CA 3.33Å; I583-L733 HydrophobicContact CB-CD2 4.23Å; I583-L733 HydrophobicContact CG1-CD2 3.49Å; I583-L733 VanDerWaalsContact CG1-CD2 3.49Å; W729-L733 HydrophobicContact CH2-CD2 4.11Å; A731-L733 HydrophobicContact CB-CD2 3.82Å; A731-L733 HydrophobicContact CB-CG 4.23Å; L733-H800 CarbonylContact O-C 3.44Å; L733-H800 WeakPolarHBondContact O-CA 3.26Å; L733-L801 PolarHBondContact N-O 3.33Å; L733-L801 PolarHBondContact O-N 3.24Å; L733-R803 HydrophobicContact CD1-CB 3.97Å; L733-R803 HydrophobicContact CD1-CG 4.49Å; L733-R803 HydrophobicContact CG-CB 4.44Å
734	W	85.4	Confident	85.4	Confident	1 Å²	1	41.4 Å²	41.4	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	144	156.3	-59.1	104.9	0	0	0	108.4	L582 D584 A736 K785 I788 T789 I799 H800	L582-W734 HydrophobicContact CB-CB 4.28Å; L582-W734 HydrophobicContact CB-CG 4.4Å; L582-W734 HydrophobicContact CD2-CG 4.37Å; L582-W734 PolarHBondContact O-N 3.3Å; D584-W734 HydrophobicContact CB-CD2 4.18Å; D584-W734 HydrophobicContact CB-CG 4.39Å; D584-W734 HydrophobicContact CB-CZ2 3.99Å; D584-W734 VanDerWaalsContact OD1-CZ2 3.22Å; D584-W734 WeakPolarHBondContact OD1-CZ2 3.17Å; W734-A736 PolarHBondContact O-N 2.87Å; W734-K785 HydrophobicContact CH2-CG 4.05Å; W734-K785 HydrophobicContact CZ2-CD 4.42Å; W734-K785 HydrophobicContact CZ2-CG 4.08Å; W734-I788 HydrophobicContact CB-CG2 3.76Å; W734-I788 HydrophobicContact CD2-CB 4.4Å; W734-I788 HydrophobicContact CD2-CG2 3.53Å; W734-I788 HydrophobicContact CE3-CB 4.48Å; W734-I788 HydrophobicContact CE3-CG2 3.66Å; W734-I788 HydrophobicContact CG-CG2 3.63Å; W734-I788 HydrophobicContact CZ3-CG2 4.39Å; W734-T789 VanDerWaalsContact CH2-OG1 3.29Å; W734-T789 WeakPolarHBondContact CH2-OG1 3.34Å; W734-T789 VanDerWaalsContact CZ3-OG1 3.32Å; W734-T789 WeakPolarHBondContact CZ3-OG1 3.3Å; W734-I799 HydrophobicContact CE3-CG2 4.01Å; W734-I799 HydrophobicContact CZ3-CG2 3.55Å; W734-H800 AromaticContact CE3-CE1 3.59Å; W734-H800 AromaticContact CE3-ND1 3.73Å; W734-H800 AromaticContact CH2-CE1 3.73Å; W734-H800 AromaticContact CZ3-CE1 3.39Å; W734-H800 WeakPolarHBondContact CZ3-CE1 3.42Å
735	T	87.6	Confident	84.7	Confident	15 Å²	15	37 Å²	37	9%	0.092	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	-12.7	177.6	57	0	0	0	0	112.7	H581 C792 Y796 L801	H581-T735 PolarHBondContact CD2-O 3.24Å; T735-C792 PolarHBondContact N-SG 2.86Å; T735-C792 VanDerWaalsContact N-SG 3.38Å; T735-C792 WeakPolarHBondContact OG1-CA 3.21Å; T735-C792 VanDerWaalsContact OG1-CB 3.25Å; T735-C792 WeakPolarHBondContact OG1-CB 3.33Å; T735-C792 PolarHBondContact OG1-SG 3Å; T735-C792 VanDerWaalsContact OG1-SG 3.36Å; T735-Y796 VanDerWaalsContact CB-CG 3.47Å; T735-Y796 HydrophobicContact CG2-CG 4.3Å; T735-Y796 WeakPolarHBondContact O-CE1 3.39Å; T735-Y796 PolarHBondContact O-OH 2.68Å; T735-Y796 WeakPolarHBondContact OG1-CB 3.33Å; T735-Y796 WeakPolarHBondContact OG1-CD2 3.49Å; T735-Y796 WeakPolarHBondContact OG1-CE2 3.5Å; T735-L801 HydrophobicContact CG2-CB 4.28Å
736	A	83.9	Confident	83.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	139.6	174.4	0	0	0	0	0	112.8	L582 W734 V741 I788 Y791 C792	L582-A736 PolarHBondContact N-O 3.29Å; W734-A736 PolarHBondContact O-N 2.87Å; A736-V741 HydrophobicContact CB-CG2 3.97Å; A736-I788 HydrophobicContact CB-CG2 4.08Å; A736-Y791 HydrophobicContact CB-CD1 3.85Å; A736-Y791 HydrophobicContact CB-CE1 4.37Å; A736-C792 PolarHBondContact N-SG 2.63Å
737	S	81.4	Confident	83.1	Confident	30 Å²	30	37.9 Å²	37.9	21%	0.21	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	161.8	176.5	71.5	0	0	0	0	112.9	G580 E740 V741	G580-S737 CarbonylContact O-C 3.52Å; G580-S737 WeakPolarHBondContact O-CA 3.34Å; S737-E740 VanDerWaalsContact CB-OE2 3.29Å; S737-E740 WeakPolarHBondContact CB-OE2 3.33Å; S737-E740 PolarHBondContact N-OE2 3.39Å; S737-E740 CarbonylContact O-C 3.49Å; S737-E740 WeakPolarHBondContact O-CA 3.41Å; S737-E740 WeakPolarHBondContact O-CB 3.4Å; S737-E740 PolarHBondContact O-N 3.22Å; S737-E740 VanDerWaalsContact OG-CD 3.26Å; S737-E740 PolarHBondContact OG-OE2 3.08Å; S737-V741 WeakPolarHBondContact O-CG2 3.29Å; S737-V741 PolarHBondContact O-N 3.14Å
738	R	81.8	Confident	82.6	Confident	89 Å²	89	37.3 Å²	37.3	34%	0.336	18%	0.179	S	C	.	.	H	α-helix	trans	-54.5	-41.5	-175.9	-174.4	171.3	-174.7	-168.3	-0.3	114.9	F576 G580 E740 V741 Y742	F576-R738 HydrophobicContact CD1-CB 3.6Å; F576-R738 HydrophobicContact CD1-CG 3.91Å; F576-R738 HydrophobicContact CD2-CB 4.49Å; F576-R738 HydrophobicContact CD2-CG 3.91Å; F576-R738 VanDerWaalsContact CE1-CA 3.48Å; F576-R738 HydrophobicContact CE1-CB 3.63Å; F576-R738 HydrophobicContact CE1-CG 3.81Å; F576-R738 HydrophobicContact CE2-CG 3.81Å; F576-R738 HydrophobicContact CG-CB 4.04Å; F576-R738 HydrophobicContact CG-CG 3.95Å; F576-R738 HydrophobicContact CZ-CB 4.11Å; F576-R738 HydrophobicContact CZ-CG 3.75Å; G580-R738 WeakPolarHBondContact O-CB 3.49Å; G580-R738 PolarHBondContact O-N 3.25Å; R738-E740 VanDerWaalsContact C-N 3.29Å; R738-E740 PolarHBondContact O-N 3.41Å; R738-V741 PolarHBondContact O-N 3.27Å; R738-Y742 HydrophobicContact CG-CD2 3.8Å; R738-Y742 HydrophobicContact CG-CE2 3.5Å; R738-Y742 VanDerWaalsContact NE-CE2 3.27Å; R738-Y742 PolarHBondContact NE-OH 3.13Å; R738-Y742 PolarHBondContact NH2-OH 3.31Å; R738-Y742 WeakPolarHBondContact O-CD2 3.42Å; R738-Y742 PolarHBondContact O-N 3.34Å
739	P	78.4	Confident	81.7	Confident	85 Å²	85	38 Å²	38	55%	0.552	19%	0.185	S	C	*	.	H	α-helix	trans	-67.5	-27.4	173.6	-20.9	34.4	0	0	0	113.8	R743	P739-R743 WeakPolarHBondContact O-CB 3.25Å; P739-R743 PolarHBondContact O-N 2.92Å
740	E	86.2	Confident	81	Confident	35 Å²	35	40.8 Å²	40.8	16%	0.164	20%	0.198	C	C	.	.	H	α-helix	trans	-75	-48.8	173.9	-66.1	156.9	147.1	0	0	109.2	S737 R738 Y742 R743 I744 Y791 Y796	S737-E740 VanDerWaalsContact CB-OE2 3.29Å; S737-E740 WeakPolarHBondContact CB-OE2 3.33Å; S737-E740 PolarHBondContact N-OE2 3.39Å; S737-E740 CarbonylContact O-C 3.49Å; S737-E740 WeakPolarHBondContact O-CA 3.41Å; S737-E740 WeakPolarHBondContact O-CB 3.4Å; S737-E740 PolarHBondContact O-N 3.22Å; S737-E740 VanDerWaalsContact OG-CD 3.26Å; S737-E740 PolarHBondContact OG-OE2 3.08Å; R738-E740 VanDerWaalsContact C-N 3.29Å; R738-E740 PolarHBondContact O-N 3.41Å; E740-Y742 VanDerWaalsContact C-N 3.34Å; E740-Y742 PolarHBondContact O-N 3.22Å; E740-R743 WeakPolarHBondContact O-CB 3.38Å; E740-R743 PolarHBondContact O-N 2.93Å; E740-I744 VanDerWaalsContact O-CB 3.22Å; E740-I744 WeakPolarHBondContact O-CB 3.14Å; E740-I744 PolarHBondContact O-N 2.7Å; E740-Y791 HydrophobicContact CB-CE1 3.88Å; E740-Y791 HydrophobicContact CG-CE1 4Å; E740-Y791 PolarHBondContact OE1-OH 2.85Å; E740-Y796 PolarHBondContact OE1-OH 3.18Å; E740-Y796 PolarHBondContact OE2-OH 3.46Å
741	V	78.3	Confident	80.8	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.7	-38	176.6	175.7	0	0	0	0	113.2	F576 L582 A736 S737 R738 I744 H745 I788	F576-V741 HydrophobicContact CE1-CB 3.85Å; F576-V741 HydrophobicContact CE1-CG1 4.01Å; F576-V741 HydrophobicContact CE1-CG2 4Å; F576-V741 HydrophobicContact CZ-CB 3.86Å; F576-V741 HydrophobicContact CZ-CG1 3.62Å; F576-V741 HydrophobicContact CZ-CG2 4.46Å; L582-V741 HydrophobicContact CB-CG2 4.2Å; L582-V741 HydrophobicContact CD2-CG1 4.17Å; L582-V741 HydrophobicContact CD2-CG2 4.24Å; A736-V741 HydrophobicContact CB-CG2 3.97Å; S737-V741 WeakPolarHBondContact O-CG2 3.29Å; S737-V741 PolarHBondContact O-N 3.14Å; R738-V741 PolarHBondContact O-N 3.27Å; V741-I744 WeakPolarHBondContact O-CB 3.47Å; V741-I744 WeakPolarHBondContact O-CG2 3.47Å; V741-H745 PolarHBondContact O-CD2 2.75Å; V741-H745 PolarHBondContact O-N 2.92Å; V741-I788 HydrophobicContact CB-CD1 4.2Å; V741-I788 HydrophobicContact CG1-CD1 3.85Å; V741-I788 HydrophobicContact CG2-CD1 3.57Å; V741-I788 HydrophobicContact CG2-CG1 4.48Å
742	Y	80.6	Confident	80.2	Confident	69 Å²	69	40.9 Å²	40.9	27%	0.271	20%	0.198	S	C	.	.	H	α-helix	trans	-73.8	-30.5	174.1	-72.5	-37.4	0	0	0	113.9	L566 F576 R738 E740 I744 H745 A746	L566-Y742 PolarHBondContact O-OH 2.72Å; F576-Y742 HydrophobicContact CE2-CE1 4.36Å; R738-Y742 HydrophobicContact CG-CD2 3.8Å; R738-Y742 HydrophobicContact CG-CE2 3.5Å; R738-Y742 VanDerWaalsContact NE-CE2 3.27Å; R738-Y742 PolarHBondContact NE-OH 3.13Å; R738-Y742 PolarHBondContact NH2-OH 3.31Å; R738-Y742 WeakPolarHBondContact O-CD2 3.42Å; R738-Y742 PolarHBondContact O-N 3.34Å; E740-Y742 VanDerWaalsContact C-N 3.34Å; E740-Y742 PolarHBondContact O-N 3.22Å; Y742-I744 VanDerWaalsContact C-N 3.3Å; Y742-H745 PolarHBondContact O-N 2.99Å; Y742-A746 WeakPolarHBondContact O-CB 3.38Å; Y742-A746 PolarHBondContact O-N 3.5Å
743	R	78.8	Confident	79.5	Confident	156 Å²	156	38.1 Å²	38.1	59%	0.589	19%	0.185	S	C	*	.	H	α-helix	trans	-67	-39.5	173	-174	-169.3	-48.4	166.3	10	110.8	P739 E740 Q747	P739-R743 WeakPolarHBondContact O-CB 3.25Å; P739-R743 PolarHBondContact O-N 2.92Å; E740-R743 WeakPolarHBondContact O-CB 3.38Å; E740-R743 PolarHBondContact O-N 2.93Å; R743-Q747 PolarHBondContact O-N 3.18Å
744	I	81	Confident	78.7	Confident	8 Å²	8	40.8 Å²	40.8	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-51.5	-70.7	164.5	-89.4	170.4	0	0	0	108.7	E740 V741 Y742 A746 Q747 L748 I788 Y791 Q2582	E740-I744 VanDerWaalsContact O-CB 3.22Å; E740-I744 WeakPolarHBondContact O-CB 3.14Å; E740-I744 PolarHBondContact O-N 2.7Å; V741-I744 WeakPolarHBondContact O-CB 3.47Å; V741-I744 WeakPolarHBondContact O-CG2 3.47Å; Y742-I744 VanDerWaalsContact C-N 3.3Å; I744-A746 CarbonylContact O-C 3.51Å; I744-A746 PolarHBondContact O-N 2.99Å; I744-Q747 WeakPolarHBondContact O-CA 3.45Å; I744-Q747 WeakPolarHBondContact O-CB 3.31Å; I744-Q747 PolarHBondContact O-N 2.96Å; I744-L748 PolarHBondContact O-N 3.24Å; I744-I788 HydrophobicContact CD1-CG1 3.95Å; I744-I788 HydrophobicContact CG2-CD1 3.93Å; I744-I788 HydrophobicContact CG2-CG1 3.81Å; I744-Y791 HydrophobicContact CD1-CD1 4.21Å; I744-Y791 HydrophobicContact CD1-CD2 3.91Å; I744-Y791 HydrophobicContact CD1-CG 3.67Å; I744-Q2582 CarbonylContact C-O 3.38Å; I744-Q2582 WeakPolarHBondContact CA-OXT 3.49Å; I744-Q2582 WeakPolarHBondContact CB-OXT 3.31Å; I744-Q2582 HydrophobicContact CG2-CB 3.45Å; I744-Q2582 VanDerWaalsContact CG2-CB 3.45Å; I744-Q2582 WeakPolarHBondContact CG2-O 3.4Å; I744-Q2582 WeakPolarHBondContact CG2-OXT 3.44Å; I744-Q2582 CarbonylContact O-C 3.48Å
745	H	77.5	Confident	77.2	Confident	21 Å²	21	41.1 Å²	41.1	10%	0.097	20%	0.204	C	C	.	.	H	α-helix	trans	-54.6	-31	-176.7	-68.6	-71	0	0	0	114.3	V741 Y742 L748 S749 E784 Q2582	V741-H745 PolarHBondContact O-CD2 2.75Å; V741-H745 PolarHBondContact O-N 2.92Å; Y742-H745 PolarHBondContact O-N 2.99Å; H745-L748 WeakPolarHBondContact O-CB 3.2Å; H745-L748 PolarHBondContact O-N 3.06Å; H745-S749 WeakPolarHBondContact O-CB 3.23Å; H745-S749 PolarHBondContact O-N 3.01Å; H745-S749 PolarHBondContact O-OG 3.48Å; H745-E784 IonicContact CE1-OE1 3.16Å; H745-E784 PolarHBondContact CE1-OE1 3.39Å; H745-E784 VanDerWaalsContact CE1-OE1 3.25Å; H745-E784 IonicContact CE1-OE2 2.63Å; H745-E784 IonicContact ND1-OE1 3.22Å; H745-E784 PolarHBondContact ND1-OE1 3.41Å; H745-E784 IonicContact ND1-OE2 3.41Å; H745-Q2582 WeakPolarHBondContact CA-O 3.31Å; H745-Q2582 PolarHBondContact N-O 3.43Å
746	A	74.7	Confident	75.4	Confident	49 Å²	49	46.8 Å²	46.8	41%	0.405	23%	0.228	S	C	.	.	H	α-helix	trans	-65.9	-47.7	173.1	0	0	0	0	0	112.9	Y742 I744 L748 S749 Q750	Y742-A746 WeakPolarHBondContact O-CB 3.38Å; Y742-A746 PolarHBondContact O-N 3.5Å; I744-A746 CarbonylContact O-C 3.51Å; I744-A746 PolarHBondContact O-N 2.99Å; A746-L748 PolarHBondContact O-N 2.85Å; A746-S749 PolarHBondContact O-OG 2.65Å; A746-Q750 VanDerWaalsContact O-CD 3.25Å; A746-Q750 VanDerWaalsContact O-CG 3.31Å; A746-Q750 WeakPolarHBondContact O-CG 3.43Å; A746-Q750 PolarHBondContact O-NE2 2.75Å
747	Q	78.7	Confident	73.4	Confident	32 Å²	32	49.2 Å²	49.2	15%	0.15	24%	0.24	C	C	.	.	H	α-helix	trans	-62.3	-28.5	172.4	179.3	160.7	31.2	0	0	112.2	R743 I744 Q750 H2503 L2580	R743-Q747 PolarHBondContact O-N 3.18Å; I744-Q747 WeakPolarHBondContact O-CA 3.45Å; I744-Q747 WeakPolarHBondContact O-CB 3.31Å; I744-Q747 PolarHBondContact O-N 2.96Å; Q747-Q750 WeakPolarHBondContact O-CB 3.4Å; Q747-H2503 PolarHBondContact NE2-CE1 2.99Å; Q747-H2503 PolarHBondContact NE2-NE2 3.12Å; Q747-L2580 HydrophobicContact CG-CB 4.35Å
748	L	80.5	Confident	71.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-79.9	-52	-176.3	-157.9	-145.9	0	0	0	114.3	I744 H745 A746 Q750 E751 F753 F772 V783 E784 Q2581 Q2582	I744-L748 PolarHBondContact O-N 3.24Å; H745-L748 WeakPolarHBondContact O-CB 3.2Å; H745-L748 PolarHBondContact O-N 3.06Å; A746-L748 PolarHBondContact O-N 2.85Å; L748-Q750 PolarHBondContact O-N 2.86Å; L748-E751 PolarHBondContact O-N 3.36Å; L748-F753 HydrophobicContact CD2-CE1 4.31Å; L748-F753 HydrophobicContact CD2-CE2 4.35Å; L748-F753 HydrophobicContact CD2-CZ 3.5Å; L748-F753 VanDerWaalsContact CD2-CZ 3.5Å; L748-F772 HydrophobicContact CD1-CD1 4.25Å; L748-F772 HydrophobicContact CD1-CD2 3.89Å; L748-F772 HydrophobicContact CD1-CE1 3.75Å; L748-F772 HydrophobicContact CD1-CE2 3.33Å; L748-F772 HydrophobicContact CD1-CG 4.31Å; L748-F772 HydrophobicContact CD1-CZ 3.25Å; L748-F772 HydrophobicContact CD2-CB 4.24Å; L748-F772 HydrophobicContact CD2-CD1 4.34Å; L748-F772 HydrophobicContact CD2-CD2 3.2Å; L748-F772 HydrophobicContact CD2-CE2 3.49Å; L748-F772 VanDerWaalsContact CD2-CE2 3.49Å; L748-F772 HydrophobicContact CD2-CG 3.67Å; L748-F772 HydrophobicContact CD2-CZ 4.19Å; L748-F772 HydrophobicContact CG-CD2 4.18Å; L748-F772 HydrophobicContact CG-CE2 4.07Å; L748-F772 HydrophobicContact CG-CZ 4.34Å; L748-V783 HydrophobicContact CD1-CG1 4.49Å; L748-V783 HydrophobicContact CD2-CG1 3.83Å; L748-V783 HydrophobicContact CG-CG1 4.44Å; L748-E784 HydrophobicContact CD1-CG 3.38Å; L748-E784 WeakPolarHBondContact CD1-OE1 3.5Å; L748-Q2581 HydrophobicContact CD2-CB 3.73Å; L748-Q2581 HydrophobicContact CD2-CG 4.43Å; L748-Q2581 VanDerWaalsContact CG-C 3.42Å; L748-Q2581 HydrophobicContact CG-CB 4.25Å; L748-Q2582 WeakPolarHBondContact CB-O 3.5Å; L748-Q2582 WeakPolarHBondContact CD1-O 3.44Å; L748-Q2582 VanDerWaalsContact CG-CA 3.49Å; L748-Q2582 WeakPolarHBondContact CG-O 3.3Å
749	S	69.7	Low	69.4	Low	41 Å²	41	50.2 Å²	50.2	29%	0.287	25%	0.254	S	S	.	.	H	α-helix	trans	-48.2	-24	-177.9	66.1	0	0	0	0	113.2	H745 A746 N2410	H745-S749 WeakPolarHBondContact O-CB 3.23Å; H745-S749 PolarHBondContact O-N 3.01Å; H745-S749 PolarHBondContact O-OG 3.48Å; A746-S749 PolarHBondContact O-OG 2.65Å; S749-N2410 PolarHBondContact O-ND2 2.93Å; S749-N2410 PolarHBondContact O-OD1 2.68Å; S749-N2410 PolarHBondContact OG-ND2 3.32Å
750	Q	75.7	Confident	67.7	Low	59 Å²	59	50.9 Å²	50.9	28%	0.276	27%	0.267	S	S	.	.	H	α-helix	trans	-80.3	-40.4	-178.6	-80.9	-176	22.3	0	0	114.6	A746 Q747 L748 L2409 N2410	A746-Q750 VanDerWaalsContact O-CD 3.25Å; A746-Q750 VanDerWaalsContact O-CG 3.31Å; A746-Q750 WeakPolarHBondContact O-CG 3.43Å; A746-Q750 PolarHBondContact O-NE2 2.75Å; Q747-Q750 WeakPolarHBondContact O-CB 3.4Å; L748-Q750 PolarHBondContact O-N 2.86Å; Q750-L2409 VanDerWaalsContact C-CD2 3.47Å; Q750-L2409 HydrophobicContact CB-CB 3.22Å; Q750-L2409 HydrophobicContact CB-CD1 4.14Å; Q750-L2409 HydrophobicContact CB-CD2 3.87Å; Q750-L2409 HydrophobicContact CB-CG 3.9Å; Q750-L2409 HydrophobicContact CG-CB 3.51Å; Q750-L2409 WeakPolarHBondContact O-CB 3.44Å; Q750-L2409 WeakPolarHBondContact O-CD2 3.49Å; Q750-N2410 PolarHBondContact N-ND2 3.09Å
751	E	80.5	Confident	65.5	Low	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.298	C	S	.	.			trans	-73.8	173.3	-170.4	-75.3	179.3	121.4	0	0	114.6	L748 F753 F772 R787 L2409 Y2551 Q2581	L748-E751 PolarHBondContact O-N 3.36Å; E751-F753 VanDerWaalsContact C-CE2 3.46Å; E751-F753 HydrophobicContact CB-CE2 4.14Å; E751-F753 HydrophobicContact CB-CZ 4.1Å; E751-F753 VanDerWaalsContact O-CE2 3.32Å; E751-F753 WeakPolarHBondContact O-CE2 3.5Å; E751-F772 PolarHBondContact O-N 3.42Å; E751-R787 IonicContact OE1-NH1 3.32Å; E751-R787 PolarHBondContact OE1-NH1 3.18Å; E751-R787 VanDerWaalsContact OE1-NH1 3.1Å; E751-R787 IonicContact OE2-NH1 3.46Å; E751-R787 PolarHBondContact OE2-NH1 2.89Å; E751-R787 VanDerWaalsContact OE2-NH1 3.14Å; E751-L2409 HydrophobicContact CG-CD2 4.16Å; E751-Y2551 WeakPolarHBondContact OE1-CB 3.19Å; E751-Q2581 HydrophobicContact CB-CG 3.99Å; E751-Q2581 VanDerWaalsContact CD-CG 3.49Å; E751-Q2581 HydrophobicContact CG-CG 4.34Å; E751-Q2581 WeakPolarHBondContact OE2-CA 3.33Å; E751-Q2581 WeakPolarHBondContact OE2-CB 3.4Å; E751-Q2581 WeakPolarHBondContact OE2-CG 3.47Å; E751-Q2581 PolarHBondContact OE2-N 3.35Å
752	R	72.2	Confident	63.4	Low	104 Å²	104	59.2 Å²	59.2	39%	0.392	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	160.5	174.8	-44	-163.3	172	-163.6	-1.8	112.9	K770 H2548	R752-K770 CarbonylContact C-O 3.53Å; R752-K770 WeakPolarHBondContact CA-O 3.36Å; R752-K770 VanDerWaalsContact CB-O 3.31Å; R752-K770 WeakPolarHBondContact CB-O 3.4Å; R752-H2548 WeakPolarHBondContact CB-NE2 3.4Å
753	F	69.1	Low	61.5	Low	6 Å²	6	62.5 Å²	62.5	3%	0.026	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	135.1	-152.4	-60.5	-96.8	0	0	0	115.7	L748 E751 M769 K770 F772 L775 V783 Q2581	L748-F753 HydrophobicContact CD2-CE1 4.31Å; L748-F753 HydrophobicContact CD2-CE2 4.35Å; L748-F753 HydrophobicContact CD2-CZ 3.5Å; L748-F753 VanDerWaalsContact CD2-CZ 3.5Å; E751-F753 VanDerWaalsContact C-CE2 3.46Å; E751-F753 HydrophobicContact CB-CE2 4.14Å; E751-F753 HydrophobicContact CB-CZ 4.1Å; E751-F753 VanDerWaalsContact O-CE2 3.32Å; E751-F753 WeakPolarHBondContact O-CE2 3.5Å; F753-M769 VanDerWaalsContact C-SD 3.54Å; F753-M769 CarbonylContact O-C 3.57Å; F753-M769 VanDerWaalsContact O-CA 3.23Å; F753-M769 WeakPolarHBondContact O-CA 3.33Å; F753-K770 WeakPolarHBondContact CD2-O 3.06Å; F753-K770 PolarHBondContact N-O 3.09Å; F753-K770 PolarHBondContact O-N 3.06Å; F753-F772 HydrophobicContact CD2-CB 4.44Å; F753-F772 HydrophobicContact CE1-CD2 4.41Å; F753-F772 VanDerWaalsContact CE2-CA 3.47Å; F753-F772 HydrophobicContact CE2-CB 3.6Å; F753-F772 AromaticContact CE2-CD2 3.81Å; F753-F772 HydrophobicContact CE2-CD2 3.81Å; F753-F772 HydrophobicContact CE2-CG 4.21Å; F753-F772 HydrophobicContact CZ-CB 4.22Å; F753-F772 AromaticContact CZ-CD2 3.69Å; F753-F772 HydrophobicContact CZ-CD2 3.69Å; F753-F772 HydrophobicContact CZ-CG 4.41Å; F753-L775 HydrophobicContact CB-CD1 4.35Å; F753-L775 HydrophobicContact CB-CD2 3.34Å; F753-L775 HydrophobicContact CB-CG 4.06Å; F753-L775 HydrophobicContact CD1-CD1 3.82Å; F753-L775 HydrophobicContact CD1-CD2 4.21Å; F753-L775 HydrophobicContact CD1-CG 4.44Å; F753-L775 HydrophobicContact CD2-CD1 3.69Å; F753-L775 HydrophobicContact CD2-CD2 4.05Å; F753-L775 HydrophobicContact CD2-CG 3.79Å; F753-L775 HydrophobicContact CE1-CD1 4.03Å; F753-L775 HydrophobicContact CE2-CD1 4.01Å; F753-L775 HydrophobicContact CG-CD1 3.68Å; F753-L775 HydrophobicContact CG-CD2 3.62Å; F753-L775 HydrophobicContact CG-CG 3.84Å; F753-L775 HydrophobicContact CZ-CD1 4.19Å; F753-V783 HydrophobicContact CD1-CG1 4.32Å; F753-V783 HydrophobicContact CD1-CG2 3.59Å; F753-V783 HydrophobicContact CE1-CB 4.01Å; F753-V783 HydrophobicContact CE1-CG1 3.35Å; F753-V783 HydrophobicContact CE1-CG2 3.46Å; F753-V783 VanDerWaalsContact CE1-CG2 3.46Å; F753-V783 HydrophobicContact CZ-CG1 3.92Å; F753-Q2581 HydrophobicContact CD1-CG 4.45Å; F753-Q2581 HydrophobicContact CE1-CB 3.97Å; F753-Q2581 HydrophobicContact CE1-CG 3.44Å; F753-Q2581 VanDerWaalsContact CE1-CG 3.44Å; F753-Q2581 HydrophobicContact CZ-CB 4.05Å; F753-Q2581 HydrophobicContact CZ-CG 3.54Å
754	P	70.4	Confident	59.4	Low	56 Å²	56	56.5 Å²	56.5	36%	0.364	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	129.5	171.6	24.6	-27.6	0	0	0	114.3	V768 M769	P754-V768 CarbonylContact C-O 3.37Å; P754-V768 VanDerWaalsContact CA-O 3.22Å; P754-V768 WeakPolarHBondContact CA-O 3.38Å; P754-M769 HydrophobicContact CB-CE 3.57Å; P754-M769 HydrophobicContact CG-CE 3.86Å
755	I	55	Low	57.2	Low	8 Å²	8	58.8 Å²	58.8	4%	0.041	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	146.2	175.7	-66.3	167	0	0	0	111.1	L757 T767 V768 K770 L775 E779 C2302	I755-L757 HydrophobicContact CG2-CD1 4.01Å; I755-T767 CarbonylContact O-C 3.54Å; I755-T767 VanDerWaalsContact O-C 3.23Å; I755-T767 WeakPolarHBondContact O-CA 3.46Å; I755-V768 PolarHBondContact N-O 2.99Å; I755-V768 PolarHBondContact O-N 2.77Å; I755-K770 HydrophobicContact CD1-CB 4.1Å; I755-K770 HydrophobicContact CD1-CD 3.51Å; I755-K770 HydrophobicContact CD1-CG 3.86Å; I755-L775 HydrophobicContact CD1-CD2 3.38Å; I755-L775 HydrophobicContact CD1-CG 4.48Å; I755-L775 HydrophobicContact CG1-CD2 3.84Å; I755-E779 WeakPolarHBondContact CD1-OE2 3.32Å; I755-E779 VanDerWaalsContact CG1-OE1 3.28Å; I755-E779 WeakPolarHBondContact CG1-OE1 3.12Å; I755-E779 WeakPolarHBondContact CG2-OE1 3.48Å; I755-C2302 HydrophobicContact CB-CB 4.41Å; I755-C2302 HydrophobicContact CG2-CB 4.06Å
756	K	49.5	Very low	55.4	Low	134 Å²	134	58.1 Å²	58.1	58%	0.583	32%	0.317	S	S	*	.			trans	-115.2	105.8	176.1	-49.3	-174.5	174	-179.9	0	111.8	T758 P765 T767	K756-T758 PolarHBondContact O-N 3.48Å; K756-P765 HydrophobicContact CD-CB 4.23Å; K756-T767 HydrophobicContact CD-CG2 4.26Å; K756-T767 WeakPolarHBondContact CD-OG1 3.2Å; K756-T767 VanDerWaalsContact CE-OG1 3.31Å; K756-T767 WeakPolarHBondContact CE-OG1 3.36Å; K756-T767 HydrophobicContact CG-CG2 3.79Å; K756-T767 WeakPolarHBondContact CG-OG1 3.44Å
757	L	42.3	Very low	54.2	Low	51 Å²	51	56.8 Å²	56.8	27%	0.267	30%	0.304	S	S	.	.			trans	-88.1	87.4	165.2	-91	81.7	0	0	0	110.2	I755 D759 K766 C2302	I755-L757 HydrophobicContact CG2-CD1 4.01Å; L757-D759 PolarHBondContact O-N 2.9Å; L757-K766 WeakPolarHBondContact O-CB 3.37Å; L757-C2302 HydrophobicContact CB-CB 4.15Å; L757-C2302 VanDerWaalsContact CB-O 3.28Å; L757-C2302 WeakPolarHBondContact CB-O 2.96Å; L757-C2302 HydrophobicContact CD1-CB 3.59Å; L757-C2302 HydrophobicContact CG-CB 4.45Å; L757-C2302 PolarHBondContact N-O 2.96Å
758	T	41	Very low	53.3	Low	102 Å²	102	55.3 Å²	55.3	63%	0.626	30%	0.297	S	S	*	.			trans	-59.9	119.1	162	46.7	0	0	0	0	109.3	K756 P765	K756-T758 PolarHBondContact O-N 3.48Å; T758-P765 HydrophobicContact CG2-CB 3.87Å
759	D	36.6	Very low	52.5	Low	38 Å²	38	56.1 Å²	56.1	20%	0.203	30%	0.301	C	S	.	.			trans	-112.3	134.1	-172.6	-135.8	-57.7	0	0	0	111	L757 N761 E762 R2303	L757-D759 PolarHBondContact O-N 2.9Å; D759-N761 PolarHBondContact O-N 3.35Å; D759-E762 PolarHBondContact O-N 2.91Å; D759-R2303 HydrophobicContact CB-CG 4.19Å; D759-R2303 IonicContact OD1-CZ 3.48Å; D759-R2303 VanDerWaalsContact OD1-CZ 3.22Å; D759-R2303 IonicContact OD1-NH1 3.3Å; D759-R2303 PolarHBondContact OD1-NH1 2.91Å; D759-R2303 IonicContact OD1-NH2 2.69Å; D759-R2303 PolarHBondContact OD1-NH2 3.41Å; D759-R2303 WeakPolarHBondContact OD2-CD 3.32Å; D759-R2303 WeakPolarHBondContact OD2-CG 3.02Å; D759-R2303 IonicContact OD2-CZ 3.5Å; D759-R2303 IonicContact OD2-NE 3.17Å; D759-R2303 PolarHBondContact OD2-NE 2.99Å; D759-R2303 IonicContact OD2-NH1 2.66Å; D759-R2303 PolarHBondContact OD2-NH1 3.19Å
760	A	44.2	Very low	52.3	Low	99 Å²	99	54.9 Å²	54.9	82%	0.818	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-10.4	-146.5	0	0	0	0	0	117.6
761	N	40.4	Very low	52.3	Low	155 Å²	155	52.1 Å²	52.1	83%	0.829	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	-0.6	-179.7	-67.9	1.5	0	0	0	113.7	D759	D759-N761 PolarHBondContact O-N 3.35Å
762	E	32.9	Very low	51.9	Low	56 Å²	56	52.8 Å²	52.8	26%	0.262	28%	0.281	S	S	.	.			trans	-126.9	145.9	-179.9	-62.4	177.8	130.1	0	0	110.3	D759 K766 V2317	D759-E762 PolarHBondContact O-N 2.91Å; E762-K766 IonicContact OE2-NZ 3.16Å; E762-K766 PolarHBondContact OE2-NZ 3.14Å; E762-V2317 HydrophobicContact CG-CG1 4.47Å
763	K	40.8	Very low	52	Low	138 Å²	138	53.7 Å²	53.7	60%	0.6	29%	0.289	S	S	*	.			trans	-100	3	-154.2	-96.7	-178.5	175	175.9	0	117.6
764	F	34.4	Very low	52.1	Low	29 Å²	29	56.8 Å²	56.8	13%	0.127	30%	0.304	C	S	.	.	S	Bend	trans	-154.1	97	-156.2	-55.2	-57.8	0	0	0	116.9	D2306 A2310 K2315 S2316 V2317	F764-D2306 VanDerWaalsContact C-OD1 3.24Å; F764-D2306 WeakPolarHBondContact CA-OD2 3.49Å; F764-D2306 PolarHBondContact N-OD2 2.83Å; F764-D2306 CarbonylContact O-C 3.03Å; F764-D2306 VanDerWaalsContact O-C 3.31Å; F764-D2306 WeakPolarHBondContact O-CA 3.35Å; F764-D2306 WeakPolarHBondContact O-CB 3.47Å; F764-D2306 VanDerWaalsContact O-OD2 3.08Å; F764-A2310 HydrophobicContact CB-CB 3.52Å; F764-A2310 HydrophobicContact CD2-CB 3.67Å; F764-A2310 HydrophobicContact CG-CB 3.91Å; F764-K2315 HydrophobicContact CD1-CB 3.93Å; F764-K2315 HydrophobicContact CD1-CD 3.88Å; F764-K2315 HydrophobicContact CD1-CG 4.46Å; F764-K2315 HydrophobicContact CD2-CB 4.11Å; F764-K2315 HydrophobicContact CE1-CB 3.71Å; F764-K2315 HydrophobicContact CE1-CD 3.61Å; F764-K2315 HydrophobicContact CE1-CG 4.06Å; F764-K2315 HydrophobicContact CE2-CB 3.87Å; F764-K2315 HydrophobicContact CG-CB 4.15Å; F764-K2315 HydrophobicContact CZ-CB 3.67Å; F764-K2315 HydrophobicContact CZ-CD 4.34Å; F764-K2315 HydrophobicContact CZ-CG 4.32Å; F764-S2316 WeakPolarHBondContact CE2-O 3.49Å; F764-V2317 HydrophobicContact CD2-CG2 4.4Å
765	P	35.8	Very low	52	Low	57 Å²	57	54.7 Å²	54.7	37%	0.37	29%	0.289	S	S	.	.			trans	-46.2	126.8	-145.6	14.4	-32.5	0	0	0	127.1	K756 T758 T767 N2305 D2306	K756-P765 HydrophobicContact CD-CB 4.23Å; T758-P765 HydrophobicContact CG2-CB 3.87Å; P765-T767 PolarHBondContact O-N 3.11Å; P765-T767 PolarHBondContact O-OG1 2.69Å; P765-N2305 CarbonylContact O-C 3.52Å; P765-D2306 WeakPolarHBondContact CA-OD1 3.09Å; P765-D2306 WeakPolarHBondContact O-CA 3.1Å; P765-D2306 PolarHBondContact O-N 2.78Å
766	K	39.7	Very low	52.5	Low	6 Å²	6	56.5 Å²	56.5	3%	0.026	30%	0.303	C	S	.	.			trans	-28.3	-12.2	177.6	-120	164.8	-153.5	-166.7	0	125	L757 E762 V768 C2302 R2303 N2304 N2305 D2306 L2307	L757-K766 WeakPolarHBondContact O-CB 3.37Å; E762-K766 IonicContact OE2-NZ 3.16Å; E762-K766 PolarHBondContact OE2-NZ 3.14Å; K766-V768 PolarHBondContact O-N 3.36Å; K766-C2302 CarbonylContact C-O 3.49Å; K766-C2302 WeakPolarHBondContact CA-O 3.4Å; K766-C2302 WeakPolarHBondContact CB-O 3.27Å; K766-C2302 WeakPolarHBondContact CG-O 3.23Å; K766-C2302 CarbonylContact O-C 3.43Å; K766-C2302 VanDerWaalsContact O-C 3.29Å; K766-C2302 WeakPolarHBondContact O-CA 3.3Å; K766-R2303 VanDerWaalsContact CD-CA 3.42Å; K766-R2303 HydrophobicContact CD-CB 4.1Å; K766-R2303 HydrophobicContact CD-CG 3.59Å; K766-R2303 VanDerWaalsContact CD-O 3.28Å; K766-R2303 WeakPolarHBondContact CD-O 3.2Å; K766-R2303 VanDerWaalsContact CE-C 3.45Å; K766-R2303 WeakPolarHBondContact CE-O 3.34Å; K766-R2303 PolarHBondContact NZ-O 2.7Å; K766-N2304 VanDerWaalsContact CG-N 3.32Å; K766-N2305 WeakPolarHBondContact O-CA 3.35Å; K766-N2305 WeakPolarHBondContact O-CB 3.41Å; K766-N2305 PolarHBondContact O-N 3.03Å; K766-D2306 VanDerWaalsContact C-N 3.29Å; K766-D2306 HydrophobicContact CB-CB 3.39Å; K766-D2306 VanDerWaalsContact CB-OD1 3.23Å; K766-D2306 WeakPolarHBondContact CB-OD1 3.38Å; K766-D2306 HydrophobicContact CD-CB 3.45Å; K766-D2306 VanDerWaalsContact CD-CB 3.45Å; K766-D2306 HydrophobicContact CG-CB 3.33Å; K766-D2306 VanDerWaalsContact N-CA 3.35Å; K766-D2306 PolarHBondContact N-OD1 2.98Å; K766-L2307 VanDerWaalsContact NZ-CD1 3.33Å
767	T	48.5	Very low	53.1	Low	22 Å²	22	56 Å²	56	14%	0.135	30%	0.297	C	S	.	.			trans	-42.4	81.2	-151.9	-36.7	0	0	0	0	125.6	I755 K756 P765 N2305 Y2348	I755-T767 CarbonylContact O-C 3.54Å; I755-T767 VanDerWaalsContact O-C 3.23Å; I755-T767 WeakPolarHBondContact O-CA 3.46Å; K756-T767 HydrophobicContact CD-CG2 4.26Å; K756-T767 WeakPolarHBondContact CD-OG1 3.2Å; K756-T767 VanDerWaalsContact CE-OG1 3.31Å; K756-T767 WeakPolarHBondContact CE-OG1 3.36Å; K756-T767 HydrophobicContact CG-CG2 3.79Å; K756-T767 WeakPolarHBondContact CG-OG1 3.44Å; P765-T767 PolarHBondContact O-N 3.11Å; P765-T767 PolarHBondContact O-OG1 2.69Å; T767-N2305 WeakPolarHBondContact O-CB 3.49Å; T767-N2305 PolarHBondContact O-ND2 3.04Å; T767-Y2348 HydrophobicContact CG2-CE1 4.3Å; T767-Y2348 WeakPolarHBondContact O-CD1 3.38Å
768	V	59.9	Low	53.8	Low	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	168	-178.7	113.7	0	0	0	0	117.5	P754 I755 K766 K770 I2301 C2302 Y2348	P754-V768 CarbonylContact C-O 3.37Å; P754-V768 VanDerWaalsContact CA-O 3.22Å; P754-V768 WeakPolarHBondContact CA-O 3.38Å; I755-V768 PolarHBondContact N-O 2.99Å; I755-V768 PolarHBondContact O-N 2.77Å; K766-V768 PolarHBondContact O-N 3.36Å; V768-K770 HydrophobicContact CG1-CG 4.22Å; V768-I2301 HydrophobicContact CB-CB 4.43Å; V768-I2301 HydrophobicContact CB-CG2 4.35Å; V768-I2301 VanDerWaalsContact CB-O 3.26Å; V768-I2301 WeakPolarHBondContact CB-O 3.34Å; V768-I2301 VanDerWaalsContact CG1-C 3.43Å; V768-I2301 HydrophobicContact CG1-CB 3.65Å; V768-I2301 HydrophobicContact CG1-CG2 3.86Å; V768-I2301 HydrophobicContact CG2-CB 4.24Å; V768-I2301 HydrophobicContact CG2-CG2 3.66Å; V768-I2301 WeakPolarHBondContact CG2-O 3.25Å; V768-C2302 HydrophobicContact CB-CB 4.11Å; V768-C2302 HydrophobicContact CG1-CB 4.04Å; V768-C2302 WeakPolarHBondContact CG1-SG 3.3Å; V768-Y2348 WeakPolarHBondContact CG2-O 3.4Å
769	M	63	Low	55.3	Low	17 Å²	17	59.2 Å²	59.2	8%	0.084	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	129.6	165.2	-68.4	-76	143.1	0	0	114	F753 P754 Y2348 R2552	F753-M769 VanDerWaalsContact C-SD 3.54Å; F753-M769 CarbonylContact O-C 3.57Å; F753-M769 VanDerWaalsContact O-CA 3.23Å; F753-M769 WeakPolarHBondContact O-CA 3.33Å; P754-M769 HydrophobicContact CB-CE 3.57Å; P754-M769 HydrophobicContact CG-CE 3.86Å; M769-Y2348 HydrophobicContact CB-CG 4.44Å; M769-Y2348 HydrophobicContact CE-CD1 3.61Å; M769-Y2348 HydrophobicContact CE-CD2 4.09Å; M769-Y2348 HydrophobicContact CE-CE1 3.59Å; M769-Y2348 HydrophobicContact CE-CE2 4.08Å; M769-Y2348 HydrophobicContact CE-CG 3.87Å; M769-Y2348 HydrophobicContact CG-CD1 3.76Å; M769-Y2348 HydrophobicContact CG-CD2 4.19Å; M769-Y2348 HydrophobicContact CG-CG 3.49Å; M769-Y2348 VanDerWaalsContact CG-CG 3.49Å; M769-R2552 PolarHBondContact SD-NH2 2.86Å; M769-R2552 VanDerWaalsContact SD-NH2 3.44Å
770	K	66.4	Low	57	Low	15 Å²	15	58 Å²	58	7%	0.065	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	150.2	167.6	-66.3	-161.6	-150.9	163	0	111.1	R752 F753 I755 V768 E774 G2298 C2302	R752-K770 CarbonylContact C-O 3.53Å; R752-K770 WeakPolarHBondContact CA-O 3.36Å; R752-K770 VanDerWaalsContact CB-O 3.31Å; R752-K770 WeakPolarHBondContact CB-O 3.4Å; F753-K770 WeakPolarHBondContact CD2-O 3.06Å; F753-K770 PolarHBondContact N-O 3.09Å; F753-K770 PolarHBondContact O-N 3.06Å; I755-K770 HydrophobicContact CD1-CB 4.1Å; I755-K770 HydrophobicContact CD1-CD 3.51Å; I755-K770 HydrophobicContact CD1-CG 3.86Å; V768-K770 HydrophobicContact CG1-CG 4.22Å; K770-E774 WeakPolarHBondContact CA-OE2 3.3Å; K770-E774 HydrophobicContact CB-CB 3.69Å; K770-E774 VanDerWaalsContact CD-C 3.47Å; K770-E774 HydrophobicContact CD-CB 3.95Å; K770-E774 WeakPolarHBondContact CD-O 3.21Å; K770-E774 HydrophobicContact CG-CB 4.23Å; K770-E774 PolarHBondContact NZ-O 2.9Å; K770-E774 VanDerWaalsContact NZ-O 3.15Å; K770-G2298 VanDerWaalsContact CE-O 3.29Å; K770-G2298 WeakPolarHBondContact CE-O 3.34Å; K770-C2302 WeakPolarHBondContact CE-SG 3.43Å
771	S	75.7	Confident	58.1	Low	2 Å²	2	54.7 Å²	54.7	1%	0.014	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	166.4	167.2	71.8	0	0	0	0	112.3	H773 E774 L775	S771-H773 PolarHBondContact O-N 3.11Å; S771-H773 PolarHBondContact OG-CD2 3.03Å; S771-H773 PolarHBondContact OG-CE1 3.34Å; S771-H773 PolarHBondContact OG-ND1 3.02Å; S771-H773 PolarHBondContact OG-NE2 3.14Å; S771-E774 PolarHBondContact N-OE2 3.03Å; S771-E774 PolarHBondContact O-N 3.09Å; S771-E774 WeakPolarHBondContact OG-CB 3.11Å; S771-E774 VanDerWaalsContact OG-CG 3.23Å; S771-E774 WeakPolarHBondContact OG-CG 3.35Å; S771-E774 PolarHBondContact OG-N 3.21Å; S771-E774 PolarHBondContact OG-OE2 2.72Å; S771-L775 PolarHBondContact O-N 3.08Å
772	F	71.7	Confident	59.6	Low	14 Å²	14	50 Å²	50	6%	0.061	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-42	176.6	-173.2	-111.7	0	0	0	112.6	L748 E751 F753 E774 L775 Q780 V783 E784	L748-F772 HydrophobicContact CD1-CD1 4.25Å; L748-F772 HydrophobicContact CD1-CD2 3.89Å; L748-F772 HydrophobicContact CD1-CE1 3.75Å; L748-F772 HydrophobicContact CD1-CE2 3.33Å; L748-F772 HydrophobicContact CD1-CG 4.31Å; L748-F772 HydrophobicContact CD1-CZ 3.25Å; L748-F772 HydrophobicContact CD2-CB 4.24Å; L748-F772 HydrophobicContact CD2-CD1 4.34Å; L748-F772 HydrophobicContact CD2-CD2 3.2Å; L748-F772 HydrophobicContact CD2-CE2 3.49Å; L748-F772 VanDerWaalsContact CD2-CE2 3.49Å; L748-F772 HydrophobicContact CD2-CG 3.67Å; L748-F772 HydrophobicContact CD2-CZ 4.19Å; L748-F772 HydrophobicContact CG-CD2 4.18Å; L748-F772 HydrophobicContact CG-CE2 4.07Å; L748-F772 HydrophobicContact CG-CZ 4.34Å; E751-F772 PolarHBondContact O-N 3.42Å; F753-F772 HydrophobicContact CD2-CB 4.44Å; F753-F772 HydrophobicContact CE1-CD2 4.41Å; F753-F772 VanDerWaalsContact CE2-CA 3.47Å; F753-F772 HydrophobicContact CE2-CB 3.6Å; F753-F772 AromaticContact CE2-CD2 3.81Å; F753-F772 HydrophobicContact CE2-CD2 3.81Å; F753-F772 HydrophobicContact CE2-CG 4.21Å; F753-F772 HydrophobicContact CZ-CB 4.22Å; F753-F772 AromaticContact CZ-CD2 3.69Å; F753-F772 HydrophobicContact CZ-CD2 3.69Å; F753-F772 HydrophobicContact CZ-CG 4.41Å; F772-E774 VanDerWaalsContact C-N 3.28Å; F772-E774 PolarHBondContact O-N 3.06Å; F772-L775 HydrophobicContact CD2-CD1 3.52Å; F772-L775 HydrophobicContact CE2-CD1 3.93Å; F772-L775 HydrophobicContact CG-CD1 4.46Å; F772-L775 WeakPolarHBondContact O-CB 3.16Å; F772-L775 PolarHBondContact O-N 2.9Å; F772-Q780 HydrophobicContact CD2-CG 4.08Å; F772-Q780 HydrophobicContact CE1-CB 4.48Å; F772-Q780 HydrophobicContact CE1-CG 4.15Å; F772-Q780 HydrophobicContact CE2-CB 3.62Å; F772-Q780 HydrophobicContact CE2-CG 3.6Å; F772-Q780 HydrophobicContact CZ-CB 3.59Å; F772-Q780 HydrophobicContact CZ-CG 3.64Å; F772-Q780 WeakPolarHBondContact O-CG 3.49Å; F772-Q780 PolarHBondContact O-NE2 3.21Å; F772-V783 HydrophobicContact CD2-CG1 4.4Å; F772-V783 HydrophobicContact CE2-CG1 4.03Å; F772-E784 HydrophobicContact CE2-CG 4.2Å; F772-E784 HydrophobicContact CZ-CG 3.87Å; F772-E784 WeakPolarHBondContact CZ-OE1 3.41Å
773	H	73.7	Confident	61.7	Low	122 Å²	122	48 Å²	48	57%	0.565	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-11.7	178.2	53	-98.3	0	0	0	114	S771 N2410	S771-H773 PolarHBondContact O-N 3.11Å; S771-H773 PolarHBondContact OG-CD2 3.03Å; S771-H773 PolarHBondContact OG-CE1 3.34Å; S771-H773 PolarHBondContact OG-ND1 3.02Å; S771-H773 PolarHBondContact OG-NE2 3.14Å; H773-N2410 PolarHBondContact CE1-OD1 2.75Å
774	E	72.6	Confident	63.4	Low	72 Å²	72	41.6 Å²	41.6	34%	0.336	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-21.1	173.9	-74.4	172.7	157.9	0	0	113.5	K770 S771 F772	K770-E774 WeakPolarHBondContact CA-OE2 3.3Å; K770-E774 HydrophobicContact CB-CB 3.69Å; K770-E774 VanDerWaalsContact CD-C 3.47Å; K770-E774 HydrophobicContact CD-CB 3.95Å; K770-E774 WeakPolarHBondContact CD-O 3.21Å; K770-E774 HydrophobicContact CG-CB 4.23Å; K770-E774 PolarHBondContact NZ-O 2.9Å; K770-E774 VanDerWaalsContact NZ-O 3.15Å; S771-E774 PolarHBondContact N-OE2 3.03Å; S771-E774 PolarHBondContact O-N 3.09Å; S771-E774 WeakPolarHBondContact OG-CB 3.11Å; S771-E774 VanDerWaalsContact OG-CG 3.23Å; S771-E774 WeakPolarHBondContact OG-CG 3.35Å; S771-E774 PolarHBondContact OG-N 3.21Å; S771-E774 PolarHBondContact OG-OE2 2.72Å; F772-E774 VanDerWaalsContact C-N 3.28Å; F772-E774 PolarHBondContact O-N 3.06Å
775	L	68.7	Low	65.4	Low	12 Å²	12	44.3 Å²	44.3	6%	0.063	23%	0.228	C	C	.	.	S	Bend	trans	-49.3	152.7	167.2	-72.6	178.2	0	0	0	110.6	F753 I755 S771 F772 E779 Q780 V783	F753-L775 HydrophobicContact CB-CD1 4.35Å; F753-L775 HydrophobicContact CB-CD2 3.34Å; F753-L775 HydrophobicContact CB-CG 4.06Å; F753-L775 HydrophobicContact CD1-CD1 3.82Å; F753-L775 HydrophobicContact CD1-CD2 4.21Å; F753-L775 HydrophobicContact CD1-CG 4.44Å; F753-L775 HydrophobicContact CD2-CD1 3.69Å; F753-L775 HydrophobicContact CD2-CD2 4.05Å; F753-L775 HydrophobicContact CD2-CG 3.79Å; F753-L775 HydrophobicContact CE1-CD1 4.03Å; F753-L775 HydrophobicContact CE2-CD1 4.01Å; F753-L775 HydrophobicContact CG-CD1 3.68Å; F753-L775 HydrophobicContact CG-CD2 3.62Å; F753-L775 HydrophobicContact CG-CG 3.84Å; F753-L775 HydrophobicContact CZ-CD1 4.19Å; I755-L775 HydrophobicContact CD1-CD2 3.38Å; I755-L775 HydrophobicContact CD1-CG 4.48Å; I755-L775 HydrophobicContact CG1-CD2 3.84Å; S771-L775 PolarHBondContact O-N 3.08Å; F772-L775 HydrophobicContact CD2-CD1 3.52Å; F772-L775 HydrophobicContact CE2-CD1 3.93Å; F772-L775 HydrophobicContact CG-CD1 4.46Å; F772-L775 WeakPolarHBondContact O-CB 3.16Å; F772-L775 PolarHBondContact O-N 2.9Å; L775-E779 HydrophobicContact CB-CB 4.25Å; L775-E779 HydrophobicContact CD2-CB 3.88Å; L775-E779 HydrophobicContact CG-CB 4.48Å; L775-Q780 HydrophobicContact CB-CG 3.61Å; L775-Q780 HydrophobicContact CD1-CB 4.38Å; L775-Q780 HydrophobicContact CD1-CG 3.81Å; L775-Q780 HydrophobicContact CG-CG 4.37Å; L775-V783 HydrophobicContact CD1-CG2 4.42Å
776	S	65	Low	67.6	Low	46 Å²	46	43.2 Å²	43.2	32%	0.322	22%	0.217	S	C	.	.			trans	-67.8	153.2	161.2	68.4	0	0	0	0	110.2	E778 E779 Q780	S776-E778 PolarHBondContact O-N 3.14Å; S776-E778 VanDerWaalsContact O-N 3.11Å; S776-E779 VanDerWaalsContact CB-OE2 3.24Å; S776-E779 WeakPolarHBondContact CB-OE2 3.35Å; S776-E779 PolarHBondContact N-OE2 2.92Å; S776-E779 PolarHBondContact O-N 2.79Å; S776-E779 VanDerWaalsContact OG-CG 3.28Å; S776-E779 WeakPolarHBondContact OG-CG 3.15Å; S776-E779 PolarHBondContact OG-N 3.41Å; S776-E779 PolarHBondContact OG-OE2 3.3Å; S776-Q780 WeakPolarHBondContact O-CG 3.29Å; S776-Q780 PolarHBondContact O-N 2.67Å
777	R	60.7	Low	69.7	Low	123 Å²	123	43 Å²	43	46%	0.464	22%	0.216	S	C	.	.	H	α-helix	trans	-57.9	-25.4	177.8	-78.1	-175.6	166.2	-173.7	-3.7	113.6	D569 A781	D569-R777 IonicContact OD1-CZ 3.83Å; D569-R777 IonicContact OD1-NH2 2.7Å; D569-R777 PolarHBondContact OD1-NH2 2.84Å; R777-A781 VanDerWaalsContact O-CB 3.26Å; R777-A781 WeakPolarHBondContact O-CB 3.45Å; R777-A781 PolarHBondContact O-N 2.76Å
778	E	58.9	Low	71.3	Confident	164 Å²	164	42 Å²	42	77%	0.766	21%	0.21	S	C	*	.	H	α-helix	trans	-73.9	-40.2	174.7	-65.7	173.7	-169	0	0	111.7	S776 A781 A782	S776-E778 PolarHBondContact O-N 3.14Å; S776-E778 VanDerWaalsContact O-N 3.11Å; E778-A781 CarbonylContact O-C 3.46Å; E778-A781 PolarHBondContact O-N 2.91Å; E778-A782 WeakPolarHBondContact O-CB 3.29Å; E778-A782 PolarHBondContact O-N 2.92Å
779	E	71	Confident	72.4	Confident	57 Å²	57	42.7 Å²	42.7	27%	0.266	21%	0.214	S	C	.	.	H	α-helix	trans	-71.1	-37.7	174.5	-65.5	156.4	145	0	0	111.1	I755 L775 S776 A782 V783	I755-E779 WeakPolarHBondContact CD1-OE2 3.32Å; I755-E779 VanDerWaalsContact CG1-OE1 3.28Å; I755-E779 WeakPolarHBondContact CG1-OE1 3.12Å; I755-E779 WeakPolarHBondContact CG2-OE1 3.48Å; L775-E779 HydrophobicContact CB-CB 4.25Å; L775-E779 HydrophobicContact CD2-CB 3.88Å; L775-E779 HydrophobicContact CG-CB 4.48Å; S776-E779 VanDerWaalsContact CB-OE2 3.24Å; S776-E779 WeakPolarHBondContact CB-OE2 3.35Å; S776-E779 PolarHBondContact N-OE2 2.92Å; S776-E779 PolarHBondContact O-N 2.79Å; S776-E779 VanDerWaalsContact OG-CG 3.28Å; S776-E779 WeakPolarHBondContact OG-CG 3.15Å; S776-E779 PolarHBondContact OG-N 3.41Å; S776-E779 PolarHBondContact OG-OE2 3.3Å; E779-A782 PolarHBondContact O-N 3.43Å; E779-V783 WeakPolarHBondContact O-CB 3.31Å; E779-V783 VanDerWaalsContact O-CG2 3.28Å; E779-V783 WeakPolarHBondContact O-CG2 2.95Å; E779-V783 PolarHBondContact O-N 3.32Å
780	Q	73.4	Confident	73.4	Confident	13 Å²	13	41.9 Å²	41.9	6%	0.061	21%	0.21	C	C	.	.	H	α-helix	trans	-55.6	-51.1	167	-68.3	176.4	-11.6	0	0	110.2	F772 L775 S776 A782 V783 E784	F772-Q780 HydrophobicContact CD2-CG 4.08Å; F772-Q780 HydrophobicContact CE1-CB 4.48Å; F772-Q780 HydrophobicContact CE1-CG 4.15Å; F772-Q780 HydrophobicContact CE2-CB 3.62Å; F772-Q780 HydrophobicContact CE2-CG 3.6Å; F772-Q780 HydrophobicContact CZ-CB 3.59Å; F772-Q780 HydrophobicContact CZ-CG 3.64Å; F772-Q780 WeakPolarHBondContact O-CG 3.49Å; F772-Q780 PolarHBondContact O-NE2 3.21Å; L775-Q780 HydrophobicContact CB-CG 3.61Å; L775-Q780 HydrophobicContact CD1-CB 4.38Å; L775-Q780 HydrophobicContact CD1-CG 3.81Å; L775-Q780 HydrophobicContact CG-CG 4.37Å; S776-Q780 WeakPolarHBondContact O-CG 3.29Å; S776-Q780 PolarHBondContact O-N 2.67Å; Q780-A782 VanDerWaalsContact C-N 3.32Å; Q780-A782 PolarHBondContact O-N 3.4Å; Q780-V783 CarbonylContact O-C 3.35Å; Q780-V783 WeakPolarHBondContact O-CB 3.03Å; Q780-V783 PolarHBondContact O-N 2.85Å; Q780-E784 WeakPolarHBondContact O-CA 3.06Å; Q780-E784 WeakPolarHBondContact O-CB 3.13Å; Q780-E784 WeakPolarHBondContact O-CG 3.3Å; Q780-E784 PolarHBondContact O-N 2.81Å
781	A	66.6	Low	74.3	Confident	28 Å²	28	44 Å²	44	23%	0.231	22%	0.218	C	C	.	.	H	α-helix	trans	-67.3	-26	179.4	0	0	0	0	0	114.2	I572 R777 E778 E784 K785	I572-A781 HydrophobicContact CG1-CB 4.5Å; R777-A781 VanDerWaalsContact O-CB 3.26Å; R777-A781 WeakPolarHBondContact O-CB 3.45Å; R777-A781 PolarHBondContact O-N 2.76Å; E778-A781 CarbonylContact O-C 3.46Å; E778-A781 PolarHBondContact O-N 2.91Å; A781-E784 CarbonylContact O-C 3.5Å; A781-E784 VanDerWaalsContact O-CA 3.28Å; A781-E784 WeakPolarHBondContact O-CA 3.45Å; A781-K785 PolarHBondContact O-N 3.09Å
782	A	71.3	Confident	74.4	Confident	58 Å²	58	43.9 Å²	43.9	48%	0.479	22%	0.218	S	C	.	.	H	α-helix	trans	-71.9	-42.4	172.6	0	0	0	0	0	110.9	E778 E779 Q780 K785 K786	E778-A782 WeakPolarHBondContact O-CB 3.29Å; E778-A782 PolarHBondContact O-N 2.92Å; E779-A782 PolarHBondContact O-N 3.43Å; Q780-A782 VanDerWaalsContact C-N 3.32Å; Q780-A782 PolarHBondContact O-N 3.4Å; A782-K785 PolarHBondContact O-N 3.4Å; A782-K786 WeakPolarHBondContact O-CB 3.48Å; A782-K786 PolarHBondContact O-N 2.78Å
783	V	78.5	Confident	74.7	Confident	14 Å²	14	47.6 Å²	47.6	9%	0.085	23%	0.231	C	C	.	.	H	α-helix	trans	-62.7	-64.7	172.8	159.2	0	0	0	0	110.2	L748 F753 F772 L775 E779 Q780 K785 K786 R787 Q2581 Q2582	L748-V783 HydrophobicContact CD1-CG1 4.49Å; L748-V783 HydrophobicContact CD2-CG1 3.83Å; L748-V783 HydrophobicContact CG-CG1 4.44Å; F753-V783 HydrophobicContact CD1-CG1 4.32Å; F753-V783 HydrophobicContact CD1-CG2 3.59Å; F753-V783 HydrophobicContact CE1-CB 4.01Å; F753-V783 HydrophobicContact CE1-CG1 3.35Å; F753-V783 HydrophobicContact CE1-CG2 3.46Å; F753-V783 VanDerWaalsContact CE1-CG2 3.46Å; F753-V783 HydrophobicContact CZ-CG1 3.92Å; F772-V783 HydrophobicContact CD2-CG1 4.4Å; F772-V783 HydrophobicContact CE2-CG1 4.03Å; L775-V783 HydrophobicContact CD1-CG2 4.42Å; E779-V783 WeakPolarHBondContact O-CB 3.31Å; E779-V783 VanDerWaalsContact O-CG2 3.28Å; E779-V783 WeakPolarHBondContact O-CG2 2.95Å; E779-V783 PolarHBondContact O-N 3.32Å; Q780-V783 CarbonylContact O-C 3.35Å; Q780-V783 WeakPolarHBondContact O-CB 3.03Å; Q780-V783 PolarHBondContact O-N 2.85Å; V783-K785 PolarHBondContact O-N 3.38Å; V783-K786 WeakPolarHBondContact O-CA 3.46Å; V783-K786 VanDerWaalsContact O-CB 3.29Å; V783-K786 WeakPolarHBondContact O-CB 3.3Å; V783-K786 PolarHBondContact O-N 3.09Å; V783-R787 PolarHBondContact O-N 2.85Å; V783-Q2581 HydrophobicContact CG1-CB 3.77Å; V783-Q2581 WeakPolarHBondContact CG1-O 3.46Å; V783-Q2582 VanDerWaalsContact O-CG 3.28Å; V783-Q2582 WeakPolarHBondContact O-CG 3.41Å; V783-Q2582 PolarHBondContact O-NE2 3.49Å
784	E	75.9	Confident	75	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.009	22%	0.217	C	C	.	.	H	α-helix		15	-48.6	123.4	8.5	168.9	161	0	0	121.2	S570 I572 H745 L748 F772 Q780 A781 Q2582	S570-E784 WeakPolarHBondContact CB-OE1 3.3Å; S570-E784 WeakPolarHBondContact CB-OE2 3.45Å; S570-E784 PolarHBondContact OG-OE1 2.84Å; S570-E784 PolarHBondContact OG-OE2 3.48Å; I572-E784 HydrophobicContact CB-CB 4.3Å; I572-E784 HydrophobicContact CD1-CB 4.26Å; I572-E784 WeakPolarHBondContact CD1-O 3.29Å; I572-E784 HydrophobicContact CG1-CB 3.89Å; I572-E784 PolarHBondContact N-OE2 3.12Å; H745-E784 IonicContact CE1-OE1 3.16Å; H745-E784 PolarHBondContact CE1-OE1 3.39Å; H745-E784 VanDerWaalsContact CE1-OE1 3.25Å; H745-E784 IonicContact CE1-OE2 2.63Å; H745-E784 IonicContact ND1-OE1 3.22Å; H745-E784 PolarHBondContact ND1-OE1 3.41Å; H745-E784 IonicContact ND1-OE2 3.41Å; L748-E784 HydrophobicContact CD1-CG 3.38Å; L748-E784 WeakPolarHBondContact CD1-OE1 3.5Å; F772-E784 HydrophobicContact CE2-CG 4.2Å; F772-E784 HydrophobicContact CZ-CG 3.87Å; F772-E784 WeakPolarHBondContact CZ-OE1 3.41Å; Q780-E784 WeakPolarHBondContact O-CA 3.06Å; Q780-E784 WeakPolarHBondContact O-CB 3.13Å; Q780-E784 WeakPolarHBondContact O-CG 3.3Å; Q780-E784 PolarHBondContact O-N 2.81Å; A781-E784 CarbonylContact O-C 3.5Å; A781-E784 VanDerWaalsContact O-CA 3.28Å; A781-E784 WeakPolarHBondContact O-CA 3.45Å; E784-Q2582 HydrophobicContact CB-CG 3.74Å; E784-Q2582 HydrophobicContact CG-CG 3.96Å; E784-Q2582 PolarHBondContact O-NE2 3.36Å; E784-Q2582 PolarHBondContact O-OE1 3.38Å
785	K	76.3	Confident	75.3	Confident	87 Å²	87	44.6 Å²	44.6	38%	0.378	23%	0.225	S	C	.	.	H	α-helix	trans	-118.1	-26	176.5	-175.6	151.2	-176.5	154.8	0	113.9	I572 D584 W734 A781 A782 V783 T789 Q2582	I572-K785 HydrophobicContact CD1-CB 4.17Å; D584-K785 WeakPolarHBondContact OD1-CE 3.1Å; D584-K785 IonicContact OD1-NZ 3.75Å; D584-K785 PolarHBondContact OD1-NZ 2.88Å; D584-K785 IonicContact OD2-NZ 3.54Å; D584-K785 PolarHBondContact OD2-NZ 2.76Å; W734-K785 HydrophobicContact CH2-CG 4.05Å; W734-K785 HydrophobicContact CZ2-CD 4.42Å; W734-K785 HydrophobicContact CZ2-CG 4.08Å; A781-K785 PolarHBondContact O-N 3.09Å; A782-K785 PolarHBondContact O-N 3.4Å; V783-K785 PolarHBondContact O-N 3.38Å; K785-T789 PolarHBondContact O-OG1 2.97Å; K785-Q2582 PolarHBondContact O-NE2 3.24Å
786	K	81.3	Confident	75.8	Confident	34 Å²	34	48.1 Å²	48.1	15%	0.148	24%	0.238	C	C	.	.	H	α-helix	trans	-56.3	-59.1	172.2	179.7	164.6	-173.8	-73.2	0	110.4	A782 V783 T789 Y2574 I2577 Q2578	A782-K786 WeakPolarHBondContact O-CB 3.48Å; A782-K786 PolarHBondContact O-N 2.78Å; V783-K786 WeakPolarHBondContact O-CA 3.46Å; V783-K786 VanDerWaalsContact O-CB 3.29Å; V783-K786 WeakPolarHBondContact O-CB 3.3Å; V783-K786 PolarHBondContact O-N 3.09Å; K786-T789 VanDerWaalsContact O-CB 3.24Å; K786-T789 WeakPolarHBondContact O-CB 3.47Å; K786-T789 PolarHBondContact O-N 3.45Å; K786-Y2574 VanDerWaalsContact CE-CE2 3.49Å; K786-I2577 PolarHBondContact NZ-O 3.28Å; K786-Q2578 CarbonylContact C-O 3.54Å; K786-Q2578 HydrophobicContact CB-CB 4.13Å; K786-Q2578 HydrophobicContact CG-CB 3.35Å; K786-Q2578 HydrophobicContact CG-CG 3.67Å; K786-Q2578 WeakPolarHBondContact O-CB 3.41Å; K786-Q2578 PolarHBondContact O-OE1 2.98Å
787	R	85.5	Confident	76.3	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-31.5	-166	-143.6	101.8	44.4	150	-56.7	121.6	E751 V783 D790 Y791 Y2551 I2577 Q2578 G2579 Q2581 Q2582	E751-R787 IonicContact OE1-NH1 3.32Å; E751-R787 PolarHBondContact OE1-NH1 3.18Å; E751-R787 VanDerWaalsContact OE1-NH1 3.1Å; E751-R787 IonicContact OE2-NH1 3.46Å; E751-R787 PolarHBondContact OE2-NH1 2.89Å; E751-R787 VanDerWaalsContact OE2-NH1 3.14Å; V783-R787 PolarHBondContact O-N 2.85Å; R787-D790 WeakPolarHBondContact O-CB 3.5Å; R787-D790 PolarHBondContact O-N 2.7Å; R787-Y791 PolarHBondContact O-N 3.25Å; R787-Y2551 VanDerWaalsContact NH2-CE2 3.29Å; R787-I2577 VanDerWaalsContact CZ-O 3.26Å; R787-I2577 PolarHBondContact NE-O 3.41Å; R787-I2577 VanDerWaalsContact NH2-CG2 3.31Å; R787-I2577 PolarHBondContact NH2-O 2.9Å; R787-Q2578 WeakPolarHBondContact CA-O 3.28Å; R787-Q2578 WeakPolarHBondContact CB-O 3.5Å; R787-Q2578 WeakPolarHBondContact CD-O 3.33Å; R787-Q2578 WeakPolarHBondContact CG-O 3.45Å; R787-Q2578 PolarHBondContact N-O 3.25Å; R787-Q2578 VanDerWaalsContact N-O 3.14Å; R787-Q2578 PolarHBondContact NE-O 2.97Å; R787-Q2578 VanDerWaalsContact NE-O 3.1Å; R787-G2579 VanDerWaalsContact CG-CA 3.44Å; R787-G2579 WeakPolarHBondContact CG-O 3.18Å; R787-Q2581 WeakPolarHBondContact CB-O 3.35Å; R787-Q2581 HydrophobicContact CG-CB 4.16Å; R787-Q2581 VanDerWaalsContact NE-CA 3.29Å; R787-Q2582 HydrophobicContact CB-CB 3.61Å; R787-Q2582 HydrophobicContact CB-CG 3.54Å; R787-Q2582 HydrophobicContact CG-CB 4.45Å
788	I	82.2	Confident	76.9	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-74.2	-23.6	168	-75.1	166.5	0	0	0	111.9	L582 W734 A736 V741 I744 D790 Y791 C792 Q2582	L582-I788 HydrophobicContact CD2-CD1 3.65Å; W734-I788 HydrophobicContact CB-CG2 3.76Å; W734-I788 HydrophobicContact CD2-CB 4.4Å; W734-I788 HydrophobicContact CD2-CG2 3.53Å; W734-I788 HydrophobicContact CE3-CB 4.48Å; W734-I788 HydrophobicContact CE3-CG2 3.66Å; W734-I788 HydrophobicContact CG-CG2 3.63Å; W734-I788 HydrophobicContact CZ3-CG2 4.39Å; A736-I788 HydrophobicContact CB-CG2 4.08Å; V741-I788 HydrophobicContact CB-CD1 4.2Å; V741-I788 HydrophobicContact CG1-CD1 3.85Å; V741-I788 HydrophobicContact CG2-CD1 3.57Å; V741-I788 HydrophobicContact CG2-CG1 4.48Å; I744-I788 HydrophobicContact CD1-CG1 3.95Å; I744-I788 HydrophobicContact CG2-CD1 3.93Å; I744-I788 HydrophobicContact CG2-CG1 3.81Å; I788-D790 PolarHBondContact O-N 2.9Å; I788-Y791 PolarHBondContact O-N 3.19Å; I788-C792 WeakPolarHBondContact CG2-SG 3.34Å; I788-C792 VanDerWaalsContact O-CB 3.24Å; I788-C792 WeakPolarHBondContact O-CB 3.46Å; I788-C792 PolarHBondContact O-N 2.91Å; I788-C792 PolarHBondContact O-SG 2.74Å; I788-Q2582 HydrophobicContact CG1-CB 4.08Å; I788-Q2582 VanDerWaalsContact N-OE1 3.08Å
789	T	82.6	Confident	78	Confident	15 Å²	15	52 Å²	52	9%	0.092	25%	0.247	C	C	.	.	H	α-helix	trans	-52.3	-25.8	169.8	-62.1	0	0	0	0	111.8	W734 K785 K786 R793 I799	W734-T789 VanDerWaalsContact CH2-OG1 3.29Å; W734-T789 WeakPolarHBondContact CH2-OG1 3.34Å; W734-T789 VanDerWaalsContact CZ3-OG1 3.32Å; W734-T789 WeakPolarHBondContact CZ3-OG1 3.3Å; K785-T789 PolarHBondContact O-OG1 2.97Å; K786-T789 VanDerWaalsContact O-CB 3.24Å; K786-T789 WeakPolarHBondContact O-CB 3.47Å; K786-T789 PolarHBondContact O-N 3.45Å; T789-R793 VanDerWaalsContact O-CB 3.3Å; T789-R793 WeakPolarHBondContact O-CB 3.37Å; T789-R793 PolarHBondContact O-N 3.38Å; T789-R793 VanDerWaalsContact O-N 3.14Å; T789-I799 HydrophobicContact CG2-CD1 4.03Å; T789-I799 HydrophobicContact CG2-CG1 4.16Å; T789-I799 HydrophobicContact CG2-CG2 3.89Å
790	D	82.5	Confident	78.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-106.1	-34.9	-170.1	-68.7	22.9	0	0	0	113.3	R787 I788 R794 W2575 L2576 Q2578 G2579	R787-D790 WeakPolarHBondContact O-CB 3.5Å; R787-D790 PolarHBondContact O-N 2.7Å; I788-D790 PolarHBondContact O-N 2.9Å; D790-R794 WeakPolarHBondContact O-CB 3.2Å; D790-R794 PolarHBondContact O-N 2.69Å; D790-R794 VanDerWaalsContact O-N 3.1Å; D790-R794 PolarHBondContact O-NH1 2.92Å; D790-W2575 HydrophobicContact CB-CZ2 4.4Å; D790-W2575 WeakPolarHBondContact O-CZ2 3.38Å; D790-W2575 PolarHBondContact OD1-NE1 2.69Å; D790-W2575 WeakPolarHBondContact OD2-CA 3.49Å; D790-L2576 PolarHBondContact OD2-N 3.34Å; D790-Q2578 WeakPolarHBondContact OD1-CB 3.13Å; D790-Q2578 PolarHBondContact OD1-OE1 2.77Å; D790-Q2578 WeakPolarHBondContact OD2-CA 3.34Å; D790-Q2578 WeakPolarHBondContact OD2-CB 3.15Å; D790-Q2578 PolarHBondContact OD2-N 2.75Å; D790-G2579 VanDerWaalsContact CB-CA 3.49Å; D790-G2579 PolarHBondContact OD2-N 2.92Å
791	Y	86.1	Confident	79.1	Confident	60 Å²	60	55.9 Å²	55.9	24%	0.235	27%	0.267	C	S	.	.	H	α-helix	trans	-55.7	-47.6	161.2	-163.3	-96.2	0	0	0	110	A736 E740 I744 R787 I788 R794 A795 Y796	A736-Y791 HydrophobicContact CB-CD1 3.85Å; A736-Y791 HydrophobicContact CB-CE1 4.37Å; E740-Y791 HydrophobicContact CB-CE1 3.88Å; E740-Y791 HydrophobicContact CG-CE1 4Å; E740-Y791 PolarHBondContact OE1-OH 2.85Å; I744-Y791 HydrophobicContact CD1-CD1 4.21Å; I744-Y791 HydrophobicContact CD1-CD2 3.91Å; I744-Y791 HydrophobicContact CD1-CG 3.67Å; R787-Y791 PolarHBondContact O-N 3.25Å; I788-Y791 PolarHBondContact O-N 3.19Å; Y791-R794 PolarHBondContact O-N 3.44Å; Y791-A795 HydrophobicContact CE1-CB 4.25Å; Y791-A795 WeakPolarHBondContact O-CB 3.49Å; Y791-A795 PolarHBondContact O-N 2.72Å; Y791-Y796 HydrophobicContact CD1-CE2 4.23Å; Y791-Y796 HydrophobicContact CE1-CE2 4.06Å
792	C	77.1	Confident	79.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-55.2	-178.3	-66.4	0	0	0	0	113.2	T735 A736 I788 R794 Y796 R798 I799	T735-C792 PolarHBondContact N-SG 2.86Å; T735-C792 VanDerWaalsContact N-SG 3.38Å; T735-C792 WeakPolarHBondContact OG1-CA 3.21Å; T735-C792 VanDerWaalsContact OG1-CB 3.25Å; T735-C792 WeakPolarHBondContact OG1-CB 3.33Å; T735-C792 PolarHBondContact OG1-SG 3Å; T735-C792 VanDerWaalsContact OG1-SG 3.36Å; A736-C792 PolarHBondContact N-SG 2.63Å; I788-C792 WeakPolarHBondContact CG2-SG 3.34Å; I788-C792 VanDerWaalsContact O-CB 3.24Å; I788-C792 WeakPolarHBondContact O-CB 3.46Å; I788-C792 PolarHBondContact O-N 2.91Å; I788-C792 PolarHBondContact O-SG 2.74Å; C792-R794 PolarHBondContact O-N 3.18Å; C792-R794 VanDerWaalsContact O-N 3.15Å; C792-Y796 WeakPolarHBondContact O-CA 3.45Å; C792-Y796 WeakPolarHBondContact O-CB 3.49Å; C792-Y796 WeakPolarHBondContact O-CD2 3.37Å; C792-Y796 PolarHBondContact O-N 3.28Å; C792-R798 CarbonylContact C-O 3.56Å; C792-R798 VanDerWaalsContact C-O 3.24Å; C792-R798 VanDerWaalsContact O-O 3.14Å; C792-I799 WeakPolarHBondContact CB-O 3.41Å
793	R	78.4	Confident	80.6	Confident	92 Å²	92	58.4 Å²	58.4	35%	0.347	27%	0.266	S	S	.	.	H	α-helix	trans	-65.4	-18.7	-179.8	-176.9	-162	-39.1	169	7.8	112.5	T789 K797 I799 W2575	T789-R793 VanDerWaalsContact O-CB 3.3Å; T789-R793 WeakPolarHBondContact O-CB 3.37Å; T789-R793 PolarHBondContact O-N 3.38Å; T789-R793 VanDerWaalsContact O-N 3.14Å; R793-K797 VanDerWaalsContact O-CA 3.27Å; R793-K797 WeakPolarHBondContact O-CA 3.3Å; R793-K797 PolarHBondContact O-N 3.45Å; R793-I799 HydrophobicContact CB-CG1 3.9Å; R793-I799 HydrophobicContact CG-CG1 4.42Å; R793-W2575 HydrophobicContact CB-CH2 4.23Å; R793-W2575 HydrophobicContact CB-CZ2 3.33Å; R793-W2575 VanDerWaalsContact CD-CE2 3.43Å; R793-W2575 HydrophobicContact CG-CH2 4.1Å; R793-W2575 HydrophobicContact CG-CZ2 3.57Å; R793-W2575 VanDerWaalsContact NE-NE1 3.17Å
794	R	79.4	Confident	81	Confident	69 Å²	69	61.2 Å²	61.2	26%	0.26	28%	0.283	S	S	.	.	H	α-helix	trans	-89.3	-55.7	178.7	-170.7	164.9	-80.4	100.3	0.1	112.4	D790 Y791 C792 W2575 L2576	D790-R794 WeakPolarHBondContact O-CB 3.2Å; D790-R794 PolarHBondContact O-N 2.69Å; D790-R794 VanDerWaalsContact O-N 3.1Å; D790-R794 PolarHBondContact O-NH1 2.92Å; Y791-R794 PolarHBondContact O-N 3.44Å; C792-R794 PolarHBondContact O-N 3.18Å; C792-R794 VanDerWaalsContact O-N 3.15Å; R794-W2575 HydrophobicContact CB-CH2 3.57Å; R794-W2575 HydrophobicContact CB-CZ2 3.81Å; R794-W2575 HydrophobicContact CG-CH2 4.23Å; R794-W2575 VanDerWaalsContact CZ-CH2 3.43Å; R794-W2575 VanDerWaalsContact CZ-CZ3 3.48Å; R794-W2575 VanDerWaalsContact CZ-O 3.29Å; R794-W2575 VanDerWaalsContact N-CZ2 3.33Å; R794-W2575 PolarHBondContact NH1-O 2.65Å; R794-W2575 PolarHBondContact NH2-O 2.75Å; R794-L2576 VanDerWaalsContact NH2-CG 3.27Å
795	A	80.6	Confident	81.5	Confident	61 Å²	61	63.5 Å²	63.5	50%	0.504	29%	0.294	S	S	.	.	H	α-helix	trans	-72.3	-27.3	-179.3	0	0	0	0	0	113.2	Y791	Y791-A795 HydrophobicContact CE1-CB 4.25Å; Y791-A795 WeakPolarHBondContact O-CB 3.49Å; Y791-A795 PolarHBondContact O-N 2.72Å
796	Y	78.1	Confident	82.1	Confident	86 Å²	86	65.6 Å²	65.6	34%	0.337	31%	0.305	S	S	.	.	S	Bend	trans	-127	1	-171.1	-48.6	-100	0	0	0	114.7	T735 E740 Y791 C792 R798	T735-Y796 VanDerWaalsContact CB-CG 3.47Å; T735-Y796 HydrophobicContact CG2-CG 4.3Å; T735-Y796 WeakPolarHBondContact O-CE1 3.39Å; T735-Y796 PolarHBondContact O-OH 2.68Å; T735-Y796 WeakPolarHBondContact OG1-CB 3.33Å; T735-Y796 WeakPolarHBondContact OG1-CD2 3.49Å; T735-Y796 WeakPolarHBondContact OG1-CE2 3.5Å; E740-Y796 PolarHBondContact OE1-OH 3.18Å; E740-Y796 PolarHBondContact OE2-OH 3.46Å; Y791-Y796 HydrophobicContact CD1-CE2 4.23Å; Y791-Y796 HydrophobicContact CE1-CE2 4.06Å; C792-Y796 WeakPolarHBondContact O-CA 3.45Å; C792-Y796 WeakPolarHBondContact O-CB 3.49Å; C792-Y796 WeakPolarHBondContact O-CD2 3.37Å; C792-Y796 PolarHBondContact O-N 3.28Å; Y796-R798 PolarHBondContact O-N 3.42Å
797	K	75.1	Confident	82.5	Confident	190 Å²	190	67.7 Å²	67.7	83%	0.826	31%	0.312	S	S	*	.	S	Bend	trans	55.7	11.7	-176.8	-58.6	-175	179	-177.1	0	115.2	R793	R793-K797 VanDerWaalsContact O-CA 3.27Å; R793-K797 WeakPolarHBondContact O-CA 3.3Å; R793-K797 PolarHBondContact O-N 3.45Å
798	R	73.4	Confident	82.7	Confident	177 Å²	177	72.9 Å²	72.9	67%	0.668	34%	0.339	S	S	*	.			trans	-143.6	139.7	178.1	-66.2	-175.9	177.8	173.9	0.8	108.5	C792 Y796	C792-R798 CarbonylContact C-O 3.56Å; C792-R798 VanDerWaalsContact C-O 3.24Å; C792-R798 VanDerWaalsContact O-O 3.14Å; Y796-R798 PolarHBondContact O-N 3.42Å
799	I	82.2	Confident	83.1	Confident	49 Å²	49	72.9 Å²	72.9	25%	0.251	34%	0.339	S	S	.	.	S	Bend	trans	-77.6	-46.6	-179	-57	166.1	0	0	0	110.5	W734 T789 C792 R793	W734-I799 HydrophobicContact CE3-CG2 4.01Å; W734-I799 HydrophobicContact CZ3-CG2 3.55Å; T789-I799 HydrophobicContact CG2-CD1 4.03Å; T789-I799 HydrophobicContact CG2-CG1 4.16Å; T789-I799 HydrophobicContact CG2-CG2 3.89Å; C792-I799 WeakPolarHBondContact CB-O 3.41Å; R793-I799 HydrophobicContact CB-CG1 3.9Å; R793-I799 HydrophobicContact CG-CG1 4.42Å
800	H	83.5	Confident	83.5	Confident	67 Å²	67	72.6 Å²	72.6	31%	0.31	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	145.9	-176.9	-52.9	-71.1	0	0	0	111.9	D584 E732 L733 W734	D584-H800 IonicContact OD2-CE1 2.68Å; D584-H800 PolarHBondContact OD2-CE1 3.03Å; D584-H800 VanDerWaalsContact OD2-CE1 3.28Å; D584-H800 IonicContact OD2-NE2 3.6Å; E732-H800 HydrophobicContact CB-CB 4.21Å; L733-H800 CarbonylContact O-C 3.44Å; L733-H800 WeakPolarHBondContact O-CA 3.26Å; W734-H800 AromaticContact CE3-CE1 3.59Å; W734-H800 AromaticContact CE3-ND1 3.73Å; W734-H800 AromaticContact CH2-CE1 3.73Å; W734-H800 AromaticContact CZ3-CE1 3.39Å; W734-H800 WeakPolarHBondContact CZ3-CE1 3.42Å
801	L	83.9	Confident	84	Confident	84 Å²	84	72.6 Å²	72.6	44%	0.44	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.6	165.5	-179.5	69.3	0	0	0	108.8	L733 T735 R803	L733-L801 PolarHBondContact N-O 3.33Å; L733-L801 PolarHBondContact O-N 3.24Å; T735-L801 HydrophobicContact CG2-CB 4.28Å; L801-R803 PolarHBondContact O-N 2.86Å
802	T	83.8	Confident	84.2	Confident	69 Å²	69	70.7 Å²	70.7	42%	0.423	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	102.2	172	-50	0	0	0	0	109.9	R730 A731	R730-T802 HydrophobicContact CG-CG2 4.14Å; A731-T802 CarbonylContact O-C 2.94Å; A731-T802 WeakPolarHBondContact O-CA 3.46Å
803	R	85.4	Confident	85	Confident	70 Å²	70	70.7 Å²	70.7	26%	0.264	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	136.2	175.7	-170	170.4	172.6	178.2	-16.6	109.3	D579 W729 R730 A731 L733 L801 E805	D579-R803 IonicContact OD1-CZ 2.69Å; D579-R803 IonicContact OD1-NH1 2.65Å; D579-R803 PolarHBondContact OD1-NH1 3.25Å; D579-R803 IonicContact OD1-NH2 3.53Å; D579-R803 PolarHBondContact OD1-NH2 3.16Å; D579-R803 IonicContact OD2-CZ 3.51Å; D579-R803 IonicContact OD2-NH1 2.65Å; D579-R803 PolarHBondContact OD2-NH1 2.79Å; W729-R803 HydrophobicContact CZ3-CB 4.49Å; W729-R803 HydrophobicContact CZ3-CG 4.34Å; R730-R803 WeakPolarHBondContact CA-O 3.38Å; A731-R803 PolarHBondContact N-O 3.19Å; A731-R803 PolarHBondContact O-N 3.32Å; L733-R803 HydrophobicContact CD1-CB 3.97Å; L733-R803 HydrophobicContact CD1-CG 4.49Å; L733-R803 HydrophobicContact CG-CB 4.44Å; L801-R803 PolarHBondContact O-N 2.86Å; R803-E805 HydrophobicContact CG-CG 4.11Å; R803-E805 IonicContact CZ-OE1 3.35Å; R803-E805 IonicContact NE-OE1 3.01Å; R803-E805 PolarHBondContact NE-OE1 2.79Å; R803-E805 IonicContact NH2-OE1 3.39Å; R803-E805 PolarHBondContact NH2-OE1 2.63Å
804	T	86.8	Confident	85.5	Confident	73 Å²	73	68.2 Å²	68.2	45%	0.448	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	126.9	178.4	-57.4	0	0	0	0	108.3	V589 T728 W729 R730	V589-T804 HydrophobicContact CG2-CG2 3.83Å; T728-T804 HydrophobicContact CG2-CG2 3.54Å; W729-T804 CarbonylContact O-C 3.52Å; W729-T804 WeakPolarHBondContact O-CA 3.29Å; R730-T804 HydrophobicContact CB-CG2 4.4Å
805	E	87.1	Confident	86	Confident	49 Å²	49	65.3 Å²	65.3	23%	0.229	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	145.2	-172.5	-59.1	-176.1	143.8	0	0	110.3	T728 W729 R803 R807	T728-E805 CarbonylContact C-O 3.56Å; T728-E805 WeakPolarHBondContact CA-O 3.28Å; W729-E805 HydrophobicContact CE3-CB 4.22Å; W729-E805 HydrophobicContact CE3-CG 4.14Å; W729-E805 HydrophobicContact CZ3-CG 4.29Å; W729-E805 WeakPolarHBondContact CZ3-OE2 3.45Å; W729-E805 PolarHBondContact N-O 2.89Å; W729-E805 PolarHBondContact O-N 3.45Å; R803-E805 HydrophobicContact CG-CG 4.11Å; R803-E805 IonicContact CZ-OE1 3.35Å; R803-E805 IonicContact NE-OE1 3.01Å; R803-E805 PolarHBondContact NE-OE1 2.79Å; R803-E805 IonicContact NH2-OE1 3.39Å; R803-E805 PolarHBondContact NH2-OE1 2.63Å; E805-R807 HydrophobicContact CB-CG 4.34Å; E805-R807 IonicContact OE2-CZ 3.25Å; E805-R807 VanDerWaalsContact OE2-CZ 3.26Å; E805-R807 IonicContact OE2-NE 2.72Å; E805-R807 PolarHBondContact OE2-NE 3.09Å; E805-R807 IonicContact OE2-NH2 2.85Å; E805-R807 PolarHBondContact OE2-NH2 2.59Å
806	E	89	Confident	86.4	Confident	132 Å²	132	64.7 Å²	64.7	62%	0.617	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	126.5	162	-166.1	170.2	122.8	0	0	108.9	P726 H907	P726-E806 HydrophobicContact CB-CG 4.03Å; P726-E806 WeakPolarHBondContact CB-OE1 3.29Å; E806-H907 IonicContact OE2-CE1 3.22Å
807	R	89.1	Confident	86.9	Confident	78 Å²	78	62.3 Å²	62.3	29%	0.294	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	155.6	178.9	-66.6	-173.9	176.4	-176.2	-4.9	109.2	P726 W727 W729 E805	P726-R807 CarbonylContact C-O 3.58Å; P726-R807 WeakPolarHBondContact CA-O 3.37Å; W727-R807 HydrophobicContact CZ2-CB 4.38Å; W727-R807 PolarHBondContact N-O 3.34Å; W727-R807 PolarHBondContact O-N 3.07Å; W729-R807 HydrophobicContact CB-CG 4.27Å; W729-R807 VanDerWaalsContact CD2-CZ 3.45Å; W729-R807 VanDerWaalsContact CE3-CZ 3.45Å; W729-R807 VanDerWaalsContact CE3-NH2 3.34Å; W729-R807 VanDerWaalsContact CH2-NH2 3.26Å; E805-R807 HydrophobicContact CB-CG 4.34Å; E805-R807 IonicContact OE2-CZ 3.25Å; E805-R807 VanDerWaalsContact OE2-CZ 3.26Å; E805-R807 IonicContact OE2-NE 2.72Å; E805-R807 PolarHBondContact OE2-NE 3.09Å; E805-R807 IonicContact OE2-NH2 2.85Å; E805-R807 PolarHBondContact OE2-NH2 2.59Å
808	I	89.7	Confident	87.6	Confident	109 Å²	109	53.8 Å²	53.8	56%	0.559	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.8	-179.6	-59	175	0	0	0	108.2	F724 M725	F724-I808 HydrophobicContact CB-CG2 3.78Å; F724-I808 HydrophobicContact CD1-CG2 4.04Å; F724-I808 HydrophobicContact CG-CG2 4.38Å; M725-I808 WeakPolarHBondContact O-CA 3.4Å
809	A	91.1	Very high	88.6	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.008	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	150.4	169.3	0	0	0	0	0	110.4	V701 F724 M725 E900 I904	V701-A809 HydrophobicContact CG1-CB 3.93Å; F724-A809 WeakPolarHBondContact CA-O 3.5Å; M725-A809 PolarHBondContact N-O 3.06Å; M725-A809 PolarHBondContact O-N 3.38Å; A809-E900 HydrophobicContact CB-CB 4.22Å; A809-I904 HydrophobicContact CB-CD1 4.31Å
810	M	91.1	Very high	89.1	Confident	9 Å²	9	43.1 Å²	43.1	4%	0.044	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.4	179.8	-171.3	-74.8	-56.8	0	0	109.3	V701 D702 Q722 F724 C812	V701-M810 CarbonylContact C-O 3.55Å; V701-M810 WeakPolarHBondContact CA-O 3.37Å; D702-M810 PolarHBondContact N-O 2.96Å; D702-M810 WeakPolarHBondContact O-CB 3.3Å; D702-M810 PolarHBondContact O-N 2.95Å; Q722-M810 HydrophobicContact CB-CG 4.04Å; Q722-M810 HydrophobicContact CB-SD 4.15Å; Q722-M810 HydrophobicContact CG-CG 4.23Å; Q722-M810 HydrophobicContact CG-SD 4.03Å; F724-M810 HydrophobicContact CD1-CB 3.89Å; F724-M810 HydrophobicContact CD1-CG 4.17Å; F724-M810 HydrophobicContact CE1-CB 3.7Å; F724-M810 HydrophobicContact CE1-CG 3.78Å; F724-M810 HydrophobicContact CE2-CG 4.47Å; F724-M810 HydrophobicContact CZ-CB 4.38Å; F724-M810 HydrophobicContact CZ-CG 3.94Å; M810-C812 HydrophobicContact CE-CB 4.36Å; M810-C812 HydrophobicContact SD-CB 4.42Å
811	V	92.4	Very high	89.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	105	179.9	-169.1	0	0	0	0	109.5	L696 A700 V701 R723 M725 Q813 I904	L696-V811 HydrophobicContact CD2-CB 4.46Å; L696-V811 HydrophobicContact CD2-CG1 3.9Å; L696-V811 HydrophobicContact CD2-CG2 3.72Å; A700-V811 HydrophobicContact CB-CG1 4.18Å; A700-V811 CarbonylContact O-C 3.52Å; A700-V811 WeakPolarHBondContact O-CA 3.32Å; V701-V811 HydrophobicContact CG2-CG1 4.28Å; V701-V811 HydrophobicContact CG2-CG2 4.27Å; R723-V811 HydrophobicContact CB-CB 4.39Å; R723-V811 PolarHBondContact N-O 2.83Å; R723-V811 PolarHBondContact O-N 2.7Å; M725-V811 HydrophobicContact CG-CG2 4.27Å; M725-V811 HydrophobicContact SD-CG2 4.26Å; V811-Q813 PolarHBondContact O-N 3.11Å; V811-Q813 VanDerWaalsContact O-N 3.09Å; V811-Q813 PolarHBondContact O-NE2 3.42Å; V811-Q813 VanDerWaalsContact O-NE2 3.1Å; V811-I904 HydrophobicContact CG2-CD1 4.09Å
812	C	91.9	Very high	89.8	Confident	20 Å²	20	39.5 Å²	39.5	14%	0.135	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	107	179.6	-178.9	0	0	0	0	111.1	A700 M810 R814 E815	A700-C812 HydrophobicContact CB-CB 4.45Å; A700-C812 PolarHBondContact O-N 2.9Å; M810-C812 HydrophobicContact CE-CB 4.36Å; M810-C812 HydrophobicContact SD-CB 4.42Å; C812-R814 PolarHBondContact O-N 2.92Å; C812-R814 VanDerWaalsContact O-N 3.17Å; C812-E815 HydrophobicContact CB-CB 4.35Å; C812-E815 WeakPolarHBondContact O-CB 3.31Å; C812-E815 PolarHBondContact O-N 3.06Å
813	Q	92.5	Very high	90.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-7.9	-177.7	-61.1	-60.5	-67	0	0	113.7	N694 R695 C721 R723 V811 N977 Q979 H981	N694-Q813 PolarHBondContact O-NE2 2.94Å; N694-Q813 VanDerWaalsContact O-NE2 3.12Å; R695-Q813 VanDerWaalsContact CD-O 3.22Å; R695-Q813 WeakPolarHBondContact CD-O 3.4Å; R695-Q813 PolarHBondContact NE-O 3.07Å; R695-Q813 PolarHBondContact NH1-O 3.32Å; C721-Q813 HydrophobicContact CB-CB 4.38Å; C721-Q813 WeakPolarHBondContact O-CG 3.44Å; C721-Q813 PolarHBondContact O-N 3.32Å; R723-Q813 HydrophobicContact CB-CG 3.93Å; V811-Q813 PolarHBondContact O-N 3.11Å; V811-Q813 VanDerWaalsContact O-N 3.09Å; V811-Q813 PolarHBondContact O-NE2 3.42Å; V811-Q813 VanDerWaalsContact O-NE2 3.1Å; Q813-N977 PolarHBondContact OE1-ND2 3.15Å; Q813-Q979 WeakPolarHBondContact CB-O 3.37Å; Q813-Q979 HydrophobicContact CG-CB 4.17Å; Q813-Q979 WeakPolarHBondContact CG-O 3.15Å; Q813-H981 HydrophobicContact CB-CB 4.4Å; Q813-H981 WeakPolarHBondContact O-CB 3.42Å
814	R	89.8	Confident	90.5	Very high	40 Å²	40	36.9 Å²	36.9	15%	0.151	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-4.8	179.4	-67.8	-176	-173.4	-158.4	-3.4	115	L169 F714 C721 C812 H981 Y991	L169-R814 HydrophobicContact CD1-CB 4.37Å; F714-R814 VanDerWaalsContact CD1-NH1 3.25Å; C721-R814 HydrophobicContact CB-CG 3.91Å; C812-R814 PolarHBondContact O-N 2.92Å; C812-R814 VanDerWaalsContact O-N 3.17Å; R814-H981 HydrophobicContact CG-CB 3.89Å; R814-H981 PolarHBondContact NE-CD2 3.01Å; R814-H981 PolarHBondContact NE-NE2 3.02Å; R814-H981 PolarHBondContact NH2-NE2 2.81Å; R814-H981 VanDerWaalsContact NH2-NE2 3.17Å; R814-Y991 HydrophobicContact CB-CD1 4.44Å; R814-Y991 HydrophobicContact CB-CE1 3.87Å; R814-Y991 HydrophobicContact CG-CD1 4.05Å; R814-Y991 HydrophobicContact CG-CE1 3.97Å; R814-Y991 HydrophobicContact CG-CG 4.4Å; R814-Y991 PolarHBondContact O-OH 3.4Å
815	E	90	Very high	90.5	Very high	7 Å²	7	35.2 Å²	35.2	3%	0.033	18%	0.177	C	C	.	.	S	Bend	trans	-51.8	155.8	-175.5	-178.7	53.8	-139.3	0	0	114.4	H168 R695 Q697 S699 A700 C812 S817	H168-E815 IonicContact CE1-OE1 2.95Å; H168-E815 IonicContact CE1-OE2 2.71Å; H168-E815 IonicContact NE2-OE1 3.43Å; H168-E815 PolarHBondContact NE2-OE1 2.88Å; H168-E815 IonicContact NE2-OE2 3.91Å; H168-E815 PolarHBondContact NE2-OE2 3.16Å; R695-E815 VanDerWaalsContact CZ-O 3.24Å; R695-E815 PolarHBondContact NH1-O 2.7Å; R695-E815 PolarHBondContact NH2-O 3.5Å; Q697-E815 HydrophobicContact CG-CG 4.32Å; Q697-E815 VanDerWaalsContact NE2-CG 3.28Å; S699-E815 VanDerWaalsContact CB-OE1 3.25Å; S699-E815 WeakPolarHBondContact CB-OE1 3.27Å; S699-E815 WeakPolarHBondContact OG-CG 3.34Å; S699-E815 PolarHBondContact OG-OE1 2.65Å; A700-E815 HydrophobicContact CB-CB 3.73Å; A700-E815 HydrophobicContact CB-CG 3.75Å; C812-E815 HydrophobicContact CB-CB 4.35Å; C812-E815 WeakPolarHBondContact O-CB 3.31Å; C812-E815 PolarHBondContact O-N 3.06Å; E815-S817 PolarHBondContact O-N 3.32Å
816	N	87.8	Confident	90.6	Very high	48 Å²	48	33 Å²	33	26%	0.257	17%	0.167	S	C	.	.			trans	-56.3	122.8	174.1	-175.8	-55.6	0	0	0	111	L163 Q697 F818	L163-N816 HydrophobicContact CD1-CB 4.3Å; L163-N816 HydrophobicContact CD2-CB 3.64Å; Q697-N816 VanDerWaalsContact CD-O 3.29Å; Q697-N816 PolarHBondContact NE2-O 2.79Å; Q697-N816 PolarHBondContact OE1-O 3.26Å; N816-F818 PolarHBondContact O-N 3.48Å; N816-F818 PolarHBondContact OD1-N 2.86Å
817	S	89.1	Confident	90.6	Very high	37 Å²	37	28.2 Å²	28.2	26%	0.259	14%	0.143	S	C	.	.			trans	-84.3	1.2	-165.2	53.9	0	0	0	0	116.3	E815 Y819 V820 D821	E815-S817 PolarHBondContact O-N 3.32Å; S817-Y819 PolarHBondContact O-N 2.82Å; S817-V820 PolarHBondContact O-N 3.36Å; S817-D821 WeakPolarHBondContact CB-OD2 3.38Å; S817-D821 PolarHBondContact O-N 3.29Å; S817-D821 PolarHBondContact OG-OD2 3.2Å
818	F	91.2	Very high	90.6	Very high	11 Å²	11	27.4 Å²	27.4	5%	0.048	15%	0.145	C	C	.	.	H	α-helix	trans	-51.6	-35.2	-168.4	87	-77.7	0	0	0	114.7	L163 A544 A547 V549 N816 T822 W896	L163-F818 HydrophobicContact CD1-CD1 4.29Å; L163-F818 HydrophobicContact CD1-CE1 3.84Å; A544-F818 HydrophobicContact CB-CD2 4.17Å; A544-F818 HydrophobicContact CB-CE2 3.87Å; A547-F818 HydrophobicContact CB-CB 3.83Å; V549-F818 HydrophobicContact CG2-CD1 4.3Å; V549-F818 HydrophobicContact CG2-CG 4.43Å; N816-F818 PolarHBondContact O-N 3.48Å; N816-F818 PolarHBondContact OD1-N 2.86Å; F818-T822 WeakPolarHBondContact O-CB 3.42Å; F818-T822 PolarHBondContact O-N 2.9Å; F818-T822 PolarHBondContact O-OG1 3.43Å; F818-W896 HydrophobicContact CE2-CZ2 4.43Å; F818-W896 AromaticContact CZ-CE2 3.96Å; F818-W896 HydrophobicContact CZ-CZ2 4.41Å; F818-W896 AromaticContact CZ-NE1 3.6Å
819	Y	93.7	Very high	90.4	Very high	1 Å²	1	27.5 Å²	27.5	0%	0.004	14%	0.138	C	C	.	.	H	α-helix	trans	-72.5	-49.2	178.4	-177.9	-73.3	0	0	0	111.2	L540 I691 Q697 S817 D821 T822 V823 F885 V889 M901	L540-Y819 HydrophobicContact CD1-CD2 4.11Å; L540-Y819 HydrophobicContact CD1-CE2 3.68Å; L540-Y819 HydrophobicContact CD2-CD2 3.61Å; L540-Y819 HydrophobicContact CD2-CE2 3.94Å; L540-Y819 HydrophobicContact CD2-CG 4.31Å; I691-Y819 HydrophobicContact CG2-CE1 4.43Å; Q697-Y819 HydrophobicContact CB-CD1 3.7Å; Q697-Y819 HydrophobicContact CB-CG 3.85Å; S817-Y819 PolarHBondContact O-N 2.82Å; Y819-D821 VanDerWaalsContact C-N 3.31Å; Y819-D821 PolarHBondContact O-N 3.43Å; Y819-T822 WeakPolarHBondContact O-CB 3.47Å; Y819-T822 PolarHBondContact O-N 3.35Å; Y819-V823 HydrophobicContact CD1-CG2 4.21Å; Y819-V823 HydrophobicContact CE1-CG2 3.85Å; Y819-V823 WeakPolarHBondContact O-CG2 3.49Å; Y819-V823 PolarHBondContact O-N 3.45Å; Y819-F885 HydrophobicContact CE2-CD1 4.48Å; Y819-F885 PolarHBondContact OH-O 3.35Å; Y819-V889 HydrophobicContact CE2-CG1 4.07Å; Y819-V889 VanDerWaalsContact OH-CG1 3.31Å; Y819-V889 WeakPolarHBondContact OH-CG1 3.29Å; Y819-M901 HydrophobicContact CE1-CE 3.65Å
820	V	92	Very high	90.2	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-59.6	-42.5	175.2	167.4	0	0	0	0	110.7	L692 R695 Q697 S817 T822 V823 K824	L692-V820 HydrophobicContact CD2-CG1 3.8Å; L692-V820 VanDerWaalsContact CD2-O 3.26Å; L692-V820 WeakPolarHBondContact CD2-O 3.32Å; R695-V820 HydrophobicContact CG-CG2 4.25Å; Q697-V820 HydrophobicContact CB-CG2 4.23Å; Q697-V820 HydrophobicContact CG-CG2 4.23Å; S817-V820 PolarHBondContact O-N 3.36Å; V820-T822 VanDerWaalsContact C-N 3.35Å; V820-T822 PolarHBondContact O-N 2.82Å; V820-V823 PolarHBondContact O-N 2.85Å; V820-K824 WeakPolarHBondContact O-CB 3.44Å; V820-K824 PolarHBondContact O-N 3.09Å
821	D	90.5	Very high	89.9	Confident	71 Å²	71	31.8 Å²	31.8	38%	0.38	15%	0.154	S	C	.	.	H	α-helix	trans	-65.8	-36	177.2	-65.4	-35.7	0	0	0	112.1	S817 Y819 K824 A825	S817-D821 WeakPolarHBondContact CB-OD2 3.38Å; S817-D821 PolarHBondContact O-N 3.29Å; S817-D821 PolarHBondContact OG-OD2 3.2Å; Y819-D821 VanDerWaalsContact C-N 3.31Å; Y819-D821 PolarHBondContact O-N 3.43Å; D821-K824 PolarHBondContact O-N 2.85Å; D821-A825 VanDerWaalsContact O-CB 3.28Å; D821-A825 WeakPolarHBondContact O-CB 3.5Å; D821-A825 PolarHBondContact O-N 2.91Å
822	T	91.8	Very high	89.6	Confident	4 Å²	4	38.7 Å²	38.7	3%	0.025	18%	0.184	C	C	.	.	H	α-helix	trans	-61.8	-47.6	172.1	-62	0	0	0	0	111.5	L539 L540 Q543 F818 Y819 V820 K824 A825 F826 F885	L539-T822 HydrophobicContact CD1-CG2 4.46Å; L539-T822 HydrophobicContact CD2-CG2 4.05Å; L539-T822 HydrophobicContact CG-CG2 4.12Å; L540-T822 HydrophobicContact CD2-CG2 4.05Å; Q543-T822 HydrophobicContact CB-CG2 4.42Å; Q543-T822 VanDerWaalsContact CB-OG1 3.25Å; Q543-T822 WeakPolarHBondContact CB-OG1 3.43Å; Q543-T822 HydrophobicContact CG-CG2 3.81Å; Q543-T822 WeakPolarHBondContact CG-OG1 3.45Å; F818-T822 WeakPolarHBondContact O-CB 3.42Å; F818-T822 PolarHBondContact O-N 2.9Å; F818-T822 PolarHBondContact O-OG1 3.43Å; Y819-T822 WeakPolarHBondContact O-CB 3.47Å; Y819-T822 PolarHBondContact O-N 3.35Å; V820-T822 VanDerWaalsContact C-N 3.35Å; V820-T822 PolarHBondContact O-N 2.82Å; T822-K824 VanDerWaalsContact C-N 3.33Å; T822-K824 PolarHBondContact O-N 3.48Å; T822-A825 PolarHBondContact O-N 2.77Å; T822-F826 PolarHBondContact O-N 3.43Å; T822-F885 HydrophobicContact CG2-CE1 4.09Å; T822-F885 HydrophobicContact CG2-CZ 3.98Å
823	V	92.4	Very high	89.3	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.2	-42.2	177.6	175.1	0	0	0	0	110.7	P688 I691 L692 Y819 V820 F826 R827 L882 F885	P688-V823 HydrophobicContact CB-CG1 4.13Å; I691-V823 HydrophobicContact CG2-CB 4.47Å; I691-V823 HydrophobicContact CG2-CG1 4.2Å; I691-V823 HydrophobicContact CG2-CG2 4.26Å; L692-V823 HydrophobicContact CD1-CG1 4.48Å; L692-V823 HydrophobicContact CD2-CB 4.06Å; L692-V823 HydrophobicContact CD2-CG1 3.96Å; L692-V823 HydrophobicContact CG-CG1 4.09Å; Y819-V823 HydrophobicContact CD1-CG2 4.21Å; Y819-V823 HydrophobicContact CE1-CG2 3.85Å; Y819-V823 WeakPolarHBondContact O-CG2 3.49Å; Y819-V823 PolarHBondContact O-N 3.45Å; V820-V823 PolarHBondContact O-N 2.85Å; V823-F826 PolarHBondContact O-N 3.26Å; V823-R827 WeakPolarHBondContact O-CB 3.4Å; V823-R827 PolarHBondContact O-N 3.4Å; V823-L882 HydrophobicContact CG1-CD1 4.29Å; V823-F885 HydrophobicContact CG2-CB 4.42Å; V823-F885 HydrophobicContact CG2-CD1 3.7Å; V823-F885 HydrophobicContact CG2-CD2 3.97Å; V823-F885 HydrophobicContact CG2-CE1 3.83Å; V823-F885 HydrophobicContact CG2-CE2 4.1Å; V823-F885 HydrophobicContact CG2-CG 3.78Å; V823-F885 HydrophobicContact CG2-CZ 4.04Å
824	K	91.5	Very high	88.9	Confident	84 Å²	84	42.2 Å²	42.2	37%	0.365	20%	0.197	S	C	.	.	H	α-helix	trans	-62.4	-52	177.4	-175.3	176.4	176.4	-178.3	0	111.1	L692 V820 D821 T822 F826 R827 D828	L692-K824 HydrophobicContact CD1-CB 4.29Å; L692-K824 HydrophobicContact CD2-CB 3.8Å; V820-K824 WeakPolarHBondContact O-CB 3.44Å; V820-K824 PolarHBondContact O-N 3.09Å; D821-K824 PolarHBondContact O-N 2.85Å; T822-K824 VanDerWaalsContact C-N 3.33Å; T822-K824 PolarHBondContact O-N 3.48Å; K824-F826 VanDerWaalsContact C-N 3.28Å; K824-F826 PolarHBondContact O-N 3.03Å; K824-R827 PolarHBondContact O-N 3.4Å; K824-D828 WeakPolarHBondContact CG-OD2 3.09Å; K824-D828 WeakPolarHBondContact O-CB 3.46Å; K824-D828 PolarHBondContact O-N 2.86Å
825	A	87.6	Confident	88.5	Confident	37 Å²	37	41.9 Å²	41.9	31%	0.306	21%	0.206	S	C	.	.	H	α-helix	trans	-57.7	-39.2	177.5	0	0	0	0	0	112.1	D821 T822 R829	D821-A825 VanDerWaalsContact O-CB 3.28Å; D821-A825 WeakPolarHBondContact O-CB 3.5Å; D821-A825 PolarHBondContact O-N 2.91Å; T822-A825 PolarHBondContact O-N 2.77Å; A825-R829 VanDerWaalsContact O-CB 3.24Å; A825-R829 WeakPolarHBondContact O-CB 3.21Å; A825-R829 WeakPolarHBondContact O-CG 3.27Å; A825-R829 PolarHBondContact O-N 3Å
826	F	88.1	Confident	88.3	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.018	22%	0.215	C	C	.	.	H	α-helix	trans	-70.4	-41.3	176.5	-99.8	-111.9	0	0	0	113.6	I519 L539 T822 V823 K824 R830 H878 I881 L882 F885	I519-F826 HydrophobicContact CB-CZ 4.13Å; I519-F826 HydrophobicContact CD1-CE1 4.12Å; I519-F826 HydrophobicContact CD1-CZ 4.23Å; I519-F826 HydrophobicContact CG2-CE1 4.45Å; I519-F826 HydrophobicContact CG2-CE2 4.12Å; I519-F826 HydrophobicContact CG2-CZ 3.53Å; L539-F826 HydrophobicContact CD1-CD2 4.34Å; L539-F826 HydrophobicContact CD1-CE2 3.39Å; L539-F826 HydrophobicContact CD1-CZ 3.6Å; L539-F826 HydrophobicContact CD2-CD1 4.09Å; L539-F826 HydrophobicContact CD2-CD2 3.85Å; L539-F826 HydrophobicContact CD2-CE1 3.7Å; L539-F826 HydrophobicContact CD2-CE2 3.47Å; L539-F826 VanDerWaalsContact CD2-CE2 3.47Å; L539-F826 HydrophobicContact CD2-CG 4.15Å; L539-F826 HydrophobicContact CD2-CZ 3.37Å; L539-F826 HydrophobicContact CG-CE2 4.07Å; L539-F826 HydrophobicContact CG-CZ 4.1Å; T822-F826 PolarHBondContact O-N 3.43Å; V823-F826 PolarHBondContact O-N 3.26Å; K824-F826 VanDerWaalsContact C-N 3.28Å; K824-F826 PolarHBondContact O-N 3.03Å; F826-R830 WeakPolarHBondContact O-CB 3.42Å; F826-R830 PolarHBondContact O-N 3.14Å; F826-H878 AromaticContact CD1-CD2 3.74Å; F826-H878 AromaticContact CE1-CD2 3.87Å; F826-I881 HydrophobicContact CD1-CB 4.21Å; F826-I881 HydrophobicContact CD1-CG2 4.14Å; F826-I881 HydrophobicContact CE1-CB 4.02Å; F826-I881 HydrophobicContact CE1-CG1 4.4Å; F826-I881 HydrophobicContact CE1-CG2 3.94Å; F826-L882 HydrophobicContact CB-CD1 4.26Å; F826-F885 HydrophobicContact CB-CE2 4.41Å
827	R	89	Confident	88.2	Confident	30 Å²	30	42.3 Å²	42.3	11%	0.113	21%	0.209	C	C	.	.	H	α-helix	trans	-59.4	-48.6	172.8	-175.4	-164.3	69.4	177.9	-1.4	110.9	N689 V823 K824 R830 Y831 L882 S998	N689-R827 WeakPolarHBondContact OD1-CD 3.27Å; N689-R827 PolarHBondContact OD1-NH1 2.67Å; V823-R827 WeakPolarHBondContact O-CB 3.4Å; V823-R827 PolarHBondContact O-N 3.4Å; K824-R827 PolarHBondContact O-N 3.4Å; R827-R830 WeakPolarHBondContact O-CB 3.19Å; R827-R830 PolarHBondContact O-N 3.25Å; R827-Y831 HydrophobicContact CG-CD2 4.22Å; R827-Y831 HydrophobicContact CG-CE1 4.21Å; R827-Y831 HydrophobicContact CG-CE2 3.7Å; R827-Y831 PolarHBondContact O-N 2.89Å; R827-L882 HydrophobicContact CB-CD1 4.2Å; R827-L882 HydrophobicContact CB-CD2 4.29Å; R827-S998 PolarHBondContact NH1-OG 3.19Å
828	D	88.8	Confident	87.9	Confident	62 Å²	62	47.7 Å²	47.7	33%	0.332	23%	0.228	S	C	.	.	H	α-helix	trans	-73.8	-36	-172.9	-61.4	-9.9	0	0	0	111	K824 Y831 K832	K824-D828 WeakPolarHBondContact CG-OD2 3.09Å; K824-D828 WeakPolarHBondContact O-CB 3.46Å; K824-D828 PolarHBondContact O-N 2.86Å; D828-Y831 PolarHBondContact O-N 2.99Å; D828-K832 PolarHBondContact O-N 2.75Å
829	R	85.2	Confident	87.5	Confident	111 Å²	111	50.4 Å²	50.4	42%	0.419	25%	0.245	S	C	.	.	H	α-helix	trans	-60.2	-47.2	166.2	-75.7	172.3	-172.6	-164.3	2.7	111.7	A825 Y831 K832 F833	A825-R829 VanDerWaalsContact O-CB 3.24Å; A825-R829 WeakPolarHBondContact O-CB 3.21Å; A825-R829 WeakPolarHBondContact O-CG 3.27Å; A825-R829 PolarHBondContact O-N 3Å; R829-Y831 VanDerWaalsContact C-N 3.25Å; R829-Y831 PolarHBondContact O-N 2.79Å; R829-K832 WeakPolarHBondContact O-CB 3.39Å; R829-K832 PolarHBondContact O-N 2.95Å; R829-F833 HydrophobicContact CB-CD2 4.48Å; R829-F833 HydrophobicContact CB-CE2 4.16Å; R829-F833 WeakPolarHBondContact O-CD2 3.45Å; R829-F833 WeakPolarHBondContact O-CG 3.47Å; R829-F833 PolarHBondContact O-N 3.39Å
830	R	88	Confident	87.1	Confident	23 Å²	23	53 Å²	53	9%	0.087	26%	0.255	C	S	.	.	H	α-helix	trans	-57.2	-40.4	175.4	-174.9	-174.5	164.2	-125.9	-8.7	111.3	F826 R827 F833 K834 Q875 H878	F826-R830 WeakPolarHBondContact O-CB 3.42Å; F826-R830 PolarHBondContact O-N 3.14Å; R827-R830 WeakPolarHBondContact O-CB 3.19Å; R827-R830 PolarHBondContact O-N 3.25Å; R830-F833 PolarHBondContact O-N 2.98Å; R830-K834 WeakPolarHBondContact O-CB 3.3Å; R830-K834 PolarHBondContact O-N 3.4Å; R830-Q875 HydrophobicContact CG-CB 4.35Å; R830-H878 HydrophobicContact CB-CB 3.83Å; R830-H878 HydrophobicContact CG-CB 4.18Å
831	Y	85	Confident	86.7	Confident	77 Å²	77	58.2 Å²	58.2	30%	0.302	28%	0.278	S	S	.	.	H	α-helix	trans	-69.7	-39.2	177.5	-67	-10.3	0	0	0	112.4	R827 D828 R829 F833 K834 G835	R827-Y831 HydrophobicContact CG-CD2 4.22Å; R827-Y831 HydrophobicContact CG-CE1 4.21Å; R827-Y831 HydrophobicContact CG-CE2 3.7Å; R827-Y831 PolarHBondContact O-N 2.89Å; D828-Y831 PolarHBondContact O-N 2.99Å; R829-Y831 VanDerWaalsContact C-N 3.25Å; R829-Y831 PolarHBondContact O-N 2.79Å; Y831-F833 VanDerWaalsContact C-N 3.31Å; Y831-F833 PolarHBondContact O-N 2.87Å; Y831-K834 PolarHBondContact O-N 3.49Å; Y831-G835 PolarHBondContact O-N 3.37Å
832	K	85	Confident	86.3	Confident	144 Å²	144	62.7 Å²	62.7	63%	0.626	29%	0.289	S	S	*	.	H	α-helix	trans	-55.9	-45.4	169.4	-173.9	-179	179	-177.2	0	111.2	D828 R829 G835 L836	D828-K832 PolarHBondContact O-N 2.75Å; R829-K832 WeakPolarHBondContact O-CB 3.39Å; R829-K832 PolarHBondContact O-N 2.95Å; K832-G835 PolarHBondContact O-N 3.49Å; K832-L836 HydrophobicContact CG-CD1 4.13Å; K832-L836 WeakPolarHBondContact O-CG 3.32Å; K832-L836 PolarHBondContact O-N 3.28Å
833	F	86.5	Confident	86	Confident	35 Å²	35	66.9 Å²	66.9	15%	0.154	31%	0.309	C	S	.	.	H	α-helix	trans	-72.8	-38.9	177.8	-60.4	-52.3	0	0	0	113.4	R829 R830 Y831 G835 L836 T837 Y871 L874 Q875 H878	R829-F833 HydrophobicContact CB-CD2 4.48Å; R829-F833 HydrophobicContact CB-CE2 4.16Å; R829-F833 WeakPolarHBondContact O-CD2 3.45Å; R829-F833 WeakPolarHBondContact O-CG 3.47Å; R829-F833 PolarHBondContact O-N 3.39Å; R830-F833 PolarHBondContact O-N 2.98Å; Y831-F833 VanDerWaalsContact C-N 3.31Å; Y831-F833 PolarHBondContact O-N 2.87Å; F833-G835 PolarHBondContact O-N 3.07Å; F833-L836 HydrophobicContact CD1-CD1 4.15Å; F833-L836 PolarHBondContact O-N 3.02Å; F833-T837 WeakPolarHBondContact O-CB 3.47Å; F833-T837 PolarHBondContact O-N 2.93Å; F833-T837 PolarHBondContact O-OG1 3.09Å; F833-Y871 AromaticContact CD1-CD1 3.7Å; F833-Y871 HydrophobicContact CD1-CD1 3.7Å; F833-Y871 HydrophobicContact CD1-CE1 4.12Å; F833-Y871 HydrophobicContact CE1-CD1 4.18Å; F833-Y871 HydrophobicContact CE1-CE1 4.19Å; F833-L874 HydrophobicContact CB-CB 4.39Å; F833-L874 HydrophobicContact CD1-CB 4.15Å; F833-L874 HydrophobicContact CD1-CD1 4.22Å; F833-L874 HydrophobicContact CD2-CB 4.08Å; F833-L874 HydrophobicContact CE1-CB 4.45Å; F833-L874 HydrophobicContact CE1-CD1 3.97Å; F833-L874 HydrophobicContact CE2-CB 4.41Å; F833-L874 HydrophobicContact CG-CB 3.96Å; F833-L874 HydrophobicContact CZ-CD1 4.39Å; F833-Q875 HydrophobicContact CB-CB 3.68Å; F833-H878 AromaticContact CD2-CE1 3.91Å; F833-H878 AromaticContact CD2-ND1 3.9Å; F833-H878 AromaticContact CE2-CE1 3.43Å; F833-H878 VanDerWaalsContact CE2-CE1 3.43Å; F833-H878 WeakPolarHBondContact CE2-CE1 3.18Å; F833-H878 AromaticContact CE2-ND1 3.9Å; F833-H878 AromaticContact CE2-NE2 3.83Å
834	K	83.4	Confident	85.7	Confident	60 Å²	60	70.3 Å²	70.3	26%	0.261	32%	0.322	S	S	.	.	H	α-helix	trans	-57.3	-36.6	169.8	-172.8	-176.9	179.6	-172	0	110.5	R830 Y831 K838 E1002	R830-K834 WeakPolarHBondContact O-CB 3.3Å; R830-K834 PolarHBondContact O-N 3.4Å; Y831-K834 PolarHBondContact O-N 3.49Å; K834-K838 PolarHBondContact O-N 3.4Å; K834-E1002 IonicContact NZ-OE1 3.2Å; K834-E1002 PolarHBondContact NZ-OE1 3.25Å; K834-E1002 IonicContact NZ-OE2 3.87Å; K834-E1002 PolarHBondContact NZ-OE2 3.17Å
835	G	81.6	Confident	85.3	Confident	32 Å²	32	69.9 Å²	69.9	33%	0.33	32%	0.324	S	S	.	.	H	α-helix	trans	-69.3	-54.1	173.2	0	0	0	0	0	113.1	Y831 K832 F833 T837 K838 T839	Y831-G835 PolarHBondContact O-N 3.37Å; K832-G835 PolarHBondContact O-N 3.49Å; F833-G835 PolarHBondContact O-N 3.07Å; G835-T837 VanDerWaalsContact C-N 3.26Å; G835-T837 PolarHBondContact O-N 2.92Å; G835-K838 WeakPolarHBondContact O-CA 3.41Å; G835-K838 WeakPolarHBondContact O-CB 3.3Å; G835-K838 PolarHBondContact O-N 2.68Å; G835-T839 PolarHBondContact O-N 3.26Å; G835-T839 PolarHBondContact O-OG1 3.5Å
836	L	85.3	Confident	85.2	Confident	44 Å²	44	71.9 Å²	71.9	23%	0.23	33%	0.329	C	S	.	.	H	α-helix	trans	-58.4	-37.2	177.9	-73.3	166.8	0	0	0	112.3	K832 F833 K838 T839 W840 Y871	K832-L836 HydrophobicContact CG-CD1 4.13Å; K832-L836 WeakPolarHBondContact O-CG 3.32Å; K832-L836 PolarHBondContact O-N 3.28Å; F833-L836 HydrophobicContact CD1-CD1 4.15Å; F833-L836 PolarHBondContact O-N 3.02Å; L836-K838 VanDerWaalsContact C-N 3.32Å; L836-K838 PolarHBondContact O-N 3.3Å; L836-T839 PolarHBondContact O-N 3.01Å; L836-T839 VanDerWaalsContact O-N 3.16Å; L836-W840 WeakPolarHBondContact O-CB 3.26Å; L836-W840 PolarHBondContact O-N 3.5Å; L836-Y871 HydrophobicContact CB-CD1 4.09Å; L836-Y871 HydrophobicContact CB-CD2 3.94Å; L836-Y871 HydrophobicContact CB-CE1 4.45Å; L836-Y871 HydrophobicContact CB-CE2 4.29Å; L836-Y871 HydrophobicContact CB-CG 3.83Å; L836-Y871 HydrophobicContact CD1-CD1 4.06Å; L836-Y871 HydrophobicContact CD1-CE1 3.77Å
837	T	85.6	Confident	85	Confident	20 Å²	20	72.5 Å²	72.5	12%	0.123	34%	0.335	C	S	.	.	H	α-helix	trans	-58.3	-41.9	173.2	-52.5	0	0	0	0	111.5	F833 G835 K841 L868 Y871 D872	F833-T837 WeakPolarHBondContact O-CB 3.47Å; F833-T837 PolarHBondContact O-N 2.93Å; F833-T837 PolarHBondContact O-OG1 3.09Å; G835-T837 VanDerWaalsContact C-N 3.26Å; G835-T837 PolarHBondContact O-N 2.92Å; T837-K841 VanDerWaalsContact O-CB 3.25Å; T837-K841 WeakPolarHBondContact O-CB 3.18Å; T837-K841 PolarHBondContact O-N 3.26Å; T837-L868 HydrophobicContact CG2-CD1 3.8Å; T837-L868 WeakPolarHBondContact O-CD1 3.49Å; T837-Y871 VanDerWaalsContact OG1-C 3.23Å; T837-Y871 PolarHBondContact OG1-O 3.27Å; T837-D872 HydrophobicContact CG2-CB 3.89Å; T837-D872 PolarHBondContact OG1-N 3.33Å
838	K	83.4	Confident	84.6	Confident	150 Å²	150	72.9 Å²	72.9	65%	0.652	34%	0.342	S	S	*	.	H	α-helix	trans	-66.9	-41.8	174.2	-69.2	180	177.6	-172.5	0	112	K834 G835 L836 R842	K834-K838 PolarHBondContact O-N 3.4Å; G835-K838 WeakPolarHBondContact O-CA 3.41Å; G835-K838 WeakPolarHBondContact O-CB 3.3Å; G835-K838 PolarHBondContact O-N 2.68Å; L836-K838 VanDerWaalsContact C-N 3.32Å; L836-K838 PolarHBondContact O-N 3.3Å; K838-R842 PolarHBondContact O-N 3.2Å
839	T	83.5	Confident	84.3	Confident	69 Å²	69	72.5 Å²	72.5	42%	0.423	35%	0.347	S	S	.	.	H	α-helix	trans	-63.8	-47.3	178.5	-55.3	0	0	0	0	111.6	G835 L836 R842 H843	G835-T839 PolarHBondContact O-N 3.26Å; G835-T839 PolarHBondContact O-OG1 3.5Å; L836-T839 PolarHBondContact O-N 3.01Å; L836-T839 VanDerWaalsContact O-N 3.16Å; T839-R842 WeakPolarHBondContact O-CB 3.4Å; T839-R842 PolarHBondContact O-N 3.37Å; T839-H843 PolarHBondContact O-CD2 3.02Å; T839-H843 PolarHBondContact O-N 2.96Å
840	W	84.9	Confident	84.1	Confident	54 Å²	54	68.5 Å²	68.5	21%	0.205	34%	0.338	C	S	.	.	H	α-helix	trans	-73.5	-30.7	178.8	-78.5	96.4	0	0	0	113.3	L836 R842 H843 Y844 A864 M867 L868 Y871	L836-W840 WeakPolarHBondContact O-CB 3.26Å; L836-W840 PolarHBondContact O-N 3.5Å; W840-R842 VanDerWaalsContact C-N 3.3Å; W840-R842 PolarHBondContact O-N 2.87Å; W840-H843 HydrophobicContact CE3-CB 4.17Å; W840-H843 PolarHBondContact O-N 3.48Å; W840-Y844 WeakPolarHBondContact O-CB 3.18Å; W840-Y844 PolarHBondContact O-N 3.16Å; W840-A864 HydrophobicContact CE3-CB 4.15Å; W840-A864 HydrophobicContact CZ3-CB 4.27Å; W840-M867 HydrophobicContact CD2-CB 3.57Å; W840-M867 HydrophobicContact CD2-CG 4.38Å; W840-M867 HydrophobicContact CE3-CB 3.53Å; W840-M867 HydrophobicContact CE3-CG 4.15Å; W840-M867 HydrophobicContact CG-CB 4.1Å; W840-M867 HydrophobicContact CH2-CB 4.09Å; W840-M867 HydrophobicContact CH2-CG 3.82Å; W840-M867 HydrophobicContact CZ2-CB 4.16Å; W840-M867 HydrophobicContact CZ2-CE 4.34Å; W840-M867 HydrophobicContact CZ2-CG 4.09Å; W840-M867 HydrophobicContact CZ3-CB 3.79Å; W840-M867 HydrophobicContact CZ3-CG 3.86Å; W840-L868 HydrophobicContact CB-CB 4.38Å; W840-Y871 AromaticContact CD1-CD2 3.41Å; W840-Y871 VanDerWaalsContact CD1-CD2 3.41Å; W840-Y871 AromaticContact CD1-CE2 3.39Å; W840-Y871 HydrophobicContact CG-CD2 4.03Å; W840-Y871 HydrophobicContact CG-CE2 4.21Å; W840-Y871 AromaticContact NE1-CD2 3.88Å; W840-Y871 AromaticContact NE1-CE2 3.33Å; W840-Y871 VanDerWaalsContact NE1-CE2 3.33Å
841	K	83.4	Confident	83.6	Confident	112 Å²	112	71.2 Å²	71.2	49%	0.487	35%	0.354	S	S	.	.	H	α-helix	trans	-58.6	-46.2	165.9	-177.9	177.1	175.3	-176.1	0	110.5	T837 H843 Y844 D845 L868	T837-K841 VanDerWaalsContact O-CB 3.25Å; T837-K841 WeakPolarHBondContact O-CB 3.18Å; T837-K841 PolarHBondContact O-N 3.26Å; K841-H843 PolarHBondContact O-N 3.14Å; K841-Y844 WeakPolarHBondContact O-CB 3.49Å; K841-Y844 PolarHBondContact O-N 3.47Å; K841-D845 VanDerWaalsContact CE-OD2 3.3Å; K841-D845 WeakPolarHBondContact CE-OD2 3.24Å; K841-D845 WeakPolarHBondContact O-CB 3.4Å; K841-D845 VanDerWaalsContact O-CG 3.23Å; K841-D845 PolarHBondContact O-N 2.7Å; K841-L868 HydrophobicContact CB-CD1 3.82Å; K841-L868 HydrophobicContact CB-CD2 4.32Å
842	R	81.9	Confident	83.3	Confident	164 Å²	164	72.8 Å²	72.8	62%	0.619	38%	0.376	S	S	*	.	H	α-helix	trans	-61.5	-43	175.7	178	178.7	175	162.9	8.4	112.1	K838 T839 W840 Y844 D845 D846	K838-R842 PolarHBondContact O-N 3.2Å; T839-R842 WeakPolarHBondContact O-CB 3.4Å; T839-R842 PolarHBondContact O-N 3.37Å; W840-R842 VanDerWaalsContact C-N 3.3Å; W840-R842 PolarHBondContact O-N 2.87Å; R842-Y844 VanDerWaalsContact C-N 3.28Å; R842-Y844 PolarHBondContact O-N 3.3Å; R842-D845 PolarHBondContact O-N 3.24Å; R842-D846 VanDerWaalsContact CG-OD2 3.3Å; R842-D846 WeakPolarHBondContact CG-OD2 3.38Å; R842-D846 IonicContact CZ-OD2 2.67Å; R842-D846 IonicContact NE-OD2 3.98Å; R842-D846 PolarHBondContact NE-OD2 3.09Å; R842-D846 IonicContact NH2-OD2 2.7Å; R842-D846 VanDerWaalsContact O-CB 3.26Å; R842-D846 WeakPolarHBondContact O-CB 3.38Å; R842-D846 PolarHBondContact O-N 3.03Å
843	H	85.4	Confident	83.2	Confident	93 Å²	93	69.4 Å²	69.4	43%	0.431	38%	0.375	S	S	.	.	H	α-helix	trans	-61.4	-37.4	175.3	-72	-61.3	0	0	0	112.4	T839 W840 K841 A847 A864	T839-H843 PolarHBondContact O-CD2 3.02Å; T839-H843 PolarHBondContact O-N 2.96Å; W840-H843 HydrophobicContact CE3-CB 4.17Å; W840-H843 PolarHBondContact O-N 3.48Å; K841-H843 PolarHBondContact O-N 3.14Å; H843-A847 WeakPolarHBondContact O-CB 3.08Å; H843-A847 PolarHBondContact O-N 3.26Å; H843-A864 HydrophobicContact CB-CB 4.36Å
844	Y	85.8	Confident	82.8	Confident	72 Å²	72	71.1 Å²	71.1	28%	0.282	40%	0.402	S	S	.	.	H	α-helix	trans	-66.3	-46.3	173.2	174.5	-96.5	0	0	0	112.1	W840 K841 R842 A847 C848 V861 N865 L868	W840-Y844 WeakPolarHBondContact O-CB 3.18Å; W840-Y844 PolarHBondContact O-N 3.16Å; K841-Y844 WeakPolarHBondContact O-CB 3.49Å; K841-Y844 PolarHBondContact O-N 3.47Å; R842-Y844 VanDerWaalsContact C-N 3.28Å; R842-Y844 PolarHBondContact O-N 3.3Å; Y844-A847 PolarHBondContact O-N 3.32Å; Y844-C848 VanDerWaalsContact CZ-SG 3.53Å; Y844-C848 WeakPolarHBondContact O-CB 3.47Å; Y844-C848 PolarHBondContact O-N 3.33Å; Y844-C848 PolarHBondContact O-SG 3.09Å; Y844-V861 HydrophobicContact CD2-CG1 4.28Å; Y844-V861 HydrophobicContact CE2-CG1 3.89Å; Y844-N865 HydrophobicContact CD2-CB 3.74Å; Y844-N865 HydrophobicContact CE2-CB 3.77Å; Y844-L868 HydrophobicContact CG-CD2 4.49Å
845	D	84.8	Confident	82.6	Confident	75 Å²	75	73.8 Å²	73.8	40%	0.401	42%	0.424	S	S	.	.	H	α-helix	trans	-62.9	-46	177.5	-65.7	-24.2	0	0	0	110.9	K841 R842 C848 A849	K841-D845 VanDerWaalsContact CE-OD2 3.3Å; K841-D845 WeakPolarHBondContact CE-OD2 3.24Å; K841-D845 WeakPolarHBondContact O-CB 3.4Å; K841-D845 VanDerWaalsContact O-CG 3.23Å; K841-D845 PolarHBondContact O-N 2.7Å; R842-D845 PolarHBondContact O-N 3.24Å; D845-C848 PolarHBondContact O-N 2.86Å; D845-A849 WeakPolarHBondContact O-CB 3.49Å; D845-A849 PolarHBondContact O-N 2.8Å
846	D	84.2	Confident	82.1	Confident	79 Å²	79	73.5 Å²	73.5	42%	0.422	42%	0.421	S	S	.	.	H	α-helix	trans	-64.9	-37.9	176.6	-74.9	-27.1	0	0	0	111.2	R842 A850	R842-D846 VanDerWaalsContact CG-OD2 3.3Å; R842-D846 WeakPolarHBondContact CG-OD2 3.38Å; R842-D846 IonicContact CZ-OD2 2.67Å; R842-D846 IonicContact NE-OD2 3.98Å; R842-D846 PolarHBondContact NE-OD2 3.09Å; R842-D846 IonicContact NH2-OD2 2.7Å; R842-D846 VanDerWaalsContact O-CB 3.26Å; R842-D846 WeakPolarHBondContact O-CB 3.38Å; R842-D846 PolarHBondContact O-N 3.03Å; D846-A850 WeakPolarHBondContact O-CB 3.45Å; D846-A850 PolarHBondContact O-N 3.22Å
847	A	83.9	Confident	81.8	Confident	16 Å²	16	75.7 Å²	75.7	13%	0.132	43%	0.433	C	S	.	.	H	α-helix	trans	-73.1	-37.5	176.1	0	0	0	0	0	112.8	H843 Y844 A850 L851 V861	H843-A847 WeakPolarHBondContact O-CB 3.08Å; H843-A847 PolarHBondContact O-N 3.26Å; Y844-A847 PolarHBondContact O-N 3.32Å; A847-A850 PolarHBondContact O-N 2.57Å; A847-L851 WeakPolarHBondContact O-CB 3.32Å; A847-L851 PolarHBondContact O-N 3.47Å; A847-V861 HydrophobicContact CB-CG2 3.76Å
848	C	81.7	Confident	81.3	Confident	39 Å²	39	77.5 Å²	77.5	26%	0.264	45%	0.447	S	S	.	.	H	α-helix	trans	-65.3	-39.9	172.1	-70.5	0	0	0	0	111.2	Y844 D845 L851 S852	Y844-C848 VanDerWaalsContact CZ-SG 3.53Å; Y844-C848 WeakPolarHBondContact O-CB 3.47Å; Y844-C848 PolarHBondContact O-N 3.33Å; Y844-C848 PolarHBondContact O-SG 3.09Å; D845-C848 PolarHBondContact O-N 2.86Å; C848-L851 PolarHBondContact O-N 3.2Å; C848-S852 WeakPolarHBondContact O-CB 3.4Å; C848-S852 PolarHBondContact O-N 3.4Å; C848-S852 PolarHBondContact O-OG 2.96Å
849	A	81.2	Confident	81	Confident	53 Å²	53	75.1 Å²	75.1	44%	0.438	44%	0.441	S	S	.	.	H	α-helix	trans	-59.7	-48.3	172.2	0	0	0	0	0	111	D845 L851 S852 A853	D845-A849 WeakPolarHBondContact O-CB 3.49Å; D845-A849 PolarHBondContact O-N 2.8Å; A849-L851 PolarHBondContact O-N 3.5Å; A849-S852 PolarHBondContact O-N 2.93Å; A849-S852 PolarHBondContact O-OG 3.26Å; A849-A853 WeakPolarHBondContact O-CB 3.46Å; A849-A853 PolarHBondContact O-N 3.49Å
850	A	82.1	Confident	80.7	Confident	28 Å²	28	73.8 Å²	73.8	23%	0.231	44%	0.437	C	S	.	.	H	α-helix	trans	-60.4	-43.5	175.6	0	0	0	0	0	112.8	D846 A847 A853 G854 T855 G856	D846-A850 WeakPolarHBondContact O-CB 3.45Å; D846-A850 PolarHBondContact O-N 3.22Å; A847-A850 PolarHBondContact O-N 2.57Å; A850-A853 CarbonylContact O-C 3.56Å; A850-A853 PolarHBondContact O-N 2.87Å; A850-G854 PolarHBondContact O-N 3.29Å; A850-G854 VanDerWaalsContact O-N 3.13Å; A850-T855 PolarHBondContact O-N 3.3Å; A850-T855 PolarHBondContact O-OG1 3.06Å; A850-G856 VanDerWaalsContact C-N 3.29Å; A850-G856 PolarHBondContact O-N 2.82Å
851	L	77.3	Confident	80.4	Confident	80 Å²	80	72.1 Å²	72.1	42%	0.419	43%	0.432	S	S	.	.	H	α-helix	trans	-62.2	-44.7	176.8	-172.9	69.4	0	0	0	111.3	A847 C848 A849 A853 G854 G856 V861	A847-L851 WeakPolarHBondContact O-CB 3.32Å; A847-L851 PolarHBondContact O-N 3.47Å; C848-L851 PolarHBondContact O-N 3.2Å; A849-L851 PolarHBondContact O-N 3.5Å; L851-A853 VanDerWaalsContact C-N 3.27Å; L851-A853 PolarHBondContact O-N 2.93Å; L851-G854 PolarHBondContact O-N 3.05Å; L851-G856 WeakPolarHBondContact CD1-O 3.35Å; L851-V861 HydrophobicContact CB-CG2 4.25Å; L851-V861 HydrophobicContact CD2-CG2 4.16Å
852	S	78.6	Confident	79.9	Confident	110 Å²	110	73.5 Å²	73.5	77%	0.769	44%	0.438	S	S	*	.	H	α-helix	trans	-67.7	-24.6	176.3	72.2	0	0	0	0	113.8	C848 A849 G854	C848-S852 WeakPolarHBondContact O-CB 3.4Å; C848-S852 PolarHBondContact O-N 3.4Å; C848-S852 PolarHBondContact O-OG 2.96Å; A849-S852 PolarHBondContact O-N 2.93Å; A849-S852 PolarHBondContact O-OG 3.26Å; S852-G854 VanDerWaalsContact C-N 3.31Å
853	A	82.4	Confident	79.8	Confident	72 Å²	72	71.4 Å²	71.4	60%	0.595	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-0.6	171	0	0	0	0	0	113.5	A849 A850 L851 T855	A849-A853 WeakPolarHBondContact O-CB 3.46Å; A849-A853 PolarHBondContact O-N 3.49Å; A850-A853 CarbonylContact O-C 3.56Å; A850-A853 PolarHBondContact O-N 2.87Å; L851-A853 VanDerWaalsContact C-N 3.27Å; L851-A853 PolarHBondContact O-N 2.93Å; A853-T855 VanDerWaalsContact C-N 3.34Å
854	G	78.1	Confident	79.6	Confident	71 Å²	71	67.2 Å²	67.2	73%	0.732	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	15.8	-179	0	0	0	0	0	115.1	A850 L851 S852	A850-G854 PolarHBondContact O-N 3.29Å; A850-G854 VanDerWaalsContact O-N 3.13Å; L851-G854 PolarHBondContact O-N 3.05Å; S852-G854 VanDerWaalsContact C-N 3.31Å
855	T	78.8	Confident	79.2	Confident	117 Å²	117	67.1 Å²	67.1	72%	0.718	42%	0.422	S	S	*	.			trans	-118.1	-5.7	-176.3	57.8	0	0	0	0	114.6	A850 A853	A850-T855 PolarHBondContact O-N 3.3Å; A850-T855 PolarHBondContact O-OG1 3.06Å; A853-T855 VanDerWaalsContact C-N 3.34Å
856	G	71.4	Confident	78.8	Confident	26 Å²	26	66.4 Å²	66.4	27%	0.268	43%	0.426	S	S	.	.	S	Bend	trans	-96.1	148.1	-179.3	0	0	0	0	0	114.3	A850 L851	A850-G856 VanDerWaalsContact C-N 3.29Å; A850-G856 PolarHBondContact O-N 2.82Å; L851-G856 WeakPolarHBondContact CD1-O 3.35Å
857	D	80.3	Confident	78.7	Confident	89 Å²	89	64.1 Å²	64.1	48%	0.476	41%	0.413	S	S	.	.			trans	-80.6	134.9	169.2	-175.2	-1.7	0	0	0	110.5	N859 A860 V861	D857-N859 PolarHBondContact O-N 3.16Å; D857-N859 PolarHBondContact OD1-N 3.42Å; D857-N859 PolarHBondContact OD1-ND2 2.94Å; D857-N859 VanDerWaalsContact OD1-ND2 3.14Å; D857-N859 PolarHBondContact OD2-ND2 3.04Å; D857-A860 HydrophobicContact CB-CB 4.31Å; D857-A860 PolarHBondContact O-N 2.91Å; D857-V861 PolarHBondContact O-N 3.34Å
858	S	75	Confident	78.6	Confident	59 Å²	59	64.8 Å²	64.8	41%	0.413	41%	0.414	S	S	.	.	H	α-helix	trans	-62.6	-28.4	172.5	-177.3	0	0	0	0	112.7	V861 K862	S858-V861 PolarHBondContact O-N 2.9Å; S858-K862 WeakPolarHBondContact O-CG 3.45Å; S858-K862 PolarHBondContact O-N 2.87Å
859	N	75.7	Confident	78.5	Confident	99 Å²	99	64.9 Å²	64.9	53%	0.529	41%	0.413	S	S	.	.	H	α-helix	trans	-68.6	-42.1	177.2	-58.8	-48.7	0	0	0	111.2	D857 V861 K862 E863	D857-N859 PolarHBondContact O-N 3.16Å; D857-N859 PolarHBondContact OD1-N 3.42Å; D857-N859 PolarHBondContact OD1-ND2 2.94Å; D857-N859 VanDerWaalsContact OD1-ND2 3.14Å; D857-N859 PolarHBondContact OD2-ND2 3.04Å; N859-V861 VanDerWaalsContact C-N 3.28Å; N859-V861 PolarHBondContact O-N 3.22Å; N859-K862 WeakPolarHBondContact O-CB 3.45Å; N859-K862 PolarHBondContact O-N 3.38Å; N859-K862 VanDerWaalsContact O-N 3.09Å; N859-E863 WeakPolarHBondContact O-CB 3.39Å; N859-E863 PolarHBondContact O-N 3.42Å
860	A	78	Confident	78.5	Confident	41 Å²	41	62.7 Å²	62.7	34%	0.339	40%	0.395	S	S	.	.	H	α-helix	trans	-61.3	-35.3	176.6	0	0	0	0	0	112.4	D857 A864	D857-A860 HydrophobicContact CB-CB 4.31Å; D857-A860 PolarHBondContact O-N 2.91Å; A860-A864 WeakPolarHBondContact O-CB 3.44Å; A860-A864 PolarHBondContact O-N 3.44Å
861	V	78.1	Confident	78.7	Confident	19 Å²	19	62.7 Å²	62.7	12%	0.115	39%	0.389	C	S	.	.	H	α-helix	trans	-66.8	-42	173	176.4	0	0	0	0	111.6	Y844 A847 L851 D857 S858 N859 N865	Y844-V861 HydrophobicContact CD2-CG1 4.28Å; Y844-V861 HydrophobicContact CE2-CG1 3.89Å; A847-V861 HydrophobicContact CB-CG2 3.76Å; L851-V861 HydrophobicContact CB-CG2 4.25Å; L851-V861 HydrophobicContact CD2-CG2 4.16Å; D857-V861 PolarHBondContact O-N 3.34Å; S858-V861 PolarHBondContact O-N 2.9Å; N859-V861 VanDerWaalsContact C-N 3.28Å; N859-V861 PolarHBondContact O-N 3.22Å; V861-N865 VanDerWaalsContact O-CB 3.32Å; V861-N865 WeakPolarHBondContact O-CB 3.32Å; V861-N865 PolarHBondContact O-N 2.82Å
862	K	73.8	Confident	78.9	Confident	141 Å²	141	61.9 Å²	61.9	61%	0.613	39%	0.385	S	S	*	.	H	α-helix	trans	-64.1	-48.3	176	-72.6	179.7	177.6	-175.7	0	111.8	S858 N859 N865 A866	S858-K862 WeakPolarHBondContact O-CG 3.45Å; S858-K862 PolarHBondContact O-N 2.87Å; N859-K862 WeakPolarHBondContact O-CB 3.45Å; N859-K862 PolarHBondContact O-N 3.38Å; N859-K862 VanDerWaalsContact O-N 3.09Å; K862-N865 PolarHBondContact O-N 3.18Å; K862-A866 WeakPolarHBondContact O-CB 3.45Å; K862-A866 PolarHBondContact O-N 2.93Å
863	E	79	Confident	79.1	Confident	121 Å²	121	57.1 Å²	57.1	57%	0.565	35%	0.351	S	S	*	.	H	α-helix	trans	-59.6	-50.2	177.8	-174.9	-174.9	175.5	0	0	111.1	N859 N865 A866 M867	N859-E863 WeakPolarHBondContact O-CB 3.39Å; N859-E863 PolarHBondContact O-N 3.42Å; E863-N865 VanDerWaalsContact C-N 3.28Å; E863-N865 PolarHBondContact O-N 3.11Å; E863-A866 PolarHBondContact O-N 3.45Å; E863-M867 WeakPolarHBondContact O-CG 3.26Å; E863-M867 PolarHBondContact O-N 2.91Å
864	A	80.5	Confident	79.2	Confident	4 Å²	4	54.5 Å²	54.5	3%	0.033	33%	0.327	C	S	.	.	H	α-helix	trans	-62.1	-35.7	179.5	0	0	0	0	0	112.8	W840 H843 A860 L868	W840-A864 HydrophobicContact CE3-CB 4.15Å; W840-A864 HydrophobicContact CZ3-CB 4.27Å; H843-A864 HydrophobicContact CB-CB 4.36Å; A860-A864 WeakPolarHBondContact O-CB 3.44Å; A860-A864 PolarHBondContact O-N 3.44Å; A864-L868 WeakPolarHBondContact O-CB 3.42Å; A864-L868 PolarHBondContact O-N 3.25Å
865	N	79.2	Confident	79.6	Confident	71 Å²	71	52.2 Å²	52.2	38%	0.38	30%	0.297	S	S	.	.	H	α-helix	trans	-68.6	-43.4	173.9	-172.9	46.5	0	0	0	112.4	Y844 V861 K862 E863 L868 V869	Y844-N865 HydrophobicContact CD2-CB 3.74Å; Y844-N865 HydrophobicContact CE2-CB 3.77Å; V861-N865 VanDerWaalsContact O-CB 3.32Å; V861-N865 WeakPolarHBondContact O-CB 3.32Å; V861-N865 PolarHBondContact O-N 2.82Å; K862-N865 PolarHBondContact O-N 3.18Å; E863-N865 VanDerWaalsContact C-N 3.28Å; E863-N865 PolarHBondContact O-N 3.11Å; N865-L868 WeakPolarHBondContact O-CB 3.26Å; N865-L868 PolarHBondContact O-N 2.98Å; N865-V869 WeakPolarHBondContact O-CG2 3.37Å; N865-V869 PolarHBondContact O-N 3.19Å
866	A	75.2	Confident	79.9	Confident	60 Å²	60	49.1 Å²	49.1	50%	0.496	28%	0.276	S	S	.	.	H	α-helix	trans	-61.8	-46.6	177.2	0	0	0	0	0	111.4	K862 E863 L868 V869 L870	K862-A866 WeakPolarHBondContact O-CB 3.45Å; K862-A866 PolarHBondContact O-N 2.93Å; E863-A866 PolarHBondContact O-N 3.45Å; A866-L868 VanDerWaalsContact C-N 3.33Å; A866-L868 PolarHBondContact O-N 3.47Å; A866-V869 PolarHBondContact O-N 2.79Å; A866-L870 WeakPolarHBondContact O-CB 3.35Å; A866-L870 PolarHBondContact O-N 3.37Å
867	M	82.3	Confident	80.5	Confident	30 Å²	30	47.9 Å²	47.9	15%	0.148	26%	0.264	C	S	.	.	H	α-helix	trans	-66.1	-33.7	176.6	-64.5	-56.6	-65	0	0	112.5	W840 E863 L870 Y871	W840-M867 HydrophobicContact CD2-CB 3.57Å; W840-M867 HydrophobicContact CD2-CG 4.38Å; W840-M867 HydrophobicContact CE3-CB 3.53Å; W840-M867 HydrophobicContact CE3-CG 4.15Å; W840-M867 HydrophobicContact CG-CB 4.1Å; W840-M867 HydrophobicContact CH2-CB 4.09Å; W840-M867 HydrophobicContact CH2-CG 3.82Å; W840-M867 HydrophobicContact CZ2-CB 4.16Å; W840-M867 HydrophobicContact CZ2-CE 4.34Å; W840-M867 HydrophobicContact CZ2-CG 4.09Å; W840-M867 HydrophobicContact CZ3-CB 3.79Å; W840-M867 HydrophobicContact CZ3-CG 3.86Å; E863-M867 WeakPolarHBondContact O-CG 3.26Å; E863-M867 PolarHBondContact O-N 2.91Å; M867-L870 HydrophobicContact CE-CD2 3.79Å; M867-L870 HydrophobicContact SD-CD2 3.82Å; M867-Y871 HydrophobicContact CB-CE2 4.49Å; M867-Y871 HydrophobicContact CE-CE2 3.57Å; M867-Y871 WeakPolarHBondContact O-CD2 3.38Å; M867-Y871 PolarHBondContact O-N 3.17Å
868	L	81.6	Confident	80.8	Confident	30 Å²	30	43.9 Å²	43.9	16%	0.157	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-48.9	171.9	172.4	59.6	0	0	0	112	T837 W840 K841 Y844 A864 N865 A866 L870 Y871 D872	T837-L868 HydrophobicContact CG2-CD1 3.8Å; T837-L868 WeakPolarHBondContact O-CD1 3.49Å; W840-L868 HydrophobicContact CB-CB 4.38Å; K841-L868 HydrophobicContact CB-CD1 3.82Å; K841-L868 HydrophobicContact CB-CD2 4.32Å; Y844-L868 HydrophobicContact CG-CD2 4.49Å; A864-L868 WeakPolarHBondContact O-CB 3.42Å; A864-L868 PolarHBondContact O-N 3.25Å; N865-L868 WeakPolarHBondContact O-CB 3.26Å; N865-L868 PolarHBondContact O-N 2.98Å; A866-L868 VanDerWaalsContact C-N 3.33Å; A866-L868 PolarHBondContact O-N 3.47Å; L868-L870 VanDerWaalsContact C-N 3.34Å; L868-L870 PolarHBondContact O-N 3.36Å; L868-Y871 PolarHBondContact O-N 3Å; L868-D872 PolarHBondContact O-N 3.2Å
869	V	80.2	Confident	81.4	Confident	41 Å²	41	44.4 Å²	44.4	25%	0.248	24%	0.237	C	C	.	.	H	α-helix	trans	-63.6	-40	177.8	171.6	0	0	0	0	111.5	P511 N865 A866 S873	P511-V869 HydrophobicContact CB-CG1 4.06Å; P511-V869 HydrophobicContact CG-CG1 4.03Å; N865-V869 WeakPolarHBondContact O-CG2 3.37Å; N865-V869 PolarHBondContact O-N 3.19Å; A866-V869 PolarHBondContact O-N 2.79Å; V869-S873 VanDerWaalsContact O-CB 3.26Å; V869-S873 WeakPolarHBondContact O-CB 3.34Å; V869-S873 PolarHBondContact O-N 3.16Å; V869-S873 PolarHBondContact O-OG 2.65Å
870	L	80.9	Confident	81.8	Confident	8 Å²	8	40.2 Å²	40.2	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-58.7	-52.4	174.2	169	63	0	0	0	111.9	V289 W291 A866 M867 L868 S873 L874	V289-L870 HydrophobicContact CG1-CD2 4.18Å; W291-L870 HydrophobicContact CH2-CB 4.06Å; W291-L870 HydrophobicContact CH2-CD1 3.63Å; W291-L870 HydrophobicContact CH2-CG 4.45Å; W291-L870 HydrophobicContact CZ2-CD1 3.29Å; W291-L870 HydrophobicContact CZ3-CD1 4.49Å; A866-L870 WeakPolarHBondContact O-CB 3.35Å; A866-L870 PolarHBondContact O-N 3.37Å; M867-L870 HydrophobicContact CE-CD2 3.79Å; M867-L870 HydrophobicContact SD-CD2 3.82Å; L868-L870 VanDerWaalsContact C-N 3.34Å; L868-L870 PolarHBondContact O-N 3.36Å; L870-S873 PolarHBondContact O-N 3.05Å; L870-L874 HydrophobicContact CD1-CD1 3.74Å; L870-L874 HydrophobicContact CD1-CG 4.25Å; L870-L874 HydrophobicContact CG-CD1 4.02Å; L870-L874 WeakPolarHBondContact O-CB 3.32Å; L870-L874 WeakPolarHBondContact O-CG 3.27Å; L870-L874 PolarHBondContact O-N 2.91Å
871	Y	85.5	Confident	82.2	Confident	28 Å²	28	38.3 Å²	38.3	11%	0.11	20%	0.199	C	C	.	.	H	α-helix	trans	-72.7	-31.7	-177.5	-70.4	-52.8	0	0	0	113.9	F833 L836 T837 W840 M867 L868 L874 Q875	F833-Y871 AromaticContact CD1-CD1 3.7Å; F833-Y871 HydrophobicContact CD1-CD1 3.7Å; F833-Y871 HydrophobicContact CD1-CE1 4.12Å; F833-Y871 HydrophobicContact CE1-CD1 4.18Å; F833-Y871 HydrophobicContact CE1-CE1 4.19Å; L836-Y871 HydrophobicContact CB-CD1 4.09Å; L836-Y871 HydrophobicContact CB-CD2 3.94Å; L836-Y871 HydrophobicContact CB-CE1 4.45Å; L836-Y871 HydrophobicContact CB-CE2 4.29Å; L836-Y871 HydrophobicContact CB-CG 3.83Å; L836-Y871 HydrophobicContact CD1-CD1 4.06Å; L836-Y871 HydrophobicContact CD1-CE1 3.77Å; T837-Y871 VanDerWaalsContact OG1-C 3.23Å; T837-Y871 PolarHBondContact OG1-O 3.27Å; W840-Y871 AromaticContact CD1-CD2 3.41Å; W840-Y871 VanDerWaalsContact CD1-CD2 3.41Å; W840-Y871 AromaticContact CD1-CE2 3.39Å; W840-Y871 HydrophobicContact CG-CD2 4.03Å; W840-Y871 HydrophobicContact CG-CE2 4.21Å; W840-Y871 AromaticContact NE1-CD2 3.88Å; W840-Y871 AromaticContact NE1-CE2 3.33Å; W840-Y871 VanDerWaalsContact NE1-CE2 3.33Å; M867-Y871 HydrophobicContact CB-CE2 4.49Å; M867-Y871 HydrophobicContact CE-CE2 3.57Å; M867-Y871 WeakPolarHBondContact O-CD2 3.38Å; M867-Y871 PolarHBondContact O-N 3.17Å; L868-Y871 PolarHBondContact O-N 3Å; Y871-L874 HydrophobicContact CD1-CD1 3.85Å; Y871-L874 HydrophobicContact CE1-CD1 4.19Å; Y871-L874 PolarHBondContact O-N 2.63Å; Y871-Q875 PolarHBondContact O-N 2.96Å
872	D	83.5	Confident	82.6	Confident	63 Å²	63	37.4 Å²	37.4	34%	0.337	19%	0.194	S	C	.	.	H	α-helix	trans	-65.9	-43.9	171.4	-167.4	44.3	0	0	0	110.7	T837 L868 L874 Q875 L876	T837-D872 HydrophobicContact CG2-CB 3.89Å; T837-D872 PolarHBondContact OG1-N 3.33Å; L868-D872 PolarHBondContact O-N 3.2Å; D872-L874 VanDerWaalsContact C-N 3.34Å; D872-L874 PolarHBondContact O-N 2.88Å; D872-Q875 WeakPolarHBondContact O-CG 3.47Å; D872-Q875 PolarHBondContact O-N 3.49Å; D872-Q875 PolarHBondContact OD1-NE2 2.68Å; D872-L876 WeakPolarHBondContact O-CB 3.47Å; D872-L876 VanDerWaalsContact O-CG 3.25Å; D872-L876 WeakPolarHBondContact O-CG 3.43Å; D872-L876 PolarHBondContact O-N 2.95Å
873	S	81.4	Confident	82.9	Confident	9 Å²	9	34 Å²	34	6%	0.063	18%	0.182	C	C	.	.	H	α-helix	trans	-63.3	-38.8	177.1	-58.8	0	0	0	0	112.2	P511 V869 L870 L876 A877	P511-S873 WeakPolarHBondContact CB-OG 3.43Å; P511-S873 WeakPolarHBondContact O-CB 3.41Å; V869-S873 VanDerWaalsContact O-CB 3.26Å; V869-S873 WeakPolarHBondContact O-CB 3.34Å; V869-S873 PolarHBondContact O-N 3.16Å; V869-S873 PolarHBondContact O-OG 2.65Å; L870-S873 PolarHBondContact O-N 3.05Å; S873-L876 PolarHBondContact O-N 3.43Å; S873-A877 VanDerWaalsContact O-CB 3.27Å; S873-A877 WeakPolarHBondContact O-CB 3.38Å; S873-A877 PolarHBondContact O-N 3.4Å
874	L	84.6	Confident	83.2	Confident	17 Å²	17	29 Å²	29	9%	0.089	16%	0.161	C	C	.	.	H	α-helix	trans	-64	-42.5	172.9	-76.6	164.2	0	0	0	112.8	A515 F833 L870 Y871 D872 H878	A515-L874 HydrophobicContact CB-CD2 3.87Å; A515-L874 HydrophobicContact CB-CG 4.18Å; F833-L874 HydrophobicContact CB-CB 4.39Å; F833-L874 HydrophobicContact CD1-CB 4.15Å; F833-L874 HydrophobicContact CD1-CD1 4.22Å; F833-L874 HydrophobicContact CD2-CB 4.08Å; F833-L874 HydrophobicContact CE1-CB 4.45Å; F833-L874 HydrophobicContact CE1-CD1 3.97Å; F833-L874 HydrophobicContact CE2-CB 4.41Å; F833-L874 HydrophobicContact CG-CB 3.96Å; F833-L874 HydrophobicContact CZ-CD1 4.39Å; L870-L874 HydrophobicContact CD1-CD1 3.74Å; L870-L874 HydrophobicContact CD1-CG 4.25Å; L870-L874 HydrophobicContact CG-CD1 4.02Å; L870-L874 WeakPolarHBondContact O-CB 3.32Å; L870-L874 WeakPolarHBondContact O-CG 3.27Å; L870-L874 PolarHBondContact O-N 2.91Å; Y871-L874 HydrophobicContact CD1-CD1 3.85Å; Y871-L874 HydrophobicContact CE1-CD1 4.19Å; Y871-L874 PolarHBondContact O-N 2.63Å; D872-L874 VanDerWaalsContact C-N 3.34Å; D872-L874 PolarHBondContact O-N 2.88Å; L874-H878 PolarHBondContact O-N 2.97Å; L874-H878 VanDerWaalsContact O-N 3.07Å; L874-H878 PolarHBondContact O-ND1 2.74Å
875	Q	87.7	Confident	83.7	Confident	23 Å²	23	28.9 Å²	28.9	11%	0.107	16%	0.159	C	C	.	.	H	α-helix	trans	-71.7	-32.7	177	77	78.2	21.5	0	0	112.5	R830 F833 Y871 D872 K879	R830-Q875 HydrophobicContact CG-CB 4.35Å; F833-Q875 HydrophobicContact CB-CB 3.68Å; Y871-Q875 PolarHBondContact O-N 2.96Å; D872-Q875 WeakPolarHBondContact O-CG 3.47Å; D872-Q875 PolarHBondContact O-N 3.49Å; D872-Q875 PolarHBondContact OD1-NE2 2.68Å; Q875-K879 WeakPolarHBondContact O-CB 3.44Å; Q875-K879 PolarHBondContact O-N 3.05Å
876	L	83.8	Confident	84.1	Confident	53 Å²	53	28.1 Å²	28.1	28%	0.277	15%	0.152	S	C	.	.	H	α-helix	trans	-68.1	-43.9	173	-70.1	175.1	0	0	0	112.2	F512 D872 S873 H878 K879 C880	F512-L876 HydrophobicContact CD2-CB 4.06Å; F512-L876 HydrophobicContact CE2-CB 3.93Å; D872-L876 WeakPolarHBondContact O-CB 3.47Å; D872-L876 VanDerWaalsContact O-CG 3.25Å; D872-L876 WeakPolarHBondContact O-CG 3.43Å; D872-L876 PolarHBondContact O-N 2.95Å; S873-L876 PolarHBondContact O-N 3.43Å; L876-H878 PolarHBondContact O-N 2.76Å; L876-K879 WeakPolarHBondContact O-CB 3.36Å; L876-K879 PolarHBondContact O-N 3.31Å; L876-K879 VanDerWaalsContact O-N 3.12Å; L876-C880 PolarHBondContact O-N 3.26Å
877	A	84.2	Confident	84.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-57.9	-47.9	174	0	0	0	0	0	111.1	F512 A515 L516 S873 K879 C880 I881	F512-A877 HydrophobicContact CE2-CB 4.49Å; A515-A877 HydrophobicContact CB-CB 4.03Å; L516-A877 HydrophobicContact CD2-CB 3.79Å; L516-A877 HydrophobicContact CG-CB 3.87Å; S873-A877 VanDerWaalsContact O-CB 3.27Å; S873-A877 WeakPolarHBondContact O-CB 3.38Å; S873-A877 PolarHBondContact O-N 3.4Å; A877-K879 PolarHBondContact O-N 3.37Å; A877-C880 PolarHBondContact O-N 3.27Å; A877-I881 PolarHBondContact O-N 2.99Å
878	H	87.8	Confident	85	Confident	5 Å²	5	25.1 Å²	25.1	2%	0.023	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-37.5	173.8	-74.4	71.4	0	0	0	112.2	I519 F826 R830 F833 L874 L876 C880 I881 L882	I519-H878 VanDerWaalsContact CD1-CE1 3.45Å; I519-H878 WeakPolarHBondContact CD1-CE1 3.33Å; F826-H878 AromaticContact CD1-CD2 3.74Å; F826-H878 AromaticContact CE1-CD2 3.87Å; R830-H878 HydrophobicContact CB-CB 3.83Å; R830-H878 HydrophobicContact CG-CB 4.18Å; F833-H878 AromaticContact CD2-CE1 3.91Å; F833-H878 AromaticContact CD2-ND1 3.9Å; F833-H878 AromaticContact CE2-CE1 3.43Å; F833-H878 VanDerWaalsContact CE2-CE1 3.43Å; F833-H878 WeakPolarHBondContact CE2-CE1 3.18Å; F833-H878 AromaticContact CE2-ND1 3.9Å; F833-H878 AromaticContact CE2-NE2 3.83Å; L874-H878 PolarHBondContact O-N 2.97Å; L874-H878 VanDerWaalsContact O-N 3.07Å; L874-H878 PolarHBondContact O-ND1 2.74Å; L876-H878 PolarHBondContact O-N 2.76Å; H878-C880 PolarHBondContact O-N 3.14Å; H878-I881 PolarHBondContact O-N 3.36Å; H878-L882 WeakPolarHBondContact O-CB 3.44Å; H878-L882 PolarHBondContact O-N 3.11Å
879	K	86.1	Confident	85.3	Confident	70 Å²	70	23.7 Å²	23.7	30%	0.304	13%	0.126	S	C	.	.	H	α-helix	trans	-61.6	-41	175.2	-170	-176.2	179.3	-176.4	0	111.9	Q875 L876 A877 L882 N883	Q875-K879 WeakPolarHBondContact O-CB 3.44Å; Q875-K879 PolarHBondContact O-N 3.05Å; L876-K879 WeakPolarHBondContact O-CB 3.36Å; L876-K879 PolarHBondContact O-N 3.31Å; L876-K879 VanDerWaalsContact O-N 3.12Å; A877-K879 PolarHBondContact O-N 3.37Å; K879-L882 PolarHBondContact O-N 3.24Å; K879-N883 WeakPolarHBondContact O-CB 3.43Å; K879-N883 PolarHBondContact O-N 2.7Å; K879-N883 PolarHBondContact O-OD1 3.27Å
880	C	84.2	Confident	85.4	Confident	11 Å²	11	25.2 Å²	25.2	7%	0.074	13%	0.132	C	C	.	.	H	α-helix	trans	-61.3	-46.7	179.1	-178.8	0	0	0	0	112.1	F512 L876 A877 H878 S884	F512-C880 HydrophobicContact CZ-CB 4.28Å; L876-C880 PolarHBondContact O-N 3.26Å; A877-C880 PolarHBondContact O-N 3.27Å; H878-C880 PolarHBondContact O-N 3.14Å; C880-S884 PolarHBondContact O-OG 2.86Å
881	I	86.3	Confident	85.4	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-70.9	-44.3	176.6	-54.5	-59.4	0	0	0	111.3	L516 L535 L539 F826 A877 H878 N883 S884 F885	L516-I881 HydrophobicContact CD2-CD1 4.11Å; L516-I881 HydrophobicContact CD2-CG1 3.97Å; L535-I881 HydrophobicContact CB-CD1 3.52Å; L535-I881 HydrophobicContact CD1-CD1 4.2Å; L539-I881 HydrophobicContact CD2-CG2 3.66Å; F826-I881 HydrophobicContact CD1-CB 4.21Å; F826-I881 HydrophobicContact CD1-CG2 4.14Å; F826-I881 HydrophobicContact CE1-CB 4.02Å; F826-I881 HydrophobicContact CE1-CG1 4.4Å; F826-I881 HydrophobicContact CE1-CG2 3.94Å; A877-I881 PolarHBondContact O-N 2.99Å; H878-I881 PolarHBondContact O-N 3.36Å; I881-N883 VanDerWaalsContact C-N 3.31Å; I881-N883 PolarHBondContact O-N 2.93Å; I881-S884 WeakPolarHBondContact O-CA 3.43Å; I881-S884 WeakPolarHBondContact O-CB 2.94Å; I881-S884 PolarHBondContact O-N 2.77Å; I881-F885 HydrophobicContact CG2-CE2 4.34Å; I881-F885 HydrophobicContact CG2-CZ 4.45Å
882	L	86.1	Confident	84.6	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-60.4	-38.2	-178.5	-174.2	67.6	0	0	0	112.7	P688 V823 F826 R827 H878 K879 S884 F885	P688-L882 HydrophobicContact CB-CD1 3.91Å; P688-L882 HydrophobicContact CB-CG 4.2Å; P688-L882 HydrophobicContact CG-CD1 3.82Å; P688-L882 HydrophobicContact CG-CD2 4.26Å; P688-L882 HydrophobicContact CG-CG 3.64Å; V823-L882 HydrophobicContact CG1-CD1 4.29Å; F826-L882 HydrophobicContact CB-CD1 4.26Å; R827-L882 HydrophobicContact CB-CD1 4.2Å; R827-L882 HydrophobicContact CB-CD2 4.29Å; H878-L882 WeakPolarHBondContact O-CB 3.44Å; H878-L882 PolarHBondContact O-N 3.11Å; K879-L882 PolarHBondContact O-N 3.24Å; L882-S884 PolarHBondContact O-N 3.06Å; L882-F885 HydrophobicContact CD1-CD2 4.33Å; L882-F885 HydrophobicContact CD1-CE2 4.22Å
883	N	80.4	Confident	84	Confident	69 Å²	69	31.8 Å²	31.8	37%	0.369	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-12	174.7	-75.8	25.3	0	0	0	113.2	K879 I881 Y886	K879-N883 WeakPolarHBondContact O-CB 3.43Å; K879-N883 PolarHBondContact O-N 2.7Å; K879-N883 PolarHBondContact O-OD1 3.27Å; I881-N883 VanDerWaalsContact C-N 3.31Å; I881-N883 PolarHBondContact O-N 2.93Å; N883-Y886 WeakPolarHBondContact O-CE1 3.21Å
884	S	86	Confident	84.1	Confident	16 Å²	16	31.3 Å²	31.3	11%	0.112	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-17.6	-174.6	-61.7	0	0	0	0	114.6	S532 C880 I881 L882 Y886 G887 Y888	S532-S884 VanDerWaalsContact CB-OG 3.3Å; S532-S884 WeakPolarHBondContact CB-OG 3.46Å; S532-S884 PolarHBondContact OG-OG 3Å; C880-S884 PolarHBondContact O-OG 2.86Å; I881-S884 WeakPolarHBondContact O-CA 3.43Å; I881-S884 WeakPolarHBondContact O-CB 2.94Å; I881-S884 PolarHBondContact O-N 2.77Å; L882-S884 PolarHBondContact O-N 3.06Å; S884-Y886 PolarHBondContact O-N 3Å; S884-G887 PolarHBondContact O-N 3.19Å; S884-Y888 WeakPolarHBondContact O-CB 3.22Å; S884-Y888 PolarHBondContact O-N 3.47Å
885	F	91.3	Very high	84.3	Confident	1 Å²	1	31 Å²	31	0%	0.004	15%	0.152	C	C	.	.	H	α-helix	trans	-55.7	-51.3	-174.4	-77.6	-78.8	0	0	0	114.2	C536 L539 L540 I691 Y819 T822 V823 F826 I881 L882 G887 Y888 V889	C536-F885 VanDerWaalsContact SG-CD1 3.54Å; L539-F885 HydrophobicContact CD2-CE1 4.4Å; L539-F885 HydrophobicContact CD2-CZ 3.78Å; L540-F885 HydrophobicContact CD1-CD1 4.4Å; L540-F885 HydrophobicContact CD1-CE1 4.33Å; L540-F885 HydrophobicContact CD2-CE1 4.09Å; L540-F885 HydrophobicContact CG-CE1 4.18Å; I691-F885 HydrophobicContact CD1-CB 4.48Å; Y819-F885 HydrophobicContact CE2-CD1 4.48Å; Y819-F885 PolarHBondContact OH-O 3.35Å; T822-F885 HydrophobicContact CG2-CE1 4.09Å; T822-F885 HydrophobicContact CG2-CZ 3.98Å; V823-F885 HydrophobicContact CG2-CB 4.42Å; V823-F885 HydrophobicContact CG2-CD1 3.7Å; V823-F885 HydrophobicContact CG2-CD2 3.97Å; V823-F885 HydrophobicContact CG2-CE1 3.83Å; V823-F885 HydrophobicContact CG2-CE2 4.1Å; V823-F885 HydrophobicContact CG2-CG 3.78Å; V823-F885 HydrophobicContact CG2-CZ 4.04Å; F826-F885 HydrophobicContact CB-CE2 4.41Å; I881-F885 HydrophobicContact CG2-CE2 4.34Å; I881-F885 HydrophobicContact CG2-CZ 4.45Å; L882-F885 HydrophobicContact CD1-CD2 4.33Å; L882-F885 HydrophobicContact CD1-CE2 4.22Å; F885-G887 VanDerWaalsContact C-N 3.34Å; F885-G887 PolarHBondContact O-N 3.03Å; F885-Y888 WeakPolarHBondContact O-CB 3.43Å; F885-Y888 PolarHBondContact O-N 3.11Å; F885-V889 PolarHBondContact O-N 2.88Å
886	Y	87.7	Confident	84.4	Confident	55 Å²	55	30.6 Å²	30.6	22%	0.216	15%	0.15	C	C	.	.	H	α-helix	trans	-69.2	-31.8	-177.3	85.4	-76	0	0	0	112.7	Y687 N883 S884 V889 V905	Y687-Y886 AromaticContact CD2-CD1 3.69Å; Y687-Y886 HydrophobicContact CD2-CD1 3.69Å; Y687-Y886 HydrophobicContact CD2-CD2 4.39Å; Y687-Y886 AromaticContact CD2-CE1 3.34Å; Y687-Y886 HydrophobicContact CD2-CE1 3.34Å; Y687-Y886 HydrophobicContact CD2-CE2 4.08Å; Y687-Y886 HydrophobicContact CD2-CG 4.21Å; Y687-Y886 AromaticContact CD2-CZ 3.54Å; Y687-Y886 HydrophobicContact CE2-CD1 4.45Å; Y687-Y886 AromaticContact CE2-CE1 3.73Å; Y687-Y886 HydrophobicContact CE2-CE1 3.73Å; Y687-Y886 AromaticContact CE2-CE2 3.96Å; Y687-Y886 HydrophobicContact CE2-CE2 3.96Å; Y687-Y886 AromaticContact CE2-CZ 3.44Å; Y687-Y886 VanDerWaalsContact CE2-CZ 3.44Å; Y687-Y886 WeakPolarHBondContact CE2-OH 3.47Å; Y687-Y886 AromaticContact CG-CD1 3.94Å; Y687-Y886 HydrophobicContact CG-CD1 3.94Å; Y687-Y886 HydrophobicContact CG-CD2 4.33Å; Y687-Y886 HydrophobicContact CG-CE1 4.05Å; Y687-Y886 HydrophobicContact CG-CE2 4.41Å; Y687-Y886 HydrophobicContact CG-CG 4.09Å; N883-Y886 WeakPolarHBondContact O-CE1 3.21Å; S884-Y886 PolarHBondContact O-N 3Å; Y886-V889 WeakPolarHBondContact O-CG2 3.29Å; Y886-V905 HydrophobicContact CD2-CG1 4.36Å; Y886-V905 HydrophobicContact CG-CG1 4.33Å
887	G	85.7	Confident	84.6	Confident	25 Å²	25	31 Å²	31	26%	0.258	15%	0.148	S	C	.	.	H	α-helix	trans	-77.5	-23.5	174.5	0	0	0	0	0	113.4	S884 F885 M890	S884-G887 PolarHBondContact O-N 3.19Å; F885-G887 VanDerWaalsContact C-N 3.34Å; F885-G887 PolarHBondContact O-N 3.03Å; G887-M890 VanDerWaalsContact O-CG 3.3Å; G887-M890 WeakPolarHBondContact O-CG 3.5Å
888	Y	89.9	Confident	84.8	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-69.9	-45.7	175.5	164.8	-107.1	0	0	0	111.9	G533 C536 E537 L540 S884 F885 M890 R891 A894 R895 W896	G533-Y888 VanDerWaalsContact O-CD2 3.27Å; G533-Y888 WeakPolarHBondContact O-CD2 3.4Å; C536-Y888 HydrophobicContact CB-CG 4.41Å; E537-Y888 HydrophobicContact CB-CD2 4.45Å; E537-Y888 HydrophobicContact CB-CE2 3.65Å; E537-Y888 HydrophobicContact CG-CE2 4.18Å; L540-Y888 HydrophobicContact CD1-CD1 3.8Å; L540-Y888 HydrophobicContact CD1-CE1 3.49Å; L540-Y888 VanDerWaalsContact CD1-CE1 3.49Å; S884-Y888 WeakPolarHBondContact O-CB 3.22Å; S884-Y888 PolarHBondContact O-N 3.47Å; F885-Y888 WeakPolarHBondContact O-CB 3.43Å; F885-Y888 PolarHBondContact O-N 3.11Å; Y888-M890 PolarHBondContact O-N 3.4Å; Y888-R891 WeakPolarHBondContact O-CB 3.19Å; Y888-R891 PolarHBondContact O-N 3.41Å; Y888-A894 HydrophobicContact CD2-CB 4.07Å; Y888-A894 HydrophobicContact CE1-CB 4.25Å; Y888-A894 HydrophobicContact CE2-CB 3.44Å; Y888-A894 VanDerWaalsContact CE2-CB 3.44Å; Y888-R895 PolarHBondContact OH-N 3.18Å; Y888-R895 VanDerWaalsContact OH-N 3.08Å; Y888-W896 HydrophobicContact CE1-CB 4.42Å; Y888-W896 HydrophobicContact CE1-CE3 4.21Å
889	V	88.9	Confident	84.7	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.9	-18.8	-174.2	-57.9	0	0	0	0	114.3	P698 Y819 F885 Y886 W896 Y897 S898 M901 A902	P698-V889 HydrophobicContact CG-CB 4.28Å; P698-V889 HydrophobicContact CG-CG1 3.8Å; Y819-V889 HydrophobicContact CE2-CG1 4.07Å; Y819-V889 VanDerWaalsContact OH-CG1 3.31Å; Y819-V889 WeakPolarHBondContact OH-CG1 3.29Å; F885-V889 PolarHBondContact O-N 2.88Å; Y886-V889 WeakPolarHBondContact O-CG2 3.29Å; V889-W896 WeakPolarHBondContact CG1-O 3.15Å; V889-Y897 CarbonylContact O-C 3.56Å; V889-Y897 VanDerWaalsContact O-CA 3.31Å; V889-Y897 WeakPolarHBondContact O-CA 3.33Å; V889-Y897 VanDerWaalsContact O-CD2 3.31Å; V889-Y897 WeakPolarHBondContact O-CD2 3.48Å; V889-S898 PolarHBondContact O-N 2.85Å; V889-M901 HydrophobicContact CB-SD 4.42Å; V889-M901 HydrophobicContact CG1-CE 4.47Å; V889-M901 HydrophobicContact CG1-SD 4.11Å; V889-M901 HydrophobicContact CG2-CB 4.38Å; V889-M901 HydrophobicContact CG2-CE 4.48Å; V889-M901 HydrophobicContact CG2-CG 4.19Å; V889-M901 HydrophobicContact CG2-SD 4.01Å; V889-A902 HydrophobicContact CG2-CB 4.11Å
890	M	82.1	Confident	84.9	Confident	74 Å²	74	30.3 Å²	30.3	37%	0.365	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-3.1	171.4	68.3	168.2	-170.3	0	0	114.1	Y588 G887 Y888 R892 A902	Y588-M890 HydrophobicContact CE1-CB 4.33Å; Y588-M890 HydrophobicContact CE1-CG 4.49Å; Y588-M890 HydrophobicContact CE1-SD 3.53Å; Y588-M890 VanDerWaalsContact CE1-SD 3.53Å; Y588-M890 PolarHBondContact OH-SD 3.02Å; G887-M890 VanDerWaalsContact O-CG 3.3Å; G887-M890 WeakPolarHBondContact O-CG 3.5Å; Y888-M890 PolarHBondContact O-N 3.4Å; M890-R892 PolarHBondContact O-N 3.41Å; M890-A902 HydrophobicContact CB-CB 3.97Å
891	R	80	Confident	85.3	Confident	69 Å²	69	29.8 Å²	29.8	26%	0.26	14%	0.143	S	C	.	.			trans	-78.2	122.5	-174.3	-167.9	-174.9	-168.1	-168.1	5.6	109.8	P423 T534 Y888 G893 A894	P423-R891 PolarHBondContact O-NH2 2.9Å; T534-R891 PolarHBondContact OG1-NH1 3.04Å; T534-R891 PolarHBondContact OG1-NH2 3.43Å; Y888-R891 WeakPolarHBondContact O-CB 3.19Å; Y888-R891 PolarHBondContact O-N 3.41Å; R891-G893 PolarHBondContact O-N 3.49Å; R891-A894 HydrophobicContact CB-CB 4.37Å; R891-A894 VanDerWaalsContact O-CB 3.27Å; R891-A894 WeakPolarHBondContact O-CB 3.41Å; R891-A894 PolarHBondContact O-N 2.82Å
892	R	68.1	Low	85.5	Confident	144 Å²	144	29.8 Å²	29.8	54%	0.543	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49	-23.5	-178.2	-68.4	-175.3	178.3	-150.2	1.2	116.2	Q555 D557 M890	Q555-R892 CarbonylContact C-O 3.57Å; Q555-R892 VanDerWaalsContact C-O 3.22Å; Q555-R892 WeakPolarHBondContact CB-O 3.4Å; D557-R892 WeakPolarHBondContact OD1-CD 3.25Å; D557-R892 IonicContact OD1-NH1 2.86Å; D557-R892 IonicContact OD2-CZ 2.65Å; D557-R892 IonicContact OD2-NH1 3.32Å; D557-R892 PolarHBondContact OD2-NH1 2.95Å; M890-R892 PolarHBondContact O-N 3.41Å
893	G	71.4	Confident	85.8	Confident	23 Å²	23	29.8 Å²	29.8	24%	0.237	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	15.7	179.1	0	0	0	0	0	116	Q555 R891	Q555-G893 WeakPolarHBondContact O-CA 3.46Å; R891-G893 PolarHBondContact O-N 3.49Å
894	A	84.1	Confident	86.4	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.125	C	C	.	.			trans	-77.9	149.1	176.9	0	0	0	0	0	111.8	Q555 Y888 R891	Q555-A894 WeakPolarHBondContact CB-O 3.43Å; Q555-A894 PolarHBondContact N-O 2.78Å; Y888-A894 HydrophobicContact CD2-CB 4.07Å; Y888-A894 HydrophobicContact CE1-CB 4.25Å; Y888-A894 HydrophobicContact CE2-CB 3.44Å; Y888-A894 VanDerWaalsContact CE2-CB 3.44Å; R891-A894 HydrophobicContact CB-CB 4.37Å; R891-A894 VanDerWaalsContact O-CB 3.27Å; R891-A894 WeakPolarHBondContact O-CB 3.41Å; R891-A894 PolarHBondContact O-N 2.82Å
895	R	87.8	Confident	86.7	Confident	9 Å²	9	25.7 Å²	25.7	3%	0.034	12%	0.12	C	C	.	.	S	Bend	trans	-72.9	-42.8	169.3	-63.7	-173.3	-174.5	-73.8	-9.1	112.8	D251 M541 P552 K554 Y888 Y897	D251-R895 IonicContact OD1-CZ 2.59Å; D251-R895 IonicContact OD1-NH1 2.65Å; D251-R895 PolarHBondContact OD1-NH1 2.86Å; D251-R895 IonicContact OD1-NH2 3.06Å; D251-R895 PolarHBondContact OD1-NH2 3.05Å; D251-R895 IonicContact OD2-CZ 2.76Å; D251-R895 IonicContact OD2-NH1 3.35Å; D251-R895 PolarHBondContact OD2-NH1 3.34Å; D251-R895 IonicContact OD2-NH2 2.75Å; D251-R895 PolarHBondContact OD2-NH2 2.89Å; M541-R895 PolarHBondContact SD-NE 2.88Å; M541-R895 VanDerWaalsContact SD-NE 3.42Å; P552-R895 HydrophobicContact CG-CB 4.12Å; P552-R895 WeakPolarHBondContact CG-O 3.41Å; P552-R895 WeakPolarHBondContact O-CD 3.32Å; P552-R895 WeakPolarHBondContact O-CG 3.46Å; P552-R895 PolarHBondContact O-NH1 3.47Å; K554-R895 HydrophobicContact CG-CG 3.89Å; Y888-R895 PolarHBondContact OH-N 3.18Å; Y888-R895 VanDerWaalsContact OH-N 3.08Å; R895-Y897 PolarHBondContact O-N 3.37Å
896	W	90.6	Very high	86.7	Confident	15 Å²	15	26 Å²	26	6%	0.057	12%	0.122	C	C	.	.	S	Bend	trans	-102.1	73.1	179.3	-60.1	-79	0	0	0	108.5	L540 M541 A544 F551 P552 P698 F818 Y888 V889	L540-W896 HydrophobicContact CB-CE3 3.69Å; L540-W896 HydrophobicContact CB-CH2 4.01Å; L540-W896 HydrophobicContact CB-CZ3 3.34Å; L540-W896 HydrophobicContact CD1-CE3 4.03Å; L540-W896 HydrophobicContact CD1-CZ3 4.49Å; L540-W896 HydrophobicContact CG-CE3 4.45Å; M541-W896 HydrophobicContact CG-CH2 3.83Å; M541-W896 HydrophobicContact CG-CZ3 4.08Å; A544-W896 HydrophobicContact CB-CH2 4.11Å; A544-W896 HydrophobicContact CB-CZ2 3.75Å; F551-W896 HydrophobicContact CD1-CH2 4.5Å; F551-W896 HydrophobicContact CD1-CZ2 4.46Å; P552-W896 HydrophobicContact CG-CD2 4.42Å; P552-W896 HydrophobicContact CG-CG 4.29Å; P552-W896 HydrophobicContact CG-CZ2 4.48Å; P698-W896 HydrophobicContact CB-CB 4.26Å; P698-W896 HydrophobicContact CG-CB 3.93Å; P698-W896 WeakPolarHBondContact CG-O 3.27Å; F818-W896 HydrophobicContact CE2-CZ2 4.43Å; F818-W896 AromaticContact CZ-CE2 3.96Å; F818-W896 HydrophobicContact CZ-CZ2 4.41Å; F818-W896 AromaticContact CZ-NE1 3.6Å; Y888-W896 HydrophobicContact CE1-CB 4.42Å; Y888-W896 HydrophobicContact CE1-CE3 4.21Å; V889-W896 WeakPolarHBondContact CG1-O 3.15Å
897	Y	87.1	Confident	86.9	Confident	61 Å²	61	24 Å²	24	24%	0.239	12%	0.115	C	C	.	.			trans	-86	131.9	-179.5	176.2	-90.7	0	0	0	111.3	Q555 V889 R895 M899	Q555-Y897 HydrophobicContact CB-CG 4.29Å; Q555-Y897 HydrophobicContact CG-CD1 4.25Å; Q555-Y897 HydrophobicContact CG-CD2 4.43Å; Q555-Y897 HydrophobicContact CG-CG 4.03Å; V889-Y897 CarbonylContact O-C 3.56Å; V889-Y897 VanDerWaalsContact O-CA 3.31Å; V889-Y897 WeakPolarHBondContact O-CA 3.33Å; V889-Y897 VanDerWaalsContact O-CD2 3.31Å; V889-Y897 WeakPolarHBondContact O-CD2 3.48Å; R895-Y897 PolarHBondContact O-N 3.37Å; Y897-M899 WeakPolarHBondContact OH-CE 3.27Å
898	S	89.3	Confident	87.2	Confident	3 Å²	3	23.1 Å²	23.1	2%	0.021	10%	0.104	C	C	.	.			trans	-156	124.1	162.1	170.9	0	0	0	0	109.8	V889 E900 M901	V889-S898 PolarHBondContact O-N 2.85Å; S898-E900 PolarHBondContact OG-N 3.09Å; S898-E900 PolarHBondContact OG-OE2 2.81Å; S898-M901 WeakPolarHBondContact OG-CB 3.35Å; S898-M901 PolarHBondContact OG-N 3.39Å
899	M	86.2	Confident	87.3	Confident	11 Å²	11	23.1 Å²	23.1	5%	0.054	10%	0.104	C	C	.	.	H	α-helix	trans	-79.3	-35.6	175.4	179.1	162	-76.8	0	0	111.2	Q586 W727 Y897 A902 G903	Q586-M899 HydrophobicContact CB-SD 4.09Å; Q586-M899 HydrophobicContact CG-CE 3.97Å; Q586-M899 HydrophobicContact CG-SD 3.78Å; Q586-M899 WeakPolarHBondContact O-CE 3.32Å; W727-M899 HydrophobicContact CH2-CG 4.2Å; W727-M899 HydrophobicContact CZ3-CG 4.07Å; Y897-M899 WeakPolarHBondContact OH-CE 3.27Å; M899-A902 PolarHBondContact O-N 3.39Å; M899-G903 PolarHBondContact O-N 2.82Å
900	E	90.1	Very high	87.4	Confident	47 Å²	47	23.8 Å²	23.8	22%	0.22	11%	0.11	C	C	.	.	H	α-helix	trans	-59.8	-47.6	178.3	-52.2	67.9	-149.3	0	0	109.4	V701 W727 A809 S898 G903 I904	V701-E900 HydrophobicContact CG1-CB 3.59Å; W727-E900 HydrophobicContact CH2-CG 4.43Å; W727-E900 HydrophobicContact CZ2-CB 4.22Å; W727-E900 HydrophobicContact CZ2-CG 3.83Å; A809-E900 HydrophobicContact CB-CB 4.22Å; S898-E900 PolarHBondContact OG-N 3.09Å; S898-E900 PolarHBondContact OG-OE2 2.81Å; E900-G903 PolarHBondContact O-N 3.47Å; E900-I904 VanDerWaalsContact O-CG1 3.26Å; E900-I904 WeakPolarHBondContact O-CG1 3.47Å; E900-I904 PolarHBondContact O-N 3.45Å
901	M	92.5	Very high	87.8	Confident	1 Å²	1	23 Å²	23	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-58.4	-51.5	175.1	178.5	177.5	169.6	0	0	112.3	I691 L696 Q697 P698 V701 Y819 V889 S898 G903 I904 V905	I691-M901 HydrophobicContact CD1-CE 3.89Å; I691-M901 HydrophobicContact CG1-CE 3.92Å; I691-M901 HydrophobicContact CG2-CE 4.4Å; L696-M901 HydrophobicContact CB-CE 4.17Å; L696-M901 HydrophobicContact CB-CG 4.23Å; L696-M901 WeakPolarHBondContact O-CE 3.26Å; Q697-M901 VanDerWaalsContact CA-SD 3.6Å; P698-M901 HydrophobicContact CG-SD 3.8Å; V701-M901 HydrophobicContact CG2-CB 4.19Å; Y819-M901 HydrophobicContact CE1-CE 3.65Å; V889-M901 HydrophobicContact CB-SD 4.42Å; V889-M901 HydrophobicContact CG1-CE 4.47Å; V889-M901 HydrophobicContact CG1-SD 4.11Å; V889-M901 HydrophobicContact CG2-CB 4.38Å; V889-M901 HydrophobicContact CG2-CE 4.48Å; V889-M901 HydrophobicContact CG2-CG 4.19Å; V889-M901 HydrophobicContact CG2-SD 4.01Å; S898-M901 WeakPolarHBondContact OG-CB 3.35Å; S898-M901 PolarHBondContact OG-N 3.39Å; M901-G903 VanDerWaalsContact C-N 3.28Å; M901-G903 PolarHBondContact O-N 2.71Å; M901-I904 PolarHBondContact O-N 2.93Å; M901-V905 VanDerWaalsContact O-CG2 3.3Å; M901-V905 WeakPolarHBondContact O-CG2 3.48Å; M901-V905 PolarHBondContact O-N 3.32Å
902	A	90.8	Very high	88.4	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.2	-36.3	-179.8	0	0	0	0	0	111.8	Y588 V889 M890 M899 V905 C906	Y588-A902 HydrophobicContact CD1-CB 3.92Å; Y588-A902 HydrophobicContact CE1-CB 3.4Å; V889-A902 HydrophobicContact CG2-CB 4.11Å; M890-A902 HydrophobicContact CB-CB 3.97Å; M899-A902 PolarHBondContact O-N 3.39Å; A902-V905 PolarHBondContact O-N 2.96Å; A902-C906 WeakPolarHBondContact O-CB 3.32Å; A902-C906 PolarHBondContact O-N 2.83Å; A902-C906 PolarHBondContact O-SG 3.29Å
903	G	91.5	Very high	89.4	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-62	-50.3	172.8	0	0	0	0	0	113	W727 M899 E900 M901 V905 C906 H907	W727-G903 VanDerWaalsContact CB-C 3.5Å; M899-G903 PolarHBondContact O-N 2.82Å; E900-G903 PolarHBondContact O-N 3.47Å; M901-G903 VanDerWaalsContact C-N 3.28Å; M901-G903 PolarHBondContact O-N 2.71Å; G903-V905 VanDerWaalsContact C-N 3.32Å; G903-V905 PolarHBondContact O-N 2.83Å; G903-C906 PolarHBondContact O-N 3.33Å; G903-H907 WeakPolarHBondContact O-CB 3.4Å; G903-H907 PolarHBondContact O-N 3.34Å
904	I	93.7	Very high	90.3	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-57.7	-46.7	176	-67.6	161.9	0	0	0	110.1	L696 V701 M725 W727 A809 V811 E900 M901 C906 T908	L696-I904 HydrophobicContact CD1-CG2 3.8Å; L696-I904 HydrophobicContact CD2-CB 4.43Å; L696-I904 HydrophobicContact CD2-CD1 4.06Å; L696-I904 HydrophobicContact CD2-CG2 3.96Å; V701-I904 HydrophobicContact CG1-CD1 3.99Å; M725-I904 HydrophobicContact CB-CD1 4.13Å; M725-I904 HydrophobicContact CB-CG1 4.16Å; M725-I904 HydrophobicContact CB-CG2 4.05Å; M725-I904 HydrophobicContact CE-CG2 3.63Å; M725-I904 HydrophobicContact SD-CG2 3.76Å; W727-I904 HydrophobicContact CB-CG1 4Å; W727-I904 HydrophobicContact CG-CG1 4.29Å; A809-I904 HydrophobicContact CB-CD1 4.31Å; V811-I904 HydrophobicContact CG2-CD1 4.09Å; E900-I904 VanDerWaalsContact O-CG1 3.26Å; E900-I904 WeakPolarHBondContact O-CG1 3.47Å; E900-I904 PolarHBondContact O-N 3.45Å; M901-I904 PolarHBondContact O-N 2.93Å; I904-C906 PolarHBondContact O-N 2.94Å; I904-T908 WeakPolarHBondContact O-CB 3.22Å; I904-T908 PolarHBondContact O-N 2.97Å; I904-T908 PolarHBondContact O-OG1 3.46Å
905	V	93	Very high	90.5	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-59.3	-45.3	-179.8	170.3	0	0	0	0	111.6	Y687 I690 I691 L696 Y886 M901 A902 G903 G909	Y687-V905 HydrophobicContact CD1-CG1 3.49Å; Y687-V905 VanDerWaalsContact CD1-CG1 3.49Å; Y687-V905 HydrophobicContact CE1-CG1 4.42Å; Y687-V905 HydrophobicContact CG-CG1 3.99Å; I690-V905 HydrophobicContact CG2-CG2 4.33Å; I691-V905 HydrophobicContact CD1-CG2 4.26Å; I691-V905 HydrophobicContact CG1-CG2 3.59Å; L696-V905 HydrophobicContact CD1-CG2 3.72Å; Y886-V905 HydrophobicContact CD2-CG1 4.36Å; Y886-V905 HydrophobicContact CG-CG1 4.33Å; M901-V905 VanDerWaalsContact O-CG2 3.3Å; M901-V905 WeakPolarHBondContact O-CG2 3.48Å; M901-V905 PolarHBondContact O-N 3.32Å; A902-V905 PolarHBondContact O-N 2.96Å; G903-V905 VanDerWaalsContact C-N 3.32Å; G903-V905 PolarHBondContact O-N 2.83Å; V905-G909 PolarHBondContact O-N 2.99Å; V905-G909 VanDerWaalsContact O-N 3.08Å
906	C	90.4	Very high	90.7	Very high	6 Å²	6	18.6 Å²	18.6	4%	0.041	9%	0.094	C	C	.	.	H	α-helix	trans	-80.2	-34.1	-176.1	-63.1	0	0	0	0	113.7	Y588 A902 G903 I904 A910	Y588-C906 HydrophobicContact CD2-CB 3.66Å; Y588-C906 HydrophobicContact CE2-CB 3.46Å; Y588-C906 VanDerWaalsContact CE2-CB 3.46Å; Y588-C906 WeakPolarHBondContact CE2-SG 3.46Å; A902-C906 WeakPolarHBondContact O-CB 3.32Å; A902-C906 PolarHBondContact O-N 2.83Å; A902-C906 PolarHBondContact O-SG 3.29Å; G903-C906 PolarHBondContact O-N 3.33Å; I904-C906 PolarHBondContact O-N 2.94Å; C906-A910 WeakPolarHBondContact O-CB 3.49Å; C906-A910 PolarHBondContact O-N 2.99Å
907	H	92.3	Very high	90.7	Very high	14 Å²	14	20.4 Å²	20.4	7%	0.065	10%	0.101	C	C	.	.	H	α-helix	trans	-68.3	-42.4	172.5	177.5	95	0	0	0	110.9	P726 W727 T728 E806 G903 G909 A910 N911	P726-H907 PolarHBondContact O-CD2 2.85Å; W727-H907 HydrophobicContact CB-CB 4.46Å; T728-H907 PolarHBondContact OG1-ND1 3.01Å; E806-H907 IonicContact OE2-CE1 3.22Å; G903-H907 WeakPolarHBondContact O-CB 3.4Å; G903-H907 PolarHBondContact O-N 3.34Å; H907-G909 PolarHBondContact O-N 3.46Å; H907-A910 WeakPolarHBondContact O-CB 3.39Å; H907-A910 PolarHBondContact O-N 3.35Å; H907-N911 PolarHBondContact CD2-ND2 2.7Å; H907-N911 VanDerWaalsContact CD2-ND2 3.26Å; H907-N911 PolarHBondContact NE2-ND2 2.98Å; H907-N911 WeakPolarHBondContact O-CB 3.42Å; H907-N911 VanDerWaalsContact O-CG 3.25Å; H907-N911 PolarHBondContact O-N 3.39Å
908	T	92.1	Very high	90.9	Very high	7 Å²	7	21.2 Å²	21.2	4%	0.043	11%	0.107	C	C	.	.	H	α-helix	trans	-60.7	-45.7	174.1	-56.9	0	0	0	0	111.1	I690 I904 N911 I912 F975	I690-T908 HydrophobicContact CD1-CG2 4.18Å; I690-T908 HydrophobicContact CG1-CG2 4.19Å; I690-T908 HydrophobicContact CG2-CG2 3.9Å; I904-T908 WeakPolarHBondContact O-CB 3.22Å; I904-T908 PolarHBondContact O-N 2.97Å; I904-T908 PolarHBondContact O-OG1 3.46Å; T908-N911 PolarHBondContact O-N 2.68Å; T908-I912 HydrophobicContact CG2-CD1 4.07Å; T908-I912 WeakPolarHBondContact O-CG1 3.37Å; T908-I912 PolarHBondContact O-N 3.4Å; T908-F975 HydrophobicContact CG2-CD1 3.82Å; T908-F975 HydrophobicContact CG2-CE1 4.15Å
909	G	91.7	Very high	90.9	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-59.4	-46.3	174	0	0	0	0	0	112.7	V905 H907 N911 I912 I913	V905-G909 PolarHBondContact O-N 2.99Å; V905-G909 VanDerWaalsContact O-N 3.08Å; H907-G909 PolarHBondContact O-N 3.46Å; G909-N911 VanDerWaalsContact C-N 3.28Å; G909-N911 PolarHBondContact O-N 3.03Å; G909-I912 PolarHBondContact O-N 2.9Å; G909-I913 WeakPolarHBondContact O-CG1 3.49Å; G909-I913 PolarHBondContact O-N 3Å
910	A	90.2	Very high	91.1	Very high	15 Å²	15	22.3 Å²	22.3	12%	0.124	11%	0.112	C	C	.	.	H	α-helix	trans	-58	-40.1	175.6	0	0	0	0	0	112.5	C906 H907 T914	C906-A910 WeakPolarHBondContact O-CB 3.49Å; C906-A910 PolarHBondContact O-N 2.99Å; H907-A910 WeakPolarHBondContact O-CB 3.39Å; H907-A910 PolarHBondContact O-N 3.35Å; A910-T914 VanDerWaalsContact O-CB 3.3Å; A910-T914 WeakPolarHBondContact O-CB 3.43Å; A910-T914 PolarHBondContact O-N 3.12Å; A910-T914 PolarHBondContact O-OG1 3.43Å
911	N	91.3	Very high	91.2	Very high	57 Å²	57	24.4 Å²	24.4	31%	0.305	12%	0.122	S	C	.	.	H	α-helix	trans	-70.5	-36.9	178.2	-69.3	-12	0	0	0	112.3	H907 T908 G909 T914 K915 F975	H907-N911 PolarHBondContact CD2-ND2 2.7Å; H907-N911 VanDerWaalsContact CD2-ND2 3.26Å; H907-N911 PolarHBondContact NE2-ND2 2.98Å; H907-N911 WeakPolarHBondContact O-CB 3.42Å; H907-N911 VanDerWaalsContact O-CG 3.25Å; H907-N911 PolarHBondContact O-N 3.39Å; T908-N911 PolarHBondContact O-N 2.68Å; G909-N911 VanDerWaalsContact C-N 3.28Å; G909-N911 PolarHBondContact O-N 3.03Å; N911-T914 PolarHBondContact O-N 3.32Å; N911-K915 WeakPolarHBondContact O-CB 3.34Å; N911-K915 WeakPolarHBondContact O-CG 3.48Å; N911-K915 PolarHBondContact O-N 2.8Å; N911-F975 HydrophobicContact CB-CE1 4.06Å; N911-F975 HydrophobicContact CB-CZ 4.09Å
912	I	92.1	Very high	91.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.1	-48.5	173.5	-68.4	158.9	0	0	0	110.4	V683 I690 T908 G909 K915 S916 V971 F975 I999 F1001	V683-I912 HydrophobicContact CG2-CG2 3.98Å; I690-I912 HydrophobicContact CD1-CD1 3.96Å; I690-I912 HydrophobicContact CG1-CD1 4.13Å; T908-I912 HydrophobicContact CG2-CD1 4.07Å; T908-I912 WeakPolarHBondContact O-CG1 3.37Å; T908-I912 PolarHBondContact O-N 3.4Å; G909-I912 PolarHBondContact O-N 2.9Å; I912-K915 PolarHBondContact O-N 3.05Å; I912-S916 VanDerWaalsContact O-CB 3.3Å; I912-S916 WeakPolarHBondContact O-CB 3.35Å; I912-S916 PolarHBondContact O-N 3.23Å; I912-S916 PolarHBondContact O-OG 2.86Å; I912-V971 HydrophobicContact CG2-CG2 4.17Å; I912-F975 HydrophobicContact CB-CE2 4.47Å; I912-F975 HydrophobicContact CB-CZ 4.36Å; I912-F975 HydrophobicContact CD1-CD1 4.33Å; I912-F975 HydrophobicContact CD1-CE1 4.5Å; I912-F975 HydrophobicContact CD1-CG 4.44Å; I912-F975 HydrophobicContact CG1-CD1 3.89Å; I912-F975 HydrophobicContact CG1-CD2 3.88Å; I912-F975 HydrophobicContact CG1-CE1 3.69Å; I912-F975 HydrophobicContact CG1-CE2 3.67Å; I912-F975 HydrophobicContact CG1-CG 3.97Å; I912-F975 HydrophobicContact CG1-CZ 3.57Å; I912-I999 HydrophobicContact CD1-CD1 4.18Å; I912-I999 HydrophobicContact CD1-CG2 4.16Å; I912-F1001 HydrophobicContact CG2-CE2 4.02Å; I912-F1001 HydrophobicContact CG2-CZ 4.04Å
913	I	90.1	Very high	91.2	Very high	13 Å²	13	28 Å²	28	7%	0.067	14%	0.139	C	C	.	.	H	α-helix	trans	-66.3	-39.3	177.8	-59.3	-57.2	0	0	0	111.2	V683 G909 S916 R917 L929 D932 I934	V683-I913 HydrophobicContact CG2-CD1 4.21Å; G909-I913 WeakPolarHBondContact O-CG1 3.49Å; G909-I913 PolarHBondContact O-N 3Å; I913-S916 PolarHBondContact O-N 2.94Å; I913-R917 VanDerWaalsContact O-CB 3.3Å; I913-R917 WeakPolarHBondContact O-CB 3.36Å; I913-R917 PolarHBondContact O-N 3.3Å; I913-L929 HydrophobicContact CG2-CD2 4.34Å; I913-D932 WeakPolarHBondContact CD1-O 3.32Å; I913-I934 HydrophobicContact CG2-CD1 4.15Å; I913-I934 HydrophobicContact CG2-CG1 3.93Å
914	T	89.3	Confident	91.2	Very high	69 Å²	69	28.3 Å²	28.3	42%	0.423	14%	0.142	S	C	.	.	H	α-helix	trans	-65.4	-44.6	177.7	-57.3	0	0	0	0	111.9	A910 N911 R917 E918	A910-T914 VanDerWaalsContact O-CB 3.3Å; A910-T914 WeakPolarHBondContact O-CB 3.43Å; A910-T914 PolarHBondContact O-N 3.12Å; A910-T914 PolarHBondContact O-OG1 3.43Å; N911-T914 PolarHBondContact O-N 3.32Å; T914-R917 WeakPolarHBondContact O-CB 3.21Å; T914-R917 PolarHBondContact O-N 3.38Å; T914-E918 WeakPolarHBondContact O-CG 3.43Å; T914-E918 PolarHBondContact O-N 3.49Å
915	K	89.5	Confident	91.2	Very high	70 Å²	70	31.9 Å²	31.9	30%	0.304	16%	0.156	S	C	.	.	H	α-helix	trans	-67.4	-37.3	176.2	-73.8	-81.6	165.9	-106.5	0	112.4	N911 I912 E918 I919 M970	N911-K915 WeakPolarHBondContact O-CB 3.34Å; N911-K915 WeakPolarHBondContact O-CG 3.48Å; N911-K915 PolarHBondContact O-N 2.8Å; I912-K915 PolarHBondContact O-N 3.05Å; K915-E918 IonicContact NZ-OE1 2.66Å; K915-E918 PolarHBondContact NZ-OE1 2.73Å; K915-E918 IonicContact NZ-OE2 3.49Å; K915-E918 PolarHBondContact NZ-OE2 2.6Å; K915-E918 WeakPolarHBondContact O-CB 3.1Å; K915-E918 PolarHBondContact O-N 3.48Å; K915-I919 PolarHBondContact O-N 2.77Å; K915-M970 VanDerWaalsContact C-SD 3.58Å; K915-M970 HydrophobicContact CB-CE 4.34Å; K915-M970 HydrophobicContact CB-SD 3.62Å
916	S	91.3	Very high	91.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.7	-40.7	174.3	-55.5	0	0	0	0	111.2	I912 I913 I919 V920 M970 F1001	I912-S916 VanDerWaalsContact O-CB 3.3Å; I912-S916 WeakPolarHBondContact O-CB 3.35Å; I912-S916 PolarHBondContact O-N 3.23Å; I912-S916 PolarHBondContact O-OG 2.86Å; I913-S916 PolarHBondContact O-N 2.94Å; S916-I919 PolarHBondContact O-N 3.04Å; S916-V920 VanDerWaalsContact O-CG2 3.27Å; S916-V920 WeakPolarHBondContact O-CG2 3.4Å; S916-V920 PolarHBondContact O-N 3.26Å; S916-M970 WeakPolarHBondContact OG-CE 3.34Å; S916-F1001 WeakPolarHBondContact OG-CZ 3.48Å
917	R	90.6	Very high	91.3	Very high	54 Å²	54	31.9 Å²	31.9	20%	0.204	16%	0.156	C	C	.	.	H	α-helix	trans	-59.1	-46.6	171.8	178	-165.2	177.4	148.4	10.8	111.7	E594 I913 T914 I919 V920 E921 L929 I934	E594-R917 IonicContact OE1-NH1 3.97Å; E594-R917 PolarHBondContact OE1-NH1 3.3Å; E594-R917 VanDerWaalsContact OE1-NH1 3.1Å; I913-R917 VanDerWaalsContact O-CB 3.3Å; I913-R917 WeakPolarHBondContact O-CB 3.36Å; I913-R917 PolarHBondContact O-N 3.3Å; T914-R917 WeakPolarHBondContact O-CB 3.21Å; T914-R917 PolarHBondContact O-N 3.38Å; R917-I919 PolarHBondContact O-N 3.48Å; R917-V920 PolarHBondContact O-N 3.04Å; R917-E921 HydrophobicContact CG-CG 4.19Å; R917-E921 IonicContact CZ-OE1 3.94Å; R917-E921 VanDerWaalsContact CZ-OE1 3.24Å; R917-E921 IonicContact NE-OE1 3.18Å; R917-E921 PolarHBondContact NE-OE1 2.97Å; R917-E921 IonicContact NE-OE2 3.23Å; R917-E921 IonicContact NH2-OE1 2.65Å; R917-E921 PolarHBondContact NH2-OE1 3.08Å; R917-E921 WeakPolarHBondContact O-CB 3.49Å; R917-E921 PolarHBondContact O-N 3.21Å; R917-L929 HydrophobicContact CB-CD2 4.26Å; R917-L929 HydrophobicContact CG-CD2 4.22Å; R917-I934 HydrophobicContact CB-CD1 4.1Å
918	E	90.7	Very high	91.3	Very high	78 Å²	78	31.2 Å²	31.2	36%	0.364	15%	0.153	S	C	.	.	H	α-helix	trans	-55.1	-39.1	176.8	-75.1	167.6	-141.1	0	0	111.9	T914 K915 Q922	T914-E918 WeakPolarHBondContact O-CG 3.43Å; T914-E918 PolarHBondContact O-N 3.49Å; K915-E918 IonicContact NZ-OE1 2.66Å; K915-E918 PolarHBondContact NZ-OE1 2.73Å; K915-E918 IonicContact NZ-OE2 3.49Å; K915-E918 PolarHBondContact NZ-OE2 2.6Å; K915-E918 WeakPolarHBondContact O-CB 3.1Å; K915-E918 PolarHBondContact O-N 3.48Å; E918-Q922 VanDerWaalsContact O-CG 3.3Å; E918-Q922 WeakPolarHBondContact O-CG 3.28Å; E918-Q922 PolarHBondContact O-NE2 2.76Å
919	I	89.9	Confident	91.1	Very high	34 Å²	34	31.5 Å²	31.5	17%	0.174	15%	0.154	C	C	.	.	H	α-helix	trans	-71.5	-50.6	174.9	-64.1	176.3	0	0	0	110.9	K915 S916 R917 E921 Q922 I923 L966 L967 M970	K915-I919 PolarHBondContact O-N 2.77Å; S916-I919 PolarHBondContact O-N 3.04Å; R917-I919 PolarHBondContact O-N 3.48Å; I919-E921 VanDerWaalsContact C-N 3.33Å; I919-E921 PolarHBondContact O-N 2.87Å; I919-Q922 WeakPolarHBondContact O-CA 3.41Å; I919-Q922 WeakPolarHBondContact O-CB 3.25Å; I919-Q922 PolarHBondContact O-N 2.8Å; I919-I923 HydrophobicContact CG2-CD1 4.11Å; I919-I923 PolarHBondContact O-N 3.37Å; I919-L966 HydrophobicContact CG2-CD2 4.12Å; I919-L967 HydrophobicContact CD1-CD2 4.42Å; I919-M970 HydrophobicContact CD1-CB 3.9Å; I919-M970 HydrophobicContact CD1-CG 3.68Å; I919-M970 HydrophobicContact CD1-SD 3.65Å
920	V	90.9	Very high	90.6	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.012	16%	0.157	C	C	.	.	H	α-helix	trans	-59.9	-39.1	-176.8	171.8	0	0	0	0	112	L681 S916 R917 Q922 I923 G924 A926 C936	L681-V920 HydrophobicContact CD1-CG2 4.31Å; S916-V920 VanDerWaalsContact O-CG2 3.27Å; S916-V920 WeakPolarHBondContact O-CG2 3.4Å; S916-V920 PolarHBondContact O-N 3.26Å; R917-V920 PolarHBondContact O-N 3.04Å; V920-Q922 PolarHBondContact O-N 3.33Å; V920-I923 PolarHBondContact O-N 3.01Å; V920-G924 CarbonylContact O-C 3.58Å; V920-G924 VanDerWaalsContact O-C 3.24Å; V920-G924 WeakPolarHBondContact O-CA 3.48Å; V920-G924 PolarHBondContact O-N 2.81Å; V920-A926 HydrophobicContact CG1-CB 4.05Å; V920-C936 HydrophobicContact CG1-CB 3.48Å; V920-C936 VanDerWaalsContact CG1-CB 3.48Å
921	E	91.6	Very high	90.2	Very high	92 Å²	92	33.6 Å²	33.6	43%	0.43	17%	0.165	S	C	.	.	H	α-helix	trans	-68.6	-13.1	175.5	-71.3	-176.7	172.1	0	0	113.5	R917 I919 A926	R917-E921 HydrophobicContact CG-CG 4.19Å; R917-E921 IonicContact CZ-OE1 3.94Å; R917-E921 VanDerWaalsContact CZ-OE1 3.24Å; R917-E921 IonicContact NE-OE1 3.18Å; R917-E921 PolarHBondContact NE-OE1 2.97Å; R917-E921 IonicContact NE-OE2 3.23Å; R917-E921 IonicContact NH2-OE1 2.65Å; R917-E921 PolarHBondContact NH2-OE1 3.08Å; R917-E921 WeakPolarHBondContact O-CB 3.49Å; R917-E921 PolarHBondContact O-N 3.21Å; I919-E921 VanDerWaalsContact C-N 3.33Å; I919-E921 PolarHBondContact O-N 2.87Å; E921-A926 HydrophobicContact CG-CB 4.3Å
922	Q	91.8	Very high	89.9	Confident	71 Å²	71	33.5 Å²	33.5	33%	0.332	16%	0.164	S	C	.	.	H	α-helix	trans	-95.5	-23.3	175.4	-67.9	176.7	69.5	0	0	113.8	L611 V612 A615 E918 I919 V920	L611-Q922 WeakPolarHBondContact CA-O 3.34Å; V612-Q922 HydrophobicContact CB-CB 4.14Å; V612-Q922 HydrophobicContact CB-CG 4.36Å; V612-Q922 HydrophobicContact CG2-CB 4.06Å; V612-Q922 HydrophobicContact CG2-CG 3.99Å; V612-Q922 PolarHBondContact N-O 2.96Å; A615-Q922 HydrophobicContact CB-CB 3.87Å; E918-Q922 VanDerWaalsContact O-CG 3.3Å; E918-Q922 WeakPolarHBondContact O-CG 3.28Å; E918-Q922 PolarHBondContact O-NE2 2.76Å; I919-Q922 WeakPolarHBondContact O-CA 3.41Å; I919-Q922 WeakPolarHBondContact O-CB 3.25Å; I919-Q922 PolarHBondContact O-N 2.8Å; V920-Q922 PolarHBondContact O-N 3.33Å
923	I	90.7	Very high	89.7	Confident	6 Å²	6	33.5 Å²	33.5	3%	0.031	16%	0.164	C	C	.	.	H	α-helix	trans	-117.1	-4.7	-177	67.3	173	0	0	0	114.7	L611 L616 L619 I919 V920 L938 F942 L966	L611-I923 VanDerWaalsContact CD2-C 3.5Å; L611-I923 VanDerWaalsContact CD2-O 3.22Å; L611-I923 WeakPolarHBondContact CD2-O 3.3Å; L616-I923 HydrophobicContact CD2-CG2 4.06Å; L619-I923 HydrophobicContact CD1-CG2 3.98Å; I919-I923 HydrophobicContact CG2-CD1 4.11Å; I919-I923 PolarHBondContact O-N 3.37Å; V920-I923 PolarHBondContact O-N 3.01Å; I923-L938 HydrophobicContact CD1-CD2 4.31Å; I923-L938 HydrophobicContact CG1-CD2 4.14Å; I923-F942 HydrophobicContact CB-CE2 4.21Å; I923-F942 HydrophobicContact CD1-CE2 3.84Å; I923-F942 HydrophobicContact CD1-CZ 3.75Å; I923-L966 HydrophobicContact CD1-CD2 3.85Å
924	G	92.7	Very high	89.7	Confident	6 Å²	6	32.9 Å²	32.9	6%	0.062	16%	0.161	C	C	.	.	S	Bend	trans	-165.9	-143.2	-174.8	0	0	0	0	0	110.9	V920 I937	V920-G924 CarbonylContact O-C 3.58Å; V920-G924 VanDerWaalsContact O-C 3.24Å; V920-G924 WeakPolarHBondContact O-CA 3.48Å; V920-G924 PolarHBondContact O-N 2.81Å; G924-I937 CarbonylContact C-O 3.54Å; G924-I937 VanDerWaalsContact CA-O 3.32Å; G924-I937 WeakPolarHBondContact CA-O 3.31Å
925	R	93.2	Very high	89.9	Confident	75 Å²	75	29.7 Å²	29.7	28%	0.283	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	129.5	170.7	-58.4	165.2	63.5	-172.7	5.6	109.6	E597 F609 C936 I937	E597-R925 IonicContact OE1-CZ 2.88Å; E597-R925 IonicContact OE1-NE 3.13Å; E597-R925 PolarHBondContact OE1-NE 2.81Å; E597-R925 IonicContact OE1-NH2 3.92Å; E597-R925 PolarHBondContact OE1-NH2 3.07Å; E597-R925 IonicContact OE2-CZ 2.69Å; E597-R925 VanDerWaalsContact OE2-CZ 3.27Å; E597-R925 IonicContact OE2-NE 3.92Å; E597-R925 IonicContact OE2-NH2 2.66Å; E597-R925 PolarHBondContact OE2-NH2 3.35Å; F609-R925 HydrophobicContact CD1-CG 4.46Å; R925-C936 WeakPolarHBondContact O-CA 3.46Å; R925-C936 WeakPolarHBondContact O-CB 3.25Å; R925-I937 HydrophobicContact CB-CD1 4.3Å; R925-I937 HydrophobicContact CB-CG1 3.9Å; R925-I937 PolarHBondContact N-O 2.83Å; R925-I937 PolarHBondContact O-N 3.49Å
926	A	93.4	Very high	90.2	Very high	5 Å²	5	26.3 Å²	26.3	4%	0.041	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	133.7	170	0	0	0	0	0	109.7	L596 V920 E921 I934	L596-A926 HydrophobicContact CD1-CB 3.6Å; V920-A926 HydrophobicContact CG1-CB 4.05Å; E921-A926 HydrophobicContact CG-CB 4.3Å; A926-I934 HydrophobicContact CB-CG2 4.2Å
927	L	92.7	Very high	90.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-46.7	-175.3	-60.3	-175.1	0	0	0	111.9	L596 E597 F601 W935 I937 M1010 L1012	L596-L927 PolarHBondContact N-O 2.6Å; E597-L927 HydrophobicContact CB-CD2 4.26Å; E597-L927 HydrophobicContact CG-CD2 4.32Å; E597-L927 PolarHBondContact N-O 3.14Å; E597-L927 VanDerWaalsContact N-O 3.16Å; F601-L927 HydrophobicContact CB-CD1 4.06Å; F601-L927 HydrophobicContact CD1-CD1 4.18Å; F601-L927 HydrophobicContact CD1-CD2 3.85Å; F601-L927 HydrophobicContact CD2-CD1 3.94Å; F601-L927 HydrophobicContact CD2-CD2 4.27Å; F601-L927 HydrophobicContact CE1-CD2 3.62Å; F601-L927 HydrophobicContact CE2-CD1 4.49Å; F601-L927 HydrophobicContact CE2-CD2 4.08Å; F601-L927 HydrophobicContact CG-CD1 3.77Å; F601-L927 HydrophobicContact CG-CD2 4.17Å; F601-L927 HydrophobicContact CZ-CD2 3.75Å; L927-W935 PolarHBondContact N-O 2.81Å; L927-I937 HydrophobicContact CD1-CG2 4.04Å; L927-I937 HydrophobicContact CD2-CD1 4.36Å; L927-I937 HydrophobicContact CD2-CG1 4.15Å; L927-I937 HydrophobicContact CG-CG1 4.39Å; L927-M1010 HydrophobicContact CB-SD 4.46Å; L927-M1010 HydrophobicContact CD1-SD 4.01Å; L927-L1012 HydrophobicContact CB-CD1 3.75Å
928	E	90.9	Very high	90.5	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	145.1	172.4	177.9	168.8	-156.1	0	0	109.9	E594 W935 L1012 K1024 Y1026	E594-E928 WeakPolarHBondContact O-CA 3.4Å; E928-W935 HydrophobicContact CB-CB 4.32Å; E928-W935 PolarHBondContact N-O 2.81Å; E928-W935 PolarHBondContact O-N 3.38Å; E928-L1012 HydrophobicContact CB-CD2 4.46Å; E928-K1024 WeakPolarHBondContact OE1-CA 3.25Å; E928-K1024 PolarHBondContact OE1-N 3.17Å; E928-Y1026 WeakPolarHBondContact OE2-CD1 3.37Å; E928-Y1026 VanDerWaalsContact OE2-CE1 3.23Å; E928-Y1026 WeakPolarHBondContact OE2-CE1 3.33Å
929	L	87.9	Confident	90.6	Very high	14 Å²	14	20.2 Å²	20.2	7%	0.073	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	120.6	165.6	-51.3	175.9	0	0	0	107.6	V593 E594 L596 I913 R917 I934	V593-L929 VanDerWaalsContact CA-O 3.29Å; V593-L929 WeakPolarHBondContact CA-O 3.49Å; V593-L929 WeakPolarHBondContact CG1-O 3.26Å; E594-L929 HydrophobicContact CG-CD1 4.15Å; E594-L929 PolarHBondContact N-O 3.49Å; E594-L929 PolarHBondContact O-N 3.39Å; L596-L929 HydrophobicContact CD1-CD1 4.42Å; L596-L929 HydrophobicContact CD1-CD2 4.13Å; L596-L929 HydrophobicContact CD1-CG 4.02Å; L596-L929 HydrophobicContact CD2-CD1 4.39Å; L596-L929 HydrophobicContact CD2-CG 4.5Å; L596-L929 HydrophobicContact CG-CG 4.31Å; I913-L929 HydrophobicContact CG2-CD2 4.34Å; R917-L929 HydrophobicContact CB-CD2 4.26Å; R917-L929 HydrophobicContact CG-CD2 4.22Å; L929-I934 HydrophobicContact CD2-CD1 4.24Å; L929-I934 HydrophobicContact CD2-CG1 3.97Å; L929-I934 HydrophobicContact CD2-CG2 4.19Å
930	D	82.6	Confident	90.6	Very high	13 Å²	13	20.5 Å²	20.5	7%	0.07	11%	0.108	C	C	.	.			trans	-93.7	-149.3	167.1	-152.4	-42.8	0	0	0	109.3	G933 K1024 Y1026	D930-G933 PolarHBondContact N-O 3.04Å; D930-K1024 WeakPolarHBondContact OD1-CE 3.2Å; D930-K1024 IonicContact OD1-NZ 2.62Å; D930-K1024 PolarHBondContact OD1-NZ 2.83Å; D930-K1024 IonicContact OD2-NZ 2.68Å; D930-Y1026 PolarHBondContact OD2-OH 2.79Å; D930-Y1026 VanDerWaalsContact OD2-OH 3.09Å
931	T	81	Confident	90.5	Very high	46 Å²	46	22 Å²	22	28%	0.282	12%	0.119	S	C	.	.	S	Bend	trans	-96.1	-35.3	-164.7	-48.3	0	0	0	0	111.2	M686 Y687 K1024	M686-T931 WeakPolarHBondContact CE-O 3.42Å; Y687-T931 WeakPolarHBondContact OH-CG2 3.25Å; T931-K1024 PolarHBondContact OG1-NZ 3.47Å
932	D	84.7	Confident	90.5	Very high	56 Å²	56	17.9 Å²	17.9	30%	0.299	10%	0.099	S	C	.	.	S	Bend	trans	-127.9	-11.1	-173.7	28.4	10	0	0	0	112	D682 V683 M686 I913	D682-D932 WeakPolarHBondContact OD1-CB 3.4Å; V683-D932 WeakPolarHBondContact CB-O 3.45Å; V683-D932 WeakPolarHBondContact CG2-O 3.45Å; V683-D932 PolarHBondContact N-O 2.64Å; M686-D932 HydrophobicContact CB-CB 4.41Å; M686-D932 HydrophobicContact CE-CB 4.17Å; I913-D932 WeakPolarHBondContact CD1-O 3.32Å
933	G	88.1	Confident	90.3	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	171.9	-178.6	0	0	0	0	0	116.5	L681 D930	L681-G933 CarbonylContact O-C 3.55Å; L681-G933 WeakPolarHBondContact O-CA 3.3Å; D930-G933 PolarHBondContact N-O 3.04Å
934	I	90.9	Very high	90.1	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126	178.7	-59	179.6	0	0	0	109.6	L681 I913 R917 A926 L929 C936	L681-I934 PolarHBondContact N-O 3.1Å; L681-I934 PolarHBondContact O-N 2.78Å; I913-I934 HydrophobicContact CG2-CD1 4.15Å; I913-I934 HydrophobicContact CG2-CG1 3.93Å; R917-I934 HydrophobicContact CB-CD1 4.1Å; A926-I934 HydrophobicContact CB-CG2 4.2Å; L929-I934 HydrophobicContact CD2-CD1 4.24Å; L929-I934 HydrophobicContact CD2-CG1 3.97Å; L929-I934 HydrophobicContact CD2-CG2 4.19Å; I934-C936 HydrophobicContact CG2-CB 4.29Å
935	W	93.7	Very high	89.8	Confident	1 Å²	1	22 Å²	22	0%	0.004	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	123.3	165.4	-72	90.7	0	0	0	109.3	H680 L927 E928 Y1007 M1010 Y1026 V1028	H680-W935 HydrophobicContact CB-CD2 3.96Å; H680-W935 HydrophobicContact CB-CE3 3.93Å; H680-W935 HydrophobicContact CB-CH2 3.78Å; H680-W935 HydrophobicContact CB-CZ2 3.83Å; H680-W935 HydrophobicContact CB-CZ3 3.85Å; H680-W935 AromaticContact CD2-CD1 3.54Å; H680-W935 AromaticContact CD2-CD2 3.79Å; H680-W935 AromaticContact CD2-CE2 3.43Å; H680-W935 VanDerWaalsContact CD2-CE2 3.43Å; H680-W935 AromaticContact CD2-CG 3.84Å; H680-W935 AromaticContact CD2-CZ2 3.98Å; H680-W935 AromaticContact CD2-NE1 3.26Å; H680-W935 PolarHBondContact CD2-NE1 3.13Å; H680-W935 VanDerWaalsContact CD2-NE1 3.26Å; H680-W935 AromaticContact CG-CE2 3.68Å; H680-W935 AromaticContact CG-CZ2 3.77Å; H680-W935 AromaticContact CG-NE1 3.96Å; H680-W935 AromaticContact NE2-NE1 3.61Å; L927-W935 PolarHBondContact N-O 2.81Å; E928-W935 HydrophobicContact CB-CB 4.32Å; E928-W935 PolarHBondContact N-O 2.81Å; E928-W935 PolarHBondContact O-N 3.38Å; W935-Y1007 HydrophobicContact CH2-CD2 4.12Å; W935-Y1007 AromaticContact CH2-CE2 3.59Å; W935-Y1007 HydrophobicContact CH2-CE2 3.59Å; W935-Y1007 AromaticContact CZ3-CD2 3.6Å; W935-Y1007 HydrophobicContact CZ3-CD2 3.6Å; W935-Y1007 AromaticContact CZ3-CE2 3.53Å; W935-Y1007 HydrophobicContact CZ3-CE2 3.53Å; W935-M1010 HydrophobicContact CB-CE 3.77Å; W935-M1010 HydrophobicContact CB-SD 3.92Å; W935-M1010 HydrophobicContact CD2-CE 3.61Å; W935-M1010 HydrophobicContact CD2-SD 3.99Å; W935-M1010 HydrophobicContact CE3-CE 3.92Å; W935-M1010 HydrophobicContact CE3-SD 3.72Å; W935-M1010 HydrophobicContact CG-CE 3.52Å; W935-M1010 HydrophobicContact CG-SD 4.09Å; W935-Y1026 HydrophobicContact CZ2-CE2 4.11Å; W935-Y1026 AromaticContact NE1-CZ 3.88Å; W935-V1028 HydrophobicContact CE3-CG2 4.34Å; W935-V1028 HydrophobicContact CH2-CB 4.29Å; W935-V1028 HydrophobicContact CH2-CG1 3.92Å; W935-V1028 HydrophobicContact CH2-CG2 3.68Å; W935-V1028 HydrophobicContact CZ2-CG2 4.25Å; W935-V1028 HydrophobicContact CZ3-CB 4.44Å; W935-V1028 HydrophobicContact CZ3-CG1 3.86Å; W935-V1028 HydrophobicContact CZ3-CG2 3.71Å
936	C	94.6	Very high	89.5	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	163.5	-177.3	68.5	0	0	0	0	113.7	Y679 V920 R925 I934	Y679-C936 PolarHBondContact N-O 3.21Å; Y679-C936 PolarHBondContact O-N 2.98Å; V920-C936 HydrophobicContact CG1-CB 3.48Å; V920-C936 VanDerWaalsContact CG1-CB 3.48Å; R925-C936 WeakPolarHBondContact O-CA 3.46Å; R925-C936 WeakPolarHBondContact O-CB 3.25Å; I934-C936 HydrophobicContact CG2-CB 4.29Å
937	I	94.6	Very high	89.1	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.3	164.3	47.8	168.8	0	0	0	111.4	F601 V607 F609 P676 V677 I678 G924 R925 L927	F601-I937 HydrophobicContact CD1-CD1 4.11Å; V607-I937 HydrophobicContact CG1-CD1 3.98Å; F609-I937 HydrophobicContact CE1-CD1 4.35Å; F609-I937 HydrophobicContact CE1-CG1 4.29Å; F609-I937 HydrophobicContact CZ-CB 4.42Å; F609-I937 HydrophobicContact CZ-CD1 4.27Å; F609-I937 HydrophobicContact CZ-CG1 4.46Å; P676-I937 HydrophobicContact CB-CB 3.83Å; P676-I937 HydrophobicContact CB-CD1 4.24Å; P676-I937 HydrophobicContact CB-CG2 3.81Å; V677-I937 WeakPolarHBondContact O-CA 3.08Å; I678-I937 HydrophobicContact CB-CG2 4.29Å; I678-I937 HydrophobicContact CG1-CG2 3.7Å; G924-I937 CarbonylContact C-O 3.54Å; G924-I937 VanDerWaalsContact CA-O 3.32Å; G924-I937 WeakPolarHBondContact CA-O 3.31Å; R925-I937 HydrophobicContact CB-CD1 4.3Å; R925-I937 HydrophobicContact CB-CG1 3.9Å; R925-I937 PolarHBondContact N-O 2.83Å; R925-I937 PolarHBondContact O-N 3.49Å; L927-I937 HydrophobicContact CD1-CG2 4.04Å; L927-I937 HydrophobicContact CD2-CD1 4.36Å; L927-I937 HydrophobicContact CD2-CG1 4.15Å; L927-I937 HydrophobicContact CG-CG1 4.39Å
938	L	93.6	Very high	88.6	Confident	4 Å²	4	24.3 Å²	24.3	2%	0.021	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	153.7	170.4	-56.8	178.2	0	0	0	108.7	F609 P676 V677 Y679 I923 F942 P963	F609-L938 VanDerWaalsContact CZ-C 3.48Å; P676-L938 CarbonylContact C-O 3.59Å; P676-L938 VanDerWaalsContact CA-O 3.31Å; P676-L938 WeakPolarHBondContact CA-O 3.24Å; V677-L938 PolarHBondContact N-O 2.99Å; V677-L938 PolarHBondContact O-N 3.35Å; V677-L938 VanDerWaalsContact O-N 3.09Å; Y679-L938 HydrophobicContact CD2-CD1 4.35Å; I923-L938 HydrophobicContact CD1-CD2 4.31Å; I923-L938 HydrophobicContact CG1-CD2 4.14Å; L938-F942 HydrophobicContact CB-CB 4.22Å; L938-F942 HydrophobicContact CD1-CD1 3.83Å; L938-F942 HydrophobicContact CD1-CE1 4.23Å; L938-F942 HydrophobicContact CD1-CG 4.38Å; L938-P963 HydrophobicContact CD1-CB 4.2Å; L938-P963 HydrophobicContact CD1-CG 3.95Å
939	P	93.3	Very high	88	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	146.3	169.9	27.2	-31.7	0	0	0	110.2	F609 L611 S941 F942	F609-P939 HydrophobicContact CD2-CB 3.91Å; F609-P939 HydrophobicContact CE2-CB 3.91Å; F609-P939 HydrophobicContact CG-CB 4.27Å; F609-P939 HydrophobicContact CZ-CB 4.28Å; L611-P939 HydrophobicContact CD2-CG 4.47Å; P939-S941 PolarHBondContact O-N 3.47Å; P939-F942 HydrophobicContact CG-CB 4.17Å; P939-F942 WeakPolarHBondContact O-CB 3.34Å; P939-F942 PolarHBondContact O-N 2.72Å
940	A	89.1	Confident	87.3	Confident	40 Å²	40	28.2 Å²	28.2	33%	0.331	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-31.8	-179.2	0	0	0	0	0	114	E674 C675 V677 F942 Q944	E674-A940 HydrophobicContact CG-CB 4.48Å; C675-A940 WeakPolarHBondContact O-CB 3.49Å; C675-A940 PolarHBondContact O-N 2.81Å; V677-A940 HydrophobicContact CG2-CB 4.07Å; A940-F942 PolarHBondContact O-N 3.2Å; A940-Q944 PolarHBondContact O-NE2 2.88Å
941	S	89.1	Confident	86.8	Confident	34 Å²	34	32.1 Å²	32.1	24%	0.238	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-1	171.8	58.6	0	0	0	0	115	T662 L666 R672 E674 P939	T662-S941 WeakPolarHBondContact CG2-O 3.39Å; L666-S941 WeakPolarHBondContact CD2-OG 3.27Å; R672-S941 PolarHBondContact NH1-OG 3Å; E674-S941 WeakPolarHBondContact OE1-CA 3.42Å; E674-S941 WeakPolarHBondContact OE1-CB 3.47Å; E674-S941 PolarHBondContact OE1-N 3.04Å; E674-S941 PolarHBondContact OE1-OG 3.17Å; E674-S941 PolarHBondContact OE2-OG 2.76Å; P939-S941 PolarHBondContact O-N 3.47Å
942	F	92.4	Very high	85.9	Confident	4 Å²	4	34.6 Å²	34.6	2%	0.018	21%	0.21	C	C	.	.	S	Bend	trans	-69.7	139	165.8	-165.5	-93.6	0	0	0	109.8	L619 L663 L666 I923 L938 P939 A940 Q944 Y962 P963 L966	L619-F942 HydrophobicContact CD1-CE2 4.32Å; L619-F942 HydrophobicContact CD1-CZ 4.34Å; L663-F942 HydrophobicContact CD2-CE2 4.22Å; L666-F942 HydrophobicContact CD1-CD2 3.6Å; L666-F942 HydrophobicContact CD1-CE2 4.26Å; L666-F942 HydrophobicContact CD1-CG 4.48Å; I923-F942 HydrophobicContact CB-CE2 4.21Å; I923-F942 HydrophobicContact CD1-CE2 3.84Å; I923-F942 HydrophobicContact CD1-CZ 3.75Å; L938-F942 HydrophobicContact CB-CB 4.22Å; L938-F942 HydrophobicContact CD1-CD1 3.83Å; L938-F942 HydrophobicContact CD1-CE1 4.23Å; L938-F942 HydrophobicContact CD1-CG 4.38Å; P939-F942 HydrophobicContact CG-CB 4.17Å; P939-F942 WeakPolarHBondContact O-CB 3.34Å; P939-F942 PolarHBondContact O-N 2.72Å; A940-F942 PolarHBondContact O-N 3.2Å; F942-Q944 PolarHBondContact O-N 2.94Å; F942-Y962 AromaticContact CE1-CD1 3.77Å; F942-Y962 HydrophobicContact CE1-CD1 3.77Å; F942-Y962 HydrophobicContact CE1-CE1 4.11Å; F942-Y962 HydrophobicContact CZ-CD1 4.04Å; F942-Y962 AromaticContact CZ-CE1 3.88Å; F942-Y962 HydrophobicContact CZ-CE1 3.88Å; F942-P963 HydrophobicContact CD1-CG 4.23Å; F942-P963 HydrophobicContact CE1-CG 4.03Å; F942-L966 HydrophobicContact CZ-CD2 4.35Å
943	P	88.3	Confident	84.4	Confident	14 Å²	14	34.5 Å²	34.5	9%	0.091	21%	0.214	C	C	.	.			trans	-61.1	123.1	176.7	-17.8	28.9	0	0	0	111.1	V659 T662 L663 Y962 P963	V659-P943 HydrophobicContact CG1-CB 4.28Å; V659-P943 HydrophobicContact CG1-CG 3.96Å; V659-P943 HydrophobicContact CG2-CB 4.46Å; T662-P943 HydrophobicContact CG2-CG 3.94Å; L663-P943 HydrophobicContact CD2-CG 4.27Å; P943-Y962 HydrophobicContact CB-CD1 3.69Å; P943-Y962 HydrophobicContact CB-CE1 4.36Å; P943-Y962 HydrophobicContact CB-CG 4.07Å; P943-Y962 HydrophobicContact CG-CD1 4.06Å; P943-Y962 HydrophobicContact CG-CE1 4.25Å; P943-P963 WeakPolarHBondContact O-CD 3.4Å
944	Q	86.2	Confident	82.8	Confident	59 Å²	59	44.4 Å²	44.4	28%	0.276	26%	0.257	S	S	.	.			trans	-103	-112.5	-178	-69.2	163.6	59.7	0	0	110.2	Y679 A940 F942 Y962	Y679-Q944 HydrophobicContact CE2-CG 4.35Å; Y679-Q944 PolarHBondContact OH-OE1 3Å; A940-Q944 PolarHBondContact O-NE2 2.88Å; F942-Q944 PolarHBondContact O-N 2.94Å; Q944-Y962 WeakPolarHBondContact O-CB 3.49Å; Q944-Y962 PolarHBondContact O-N 2.99Å
945	N	85.8	Confident	81.1	Confident	98 Å²	98	48.7 Å²	48.7	52%	0.524	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	139.9	177.5	-65.8	-19.1	0	0	0	111.2	I960 S961	N945-I960 CarbonylContact C-O 3.58Å; N945-I960 WeakPolarHBondContact CA-O 3.38Å; N945-S961 WeakPolarHBondContact OD1-CA 3.42Å; N945-S961 WeakPolarHBondContact OD1-CB 3.34Å; N945-S961 PolarHBondContact OD1-OG 3.26Å
946	I	86.9	Confident	79.7	Confident	19 Å²	19	52.3 Å²	52.3	10%	0.097	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	117.9	-171.8	-57.8	179.3	0	0	0	109	I627 I655 V659 F948 S959 I960 Y962	I627-I946 HydrophobicContact CD1-CD1 4.31Å; I655-I946 HydrophobicContact CG2-CG2 3.23Å; V659-I946 HydrophobicContact CG2-CD1 3.51Å; I946-F948 HydrophobicContact CB-CE2 4.21Å; I946-F948 HydrophobicContact CG2-CD2 4.31Å; I946-F948 HydrophobicContact CG2-CE2 3.52Å; I946-F948 HydrophobicContact CG2-CZ 3.76Å; I946-S959 WeakPolarHBondContact O-CA 3.49Å; I946-I960 PolarHBondContact N-O 2.75Å; I946-I960 PolarHBondContact O-N 3.07Å; I946-Y962 HydrophobicContact CD1-CD2 4.29Å; I946-Y962 HydrophobicContact CD1-CG 4.3Å
947	E	84.2	Confident	78.8	Confident	107 Å²	107	59.8 Å²	59.8	50%	0.5	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.6	178.6	-69.5	-171.9	-163.7	0	0	112.9	I655 R957 I958	I655-E947 WeakPolarHBondContact CD1-O 3.36Å; E947-R957 IonicContact OE1-NH1 3.9Å; E947-R957 WeakPolarHBondContact OE2-CD 3.38Å; E947-R957 IonicContact OE2-CZ 3.26Å; E947-R957 IonicContact OE2-NE 2.76Å; E947-R957 IonicContact OE2-NH1 3.2Å; E947-R957 PolarHBondContact OE2-NH1 2.96Å; E947-I958 WeakPolarHBondContact CA-O 3.49Å
948	F	82.3	Confident	78	Confident	1 Å²	1	60.8 Å²	60.8	0%	0.004	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	138.7	168.7	-62.7	-94.3	0	0	0	110.3	I627 L631 I647 F652 I655 I946 R957 I958 I960	I627-F948 HydrophobicContact CG2-CE1 3.98Å; I627-F948 HydrophobicContact CG2-CE2 4.13Å; I627-F948 HydrophobicContact CG2-CZ 3.34Å; L631-F948 HydrophobicContact CD1-CD1 3.94Å; L631-F948 HydrophobicContact CD1-CD2 4.37Å; L631-F948 HydrophobicContact CD1-CE1 3.87Å; L631-F948 HydrophobicContact CD1-CE2 4.31Å; L631-F948 HydrophobicContact CD1-CG 4.22Å; L631-F948 HydrophobicContact CD1-CZ 4.08Å; L631-F948 HydrophobicContact CD2-CB 4.4Å; L631-F948 HydrophobicContact CD2-CD2 3.78Å; L631-F948 HydrophobicContact CD2-CE2 4.22Å; L631-F948 HydrophobicContact CD2-CG 3.98Å; L631-F948 HydrophobicContact CG-CD2 4.45Å; L631-F948 HydrophobicContact CG-CE2 4.44Å; I647-F948 HydrophobicContact CD1-CB 3.78Å; I647-F948 HydrophobicContact CD1-CD1 4.43Å; I647-F948 HydrophobicContact CD1-CG 4.21Å; I647-F948 HydrophobicContact CG1-CB 4.45Å; I647-F948 HydrophobicContact CG2-CD1 4.23Å; F652-F948 HydrophobicContact CD2-CE1 4.41Å; I655-F948 HydrophobicContact CB-CE1 3.84Å; I655-F948 HydrophobicContact CB-CZ 4.22Å; I655-F948 HydrophobicContact CD1-CD1 3.49Å; I655-F948 VanDerWaalsContact CD1-CD1 3.49Å; I655-F948 HydrophobicContact CD1-CE1 3.61Å; I655-F948 HydrophobicContact CD1-CG 4.1Å; I655-F948 HydrophobicContact CD1-CZ 4.3Å; I655-F948 HydrophobicContact CG1-CE1 4.32Å; I655-F948 HydrophobicContact CG2-CE1 3.61Å; I655-F948 HydrophobicContact CG2-CE2 4.32Å; I655-F948 HydrophobicContact CG2-CZ 3.46Å; I655-F948 VanDerWaalsContact CG2-CZ 3.46Å; I946-F948 HydrophobicContact CB-CE2 4.21Å; I946-F948 HydrophobicContact CG2-CD2 4.31Å; I946-F948 HydrophobicContact CG2-CE2 3.52Å; I946-F948 HydrophobicContact CG2-CZ 3.76Å; F948-R957 CarbonylContact O-C 3.11Å; F948-R957 VanDerWaalsContact O-CA 3.29Å; F948-R957 WeakPolarHBondContact O-CA 3.33Å; F948-I958 PolarHBondContact N-O 3.21Å; F948-I958 PolarHBondContact O-N 2.91Å; F948-I960 HydrophobicContact CD2-CD1 4.47Å; F948-I960 HydrophobicContact CE2-CD1 4.17Å
949	T	77.9	Confident	77.4	Confident	82 Å²	82	63.7 Å²	63.7	50%	0.503	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	123.3	175.6	-37.3	0	0	0	0	109.8	N651	N651-T949 PolarHBondContact ND2-N 2.97Å
950	A	74.7	Confident	77	Confident	14 Å²	14	64 Å²	64	12%	0.116	37%	0.366	C	S	.	.			trans	-82.8	149.3	176.9	0	0	0	0	0	111.7	V646 S956	V646-A950 HydrophobicContact CG1-CB 4.28Å; V646-A950 CarbonylContact O-C 3.51Å; V646-A950 WeakPolarHBondContact O-CA 3.33Å; A950-S956 PolarHBondContact N-O 3.24Å
951	V	71.3	Confident	76.9	Confident	95 Å²	95	63.3 Å²	63.3	58%	0.576	36%	0.358	S	S	*	.	S	Bend	trans	-80.7	-33.3	-172.3	175.9	0	0	0	0	113.2	V646 A648	V646-V951 WeakPolarHBondContact O-CG2 3.27Å; V646-V951 PolarHBondContact O-N 3.33Å; A648-V951 HydrophobicContact CB-CG2 4.24Å
952	A	62.3	Low	77	Confident	99 Å²	99	61.7 Å²	61.7	82%	0.818	35%	0.347	S	S	*	.	S	Bend	trans	-148.7	-21.5	-173.7	0	0	0	0	0	116.8
953	S	53.9	Low	76.8	Confident	54 Å²	54	61.7 Å²	61.7	38%	0.378	35%	0.348	S	S	.	.	S	Bend	trans	-88.4	157	-175.6	47.1	0	0	0	0	113.4	P955	S953-P955 CarbonylContact O-C 3.6Å
954	K	54.2	Low	76.8	Confident	207 Å²	207	61.2 Å²	61.2	90%	0.9	35%	0.345	S	S	*	.	S	Bend	trans	-91.7	134.1	158.6	-75.8	-177.9	177.5	177.1	0	108
955	P	54.8	Low	76.9	Confident	91 Å²	91	58.7 Å²	58.7	59%	0.591	33%	0.334	S	S	*	.	S	Bend	cis	-74.1	141.5	1.9	31.2	-35.6	0	0	0	113.2	S953 R957	S953-P955 CarbonylContact O-C 3.6Å; P955-R957 PolarHBondContact O-N 3.26Å
956	S	64.8	Low	77.1	Confident	77 Å²	77	54.5 Å²	54.5	54%	0.538	31%	0.312	S	S	.	.	S	Bend	trans	-72.4	-9.8	-178.5	52	0	0	0	0	114.2	A950	A950-S956 PolarHBondContact N-O 3.24Å
957	R	74.6	Confident	77.3	Confident	157 Å²	157	53.7 Å²	53.7	59%	0.592	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.2	139.6	173.8	-55	-163.1	-165.7	176.4	4.2	109.5	E947 F948 P955	E947-R957 IonicContact OE1-NH1 3.9Å; E947-R957 WeakPolarHBondContact OE2-CD 3.38Å; E947-R957 IonicContact OE2-CZ 3.26Å; E947-R957 IonicContact OE2-NE 2.76Å; E947-R957 IonicContact OE2-NH1 3.2Å; E947-R957 PolarHBondContact OE2-NH1 2.96Å; F948-R957 CarbonylContact O-C 3.11Å; F948-R957 VanDerWaalsContact O-CA 3.29Å; F948-R957 WeakPolarHBondContact O-CA 3.33Å; P955-R957 PolarHBondContact O-N 3.26Å
958	I	78	Confident	77.6	Confident	20 Å²	20	50.7 Å²	50.7	10%	0.103	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	124.3	177.4	-62.6	166.3	0	0	0	106.6	L631 E634 I635 I647 E947 F948	L631-I958 HydrophobicContact CD2-CG2 4.07Å; E634-I958 HydrophobicContact CB-CG2 4.14Å; I635-I958 HydrophobicContact CD1-CD1 3.88Å; I635-I958 HydrophobicContact CG1-CD1 3.68Å; I647-I958 HydrophobicContact CD1-CD1 4.25Å; E947-I958 WeakPolarHBondContact CA-O 3.49Å; F948-I958 PolarHBondContact N-O 3.21Å; F948-I958 PolarHBondContact O-N 2.91Å
959	S	82.3	Confident	77.9	Confident	65 Å²	65	51 Å²	51	46%	0.455	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	116.9	-176	171.1	0	0	0	0	110.4	I946	I946-S959 WeakPolarHBondContact O-CA 3.49Å
960	I	84	Confident	78.5	Confident	8 Å²	8	47.6 Å²	47.6	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	132.2	176.3	-76.1	165.6	0	0	0	110.4	A630 L631 E634 N945 I946 F948 Y962 A965	A630-I960 HydrophobicContact CB-CD1 3.73Å; A630-I960 HydrophobicContact CB-CG1 4.3Å; A630-I960 HydrophobicContact CB-CG2 4.01Å; L631-I960 HydrophobicContact CB-CD1 4.25Å; L631-I960 HydrophobicContact CD2-CD1 3.38Å; L631-I960 HydrophobicContact CD2-CG1 4.48Å; L631-I960 HydrophobicContact CG-CD1 3.45Å; L631-I960 VanDerWaalsContact CG-CD1 3.45Å; E634-I960 HydrophobicContact CG-CG1 4.29Å; N945-I960 CarbonylContact C-O 3.58Å; N945-I960 WeakPolarHBondContact CA-O 3.38Å; I946-I960 PolarHBondContact N-O 2.75Å; I946-I960 PolarHBondContact O-N 3.07Å; F948-I960 HydrophobicContact CD2-CD1 4.47Å; F948-I960 HydrophobicContact CE2-CD1 4.17Å; I960-Y962 PolarHBondContact O-N 2.79Å; I960-A965 HydrophobicContact CG2-CB 3.98Å
961	S	87.6	Confident	79.2	Confident	24 Å²	24	47 Å²	47	17%	0.168	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	110.6	165.8	-172.7	0	0	0	0	109.7	N945 G964 A965	N945-S961 WeakPolarHBondContact OD1-CA 3.42Å; N945-S961 WeakPolarHBondContact OD1-CB 3.34Å; N945-S961 PolarHBondContact OD1-OG 3.26Å; S961-G964 PolarHBondContact O-N 3.18Å; S961-G964 VanDerWaalsContact O-N 3.16Å; S961-A965 PolarHBondContact O-N 2.9Å
962	Y	90.6	Very high	80	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-37.2	-179.6	-176.5	-103.4	0	0	0	114.1	C626 I627 V659 F942 P943 Q944 I946 I960 G964 A965 L966	C626-Y962 HydrophobicContact CB-CE2 4.28Å; I627-Y962 HydrophobicContact CG1-CD2 4.36Å; V659-Y962 HydrophobicContact CG1-CD2 4.29Å; V659-Y962 HydrophobicContact CG1-CE1 4.27Å; V659-Y962 HydrophobicContact CG1-CE2 3.92Å; F942-Y962 AromaticContact CE1-CD1 3.77Å; F942-Y962 HydrophobicContact CE1-CD1 3.77Å; F942-Y962 HydrophobicContact CE1-CE1 4.11Å; F942-Y962 HydrophobicContact CZ-CD1 4.04Å; F942-Y962 AromaticContact CZ-CE1 3.88Å; F942-Y962 HydrophobicContact CZ-CE1 3.88Å; P943-Y962 HydrophobicContact CB-CD1 3.69Å; P943-Y962 HydrophobicContact CB-CE1 4.36Å; P943-Y962 HydrophobicContact CB-CG 4.07Å; P943-Y962 HydrophobicContact CG-CD1 4.06Å; P943-Y962 HydrophobicContact CG-CE1 4.25Å; Q944-Y962 WeakPolarHBondContact O-CB 3.49Å; Q944-Y962 PolarHBondContact O-N 2.99Å; I946-Y962 HydrophobicContact CD1-CD2 4.29Å; I946-Y962 HydrophobicContact CD1-CG 4.3Å; I960-Y962 PolarHBondContact O-N 2.79Å; Y962-G964 VanDerWaalsContact C-N 3.29Å; Y962-G964 PolarHBondContact O-N 2.88Å; Y962-A965 PolarHBondContact O-N 3.35Å; Y962-L966 WeakPolarHBondContact O-CB 3.28Å; Y962-L966 PolarHBondContact O-N 3.4Å
963	P	89	Confident	81.2	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.032	24%	0.238	C	C	.	.	H	α-helix	trans	-57.6	-40.5	170.5	-24.5	34.1	0	0	0	112.9	L681 L938 F942 P943 L967	L681-P963 HydrophobicContact CD2-CB 4.45Å; L938-P963 HydrophobicContact CD1-CB 4.2Å; L938-P963 HydrophobicContact CD1-CG 3.95Å; F942-P963 HydrophobicContact CD1-CG 4.23Å; F942-P963 HydrophobicContact CE1-CG 4.03Å; P943-P963 WeakPolarHBondContact O-CD 3.4Å; P963-L967 PolarHBondContact O-N 3.14Å
964	G	88.2	Confident	83	Confident	4 Å²	4	48.6 Å²	48.6	4%	0.041	25%	0.249	C	C	.	.	H	α-helix	trans	-67.9	-46.1	174.9	0	0	0	0	0	112.4	S961 Y962 L966 L967 N968	S961-G964 PolarHBondContact O-N 3.18Å; S961-G964 VanDerWaalsContact O-N 3.16Å; Y962-G964 VanDerWaalsContact C-N 3.29Å; Y962-G964 PolarHBondContact O-N 2.88Å; G964-L966 VanDerWaalsContact C-N 3.3Å; G964-L966 PolarHBondContact O-N 3.09Å; G964-L967 PolarHBondContact O-N 3.18Å; G964-N968 VanDerWaalsContact O-CB 3.31Å; G964-N968 WeakPolarHBondContact O-CB 3.35Å; G964-N968 PolarHBondContact O-N 3.49Å; G964-N968 PolarHBondContact O-ND2 3.32Å
965	A	88.4	Confident	84.8	Confident	5 Å²	5	40 Å²	40	4%	0.041	21%	0.212	C	C	.	.	H	α-helix	trans	-58	-40.8	176.5	0	0	0	0	0	112.4	A630 I960 S961 Y962 N968 I969	A630-A965 HydrophobicContact CB-CB 3.8Å; I960-A965 HydrophobicContact CG2-CB 3.98Å; S961-A965 PolarHBondContact O-N 2.9Å; Y962-A965 PolarHBondContact O-N 3.35Å; A965-N968 PolarHBondContact O-N 3.41Å; A965-I969 PolarHBondContact O-N 3.48Å
966	L	89.2	Confident	86.6	Confident	10 Å²	10	36.5 Å²	36.5	5%	0.052	19%	0.189	C	C	.	.	H	α-helix	trans	-60.5	-53	175.2	170.8	57.6	0	0	0	112.2	L619 I919 I923 F942 Y962 G964 N968 I969 M970	L619-L966 HydrophobicContact CD1-CD1 4.45Å; L619-L966 HydrophobicContact CD1-CD2 3.65Å; L619-L966 HydrophobicContact CD2-CD1 3.47Å; L619-L966 VanDerWaalsContact CD2-CD1 3.47Å; L619-L966 HydrophobicContact CD2-CD2 4.12Å; L619-L966 HydrophobicContact CD2-CG 4.46Å; I919-L966 HydrophobicContact CG2-CD2 4.12Å; I923-L966 HydrophobicContact CD1-CD2 3.85Å; F942-L966 HydrophobicContact CZ-CD2 4.35Å; Y962-L966 WeakPolarHBondContact O-CB 3.28Å; Y962-L966 PolarHBondContact O-N 3.4Å; G964-L966 VanDerWaalsContact C-N 3.3Å; G964-L966 PolarHBondContact O-N 3.09Å; L966-N968 VanDerWaalsContact C-N 3.28Å; L966-N968 PolarHBondContact O-N 3.34Å; L966-I969 PolarHBondContact O-N 2.94Å; L966-M970 PolarHBondContact O-N 2.87Å; L966-M970 VanDerWaalsContact O-N 3.14Å
967	L	90.8	Very high	88	Confident	3 Å²	3	32.9 Å²	32.9	2%	0.016	16%	0.163	C	C	.	.	H	α-helix	trans	-66.6	-32.2	179.4	-66.4	-175.7	0	0	0	111.9	L681 I919 P963 G964 M970 V971 F1001	L681-L967 HydrophobicContact CB-CD1 4.08Å; L681-L967 HydrophobicContact CD1-CD1 3.78Å; L681-L967 HydrophobicContact CG-CD1 4.47Å; I919-L967 HydrophobicContact CD1-CD2 4.42Å; P963-L967 PolarHBondContact O-N 3.14Å; G964-L967 PolarHBondContact O-N 3.18Å; L967-M970 WeakPolarHBondContact O-CB 3.39Å; L967-M970 PolarHBondContact O-N 2.9Å; L967-V971 WeakPolarHBondContact O-CG2 3.33Å; L967-V971 PolarHBondContact O-N 2.99Å; L967-F1001 HydrophobicContact CB-CB 4.48Å; L967-F1001 HydrophobicContact CB-CD2 3.49Å; L967-F1001 VanDerWaalsContact CB-CD2 3.49Å; L967-F1001 HydrophobicContact CB-CE2 3.78Å; L967-F1001 HydrophobicContact CB-CG 3.95Å; L967-F1001 HydrophobicContact CB-CZ 4.45Å; L967-F1001 HydrophobicContact CD1-CD1 3.89Å; L967-F1001 HydrophobicContact CD1-CD2 4.18Å; L967-F1001 HydrophobicContact CD1-CE1 3.84Å; L967-F1001 HydrophobicContact CD1-CE2 4.13Å; L967-F1001 HydrophobicContact CD1-CG 4.06Å; L967-F1001 HydrophobicContact CD1-CZ 3.96Å; L967-F1001 HydrophobicContact CG-CD2 4.48Å; L967-F1001 HydrophobicContact CG-CE2 4.5Å
968	N	90.8	Very high	88.9	Confident	43 Å²	43	31.2 Å²	31.2	23%	0.23	16%	0.162	C	C	.	.	H	α-helix	trans	-65.2	-36.6	174.2	-72.7	-22.5	0	0	0	112.7	G964 A965 L966 V971 Q972 Y1000 F1001	G964-N968 VanDerWaalsContact O-CB 3.31Å; G964-N968 WeakPolarHBondContact O-CB 3.35Å; G964-N968 PolarHBondContact O-N 3.49Å; G964-N968 PolarHBondContact O-ND2 3.32Å; A965-N968 PolarHBondContact O-N 3.41Å; L966-N968 VanDerWaalsContact C-N 3.28Å; L966-N968 PolarHBondContact O-N 3.34Å; N968-V971 PolarHBondContact O-N 3.45Å; N968-Q972 WeakPolarHBondContact O-CB 3.41Å; N968-Q972 PolarHBondContact O-N 3.26Å; N968-Y1000 WeakPolarHBondContact OD1-CA 3.16Å; N968-F1001 PolarHBondContact OD1-N 3.02Å
969	I	89.1	Confident	89.5	Confident	8 Å²	8	33 Å²	33	4%	0.041	17%	0.17	C	C	.	.	H	α-helix	trans	-65.3	-44.1	170.5	-71.4	-59.4	0	0	0	111.6	C626 R629 A965 L966 V971 Q972 D973	C626-I969 HydrophobicContact CB-CG1 4.09Å; R629-I969 HydrophobicContact CB-CD1 4.02Å; R629-I969 HydrophobicContact CG-CD1 4.34Å; A965-I969 PolarHBondContact O-N 3.48Å; L966-I969 PolarHBondContact O-N 2.94Å; I969-V971 VanDerWaalsContact C-N 3.32Å; I969-V971 PolarHBondContact O-N 3.41Å; I969-Q972 WeakPolarHBondContact O-CB 3.45Å; I969-Q972 PolarHBondContact O-N 3.02Å; I969-Q972 VanDerWaalsContact O-N 3.09Å; I969-D973 PolarHBondContact O-N 3.2Å
970	M	90.5	Very high	90	Very high	10 Å²	10	30.7 Å²	30.7	5%	0.049	15%	0.151	C	C	.	.	H	α-helix	trans	-59.1	-44.5	175	-179.5	-141.7	66.9	0	0	111.2	K915 S916 I919 L966 L967 Q972 D973 F974	K915-M970 VanDerWaalsContact C-SD 3.58Å; K915-M970 HydrophobicContact CB-CE 4.34Å; K915-M970 HydrophobicContact CB-SD 3.62Å; S916-M970 WeakPolarHBondContact OG-CE 3.34Å; I919-M970 HydrophobicContact CD1-CB 3.9Å; I919-M970 HydrophobicContact CD1-CG 3.68Å; I919-M970 HydrophobicContact CD1-SD 3.65Å; L966-M970 PolarHBondContact O-N 2.87Å; L966-M970 VanDerWaalsContact O-N 3.14Å; L967-M970 WeakPolarHBondContact O-CB 3.39Å; L967-M970 PolarHBondContact O-N 2.9Å; M970-Q972 VanDerWaalsContact C-N 3.27Å; M970-Q972 PolarHBondContact O-N 2.81Å; M970-D973 PolarHBondContact O-N 3.16Å; M970-F974 HydrophobicContact CG-CD2 3.91Å; M970-F974 HydrophobicContact CG-CE2 4.26Å; M970-F974 WeakPolarHBondContact O-CD2 3.18Å; M970-F974 PolarHBondContact O-N 3.02Å; M970-F974 VanDerWaalsContact O-N 3.14Å
971	V	89.9	Confident	90.4	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-60.8	-38.9	174.9	170.6	0	0	0	0	111.2	I912 L967 N968 I969 F975 N997 I999 F1001	I912-V971 HydrophobicContact CG2-CG2 4.17Å; L967-V971 WeakPolarHBondContact O-CG2 3.33Å; L967-V971 PolarHBondContact O-N 2.99Å; N968-V971 PolarHBondContact O-N 3.45Å; I969-V971 VanDerWaalsContact C-N 3.32Å; I969-V971 PolarHBondContact O-N 3.41Å; V971-F975 WeakPolarHBondContact O-CA 3.44Å; V971-F975 WeakPolarHBondContact O-CB 3.23Å; V971-F975 PolarHBondContact O-N 3.3Å; V971-N997 PolarHBondContact O-ND2 3.15Å; V971-I999 HydrophobicContact CG1-CB 3.64Å; V971-I999 HydrophobicContact CG1-CG2 3.69Å; V971-I999 VanDerWaalsContact CG1-O 3.3Å; V971-I999 WeakPolarHBondContact CG1-O 3.35Å; V971-F1001 HydrophobicContact CG2-CD2 4.01Å; V971-F1001 HydrophobicContact CG2-CE2 3.7Å
972	Q	86.3	Confident	90.3	Very high	69 Å²	69	32.2 Å²	32.2	32%	0.322	16%	0.156	S	C	.	.	H	α-helix	trans	-69.2	-42.6	178.3	-162.7	177.2	29.4	0	0	112.8	R629 N968 I969 M970 T976	R629-Q972 VanDerWaalsContact NH1-CD 3.29Å; N968-Q972 WeakPolarHBondContact O-CB 3.41Å; N968-Q972 PolarHBondContact O-N 3.26Å; I969-Q972 WeakPolarHBondContact O-CB 3.45Å; I969-Q972 PolarHBondContact O-N 3.02Å; I969-Q972 VanDerWaalsContact O-N 3.09Å; M970-Q972 VanDerWaalsContact C-N 3.27Å; M970-Q972 PolarHBondContact O-N 2.81Å; Q972-T976 WeakPolarHBondContact CA-OG1 3.06Å; Q972-T976 VanDerWaalsContact O-CB 3.25Å; Q972-T976 WeakPolarHBondContact O-CB 3.41Å; Q972-T976 PolarHBondContact O-OG1 3.48Å
973	D	89	Confident	90.1	Very high	75 Å²	75	35.3 Å²	35.3	40%	0.401	17%	0.171	S	C	.	.	H	α-helix	trans	-71.6	-34.6	-176.9	-75.9	-14.3	0	0	0	112.9	R625 I969 M970	R625-D973 IonicContact CZ-OD1 3.36Å; R625-D973 IonicContact CZ-OD2 3.42Å; R625-D973 VanDerWaalsContact CZ-OD2 3.24Å; R625-D973 IonicContact NH1-OD1 3.23Å; R625-D973 PolarHBondContact NH1-OD1 3.29Å; R625-D973 IonicContact NH1-OD2 3.67Å; R625-D973 PolarHBondContact NH1-OD2 3.26Å; R625-D973 IonicContact NH2-OD1 3.66Å; R625-D973 IonicContact NH2-OD2 3.27Å; R625-D973 PolarHBondContact NH2-OD2 3.44Å; I969-D973 PolarHBondContact O-N 3.2Å; M970-D973 PolarHBondContact O-N 3.16Å
974	F	90	Very high	89.8	Confident	138 Å²	138	39.7 Å²	39.7	61%	0.605	20%	0.198	S	C	*	.	H	α-helix	trans	-101.3	-23.6	-175.2	-69.8	-75.2	0	0	0	115	M970	M970-F974 HydrophobicContact CG-CD2 3.91Å; M970-F974 HydrophobicContact CG-CE2 4.26Å; M970-F974 WeakPolarHBondContact O-CD2 3.18Å; M970-F974 PolarHBondContact O-N 3.02Å; M970-F974 VanDerWaalsContact O-N 3.14Å
975	F	93.7	Very high	89.4	Confident	28 Å²	28	42.1 Å²	42.1	12%	0.123	21%	0.21	C	C	.	.	H	α-helix	trans	-124.3	4.7	-169.7	-56.5	-88.2	0	0	0	115.3	T693 T908 N911 I912 V971 I999	T693-F975 WeakPolarHBondContact CG2-O 3.31Å; T908-F975 HydrophobicContact CG2-CD1 3.82Å; T908-F975 HydrophobicContact CG2-CE1 4.15Å; N911-F975 HydrophobicContact CB-CE1 4.06Å; N911-F975 HydrophobicContact CB-CZ 4.09Å; I912-F975 HydrophobicContact CB-CE2 4.47Å; I912-F975 HydrophobicContact CB-CZ 4.36Å; I912-F975 HydrophobicContact CD1-CD1 4.33Å; I912-F975 HydrophobicContact CD1-CE1 4.5Å; I912-F975 HydrophobicContact CD1-CG 4.44Å; I912-F975 HydrophobicContact CG1-CD1 3.89Å; I912-F975 HydrophobicContact CG1-CD2 3.88Å; I912-F975 HydrophobicContact CG1-CE1 3.69Å; I912-F975 HydrophobicContact CG1-CE2 3.67Å; I912-F975 HydrophobicContact CG1-CG 3.97Å; I912-F975 HydrophobicContact CG1-CZ 3.57Å; V971-F975 WeakPolarHBondContact O-CA 3.44Å; V971-F975 WeakPolarHBondContact O-CB 3.23Å; V971-F975 PolarHBondContact O-N 3.3Å; F975-I999 HydrophobicContact CB-CD1 4.41Å
976	T	92.5	Very high	88.9	Confident	17 Å²	17	49.4 Å²	49.4	10%	0.104	24%	0.243	C	C	.	.			trans	-66.2	142.1	173.1	-62.6	0	0	0	0	112	R723 Q972 N997	R723-T976 PolarHBondContact NH2-O 3Å; Q972-T976 WeakPolarHBondContact CA-OG1 3.06Å; Q972-T976 VanDerWaalsContact O-CB 3.25Å; Q972-T976 WeakPolarHBondContact O-CB 3.41Å; Q972-T976 PolarHBondContact O-OG1 3.48Å; T976-N997 HydrophobicContact CG2-CB 4.28Å; T976-N997 PolarHBondContact N-ND2 3.27Å; T976-N997 PolarHBondContact OG1-ND2 3.4Å
977	N	94	Very high	88.2	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	95.9	175.5	-179.6	9	0	0	0	111.1	T693 R723 Q813 Q979 Y980 S995 E996	T693-N977 HydrophobicContact CG2-CB 4.25Å; T693-N977 WeakPolarHBondContact O-CB 3.4Å; T693-N977 PolarHBondContact O-ND2 2.65Å; R723-N977 WeakPolarHBondContact CD-OD1 3.26Å; R723-N977 PolarHBondContact NH1-OD1 2.93Å; Q813-N977 PolarHBondContact OE1-ND2 3.15Å; N977-Q979 PolarHBondContact O-N 3.08Å; N977-Q979 WeakPolarHBondContact OD1-CB 3.46Å; N977-Q979 PolarHBondContact OD1-N 3.06Å; N977-Y980 PolarHBondContact OD1-N 2.59Å; N977-S995 WeakPolarHBondContact O-CA 3.5Å; N977-E996 PolarHBondContact N-O 2.99Å; N977-E996 PolarHBondContact O-N 2.88Å
978	H	92.3	Very high	87.8	Confident	123 Å²	123	61.9 Å²	61.9	57%	0.569	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	2	175.7	-57.6	-61.9	0	0	0	114.6	S995	H978-S995 PolarHBondContact ND1-OG 2.9Å
979	Q	92.1	Very high	87.3	Confident	56 Å²	56	62.2 Å²	62.2	26%	0.262	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	4.7	-174.2	-65.6	168.5	-53.2	0	0	112.9	R723 Q813 N977 H981	R723-Q979 VanDerWaalsContact CG-OE1 3.31Å; R723-Q979 VanDerWaalsContact NH1-OE1 3.14Å; Q813-Q979 WeakPolarHBondContact CB-O 3.37Å; Q813-Q979 HydrophobicContact CG-CB 4.17Å; Q813-Q979 WeakPolarHBondContact CG-O 3.15Å; N977-Q979 PolarHBondContact O-N 3.08Å; N977-Q979 WeakPolarHBondContact OD1-CB 3.46Å; N977-Q979 PolarHBondContact OD1-N 3.06Å; Q979-H981 PolarHBondContact O-N 3.49Å; Q979-H981 VanDerWaalsContact O-N 3.09Å; Q979-H981 PolarHBondContact O-ND1 3.31Å
980	Y	92.4	Very high	87	Confident	18 Å²	18	65.2 Å²	65.2	7%	0.071	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	113.1	-174	-162.7	-77.4	0	0	0	110.6	L692 R695 N977 I993 R994 E996	L692-Y980 WeakPolarHBondContact O-CE2 3.46Å; R695-Y980 HydrophobicContact CB-CD2 4.04Å; R695-Y980 HydrophobicContact CB-CE2 3.62Å; R695-Y980 HydrophobicContact CG-CD2 4.34Å; R695-Y980 HydrophobicContact CG-CE2 3.63Å; N977-Y980 PolarHBondContact OD1-N 2.59Å; Y980-I993 WeakPolarHBondContact O-CA 3.37Å; Y980-R994 HydrophobicContact CD1-CG 4.44Å; Y980-R994 PolarHBondContact N-O 3.28Å; Y980-R994 PolarHBondContact O-N 3.22Å; Y980-E996 HydrophobicContact CD2-CB 3.6Å; Y980-E996 HydrophobicContact CD2-CG 3.72Å; Y980-E996 HydrophobicContact CE2-CB 4.35Å; Y980-E996 HydrophobicContact CE2-CG 3.97Å; Y980-E996 HydrophobicContact CG-CB 3.73Å; Y980-E996 HydrophobicContact CG-CG 4.23Å
981	H	91.1	Very high	86.8	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	132	174.3	-70.4	59.6	0	0	0	110.3	R695 Q813 R814 Q979 Y991 K992	R695-H981 PolarHBondContact NE-O 2.83Å; R695-H981 VanDerWaalsContact NE-O 3.11Å; Q813-H981 HydrophobicContact CB-CB 4.4Å; Q813-H981 WeakPolarHBondContact O-CB 3.42Å; R814-H981 HydrophobicContact CG-CB 3.89Å; R814-H981 PolarHBondContact NE-CD2 3.01Å; R814-H981 PolarHBondContact NE-NE2 3.02Å; R814-H981 PolarHBondContact NH2-NE2 2.81Å; R814-H981 VanDerWaalsContact NH2-NE2 3.17Å; Q979-H981 PolarHBondContact O-N 3.49Å; Q979-H981 VanDerWaalsContact O-N 3.09Å; Q979-H981 PolarHBondContact O-ND1 3.31Å; H981-Y991 HydrophobicContact CB-CD1 3.99Å; H981-K992 WeakPolarHBondContact CA-O 3.35Å
982	E	86.8	Confident	86.7	Confident	64 Å²	64	73 Å²	73	30%	0.299	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	126.7	176.5	-179.5	169.7	-112.1	0	0	108.7	V984 Y991 K992 R994	E982-V984 PolarHBondContact O-N 2.95Å; E982-Y991 CarbonylContact O-C 3.56Å; E982-Y991 VanDerWaalsContact O-CA 3.24Å; E982-Y991 WeakPolarHBondContact O-CA 3.17Å; E982-K992 PolarHBondContact N-O 3.02Å; E982-K992 PolarHBondContact O-N 3.37Å; E982-R994 IonicContact OE1-CZ 3.19Å; E982-R994 IonicContact OE1-NH1 3.09Å; E982-R994 PolarHBondContact OE1-NH1 3.29Å; E982-R994 IonicContact OE1-NH2 2.67Å; E982-R994 IonicContact OE2-CZ 2.73Å; E982-R994 IonicContact OE2-NH1 2.65Å; E982-R994 PolarHBondContact OE2-NH1 3.22Å
983	L	85.5	Confident	86.9	Confident	64 Å²	64	73.6 Å²	73.6	34%	0.335	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	114.3	176.1	180	60.5	0	0	0	108.3	D985 Q986 Y991	L983-D985 VanDerWaalsContact CD1-O 3.26Å; L983-D985 WeakPolarHBondContact CD1-O 3.37Å; L983-Q986 HydrophobicContact CD2-CG 4.02Å; L983-Q986 HydrophobicContact CG-CG 4.42Å; L983-Y991 HydrophobicContact CB-CD1 4.07Å; L983-Y991 HydrophobicContact CB-CE1 3.81Å; L983-Y991 HydrophobicContact CD1-CD1 4.42Å; L983-Y991 HydrophobicContact CD1-CD2 4.26Å; L983-Y991 HydrophobicContact CD1-CE1 4.13Å; L983-Y991 HydrophobicContact CD1-CE2 3.93Å; L983-Y991 HydrophobicContact CD1-CG 4.49Å; L983-Y991 HydrophobicContact CG-CE1 4.47Å
984	V	83.2	Confident	87	Confident	97 Å²	97	73.3 Å²	73.3	59%	0.588	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	-38.1	-175.2	179.6	0	0	0	0	111.3	E982 T990 K992	E982-V984 PolarHBondContact O-N 2.95Å; V984-T990 PolarHBondContact N-O 3.22Å; V984-K992 HydrophobicContact CG2-CB 3.57Å
985	D	80.2	Confident	86.9	Confident	56 Å²	56	70.2 Å²	70.2	30%	0.299	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	126.8	175.4	170.4	23	0	0	0	110	L983 E987 T988 L989 T990	L983-D985 VanDerWaalsContact CD1-O 3.26Å; L983-D985 WeakPolarHBondContact CD1-O 3.37Å; D985-E987 PolarHBondContact OD1-N 3.01Å; D985-T988 VanDerWaalsContact OD2-CB 3.25Å; D985-T988 WeakPolarHBondContact OD2-CB 3.09Å; D985-T988 WeakPolarHBondContact OD2-CG2 3.34Å; D985-T988 PolarHBondContact OD2-N 2.91Å; D985-T988 PolarHBondContact OD2-OG1 2.91Å; D985-L989 WeakPolarHBondContact O-CA 3.23Å; D985-L989 PolarHBondContact O-N 3.35Å; D985-T990 PolarHBondContact O-N 3.27Å
986	Q	76.4	Confident	86.7	Confident	158 Å²	158	70.3 Å²	70.3	74%	0.738	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-23.4	-178.2	-60	-173.7	2.6	0	0	112.8	L983	L983-Q986 HydrophobicContact CD2-CG 4.02Å; L983-Q986 HydrophobicContact CG-CG 4.42Å
987	E	76.3	Confident	86.6	Confident	185 Å²	185	70.5 Å²	70.5	86%	0.864	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-41.3	-179.7	-63.6	-169	174.2	0	0	111.6	D985	D985-E987 PolarHBondContact OD1-N 3.01Å
988	T	80.8	Confident	86.3	Confident	89 Å²	89	71 Å²	71	55%	0.546	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-4	174.2	63.3	0	0	0	0	114.5	D985 T990	D985-T988 VanDerWaalsContact OD2-CB 3.25Å; D985-T988 WeakPolarHBondContact OD2-CB 3.09Å; D985-T988 WeakPolarHBondContact OD2-CG2 3.34Å; D985-T988 PolarHBondContact OD2-N 2.91Å; D985-T988 PolarHBondContact OD2-OG1 2.91Å; T988-T990 PolarHBondContact O-N 3.33Å; T988-T990 WeakPolarHBondContact OG1-CG2 3.15Å; T988-T990 PolarHBondContact OG1-OG1 3.1Å
989	L	80.7	Confident	86.2	Confident	50 Å²	50	65.2 Å²	65.2	26%	0.262	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	36.2	-174.7	-60.5	171.7	0	0	0	113.4	V170 F714 D985 Y991	V170-L989 HydrophobicContact CB-CD1 4.48Å; F714-L989 HydrophobicContact CZ-CB 4.34Å; F714-L989 HydrophobicContact CZ-CD1 4.44Å; D985-L989 WeakPolarHBondContact O-CA 3.23Å; D985-L989 PolarHBondContact O-N 3.35Å; L989-Y991 VanDerWaalsContact O-CD2 3.22Å; L989-Y991 WeakPolarHBondContact O-CD2 3.28Å; L989-Y991 WeakPolarHBondContact O-CE2 3.47Å
990	T	82.3	Confident	85.9	Confident	72 Å²	72	68.3 Å²	68.3	44%	0.442	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	127.9	-176	48.2	0	0	0	0	112.4	V984 D985 T988	V984-T990 PolarHBondContact N-O 3.22Å; D985-T990 PolarHBondContact O-N 3.27Å; T988-T990 PolarHBondContact O-N 3.33Å; T988-T990 WeakPolarHBondContact OG1-CG2 3.15Å; T988-T990 PolarHBondContact OG1-OG1 3.1Å
991	Y	86.1	Confident	85.8	Confident	46 Å²	46	68 Å²	68	18%	0.18	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	132.8	-177.4	-67.9	-98.6	0	0	0	111.8	F714 R814 H981 E982 L983 L989	F714-Y991 HydrophobicContact CZ-CE2 4.25Å; R814-Y991 HydrophobicContact CB-CD1 4.44Å; R814-Y991 HydrophobicContact CB-CE1 3.87Å; R814-Y991 HydrophobicContact CG-CD1 4.05Å; R814-Y991 HydrophobicContact CG-CE1 3.97Å; R814-Y991 HydrophobicContact CG-CG 4.4Å; R814-Y991 PolarHBondContact O-OH 3.4Å; H981-Y991 HydrophobicContact CB-CD1 3.99Å; E982-Y991 CarbonylContact O-C 3.56Å; E982-Y991 VanDerWaalsContact O-CA 3.24Å; E982-Y991 WeakPolarHBondContact O-CA 3.17Å; L983-Y991 HydrophobicContact CB-CD1 4.07Å; L983-Y991 HydrophobicContact CB-CE1 3.81Å; L983-Y991 HydrophobicContact CD1-CD1 4.42Å; L983-Y991 HydrophobicContact CD1-CD2 4.26Å; L983-Y991 HydrophobicContact CD1-CE1 4.13Å; L983-Y991 HydrophobicContact CD1-CE2 3.93Å; L983-Y991 HydrophobicContact CD1-CG 4.49Å; L983-Y991 HydrophobicContact CG-CE1 4.47Å; L989-Y991 VanDerWaalsContact O-CD2 3.22Å; L989-Y991 WeakPolarHBondContact O-CD2 3.28Å; L989-Y991 WeakPolarHBondContact O-CE2 3.47Å
992	K	88.8	Confident	85.4	Confident	128 Å²	128	72.2 Å²	72.2	56%	0.557	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	134.8	166.4	-179.4	179.4	179.3	-175.9	0	109.1	H981 E982 V984	H981-K992 WeakPolarHBondContact CA-O 3.35Å; E982-K992 PolarHBondContact N-O 3.02Å; E982-K992 PolarHBondContact O-N 3.37Å; V984-K992 HydrophobicContact CG2-CB 3.57Å
993	I	90.2	Very high	85.3	Confident	81 Å²	81	71.2 Å²	71.2	42%	0.415	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.1	170.6	-51.3	-179.5	0	0	0	108	S720 Y980	S720-I993 WeakPolarHBondContact OG-CD1 3.42Å; Y980-I993 WeakPolarHBondContact O-CA 3.37Å
994	R	90.7	Very high	85.2	Confident	70 Å²	70	72.1 Å²	72.1	26%	0.264	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	168.7	170.6	72.9	164.8	179.6	-112.9	-2.6	112.2	Y980 E982 E996	Y980-R994 HydrophobicContact CD1-CG 4.44Å; Y980-R994 PolarHBondContact N-O 3.28Å; Y980-R994 PolarHBondContact O-N 3.22Å; E982-R994 IonicContact OE1-CZ 3.19Å; E982-R994 IonicContact OE1-NH1 3.09Å; E982-R994 PolarHBondContact OE1-NH1 3.29Å; E982-R994 IonicContact OE1-NH2 2.67Å; E982-R994 IonicContact OE2-CZ 2.73Å; E982-R994 IonicContact OE2-NH1 2.65Å; E982-R994 PolarHBondContact OE2-NH1 3.22Å; R994-E996 IonicContact CZ-OE2 2.73Å; R994-E996 IonicContact NE-OE2 2.88Å; R994-E996 PolarHBondContact NE-OE2 3.05Å; R994-E996 IonicContact NH2-OE2 2.85Å; R994-E996 PolarHBondContact NH2-OE2 3.05Å
995	S	87.8	Confident	85.3	Confident	72 Å²	72	68.9 Å²	68.9	50%	0.503	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	127.5	162.5	-60.8	0	0	0	0	109.1	N977 H978	N977-S995 WeakPolarHBondContact O-CA 3.5Å; H978-S995 PolarHBondContact ND1-OG 2.9Å
996	E	90.9	Very high	85.7	Confident	31 Å²	31	68.4 Å²	68.4	15%	0.145	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	134.7	177.6	-178.5	70	-134.8	0	0	109.5	N977 Y980 R994 S998	N977-E996 PolarHBondContact N-O 2.99Å; N977-E996 PolarHBondContact O-N 2.88Å; Y980-E996 HydrophobicContact CD2-CB 3.6Å; Y980-E996 HydrophobicContact CD2-CG 3.72Å; Y980-E996 HydrophobicContact CE2-CB 4.35Å; Y980-E996 HydrophobicContact CE2-CG 3.97Å; Y980-E996 HydrophobicContact CG-CB 3.73Å; Y980-E996 HydrophobicContact CG-CG 4.23Å; R994-E996 IonicContact CZ-OE2 2.73Å; R994-E996 IonicContact NE-OE2 2.88Å; R994-E996 PolarHBondContact NE-OE2 3.05Å; R994-E996 IonicContact NH2-OE2 2.85Å; R994-E996 PolarHBondContact NH2-OE2 3.05Å; E996-S998 PolarHBondContact OE1-OG 3.32Å
997	N	90.2	Very high	86.6	Confident	21 Å²	21	62 Å²	62	11%	0.112	32%	0.319	C	S	.	.			trans	-154.9	122.2	164.5	-163.4	-21.9	0	0	0	108.8	T693 V971 T976 I999 Y1000	T693-N997 HydrophobicContact CG2-CB 4.38Å; V971-N997 PolarHBondContact O-ND2 3.15Å; T976-N997 HydrophobicContact CG2-CB 4.28Å; T976-N997 PolarHBondContact N-ND2 3.27Å; T976-N997 PolarHBondContact OG1-ND2 3.4Å; N997-I999 WeakPolarHBondContact OD1-CB 3.32Å; N997-I999 PolarHBondContact OD1-N 2.91Å; N997-Y1000 PolarHBondContact O-OH 3.39Å; N997-Y1000 VanDerWaalsContact O-OH 3.06Å
998	S	86.6	Confident	87.3	Confident	11 Å²	11	55.2 Å²	55.2	8%	0.077	29%	0.287	C	S	.	.			trans	-112.5	3.2	178.7	-85.3	0	0	0	0	112.5	N689 T693 R827 E996 Y1000	N689-S998 VanDerWaalsContact CB-O 3.25Å; N689-S998 WeakPolarHBondContact CB-O 3.45Å; N689-S998 PolarHBondContact ND2-O 3.1Å; N689-S998 PolarHBondContact OD1-O 3.5Å; T693-S998 PolarHBondContact OG1-N 3.01Å; R827-S998 PolarHBondContact NH1-OG 3.19Å; E996-S998 PolarHBondContact OE1-OG 3.32Å; S998-Y1000 VanDerWaalsContact O-CD2 3.28Å; S998-Y1000 WeakPolarHBondContact O-CD2 3.48Å; S998-Y1000 WeakPolarHBondContact O-CE2 3.34Å
999	I	90.5	Very high	87.9	Confident	1 Å²	1	51 Å²	51	1%	0.005	26%	0.261	C	S	.	.			trans	-90.4	124.7	-174.3	-53.5	160.5	0	0	0	109.2	V683 N689 I690 T693 I912 V971 F975 N997	V683-I999 HydrophobicContact CG1-CG2 3.59Å; N689-I999 HydrophobicContact CB-CG1 4.12Å; I690-I999 HydrophobicContact CB-CD1 4.45Å; I690-I999 HydrophobicContact CG1-CD1 3.72Å; I690-I999 HydrophobicContact CG1-CG1 4.11Å; T693-I999 HydrophobicContact CG2-CD1 4.23Å; I912-I999 HydrophobicContact CD1-CD1 4.18Å; I912-I999 HydrophobicContact CD1-CG2 4.16Å; V971-I999 HydrophobicContact CG1-CB 3.64Å; V971-I999 HydrophobicContact CG1-CG2 3.69Å; V971-I999 VanDerWaalsContact CG1-O 3.3Å; V971-I999 WeakPolarHBondContact CG1-O 3.35Å; F975-I999 HydrophobicContact CB-CD1 4.41Å; N997-I999 WeakPolarHBondContact OD1-CB 3.32Å; N997-I999 PolarHBondContact OD1-N 2.91Å
1000	Y	86.7	Confident	88.5	Confident	121 Å²	121	48.7 Å²	48.7	48%	0.475	25%	0.249	S	C	.	.			trans	-144.5	150.4	179.1	-50.7	-77.4	0	0	0	111.2	V683 G684 N968 N997 S998	V683-Y1000 CarbonylContact C-O 3.51Å; G684-Y1000 PolarHBondContact N-O 2.91Å; N968-Y1000 WeakPolarHBondContact OD1-CA 3.16Å; N997-Y1000 PolarHBondContact O-OH 3.39Å; N997-Y1000 VanDerWaalsContact O-OH 3.06Å; S998-Y1000 VanDerWaalsContact O-CD2 3.28Å; S998-Y1000 WeakPolarHBondContact O-CD2 3.48Å; S998-Y1000 WeakPolarHBondContact O-CE2 3.34Å
1001	F	89.1	Confident	89	Confident	12 Å²	12	45.3 Å²	45.3	5%	0.053	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	125.3	168.6	-81.3	-91.9	0	0	0	111.2	L681 D682 V683 I912 S916 L967 N968 V971	L681-F1001 HydrophobicContact CB-CD1 4.19Å; L681-F1001 HydrophobicContact CB-CE1 4.4Å; L681-F1001 WeakPolarHBondContact O-CE1 3.33Å; D682-F1001 CarbonylContact O-C 3.58Å; D682-F1001 WeakPolarHBondContact O-CA 3.34Å; D682-F1001 WeakPolarHBondContact O-CD1 3.02Å; V683-F1001 HydrophobicContact CG2-CD1 3.83Å; V683-F1001 HydrophobicContact CG2-CD2 4.15Å; V683-F1001 HydrophobicContact CG2-CE1 3.37Å; V683-F1001 HydrophobicContact CG2-CE2 3.73Å; V683-F1001 HydrophobicContact CG2-CG 4.21Å; V683-F1001 HydrophobicContact CG2-CZ 3.31Å; I912-F1001 HydrophobicContact CG2-CE2 4.02Å; I912-F1001 HydrophobicContact CG2-CZ 4.04Å; S916-F1001 WeakPolarHBondContact OG-CZ 3.48Å; L967-F1001 HydrophobicContact CB-CB 4.48Å; L967-F1001 HydrophobicContact CB-CD2 3.49Å; L967-F1001 VanDerWaalsContact CB-CD2 3.49Å; L967-F1001 HydrophobicContact CB-CE2 3.78Å; L967-F1001 HydrophobicContact CB-CG 3.95Å; L967-F1001 HydrophobicContact CB-CZ 4.45Å; L967-F1001 HydrophobicContact CD1-CD1 3.89Å; L967-F1001 HydrophobicContact CD1-CD2 4.18Å; L967-F1001 HydrophobicContact CD1-CE1 3.84Å; L967-F1001 HydrophobicContact CD1-CE2 4.13Å; L967-F1001 HydrophobicContact CD1-CG 4.06Å; L967-F1001 HydrophobicContact CD1-CZ 3.96Å; L967-F1001 HydrophobicContact CG-CD2 4.48Å; L967-F1001 HydrophobicContact CG-CE2 4.5Å; N968-F1001 PolarHBondContact OD1-N 3.02Å; V971-F1001 HydrophobicContact CG2-CD2 4.01Å; V971-F1001 HydrophobicContact CG2-CE2 3.7Å
1002	E	82.8	Confident	89.3	Confident	88 Å²	88	43.1 Å²	43.1	41%	0.411	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	131	158.3	-69.9	-173	-124.9	0	0	106.9	D682 K834	D682-E1002 PolarHBondContact N-O 2.94Å; D682-E1002 VanDerWaalsContact N-O 3.11Å; D682-E1002 PolarHBondContact O-N 3.44Å; D682-E1002 VanDerWaalsContact O-O 3.06Å; K834-E1002 IonicContact NZ-OE1 3.2Å; K834-E1002 PolarHBondContact NZ-OE1 3.25Å; K834-E1002 IonicContact NZ-OE2 3.87Å; K834-E1002 PolarHBondContact NZ-OE2 3.17Å
1003	V	84.5	Confident	89.4	Confident	43 Å²	43	37.4 Å²	37.4	26%	0.261	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	121.4	177.9	177.2	0	0	0	0	109.1	Y679 L681	Y679-V1003 HydrophobicContact CD1-CG1 3.62Å; Y679-V1003 HydrophobicContact CE1-CG1 3.84Å; Y679-V1003 HydrophobicContact CG-CG1 4.45Å; L681-V1003 HydrophobicContact CD2-CB 4.41Å; L681-V1003 HydrophobicContact CD2-CG1 3.94Å; L681-V1003 HydrophobicContact CD2-CG2 3.97Å
1004	D	84.3	Confident	89.4	Confident	82 Å²	82	33.9 Å²	33.9	44%	0.439	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	143.4	-179.5	-165.5	7	0	0	0	111.6	Y679 H680 Y1007	Y679-D1004 WeakPolarHBondContact CD1-O 3.47Å; H680-D1004 HydrophobicContact CB-CB 4.31Å; H680-D1004 PolarHBondContact N-O 2.89Å; H680-D1004 PolarHBondContact O-N 2.92Å; D1004-Y1007 PolarHBondContact OD1-OH 3.03Å; D1004-Y1007 PolarHBondContact OD2-OH 2.74Å
1005	G	84.5	Confident	89.3	Confident	29 Å²	29	31.2 Å²	31.2	30%	0.299	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	94.5	-165.4	-161.8	0	0	0	0	0	114
1006	P	89.8	Confident	89.1	Confident	47 Å²	47	31.3 Å²	31.3	31%	0.305	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	cis	-74.2	151.4	12.2	30.8	-36.5	0	0	0	113.7	V677 I678 Y679 F1031	V677-P1006 HydrophobicContact CG1-CB 3.43Å; V677-P1006 VanDerWaalsContact CG1-CB 3.43Å; V677-P1006 HydrophobicContact CG1-CG 4.33Å; I678-P1006 CarbonylContact O-C 3.42Å; I678-P1006 VanDerWaalsContact O-CA 3.25Å; I678-P1006 WeakPolarHBondContact O-CA 3.29Å; Y679-P1006 HydrophobicContact CD1-CB 4.46Å; Y679-P1006 HydrophobicContact CE1-CB 3.95Å; Y679-P1006 HydrophobicContact CE1-CG 4.4Å; P1006-F1031 HydrophobicContact CB-CE2 4.38Å; P1006-F1031 HydrophobicContact CG-CE2 4.31Å; P1006-F1031 WeakPolarHBondContact O-CE2 3.28Å
1007	Y	94	Very high	88.7	Confident	22 Å²	22	35.1 Å²	35.1	9%	0.086	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	155.8	176.3	-63.5	-74.1	0	0	0	112.5	I678 H680 W935 D1004 V1028 A1036	I678-Y1007 PolarHBondContact O-N 3.47Å; H680-Y1007 HydrophobicContact CB-CE2 4.4Å; W935-Y1007 HydrophobicContact CH2-CD2 4.12Å; W935-Y1007 AromaticContact CH2-CE2 3.59Å; W935-Y1007 HydrophobicContact CH2-CE2 3.59Å; W935-Y1007 AromaticContact CZ3-CD2 3.6Å; W935-Y1007 HydrophobicContact CZ3-CD2 3.6Å; W935-Y1007 AromaticContact CZ3-CE2 3.53Å; W935-Y1007 HydrophobicContact CZ3-CE2 3.53Å; D1004-Y1007 PolarHBondContact OD1-OH 3.03Å; D1004-Y1007 PolarHBondContact OD2-OH 2.74Å; Y1007-V1028 HydrophobicContact CD1-CG1 3.59Å; Y1007-V1028 HydrophobicContact CD2-CG1 3.94Å; Y1007-V1028 HydrophobicContact CE1-CG1 4.01Å; Y1007-V1028 HydrophobicContact CE2-CG1 4.28Å; Y1007-V1028 HydrophobicContact CG-CG1 3.54Å; Y1007-A1036 HydrophobicContact CD1-CB 4.34Å; Y1007-A1036 HydrophobicContact CE1-CB 4.01Å
1008	K	92.3	Very high	88.2	Confident	44 Å²	44	38.4 Å²	38.4	19%	0.191	20%	0.196	C	C	.	.	S	Bend	trans	-76.4	-43.8	178.8	-177.7	-179.5	177	177.7	0	111.9	R602 A603 F1029 N1030 F1031	R602-K1008 WeakPolarHBondContact CA-O 3.3Å; A603-K1008 PolarHBondContact N-O 3Å; K1008-F1029 PolarHBondContact N-O 3.14Å; K1008-N1030 WeakPolarHBondContact CB-O 3.5Å; K1008-F1031 HydrophobicContact CB-CD1 3.95Å; K1008-F1031 HydrophobicContact CB-CD2 4.4Å; K1008-F1031 HydrophobicContact CB-CE1 4.11Å; K1008-F1031 HydrophobicContact CB-CG 4.1Å; K1008-F1031 HydrophobicContact CB-CZ 4.41Å; K1008-F1031 HydrophobicContact CG-CD1 4.18Å; K1008-F1031 HydrophobicContact CG-CE1 4.33Å
1009	A	93.2	Very high	87.6	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	150	-177.5	0	0	0	0	0	112.9	F601 R602 V1028 F1029 L1064	F601-A1009 CarbonylContact O-C 3.57Å; F601-A1009 WeakPolarHBondContact O-CA 3.31Å; R602-A1009 HydrophobicContact CG-CB 3.61Å; A1009-V1028 CarbonylContact O-C 3.59Å; A1009-V1028 WeakPolarHBondContact O-CA 3.18Å; A1009-F1029 HydrophobicContact CB-CB 4.23Å; A1009-F1029 HydrophobicContact CB-CD2 3.98Å; A1009-F1029 HydrophobicContact CB-CG 4.49Å; A1009-F1029 PolarHBondContact N-O 2.65Å; A1009-F1029 PolarHBondContact O-N 3.13Å; A1009-L1064 HydrophobicContact CB-CD2 3.66Å
1010	M	93.9	Very high	87.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	130.8	167.9	-176.8	-179.7	-162.4	0	0	109.1	F601 I678 L927 W935 L1012 Y1026 A1027 V1028	F601-M1010 PolarHBondContact N-O 3.07Å; F601-M1010 PolarHBondContact O-N 2.94Å; I678-M1010 HydrophobicContact CD1-CB 4.46Å; I678-M1010 HydrophobicContact CG2-CB 4.21Å; L927-M1010 HydrophobicContact CB-SD 4.46Å; L927-M1010 HydrophobicContact CD1-SD 4.01Å; W935-M1010 HydrophobicContact CB-CE 3.77Å; W935-M1010 HydrophobicContact CB-SD 3.92Å; W935-M1010 HydrophobicContact CD2-CE 3.61Å; W935-M1010 HydrophobicContact CD2-SD 3.99Å; W935-M1010 HydrophobicContact CE3-CE 3.92Å; W935-M1010 HydrophobicContact CE3-SD 3.72Å; W935-M1010 HydrophobicContact CG-CE 3.52Å; W935-M1010 HydrophobicContact CG-SD 4.09Å; M1010-L1012 HydrophobicContact CE-CD1 4.22Å; M1010-L1012 HydrophobicContact CE-CD2 4.09Å; M1010-L1012 HydrophobicContact CE-CG 4.21Å; M1010-L1012 HydrophobicContact CG-CG 4.45Å; M1010-L1012 HydrophobicContact SD-CD1 4.19Å; M1010-Y1026 HydrophobicContact CE-CD2 4.37Å; M1010-Y1026 HydrophobicContact CE-CG 4.03Å; M1010-A1027 CarbonylContact C-O 3.59Å; M1010-A1027 WeakPolarHBondContact CA-O 3.21Å; M1010-V1028 HydrophobicContact CB-CG2 4.35Å; M1010-V1028 HydrophobicContact CE-CG2 4.42Å; M1010-V1028 HydrophobicContact CG-CG2 3.94Å
1011	V	91.8	Very high	86.7	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	122.6	179.9	-179.8	0	0	0	0	109.6	Y1026 A1027 F1029 F1063	V1011-Y1026 WeakPolarHBondContact O-CA 3.39Å; V1011-A1027 HydrophobicContact CB-CB 4.42Å; V1011-A1027 PolarHBondContact N-O 3.03Å; V1011-A1027 PolarHBondContact O-N 3.12Å; V1011-A1027 VanDerWaalsContact O-N 3.15Å; V1011-F1029 HydrophobicContact CG2-CE2 4.16Å; V1011-F1063 HydrophobicContact CB-CD2 4.49Å; V1011-F1063 HydrophobicContact CB-CE2 4.48Å; V1011-F1063 HydrophobicContact CG1-CD2 4.05Å; V1011-F1063 HydrophobicContact CG1-CE1 4.3Å; V1011-F1063 HydrophobicContact CG1-CE2 3.59Å; V1011-F1063 HydrophobicContact CG1-CZ 3.74Å; V1011-F1063 HydrophobicContact CG2-CB 4.18Å; V1011-F1063 HydrophobicContact CG2-CD1 4.32Å; V1011-F1063 HydrophobicContact CG2-CD2 3.81Å; V1011-F1063 HydrophobicContact CG2-CE2 4.23Å; V1011-F1063 HydrophobicContact CG2-CG 3.87Å
1012	L	91.8	Very high	86.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	113.6	-178.4	-77.5	161	0	0	0	110	A595 A598 G599 F601 L927 E928 M1010	A595-L1012 HydrophobicContact CB-CD2 4.2Å; A598-L1012 CarbonylContact C-O 3.49Å; A598-L1012 WeakPolarHBondContact CA-O 3.45Å; G599-L1012 PolarHBondContact N-O 3.33Å; G599-L1012 PolarHBondContact O-N 3.13Å; F601-L1012 HydrophobicContact CD2-CD1 4.31Å; F601-L1012 HydrophobicContact CE2-CD1 4.07Å; L927-L1012 HydrophobicContact CB-CD1 3.75Å; E928-L1012 HydrophobicContact CB-CD2 4.46Å; M1010-L1012 HydrophobicContact CE-CD1 4.22Å; M1010-L1012 HydrophobicContact CE-CD2 4.09Å; M1010-L1012 HydrophobicContact CE-CG 4.21Å; M1010-L1012 HydrophobicContact CG-CG 4.45Å; M1010-L1012 HydrophobicContact SD-CD1 4.19Å
1013	P	91.6	Very high	85.9	Confident	7 Å²	7	49.9 Å²	49.9	5%	0.045	27%	0.265	C	S	.	.			trans	-76.4	162.3	177.3	34	-32.3	0	0	0	111.3	L1022 R1025 F1041 K1214 I1215	P1013-L1022 HydrophobicContact CB-CD1 4.46Å; P1013-L1022 HydrophobicContact CG-CD1 4.07Å; P1013-R1025 WeakPolarHBondContact CD-O 3.45Å; P1013-R1025 HydrophobicContact CG-CB 4.01Å; P1013-F1041 HydrophobicContact CB-CE1 4.25Å; P1013-F1041 HydrophobicContact CB-CZ 4.19Å; P1013-F1041 HydrophobicContact CG-CE1 4.06Å; P1013-F1041 HydrophobicContact CG-CE2 4.32Å; P1013-F1041 HydrophobicContact CG-CZ 3.72Å; P1013-K1214 CarbonylContact C-O 3.59Å; P1013-K1214 WeakPolarHBondContact CA-O 3.4Å; P1013-K1214 WeakPolarHBondContact CB-O 3.5Å; P1013-I1215 HydrophobicContact CB-CG1 4.4Å
1014	A	90.1	Very high	85.4	Confident	8 Å²	8	51.7 Å²	51.7	7%	0.066	27%	0.269	C	S	.	.			trans	-105.3	159.5	176.7	0	0	0	0	0	112.5	A598 K1214 I1218 P1219 L1222	A598-A1014 HydrophobicContact CB-CB 3.86Å; A1014-K1214 PolarHBondContact N-O 3.34Å; A1014-K1214 WeakPolarHBondContact O-CB 3.15Å; A1014-K1214 WeakPolarHBondContact O-CG 3.39Å; A1014-I1218 HydrophobicContact CB-CB 3.92Å; A1014-I1218 HydrophobicContact CB-CG2 3.37Å; A1014-P1219 HydrophobicContact CB-CG 4.2Å; A1014-L1222 HydrophobicContact CB-CD1 4.26Å
1015	A	88.3	Confident	85.3	Confident	14 Å²	14	49.8 Å²	49.8	12%	0.116	26%	0.256	C	S	.	.			trans	-77.1	152.8	167.4	0	0	0	0	0	111.6	E1017 K1020 L1022	A1015-E1017 VanDerWaalsContact C-N 3.34Å; A1015-K1020 HydrophobicContact CB-CB 4.23Å; A1015-K1020 WeakPolarHBondContact CB-O 3.2Å; A1015-L1022 HydrophobicContact CB-CD2 4.23Å; A1015-L1022 HydrophobicContact CB-CG 4.38Å
1016	K	84.1	Confident	85.5	Confident	74 Å²	74	48.6 Å²	48.6	32%	0.322	24%	0.243	S	C	.	.	S	Bend	trans	-77.1	-23.4	170.3	-170.6	175.1	178.2	177.7	0	111.7	E1206 P1235 W1237	K1016-E1206 IonicContact NZ-OE1 3.47Å; K1016-P1235 HydrophobicContact CG-CG 4.45Å; K1016-W1237 PolarHBondContact O-NE1 2.94Å
1017	E	83.4	Confident	85.5	Confident	111 Å²	111	46.4 Å²	46.4	52%	0.519	23%	0.228	S	C	.	.	S	Bend	trans	-90.5	141.9	178.5	-63.6	159.1	-106.1	0	0	110.9	A1015 K1020	A1015-E1017 VanDerWaalsContact C-N 3.34Å; E1017-K1020 HydrophobicContact CB-CB 4.2Å; E1017-K1020 HydrophobicContact CB-CD 4.05Å; E1017-K1020 VanDerWaalsContact CD-CD 3.46Å; E1017-K1020 HydrophobicContact CG-CD 4.39Å; E1017-K1020 WeakPolarHBondContact OE1-CD 3.01Å; E1017-K1020 IonicContact OE1-NZ 3.78Å; E1017-K1020 PolarHBondContact OE1-NZ 3.17Å; E1017-K1020 WeakPolarHBondContact OE2-CD 3.48Å; E1017-K1020 WeakPolarHBondContact OE2-CE 3.4Å; E1017-K1020 IonicContact OE2-NZ 3.91Å; E1017-K1020 PolarHBondContact OE2-NZ 3.07Å
1018	E	78.5	Confident	85.3	Confident	90 Å²	90	45.3 Å²	45.3	42%	0.421	22%	0.224	S	C	.	.	S	Bend	trans	-69.5	147.2	176.5	-177.3	155.9	-143	0	0	112.1	K1020 W1237 K1241	E1018-K1020 PolarHBondContact O-N 3.08Å; E1018-W1237 HydrophobicContact CB-CB 4.31Å; E1018-W1237 HydrophobicContact CB-CD2 3.81Å; E1018-W1237 HydrophobicContact CB-CE3 4.08Å; E1018-W1237 HydrophobicContact CB-CG 3.91Å; E1018-W1237 HydrophobicContact CG-CD2 4.28Å; E1018-W1237 HydrophobicContact CG-CE3 4.04Å; E1018-K1241 IonicContact OE1-NZ 2.86Å; E1018-K1241 PolarHBondContact OE1-NZ 2.86Å
1019	G	74.2	Confident	85.3	Confident	77 Å²	77	43.6 Å²	43.6	79%	0.794	22%	0.216	S	C	*	.	S	Bend	trans	74.5	-20	175.9	0	0	0	0	0	115.6	R1021	G1019-R1021 PolarHBondContact O-N 3.35Å
1020	K	79.5	Confident	85.1	Confident	110 Å²	110	46 Å²	46	48%	0.478	23%	0.229	S	C	.	.			trans	-80.3	103.1	-175	-165.7	172.3	-171.2	174.3	0	112	A1015 E1017 E1018	A1015-K1020 HydrophobicContact CB-CB 4.23Å; A1015-K1020 WeakPolarHBondContact CB-O 3.2Å; E1017-K1020 HydrophobicContact CB-CB 4.2Å; E1017-K1020 HydrophobicContact CB-CD 4.05Å; E1017-K1020 VanDerWaalsContact CD-CD 3.46Å; E1017-K1020 HydrophobicContact CG-CD 4.39Å; E1017-K1020 WeakPolarHBondContact OE1-CD 3.01Å; E1017-K1020 IonicContact OE1-NZ 3.78Å; E1017-K1020 PolarHBondContact OE1-NZ 3.17Å; E1017-K1020 WeakPolarHBondContact OE2-CD 3.48Å; E1017-K1020 WeakPolarHBondContact OE2-CE 3.4Å; E1017-K1020 IonicContact OE2-NZ 3.91Å; E1017-K1020 PolarHBondContact OE2-NZ 3.07Å; E1018-K1020 PolarHBondContact O-N 3.08Å
1021	R	78.8	Confident	84.7	Confident	130 Å²	130	52 Å²	52	49%	0.491	26%	0.256	S	S	.	.			trans	-73.3	145.1	171.6	-71.5	175.9	173.1	152.9	-1.9	111.4	E594 A595 G1019	E594-R1021 HydrophobicContact CB-CB 4.33Å; E594-R1021 IonicContact OE1-CZ 2.72Å; E594-R1021 IonicContact OE1-NH1 2.72Å; E594-R1021 PolarHBondContact OE1-NH1 3.5Å; E594-R1021 WeakPolarHBondContact OE2-CD 3.47Å; E594-R1021 IonicContact OE2-CZ 3.76Å; E594-R1021 IonicContact OE2-NE 2.83Å; E594-R1021 IonicContact OE2-NH1 3.25Å; E594-R1021 PolarHBondContact OE2-NH1 3.39Å; A595-R1021 WeakPolarHBondContact O-CD 3.43Å; A595-R1021 WeakPolarHBondContact O-CG 3.47Å; G1019-R1021 PolarHBondContact O-N 3.35Å
1022	L	78.5	Confident	84.2	Confident	36 Å²	36	58 Å²	58	19%	0.188	29%	0.287	C	S	.	.			trans	-87.6	159.3	173.8	-63.6	-178.9	0	0	0	110.4	A595 P1013 A1015 R1025	A595-L1022 PolarHBondContact N-O 3.02Å; P1013-L1022 HydrophobicContact CB-CD1 4.46Å; P1013-L1022 HydrophobicContact CG-CD1 4.07Å; A1015-L1022 HydrophobicContact CB-CD2 4.23Å; A1015-L1022 HydrophobicContact CB-CG 4.38Å; L1022-R1025 HydrophobicContact CB-CB 4.24Å; L1022-R1025 HydrophobicContact CB-CG 4.18Å; L1022-R1025 HydrophobicContact CD1-CG 4.47Å
1023	K	76.2	Confident	83.5	Confident	121 Å²	121	59.3 Å²	59.3	53%	0.526	30%	0.301	S	S	.	.	S	Bend	trans	-127.8	132.3	179.9	-54.5	-164.2	173.7	-152.4	0	109.8	V593 R1025	V593-K1023 HydrophobicContact CB-CD 4.48Å; V593-K1023 HydrophobicContact CG1-CB 4.06Å; V593-K1023 WeakPolarHBondContact O-CD 3.41Å; V593-K1023 WeakPolarHBondContact O-CE 3.41Å; V593-K1023 VanDerWaalsContact O-CG 3.3Å; V593-K1023 WeakPolarHBondContact O-CG 3.47Å; V593-K1023 PolarHBondContact O-NZ 3.33Å; K1023-R1025 WeakPolarHBondContact O-CG 3.18Å; K1023-R1025 PolarHBondContact O-N 2.93Å
1024	K	74.3	Confident	82.9	Confident	80 Å²	80	61.2 Å²	61.2	35%	0.348	32%	0.315	S	S	.	.	S	Bend	trans	48.4	53.8	177.7	-47.6	-152.8	-172.8	-150.7	0	112.5	V593 E928 D930 T931 Y1026 K1039 G1040	V593-K1024 HydrophobicContact CG1-CG 3.71Å; E928-K1024 WeakPolarHBondContact OE1-CA 3.25Å; E928-K1024 PolarHBondContact OE1-N 3.17Å; D930-K1024 WeakPolarHBondContact OD1-CE 3.2Å; D930-K1024 IonicContact OD1-NZ 2.62Å; D930-K1024 PolarHBondContact OD1-NZ 2.83Å; D930-K1024 IonicContact OD2-NZ 2.68Å; T931-K1024 PolarHBondContact OG1-NZ 3.47Å; K1024-Y1026 HydrophobicContact CB-CE1 4.46Å; K1024-K1039 HydrophobicContact CB-CB 4.41Å; K1024-K1039 CarbonylContact O-C 3.52Å; K1024-K1039 WeakPolarHBondContact O-CB 3.48Å; K1024-G1040 VanDerWaalsContact O-CA 3.31Å; K1024-G1040 WeakPolarHBondContact O-CA 3.43Å; K1024-G1040 PolarHBondContact O-N 2.79Å
1025	R	82.1	Confident	82.4	Confident	43 Å²	43	64.5 Å²	64.5	16%	0.162	33%	0.331	C	S	.	.			trans	-129.7	85.6	-177.8	-76.4	-117.2	-164.6	-162.3	8.4	109.1	P1013 L1022 K1023 K1039 G1040 E1042 R1045	P1013-R1025 WeakPolarHBondContact CD-O 3.45Å; P1013-R1025 HydrophobicContact CG-CB 4.01Å; L1022-R1025 HydrophobicContact CB-CB 4.24Å; L1022-R1025 HydrophobicContact CB-CG 4.18Å; L1022-R1025 HydrophobicContact CD1-CG 4.47Å; K1023-R1025 WeakPolarHBondContact O-CG 3.18Å; K1023-R1025 PolarHBondContact O-N 2.93Å; R1025-K1039 WeakPolarHBondContact CA-O 3.11Å; R1025-G1040 PolarHBondContact NH1-O 3.29Å; R1025-E1042 IonicContact CZ-OE1 3.55Å; R1025-E1042 VanDerWaalsContact NH1-CD 3.27Å; R1025-E1042 IonicContact NH1-OE1 2.83Å; R1025-E1042 PolarHBondContact NH1-OE1 3.26Å; R1025-E1042 IonicContact NH1-OE2 3.66Å; R1025-E1042 PolarHBondContact NH1-OE2 2.82Å; R1025-E1042 VanDerWaalsContact NH1-OE2 3.09Å; R1025-E1042 IonicContact NH2-OE1 3.47Å; R1025-E1042 PolarHBondContact NH2-OE1 3.03Å; R1025-E1042 VanDerWaalsContact NH2-OE1 3.11Å; R1025-R1045 VanDerWaalsContact CZ-NH2 3.27Å; R1025-R1045 VanDerWaalsContact NH2-NH2 3.1Å
1026	Y	89.2	Confident	81.9	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.016	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	154.7	-175.9	48.9	-90.8	0	0	0	112.5	E928 D930 W935 M1010 V1011 K1024 V1028 E1037 L1038 K1039	E928-Y1026 WeakPolarHBondContact OE2-CD1 3.37Å; E928-Y1026 VanDerWaalsContact OE2-CE1 3.23Å; E928-Y1026 WeakPolarHBondContact OE2-CE1 3.33Å; D930-Y1026 PolarHBondContact OD2-OH 2.79Å; D930-Y1026 VanDerWaalsContact OD2-OH 3.09Å; W935-Y1026 HydrophobicContact CZ2-CE2 4.11Å; W935-Y1026 AromaticContact NE1-CZ 3.88Å; M1010-Y1026 HydrophobicContact CE-CD2 4.37Å; M1010-Y1026 HydrophobicContact CE-CG 4.03Å; V1011-Y1026 WeakPolarHBondContact O-CA 3.39Å; K1024-Y1026 HydrophobicContact CB-CE1 4.46Å; Y1026-V1028 HydrophobicContact CD2-CG2 3.96Å; Y1026-E1037 HydrophobicContact CE2-CG 4.1Å; Y1026-E1037 WeakPolarHBondContact CE2-OE2 3.45Å; Y1026-L1038 WeakPolarHBondContact O-CA 3.49Å; Y1026-K1039 HydrophobicContact CD1-CB 4.21Å; Y1026-K1039 HydrophobicContact CD1-CG 4.13Å; Y1026-K1039 HydrophobicContact CD2-CG 3.96Å; Y1026-K1039 HydrophobicContact CE1-CB 4.21Å; Y1026-K1039 HydrophobicContact CE1-CG 3.74Å; Y1026-K1039 HydrophobicContact CE2-CB 4.46Å; Y1026-K1039 HydrophobicContact CE2-CD 4.48Å; Y1026-K1039 HydrophobicContact CE2-CG 3.5Å; Y1026-K1039 VanDerWaalsContact CE2-CG 3.5Å; Y1026-K1039 HydrophobicContact CG-CB 4.44Å; Y1026-K1039 HydrophobicContact CG-CG 4.29Å; Y1026-K1039 VanDerWaalsContact CZ-CG 3.42Å; Y1026-K1039 PolarHBondContact N-O 3.17Å; Y1026-K1039 PolarHBondContact O-N 3.11Å; Y1026-K1039 WeakPolarHBondContact OH-CE 3.38Å
1027	A	89.2	Confident	81.6	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.3	167.6	0	0	0	0	0	108.7	M1010 V1011 F1029 L1035 E1037 L1038 F1041 F1060	M1010-A1027 CarbonylContact C-O 3.59Å; M1010-A1027 WeakPolarHBondContact CA-O 3.21Å; V1011-A1027 HydrophobicContact CB-CB 4.42Å; V1011-A1027 PolarHBondContact N-O 3.03Å; V1011-A1027 PolarHBondContact O-N 3.12Å; V1011-A1027 VanDerWaalsContact O-N 3.15Å; A1027-F1029 HydrophobicContact CB-CE2 4.03Å; A1027-F1029 HydrophobicContact CB-CZ 4.35Å; A1027-L1035 HydrophobicContact CB-CD1 4.1Å; A1027-E1037 CarbonylContact C-O 2.89Å; A1027-E1037 WeakPolarHBondContact CA-O 3.46Å; A1027-L1038 HydrophobicContact CB-CD1 3.76Å; A1027-F1041 HydrophobicContact CB-CE2 4.21Å; A1027-F1060 HydrophobicContact CB-CE1 4.25Å; A1027-F1060 HydrophobicContact CB-CZ 4.26Å
1028	V	90.4	Very high	81.5	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	137	-174.1	176.8	0	0	0	0	109.4	W935 Y1007 A1009 M1010 Y1026 L1035 A1036 E1037	W935-V1028 HydrophobicContact CE3-CG2 4.34Å; W935-V1028 HydrophobicContact CH2-CB 4.29Å; W935-V1028 HydrophobicContact CH2-CG1 3.92Å; W935-V1028 HydrophobicContact CH2-CG2 3.68Å; W935-V1028 HydrophobicContact CZ2-CG2 4.25Å; W935-V1028 HydrophobicContact CZ3-CB 4.44Å; W935-V1028 HydrophobicContact CZ3-CG1 3.86Å; W935-V1028 HydrophobicContact CZ3-CG2 3.71Å; Y1007-V1028 HydrophobicContact CD1-CG1 3.59Å; Y1007-V1028 HydrophobicContact CD2-CG1 3.94Å; Y1007-V1028 HydrophobicContact CE1-CG1 4.01Å; Y1007-V1028 HydrophobicContact CE2-CG1 4.28Å; Y1007-V1028 HydrophobicContact CG-CG1 3.54Å; A1009-V1028 CarbonylContact O-C 3.59Å; A1009-V1028 WeakPolarHBondContact O-CA 3.18Å; M1010-V1028 HydrophobicContact CB-CG2 4.35Å; M1010-V1028 HydrophobicContact CE-CG2 4.42Å; M1010-V1028 HydrophobicContact CG-CG2 3.94Å; Y1026-V1028 HydrophobicContact CD2-CG2 3.96Å; V1028-L1035 CarbonylContact O-C 3.57Å; V1028-A1036 HydrophobicContact CG1-CB 4.29Å; V1028-A1036 WeakPolarHBondContact O-CB 3.11Å; V1028-A1036 PolarHBondContact O-N 3.26Å; V1028-E1037 HydrophobicContact CB-CB 4.42Å; V1028-E1037 PolarHBondContact N-O 3.19Å; V1028-E1037 PolarHBondContact O-N 2.93Å
1029	F	91.2	Very high	81.4	Confident	7 Å²	7	60 Å²	60	3%	0.031	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	139.4	-173	-57	-98.9	0	0	0	112.5	K1008 A1009 V1011 A1027 S1034 L1035 F1060 L1064	K1008-F1029 PolarHBondContact N-O 3.14Å; A1009-F1029 HydrophobicContact CB-CB 4.23Å; A1009-F1029 HydrophobicContact CB-CD2 3.98Å; A1009-F1029 HydrophobicContact CB-CG 4.49Å; A1009-F1029 PolarHBondContact N-O 2.65Å; A1009-F1029 PolarHBondContact O-N 3.13Å; V1011-F1029 HydrophobicContact CG2-CE2 4.16Å; A1027-F1029 HydrophobicContact CB-CE2 4.03Å; A1027-F1029 HydrophobicContact CB-CZ 4.35Å; F1029-S1034 WeakPolarHBondContact CA-O 3.45Å; F1029-L1035 HydrophobicContact CD1-CB 4.3Å; F1029-L1035 HydrophobicContact CD1-CD1 4.01Å; F1029-L1035 HydrophobicContact CE1-CB 4.28Å; F1029-L1035 HydrophobicContact CE1-CD1 3.63Å; F1029-L1035 HydrophobicContact CE2-CD1 4.22Å; F1029-L1035 HydrophobicContact CG-CD1 4.48Å; F1029-L1035 HydrophobicContact CZ-CD1 3.75Å; F1029-F1060 HydrophobicContact CE1-CB 4.38Å; F1029-F1060 HydrophobicContact CZ-CB 3.94Å; F1029-F1060 HydrophobicContact CZ-CG 4.43Å; F1029-F1060 WeakPolarHBondContact CZ-O 3.49Å; F1029-L1064 HydrophobicContact CB-CD1 4.35Å; F1029-L1064 HydrophobicContact CB-CD2 4.08Å; F1029-L1064 HydrophobicContact CD1-CD1 3.76Å; F1029-L1064 HydrophobicContact CD1-CD2 4.34Å; F1029-L1064 HydrophobicContact CD1-CG 4.28Å; F1029-L1064 HydrophobicContact CD2-CD2 4.22Å; F1029-L1064 HydrophobicContact CE1-CD1 4.26Å; F1029-L1064 HydrophobicContact CG-CD1 4.16Å; F1029-L1064 HydrophobicContact CG-CD2 3.98Å; F1029-L1064 HydrophobicContact CG-CG 4.41Å
1030	N	89.2	Confident	81.4	Confident	53 Å²	53	57.7 Å²	57.7	28%	0.283	29%	0.291	S	S	.	.			trans	-77.1	168.5	173.5	-70.6	-37.1	0	0	0	111.9	K1008 D1032 G1033 S1034	K1008-N1030 WeakPolarHBondContact CB-O 3.5Å; N1030-D1032 VanDerWaalsContact C-N 3.29Å; N1030-D1032 WeakPolarHBondContact CB-OD1 3.39Å; N1030-D1032 PolarHBondContact O-N 3.33Å; N1030-G1033 PolarHBondContact O-N 3.38Å; N1030-S1034 WeakPolarHBondContact CB-OG 3.33Å; N1030-S1034 PolarHBondContact N-O 3.22Å; N1030-S1034 PolarHBondContact ND2-OG 3.27Å
1031	F	86.5	Confident	81.5	Confident	126 Å²	126	52.5 Å²	52.5	55%	0.553	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-24	179.1	-80.3	-82.2	0	0	0	114.6	A603 P1006 K1008 G1033	A603-F1031 HydrophobicContact CB-CE1 4.34Å; A603-F1031 HydrophobicContact CB-CZ 4.04Å; P1006-F1031 HydrophobicContact CB-CE2 4.38Å; P1006-F1031 HydrophobicContact CG-CE2 4.31Å; P1006-F1031 WeakPolarHBondContact O-CE2 3.28Å; K1008-F1031 HydrophobicContact CB-CD1 3.95Å; K1008-F1031 HydrophobicContact CB-CD2 4.4Å; K1008-F1031 HydrophobicContact CB-CE1 4.11Å; K1008-F1031 HydrophobicContact CB-CG 4.1Å; K1008-F1031 HydrophobicContact CB-CZ 4.41Å; K1008-F1031 HydrophobicContact CG-CD1 4.18Å; K1008-F1031 HydrophobicContact CG-CE1 4.33Å; F1031-G1033 PolarHBondContact O-N 2.94Å
1032	D	81.1	Confident	81.2	Confident	127 Å²	127	47.3 Å²	47.3	68%	0.679	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-5.7	169.6	67	-7.5	0	0	0	113.5	N1030 S1034	N1030-D1032 VanDerWaalsContact C-N 3.29Å; N1030-D1032 WeakPolarHBondContact CB-OD1 3.39Å; N1030-D1032 PolarHBondContact O-N 3.33Å; D1032-S1034 VanDerWaalsContact CG-OG 3.29Å; D1032-S1034 VanDerWaalsContact OD1-CB 3.28Å; D1032-S1034 WeakPolarHBondContact OD1-CB 3.34Å; D1032-S1034 PolarHBondContact OD1-N 3.46Å; D1032-S1034 PolarHBondContact OD1-OG 2.93Å; D1032-S1034 PolarHBondContact OD2-OG 2.87Å
1033	G	77.7	Confident	80.9	Confident	28 Å²	28	47.7 Å²	47.7	29%	0.289	25%	0.251	S	S	.	.	S	Bend	trans	88	-3.3	-175.9	0	0	0	0	0	114.6	N1030 F1031	N1030-G1033 PolarHBondContact O-N 3.38Å; F1031-G1033 PolarHBondContact O-N 2.94Å
1034	S	77.5	Confident	80.2	Confident	47 Å²	47	46 Å²	46	33%	0.329	24%	0.244	S	C	.	.			trans	-67.7	141.5	176.9	65.6	0	0	0	0	111.8	F1029 N1030 D1032 A1036	F1029-S1034 WeakPolarHBondContact CA-O 3.45Å; N1030-S1034 WeakPolarHBondContact CB-OG 3.33Å; N1030-S1034 PolarHBondContact N-O 3.22Å; N1030-S1034 PolarHBondContact ND2-OG 3.27Å; D1032-S1034 VanDerWaalsContact CG-OG 3.29Å; D1032-S1034 VanDerWaalsContact OD1-CB 3.28Å; D1032-S1034 WeakPolarHBondContact OD1-CB 3.34Å; D1032-S1034 PolarHBondContact OD1-N 3.46Å; D1032-S1034 PolarHBondContact OD1-OG 2.93Å; D1032-S1034 PolarHBondContact OD2-OG 2.87Å; S1034-A1036 PolarHBondContact O-N 2.74Å; S1034-A1036 VanDerWaalsContact O-N 3.13Å
1035	L	79.9	Confident	79.5	Confident	76 Å²	76	47 Å²	47	40%	0.398	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	99.1	176.1	-179.2	68.2	0	0	0	109.2	A1027 V1028 F1029 L1038	A1027-L1035 HydrophobicContact CB-CD1 4.1Å; V1028-L1035 CarbonylContact O-C 3.57Å; F1029-L1035 HydrophobicContact CD1-CB 4.3Å; F1029-L1035 HydrophobicContact CD1-CD1 4.01Å; F1029-L1035 HydrophobicContact CE1-CB 4.28Å; F1029-L1035 HydrophobicContact CE1-CD1 3.63Å; F1029-L1035 HydrophobicContact CE2-CD1 4.22Å; F1029-L1035 HydrophobicContact CG-CD1 4.48Å; F1029-L1035 HydrophobicContact CZ-CD1 3.75Å; L1035-L1038 HydrophobicContact CD1-CB 4.46Å; L1035-L1038 HydrophobicContact CD2-CB 4.04Å; L1035-L1038 HydrophobicContact CD2-CD2 4.1Å; L1035-L1038 HydrophobicContact CG-CB 4.4Å
1036	A	78.9	Confident	78.3	Confident	42 Å²	42	50.7 Å²	50.7	35%	0.347	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	-46.6	-178.4	0	0	0	0	0	111.7	Y1007 V1028 S1034	Y1007-A1036 HydrophobicContact CD1-CB 4.34Å; Y1007-A1036 HydrophobicContact CE1-CB 4.01Å; V1028-A1036 HydrophobicContact CG1-CB 4.29Å; V1028-A1036 WeakPolarHBondContact O-CB 3.11Å; V1028-A1036 PolarHBondContact O-N 3.26Å; S1034-A1036 PolarHBondContact O-N 2.74Å; S1034-A1036 VanDerWaalsContact O-N 3.13Å
1037	E	78	Confident	76.9	Confident	68 Å²	68	51.7 Å²	51.7	32%	0.318	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	147.1	179.9	-168.4	153.3	-126.5	0	0	113	Y1026 A1027 V1028 K1039	Y1026-E1037 HydrophobicContact CE2-CG 4.1Å; Y1026-E1037 WeakPolarHBondContact CE2-OE2 3.45Å; A1027-E1037 CarbonylContact C-O 2.89Å; A1027-E1037 WeakPolarHBondContact CA-O 3.46Å; V1028-E1037 HydrophobicContact CB-CB 4.42Å; V1028-E1037 PolarHBondContact N-O 3.19Å; V1028-E1037 PolarHBondContact O-N 2.93Å; E1037-K1039 VanDerWaalsContact CD-NZ 3.29Å; E1037-K1039 HydrophobicContact CG-CD 4.46Å; E1037-K1039 HydrophobicContact CG-CG 4.44Å; E1037-K1039 WeakPolarHBondContact OE1-CE 3.12Å; E1037-K1039 IonicContact OE1-NZ 2.77Å; E1037-K1039 PolarHBondContact OE1-NZ 3.4Å; E1037-K1039 VanDerWaalsContact OE2-CE 3.29Å; E1037-K1039 WeakPolarHBondContact OE2-CE 3.37Å; E1037-K1039 IonicContact OE2-NZ 3.24Å
1038	L	80	Confident	76.2	Confident	16 Å²	16	53.6 Å²	53.6	8%	0.084	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	115.4	178.9	177.9	66.4	0	0	0	111.2	Y1026 A1027 L1035 F1041 I1043 K1044 F1060	Y1026-L1038 WeakPolarHBondContact O-CA 3.49Å; A1027-L1038 HydrophobicContact CB-CD1 3.76Å; L1035-L1038 HydrophobicContact CD1-CB 4.46Å; L1035-L1038 HydrophobicContact CD2-CB 4.04Å; L1035-L1038 HydrophobicContact CD2-CD2 4.1Å; L1035-L1038 HydrophobicContact CG-CB 4.4Å; L1038-F1041 HydrophobicContact CD1-CB 4.15Å; L1038-F1041 HydrophobicContact CD1-CD2 3.52Å; L1038-F1041 HydrophobicContact CD1-CE2 4.24Å; L1038-F1041 HydrophobicContact CD1-CG 4.11Å; L1038-I1043 HydrophobicContact CD2-CD1 4.34Å; L1038-K1044 HydrophobicContact CD2-CD 4.47Å; L1038-K1044 PolarHBondContact O-NZ 2.92Å; L1038-F1060 HydrophobicContact CD1-CD2 4.35Å; L1038-F1060 HydrophobicContact CD1-CE2 3.36Å; L1038-F1060 HydrophobicContact CD1-CZ 3.6Å; L1038-F1060 HydrophobicContact CD2-CE2 3.8Å; L1038-F1060 HydrophobicContact CG-CE2 4.24Å
1039	K	76.7	Confident	75.7	Confident	70 Å²	70	53.7 Å²	53.7	30%	0.304	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	148.9	178.1	-50.3	-77.7	177.8	170.4	0	112.1	K1024 R1025 Y1026 E1037 F1041	K1024-K1039 HydrophobicContact CB-CB 4.41Å; K1024-K1039 CarbonylContact O-C 3.52Å; K1024-K1039 WeakPolarHBondContact O-CB 3.48Å; R1025-K1039 WeakPolarHBondContact CA-O 3.11Å; Y1026-K1039 HydrophobicContact CD1-CB 4.21Å; Y1026-K1039 HydrophobicContact CD1-CG 4.13Å; Y1026-K1039 HydrophobicContact CD2-CG 3.96Å; Y1026-K1039 HydrophobicContact CE1-CB 4.21Å; Y1026-K1039 HydrophobicContact CE1-CG 3.74Å; Y1026-K1039 HydrophobicContact CE2-CB 4.46Å; Y1026-K1039 HydrophobicContact CE2-CD 4.48Å; Y1026-K1039 HydrophobicContact CE2-CG 3.5Å; Y1026-K1039 VanDerWaalsContact CE2-CG 3.5Å; Y1026-K1039 HydrophobicContact CG-CB 4.44Å; Y1026-K1039 HydrophobicContact CG-CG 4.29Å; Y1026-K1039 VanDerWaalsContact CZ-CG 3.42Å; Y1026-K1039 PolarHBondContact N-O 3.17Å; Y1026-K1039 PolarHBondContact O-N 3.11Å; Y1026-K1039 WeakPolarHBondContact OH-CE 3.38Å; E1037-K1039 VanDerWaalsContact CD-NZ 3.29Å; E1037-K1039 HydrophobicContact CG-CD 4.46Å; E1037-K1039 HydrophobicContact CG-CG 4.44Å; E1037-K1039 WeakPolarHBondContact OE1-CE 3.12Å; E1037-K1039 IonicContact OE1-NZ 2.77Å; E1037-K1039 PolarHBondContact OE1-NZ 3.4Å; E1037-K1039 VanDerWaalsContact OE2-CE 3.29Å; E1037-K1039 WeakPolarHBondContact OE2-CE 3.37Å; E1037-K1039 IonicContact OE2-NZ 3.24Å; K1039-F1041 VanDerWaalsContact O-CD2 3.29Å; K1039-F1041 WeakPolarHBondContact O-CD2 3.46Å; K1039-F1041 PolarHBondContact O-N 3.01Å
1040	G	74.3	Confident	75.1	Confident	27 Å²	27	57.3 Å²	57.3	28%	0.278	31%	0.306	S	S	.	.	S	Bend	trans	73.1	-22.3	160.7	0	0	0	0	0	118.1	K1024 R1025 R1045	K1024-G1040 VanDerWaalsContact O-CA 3.31Å; K1024-G1040 WeakPolarHBondContact O-CA 3.43Å; K1024-G1040 PolarHBondContact O-N 2.79Å; R1025-G1040 PolarHBondContact NH1-O 3.29Å; G1040-R1045 PolarHBondContact O-NE 3.08Å; G1040-R1045 PolarHBondContact O-NH2 2.94Å
1041	F	80.9	Confident	75	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.009	29%	0.293	C	S	.	.			trans	-63.9	156.5	176	-78.3	-86.6	0	0	0	113.9	P1013 A1027 L1038 K1039 I1043 K1044 F1060 I1215	P1013-F1041 HydrophobicContact CB-CE1 4.25Å; P1013-F1041 HydrophobicContact CB-CZ 4.19Å; P1013-F1041 HydrophobicContact CG-CE1 4.06Å; P1013-F1041 HydrophobicContact CG-CE2 4.32Å; P1013-F1041 HydrophobicContact CG-CZ 3.72Å; A1027-F1041 HydrophobicContact CB-CE2 4.21Å; L1038-F1041 HydrophobicContact CD1-CB 4.15Å; L1038-F1041 HydrophobicContact CD1-CD2 3.52Å; L1038-F1041 HydrophobicContact CD1-CE2 4.24Å; L1038-F1041 HydrophobicContact CD1-CG 4.11Å; K1039-F1041 VanDerWaalsContact O-CD2 3.29Å; K1039-F1041 WeakPolarHBondContact O-CD2 3.46Å; K1039-F1041 PolarHBondContact O-N 3.01Å; F1041-I1043 PolarHBondContact O-N 2.98Å; F1041-K1044 PolarHBondContact O-N 3.16Å; F1041-F1060 HydrophobicContact CB-CZ 4.22Å; F1041-F1060 HydrophobicContact CD1-CE1 4.16Å; F1041-F1060 AromaticContact CD1-CZ 3.75Å; F1041-F1060 HydrophobicContact CD1-CZ 3.75Å; F1041-F1060 AromaticContact CD2-CZ 3.87Å; F1041-F1060 HydrophobicContact CD2-CZ 3.87Å; F1041-F1060 AromaticContact CE1-CE1 3.91Å; F1041-F1060 HydrophobicContact CE1-CE1 3.91Å; F1041-F1060 AromaticContact CE1-CZ 3.95Å; F1041-F1060 HydrophobicContact CE1-CZ 3.95Å; F1041-F1060 HydrophobicContact CE2-CE1 4.34Å; F1041-F1060 HydrophobicContact CE2-CZ 4.08Å; F1041-F1060 HydrophobicContact CG-CE1 4.47Å; F1041-F1060 AromaticContact CG-CZ 3.7Å; F1041-F1060 HydrophobicContact CG-CZ 3.7Å; F1041-F1060 HydrophobicContact CZ-CE1 4.01Å; F1041-F1060 HydrophobicContact CZ-CZ 4.12Å; F1041-I1215 HydrophobicContact CD1-CD1 4.16Å; F1041-I1215 HydrophobicContact CE1-CD1 3.9Å; F1041-I1215 HydrophobicContact CE1-CG1 4.05Å
1042	E	73.9	Confident	75	Confident	20 Å²	20	49.1 Å²	49.1	9%	0.093	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-70.1	-23.4	-171.8	-75.8	59.3	-144.8	0	0	114.5	R1025 K1044 R1045 E1048 I1052 Q1056	R1025-E1042 IonicContact CZ-OE1 3.55Å; R1025-E1042 VanDerWaalsContact NH1-CD 3.27Å; R1025-E1042 IonicContact NH1-OE1 2.83Å; R1025-E1042 PolarHBondContact NH1-OE1 3.26Å; R1025-E1042 IonicContact NH1-OE2 3.66Å; R1025-E1042 PolarHBondContact NH1-OE2 2.82Å; R1025-E1042 VanDerWaalsContact NH1-OE2 3.09Å; R1025-E1042 IonicContact NH2-OE1 3.47Å; R1025-E1042 PolarHBondContact NH2-OE1 3.03Å; R1025-E1042 VanDerWaalsContact NH2-OE1 3.11Å; E1042-K1044 PolarHBondContact O-N 2.91Å; E1042-R1045 WeakPolarHBondContact O-CB 3.19Å; E1042-R1045 PolarHBondContact O-N 2.88Å; E1042-R1045 IonicContact OE1-CZ 3.26Å; E1042-R1045 IonicContact OE1-NE 2.82Å; E1042-R1045 IonicContact OE1-NH1 2.75Å; E1042-E1048 HydrophobicContact CB-CG 4.01Å; E1042-E1048 HydrophobicContact CG-CG 4.07Å; E1042-E1048 WeakPolarHBondContact CG-OE2 3.42Å; E1042-I1052 HydrophobicContact CB-CG2 4.37Å; E1042-Q1056 PolarHBondContact OE2-NE2 2.91Å
1043	I	70.8	Confident	75.1	Confident	45 Å²	45	45.2 Å²	45.2	23%	0.231	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-44.9	-38	168.7	-69.6	154.4	0	0	0	112.3	L1038 F1041 Q1056 F1060	L1038-I1043 HydrophobicContact CD2-CD1 4.34Å; F1041-I1043 PolarHBondContact O-N 2.98Å; I1043-Q1056 HydrophobicContact CD1-CB 3.52Å; I1043-Q1056 HydrophobicContact CG1-CB 3.7Å; I1043-F1060 HydrophobicContact CD1-CD2 3.9Å; I1043-F1060 HydrophobicContact CD1-CE2 3.3Å; I1043-F1060 HydrophobicContact CD1-CZ 3.99Å
1044	K	62	Low	75.3	Confident	86 Å²	86	46.6 Å²	46.6	37%	0.374	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-93.2	17.5	-176.4	-72	179.1	174.2	-178.7	0	113.8	P453 L1038 F1041 E1042	P453-K1044 HydrophobicContact CB-CB 4.49Å; P453-K1044 HydrophobicContact CG-CB 4.01Å; P453-K1044 HydrophobicContact CG-CD 4.23Å; P453-K1044 HydrophobicContact CG-CG 4.27Å; L1038-K1044 HydrophobicContact CD2-CD 4.47Å; L1038-K1044 PolarHBondContact O-NZ 2.92Å; F1041-K1044 PolarHBondContact O-N 3.16Å; E1042-K1044 PolarHBondContact O-N 2.91Å
1045	R	60.3	Low	75.9	Confident	100 Å²	100	44.3 Å²	44.3	38%	0.377	23%	0.23	S	C	.	.			trans	-117.4	143.1	-175.5	-58.8	-176.5	-175.2	-141.4	-11.6	113.2	R1025 G1040 E1042 K1053	R1025-R1045 VanDerWaalsContact CZ-NH2 3.27Å; R1025-R1045 VanDerWaalsContact NH2-NH2 3.1Å; G1040-R1045 PolarHBondContact O-NE 3.08Å; G1040-R1045 PolarHBondContact O-NH2 2.94Å; E1042-R1045 WeakPolarHBondContact O-CB 3.19Å; E1042-R1045 PolarHBondContact O-N 2.88Å; E1042-R1045 IonicContact OE1-CZ 3.26Å; E1042-R1045 IonicContact OE1-NE 2.82Å; E1042-R1045 IonicContact OE1-NH1 2.75Å; R1045-K1053 VanDerWaalsContact O-CE 3.22Å; R1045-K1053 WeakPolarHBondContact O-CE 3.4Å; R1045-K1053 PolarHBondContact O-NZ 3Å
1046	N	55.8	Low	76.3	Confident	120 Å²	120	40.8 Å²	40.8	64%	0.642	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	149.2	172.2	-72.4	6.7	0	0	0	111.1	G455 E1048	G455-N1046 WeakPolarHBondContact CA-OD1 3.46Å; N1046-E1048 PolarHBondContact O-N 3.29Å
1047	G	60.5	Low	76.4	Confident	25 Å²	25	41.5 Å²	41.5	26%	0.258	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	-3	175	0	0	0	0	0	116.8	N1106	G1047-N1106 WeakPolarHBondContact CA-O 3.31Å
1048	E	73.7	Confident	76.7	Confident	40 Å²	40	40.2 Å²	40.2	19%	0.187	21%	0.212	C	C	.	.	S	Bend	trans	-79.3	140.8	169.8	-161.5	75	-98.7	0	0	110.8	E1042 N1046 Q1050 I1052 K1053 R1207	E1042-E1048 HydrophobicContact CB-CG 4.01Å; E1042-E1048 HydrophobicContact CG-CG 4.07Å; E1042-E1048 WeakPolarHBondContact CG-OE2 3.42Å; N1046-E1048 PolarHBondContact O-N 3.29Å; E1048-Q1050 PolarHBondContact O-N 3.03Å; E1048-I1052 HydrophobicContact CG-CB 4.32Å; E1048-I1052 HydrophobicContact CG-CD1 4.41Å; E1048-I1052 HydrophobicContact CG-CG2 4.25Å; E1048-K1053 VanDerWaalsContact O-CE 3.23Å; E1048-K1053 WeakPolarHBondContact O-CE 3.39Å; E1048-K1053 PolarHBondContact O-NZ 2.72Å; E1048-R1207 IonicContact OE1-CZ 2.7Å; E1048-R1207 IonicContact OE1-NH1 3.11Å; E1048-R1207 PolarHBondContact OE1-NH1 3.11Å; E1048-R1207 IonicContact OE1-NH2 3.9Å; E1048-R1207 PolarHBondContact OE1-NH2 2.7Å
1049	L	81.4	Confident	77.1	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	21%	0.208	C	C	.	.			trans	-48.4	133	178.6	-67.5	167.8	0	0	0	112.3	L1051 I1052 K1053 I1103 E1105 Y1204 R1207	L1049-L1051 VanDerWaalsContact C-N 3.26Å; L1049-L1051 PolarHBondContact O-N 3.11Å; L1049-I1052 HydrophobicContact CB-CB 4.49Å; L1049-I1052 HydrophobicContact CB-CD1 4.2Å; L1049-I1052 HydrophobicContact CB-CG1 4.15Å; L1049-I1052 HydrophobicContact CD1-CD1 4.06Å; L1049-I1052 PolarHBondContact O-N 3.12Å; L1049-K1053 PolarHBondContact O-N 3.21Å; L1049-I1103 WeakPolarHBondContact CD2-O 3.47Å; L1049-E1105 HydrophobicContact CD2-CG 3.56Å; L1049-E1105 HydrophobicContact CG-CG 4.07Å; L1049-Y1204 HydrophobicContact CD1-CD1 4.01Å; L1049-Y1204 HydrophobicContact CD1-CE1 4.22Å; L1049-Y1204 HydrophobicContact CD2-CD1 4.4Å; L1049-Y1204 HydrophobicContact CD2-CE1 3.87Å; L1049-R1207 HydrophobicContact CD1-CB 4.03Å; L1049-R1207 HydrophobicContact CD1-CG 4.29Å
1050	Q	78.7	Confident	77.5	Confident	84 Å²	84	36.6 Å²	36.6	39%	0.393	20%	0.196	S	C	.	.	H	α-helix	trans	-61.4	-36.5	179.4	-171.3	69.5	-12.5	0	0	111.6	E1048 I1052 K1053 I1054 D1101	E1048-Q1050 PolarHBondContact O-N 3.03Å; Q1050-I1052 VanDerWaalsContact C-N 3.26Å; Q1050-I1052 PolarHBondContact O-N 3.31Å; Q1050-K1053 PolarHBondContact O-N 2.79Å; Q1050-I1054 HydrophobicContact CG-CD1 3.86Å; Q1050-I1054 HydrophobicContact CG-CG1 4.29Å; Q1050-I1054 WeakPolarHBondContact O-CG1 3.42Å; Q1050-I1054 PolarHBondContact O-N 2.83Å; Q1050-D1101 WeakPolarHBondContact CB-O 3.4Å
1051	L	86.5	Confident	77.7	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-49	-44.8	169.8	179.1	65.7	0	0	0	112.7	L1049 F1055 W1083 L1087 L1102	L1049-L1051 VanDerWaalsContact C-N 3.26Å; L1049-L1051 PolarHBondContact O-N 3.11Å; L1051-F1055 WeakPolarHBondContact O-CB 3.34Å; L1051-F1055 PolarHBondContact O-N 3.4Å; L1051-W1083 HydrophobicContact CD1-CD2 4.02Å; L1051-W1083 HydrophobicContact CD1-CE3 3.31Å; L1051-W1083 HydrophobicContact CD1-CZ3 3.79Å; L1051-L1087 HydrophobicContact CD2-CD1 4.01Å; L1051-L1087 HydrophobicContact CD2-CD2 3.87Å; L1051-L1087 HydrophobicContact CD2-CG 4.17Å; L1051-L1102 HydrophobicContact CB-CB 4.28Å; L1051-L1102 HydrophobicContact CB-CD2 4.4Å; L1051-L1102 VanDerWaalsContact CB-O 3.27Å; L1051-L1102 WeakPolarHBondContact CB-O 3.45Å; L1051-L1102 HydrophobicContact CD1-CD2 4.34Å; L1051-L1102 PolarHBondContact N-O 3.37Å
1052	I	87.1	Confident	78	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.026	21%	0.21	C	C	.	.	H	α-helix	trans	-71	-36	-179.9	-64.3	176.9	0	0	0	110.9	E1042 E1048 L1049 Q1050 Q1056 R1207 A1211	E1042-I1052 HydrophobicContact CB-CG2 4.37Å; E1048-I1052 HydrophobicContact CG-CB 4.32Å; E1048-I1052 HydrophobicContact CG-CD1 4.41Å; E1048-I1052 HydrophobicContact CG-CG2 4.25Å; L1049-I1052 HydrophobicContact CB-CB 4.49Å; L1049-I1052 HydrophobicContact CB-CD1 4.2Å; L1049-I1052 HydrophobicContact CB-CG1 4.15Å; L1049-I1052 HydrophobicContact CD1-CD1 4.06Å; L1049-I1052 PolarHBondContact O-N 3.12Å; Q1050-I1052 VanDerWaalsContact C-N 3.26Å; Q1050-I1052 PolarHBondContact O-N 3.31Å; I1052-Q1056 WeakPolarHBondContact O-CB 3.26Å; I1052-Q1056 VanDerWaalsContact O-CG 3.3Å; I1052-Q1056 WeakPolarHBondContact O-CG 3.25Å; I1052-Q1056 PolarHBondContact O-N 2.92Å; I1052-R1207 HydrophobicContact CD1-CB 4.41Å; I1052-A1211 HydrophobicContact CG2-CB 4.28Å
1053	K	81.8	Confident	78.6	Confident	44 Å²	44	40.4 Å²	40.4	19%	0.191	21%	0.206	C	C	.	.	H	α-helix	trans	-69.5	-41.9	177.8	-62	176.6	-179.4	163.6	0	112.3	R1045 E1048 L1049 Q1050 S1057	R1045-K1053 VanDerWaalsContact O-CE 3.22Å; R1045-K1053 WeakPolarHBondContact O-CE 3.4Å; R1045-K1053 PolarHBondContact O-NZ 3Å; E1048-K1053 VanDerWaalsContact O-CE 3.23Å; E1048-K1053 WeakPolarHBondContact O-CE 3.39Å; E1048-K1053 PolarHBondContact O-NZ 2.72Å; L1049-K1053 PolarHBondContact O-N 3.21Å; Q1050-K1053 PolarHBondContact O-N 2.79Å; K1053-S1057 PolarHBondContact O-N 2.91Å; K1053-S1057 VanDerWaalsContact O-N 3.09Å; K1053-S1057 PolarHBondContact O-OG 3.25Å
1054	I	83.3	Confident	79.4	Confident	57 Å²	57	39.7 Å²	39.7	29%	0.292	20%	0.203	S	C	.	.	H	α-helix	trans	-67.9	-48.7	176	-63.7	172	0	0	0	109.4	Q1050 Q1056 S1057 S1058 W1083 L1102	Q1050-I1054 HydrophobicContact CG-CD1 3.86Å; Q1050-I1054 HydrophobicContact CG-CG1 4.29Å; Q1050-I1054 WeakPolarHBondContact O-CG1 3.42Å; Q1050-I1054 PolarHBondContact O-N 2.83Å; I1054-Q1056 VanDerWaalsContact C-N 3.34Å; I1054-Q1056 PolarHBondContact O-N 3.47Å; I1054-S1057 WeakPolarHBondContact O-CB 3.47Å; I1054-S1057 PolarHBondContact O-N 2.72Å; I1054-S1058 PolarHBondContact O-N 2.95Å; I1054-S1058 PolarHBondContact O-OG 3.15Å; I1054-W1083 HydrophobicContact CB-CZ2 4.41Å; I1054-W1083 HydrophobicContact CG2-CH2 3.88Å; I1054-W1083 HydrophobicContact CG2-CZ2 3.41Å; I1054-W1083 VanDerWaalsContact CG2-CZ2 3.41Å; I1054-L1102 HydrophobicContact CD1-CD2 3.77Å
1055	F	90	Very high	80.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-49.8	-50.5	173	162.9	-105.6	0	0	0	112.4	L1051 S1057 S1058 V1059 A1080 W1083 L1208 A1211 I1212 I1215 I1216	L1051-F1055 WeakPolarHBondContact O-CB 3.34Å; L1051-F1055 PolarHBondContact O-N 3.4Å; F1055-S1057 PolarHBondContact O-N 2.95Å; F1055-S1058 PolarHBondContact O-N 3.26Å; F1055-V1059 HydrophobicContact CD2-CG2 3.84Å; F1055-V1059 HydrophobicContact CE2-CG2 3.47Å; F1055-V1059 VanDerWaalsContact CE2-CG2 3.47Å; F1055-V1059 HydrophobicContact CZ-CG2 3.88Å; F1055-V1059 VanDerWaalsContact O-CB 3.28Å; F1055-V1059 WeakPolarHBondContact O-CB 3.16Å; F1055-V1059 VanDerWaalsContact O-CG2 3.26Å; F1055-V1059 WeakPolarHBondContact O-CG2 3.49Å; F1055-V1059 PolarHBondContact O-N 2.82Å; F1055-A1080 HydrophobicContact CE2-CB 3.93Å; F1055-W1083 HydrophobicContact CB-CG 4.41Å; F1055-W1083 HydrophobicContact CD2-CB 4.48Å; F1055-W1083 AromaticContact CD2-CD1 3.91Å; F1055-W1083 HydrophobicContact CD2-CG 4.44Å; F1055-L1208 HydrophobicContact CB-CD1 4.18Å; F1055-L1208 HydrophobicContact CD1-CD1 3.87Å; F1055-L1208 HydrophobicContact CD2-CD1 4.17Å; F1055-L1208 HydrophobicContact CE1-CD1 4.31Å; F1055-L1208 HydrophobicContact CG-CD1 3.8Å; F1055-A1211 HydrophobicContact CD1-CB 4.41Å; F1055-A1211 HydrophobicContact CE1-CB 4Å; F1055-I1212 HydrophobicContact CE1-CG1 4.22Å; F1055-I1212 HydrophobicContact CE2-CG1 3.96Å; F1055-I1212 HydrophobicContact CZ-CG1 3.51Å; F1055-I1215 HydrophobicContact CE1-CD1 4.48Å; F1055-I1216 HydrophobicContact CE2-CD1 4.16Å; F1055-I1216 HydrophobicContact CZ-CD1 3.8Å
1056	Q	86.5	Confident	82	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-61.8	-41	178.1	-75.9	-174	0.5	0	0	112.3	E1042 I1043 I1052 I1054 V1059 F1060 I1215	E1042-Q1056 PolarHBondContact OE2-NE2 2.91Å; I1043-Q1056 HydrophobicContact CD1-CB 3.52Å; I1043-Q1056 HydrophobicContact CG1-CB 3.7Å; I1052-Q1056 WeakPolarHBondContact O-CB 3.26Å; I1052-Q1056 VanDerWaalsContact O-CG 3.3Å; I1052-Q1056 WeakPolarHBondContact O-CG 3.25Å; I1052-Q1056 PolarHBondContact O-N 2.92Å; I1054-Q1056 VanDerWaalsContact C-N 3.34Å; I1054-Q1056 PolarHBondContact O-N 3.47Å; Q1056-V1059 PolarHBondContact O-N 3.05Å; Q1056-F1060 WeakPolarHBondContact O-CD1 3.19Å; Q1056-F1060 VanDerWaalsContact O-CG 3.23Å; Q1056-F1060 WeakPolarHBondContact O-CG 3.46Å; Q1056-F1060 PolarHBondContact O-N 3.14Å; Q1056-F1060 VanDerWaalsContact O-N 3.12Å; Q1056-I1215 HydrophobicContact CG-CD1 3.74Å
1057	S	82.7	Confident	83.5	Confident	57 Å²	57	38.8 Å²	38.8	40%	0.399	21%	0.207	S	C	.	.	H	α-helix	trans	-63.3	-48.2	177.5	-59.4	0	0	0	0	111.8	K1053 I1054 F1055 V1059 F1060	K1053-S1057 PolarHBondContact O-N 2.91Å; K1053-S1057 VanDerWaalsContact O-N 3.09Å; K1053-S1057 PolarHBondContact O-OG 3.25Å; I1054-S1057 WeakPolarHBondContact O-CB 3.47Å; I1054-S1057 PolarHBondContact O-N 2.72Å; F1055-S1057 PolarHBondContact O-N 2.95Å; S1057-V1059 VanDerWaalsContact C-N 3.33Å; S1057-V1059 PolarHBondContact O-N 3.08Å; S1057-F1060 PolarHBondContact O-N 3.49Å
1058	S	84.4	Confident	85	Confident	42 Å²	42	39.2 Å²	39.2	29%	0.294	21%	0.205	S	C	.	.	H	α-helix	trans	-63.1	-37.1	176.9	-54.3	0	0	0	0	112.8	I1054 F1055 F1060 A1062	I1054-S1058 PolarHBondContact O-N 2.95Å; I1054-S1058 PolarHBondContact O-OG 3.15Å; F1055-S1058 PolarHBondContact O-N 3.26Å; S1058-F1060 VanDerWaalsContact C-N 3.34Å; S1058-A1062 PolarHBondContact O-N 3.02Å
1059	V	88.1	Confident	85.7	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66.8	-33.4	178	157.9	0	0	0	0	112.2	F1055 Q1056 S1057 E1061 A1062 F1063 V1076 V1079 I1215	F1055-V1059 HydrophobicContact CD2-CG2 3.84Å; F1055-V1059 HydrophobicContact CE2-CG2 3.47Å; F1055-V1059 VanDerWaalsContact CE2-CG2 3.47Å; F1055-V1059 HydrophobicContact CZ-CG2 3.88Å; F1055-V1059 VanDerWaalsContact O-CB 3.28Å; F1055-V1059 WeakPolarHBondContact O-CB 3.16Å; F1055-V1059 VanDerWaalsContact O-CG2 3.26Å; F1055-V1059 WeakPolarHBondContact O-CG2 3.49Å; F1055-V1059 PolarHBondContact O-N 2.82Å; Q1056-V1059 PolarHBondContact O-N 3.05Å; S1057-V1059 VanDerWaalsContact C-N 3.33Å; S1057-V1059 PolarHBondContact O-N 3.08Å; V1059-E1061 PolarHBondContact O-N 3.34Å; V1059-A1062 PolarHBondContact O-N 3.29Å; V1059-A1062 VanDerWaalsContact O-N 3.15Å; V1059-F1063 HydrophobicContact CG1-CD2 3.86Å; V1059-F1063 HydrophobicContact CG1-CE2 3.29Å; V1059-F1063 HydrophobicContact CG1-CZ 3.83Å; V1059-F1063 VanDerWaalsContact O-CD2 3.25Å; V1059-F1063 WeakPolarHBondContact O-CD2 3.37Å; V1059-F1063 PolarHBondContact O-N 3.47Å; V1059-F1063 VanDerWaalsContact O-N 3.1Å; V1059-V1076 HydrophobicContact CG1-CG1 3.82Å; V1059-V1076 HydrophobicContact CG2-CG1 4.22Å; V1059-V1079 HydrophobicContact CG2-CB 4.2Å; V1059-V1079 HydrophobicContact CG2-CG1 3.75Å; V1059-I1215 HydrophobicContact CG1-CG2 4.04Å
1060	F	84.4	Confident	86.2	Confident	10 Å²	10	42.9 Å²	42.9	4%	0.044	23%	0.229	C	C	.	.	H	α-helix	trans	-64.3	-39.6	179.5	-71.9	-12.2	0	0	0	113.7	A1027 F1029 L1038 F1041 I1043 Q1056 S1057 S1058 A1062 F1063	A1027-F1060 HydrophobicContact CB-CE1 4.25Å; A1027-F1060 HydrophobicContact CB-CZ 4.26Å; F1029-F1060 HydrophobicContact CE1-CB 4.38Å; F1029-F1060 HydrophobicContact CZ-CB 3.94Å; F1029-F1060 HydrophobicContact CZ-CG 4.43Å; F1029-F1060 WeakPolarHBondContact CZ-O 3.49Å; L1038-F1060 HydrophobicContact CD1-CD2 4.35Å; L1038-F1060 HydrophobicContact CD1-CE2 3.36Å; L1038-F1060 HydrophobicContact CD1-CZ 3.6Å; L1038-F1060 HydrophobicContact CD2-CE2 3.8Å; L1038-F1060 HydrophobicContact CG-CE2 4.24Å; F1041-F1060 HydrophobicContact CB-CZ 4.22Å; F1041-F1060 HydrophobicContact CD1-CE1 4.16Å; F1041-F1060 AromaticContact CD1-CZ 3.75Å; F1041-F1060 HydrophobicContact CD1-CZ 3.75Å; F1041-F1060 AromaticContact CD2-CZ 3.87Å; F1041-F1060 HydrophobicContact CD2-CZ 3.87Å; F1041-F1060 AromaticContact CE1-CE1 3.91Å; F1041-F1060 HydrophobicContact CE1-CE1 3.91Å; F1041-F1060 AromaticContact CE1-CZ 3.95Å; F1041-F1060 HydrophobicContact CE1-CZ 3.95Å; F1041-F1060 HydrophobicContact CE2-CE1 4.34Å; F1041-F1060 HydrophobicContact CE2-CZ 4.08Å; F1041-F1060 HydrophobicContact CG-CE1 4.47Å; F1041-F1060 AromaticContact CG-CZ 3.7Å; F1041-F1060 HydrophobicContact CG-CZ 3.7Å; F1041-F1060 HydrophobicContact CZ-CE1 4.01Å; F1041-F1060 HydrophobicContact CZ-CZ 4.12Å; I1043-F1060 HydrophobicContact CD1-CD2 3.9Å; I1043-F1060 HydrophobicContact CD1-CE2 3.3Å; I1043-F1060 HydrophobicContact CD1-CZ 3.99Å; Q1056-F1060 WeakPolarHBondContact O-CD1 3.19Å; Q1056-F1060 VanDerWaalsContact O-CG 3.23Å; Q1056-F1060 WeakPolarHBondContact O-CG 3.46Å; Q1056-F1060 PolarHBondContact O-N 3.14Å; Q1056-F1060 VanDerWaalsContact O-N 3.12Å; S1057-F1060 PolarHBondContact O-N 3.49Å; S1058-F1060 VanDerWaalsContact C-N 3.34Å; F1060-A1062 VanDerWaalsContact C-N 3.34Å; F1060-F1063 HydrophobicContact CD1-CD2 4.29Å; F1060-F1063 HydrophobicContact CD1-CE2 4.31Å
1061	E	78.8	Confident	86.8	Confident	127 Å²	127	43.2 Å²	43.2	59%	0.593	23%	0.231	S	C	*	.	H	α-helix	trans	-69.4	-32.9	171.7	-64.6	-175.6	-173	0	0	112.6	V1059 L1064 R1065	V1059-E1061 PolarHBondContact O-N 3.34Å; E1061-L1064 PolarHBondContact O-N 3.47Å; E1061-R1065 IonicContact OE2-NH2 2.67Å; E1061-R1065 PolarHBondContact OE2-NH2 3.03Å
1062	A	86.6	Confident	87	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-70.2	-29.6	-178.4	0	0	0	0	0	113.2	S1058 V1059 F1060 L1064 R1065 V1076 V1079	S1058-A1062 PolarHBondContact O-N 3.02Å; V1059-A1062 PolarHBondContact O-N 3.29Å; V1059-A1062 VanDerWaalsContact O-N 3.15Å; F1060-A1062 VanDerWaalsContact C-N 3.34Å; A1062-L1064 PolarHBondContact O-N 3.1Å; A1062-R1065 WeakPolarHBondContact O-CB 3.35Å; A1062-R1065 PolarHBondContact O-N 2.88Å; A1062-R1065 VanDerWaalsContact O-N 3.15Å; A1062-V1076 HydrophobicContact CB-CG2 3.71Å; A1062-V1079 HydrophobicContact CB-CG2 3.92Å
1063	F	87.5	Confident	87.4	Confident	1 Å²	1	42.9 Å²	42.9	0%	0.004	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-23.9	175.7	-80.2	-59.4	0	0	0	114	V600 R602 V1011 V1059 F1060 R1065 Y1073 V1076 I1215	V600-F1063 HydrophobicContact CB-CD1 4.44Å; V600-F1063 HydrophobicContact CG1-CD1 4.27Å; V600-F1063 HydrophobicContact CG2-CD1 3.3Å; V600-F1063 HydrophobicContact CG2-CE1 3.24Å; V600-F1063 HydrophobicContact CG2-CG 4.38Å; V600-F1063 HydrophobicContact CG2-CZ 4.26Å; R602-F1063 WeakPolarHBondContact CD-O 3.12Å; R602-F1063 PolarHBondContact NH1-O 3.37Å; V1011-F1063 HydrophobicContact CB-CD2 4.49Å; V1011-F1063 HydrophobicContact CB-CE2 4.48Å; V1011-F1063 HydrophobicContact CG1-CD2 4.05Å; V1011-F1063 HydrophobicContact CG1-CE1 4.3Å; V1011-F1063 HydrophobicContact CG1-CE2 3.59Å; V1011-F1063 HydrophobicContact CG1-CZ 3.74Å; V1011-F1063 HydrophobicContact CG2-CB 4.18Å; V1011-F1063 HydrophobicContact CG2-CD1 4.32Å; V1011-F1063 HydrophobicContact CG2-CD2 3.81Å; V1011-F1063 HydrophobicContact CG2-CE2 4.23Å; V1011-F1063 HydrophobicContact CG2-CG 3.87Å; V1059-F1063 HydrophobicContact CG1-CD2 3.86Å; V1059-F1063 HydrophobicContact CG1-CE2 3.29Å; V1059-F1063 HydrophobicContact CG1-CZ 3.83Å; V1059-F1063 VanDerWaalsContact O-CD2 3.25Å; V1059-F1063 WeakPolarHBondContact O-CD2 3.37Å; V1059-F1063 PolarHBondContact O-N 3.47Å; V1059-F1063 VanDerWaalsContact O-N 3.1Å; F1060-F1063 HydrophobicContact CD1-CD2 4.29Å; F1060-F1063 HydrophobicContact CD1-CE2 4.31Å; F1063-R1065 VanDerWaalsContact C-N 3.33Å; F1063-Y1073 HydrophobicContact CE1-CE1 4.45Å; F1063-V1076 HydrophobicContact CB-CG2 4.36Å; F1063-V1076 HydrophobicContact CD1-CG2 3.51Å; F1063-V1076 HydrophobicContact CD2-CG2 4.37Å; F1063-V1076 HydrophobicContact CE1-CB 4.36Å; F1063-V1076 HydrophobicContact CE1-CG1 4.03Å; F1063-V1076 HydrophobicContact CE1-CG2 3.8Å; F1063-V1076 HydrophobicContact CG-CG2 3.81Å; F1063-V1076 HydrophobicContact CZ-CG1 4.12Å; F1063-V1076 HydrophobicContact CZ-CG2 4.36Å; F1063-I1215 HydrophobicContact CE2-CG2 4.1Å; F1063-I1215 HydrophobicContact CZ-CG2 3.91Å
1064	L	87.9	Confident	87.8	Confident	31 Å²	31	43.7 Å²	43.7	16%	0.162	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	2.1	-179.9	-59.8	-175.8	0	0	0	114	A1009 F1029 E1061 A1062	A1009-L1064 HydrophobicContact CB-CD2 3.66Å; F1029-L1064 HydrophobicContact CB-CD1 4.35Å; F1029-L1064 HydrophobicContact CB-CD2 4.08Å; F1029-L1064 HydrophobicContact CD1-CD1 3.76Å; F1029-L1064 HydrophobicContact CD1-CD2 4.34Å; F1029-L1064 HydrophobicContact CD1-CG 4.28Å; F1029-L1064 HydrophobicContact CD2-CD2 4.22Å; F1029-L1064 HydrophobicContact CE1-CD1 4.26Å; F1029-L1064 HydrophobicContact CG-CD1 4.16Å; F1029-L1064 HydrophobicContact CG-CD2 3.98Å; F1029-L1064 HydrophobicContact CG-CG 4.41Å; E1061-L1064 PolarHBondContact O-N 3.47Å; A1062-L1064 PolarHBondContact O-N 3.1Å
1065	R	88.9	Confident	88.2	Confident	125 Å²	125	42.1 Å²	42.1	47%	0.472	23%	0.234	S	C	.	.			trans	-101.8	156.8	-176.8	-54	179.1	-169.7	175.8	1.6	111	R602 E1061 A1062 F1063 A1072	R602-R1065 PolarHBondContact NH1-O 2.84Å; E1061-R1065 IonicContact OE2-NH2 2.67Å; E1061-R1065 PolarHBondContact OE2-NH2 3.03Å; A1062-R1065 WeakPolarHBondContact O-CB 3.35Å; A1062-R1065 PolarHBondContact O-N 2.88Å; A1062-R1065 VanDerWaalsContact O-N 3.15Å; F1063-R1065 VanDerWaalsContact C-N 3.33Å; R1065-A1072 WeakPolarHBondContact O-CA 3.24Å
1066	G	87.7	Confident	88.2	Confident	27 Å²	27	42.1 Å²	42.1	28%	0.278	23%	0.234	S	C	.	.	S	Bend	trans	74.1	156.6	-176.6	0	0	0	0	0	113.9	R602	R602-G1066 VanDerWaalsContact CZ-O 3.26Å; R602-G1066 PolarHBondContact NH1-O 3.44Å; R602-G1066 PolarHBondContact NH2-O 3.43Å
1067	D	87.6	Confident	88.5	Confident	135 Å²	135	42.3 Å²	42.3	72%	0.722	24%	0.236	S	C	*	.	S	Bend	trans	-104.3	-3.7	-170.7	-63.5	-19.1	0	0	0	113	E1071	D1067-E1071 PolarHBondContact N-OE2 3.44Å
1068	S	90.8	Very high	88.9	Confident	33 Å²	33	43 Å²	43	23%	0.231	24%	0.241	C	C	.	.	S	Bend	trans	-129.3	160.9	174.5	73.8	0	0	0	0	112.2	V1070 E1071 A1072	S1068-V1070 PolarHBondContact O-N 2.91Å; S1068-E1071 VanDerWaalsContact CB-OE1 3.29Å; S1068-E1071 WeakPolarHBondContact CB-OE1 3.37Å; S1068-E1071 PolarHBondContact O-N 2.76Å; S1068-E1071 WeakPolarHBondContact OG-CG 3.46Å; S1068-E1071 PolarHBondContact OG-N 3.3Å; S1068-E1071 PolarHBondContact OG-OE1 2.87Å; S1068-A1072 WeakPolarHBondContact O-CB 3.25Å; S1068-A1072 PolarHBondContact O-N 2.76Å
1069	L	89.8	Confident	89.2	Confident	38 Å²	38	42 Å²	42	20%	0.199	23%	0.233	C	C	.	.	H	α-helix	trans	-57.6	-34.9	174.1	-86.3	176.9	0	0	0	111.7	V600 I605 Y1073 V1225	V600-L1069 HydrophobicContact CB-CD2 4.13Å; I605-L1069 HydrophobicContact CD1-CD2 4.45Å; I605-L1069 HydrophobicContact CG2-CG 4.08Å; L1069-Y1073 HydrophobicContact CD2-CE2 4.27Å; L1069-Y1073 WeakPolarHBondContact O-CB 3.47Å; L1069-Y1073 WeakPolarHBondContact O-CD2 3.33Å; L1069-Y1073 PolarHBondContact O-N 3.36Å; L1069-V1225 HydrophobicContact CB-CG2 4.22Å
1070	V	91.1	Very high	89.4	Confident	82 Å²	82	42 Å²	42	50%	0.497	23%	0.233	S	C	.	.	H	α-helix	trans	-66.4	-45.6	178.6	-177.6	0	0	0	0	110.3	S1068 S1074 V1225	S1068-V1070 PolarHBondContact O-N 2.91Å; V1070-S1074 VanDerWaalsContact O-CB 3.32Å; V1070-S1074 WeakPolarHBondContact O-CB 3.35Å; V1070-S1074 PolarHBondContact O-N 3.41Å; V1070-S1074 PolarHBondContact O-OG 3.48Å; V1070-V1225 HydrophobicContact CG2-CG1 4.45Å
1071	E	91.6	Very high	89.8	Confident	91 Å²	91	43.3 Å²	43.3	43%	0.425	24%	0.24	S	C	.	.	H	α-helix	trans	-67.7	-39.6	176.8	-70.4	150.2	-119.3	0	0	112.7	D1067 S1068 S1074 S1075	D1067-E1071 PolarHBondContact N-OE2 3.44Å; S1068-E1071 VanDerWaalsContact CB-OE1 3.29Å; S1068-E1071 WeakPolarHBondContact CB-OE1 3.37Å; S1068-E1071 PolarHBondContact O-N 2.76Å; S1068-E1071 WeakPolarHBondContact OG-CG 3.46Å; S1068-E1071 PolarHBondContact OG-N 3.3Å; S1068-E1071 PolarHBondContact OG-OE1 2.87Å; E1071-S1074 CarbonylContact O-C 3.57Å; E1071-S1074 PolarHBondContact O-N 2.98Å; E1071-S1074 VanDerWaalsContact O-N 3.13Å; E1071-S1075 PolarHBondContact O-N 2.68Å
1072	A	90.8	Very high	90.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.7	-46.8	176.1	0	0	0	0	0	111.2	R1065 S1068 S1074 S1075 V1076	R1065-A1072 WeakPolarHBondContact O-CA 3.24Å; S1068-A1072 WeakPolarHBondContact O-CB 3.25Å; S1068-A1072 PolarHBondContact O-N 2.76Å; A1072-S1074 VanDerWaalsContact C-N 3.3Å; A1072-S1074 PolarHBondContact O-N 2.95Å; A1072-S1075 PolarHBondContact O-N 2.87Å; A1072-V1076 WeakPolarHBondContact O-CB 3.17Å; A1072-V1076 WeakPolarHBondContact O-CG2 3.46Å; A1072-V1076 PolarHBondContact O-N 3.34Å; A1072-V1076 VanDerWaalsContact O-N 3.07Å
1073	Y	95.1	Very high	90.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.5	-29.4	172.6	-81.1	-62.5	0	0	0	112.9	V600 F1063 L1069 A1077 I1216 P1219 A1220 Q1223 V1225 P1228	V600-Y1073 HydrophobicContact CG2-CE1 3.95Å; V600-Y1073 HydrophobicContact CG2-CE2 4.36Å; V600-Y1073 PolarHBondContact N-OH 3.4Å; F1063-Y1073 HydrophobicContact CE1-CE1 4.45Å; L1069-Y1073 HydrophobicContact CD2-CE2 4.27Å; L1069-Y1073 WeakPolarHBondContact O-CB 3.47Å; L1069-Y1073 WeakPolarHBondContact O-CD2 3.33Å; L1069-Y1073 PolarHBondContact O-N 3.36Å; Y1073-A1077 WeakPolarHBondContact O-CB 3.31Å; Y1073-A1077 PolarHBondContact O-N 3.21Å; Y1073-I1216 HydrophobicContact CD1-CG2 4.06Å; Y1073-P1219 HydrophobicContact CE1-CB 4.43Å; Y1073-P1219 VanDerWaalsContact OH-C 3.32Å; Y1073-P1219 WeakPolarHBondContact OH-CB 3.38Å; Y1073-A1220 HydrophobicContact CD1-CB 3.91Å; Y1073-A1220 HydrophobicContact CD2-CB 4.05Å; Y1073-A1220 HydrophobicContact CE1-CB 3.82Å; Y1073-A1220 HydrophobicContact CE2-CB 3.98Å; Y1073-A1220 HydrophobicContact CG-CB 4.03Å; Y1073-A1220 PolarHBondContact OH-N 2.92Å; Y1073-Q1223 PolarHBondContact OH-OE1 3.36Å; Y1073-V1225 HydrophobicContact CD2-CB 4.22Å; Y1073-V1225 HydrophobicContact CD2-CG1 4.16Å; Y1073-V1225 HydrophobicContact CD2-CG2 4.04Å; Y1073-V1225 HydrophobicContact CE2-CG2 4.3Å; Y1073-P1228 HydrophobicContact CD1-CG 4.43Å; Y1073-P1228 HydrophobicContact CG-CG 4.49Å
1074	S	90.8	Very high	90.8	Very high	60 Å²	60	43.7 Å²	43.7	42%	0.42	24%	0.24	S	C	.	.	H	α-helix	trans	-73	-38.5	175	-58.9	0	0	0	0	112.5	V1070 E1071 A1072 V1076 A1077 S1078	V1070-S1074 VanDerWaalsContact O-CB 3.32Å; V1070-S1074 WeakPolarHBondContact O-CB 3.35Å; V1070-S1074 PolarHBondContact O-N 3.41Å; V1070-S1074 PolarHBondContact O-OG 3.48Å; E1071-S1074 CarbonylContact O-C 3.57Å; E1071-S1074 PolarHBondContact O-N 2.98Å; E1071-S1074 VanDerWaalsContact O-N 3.13Å; A1072-S1074 VanDerWaalsContact C-N 3.3Å; A1072-S1074 PolarHBondContact O-N 2.95Å; S1074-V1076 VanDerWaalsContact C-N 3.31Å; S1074-V1076 PolarHBondContact O-N 3.33Å; S1074-A1077 PolarHBondContact O-N 3.08Å; S1074-S1078 PolarHBondContact O-N 3.33Å
1075	S	90.3	Very high	90.8	Very high	25 Å²	25	46 Å²	46	18%	0.175	25%	0.253	C	S	.	.	H	α-helix	trans	-64.3	-39.7	173.4	-174.2	0	0	0	0	110.9	E1071 A1072 S1078	E1071-S1075 PolarHBondContact O-N 2.68Å; A1072-S1075 PolarHBondContact O-N 2.87Å; S1075-S1078 PolarHBondContact O-N 3.31Å; S1075-S1078 PolarHBondContact O-OG 2.98Å
1076	V	91.3	Very high	90.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-73.1	-33.9	175.9	168	0	0	0	0	111.7	V1059 A1062 F1063 A1072 S1074 V1079 A1080 I1216	V1059-V1076 HydrophobicContact CG1-CG1 3.82Å; V1059-V1076 HydrophobicContact CG2-CG1 4.22Å; A1062-V1076 HydrophobicContact CB-CG2 3.71Å; F1063-V1076 HydrophobicContact CB-CG2 4.36Å; F1063-V1076 HydrophobicContact CD1-CG2 3.51Å; F1063-V1076 HydrophobicContact CD2-CG2 4.37Å; F1063-V1076 HydrophobicContact CE1-CB 4.36Å; F1063-V1076 HydrophobicContact CE1-CG1 4.03Å; F1063-V1076 HydrophobicContact CE1-CG2 3.8Å; F1063-V1076 HydrophobicContact CG-CG2 3.81Å; F1063-V1076 HydrophobicContact CZ-CG1 4.12Å; F1063-V1076 HydrophobicContact CZ-CG2 4.36Å; A1072-V1076 WeakPolarHBondContact O-CB 3.17Å; A1072-V1076 WeakPolarHBondContact O-CG2 3.46Å; A1072-V1076 PolarHBondContact O-N 3.34Å; A1072-V1076 VanDerWaalsContact O-N 3.07Å; S1074-V1076 VanDerWaalsContact C-N 3.31Å; S1074-V1076 PolarHBondContact O-N 3.33Å; V1076-V1079 PolarHBondContact O-N 3.45Å; V1076-A1080 PolarHBondContact O-N 3.3Å; V1076-I1216 HydrophobicContact CG1-CB 4.46Å; V1076-I1216 HydrophobicContact CG1-CD1 3.53Å; V1076-I1216 HydrophobicContact CG1-CG1 3.61Å; V1076-I1216 HydrophobicContact CG1-CG2 4.08Å
1077	A	91.2	Very high	90.9	Very high	4 Å²	4	40 Å²	40	3%	0.033	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-41.5	171.1	0	0	0	0	0	112	Y1073 S1074 V1079 A1080 D1081 P1228 V1229	Y1073-A1077 WeakPolarHBondContact O-CB 3.31Å; Y1073-A1077 PolarHBondContact O-N 3.21Å; S1074-A1077 PolarHBondContact O-N 3.08Å; A1077-V1079 PolarHBondContact O-N 2.93Å; A1077-A1080 CarbonylContact O-C 3.47Å; A1077-A1080 WeakPolarHBondContact O-CA 3.38Å; A1077-A1080 WeakPolarHBondContact O-CB 3.49Å; A1077-A1080 PolarHBondContact O-N 2.97Å; A1077-D1081 WeakPolarHBondContact O-CB 3.32Å; A1077-D1081 PolarHBondContact O-N 2.92Å; A1077-P1228 HydrophobicContact CB-CB 4.12Å; A1077-P1228 WeakPolarHBondContact CB-O 3.15Å; A1077-V1229 HydrophobicContact CB-CG2 3.59Å
1078	S	91.3	Very high	91	Very high	72 Å²	72	39.3 Å²	39.3	50%	0.503	21%	0.213	S	C	.	.	H	α-helix	trans	-60.4	-33.2	177	72.4	0	0	0	0	113.2	S1074 S1075 H1082	S1074-S1078 PolarHBondContact O-N 3.33Å; S1075-S1078 PolarHBondContact O-N 3.31Å; S1075-S1078 PolarHBondContact O-OG 2.98Å; S1078-H1082 WeakPolarHBondContact O-CB 3.28Å; S1078-H1082 PolarHBondContact O-N 2.93Å
1079	V	91.7	Very high	90.9	Very high	21 Å²	21	40.5 Å²	40.5	13%	0.127	22%	0.221	C	C	.	.	H	α-helix	trans	-70.2	-41.1	171.5	177.3	0	0	0	0	111.1	V1059 A1062 V1076 A1077 W1083	V1059-V1079 HydrophobicContact CG2-CB 4.2Å; V1059-V1079 HydrophobicContact CG2-CG1 3.75Å; A1062-V1079 HydrophobicContact CB-CG2 3.92Å; V1076-V1079 PolarHBondContact O-N 3.45Å; A1077-V1079 PolarHBondContact O-N 2.93Å; V1079-W1083 PolarHBondContact O-N 3.31Å; V1079-W1083 VanDerWaalsContact O-N 3.14Å
1080	A	92.8	Very high	90.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65.3	-42.7	175.8	0	0	0	0	0	112.6	F1055 V1076 A1077 W1083 L1084 I1212 I1216 V1229	F1055-A1080 HydrophobicContact CE2-CB 3.93Å; V1076-A1080 PolarHBondContact O-N 3.3Å; A1077-A1080 CarbonylContact O-C 3.47Å; A1077-A1080 WeakPolarHBondContact O-CA 3.38Å; A1077-A1080 WeakPolarHBondContact O-CB 3.49Å; A1077-A1080 PolarHBondContact O-N 2.97Å; A1080-W1083 PolarHBondContact O-N 3Å; A1080-L1084 WeakPolarHBondContact O-CB 3.26Å; A1080-L1084 VanDerWaalsContact O-CG 3.22Å; A1080-L1084 WeakPolarHBondContact O-CG 3.36Å; A1080-L1084 PolarHBondContact O-N 3.38Å; A1080-I1212 HydrophobicContact CB-CD1 3.95Å; A1080-I1212 HydrophobicContact CB-CG1 4.06Å; A1080-I1216 HydrophobicContact CB-CD1 3.68Å; A1080-V1229 HydrophobicContact CB-CG2 3.85Å
1081	D	92.4	Very high	90.5	Very high	37 Å²	37	39.7 Å²	39.7	20%	0.198	21%	0.21	C	C	.	.	H	α-helix	trans	-65.3	-40.4	176.4	-86	-57.6	0	0	0	111.5	A1077 L1084 D1085 R1231	A1077-D1081 WeakPolarHBondContact O-CB 3.32Å; A1077-D1081 PolarHBondContact O-N 2.92Å; D1081-L1084 CarbonylContact O-C 3.51Å; D1081-L1084 PolarHBondContact O-N 3.41Å; D1081-D1085 WeakPolarHBondContact O-CB 3.4Å; D1081-D1085 PolarHBondContact O-N 3.5Å; D1081-R1231 PolarHBondContact O-NH1 2.94Å; D1081-R1231 WeakPolarHBondContact OD1-CD 3.33Å; D1081-R1231 IonicContact OD1-CZ 3.6Å; D1081-R1231 IonicContact OD1-NE 3.58Å; D1081-R1231 IonicContact OD1-NH1 2.86Å; D1081-R1231 PolarHBondContact OD1-NH1 2.94Å
1082	H	90.8	Very high	90	Very high	105 Å²	105	38.5 Å²	38.5	49%	0.486	22%	0.215	S	C	.	.	H	α-helix	trans	-58.6	-48.9	172.3	173.9	63.3	0	0	0	112.6	S1078 L1084 D1085 V1086	S1078-H1082 WeakPolarHBondContact O-CB 3.28Å; S1078-H1082 PolarHBondContact O-N 2.93Å; H1082-L1084 VanDerWaalsContact C-N 3.32Å; H1082-L1084 PolarHBondContact O-N 3.17Å; H1082-D1085 WeakPolarHBondContact O-CB 3.39Å; H1082-D1085 PolarHBondContact O-N 3Å; H1082-D1085 VanDerWaalsContact O-N 3.15Å; H1082-V1086 PolarHBondContact O-N 3.48Å
1083	W	91.4	Very high	89.5	Confident	30 Å²	30	46.3 Å²	46.3	11%	0.114	26%	0.257	C	S	.	.	H	α-helix	trans	-71.5	-25.6	177.9	-72.5	113.3	0	0	0	113.4	L1051 I1054 F1055 V1079 A1080 V1086 L1102 L1208	L1051-W1083 HydrophobicContact CD1-CD2 4.02Å; L1051-W1083 HydrophobicContact CD1-CE3 3.31Å; L1051-W1083 HydrophobicContact CD1-CZ3 3.79Å; I1054-W1083 HydrophobicContact CB-CZ2 4.41Å; I1054-W1083 HydrophobicContact CG2-CH2 3.88Å; I1054-W1083 HydrophobicContact CG2-CZ2 3.41Å; I1054-W1083 VanDerWaalsContact CG2-CZ2 3.41Å; F1055-W1083 HydrophobicContact CB-CG 4.41Å; F1055-W1083 HydrophobicContact CD2-CB 4.48Å; F1055-W1083 AromaticContact CD2-CD1 3.91Å; F1055-W1083 HydrophobicContact CD2-CG 4.44Å; V1079-W1083 PolarHBondContact O-N 3.31Å; V1079-W1083 VanDerWaalsContact O-N 3.14Å; A1080-W1083 PolarHBondContact O-N 3Å; W1083-V1086 HydrophobicContact CE3-CG2 4.31Å; W1083-L1102 HydrophobicContact CH2-CD2 4.44Å; W1083-L1102 HydrophobicContact CZ3-CD1 4.11Å; W1083-L1102 HydrophobicContact CZ3-CD2 4.19Å; W1083-L1208 HydrophobicContact CB-CD2 3.97Å
1084	L	90.6	Very high	88.9	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-69.6	-41.2	166.5	-74	169.4	0	0	0	111	A1080 D1081 H1082 V1086 L1087 Y1088 L1208 I1212 V1229 R1231 V1232	A1080-L1084 WeakPolarHBondContact O-CB 3.26Å; A1080-L1084 VanDerWaalsContact O-CG 3.22Å; A1080-L1084 WeakPolarHBondContact O-CG 3.36Å; A1080-L1084 PolarHBondContact O-N 3.38Å; D1081-L1084 CarbonylContact O-C 3.51Å; D1081-L1084 PolarHBondContact O-N 3.41Å; H1082-L1084 VanDerWaalsContact C-N 3.32Å; H1082-L1084 PolarHBondContact O-N 3.17Å; L1084-V1086 VanDerWaalsContact C-N 3.33Å; L1084-V1086 PolarHBondContact O-N 2.67Å; L1084-L1087 CarbonylContact O-C 3.56Å; L1084-L1087 WeakPolarHBondContact O-CA 3.42Å; L1084-L1087 PolarHBondContact O-N 3.31Å; L1084-Y1088 HydrophobicContact CB-CD2 4.11Å; L1084-Y1088 HydrophobicContact CB-CE2 4.27Å; L1084-Y1088 HydrophobicContact CD2-CE2 4.18Å; L1084-Y1088 VanDerWaalsContact O-CD2 3.24Å; L1084-Y1088 WeakPolarHBondContact O-CD2 3.24Å; L1084-Y1088 PolarHBondContact O-N 2.87Å; L1084-L1208 HydrophobicContact CD2-CD2 4.11Å; L1084-L1208 HydrophobicContact CG-CD2 4.35Å; L1084-I1212 HydrophobicContact CD1-CD1 3.89Å; L1084-I1212 HydrophobicContact CD2-CD1 4.06Å; L1084-I1212 HydrophobicContact CG-CD1 3.87Å; L1084-V1229 HydrophobicContact CD1-CG1 3.77Å; L1084-R1231 HydrophobicContact CD1-CB 4.35Å; L1084-V1232 HydrophobicContact CD1-CG2 3.96Å
1085	D	89.9	Confident	88.6	Confident	81 Å²	81	48.1 Å²	48.1	43%	0.433	27%	0.265	S	S	.	.	H	α-helix	trans	-62.1	-39.2	179.5	-71.8	-21.9	0	0	0	111.5	D1081 H1082 L1087 Y1088 S1089 R1231	D1081-D1085 WeakPolarHBondContact O-CB 3.4Å; D1081-D1085 PolarHBondContact O-N 3.5Å; H1082-D1085 WeakPolarHBondContact O-CB 3.39Å; H1082-D1085 PolarHBondContact O-N 3Å; H1082-D1085 VanDerWaalsContact O-N 3.15Å; D1085-L1087 VanDerWaalsContact C-N 3.28Å; D1085-L1087 PolarHBondContact O-N 3.01Å; D1085-Y1088 PolarHBondContact O-N 2.97Å; D1085-S1089 WeakPolarHBondContact O-CB 3.4Å; D1085-S1089 PolarHBondContact O-N 2.68Å; D1085-S1089 PolarHBondContact O-OG 3.15Å; D1085-R1231 IonicContact OD1-CZ 3.46Å; D1085-R1231 IonicContact OD1-NH1 2.74Å; D1085-R1231 PolarHBondContact OD1-NH1 3.26Å; D1085-R1231 IonicContact OD1-NH2 3.04Å; D1085-R1231 PolarHBondContact OD1-NH2 3Å; D1085-R1231 IonicContact OD2-NH1 3.92Å
1086	V	86.9	Confident	88.2	Confident	22 Å²	22	50 Å²	50	13%	0.133	27%	0.274	C	S	.	.	H	α-helix	trans	-56.7	-40.1	170.7	173.5	0	0	0	0	112	H1082 W1083 L1084 S1089 K1090 G1091 M1094	H1082-V1086 PolarHBondContact O-N 3.48Å; W1083-V1086 HydrophobicContact CE3-CG2 4.31Å; L1084-V1086 VanDerWaalsContact C-N 3.33Å; L1084-V1086 PolarHBondContact O-N 2.67Å; V1086-S1089 PolarHBondContact O-OG 3.26Å; V1086-K1090 PolarHBondContact O-N 2.85Å; V1086-G1091 PolarHBondContact O-N 2.88Å; V1086-M1094 HydrophobicContact CG1-CE 4.23Å
1087	L	90.1	Very high	87.5	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-78	-37	177.7	-65.6	-178.2	0	0	0	113.3	L1051 L1084 D1085 K1090 W1201 I1205 L1208	L1051-L1087 HydrophobicContact CD2-CD1 4.01Å; L1051-L1087 HydrophobicContact CD2-CD2 3.87Å; L1051-L1087 HydrophobicContact CD2-CG 4.17Å; L1084-L1087 CarbonylContact O-C 3.56Å; L1084-L1087 WeakPolarHBondContact O-CA 3.42Å; L1084-L1087 PolarHBondContact O-N 3.31Å; D1085-L1087 VanDerWaalsContact C-N 3.28Å; D1085-L1087 PolarHBondContact O-N 3.01Å; L1087-K1090 PolarHBondContact O-N 2.84Å; L1087-W1201 HydrophobicContact CD2-CE3 4.04Å; L1087-W1201 HydrophobicContact CD2-CZ3 3.95Å; L1087-I1205 HydrophobicContact CB-CD1 4.27Å; L1087-I1205 HydrophobicContact CB-CG1 3.69Å; L1087-I1205 HydrophobicContact CD1-CG1 3.84Å; L1087-I1205 HydrophobicContact CG-CG1 4.42Å; L1087-L1208 HydrophobicContact CD1-CB 4.08Å; L1087-L1208 HydrophobicContact CD1-CD2 3.75Å
1088	Y	90.3	Very high	87	Confident	120 Å²	120	58.2 Å²	58.2	47%	0.471	32%	0.32	S	S	.	.	H	α-helix	trans	-76	-29.5	179.4	-82.8	-73.6	0	0	0	112.5	L1084 D1085 I1205	L1084-Y1088 HydrophobicContact CB-CD2 4.11Å; L1084-Y1088 HydrophobicContact CB-CE2 4.27Å; L1084-Y1088 HydrophobicContact CD2-CE2 4.18Å; L1084-Y1088 VanDerWaalsContact O-CD2 3.24Å; L1084-Y1088 WeakPolarHBondContact O-CD2 3.24Å; L1084-Y1088 PolarHBondContact O-N 2.87Å; D1085-Y1088 PolarHBondContact O-N 2.97Å; Y1088-I1205 HydrophobicContact CD1-CD1 4.03Å; Y1088-I1205 HydrophobicContact CD2-CD1 4.41Å; Y1088-I1205 HydrophobicContact CE1-CD1 3.92Å; Y1088-I1205 HydrophobicContact CE2-CD1 4.32Å; Y1088-I1205 HydrophobicContact CE2-CG2 4.44Å; Y1088-I1205 HydrophobicContact CG-CD1 4.28Å
1089	S	89.2	Confident	86.8	Confident	59 Å²	59	54.8 Å²	54.8	41%	0.413	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-5.5	169.1	74	0	0	0	0	113.3	D1085 V1086 G1091 A1092	D1085-S1089 WeakPolarHBondContact O-CB 3.4Å; D1085-S1089 PolarHBondContact O-N 2.68Å; D1085-S1089 PolarHBondContact O-OG 3.15Å; V1086-S1089 PolarHBondContact O-OG 3.26Å; S1089-G1091 PolarHBondContact O-N 3.31Å; S1089-G1091 PolarHBondContact OG-N 3.38Å; S1089-A1092 PolarHBondContact O-N 2.86Å
1090	K	88.6	Confident	86.4	Confident	101 Å²	101	55.2 Å²	55.2	44%	0.439	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	29.4	-174.6	-54.8	-177.1	178.3	-177	0	114.4	V1086 L1087 A1092 R1196 W1201	V1086-K1090 PolarHBondContact O-N 2.85Å; L1087-K1090 PolarHBondContact O-N 2.84Å; K1090-A1092 VanDerWaalsContact C-N 3.31Å; K1090-A1092 PolarHBondContact O-N 3.3Å; K1090-R1196 WeakPolarHBondContact O-CD 3.35Å; K1090-R1196 WeakPolarHBondContact O-CG 3.46Å; K1090-W1201 VanDerWaalsContact CA-CH2 3.49Å; K1090-W1201 HydrophobicContact CB-CD2 4.05Å; K1090-W1201 HydrophobicContact CB-CE3 4.48Å; K1090-W1201 HydrophobicContact CB-CH2 4.06Å; K1090-W1201 HydrophobicContact CB-CZ2 3.57Å; K1090-W1201 HydrophobicContact CB-CZ3 4.5Å; K1090-W1201 HydrophobicContact CG-CD2 3.94Å; K1090-W1201 HydrophobicContact CG-CG 4.06Å; K1090-W1201 HydrophobicContact CG-CZ2 4.3Å; K1090-W1201 WeakPolarHBondContact O-CH2 3.41Å; K1090-W1201 VanDerWaalsContact O-CZ2 3.24Å; K1090-W1201 WeakPolarHBondContact O-CZ2 3.46Å
1091	G	84.3	Confident	85.7	Confident	2 Å²	2	59.3 Å²	59.3	2%	0.021	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	38	-178.9	0	0	0	0	0	113.6	V1086 S1089 D1093 M1094 R1196	V1086-G1091 PolarHBondContact O-N 2.88Å; S1089-G1091 PolarHBondContact O-N 3.31Å; S1089-G1091 PolarHBondContact OG-N 3.38Å; G1091-D1093 VanDerWaalsContact C-N 3.31Å; G1091-D1093 PolarHBondContact O-N 3.36Å; G1091-M1094 PolarHBondContact O-N 2.78Å; G1091-R1196 PolarHBondContact O-NE 3.32Å
1092	A	80.9	Confident	85.3	Confident	65 Å²	65	58 Å²	58	54%	0.537	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-39.1	-176.6	0	0	0	0	0	113.8	S1089 K1090	S1089-A1092 PolarHBondContact O-N 2.86Å; K1090-A1092 VanDerWaalsContact C-N 3.31Å; K1090-A1092 PolarHBondContact O-N 3.3Å
1093	D	79.3	Confident	85.2	Confident	165 Å²	165	53 Å²	53	88%	0.882	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	8.5	-177.5	-53.6	-64.5	0	0	0	113.8	G1091	G1091-D1093 VanDerWaalsContact C-N 3.31Å; G1091-D1093 PolarHBondContact O-N 3.36Å
1094	M	83	Confident	84.8	Confident	27 Å²	27	52.1 Å²	52.1	13%	0.133	29%	0.286	C	S	.	.	S	Bend	trans	-114	135.3	-172.6	175.8	179.1	-77.6	0	0	110.6	V1086 G1091 E1098 L1099 L1102 R1196	V1086-M1094 HydrophobicContact CG1-CE 4.23Å; G1091-M1094 PolarHBondContact O-N 2.78Å; M1094-E1098 HydrophobicContact CE-CG 4.14Å; M1094-E1098 HydrophobicContact CG-CB 3.86Å; M1094-E1098 HydrophobicContact CG-CG 3.96Å; M1094-E1098 HydrophobicContact SD-CB 4.31Å; M1094-E1098 HydrophobicContact SD-CG 3.98Å; M1094-L1099 HydrophobicContact CG-CB 4.49Å; M1094-L1099 HydrophobicContact SD-CB 4.2Å; M1094-L1102 HydrophobicContact CE-CD1 3.63Å; M1094-L1102 HydrophobicContact SD-CD1 3.61Å; M1094-R1196 PolarHBondContact O-NH2 3.22Å
1095	P	85.1	Confident	84.4	Confident	70 Å²	70	52.2 Å²	52.2	46%	0.455	29%	0.287	S	S	.	.			trans	-67.4	149.8	178.2	28.6	-34.9	0	0	0	112.5	S1097 E1098 L1099	P1095-S1097 PolarHBondContact O-N 3.42Å; P1095-S1097 VanDerWaalsContact O-N 3.13Å; P1095-E1098 WeakPolarHBondContact CD-OE2 3.49Å; P1095-E1098 HydrophobicContact CG-CB 3.95Å; P1095-E1098 PolarHBondContact O-N 3.32Å; P1095-E1098 VanDerWaalsContact O-N 3.12Å; P1095-L1099 PolarHBondContact O-N 3.3Å; P1095-L1099 VanDerWaalsContact O-N 3.08Å
1096	D	81.5	Confident	83.6	Confident	66 Å²	66	51.8 Å²	51.8	35%	0.353	28%	0.284	S	S	.	.	H	α-helix	trans	-55.3	-34.9	-175.1	-69.8	30.6	0	0	0	113.4	L1099 F1100 I1195 R1196	D1096-L1099 PolarHBondContact O-N 3.38Å; D1096-F1100 HydrophobicContact CB-CE2 4.38Å; D1096-F1100 WeakPolarHBondContact O-CB 3.31Å; D1096-F1100 WeakPolarHBondContact O-CD2 3.28Å; D1096-F1100 WeakPolarHBondContact O-CG 3.41Å; D1096-F1100 PolarHBondContact O-N 2.9Å; D1096-I1195 HydrophobicContact CB-CG2 4.45Å; D1096-I1195 WeakPolarHBondContact OD2-CG2 3.38Å; D1096-R1196 IonicContact OD1-CZ 2.69Å; D1096-R1196 VanDerWaalsContact OD1-CZ 3.25Å; D1096-R1196 IonicContact OD1-NH1 3.88Å; D1096-R1196 PolarHBondContact OD1-NH1 3.35Å; D1096-R1196 IonicContact OD1-NH2 3.13Å; D1096-R1196 PolarHBondContact OD1-NH2 3.33Å; D1096-R1196 IonicContact OD2-NH1 3.22Å
1097	S	77.1	Confident	82.8	Confident	77 Å²	77	56.1 Å²	56.1	54%	0.538	30%	0.298	S	S	.	.	H	α-helix	trans	-62.6	-49.8	176.3	46.3	0	0	0	0	113	P1095 L1099 F1100 D1101	P1095-S1097 PolarHBondContact O-N 3.42Å; P1095-S1097 VanDerWaalsContact O-N 3.13Å; S1097-L1099 VanDerWaalsContact C-N 3.31Å; S1097-L1099 PolarHBondContact O-N 2.99Å; S1097-F1100 WeakPolarHBondContact O-CB 3.14Å; S1097-F1100 PolarHBondContact O-N 3.37Å; S1097-D1101 PolarHBondContact O-N 2.96Å
1098	E	80.3	Confident	81.7	Confident	98 Å²	98	59.8 Å²	59.8	46%	0.458	32%	0.324	S	S	.	.	H	α-helix	trans	-64.1	-39.1	177.6	-173.3	-179.9	177.5	0	0	110.9	M1094 P1095 D1101 L1102	M1094-E1098 HydrophobicContact CE-CG 4.14Å; M1094-E1098 HydrophobicContact CG-CB 3.86Å; M1094-E1098 HydrophobicContact CG-CG 3.96Å; M1094-E1098 HydrophobicContact SD-CB 4.31Å; M1094-E1098 HydrophobicContact SD-CG 3.98Å; P1095-E1098 WeakPolarHBondContact CD-OE2 3.49Å; P1095-E1098 HydrophobicContact CG-CB 3.95Å; P1095-E1098 PolarHBondContact O-N 3.32Å; P1095-E1098 VanDerWaalsContact O-N 3.12Å; E1098-D1101 PolarHBondContact O-N 3.5Å; E1098-L1102 WeakPolarHBondContact O-CG 3.43Å; E1098-L1102 PolarHBondContact O-N 2.69Å; E1098-L1102 VanDerWaalsContact O-N 3.11Å
1099	L	86.2	Confident	80.6	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-60.7	-49.5	172.8	177.7	58.1	0	0	0	111.4	M1094 P1095 D1096 S1097 D1101 L1102 I1103 I1195 R1196 L1199 W1201	M1094-L1099 HydrophobicContact CG-CB 4.49Å; M1094-L1099 HydrophobicContact SD-CB 4.2Å; P1095-L1099 PolarHBondContact O-N 3.3Å; P1095-L1099 VanDerWaalsContact O-N 3.08Å; D1096-L1099 PolarHBondContact O-N 3.38Å; S1097-L1099 VanDerWaalsContact C-N 3.31Å; S1097-L1099 PolarHBondContact O-N 2.99Å; L1099-D1101 VanDerWaalsContact C-N 3.29Å; L1099-D1101 PolarHBondContact O-N 3.39Å; L1099-L1102 PolarHBondContact O-N 3.01Å; L1099-I1103 HydrophobicContact CD1-CG1 4.05Å; L1099-I1103 HydrophobicContact CD1-CG2 4.1Å; L1099-I1103 HydrophobicContact CG-CG1 4.27Å; L1099-I1103 WeakPolarHBondContact O-CG1 3.12Å; L1099-I1103 PolarHBondContact O-N 2.9Å; L1099-I1195 HydrophobicContact CD2-CG2 4.33Å; L1099-R1196 HydrophobicContact CD2-CG 4.18Å; L1099-L1199 HydrophobicContact CD2-CD1 3.94Å; L1099-L1199 HydrophobicContact CG-CD1 4.4Å; L1099-W1201 HydrophobicContact CD1-CH2 3.69Å; L1099-W1201 HydrophobicContact CD1-CZ3 4.23Å; L1099-W1201 HydrophobicContact CD2-CH2 3.98Å; L1099-W1201 HydrophobicContact CD2-CZ2 4.33Å; L1099-W1201 HydrophobicContact CG-CH2 4.49Å
1100	F	84.1	Confident	79.2	Confident	29 Å²	29	56.6 Å²	56.6	13%	0.127	32%	0.319	C	S	.	.	H	α-helix	trans	-55.2	-43	176.5	-80.7	-57	0	0	0	112.4	D1096 S1097 I1103 S1104 I1149 L1166 F1169 I1195	D1096-F1100 HydrophobicContact CB-CE2 4.38Å; D1096-F1100 WeakPolarHBondContact O-CB 3.31Å; D1096-F1100 WeakPolarHBondContact O-CD2 3.28Å; D1096-F1100 WeakPolarHBondContact O-CG 3.41Å; D1096-F1100 PolarHBondContact O-N 2.9Å; S1097-F1100 WeakPolarHBondContact O-CB 3.14Å; S1097-F1100 PolarHBondContact O-N 3.37Å; F1100-I1103 PolarHBondContact O-N 3.43Å; F1100-S1104 WeakPolarHBondContact O-CB 3.36Å; F1100-S1104 PolarHBondContact O-N 2.87Å; F1100-S1104 PolarHBondContact O-OG 2.96Å; F1100-I1149 HydrophobicContact CD1-CG2 4.27Å; F1100-I1149 HydrophobicContact CE1-CD1 4.36Å; F1100-L1166 HydrophobicContact CB-CD2 4.45Å; F1100-L1166 HydrophobicContact CD1-CD1 3.47Å; F1100-L1166 VanDerWaalsContact CD1-CD1 3.47Å; F1100-L1166 HydrophobicContact CD1-CD2 4.41Å; F1100-L1166 HydrophobicContact CD1-CG 3.99Å; F1100-L1166 HydrophobicContact CE1-CD1 3.87Å; F1100-L1166 HydrophobicContact CE1-CG 4.17Å; F1100-L1166 HydrophobicContact CG-CD1 4.25Å; F1100-L1166 HydrophobicContact CG-CD2 4.45Å; F1100-L1166 HydrophobicContact CG-CG 4.49Å; F1100-F1169 HydrophobicContact CE1-CB 4.48Å; F1100-F1169 AromaticContact CE1-CD2 3.86Å; F1100-F1169 HydrophobicContact CE1-CD2 3.86Å; F1100-F1169 HydrophobicContact CE1-CE2 4.22Å; F1100-F1169 HydrophobicContact CE1-CG 4.05Å; F1100-F1169 HydrophobicContact CE2-CB 4.3Å; F1100-F1169 HydrophobicContact CZ-CB 3.65Å; F1100-F1169 AromaticContact CZ-CD1 3.88Å; F1100-F1169 HydrophobicContact CZ-CD1 3.88Å; F1100-F1169 AromaticContact CZ-CD2 3.81Å; F1100-F1169 HydrophobicContact CZ-CD2 3.81Å; F1100-F1169 HydrophobicContact CZ-CE2 4.45Å; F1100-F1169 AromaticContact CZ-CG 3.5Å; F1100-F1169 HydrophobicContact CZ-CG 3.5Å; F1100-F1169 VanDerWaalsContact CZ-CG 3.5Å; F1100-I1195 HydrophobicContact CD1-CD1 3.81Å; F1100-I1195 HydrophobicContact CE1-CD1 3.09Å; F1100-I1195 HydrophobicContact CE2-CD1 4.22Å; F1100-I1195 HydrophobicContact CZ-CD1 3.32Å
1101	D	78.5	Confident	78.2	Confident	86 Å²	86	58.9 Å²	58.9	46%	0.46	32%	0.324	S	S	.	.	H	α-helix	trans	-64.6	-40.9	178.9	-76.3	-28.9	0	0	0	111.9	Q1050 S1097 E1098 L1099 R1147	Q1050-D1101 WeakPolarHBondContact CB-O 3.4Å; S1097-D1101 PolarHBondContact O-N 2.96Å; E1098-D1101 PolarHBondContact O-N 3.5Å; L1099-D1101 VanDerWaalsContact C-N 3.29Å; L1099-D1101 PolarHBondContact O-N 3.39Å; D1101-R1147 IonicContact OD1-CZ 2.85Å; D1101-R1147 IonicContact OD1-NH1 3.2Å; D1101-R1147 IonicContact OD1-NH2 3.85Å; D1101-R1147 PolarHBondContact OD1-NH2 2.87Å
1102	L	83.9	Confident	77.7	Confident	9 Å²	9	62.1 Å²	62.1	5%	0.047	34%	0.338	C	S	.	.	H	α-helix	trans	-64.1	-43.3	176.6	-71.3	176.7	0	0	0	113.6	L1051 I1054 W1083 M1094 E1098 L1099	L1051-L1102 HydrophobicContact CB-CB 4.28Å; L1051-L1102 HydrophobicContact CB-CD2 4.4Å; L1051-L1102 VanDerWaalsContact CB-O 3.27Å; L1051-L1102 WeakPolarHBondContact CB-O 3.45Å; L1051-L1102 HydrophobicContact CD1-CD2 4.34Å; L1051-L1102 PolarHBondContact N-O 3.37Å; I1054-L1102 HydrophobicContact CD1-CD2 3.77Å; W1083-L1102 HydrophobicContact CH2-CD2 4.44Å; W1083-L1102 HydrophobicContact CZ3-CD1 4.11Å; W1083-L1102 HydrophobicContact CZ3-CD2 4.19Å; M1094-L1102 HydrophobicContact CE-CD1 3.63Å; M1094-L1102 HydrophobicContact SD-CD1 3.61Å; E1098-L1102 WeakPolarHBondContact O-CG 3.43Å; E1098-L1102 PolarHBondContact O-N 2.69Å; E1098-L1102 VanDerWaalsContact O-N 3.11Å; L1099-L1102 PolarHBondContact O-N 3.01Å
1103	I	87.5	Confident	77.4	Confident	2 Å²	2	60 Å²	60	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-109.2	-2.7	-166.2	63.4	130	0	0	0	116	L1049 L1099 F1100 I1149 L1199 Y1204	L1049-I1103 WeakPolarHBondContact CD2-O 3.47Å; L1099-I1103 HydrophobicContact CD1-CG1 4.05Å; L1099-I1103 HydrophobicContact CD1-CG2 4.1Å; L1099-I1103 HydrophobicContact CG-CG1 4.27Å; L1099-I1103 WeakPolarHBondContact O-CG1 3.12Å; L1099-I1103 PolarHBondContact O-N 2.9Å; F1100-I1103 PolarHBondContact O-N 3.43Å; I1103-I1149 HydrophobicContact CD1-CB 4.37Å; I1103-I1149 HydrophobicContact CD1-CG2 3.74Å; I1103-I1149 HydrophobicContact CG1-CG2 4.42Å; I1103-L1199 HydrophobicContact CD1-CD1 3.54Å; I1103-L1199 HydrophobicContact CD1-CD2 3.26Å; I1103-L1199 HydrophobicContact CD1-CG 4.03Å; I1103-Y1204 HydrophobicContact CB-CD1 4.15Å; I1103-Y1204 HydrophobicContact CB-CE1 3.75Å; I1103-Y1204 HydrophobicContact CB-CE2 4.38Å; I1103-Y1204 HydrophobicContact CD1-CE2 4.09Å; I1103-Y1204 HydrophobicContact CG2-CD1 4.22Å; I1103-Y1204 HydrophobicContact CG2-CE1 4.34Å; I1103-Y1204 HydrophobicContact CG2-CG 4.42Å; I1103-Y1204 WeakPolarHBondContact O-CE1 3.32Å; I1103-Y1204 VanDerWaalsContact O-CZ 3.27Å; I1103-Y1204 PolarHBondContact O-OH 3.27Å
1104	S	84.3	Confident	77.1	Confident	10 Å²	10	56.2 Å²	56.2	7%	0.07	29%	0.294	C	S	.	.			trans	-80.6	143.8	173.3	56.7	0	0	0	0	112.6	F1100 R1147 Y1148	F1100-S1104 WeakPolarHBondContact O-CB 3.36Å; F1100-S1104 PolarHBondContact O-N 2.87Å; F1100-S1104 PolarHBondContact O-OG 2.96Å; S1104-R1147 PolarHBondContact OG-NE 3.39Å; S1104-R1147 VanDerWaalsContact OG-NE 3.08Å; S1104-R1147 PolarHBondContact OG-NH2 2.88Å; S1104-Y1148 WeakPolarHBondContact CA-O 3.2Å
1105	E	80.8	Confident	76.6	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.019	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	141.3	164.6	-66.9	-171.1	-173.1	0	0	109.3	L1049 R1107 R1147 Y1148 Y1203 R1207	L1049-E1105 HydrophobicContact CD2-CG 3.56Å; L1049-E1105 HydrophobicContact CG-CG 4.07Å; E1105-R1107 IonicContact OE2-CZ 3.43Å; E1105-R1107 IonicContact OE2-NE 3.29Å; E1105-R1107 PolarHBondContact OE2-NE 3.4Å; E1105-R1107 IonicContact OE2-NH2 2.73Å; E1105-R1107 PolarHBondContact OE2-NH2 3.39Å; E1105-R1147 CarbonylContact O-C 3.59Å; E1105-R1147 WeakPolarHBondContact O-CA 3.43Å; E1105-Y1148 HydrophobicContact CB-CD2 4.39Å; E1105-Y1148 HydrophobicContact CB-CE1 4.28Å; E1105-Y1148 HydrophobicContact CB-CE2 3.72Å; E1105-Y1148 HydrophobicContact CG-CE2 4.28Å; E1105-Y1148 PolarHBondContact N-O 2.69Å; E1105-Y1148 PolarHBondContact O-N 2.87Å; E1105-Y1148 PolarHBondContact OE2-OH 3.48Å; E1105-Y1203 PolarHBondContact OE1-OH 2.91Å; E1105-R1207 IonicContact OE1-CZ 2.74Å; E1105-R1207 IonicContact OE1-NE 2.7Å; E1105-R1207 IonicContact OE1-NH2 3.61Å; E1105-R1207 PolarHBondContact OE1-NH2 2.93Å
1106	N	73.3	Confident	75.9	Confident	71 Å²	71	58 Å²	58	38%	0.38	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.1	171.6	-173.9	-11.4	0	0	0	109.9	G1047 S1145 R1147	G1047-N1106 WeakPolarHBondContact CA-O 3.31Å; N1106-S1145 PolarHBondContact ND2-OG 3.49Å; N1106-S1145 PolarHBondContact OD1-OG 3.04Å; N1106-R1147 HydrophobicContact CB-CB 4.45Å; N1106-R1147 HydrophobicContact CB-CG 4.36Å
1107	R	71.4	Confident	75.4	Confident	114 Å²	114	56.7 Å²	56.7	43%	0.43	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	118.7	174.8	-59.9	-175.5	-168	-163.5	8.1	110.9	E1105 S1123 C1146 Y1148	E1105-R1107 IonicContact OE2-CZ 3.43Å; E1105-R1107 IonicContact OE2-NE 3.29Å; E1105-R1107 PolarHBondContact OE2-NE 3.4Å; E1105-R1107 IonicContact OE2-NH2 2.73Å; E1105-R1107 PolarHBondContact OE2-NH2 3.39Å; R1107-S1123 WeakPolarHBondContact CB-OG 3.49Å; R1107-C1146 PolarHBondContact N-O 3.44Å; R1107-C1146 WeakPolarHBondContact O-CB 3.47Å; R1107-C1146 PolarHBondContact O-N 3.31Å; R1107-Y1148 PolarHBondContact NE-OH 3.26Å
1108	S	66.9	Low	75.1	Confident	79 Å²	79	58.5 Å²	58.5	55%	0.552	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	139	172.7	-44	0	0	0	0	111.6
1109	M	65.6	Low	74.8	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.039	32%	0.318	C	S	.	.			trans	-88.3	124.3	175.6	-56.1	-155.6	-52.3	0	0	111	R1111 L1113 Y1116 L1124 A1127 G1143 L1144	M1109-R1111 VanDerWaalsContact C-N 3.28Å; M1109-R1111 PolarHBondContact O-N 2.9Å; M1109-L1113 HydrophobicContact CE-CB 4.46Å; M1109-L1113 HydrophobicContact CE-CD1 4.29Å; M1109-Y1116 HydrophobicContact CB-CE2 4.16Å; M1109-Y1116 HydrophobicContact SD-CE2 4.41Å; M1109-L1124 HydrophobicContact CE-CD2 4.37Å; M1109-L1124 HydrophobicContact SD-CD2 3.64Å; M1109-L1124 HydrophobicContact SD-CG 4.28Å; M1109-A1127 HydrophobicContact CE-CB 3.8Å; M1109-A1127 HydrophobicContact SD-CB 4.15Å; M1109-G1143 CarbonylContact O-C 3.54Å; M1109-G1143 WeakPolarHBondContact O-CA 3.34Å; M1109-G1143 PolarHBondContact O-N 3.05Å; M1109-L1144 HydrophobicContact CE-CB 4.32Å; M1109-L1144 HydrophobicContact CE-CD2 4.3Å; M1109-L1144 PolarHBondContact N-O 2.74Å
1110	S	60.4	Low	74.4	Confident	105 Å²	105	65.5 Å²	65.5	73%	0.734	34%	0.343	S	S	*	.	S	Bend	trans	-82.3	0.7	-175.9	57.5	0	0	0	0	115.1	Y1116	S1110-Y1116 PolarHBondContact N-OH 2.98Å; S1110-Y1116 VanDerWaalsContact N-OH 3.12Å; S1110-Y1116 PolarHBondContact OG-OH 2.94Å
1111	R	68.3	Low	74.3	Confident	148 Å²	148	65.9 Å²	65.9	56%	0.558	35%	0.35	S	S	*	.	S	Bend	trans	-143	173.7	178.3	-57.5	-174.1	179.9	172.3	-2.1	109.6	M1109 D1115 Y1116	M1109-R1111 VanDerWaalsContact C-N 3.28Å; M1109-R1111 PolarHBondContact O-N 2.9Å; R1111-D1115 HydrophobicContact CB-CB 3.68Å; R1111-D1115 WeakPolarHBondContact CB-OD2 3.39Å; R1111-D1115 HydrophobicContact CG-CB 4.45Å; R1111-Y1116 HydrophobicContact CB-CD2 4.44Å; R1111-Y1116 HydrophobicContact CB-CE2 3.72Å; R1111-Y1116 PolarHBondContact N-OH 3.14Å
1112	K	73.4	Confident	74.6	Confident	71 Å²	71	62.5 Å²	62.5	31%	0.309	33%	0.332	S	S	.	.			trans	-70.1	162.3	175.6	-60.4	-175.6	168.2	-140.8	0	111	E1114 D1115 Y1116 K1140 A1142	K1112-E1114 HydrophobicContact CB-CG 3.76Å; K1112-E1114 HydrophobicContact CD-CG 4.21Å; K1112-E1114 WeakPolarHBondContact CD-OE1 3.37Å; K1112-E1114 IonicContact NZ-OE1 2.71Å; K1112-E1114 PolarHBondContact O-N 3.5Å; K1112-D1115 WeakPolarHBondContact CB-OD2 3.31Å; K1112-D1115 PolarHBondContact N-OD2 3.36Å; K1112-D1115 PolarHBondContact O-N 3.43Å; K1112-D1115 VanDerWaalsContact O-N 3.15Å; K1112-Y1116 VanDerWaalsContact O-CD2 3.24Å; K1112-Y1116 WeakPolarHBondContact O-CD2 3.5Å; K1112-K1140 VanDerWaalsContact CD-O 3.29Å; K1112-K1140 WeakPolarHBondContact CD-O 3.41Å; K1112-K1140 WeakPolarHBondContact CE-O 3.25Å; K1112-K1140 PolarHBondContact NZ-O 3.14Å; K1112-A1142 HydrophobicContact CG-CB 4.25Å
1113	L	74.2	Confident	74.5	Confident	20 Å²	20	62.8 Å²	62.8	11%	0.105	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-58.4	-36.8	176.4	-176.6	65.7	0	0	0	112.1	M1109 D1115 Y1116 L1124 A1127 R1128 V1139	M1109-L1113 HydrophobicContact CE-CB 4.46Å; M1109-L1113 HydrophobicContact CE-CD1 4.29Å; L1113-D1115 VanDerWaalsContact C-N 3.33Å; L1113-D1115 PolarHBondContact O-N 3.02Å; L1113-Y1116 PolarHBondContact O-N 2.95Å; L1113-L1124 HydrophobicContact CD1-CD2 3.6Å; L1113-A1127 HydrophobicContact CD1-CB 4.21Å; L1113-R1128 HydrophobicContact CD1-CG 4.37Å; L1113-R1128 HydrophobicContact CD2-CG 3.95Å; L1113-V1139 HydrophobicContact CB-CB 4.01Å; L1113-V1139 HydrophobicContact CD2-CB 3.69Å; L1113-V1139 HydrophobicContact CD2-CG1 3.9Å; L1113-V1139 HydrophobicContact CD2-CG2 3.98Å; L1113-V1139 HydrophobicContact CG-CB 4.47Å
1114	E	74.2	Confident	74.3	Confident	85 Å²	85	62.9 Å²	62.9	40%	0.397	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-64.7	-29.4	178.1	57.4	-178.9	153.8	0	0	114.1	K1112 Y1116 G1117	K1112-E1114 HydrophobicContact CB-CG 3.76Å; K1112-E1114 HydrophobicContact CD-CG 4.21Å; K1112-E1114 WeakPolarHBondContact CD-OE1 3.37Å; K1112-E1114 IonicContact NZ-OE1 2.71Å; K1112-E1114 PolarHBondContact O-N 3.5Å; E1114-Y1116 VanDerWaalsContact C-N 3.29Å; E1114-Y1116 PolarHBondContact O-N 2.78Å; E1114-G1117 PolarHBondContact O-N 3.43Å
1115	D	71.6	Confident	74.4	Confident	90 Å²	90	63.3 Å²	63.3	48%	0.481	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-73.4	-18.4	-177.4	-66.6	-49.1	0	0	0	113.6	R1111 K1112 L1113	R1111-D1115 HydrophobicContact CB-CB 3.68Å; R1111-D1115 WeakPolarHBondContact CB-OD2 3.39Å; R1111-D1115 HydrophobicContact CG-CB 4.45Å; K1112-D1115 WeakPolarHBondContact CB-OD2 3.31Å; K1112-D1115 PolarHBondContact N-OD2 3.36Å; K1112-D1115 PolarHBondContact O-N 3.43Å; K1112-D1115 VanDerWaalsContact O-N 3.15Å; L1113-D1115 VanDerWaalsContact C-N 3.33Å; L1113-D1115 PolarHBondContact O-N 3.02Å
1116	Y	69.8	Low	74.7	Confident	45 Å²	45	63.1 Å²	63.1	18%	0.176	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-94.6	-13.8	177.8	-63.8	-80	0	0	0	113.2	M1109 S1110 R1111 K1112 L1113 E1114 S1118 Q1119 L1124	M1109-Y1116 HydrophobicContact CB-CE2 4.16Å; M1109-Y1116 HydrophobicContact SD-CE2 4.41Å; S1110-Y1116 PolarHBondContact N-OH 2.98Å; S1110-Y1116 VanDerWaalsContact N-OH 3.12Å; S1110-Y1116 PolarHBondContact OG-OH 2.94Å; R1111-Y1116 HydrophobicContact CB-CD2 4.44Å; R1111-Y1116 HydrophobicContact CB-CE2 3.72Å; R1111-Y1116 PolarHBondContact N-OH 3.14Å; K1112-Y1116 VanDerWaalsContact O-CD2 3.24Å; K1112-Y1116 WeakPolarHBondContact O-CD2 3.5Å; L1113-Y1116 PolarHBondContact O-N 2.95Å; E1114-Y1116 VanDerWaalsContact C-N 3.29Å; E1114-Y1116 PolarHBondContact O-N 2.78Å; Y1116-S1118 PolarHBondContact O-N 3.12Å; Y1116-Q1119 WeakPolarHBondContact O-CB 3.29Å; Y1116-Q1119 WeakPolarHBondContact O-CG 3.33Å; Y1116-Q1119 PolarHBondContact O-N 3.47Å; Y1116-L1124 HydrophobicContact CD2-CD2 3.71Å; Y1116-L1124 HydrophobicContact CG-CD1 4.26Å; Y1116-L1124 HydrophobicContact CG-CD2 3.83Å
1117	G	70.7	Confident	75.2	Confident	38 Å²	38	59.8 Å²	59.8	39%	0.392	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	-126.5	176.5	0	0	0	0	0	114.5	E1114 Q1119 R1128	E1114-G1117 PolarHBondContact O-N 3.43Å; G1117-Q1119 VanDerWaalsContact C-N 3.34Å; G1117-R1128 PolarHBondContact O-NH2 2.99Å; G1117-R1128 VanDerWaalsContact O-NH2 3.14Å
1118	S	72.5	Confident	75.9	Confident	115 Å²	115	57.9 Å²	57.9	80%	0.804	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-1.9	-175.2	53.9	0	0	0	0	114.8	Y1116 K1120	Y1116-S1118 PolarHBondContact O-N 3.12Å; S1118-K1120 PolarHBondContact O-N 3.07Å
1119	Q	73.7	Confident	76.9	Confident	124 Å²	124	55.7 Å²	55.7	58%	0.579	29%	0.292	S	S	*	.			trans	-59.7	133.1	-177.8	-65.8	-179.1	11.4	0	0	111.6	Y1116 G1117 L1124	Y1116-Q1119 WeakPolarHBondContact O-CB 3.29Å; Y1116-Q1119 WeakPolarHBondContact O-CG 3.33Å; Y1116-Q1119 PolarHBondContact O-N 3.47Å; G1117-Q1119 VanDerWaalsContact C-N 3.34Å; Q1119-L1124 HydrophobicContact CB-CD1 4.08Å; Q1119-L1124 WeakPolarHBondContact O-CD1 3.34Å
1120	K	76.3	Confident	77.6	Confident	122 Å²	122	55.5 Å²	55.5	53%	0.53	29%	0.291	S	S	.	.			trans	-95.4	118.6	175.9	-67.6	-169	177.9	-169.7	0	110.6	S1118 E1161	S1118-K1120 PolarHBondContact O-N 3.07Å; K1120-E1161 WeakPolarHBondContact CE-OE1 3.44Å; K1120-E1161 IonicContact NZ-OE1 3.45Å; K1120-E1161 PolarHBondContact NZ-OE1 3.17Å
1121	S	82	Confident	78.7	Confident	38 Å²	38	50.8 Å²	50.8	27%	0.266	26%	0.258	S	S	.	.			trans	-142.6	163.6	170.6	80	0	0	0	0	110.9	S1123 L1124 S1125	S1121-S1123 VanDerWaalsContact C-N 3.34Å; S1121-L1124 PolarHBondContact O-N 2.92Å; S1121-L1124 WeakPolarHBondContact OG-CB 3.21Å; S1121-L1124 WeakPolarHBondContact OG-CD1 3.49Å; S1121-L1124 VanDerWaalsContact OG-CG 3.26Å; S1121-L1124 WeakPolarHBondContact OG-CG 3.37Å; S1121-L1124 PolarHBondContact OG-N 3.49Å; S1121-L1124 VanDerWaalsContact OG-N 3.09Å; S1121-S1125 WeakPolarHBondContact O-CB 3.47Å; S1121-S1125 PolarHBondContact O-N 3.41Å; S1121-S1125 PolarHBondContact O-OG 3.04Å
1122	T	85.2	Confident	79.5	Confident	15 Å²	15	45 Å²	45	9%	0.092	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-44.3	174.8	46	0	0	0	0	111.2	S1125 T1126 Y1148 I1150 T1160 A1163	T1122-S1125 PolarHBondContact O-N 2.87Å; T1122-T1126 WeakPolarHBondContact O-CB 3.31Å; T1122-T1126 PolarHBondContact O-N 3.14Å; T1122-T1126 PolarHBondContact O-OG1 2.76Å; T1122-Y1148 VanDerWaalsContact CB-CZ 3.44Å; T1122-Y1148 HydrophobicContact CG2-CE2 4.06Å; T1122-Y1148 VanDerWaalsContact OG1-CZ 3.28Å; T1122-Y1148 PolarHBondContact OG1-OH 3.03Å; T1122-I1150 HydrophobicContact CG2-CD1 4.3Å; T1122-T1160 HydrophobicContact CG2-CG2 4.5Å; T1122-A1163 HydrophobicContact CG2-CB 4.24Å
1123	S	82.5	Confident	79.8	Confident	14 Å²	14	43 Å²	43	10%	0.098	23%	0.229	C	C	.	.	H	α-helix	trans	-59.7	-48	175.1	-59.1	0	0	0	0	112.4	R1107 S1121 S1125 T1126 A1127 C1146	R1107-S1123 WeakPolarHBondContact CB-OG 3.49Å; S1121-S1123 VanDerWaalsContact C-N 3.34Å; S1123-S1125 VanDerWaalsContact C-N 3.32Å; S1123-S1125 PolarHBondContact O-N 3.31Å; S1123-T1126 WeakPolarHBondContact O-CB 3.26Å; S1123-T1126 PolarHBondContact O-N 3.47Å; S1123-A1127 WeakPolarHBondContact O-CB 3.07Å; S1123-A1127 PolarHBondContact O-N 3.47Å; S1123-C1146 PolarHBondContact O-SG 2.92Å; S1123-C1146 VanDerWaalsContact O-SG 3.37Å
1124	L	83.8	Confident	80	Confident	4 Å²	4	45.5 Å²	45.5	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-66.8	-34.5	-178.2	-67.2	165.2	0	0	0	112	M1109 L1113 Y1116 Q1119 S1121 R1128	M1109-L1124 HydrophobicContact CE-CD2 4.37Å; M1109-L1124 HydrophobicContact SD-CD2 3.64Å; M1109-L1124 HydrophobicContact SD-CG 4.28Å; L1113-L1124 HydrophobicContact CD1-CD2 3.6Å; Y1116-L1124 HydrophobicContact CD2-CD2 3.71Å; Y1116-L1124 HydrophobicContact CG-CD1 4.26Å; Y1116-L1124 HydrophobicContact CG-CD2 3.83Å; Q1119-L1124 HydrophobicContact CB-CD1 4.08Å; Q1119-L1124 WeakPolarHBondContact O-CD1 3.34Å; S1121-L1124 PolarHBondContact O-N 2.92Å; S1121-L1124 WeakPolarHBondContact OG-CB 3.21Å; S1121-L1124 WeakPolarHBondContact OG-CD1 3.49Å; S1121-L1124 VanDerWaalsContact OG-CG 3.26Å; S1121-L1124 WeakPolarHBondContact OG-CG 3.37Å; S1121-L1124 PolarHBondContact OG-N 3.49Å; S1121-L1124 VanDerWaalsContact OG-N 3.09Å; L1124-R1128 WeakPolarHBondContact O-CG 3.35Å; L1124-R1128 PolarHBondContact O-N 3.04Å; L1124-R1128 VanDerWaalsContact O-N 3.11Å
1125	S	86.5	Confident	80	Confident	20 Å²	20	42.9 Å²	42.9	14%	0.14	24%	0.238	C	C	.	.	H	α-helix	trans	-71.7	-36.2	174.1	-51.8	0	0	0	0	111.9	S1121 T1122 S1123 R1129 T1160	S1121-S1125 WeakPolarHBondContact O-CB 3.47Å; S1121-S1125 PolarHBondContact O-N 3.41Å; S1121-S1125 PolarHBondContact O-OG 3.04Å; T1122-S1125 PolarHBondContact O-N 2.87Å; S1123-S1125 VanDerWaalsContact C-N 3.32Å; S1123-S1125 PolarHBondContact O-N 3.31Å; S1125-R1129 WeakPolarHBondContact O-CB 3.35Å; S1125-R1129 WeakPolarHBondContact O-CG 3.25Å; S1125-R1129 PolarHBondContact O-N 3.28Å; S1125-T1160 WeakPolarHBondContact CB-O 3.27Å; S1125-T1160 PolarHBondContact OG-O 3.39Å; S1125-T1160 VanDerWaalsContact OG-O 3.09Å
1126	T	86.4	Confident	80.1	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-65.4	-47.5	173.6	-55.9	0	0	0	0	110.9	T1122 S1123 R1128 R1129 M1130 C1146 Y1148 P1165	T1122-T1126 WeakPolarHBondContact O-CB 3.31Å; T1122-T1126 PolarHBondContact O-N 3.14Å; T1122-T1126 PolarHBondContact O-OG1 2.76Å; S1123-T1126 WeakPolarHBondContact O-CB 3.26Å; S1123-T1126 PolarHBondContact O-N 3.47Å; T1126-R1128 PolarHBondContact O-N 3.35Å; T1126-R1129 PolarHBondContact O-N 3.19Å; T1126-M1130 HydrophobicContact CG2-SD 3.95Å; T1126-M1130 WeakPolarHBondContact O-CG 3.28Å; T1126-M1130 PolarHBondContact O-N 3.02Å; T1126-C1146 HydrophobicContact CG2-CB 3.84Å; T1126-Y1148 HydrophobicContact CG2-CD1 4.31Å; T1126-Y1148 WeakPolarHBondContact OG1-CB 3.16Å; T1126-Y1148 WeakPolarHBondContact OG1-CD1 3.16Å; T1126-P1165 HydrophobicContact CG2-CB 3.85Å; T1126-P1165 HydrophobicContact CG2-CG 3.82Å
1127	A	83.9	Confident	80	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57.8	-47.8	177.6	0	0	0	0	0	112.3	M1109 L1113 S1123 M1130 A1131 V1139 L1144	M1109-A1127 HydrophobicContact CE-CB 3.8Å; M1109-A1127 HydrophobicContact SD-CB 4.15Å; L1113-A1127 HydrophobicContact CD1-CB 4.21Å; S1123-A1127 WeakPolarHBondContact O-CB 3.07Å; S1123-A1127 PolarHBondContact O-N 3.47Å; A1127-M1130 PolarHBondContact O-N 2.55Å; A1127-A1131 PolarHBondContact O-N 3.18Å; A1127-A1131 VanDerWaalsContact O-N 3.13Å; A1127-V1139 HydrophobicContact CB-CG1 4.17Å; A1127-V1139 WeakPolarHBondContact O-CG1 3.33Å; A1127-L1144 HydrophobicContact CB-CD2 3.65Å
1128	R	85.1	Confident	79.8	Confident	75 Å²	75	43.5 Å²	43.5	28%	0.283	23%	0.231	S	C	.	.	H	α-helix	trans	-59.7	-47.9	173.9	-71.9	176.8	-168.2	163.2	6.1	111.1	L1113 G1117 L1124 T1126 M1130 A1131 E1132	L1113-R1128 HydrophobicContact CD1-CG 4.37Å; L1113-R1128 HydrophobicContact CD2-CG 3.95Å; G1117-R1128 PolarHBondContact O-NH2 2.99Å; G1117-R1128 VanDerWaalsContact O-NH2 3.14Å; L1124-R1128 WeakPolarHBondContact O-CG 3.35Å; L1124-R1128 PolarHBondContact O-N 3.04Å; L1124-R1128 VanDerWaalsContact O-N 3.11Å; T1126-R1128 PolarHBondContact O-N 3.35Å; R1128-M1130 VanDerWaalsContact C-N 3.33Å; R1128-M1130 PolarHBondContact O-N 2.9Å; R1128-A1131 WeakPolarHBondContact O-CB 3.24Å; R1128-A1131 PolarHBondContact O-N 3.43Å; R1128-A1131 VanDerWaalsContact O-N 3.11Å; R1128-E1132 WeakPolarHBondContact O-CG 3.45Å; R1128-E1132 PolarHBondContact O-N 2.94Å; R1128-E1132 VanDerWaalsContact O-N 3.14Å
1129	R	88.1	Confident	79.7	Confident	33 Å²	33	38.8 Å²	38.8	13%	0.125	20%	0.198	C	C	.	.	H	α-helix	trans	-59.3	-38.8	177.5	-79.9	-175.1	167.2	147.6	5.5	113.5	S1125 T1126 E1132 F1133 E1161 A1163 P1165 W1183	S1125-R1129 WeakPolarHBondContact O-CB 3.35Å; S1125-R1129 WeakPolarHBondContact O-CG 3.25Å; S1125-R1129 PolarHBondContact O-N 3.28Å; T1126-R1129 PolarHBondContact O-N 3.19Å; R1129-E1132 WeakPolarHBondContact O-CB 3.49Å; R1129-E1132 PolarHBondContact O-N 3.04Å; R1129-F1133 WeakPolarHBondContact O-CD1 3.15Å; R1129-E1161 VanDerWaalsContact CZ-O 3.26Å; R1129-E1161 PolarHBondContact NH1-O 2.66Å; R1129-E1161 PolarHBondContact NH2-O 3.33Å; R1129-A1163 WeakPolarHBondContact CD-O 3.24Å; R1129-A1163 PolarHBondContact NH1-O 3.27Å; R1129-P1165 HydrophobicContact CB-CG 3.58Å; R1129-W1183 HydrophobicContact CB-CD2 4.48Å; R1129-W1183 HydrophobicContact CB-CH2 4.01Å; R1129-W1183 HydrophobicContact CB-CZ2 3.67Å; R1129-W1183 HydrophobicContact CG-CD2 4.06Å; R1129-W1183 HydrophobicContact CG-CG 4.4Å; R1129-W1183 HydrophobicContact CG-CZ2 3.98Å; R1129-W1183 VanDerWaalsContact NE-CG 3.34Å; R1129-W1183 VanDerWaalsContact O-CZ2 3.23Å; R1129-W1183 WeakPolarHBondContact O-CZ2 3.33Å
1130	M	81.5	Confident	79.5	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.02	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-45.6	173.7	-69.4	165	71.6	0	0	111.2	L308 T1126 A1127 R1128 E1132 F1133 L1134 L1144 P1165	L308-M1130 HydrophobicContact CB-CE 3.8Å; L308-M1130 HydrophobicContact CD1-CE 4.08Å; L308-M1130 HydrophobicContact CD2-CE 4.04Å; L308-M1130 HydrophobicContact CG-CE 4.18Å; T1126-M1130 HydrophobicContact CG2-SD 3.95Å; T1126-M1130 WeakPolarHBondContact O-CG 3.28Å; T1126-M1130 PolarHBondContact O-N 3.02Å; A1127-M1130 PolarHBondContact O-N 2.55Å; R1128-M1130 VanDerWaalsContact C-N 3.33Å; R1128-M1130 PolarHBondContact O-N 2.9Å; M1130-E1132 PolarHBondContact O-N 3.24Å; M1130-F1133 PolarHBondContact O-N 3.26Å; M1130-L1134 HydrophobicContact CB-CD1 4.19Å; M1130-L1134 WeakPolarHBondContact O-CB 3.24Å; M1130-L1134 PolarHBondContact O-N 3.02Å; M1130-L1144 HydrophobicContact CE-CD1 3.94Å; M1130-P1165 HydrophobicContact CG-CB 3.64Å; M1130-P1165 HydrophobicContact CG-CG 3.75Å; M1130-P1165 HydrophobicContact SD-CB 4.35Å
1131	A	82.6	Confident	78.8	Confident	5 Å²	5	35.7 Å²	35.7	4%	0.041	19%	0.186	C	C	.	.	H	α-helix	trans	-59.4	-32	176	0	0	0	0	0	113.2	A1127 R1128 F1133 G1135 V1139	A1127-A1131 PolarHBondContact O-N 3.18Å; A1127-A1131 VanDerWaalsContact O-N 3.13Å; R1128-A1131 WeakPolarHBondContact O-CB 3.24Å; R1128-A1131 PolarHBondContact O-N 3.43Å; R1128-A1131 VanDerWaalsContact O-N 3.11Å; A1131-F1133 VanDerWaalsContact C-N 3.32Å; A1131-F1133 PolarHBondContact O-N 3.08Å; A1131-G1135 CarbonylContact O-C 3.52Å; A1131-G1135 VanDerWaalsContact O-C 3.31Å; A1131-G1135 WeakPolarHBondContact O-CA 3.03Å; A1131-G1135 PolarHBondContact O-N 3.01Å; A1131-V1139 HydrophobicContact CB-CG1 4.03Å; A1131-V1139 HydrophobicContact CB-CG2 3.83Å
1132	E	84.8	Confident	77.8	Confident	28 Å²	28	36.5 Å²	36.5	13%	0.131	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-33.5	-178.8	-53.5	-174.9	-159.2	0	0	114.6	R1128 R1129 M1130 Y1179 K1182 W1183 H2463	R1128-E1132 WeakPolarHBondContact O-CG 3.45Å; R1128-E1132 PolarHBondContact O-N 2.94Å; R1128-E1132 VanDerWaalsContact O-N 3.14Å; R1129-E1132 WeakPolarHBondContact O-CB 3.49Å; R1129-E1132 PolarHBondContact O-N 3.04Å; M1130-E1132 PolarHBondContact O-N 3.24Å; E1132-Y1179 HydrophobicContact CB-CD1 4.15Å; E1132-Y1179 HydrophobicContact CB-CE1 3.73Å; E1132-Y1179 VanDerWaalsContact O-CE1 3.26Å; E1132-Y1179 WeakPolarHBondContact O-CE1 3.15Å; E1132-Y1179 VanDerWaalsContact O-CZ 3.28Å; E1132-Y1179 PolarHBondContact O-OH 3.25Å; E1132-K1182 VanDerWaalsContact OE2-CE 3.29Å; E1132-K1182 WeakPolarHBondContact OE2-CE 3.34Å; E1132-K1182 IonicContact OE2-NZ 2.68Å; E1132-K1182 PolarHBondContact OE2-NZ 2.91Å; E1132-W1183 VanDerWaalsContact CD-NE1 3.3Å; E1132-W1183 PolarHBondContact OE1-NE1 2.94Å; E1132-W1183 PolarHBondContact OE2-NE1 2.92Å; E1132-H2463 HydrophobicContact CG-CB 4.09Å; E1132-H2463 IonicContact OE1-CD2 3.26Å; E1132-H2463 IonicContact OE2-CD2 3.71Å
1133	F	80.9	Confident	76.6	Confident	29 Å²	29	36.7 Å²	36.7	13%	0.127	20%	0.199	C	C	.	.	H	α-helix	trans	-115.1	-15.7	-174.4	83	-83.5	0	0	0	114.7	R1129 M1130 A1131 A1167 I1168 A1171 I1175 Y1179 W1183	R1129-F1133 WeakPolarHBondContact O-CD1 3.15Å; M1130-F1133 PolarHBondContact O-N 3.26Å; A1131-F1133 VanDerWaalsContact C-N 3.32Å; A1131-F1133 PolarHBondContact O-N 3.08Å; F1133-A1167 HydrophobicContact CZ-CB 3.93Å; F1133-I1168 HydrophobicContact CD1-CD1 4.13Å; F1133-I1168 HydrophobicContact CD2-CD1 3.67Å; F1133-I1168 HydrophobicContact CE1-CB 4.37Å; F1133-I1168 HydrophobicContact CE1-CD1 4.16Å; F1133-I1168 HydrophobicContact CE2-CD1 3.71Å; F1133-I1168 HydrophobicContact CG-CD1 3.89Å; F1133-I1168 HydrophobicContact CZ-CB 4.14Å; F1133-I1168 HydrophobicContact CZ-CD1 3.95Å; F1133-A1171 HydrophobicContact CE2-CB 4.11Å; F1133-I1175 HydrophobicContact CB-CG2 4.36Å; F1133-I1175 HydrophobicContact CD2-CG2 3.99Å; F1133-Y1179 HydrophobicContact CB-CD1 3.86Å; F1133-Y1179 HydrophobicContact CB-CD2 3.49Å; F1133-Y1179 VanDerWaalsContact CB-CD2 3.49Å; F1133-Y1179 HydrophobicContact CB-CE1 3.71Å; F1133-Y1179 HydrophobicContact CB-CE2 3.36Å; F1133-Y1179 HydrophobicContact CB-CG 3.76Å; F1133-Y1179 VanDerWaalsContact CB-CZ 3.46Å; F1133-Y1179 HydrophobicContact CG-CD2 4.44Å; F1133-W1183 AromaticContact CD1-CH2 3.67Å; F1133-W1183 HydrophobicContact CD1-CH2 3.67Å; F1133-W1183 HydrophobicContact CD1-CZ2 4.06Å; F1133-W1183 AromaticContact CE1-CH2 3.84Å; F1133-W1183 HydrophobicContact CE1-CH2 3.84Å
1134	L	77.3	Confident	76.1	Confident	71 Å²	71	36.3 Å²	36.3	37%	0.372	20%	0.196	S	C	.	.	H	α-helix	trans	-112.6	-8.5	178.1	-58.7	153.4	0	0	0	112.4	L308 M1130 I1138	L308-L1134 HydrophobicContact CD1-CD1 3.35Å; L308-L1134 HydrophobicContact CD1-CD2 4.38Å; L308-L1134 HydrophobicContact CD1-CG 4.49Å; M1130-L1134 HydrophobicContact CB-CD1 4.19Å; M1130-L1134 WeakPolarHBondContact O-CB 3.24Å; M1130-L1134 PolarHBondContact O-N 3.02Å; L1134-I1138 HydrophobicContact CB-CD1 3.31Å; L1134-I1138 HydrophobicContact CD1-CD1 4.07Å; L1134-I1138 HydrophobicContact CG-CD1 4.26Å
1135	G	75.1	Confident	75.4	Confident	31 Å²	31	38 Å²	38	32%	0.32	21%	0.208	S	C	.	.			trans	97.1	147.9	177	0	0	0	0	0	114.7	A1131 Q1137 I1138	A1131-G1135 CarbonylContact O-C 3.52Å; A1131-G1135 VanDerWaalsContact O-C 3.31Å; A1131-G1135 WeakPolarHBondContact O-CA 3.03Å; A1131-G1135 PolarHBondContact O-N 3.01Å; G1135-Q1137 PolarHBondContact O-N 2.87Å; G1135-I1138 PolarHBondContact O-N 3.05Å
1136	D	74.4	Confident	74.8	Confident	45 Å²	45	37.1 Å²	37.1	24%	0.241	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-60.4	-9.1	-177.7	-65.8	-77.6	0	0	0	115.1	I1138 V1139 K1140	D1136-I1138 PolarHBondContact O-N 3.17Å; D1136-V1139 WeakPolarHBondContact O-CG2 3.27Å; D1136-V1139 PolarHBondContact O-N 2.99Å; D1136-K1140 WeakPolarHBondContact O-CG 3.2Å
1137	Q	67	Low	74.6	Confident	125 Å²	125	40.2 Å²	40.2	58%	0.584	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-61.7	-26.9	174.7	-61.2	-164.5	16.1	0	0	113.1	K309 G1135	K309-Q1137 WeakPolarHBondContact CE-O 3.27Å; K309-Q1137 PolarHBondContact NZ-O 3.21Å; G1135-Q1137 PolarHBondContact O-N 2.87Å
1138	I	66.9	Low	74.9	Confident	16 Å²	16	40.2 Å²	40.2	8%	0.082	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-72.9	-25.2	-176.7	-76.3	162	0	0	0	113.3	K309 L1134 G1135 D1136 L1144	K309-I1138 HydrophobicContact CG-CG1 4.43Å; L1134-I1138 HydrophobicContact CB-CD1 3.31Å; L1134-I1138 HydrophobicContact CD1-CD1 4.07Å; L1134-I1138 HydrophobicContact CG-CD1 4.26Å; G1135-I1138 PolarHBondContact O-N 3.05Å; D1136-I1138 PolarHBondContact O-N 3.17Å; I1138-L1144 HydrophobicContact CG2-CD1 3.59Å; I1138-L1144 HydrophobicContact CG2-CD2 4.11Å
1139	V	69.7	Low	75.3	Confident	16 Å²	16	36.7 Å²	36.7	10%	0.097	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-100.6	0.9	-175.5	-71.7	0	0	0	0	114.4	L1113 A1127 A1131 D1136 D1141 L1144	L1113-V1139 HydrophobicContact CB-CB 4.01Å; L1113-V1139 HydrophobicContact CD2-CB 3.69Å; L1113-V1139 HydrophobicContact CD2-CG1 3.9Å; L1113-V1139 HydrophobicContact CD2-CG2 3.98Å; L1113-V1139 HydrophobicContact CG-CB 4.47Å; A1127-V1139 HydrophobicContact CB-CG1 4.17Å; A1127-V1139 WeakPolarHBondContact O-CG1 3.33Å; A1131-V1139 HydrophobicContact CB-CG1 4.03Å; A1131-V1139 HydrophobicContact CB-CG2 3.83Å; D1136-V1139 WeakPolarHBondContact O-CG2 3.27Å; D1136-V1139 PolarHBondContact O-N 2.99Å; V1139-D1141 VanDerWaalsContact C-N 3.28Å; V1139-D1141 PolarHBondContact O-N 3.48Å; V1139-L1144 HydrophobicContact CG1-CD2 3.82Å
1140	K	68.5	Low	75.5	Confident	109 Å²	109	35.1 Å²	35.1	47%	0.474	19%	0.194	S	C	.	.	S	Bend	trans	-75.1	-16.1	177.9	-68.6	-179.2	-174.7	-173.4	0	113.6	K1112 D1136	K1112-K1140 VanDerWaalsContact CD-O 3.29Å; K1112-K1140 WeakPolarHBondContact CD-O 3.41Å; K1112-K1140 WeakPolarHBondContact CE-O 3.25Å; K1112-K1140 PolarHBondContact NZ-O 3.14Å; D1136-K1140 WeakPolarHBondContact O-CG 3.2Å
1141	D	62.1	Low	76	Confident	72 Å²	72	35 Å²	35	39%	0.385	19%	0.194	S	C	.	.	S	Bend	trans	-117.1	160.1	-172.5	-54.5	-49.2	0	0	0	111.9	K309 V1139	K309-D1141 IonicContact NZ-OD2 2.95Å; K309-D1141 PolarHBondContact NZ-OD2 3.38Å; V1139-D1141 VanDerWaalsContact C-N 3.28Å; V1139-D1141 PolarHBondContact O-N 3.48Å
1142	A	61.6	Low	76.2	Confident	55 Å²	55	41.1 Å²	41.1	46%	0.455	22%	0.216	S	C	.	.	S	Bend	trans	-85.5	161.2	176.9	0	0	0	0	0	111	K1112	K1112-A1142 HydrophobicContact CG-CB 4.25Å
1143	G	60.8	Low	76.3	Confident	18 Å²	18	42.2 Å²	42.2	19%	0.186	22%	0.221	C	C	.	.			trans	102	-23.8	176	0	0	0	0	0	114.9	F310 M1109 S1145	F310-G1143 WeakPolarHBondContact CE2-O 3.42Å; M1109-G1143 CarbonylContact O-C 3.54Å; M1109-G1143 WeakPolarHBondContact O-CA 3.34Å; M1109-G1143 PolarHBondContact O-N 3.05Å; G1143-S1145 PolarHBondContact O-N 2.84Å
1144	L	70.8	Confident	76.5	Confident	7 Å²	7	42.2 Å²	42.2	4%	0.037	22%	0.224	C	C	.	.			trans	-35.7	117.6	-168.6	-177.2	60.6	0	0	0	114.4	L308 M1109 A1127 M1130 I1138 V1139 C1146	L308-L1144 WeakPolarHBondContact O-CD1 3.42Å; M1109-L1144 HydrophobicContact CE-CB 4.32Å; M1109-L1144 HydrophobicContact CE-CD2 4.3Å; M1109-L1144 PolarHBondContact N-O 2.74Å; A1127-L1144 HydrophobicContact CB-CD2 3.65Å; M1130-L1144 HydrophobicContact CE-CD1 3.94Å; I1138-L1144 HydrophobicContact CG2-CD1 3.59Å; I1138-L1144 HydrophobicContact CG2-CD2 4.11Å; V1139-L1144 HydrophobicContact CG1-CD2 3.82Å; L1144-C1146 PolarHBondContact O-N 3.03Å
1145	S	68.5	Low	76.3	Confident	40 Å²	40	43.2 Å²	43.2	28%	0.28	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	107.8	-179.8	-173.6	0	0	0	0	110.6	N1106 G1143 R1147	N1106-S1145 PolarHBondContact ND2-OG 3.49Å; N1106-S1145 PolarHBondContact OD1-OG 3.04Å; G1143-S1145 PolarHBondContact O-N 2.84Å; S1145-R1147 PolarHBondContact O-N 2.97Å
1146	C	75.7	Confident	76.5	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	93.4	179	-61.3	0	0	0	0	109.7	R1107 S1123 T1126 L1144 Y1148	R1107-C1146 PolarHBondContact N-O 3.44Å; R1107-C1146 WeakPolarHBondContact O-CB 3.47Å; R1107-C1146 PolarHBondContact O-N 3.31Å; S1123-C1146 PolarHBondContact O-SG 2.92Å; S1123-C1146 VanDerWaalsContact O-SG 3.37Å; T1126-C1146 HydrophobicContact CG2-CB 3.84Å; L1144-C1146 PolarHBondContact O-N 3.03Å; C1146-Y1148 HydrophobicContact CB-CD1 4.45Å; C1146-Y1148 WeakPolarHBondContact O-CD1 3.4Å
1147	R	81.7	Confident	77	Confident	65 Å²	65	43.1 Å²	43.1	25%	0.245	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	120.4	168.5	-167.9	173.1	-177.4	-172.5	-2.2	109.9	D1101 S1104 E1105 N1106 S1145 L1166	D1101-R1147 IonicContact OD1-CZ 2.85Å; D1101-R1147 IonicContact OD1-NH1 3.2Å; D1101-R1147 IonicContact OD1-NH2 3.85Å; D1101-R1147 PolarHBondContact OD1-NH2 2.87Å; S1104-R1147 PolarHBondContact OG-NE 3.39Å; S1104-R1147 VanDerWaalsContact OG-NE 3.08Å; S1104-R1147 PolarHBondContact OG-NH2 2.88Å; E1105-R1147 CarbonylContact O-C 3.59Å; E1105-R1147 WeakPolarHBondContact O-CA 3.43Å; N1106-R1147 HydrophobicContact CB-CB 4.45Å; N1106-R1147 HydrophobicContact CB-CG 4.36Å; S1145-R1147 PolarHBondContact O-N 2.97Å; R1147-L1166 HydrophobicContact CB-CB 4.46Å; R1147-L1166 HydrophobicContact CG-CB 4.24Å; R1147-L1166 HydrophobicContact CG-CD2 4.29Å; R1147-L1166 PolarHBondContact O-N 3.39Å
1148	Y	90.3	Very high	78	Confident	1 Å²	1	38.3 Å²	38.3	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	161	-173	61.2	-96.8	0	0	0	113.9	S1104 E1105 R1107 T1122 T1126 C1146 I1150 A1163 I1164	S1104-Y1148 WeakPolarHBondContact CA-O 3.2Å; E1105-Y1148 HydrophobicContact CB-CD2 4.39Å; E1105-Y1148 HydrophobicContact CB-CE1 4.28Å; E1105-Y1148 HydrophobicContact CB-CE2 3.72Å; E1105-Y1148 HydrophobicContact CG-CE2 4.28Å; E1105-Y1148 PolarHBondContact N-O 2.69Å; E1105-Y1148 PolarHBondContact O-N 2.87Å; E1105-Y1148 PolarHBondContact OE2-OH 3.48Å; R1107-Y1148 PolarHBondContact NE-OH 3.26Å; T1122-Y1148 VanDerWaalsContact CB-CZ 3.44Å; T1122-Y1148 HydrophobicContact CG2-CE2 4.06Å; T1122-Y1148 VanDerWaalsContact OG1-CZ 3.28Å; T1122-Y1148 PolarHBondContact OG1-OH 3.03Å; T1126-Y1148 HydrophobicContact CG2-CD1 4.31Å; T1126-Y1148 WeakPolarHBondContact OG1-CB 3.16Å; T1126-Y1148 WeakPolarHBondContact OG1-CD1 3.16Å; C1146-Y1148 HydrophobicContact CB-CD1 4.45Å; C1146-Y1148 WeakPolarHBondContact O-CD1 3.4Å; Y1148-I1150 HydrophobicContact CD2-CD1 4.01Å; Y1148-I1150 HydrophobicContact CE2-CD1 4.01Å; Y1148-A1163 HydrophobicContact CD2-CB 3.97Å; Y1148-A1163 HydrophobicContact CG-CB 4.18Å; Y1148-I1164 WeakPolarHBondContact CA-O 3.39Å; Y1148-I1164 VanDerWaalsContact CB-O 3.3Å; Y1148-I1164 WeakPolarHBondContact CB-O 3.13Å
1149	I	92	Very high	78.8	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	159.5	167.6	53.8	168.1	0	0	0	110.1	F1100 I1103 A1163 I1164 L1166 F1169 I1195 L1199	F1100-I1149 HydrophobicContact CD1-CG2 4.27Å; F1100-I1149 HydrophobicContact CE1-CD1 4.36Å; I1103-I1149 HydrophobicContact CD1-CB 4.37Å; I1103-I1149 HydrophobicContact CD1-CG2 3.74Å; I1103-I1149 HydrophobicContact CG1-CG2 4.42Å; I1149-A1163 CarbonylContact O-C 3.55Å; I1149-A1163 WeakPolarHBondContact O-CA 3.43Å; I1149-I1164 HydrophobicContact CG1-CB 4.19Å; I1149-I1164 PolarHBondContact N-O 3.32Å; I1149-I1164 PolarHBondContact O-N 3.43Å; I1149-L1166 HydrophobicContact CG2-CD1 3.81Å; I1149-F1169 HydrophobicContact CD1-CE2 3.62Å; I1149-F1169 HydrophobicContact CD1-CZ 3.78Å; I1149-F1169 HydrophobicContact CG1-CE2 4.38Å; I1149-I1195 HydrophobicContact CD1-CD1 3.95Å; I1149-L1199 HydrophobicContact CB-CD2 4.07Å; I1149-L1199 HydrophobicContact CD1-CD2 3.77Å; I1149-L1199 HydrophobicContact CG1-CD2 4.43Å; I1149-L1199 HydrophobicContact CG2-CD2 4.48Å
1150	I	93.2	Very high	79.6	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	109.4	172.8	-56.1	-53.4	0	0	0	109.1	T1122 Y1148 V1159 R1162 A1163 D1200 Y1203 Y1204	T1122-I1150 HydrophobicContact CG2-CD1 4.3Å; Y1148-I1150 HydrophobicContact CD2-CD1 4.01Å; Y1148-I1150 HydrophobicContact CE2-CD1 4.01Å; I1150-V1159 HydrophobicContact CD1-CG1 3.81Å; I1150-V1159 HydrophobicContact CG1-CG1 4.07Å; I1150-V1159 HydrophobicContact CG2-CG1 4.18Å; I1150-R1162 HydrophobicContact CG2-CB 4.37Å; I1150-A1163 HydrophobicContact CD1-CB 4.05Å; I1150-D1200 HydrophobicContact CG2-CB 3.99Å; I1150-D1200 PolarHBondContact O-N 3.07Å; I1150-Y1203 HydrophobicContact CB-CD1 3.9Å; I1150-Y1203 HydrophobicContact CB-CE1 4.13Å; I1150-Y1203 HydrophobicContact CB-CG 4.46Å; I1150-Y1203 HydrophobicContact CG1-CD1 3.89Å; I1150-Y1203 HydrophobicContact CG1-CE1 3.57Å; I1150-Y1203 HydrophobicContact CG2-CD1 4.17Å; I1150-Y1203 HydrophobicContact CG2-CG 4.22Å; I1150-Y1204 HydrophobicContact CB-CE2 4.39Å; I1150-Y1204 PolarHBondContact N-OH 3.05Å
1151	A	91.7	Very high	80.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-78.4	149.1	173.5	0	0	0	0	0	111	R1162 I1164 L1184 I1198	A1151-R1162 PolarHBondContact N-O 3.02Å; A1151-R1162 WeakPolarHBondContact O-CB 3.39Å; A1151-R1162 PolarHBondContact O-NH1 3.43Å; A1151-I1164 HydrophobicContact CB-CD1 3.69Å; A1151-I1164 HydrophobicContact CB-CG1 4.1Å; A1151-L1184 HydrophobicContact CB-CD2 3.49Å; A1151-L1184 VanDerWaalsContact CB-CD2 3.49Å; A1151-I1198 CarbonylContact C-O 3.59Å; A1151-I1198 VanDerWaalsContact CA-O 3.31Å; A1151-I1198 WeakPolarHBondContact CA-O 3.36Å; A1151-I1198 HydrophobicContact CB-CG2 3.81Å
1152	R	87.8	Confident	81.8	Confident	134 Å²	134	36.3 Å²	36.3	51%	0.506	21%	0.21	S	C	.	.	S	Bend	trans	-66.2	-48.2	174.9	176.6	179.3	161.5	-165.4	-11.7	110.9	D1155 R1162 I1198 D1200	R1152-D1155 WeakPolarHBondContact CG-OD1 3.16Å; R1152-D1155 IonicContact CZ-OD1 3.02Å; R1152-D1155 IonicContact CZ-OD2 2.7Å; R1152-D1155 IonicContact NE-OD1 3.51Å; R1152-D1155 PolarHBondContact NE-OD1 3.16Å; R1152-D1155 IonicContact NE-OD2 3.86Å; R1152-D1155 PolarHBondContact NE-OD2 2.99Å; R1152-D1155 IonicContact NH2-OD1 3.81Å; R1152-D1155 IonicContact NH2-OD2 2.84Å; R1152-D1155 PolarHBondContact NH2-OD2 2.91Å; R1152-R1162 WeakPolarHBondContact O-CD 3.32Å; R1152-I1198 PolarHBondContact N-O 3.35Å; R1152-D1200 HydrophobicContact CB-CB 4.24Å
1153	Q	86.4	Confident	83.2	Confident	51 Å²	51	33.7 Å²	33.7	24%	0.238	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-79.6	156.1	179.3	-68.6	174.4	-29.9	0	0	111.7	L1184 D1186	Q1153-L1184 HydrophobicContact CB-CB 4.06Å; Q1153-L1184 HydrophobicContact CB-CD2 3.84Å; Q1153-D1186 PolarHBondContact NE2-OD2 2.8Å
1154	P	85	Confident	84.7	Confident	29 Å²	29	33 Å²	33	19%	0.188	18%	0.18	C	C	.	.	S	Bend	cis	-68.1	128.4	-10.9	25	-31.1	0	0	0	111	G1156 A1157 W1183 K1185	P1154-G1156 PolarHBondContact O-N 3.24Å; P1154-G1156 VanDerWaalsContact O-N 3.17Å; P1154-A1157 HydrophobicContact CG-CB 3.88Å; P1154-A1157 WeakPolarHBondContact O-CB 3.29Å; P1154-A1157 PolarHBondContact O-N 3.32Å; P1154-A1157 VanDerWaalsContact O-N 3.11Å; P1154-W1183 WeakPolarHBondContact CD-O 3.47Å; P1154-K1185 HydrophobicContact CB-CD 4.37Å; P1154-K1185 HydrophobicContact CB-CG 4.5Å
1155	D	73.7	Confident	85.6	Confident	93 Å²	93	32.7 Å²	32.7	50%	0.497	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	120.6	-173.8	-98.3	-33.5	0	0	0	109.7	R1152	R1152-D1155 WeakPolarHBondContact CG-OD1 3.16Å; R1152-D1155 IonicContact CZ-OD1 3.02Å; R1152-D1155 IonicContact CZ-OD2 2.7Å; R1152-D1155 IonicContact NE-OD1 3.51Å; R1152-D1155 PolarHBondContact NE-OD1 3.16Å; R1152-D1155 IonicContact NE-OD2 3.86Å; R1152-D1155 PolarHBondContact NE-OD2 2.99Å; R1152-D1155 IonicContact NH2-OD1 3.81Å; R1152-D1155 IonicContact NH2-OD2 2.84Å; R1152-D1155 PolarHBondContact NH2-OD2 2.91Å
1156	G	78.6	Confident	86.4	Confident	52 Å²	52	31.6 Å²	31.6	54%	0.536	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.9	-3.8	179.9	0	0	0	0	0	116.4	P1154 Q1594	P1154-G1156 PolarHBondContact O-N 3.24Å; P1154-G1156 VanDerWaalsContact O-N 3.17Å; G1156-Q1594 PolarHBondContact O-NE2 3.48Å
1157	A	85.5	Confident	86.7	Confident	21 Å²	21	32.1 Å²	32.1	17%	0.174	17%	0.174	C	C	.	.	S	Bend	trans	-74.1	157	169.6	0	0	0	0	0	112.5	P1154 R1162	P1154-A1157 HydrophobicContact CG-CB 3.88Å; P1154-A1157 WeakPolarHBondContact O-CB 3.29Å; P1154-A1157 PolarHBondContact O-N 3.32Å; P1154-A1157 VanDerWaalsContact O-N 3.11Å; A1157-R1162 HydrophobicContact CB-CG 3.79Å; A1157-R1162 WeakPolarHBondContact O-CD 3.48Å; A1157-R1162 PolarHBondContact O-NE 3.12Å
1158	P	86.6	Confident	86.9	Confident	24 Å²	24	29 Å²	29	16%	0.156	16%	0.162	C	C	.	.			trans	-71.3	152.7	-179.3	29.8	-31.3	0	0	0	110.5	T1160 E1161 R1162 Q1594	P1158-T1160 PolarHBondContact O-N 2.92Å; P1158-E1161 VanDerWaalsContact CD-OE2 3.31Å; P1158-E1161 WeakPolarHBondContact CD-OE2 3.35Å; P1158-E1161 HydrophobicContact CG-CB 3.95Å; P1158-E1161 VanDerWaalsContact CG-CD 3.47Å; P1158-E1161 HydrophobicContact CG-CG 3.84Å; P1158-E1161 WeakPolarHBondContact CG-OE2 3.36Å; P1158-E1161 PolarHBondContact O-N 2.8Å; P1158-R1162 PolarHBondContact O-N 3.29Å; P1158-R1162 VanDerWaalsContact O-N 3.17Å; P1158-Q1594 HydrophobicContact CB-CG 3.86Å; P1158-Q1594 HydrophobicContact CG-CG 3.81Å
1159	V	84.8	Confident	86.7	Confident	51 Å²	51	30.7 Å²	30.7	31%	0.309	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-33.2	-178.7	179.4	0	0	0	0	112.3	I1150 E1161 R1162 A1163 Y1203	I1150-V1159 HydrophobicContact CD1-CG1 3.81Å; I1150-V1159 HydrophobicContact CG1-CG1 4.07Å; I1150-V1159 HydrophobicContact CG2-CG1 4.18Å; V1159-E1161 PolarHBondContact O-N 3Å; V1159-R1162 PolarHBondContact O-N 3.2Å; V1159-A1163 PolarHBondContact O-N 3.48Å; V1159-Y1203 HydrophobicContact CG1-CD2 4.2Å; V1159-Y1203 HydrophobicContact CG1-CE2 3.76Å; V1159-Y1203 HydrophobicContact CG2-CD2 4.2Å; V1159-Y1203 HydrophobicContact CG2-CE2 4.35Å
1160	T	87	Confident	85.9	Confident	34 Å²	34	37.3 Å²	37.3	21%	0.209	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-41.4	175	49.7	0	0	0	0	113.3	T1122 S1125 P1158	T1122-T1160 HydrophobicContact CG2-CG2 4.5Å; S1125-T1160 WeakPolarHBondContact CB-O 3.27Å; S1125-T1160 PolarHBondContact OG-O 3.39Å; S1125-T1160 VanDerWaalsContact OG-O 3.09Å; P1158-T1160 PolarHBondContact O-N 2.92Å
1161	E	84.3	Confident	85.2	Confident	59 Å²	59	38.6 Å²	38.6	28%	0.276	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-5.5	-175.6	-65.7	168	-167.4	0	0	112.5	K1120 R1129 P1158 V1159	K1120-E1161 WeakPolarHBondContact CE-OE1 3.44Å; K1120-E1161 IonicContact NZ-OE1 3.45Å; K1120-E1161 PolarHBondContact NZ-OE1 3.17Å; R1129-E1161 VanDerWaalsContact CZ-O 3.26Å; R1129-E1161 PolarHBondContact NH1-O 2.66Å; R1129-E1161 PolarHBondContact NH2-O 3.33Å; P1158-E1161 VanDerWaalsContact CD-OE2 3.31Å; P1158-E1161 WeakPolarHBondContact CD-OE2 3.35Å; P1158-E1161 HydrophobicContact CG-CB 3.95Å; P1158-E1161 VanDerWaalsContact CG-CD 3.47Å; P1158-E1161 HydrophobicContact CG-CG 3.84Å; P1158-E1161 WeakPolarHBondContact CG-OE2 3.36Å; P1158-E1161 PolarHBondContact O-N 2.8Å; V1159-E1161 PolarHBondContact O-N 3Å
1162	R	91.2	Very high	84.5	Confident	28 Å²	28	45.2 Å²	45.2	11%	0.106	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	4	171.9	-64.5	-166.9	-69.7	113.4	-15.7	113.9	I1150 A1151 R1152 A1157 P1158 V1159 I1164 D1200	I1150-R1162 HydrophobicContact CG2-CB 4.37Å; A1151-R1162 PolarHBondContact N-O 3.02Å; A1151-R1162 WeakPolarHBondContact O-CB 3.39Å; A1151-R1162 PolarHBondContact O-NH1 3.43Å; R1152-R1162 WeakPolarHBondContact O-CD 3.32Å; A1157-R1162 HydrophobicContact CB-CG 3.79Å; A1157-R1162 WeakPolarHBondContact O-CD 3.48Å; A1157-R1162 PolarHBondContact O-NE 3.12Å; P1158-R1162 PolarHBondContact O-N 3.29Å; P1158-R1162 VanDerWaalsContact O-N 3.17Å; V1159-R1162 PolarHBondContact O-N 3.2Å; R1162-I1164 PolarHBondContact O-N 3.38Å; R1162-D1200 IonicContact CZ-OD2 3.06Å; R1162-D1200 VanDerWaalsContact CZ-OD2 3.28Å; R1162-D1200 IonicContact NH1-OD2 2.69Å; R1162-D1200 PolarHBondContact NH1-OD2 3.27Å; R1162-D1200 IonicContact NH2-OD2 3.89Å; R1162-D1200 PolarHBondContact NH2-OD2 2.89Å
1163	A	91.6	Very high	83.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	117.5	173.5	0	0	0	0	0	111.4	T1122 R1129 Y1148 I1149 I1150 V1159	T1122-A1163 HydrophobicContact CG2-CB 4.24Å; R1129-A1163 WeakPolarHBondContact CD-O 3.24Å; R1129-A1163 PolarHBondContact NH1-O 3.27Å; Y1148-A1163 HydrophobicContact CD2-CB 3.97Å; Y1148-A1163 HydrophobicContact CG-CB 4.18Å; I1149-A1163 CarbonylContact O-C 3.55Å; I1149-A1163 WeakPolarHBondContact O-CA 3.43Å; I1150-A1163 HydrophobicContact CD1-CB 4.05Å; V1159-A1163 PolarHBondContact O-N 3.48Å
1164	I	91.4	Very high	83.5	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.1	176.5	-66.2	-169.4	0	0	0	109.3	Y1148 I1149 A1151 R1162 I1168 F1169 L1180 W1183 L1184	Y1148-I1164 WeakPolarHBondContact CA-O 3.39Å; Y1148-I1164 VanDerWaalsContact CB-O 3.3Å; Y1148-I1164 WeakPolarHBondContact CB-O 3.13Å; I1149-I1164 HydrophobicContact CG1-CB 4.19Å; I1149-I1164 PolarHBondContact N-O 3.32Å; I1149-I1164 PolarHBondContact O-N 3.43Å; A1151-I1164 HydrophobicContact CB-CD1 3.69Å; A1151-I1164 HydrophobicContact CB-CG1 4.1Å; R1162-I1164 PolarHBondContact O-N 3.38Å; I1164-I1168 HydrophobicContact CG2-CG2 3.75Å; I1164-F1169 HydrophobicContact CG2-CE2 3.83Å; I1164-F1169 HydrophobicContact CG2-CZ 4.37Å; I1164-L1180 HydrophobicContact CD1-CD2 3.99Å; I1164-L1180 HydrophobicContact CG2-CD2 4.11Å; I1164-W1183 HydrophobicContact CG1-CE3 4.42Å; I1164-W1183 HydrophobicContact CG2-CE3 4Å; I1164-W1183 HydrophobicContact CG2-CZ3 4.04Å; I1164-L1184 HydrophobicContact CD1-CD1 4.45Å; I1164-L1184 HydrophobicContact CD1-CD2 3.59Å; I1164-L1184 HydrophobicContact CD1-CG 3.91Å
1165	P	89.8	Confident	83.3	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	136.6	174.7	-16.8	26.6	0	0	0	111.8	T1126 R1129 M1130 A1167 I1168 W1183	T1126-P1165 HydrophobicContact CG2-CB 3.85Å; T1126-P1165 HydrophobicContact CG2-CG 3.82Å; R1129-P1165 HydrophobicContact CB-CG 3.58Å; M1130-P1165 HydrophobicContact CG-CB 3.64Å; M1130-P1165 HydrophobicContact CG-CG 3.75Å; M1130-P1165 HydrophobicContact SD-CB 4.35Å; P1165-A1167 PolarHBondContact O-N 3.48Å; P1165-I1168 WeakPolarHBondContact O-CG2 3.23Å; P1165-I1168 PolarHBondContact O-N 3.38Å; P1165-W1183 HydrophobicContact CG-CH2 4.25Å; P1165-W1183 HydrophobicContact CG-CZ3 4.32Å
1166	L	85.8	Confident	83.7	Confident	18 Å²	18	39.6 Å²	39.6	9%	0.094	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-60.5	-33.4	178.7	-139.5	85	0	0	0	112.4	F1100 R1147 I1149 I1168 F1169	F1100-L1166 HydrophobicContact CB-CD2 4.45Å; F1100-L1166 HydrophobicContact CD1-CD1 3.47Å; F1100-L1166 VanDerWaalsContact CD1-CD1 3.47Å; F1100-L1166 HydrophobicContact CD1-CD2 4.41Å; F1100-L1166 HydrophobicContact CD1-CG 3.99Å; F1100-L1166 HydrophobicContact CE1-CD1 3.87Å; F1100-L1166 HydrophobicContact CE1-CG 4.17Å; F1100-L1166 HydrophobicContact CG-CD1 4.25Å; F1100-L1166 HydrophobicContact CG-CD2 4.45Å; F1100-L1166 HydrophobicContact CG-CG 4.49Å; R1147-L1166 HydrophobicContact CB-CB 4.46Å; R1147-L1166 HydrophobicContact CG-CB 4.24Å; R1147-L1166 HydrophobicContact CG-CD2 4.29Å; R1147-L1166 PolarHBondContact O-N 3.39Å; I1149-L1166 HydrophobicContact CG2-CD1 3.81Å; L1166-I1168 PolarHBondContact O-N 3.04Å; L1166-I1168 VanDerWaalsContact O-N 3.09Å; L1166-F1169 WeakPolarHBondContact O-CD2 3.31Å; L1166-F1169 PolarHBondContact O-N 2.97Å; L1166-F1169 VanDerWaalsContact O-N 3.07Å
1167	A	82.8	Confident	83.8	Confident	11 Å²	11	41.6 Å²	41.6	9%	0.091	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-57.1	-24.8	-177	0	0	0	0	0	114.3	L308 F1133 P1165 F1169 Q1170 A1171	L308-A1167 HydrophobicContact CD1-CB 3.67Å; L308-A1167 HydrophobicContact CD2-CB 4.25Å; F1133-A1167 HydrophobicContact CZ-CB 3.93Å; P1165-A1167 PolarHBondContact O-N 3.48Å; A1167-F1169 PolarHBondContact O-N 3.06Å; A1167-Q1170 PolarHBondContact O-N 3.29Å; A1167-Q1170 VanDerWaalsContact O-N 3.12Å; A1167-A1171 PolarHBondContact O-N 2.67Å
1168	I	86.1	Confident	83.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-67.2	-24.6	178.8	-162.4	56.1	0	0	0	112.6	F1133 I1164 P1165 L1166 Q1170 A1171 I1175 K1176 Y1179 L1180 W1183	F1133-I1168 HydrophobicContact CD1-CD1 4.13Å; F1133-I1168 HydrophobicContact CD2-CD1 3.67Å; F1133-I1168 HydrophobicContact CE1-CB 4.37Å; F1133-I1168 HydrophobicContact CE1-CD1 4.16Å; F1133-I1168 HydrophobicContact CE2-CD1 3.71Å; F1133-I1168 HydrophobicContact CG-CD1 3.89Å; F1133-I1168 HydrophobicContact CZ-CB 4.14Å; F1133-I1168 HydrophobicContact CZ-CD1 3.95Å; I1164-I1168 HydrophobicContact CG2-CG2 3.75Å; P1165-I1168 WeakPolarHBondContact O-CG2 3.23Å; P1165-I1168 PolarHBondContact O-N 3.38Å; L1166-I1168 PolarHBondContact O-N 3.04Å; L1166-I1168 VanDerWaalsContact O-N 3.09Å; I1168-Q1170 VanDerWaalsContact C-N 3.26Å; I1168-Q1170 PolarHBondContact O-N 2.68Å; I1168-A1171 HydrophobicContact CD1-CB 4.19Å; I1168-A1171 PolarHBondContact O-N 3.15Å; I1168-I1175 HydrophobicContact CD1-CG2 4.27Å; I1168-K1176 WeakPolarHBondContact O-CB 3.33Å; I1168-K1176 WeakPolarHBondContact O-CG 3.33Å; I1168-Y1179 HydrophobicContact CD1-CD2 4.42Å; I1168-Y1179 HydrophobicContact CD1-CG 4.42Å; I1168-L1180 HydrophobicContact CG1-CG 4.4Å; I1168-L1180 HydrophobicContact CG2-CD2 3.88Å; I1168-L1180 HydrophobicContact CG2-CG 4.37Å; I1168-W1183 HydrophobicContact CB-CH2 4.19Å; I1168-W1183 HydrophobicContact CB-CZ3 3.79Å; I1168-W1183 HydrophobicContact CD1-CH2 4.29Å; I1168-W1183 HydrophobicContact CD1-CZ3 4.47Å; I1168-W1183 HydrophobicContact CG1-CH2 4.14Å; I1168-W1183 HydrophobicContact CG1-CZ3 3.83Å; I1168-W1183 HydrophobicContact CG2-CZ3 3.92Å
1169	F	84.5	Confident	83.9	Confident	35 Å²	35	46.5 Å²	46.5	15%	0.154	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-79.8	-10.1	177.5	-62	-87	0	0	0	112.9	F1100 I1149 I1164 L1166 A1167 L1180 I1195 I1198	F1100-F1169 HydrophobicContact CE1-CB 4.48Å; F1100-F1169 AromaticContact CE1-CD2 3.86Å; F1100-F1169 HydrophobicContact CE1-CD2 3.86Å; F1100-F1169 HydrophobicContact CE1-CE2 4.22Å; F1100-F1169 HydrophobicContact CE1-CG 4.05Å; F1100-F1169 HydrophobicContact CE2-CB 4.3Å; F1100-F1169 HydrophobicContact CZ-CB 3.65Å; F1100-F1169 AromaticContact CZ-CD1 3.88Å; F1100-F1169 HydrophobicContact CZ-CD1 3.88Å; F1100-F1169 AromaticContact CZ-CD2 3.81Å; F1100-F1169 HydrophobicContact CZ-CD2 3.81Å; F1100-F1169 HydrophobicContact CZ-CE2 4.45Å; F1100-F1169 AromaticContact CZ-CG 3.5Å; F1100-F1169 HydrophobicContact CZ-CG 3.5Å; F1100-F1169 VanDerWaalsContact CZ-CG 3.5Å; I1149-F1169 HydrophobicContact CD1-CE2 3.62Å; I1149-F1169 HydrophobicContact CD1-CZ 3.78Å; I1149-F1169 HydrophobicContact CG1-CE2 4.38Å; I1164-F1169 HydrophobicContact CG2-CE2 3.83Å; I1164-F1169 HydrophobicContact CG2-CZ 4.37Å; L1166-F1169 WeakPolarHBondContact O-CD2 3.31Å; L1166-F1169 PolarHBondContact O-N 2.97Å; L1166-F1169 VanDerWaalsContact O-N 3.07Å; A1167-F1169 PolarHBondContact O-N 3.06Å; F1169-L1180 HydrophobicContact CE1-CD1 4.02Å; F1169-L1180 HydrophobicContact CE1-CD2 4.48Å; F1169-L1180 HydrophobicContact CZ-CD1 4.42Å; F1169-L1180 HydrophobicContact CZ-CD2 4.06Å; F1169-I1195 HydrophobicContact CE1-CD1 4.14Å; F1169-I1195 HydrophobicContact CE1-CG1 4.42Å; F1169-I1195 HydrophobicContact CZ-CD1 4.23Å; F1169-I1198 HydrophobicContact CE1-CD1 4.27Å
1170	Q	76.1	Confident	84	Confident	139 Å²	139	44.4 Å²	44.4	65%	0.65	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-100.3	-5.6	173	-63.3	175.3	-18.9	0	0	112.6	A1167 I1168	A1167-Q1170 PolarHBondContact O-N 3.29Å; A1167-Q1170 VanDerWaalsContact O-N 3.12Å; I1168-Q1170 VanDerWaalsContact C-N 3.26Å; I1168-Q1170 PolarHBondContact O-N 2.68Å
1171	A	78.9	Confident	83.9	Confident	28 Å²	28	45.3 Å²	45.3	23%	0.231	22%	0.224	C	C	.	.	S	Bend	trans	-76.7	161.3	177.4	0	0	0	0	0	112	F1133 A1167 I1168 I1175	F1133-A1171 HydrophobicContact CE2-CB 4.11Å; A1167-A1171 PolarHBondContact O-N 2.67Å; I1168-A1171 HydrophobicContact CD1-CB 4.19Å; I1168-A1171 PolarHBondContact O-N 3.15Å; A1171-I1175 HydrophobicContact CB-CB 4.24Å; A1171-I1175 HydrophobicContact CB-CG2 4.08Å
1172	E	76	Confident	84.1	Confident	139 Å²	139	46.4 Å²	46.4	65%	0.65	23%	0.228	S	C	*	.			trans	-52.8	141.4	172.1	-168.9	-178.6	-164.5	0	0	110.8	S1174 I1175 K1176	E1172-S1174 PolarHBondContact O-N 3.14Å; E1172-S1174 VanDerWaalsContact O-N 3.12Å; E1172-S1174 PolarHBondContact OE2-OG 3.33Å; E1172-I1175 HydrophobicContact CB-CD1 4.17Å; E1172-I1175 HydrophobicContact CB-CG1 4.34Å; E1172-I1175 WeakPolarHBondContact O-CA 3.19Å; E1172-I1175 WeakPolarHBondContact O-CB 3.32Å; E1172-I1175 PolarHBondContact O-N 2.92Å; E1172-K1176 PolarHBondContact O-N 2.71Å
1173	G	76.3	Confident	84.1	Confident	17 Å²	17	45.5 Å²	45.5	18%	0.175	23%	0.225	C	C	.	.	H	α-helix	trans	-57.8	-32.4	-170.1	0	0	0	0	0	114.3	R1177 E1191	G1173-R1177 WeakPolarHBondContact O-CB 3.27Å; G1173-R1177 PolarHBondContact O-N 2.74Å; G1173-E1191 WeakPolarHBondContact CA-OE1 3.48Å
1174	S	77.1	Confident	83.9	Confident	64 Å²	64	45.7 Å²	45.7	45%	0.448	23%	0.225	S	C	.	.	H	α-helix	trans	-59.1	-49.2	170.3	57.2	0	0	0	0	112.9	E1172 H1178	E1172-S1174 PolarHBondContact O-N 3.14Å; E1172-S1174 VanDerWaalsContact O-N 3.12Å; E1172-S1174 PolarHBondContact OE2-OG 3.33Å; S1174-H1178 PolarHBondContact O-N 3.36Å
1175	I	81.2	Confident	83.7	Confident	62 Å²	62	53.6 Å²	53.6	32%	0.318	26%	0.26	S	S	.	.	H	α-helix	trans	-69.1	-49.5	178.6	-59	175.4	0	0	0	109.8	F1133 I1168 A1171 E1172 R1177 H1178 Y1179	F1133-I1175 HydrophobicContact CB-CG2 4.36Å; F1133-I1175 HydrophobicContact CD2-CG2 3.99Å; I1168-I1175 HydrophobicContact CD1-CG2 4.27Å; A1171-I1175 HydrophobicContact CB-CB 4.24Å; A1171-I1175 HydrophobicContact CB-CG2 4.08Å; E1172-I1175 HydrophobicContact CB-CD1 4.17Å; E1172-I1175 HydrophobicContact CB-CG1 4.34Å; E1172-I1175 WeakPolarHBondContact O-CA 3.19Å; E1172-I1175 WeakPolarHBondContact O-CB 3.32Å; E1172-I1175 PolarHBondContact O-N 2.92Å; I1175-R1177 VanDerWaalsContact C-N 3.28Å; I1175-R1177 PolarHBondContact O-N 2.93Å; I1175-H1178 PolarHBondContact O-N 3.32Å; I1175-H1178 VanDerWaalsContact O-N 3.16Å; I1175-Y1179 HydrophobicContact CG2-CD2 3.84Å; I1175-Y1179 HydrophobicContact CG2-CE2 4.01Å; I1175-Y1179 WeakPolarHBondContact O-CD2 3.44Å; I1175-Y1179 PolarHBondContact O-N 3.12Å
1176	K	82.9	Confident	83.3	Confident	46 Å²	46	55.1 Å²	55.1	20%	0.2	27%	0.268	C	S	.	.	H	α-helix	trans	-49.8	-51.5	175	174.9	-173.2	168.9	-164.9	0	110.3	I1168 E1172 L1180	I1168-K1176 WeakPolarHBondContact O-CB 3.33Å; I1168-K1176 WeakPolarHBondContact O-CG 3.33Å; E1172-K1176 PolarHBondContact O-N 2.71Å; K1176-L1180 HydrophobicContact CD-CD1 4.48Å; K1176-L1180 HydrophobicContact CG-CD1 3.7Å; K1176-L1180 HydrophobicContact CG-CG 4.41Å; K1176-L1180 VanDerWaalsContact O-CB 3.23Å; K1176-L1180 WeakPolarHBondContact O-CB 3.43Å; K1176-L1180 WeakPolarHBondContact O-CG 3.46Å; K1176-L1180 PolarHBondContact O-N 3.25Å
1177	R	80.4	Confident	83.1	Confident	94 Å²	94	59 Å²	59	36%	0.355	30%	0.297	S	S	.	.	H	α-helix	trans	-60.1	-50.5	178.5	-172.9	177.1	-171.4	172.6	6.6	111.9	G1173 I1175 Y1179 L1180 Q1181 L1189	G1173-R1177 WeakPolarHBondContact O-CB 3.27Å; G1173-R1177 PolarHBondContact O-N 2.74Å; I1175-R1177 VanDerWaalsContact C-N 3.28Å; I1175-R1177 PolarHBondContact O-N 2.93Å; R1177-Y1179 PolarHBondContact O-N 2.8Å; R1177-L1180 PolarHBondContact O-N 2.88Å; R1177-Q1181 HydrophobicContact CG-CG 4.33Å; R1177-Q1181 WeakPolarHBondContact O-CB 3.38Å; R1177-Q1181 VanDerWaalsContact O-CG 3.23Å; R1177-Q1181 WeakPolarHBondContact O-CG 3.32Å; R1177-Q1181 PolarHBondContact O-N 3.35Å; R1177-L1189 VanDerWaalsContact CZ-O 3.31Å; R1177-L1189 PolarHBondContact NE-O 2.98Å; R1177-L1189 PolarHBondContact NH2-O 2.84Å
1178	H	84.6	Confident	82.8	Confident	106 Å²	106	65.3 Å²	65.3	49%	0.491	33%	0.329	S	S	.	.	H	α-helix	trans	-56.4	-51.8	-178	-178.4	84.4	0	0	0	112.6	S1174 I1175 K1182	S1174-H1178 PolarHBondContact O-N 3.36Å; I1175-H1178 PolarHBondContact O-N 3.32Å; I1175-H1178 VanDerWaalsContact O-N 3.16Å; H1178-K1182 WeakPolarHBondContact O-CB 3.31Å; H1178-K1182 PolarHBondContact O-N 2.75Å; H1178-K1182 VanDerWaalsContact O-N 3.07Å
1179	Y	89.7	Confident	82.3	Confident	43 Å²	43	65.9 Å²	65.9	17%	0.169	33%	0.332	C	S	.	.	H	α-helix	trans	-78.3	-30.6	-175.9	-70.6	-87.8	0	0	0	113.2	E1132 F1133 I1168 I1175 R1177 K1182 W1183	E1132-Y1179 HydrophobicContact CB-CD1 4.15Å; E1132-Y1179 HydrophobicContact CB-CE1 3.73Å; E1132-Y1179 VanDerWaalsContact O-CE1 3.26Å; E1132-Y1179 WeakPolarHBondContact O-CE1 3.15Å; E1132-Y1179 VanDerWaalsContact O-CZ 3.28Å; E1132-Y1179 PolarHBondContact O-OH 3.25Å; F1133-Y1179 HydrophobicContact CB-CD1 3.86Å; F1133-Y1179 HydrophobicContact CB-CD2 3.49Å; F1133-Y1179 VanDerWaalsContact CB-CD2 3.49Å; F1133-Y1179 HydrophobicContact CB-CE1 3.71Å; F1133-Y1179 HydrophobicContact CB-CE2 3.36Å; F1133-Y1179 HydrophobicContact CB-CG 3.76Å; F1133-Y1179 VanDerWaalsContact CB-CZ 3.46Å; F1133-Y1179 HydrophobicContact CG-CD2 4.44Å; I1168-Y1179 HydrophobicContact CD1-CD2 4.42Å; I1168-Y1179 HydrophobicContact CD1-CG 4.42Å; I1175-Y1179 HydrophobicContact CG2-CD2 3.84Å; I1175-Y1179 HydrophobicContact CG2-CE2 4.01Å; I1175-Y1179 WeakPolarHBondContact O-CD2 3.44Å; I1175-Y1179 PolarHBondContact O-N 3.12Å; R1177-Y1179 PolarHBondContact O-N 2.8Å; Y1179-K1182 HydrophobicContact CD1-CD 4.1Å; Y1179-K1182 HydrophobicContact CE1-CD 4.44Å; Y1179-K1182 PolarHBondContact O-N 2.73Å; Y1179-W1183 AromaticContact CD1-CZ2 3.86Å; Y1179-W1183 HydrophobicContact CD1-CZ2 3.86Å; Y1179-W1183 HydrophobicContact CG-CZ2 4.18Å; Y1179-W1183 WeakPolarHBondContact O-CB 3.4Å; Y1179-W1183 VanDerWaalsContact O-CD2 3.32Å; Y1179-W1183 PolarHBondContact O-N 2.78Å
1180	L	86.8	Confident	81.8	Confident	7 Å²	7	67.4 Å²	67.4	4%	0.037	34%	0.342	C	S	.	.	H	α-helix	trans	-64.7	-45.8	170.4	-72.5	179.9	0	0	0	111.5	I1164 I1168 F1169 K1176 R1177 K1182 W1183 L1184 L1189 I1198	I1164-L1180 HydrophobicContact CD1-CD2 3.99Å; I1164-L1180 HydrophobicContact CG2-CD2 4.11Å; I1168-L1180 HydrophobicContact CG1-CG 4.4Å; I1168-L1180 HydrophobicContact CG2-CD2 3.88Å; I1168-L1180 HydrophobicContact CG2-CG 4.37Å; F1169-L1180 HydrophobicContact CE1-CD1 4.02Å; F1169-L1180 HydrophobicContact CE1-CD2 4.48Å; F1169-L1180 HydrophobicContact CZ-CD1 4.42Å; F1169-L1180 HydrophobicContact CZ-CD2 4.06Å; K1176-L1180 HydrophobicContact CD-CD1 4.48Å; K1176-L1180 HydrophobicContact CG-CD1 3.7Å; K1176-L1180 HydrophobicContact CG-CG 4.41Å; K1176-L1180 VanDerWaalsContact O-CB 3.23Å; K1176-L1180 WeakPolarHBondContact O-CB 3.43Å; K1176-L1180 WeakPolarHBondContact O-CG 3.46Å; K1176-L1180 PolarHBondContact O-N 3.25Å; R1177-L1180 PolarHBondContact O-N 2.88Å; L1180-K1182 VanDerWaalsContact C-N 3.28Å; L1180-K1182 PolarHBondContact O-N 2.89Å; L1180-W1183 PolarHBondContact O-N 3.14Å; L1180-L1184 HydrophobicContact CB-CD1 4.12Å; L1180-L1184 HydrophobicContact CD2-CD1 4.22Å; L1180-L1184 VanDerWaalsContact O-CB 3.24Å; L1180-L1184 WeakPolarHBondContact O-CB 3.3Å; L1180-L1184 WeakPolarHBondContact O-CG 3.35Å; L1180-L1184 PolarHBondContact O-N 3.05Å; L1180-L1189 HydrophobicContact CB-CD1 4.02Å; L1180-I1198 HydrophobicContact CD1-CD1 4.23Å
1181	Q	84.6	Confident	81.5	Confident	53 Å²	53	65.9 Å²	65.9	25%	0.248	33%	0.334	C	S	.	.	H	α-helix	trans	-56.8	-43.2	174.1	-72.5	-178.4	-15	0	0	111.4	R1177 K1185 D1186 S1187 L1189	R1177-Q1181 HydrophobicContact CG-CG 4.33Å; R1177-Q1181 WeakPolarHBondContact O-CB 3.38Å; R1177-Q1181 VanDerWaalsContact O-CG 3.23Å; R1177-Q1181 WeakPolarHBondContact O-CG 3.32Å; R1177-Q1181 PolarHBondContact O-N 3.35Å; Q1181-K1185 WeakPolarHBondContact O-CA 3.37Å; Q1181-K1185 PolarHBondContact O-N 2.95Å; Q1181-D1186 WeakPolarHBondContact CA-O 3.48Å; Q1181-D1186 WeakPolarHBondContact CG-O 3.34Å; Q1181-D1186 PolarHBondContact O-N 2.8Å; Q1181-S1187 PolarHBondContact NE2-O 2.79Å; Q1181-L1189 HydrophobicContact CG-CB 3.96Å; Q1181-L1189 HydrophobicContact CG-CD1 4.15Å; Q1181-L1189 HydrophobicContact CG-CG 4.44Å; Q1181-L1189 PolarHBondContact NE2-O 2.66Å
1182	K	88.9	Confident	81.1	Confident	82 Å²	82	72.2 Å²	72.2	36%	0.357	36%	0.359	S	S	.	.	H	α-helix	trans	-63.8	-45.9	177	-174.4	-171.9	-178.1	-169.7	0	113.6	E1132 H1178 Y1179 L1180	E1132-K1182 VanDerWaalsContact OE2-CE 3.29Å; E1132-K1182 WeakPolarHBondContact OE2-CE 3.34Å; E1132-K1182 IonicContact OE2-NZ 2.68Å; E1132-K1182 PolarHBondContact OE2-NZ 2.91Å; H1178-K1182 WeakPolarHBondContact O-CB 3.31Å; H1178-K1182 PolarHBondContact O-N 2.75Å; H1178-K1182 VanDerWaalsContact O-N 3.07Å; Y1179-K1182 HydrophobicContact CD1-CD 4.1Å; Y1179-K1182 HydrophobicContact CE1-CD 4.44Å; Y1179-K1182 PolarHBondContact O-N 2.73Å; L1180-K1182 VanDerWaalsContact C-N 3.28Å; L1180-K1182 PolarHBondContact O-N 2.89Å
1183	W	91.3	Very high	81.2	Confident	9 Å²	9	67 Å²	67	3%	0.034	34%	0.336	C	S	.	.	H	α-helix	trans	-81.5	-39.8	-173.5	-63.1	-21.1	0	0	0	113.6	R1129 E1132 F1133 P1154 I1164 P1165 I1168 Y1179 L1180 K1185	R1129-W1183 HydrophobicContact CB-CD2 4.48Å; R1129-W1183 HydrophobicContact CB-CH2 4.01Å; R1129-W1183 HydrophobicContact CB-CZ2 3.67Å; R1129-W1183 HydrophobicContact CG-CD2 4.06Å; R1129-W1183 HydrophobicContact CG-CG 4.4Å; R1129-W1183 HydrophobicContact CG-CZ2 3.98Å; R1129-W1183 VanDerWaalsContact NE-CG 3.34Å; R1129-W1183 VanDerWaalsContact O-CZ2 3.23Å; R1129-W1183 WeakPolarHBondContact O-CZ2 3.33Å; E1132-W1183 VanDerWaalsContact CD-NE1 3.3Å; E1132-W1183 PolarHBondContact OE1-NE1 2.94Å; E1132-W1183 PolarHBondContact OE2-NE1 2.92Å; F1133-W1183 AromaticContact CD1-CH2 3.67Å; F1133-W1183 HydrophobicContact CD1-CH2 3.67Å; F1133-W1183 HydrophobicContact CD1-CZ2 4.06Å; F1133-W1183 AromaticContact CE1-CH2 3.84Å; F1133-W1183 HydrophobicContact CE1-CH2 3.84Å; P1154-W1183 WeakPolarHBondContact CD-O 3.47Å; I1164-W1183 HydrophobicContact CG1-CE3 4.42Å; I1164-W1183 HydrophobicContact CG2-CE3 4Å; I1164-W1183 HydrophobicContact CG2-CZ3 4.04Å; P1165-W1183 HydrophobicContact CG-CH2 4.25Å; P1165-W1183 HydrophobicContact CG-CZ3 4.32Å; I1168-W1183 HydrophobicContact CB-CH2 4.19Å; I1168-W1183 HydrophobicContact CB-CZ3 3.79Å; I1168-W1183 HydrophobicContact CD1-CH2 4.29Å; I1168-W1183 HydrophobicContact CD1-CZ3 4.47Å; I1168-W1183 HydrophobicContact CG1-CH2 4.14Å; I1168-W1183 HydrophobicContact CG1-CZ3 3.83Å; I1168-W1183 HydrophobicContact CG2-CZ3 3.92Å; Y1179-W1183 AromaticContact CD1-CZ2 3.86Å; Y1179-W1183 HydrophobicContact CD1-CZ2 3.86Å; Y1179-W1183 HydrophobicContact CG-CZ2 4.18Å; Y1179-W1183 WeakPolarHBondContact O-CB 3.4Å; Y1179-W1183 VanDerWaalsContact O-CD2 3.32Å; Y1179-W1183 PolarHBondContact O-N 2.78Å; L1180-W1183 PolarHBondContact O-N 3.14Å; W1183-K1185 VanDerWaalsContact C-N 3.34Å
1184	L	87.9	Confident	81.4	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.016	34%	0.344	C	S	.	.	H	α-helix	trans	-77.2	-25.4	176.7	-63.1	165.8	0	0	0	111.6	A1151 Q1153 I1164 L1180 D1186 L1189 I1198	A1151-L1184 HydrophobicContact CB-CD2 3.49Å; A1151-L1184 VanDerWaalsContact CB-CD2 3.49Å; Q1153-L1184 HydrophobicContact CB-CB 4.06Å; Q1153-L1184 HydrophobicContact CB-CD2 3.84Å; I1164-L1184 HydrophobicContact CD1-CD1 4.45Å; I1164-L1184 HydrophobicContact CD1-CD2 3.59Å; I1164-L1184 HydrophobicContact CD1-CG 3.91Å; L1180-L1184 HydrophobicContact CB-CD1 4.12Å; L1180-L1184 HydrophobicContact CD2-CD1 4.22Å; L1180-L1184 VanDerWaalsContact O-CB 3.24Å; L1180-L1184 WeakPolarHBondContact O-CB 3.3Å; L1180-L1184 WeakPolarHBondContact O-CG 3.35Å; L1180-L1184 PolarHBondContact O-N 3.05Å; L1184-D1186 VanDerWaalsContact C-N 3.31Å; L1184-L1189 HydrophobicContact CB-CD1 4.39Å; L1184-L1189 HydrophobicContact CD1-CD1 3.55Å; L1184-I1198 HydrophobicContact CD1-CD1 4.14Å; L1184-I1198 HydrophobicContact CD1-CG1 4.12Å; L1184-I1198 HydrophobicContact CD1-CG2 3.91Å; L1184-I1198 HydrophobicContact CD2-CG2 3.8Å
1185	K	85.9	Confident	81.8	Confident	168 Å²	168	66.2 Å²	66.2	73%	0.73	32%	0.323	S	S	*	.			trans	63.8	33	-172.6	-51.5	-174.3	179.4	-174.5	0	113.1	P1154 Q1181 W1183	P1154-K1185 HydrophobicContact CB-CD 4.37Å; P1154-K1185 HydrophobicContact CB-CG 4.5Å; Q1181-K1185 WeakPolarHBondContact O-CA 3.37Å; Q1181-K1185 PolarHBondContact O-N 2.95Å; W1183-K1185 VanDerWaalsContact C-N 3.34Å
1186	D	81.8	Confident	82	Confident	34 Å²	34	64.8 Å²	64.8	18%	0.182	31%	0.314	C	S	.	.			trans	-116.6	118.6	174.4	-164.2	-32.2	0	0	0	109.9	Q1153 Q1181 L1184 N1188 L1189	Q1153-D1186 PolarHBondContact NE2-OD2 2.8Å; Q1181-D1186 WeakPolarHBondContact CA-O 3.48Å; Q1181-D1186 WeakPolarHBondContact CG-O 3.34Å; Q1181-D1186 PolarHBondContact O-N 2.8Å; L1184-D1186 VanDerWaalsContact C-N 3.31Å; D1186-N1188 WeakPolarHBondContact OD1-CB 3.39Å; D1186-N1188 PolarHBondContact OD1-N 2.87Å; D1186-N1188 PolarHBondContact OD1-ND2 2.95Å; D1186-L1189 HydrophobicContact CB-CD1 4.41Å; D1186-L1189 HydrophobicContact CB-CG 4.22Å
1187	S	81.2	Confident	82.1	Confident	100 Å²	100	69.3 Å²	69.3	70%	0.699	34%	0.336	S	S	*	.	S	Bend	trans	-83.8	-12.3	-178.8	-52.5	0	0	0	0	113.7	Q1181 L1189	Q1181-S1187 PolarHBondContact NE2-O 2.79Å; S1187-L1189 VanDerWaalsContact C-N 3.27Å; S1187-L1189 PolarHBondContact O-N 3.05Å
1188	N	77.7	Confident	82.4	Confident	142 Å²	142	65.1 Å²	65.1	76%	0.759	32%	0.32	S	S	*	.			trans	-77.1	-17.1	-175.7	-57.4	-64.3	0	0	0	112.8	D1186 D1190	D1186-N1188 WeakPolarHBondContact OD1-CB 3.39Å; D1186-N1188 PolarHBondContact OD1-N 2.87Å; D1186-N1188 PolarHBondContact OD1-ND2 2.95Å; N1188-D1190 PolarHBondContact O-N 2.91Å
1189	L	74.6	Confident	82.6	Confident	13 Å²	13	60.1 Å²	60.1	7%	0.068	30%	0.297	C	S	.	.			trans	-53.3	124.3	178.5	-53	174.1	0	0	0	110	R1177 L1180 Q1181 L1184 D1186 S1187 T1193	R1177-L1189 VanDerWaalsContact CZ-O 3.31Å; R1177-L1189 PolarHBondContact NE-O 2.98Å; R1177-L1189 PolarHBondContact NH2-O 2.84Å; L1180-L1189 HydrophobicContact CB-CD1 4.02Å; Q1181-L1189 HydrophobicContact CG-CB 3.96Å; Q1181-L1189 HydrophobicContact CG-CD1 4.15Å; Q1181-L1189 HydrophobicContact CG-CG 4.44Å; Q1181-L1189 PolarHBondContact NE2-O 2.66Å; L1184-L1189 HydrophobicContact CB-CD1 4.39Å; L1184-L1189 HydrophobicContact CD1-CD1 3.55Å; D1186-L1189 HydrophobicContact CB-CD1 4.41Å; D1186-L1189 HydrophobicContact CB-CG 4.22Å; S1187-L1189 VanDerWaalsContact C-N 3.27Å; S1187-L1189 PolarHBondContact O-N 3.05Å; L1189-T1193 HydrophobicContact CD2-CG2 3.81Å
1190	D	75.1	Confident	82.8	Confident	67 Å²	67	58.5 Å²	58.5	36%	0.358	29%	0.291	S	S	.	.			trans	-100	-169.9	171.2	76.2	-7.3	0	0	0	111	N1188 H1192 T1193	N1188-D1190 PolarHBondContact O-N 2.91Å; D1190-H1192 VanDerWaalsContact C-N 3.27Å; D1190-H1192 WeakPolarHBondContact OD1-CA 3.04Å; D1190-H1192 PolarHBondContact OD1-N 3.19Å; D1190-T1193 PolarHBondContact N-OG1 2.82Å; D1190-T1193 WeakPolarHBondContact OD1-CA 3.27Å; D1190-T1193 PolarHBondContact OD1-N 2.97Å; D1190-T1193 PolarHBondContact OD1-OG1 2.99Å
1191	E	69.5	Low	83	Confident	106 Å²	106	59.2 Å²	59.2	50%	0.495	29%	0.294	S	S	.	.	S	Bend	trans	-79.9	-13.4	179.5	-161.7	162.2	-177.2	0	0	112.5	G1173	G1173-E1191 WeakPolarHBondContact CA-OE1 3.48Å
1192	H	70.9	Confident	83.3	Confident	162 Å²	162	60.7 Å²	60.7	75%	0.75	31%	0.31	S	S	*	.	S	Bend	trans	-108.6	1.1	-174.6	-55.5	-40.3	0	0	0	113.6	D1190 D1194	D1190-H1192 VanDerWaalsContact C-N 3.27Å; D1190-H1192 WeakPolarHBondContact OD1-CA 3.04Å; D1190-H1192 PolarHBondContact OD1-N 3.19Å; H1192-D1194 PolarHBondContact O-N 2.89Å
1193	T	77.1	Confident	83.5	Confident	29 Å²	29	58.6 Å²	58.6	18%	0.178	30%	0.3	C	S	.	.			trans	-62.5	129.5	-172.8	-55.9	0	0	0	0	111.7	L1189 D1190	L1189-T1193 HydrophobicContact CD2-CG2 3.81Å; D1190-T1193 PolarHBondContact N-OG1 2.82Å; D1190-T1193 WeakPolarHBondContact OD1-CA 3.27Å; D1190-T1193 PolarHBondContact OD1-N 2.97Å; D1190-T1193 PolarHBondContact OD1-OG1 2.99Å
1194	D	80.9	Confident	83.5	Confident	61 Å²	61	58.4 Å²	58.4	33%	0.326	30%	0.299	S	S	.	.			trans	-72.4	131.5	-176.6	-174.3	-16.2	0	0	0	111.6	H1192 R1196 E1197	H1192-D1194 PolarHBondContact O-N 2.89Å; D1194-R1196 VanDerWaalsContact CG-NH1 3.33Å; D1194-R1196 PolarHBondContact O-N 2.82Å; D1194-R1196 VanDerWaalsContact OD1-CB 3.32Å; D1194-R1196 WeakPolarHBondContact OD1-CB 3.06Å; D1194-R1196 VanDerWaalsContact OD1-CG 3.23Å; D1194-R1196 WeakPolarHBondContact OD1-CG 3.23Å; D1194-R1196 IonicContact OD1-CZ 3.32Å; D1194-R1196 PolarHBondContact OD1-N 2.82Å; D1194-R1196 IonicContact OD1-NH1 3.82Å; D1194-R1196 PolarHBondContact OD1-NH1 2.9Å; D1194-R1196 WeakPolarHBondContact OD2-CD 3.33Å; D1194-R1196 IonicContact OD2-NH1 3.07Å; D1194-R1196 PolarHBondContact OD2-NH1 2.89Å; D1194-E1197 HydrophobicContact CB-CG 4.44Å; D1194-E1197 PolarHBondContact O-N 2.82Å; D1194-E1197 VanDerWaalsContact O-N 3.09Å
1195	I	84.8	Confident	83.8	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.015	30%	0.304	C	S	.	.	H	α-helix	trans	-55.8	-29.1	173.4	-175.6	164.2	0	0	0	113.5	D1096 L1099 F1100 I1149 F1169 E1197 I1198 L1199	D1096-I1195 HydrophobicContact CB-CG2 4.45Å; D1096-I1195 WeakPolarHBondContact OD2-CG2 3.38Å; L1099-I1195 HydrophobicContact CD2-CG2 4.33Å; F1100-I1195 HydrophobicContact CD1-CD1 3.81Å; F1100-I1195 HydrophobicContact CE1-CD1 3.09Å; F1100-I1195 HydrophobicContact CE2-CD1 4.22Å; F1100-I1195 HydrophobicContact CZ-CD1 3.32Å; I1149-I1195 HydrophobicContact CD1-CD1 3.95Å; F1169-I1195 HydrophobicContact CE1-CD1 4.14Å; F1169-I1195 HydrophobicContact CE1-CG1 4.42Å; F1169-I1195 HydrophobicContact CZ-CD1 4.23Å; I1195-E1197 PolarHBondContact O-N 3.4Å; I1195-E1197 VanDerWaalsContact O-N 3.14Å; I1195-I1198 WeakPolarHBondContact O-CB 3.3Å; I1195-I1198 PolarHBondContact O-N 2.87Å; I1195-L1199 HydrophobicContact CD1-CD1 4.44Å; I1195-L1199 HydrophobicContact CG1-CD1 3.9Å; I1195-L1199 HydrophobicContact CG1-CD2 4.43Å; I1195-L1199 HydrophobicContact CG1-CG 3.92Å; I1195-L1199 WeakPolarHBondContact O-CG 3.45Å; I1195-L1199 PolarHBondContact O-N 3.13Å
1196	R	86.2	Confident	84	Confident	32 Å²	32	56.9 Å²	56.9	12%	0.121	30%	0.295	C	S	.	.	H	α-helix	trans	-63	-18.7	178.7	-61.2	168.5	-168.6	68.5	4.6	112.7	K1090 G1091 M1094 D1096 L1099 D1194 W1201	K1090-R1196 WeakPolarHBondContact O-CD 3.35Å; K1090-R1196 WeakPolarHBondContact O-CG 3.46Å; G1091-R1196 PolarHBondContact O-NE 3.32Å; M1094-R1196 PolarHBondContact O-NH2 3.22Å; D1096-R1196 IonicContact OD1-CZ 2.69Å; D1096-R1196 VanDerWaalsContact OD1-CZ 3.25Å; D1096-R1196 IonicContact OD1-NH1 3.88Å; D1096-R1196 PolarHBondContact OD1-NH1 3.35Å; D1096-R1196 IonicContact OD1-NH2 3.13Å; D1096-R1196 PolarHBondContact OD1-NH2 3.33Å; D1096-R1196 IonicContact OD2-NH1 3.22Å; L1099-R1196 HydrophobicContact CD2-CG 4.18Å; D1194-R1196 VanDerWaalsContact CG-NH1 3.33Å; D1194-R1196 PolarHBondContact O-N 2.82Å; D1194-R1196 VanDerWaalsContact OD1-CB 3.32Å; D1194-R1196 WeakPolarHBondContact OD1-CB 3.06Å; D1194-R1196 VanDerWaalsContact OD1-CG 3.23Å; D1194-R1196 WeakPolarHBondContact OD1-CG 3.23Å; D1194-R1196 IonicContact OD1-CZ 3.32Å; D1194-R1196 PolarHBondContact OD1-N 2.82Å; D1194-R1196 IonicContact OD1-NH1 3.82Å; D1194-R1196 PolarHBondContact OD1-NH1 2.9Å; D1194-R1196 WeakPolarHBondContact OD2-CD 3.33Å; D1194-R1196 IonicContact OD2-NH1 3.07Å; D1194-R1196 PolarHBondContact OD2-NH1 2.89Å; R1196-W1201 HydrophobicContact CB-CZ2 4.26Å; R1196-W1201 HydrophobicContact CG-CZ2 4.28Å; R1196-W1201 PolarHBondContact O-NE1 2.95Å
1197	E	83.4	Confident	84.4	Confident	142 Å²	142	57.8 Å²	57.8	66%	0.664	30%	0.296	S	S	*	.	H	α-helix	trans	-85.2	-31.7	172.1	-54.4	-160.7	136.2	0	0	112.6	D1194 I1195	D1194-E1197 HydrophobicContact CB-CG 4.44Å; D1194-E1197 PolarHBondContact O-N 2.82Å; D1194-E1197 VanDerWaalsContact O-N 3.09Å; I1195-E1197 PolarHBondContact O-N 3.4Å; I1195-E1197 VanDerWaalsContact O-N 3.14Å
1198	I	87.6	Confident	84.9	Confident	5 Å²	5	53 Å²	53	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-74.5	-33.9	-176.8	-62.7	175.7	0	0	0	112.5	A1151 R1152 F1169 L1180 L1184 I1195	A1151-I1198 CarbonylContact C-O 3.59Å; A1151-I1198 VanDerWaalsContact CA-O 3.31Å; A1151-I1198 WeakPolarHBondContact CA-O 3.36Å; A1151-I1198 HydrophobicContact CB-CG2 3.81Å; R1152-I1198 PolarHBondContact N-O 3.35Å; F1169-I1198 HydrophobicContact CE1-CD1 4.27Å; L1180-I1198 HydrophobicContact CD1-CD1 4.23Å; L1184-I1198 HydrophobicContact CD1-CD1 4.14Å; L1184-I1198 HydrophobicContact CD1-CG1 4.12Å; L1184-I1198 HydrophobicContact CD1-CG2 3.91Å; L1184-I1198 HydrophobicContact CD2-CG2 3.8Å; I1195-I1198 WeakPolarHBondContact O-CB 3.3Å; I1195-I1198 PolarHBondContact O-N 2.87Å
1199	L	89.8	Confident	85.6	Confident	2 Å²	2	47 Å²	47	1%	0.01	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-73.1	142.6	-166.8	-72.6	168.6	0	0	0	115.9	L1099 I1103 I1149 I1195 W1201 Y1204	L1099-L1199 HydrophobicContact CD2-CD1 3.94Å; L1099-L1199 HydrophobicContact CG-CD1 4.4Å; I1103-L1199 HydrophobicContact CD1-CD1 3.54Å; I1103-L1199 HydrophobicContact CD1-CD2 3.26Å; I1103-L1199 HydrophobicContact CD1-CG 4.03Å; I1149-L1199 HydrophobicContact CB-CD2 4.07Å; I1149-L1199 HydrophobicContact CD1-CD2 3.77Å; I1149-L1199 HydrophobicContact CG1-CD2 4.43Å; I1149-L1199 HydrophobicContact CG2-CD2 4.48Å; I1195-L1199 HydrophobicContact CD1-CD1 4.44Å; I1195-L1199 HydrophobicContact CG1-CD1 3.9Å; I1195-L1199 HydrophobicContact CG1-CD2 4.43Å; I1195-L1199 HydrophobicContact CG1-CG 3.92Å; I1195-L1199 WeakPolarHBondContact O-CG 3.45Å; I1195-L1199 PolarHBondContact O-N 3.13Å; L1199-W1201 VanDerWaalsContact C-N 3.27Å; L1199-W1201 HydrophobicContact CB-CD2 4.42Å; L1199-W1201 HydrophobicContact CB-CZ2 4.21Å; L1199-W1201 HydrophobicContact CD1-CH2 4.04Å; L1199-W1201 HydrophobicContact CD1-CZ2 3.63Å; L1199-W1201 PolarHBondContact O-N 3.2Å; L1199-Y1204 HydrophobicContact CD2-CE2 4.22Å
1200	D	92.2	Very high	86.4	Confident	9 Å²	9	47.4 Å²	47.4	5%	0.048	24%	0.235	C	C	.	.			trans	-80.3	73.4	169	-168.3	-8.1	0	0	0	111.5	I1150 R1152 R1162 S1202 Y1203 Y1204	I1150-D1200 HydrophobicContact CG2-CB 3.99Å; I1150-D1200 PolarHBondContact O-N 3.07Å; R1152-D1200 HydrophobicContact CB-CB 4.24Å; R1162-D1200 IonicContact CZ-OD2 3.06Å; R1162-D1200 VanDerWaalsContact CZ-OD2 3.28Å; R1162-D1200 IonicContact NH1-OD2 2.69Å; R1162-D1200 PolarHBondContact NH1-OD2 3.27Å; R1162-D1200 IonicContact NH2-OD2 3.89Å; R1162-D1200 PolarHBondContact NH2-OD2 2.89Å; D1200-S1202 PolarHBondContact O-N 2.73Å; D1200-S1202 VanDerWaalsContact O-N 3.08Å; D1200-S1202 WeakPolarHBondContact OD1-CB 3.32Å; D1200-S1202 PolarHBondContact OD1-N 3.42Å; D1200-S1202 VanDerWaalsContact OD1-N 3.12Å; D1200-S1202 PolarHBondContact OD1-OG 2.83Å; D1200-Y1203 VanDerWaalsContact CG-CB 3.42Å; D1200-Y1203 WeakPolarHBondContact O-CB 3.48Å; D1200-Y1203 PolarHBondContact O-N 2.81Å; D1200-Y1203 VanDerWaalsContact O-N 3.09Å; D1200-Y1203 PolarHBondContact OD1-N 2.93Å; D1200-Y1203 WeakPolarHBondContact OD2-CB 3.35Å; D1200-Y1204 WeakPolarHBondContact O-CD2 3.38Å; D1200-Y1204 PolarHBondContact O-N 3.29Å
1201	W	92.6	Very high	87.1	Confident	22 Å²	22	44.5 Å²	44.5	8%	0.083	22%	0.221	C	C	.	.	H	α-helix	trans	-51.8	-30.1	173.3	-62.1	100.7	0	0	0	112.9	L1087 K1090 L1099 R1196 L1199 Y1204 I1205	L1087-W1201 HydrophobicContact CD2-CE3 4.04Å; L1087-W1201 HydrophobicContact CD2-CZ3 3.95Å; K1090-W1201 VanDerWaalsContact CA-CH2 3.49Å; K1090-W1201 HydrophobicContact CB-CD2 4.05Å; K1090-W1201 HydrophobicContact CB-CE3 4.48Å; K1090-W1201 HydrophobicContact CB-CH2 4.06Å; K1090-W1201 HydrophobicContact CB-CZ2 3.57Å; K1090-W1201 HydrophobicContact CB-CZ3 4.5Å; K1090-W1201 HydrophobicContact CG-CD2 3.94Å; K1090-W1201 HydrophobicContact CG-CG 4.06Å; K1090-W1201 HydrophobicContact CG-CZ2 4.3Å; K1090-W1201 WeakPolarHBondContact O-CH2 3.41Å; K1090-W1201 VanDerWaalsContact O-CZ2 3.24Å; K1090-W1201 WeakPolarHBondContact O-CZ2 3.46Å; L1099-W1201 HydrophobicContact CD1-CH2 3.69Å; L1099-W1201 HydrophobicContact CD1-CZ3 4.23Å; L1099-W1201 HydrophobicContact CD2-CH2 3.98Å; L1099-W1201 HydrophobicContact CD2-CZ2 4.33Å; L1099-W1201 HydrophobicContact CG-CH2 4.49Å; R1196-W1201 HydrophobicContact CB-CZ2 4.26Å; R1196-W1201 HydrophobicContact CG-CZ2 4.28Å; R1196-W1201 PolarHBondContact O-NE1 2.95Å; L1199-W1201 VanDerWaalsContact C-N 3.27Å; L1199-W1201 HydrophobicContact CB-CD2 4.42Å; L1199-W1201 HydrophobicContact CB-CZ2 4.21Å; L1199-W1201 HydrophobicContact CD1-CH2 4.04Å; L1199-W1201 HydrophobicContact CD1-CZ2 3.63Å; L1199-W1201 PolarHBondContact O-N 3.2Å; W1201-Y1204 PolarHBondContact O-N 2.76Å; W1201-I1205 WeakPolarHBondContact O-CB 3.42Å; W1201-I1205 WeakPolarHBondContact O-CD1 3.47Å; W1201-I1205 WeakPolarHBondContact O-CG1 3.06Å; W1201-I1205 PolarHBondContact O-N 2.92Å
1202	S	90.5	Very high	88.3	Confident	83 Å²	83	39.5 Å²	39.5	58%	0.58	20%	0.197	S	C	*	.	H	α-helix	trans	-70.1	-40	179	79.4	0	0	0	0	112.6	D1200 I1205 E1206	D1200-S1202 PolarHBondContact O-N 2.73Å; D1200-S1202 VanDerWaalsContact O-N 3.08Å; D1200-S1202 WeakPolarHBondContact OD1-CB 3.32Å; D1200-S1202 PolarHBondContact OD1-N 3.42Å; D1200-S1202 VanDerWaalsContact OD1-N 3.12Å; D1200-S1202 PolarHBondContact OD1-OG 2.83Å; S1202-I1205 PolarHBondContact O-N 2.8Å; S1202-E1206 PolarHBondContact O-N 2.86Å
1203	Y	92	Very high	89.4	Confident	39 Å²	39	32.5 Å²	32.5	15%	0.153	17%	0.165	C	C	.	.	H	α-helix	trans	-61.1	-47.4	172.1	168.9	-95.8	0	0	0	111.4	E1105 I1150 V1159 D1200 I1205 E1206 R1207	E1105-Y1203 PolarHBondContact OE1-OH 2.91Å; I1150-Y1203 HydrophobicContact CB-CD1 3.9Å; I1150-Y1203 HydrophobicContact CB-CE1 4.13Å; I1150-Y1203 HydrophobicContact CB-CG 4.46Å; I1150-Y1203 HydrophobicContact CG1-CD1 3.89Å; I1150-Y1203 HydrophobicContact CG1-CE1 3.57Å; I1150-Y1203 HydrophobicContact CG2-CD1 4.17Å; I1150-Y1203 HydrophobicContact CG2-CG 4.22Å; V1159-Y1203 HydrophobicContact CG1-CD2 4.2Å; V1159-Y1203 HydrophobicContact CG1-CE2 3.76Å; V1159-Y1203 HydrophobicContact CG2-CD2 4.2Å; V1159-Y1203 HydrophobicContact CG2-CE2 4.35Å; D1200-Y1203 VanDerWaalsContact CG-CB 3.42Å; D1200-Y1203 WeakPolarHBondContact O-CB 3.48Å; D1200-Y1203 PolarHBondContact O-N 2.81Å; D1200-Y1203 VanDerWaalsContact O-N 3.09Å; D1200-Y1203 PolarHBondContact OD1-N 2.93Å; D1200-Y1203 WeakPolarHBondContact OD2-CB 3.35Å; Y1203-I1205 PolarHBondContact O-N 3.19Å; Y1203-E1206 PolarHBondContact O-N 2.82Å; Y1203-R1207 HydrophobicContact CD1-CG 4.13Å; Y1203-R1207 HydrophobicContact CD2-CG 4.32Å; Y1203-R1207 HydrophobicContact CE1-CG 3.74Å; Y1203-R1207 HydrophobicContact CE2-CG 3.97Å; Y1203-R1207 HydrophobicContact CG-CG 4.4Å; Y1203-R1207 WeakPolarHBondContact O-CG 3.37Å; Y1203-R1207 PolarHBondContact O-N 2.89Å; Y1203-R1207 WeakPolarHBondContact OH-CD 3.1Å; Y1203-R1207 PolarHBondContact OH-NE 2.94Å
1204	Y	93	Very high	90	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-65.3	-38.8	179.1	-68.5	-68.4	0	0	0	112.3	L1049 I1103 I1150 L1199 D1200 W1201 R1207 L1208	L1049-Y1204 HydrophobicContact CD1-CD1 4.01Å; L1049-Y1204 HydrophobicContact CD1-CE1 4.22Å; L1049-Y1204 HydrophobicContact CD2-CD1 4.4Å; L1049-Y1204 HydrophobicContact CD2-CE1 3.87Å; I1103-Y1204 HydrophobicContact CB-CD1 4.15Å; I1103-Y1204 HydrophobicContact CB-CE1 3.75Å; I1103-Y1204 HydrophobicContact CB-CE2 4.38Å; I1103-Y1204 HydrophobicContact CD1-CE2 4.09Å; I1103-Y1204 HydrophobicContact CG2-CD1 4.22Å; I1103-Y1204 HydrophobicContact CG2-CE1 4.34Å; I1103-Y1204 HydrophobicContact CG2-CG 4.42Å; I1103-Y1204 WeakPolarHBondContact O-CE1 3.32Å; I1103-Y1204 VanDerWaalsContact O-CZ 3.27Å; I1103-Y1204 PolarHBondContact O-OH 3.27Å; I1150-Y1204 HydrophobicContact CB-CE2 4.39Å; I1150-Y1204 PolarHBondContact N-OH 3.05Å; L1199-Y1204 HydrophobicContact CD2-CE2 4.22Å; D1200-Y1204 WeakPolarHBondContact O-CD2 3.38Å; D1200-Y1204 PolarHBondContact O-N 3.29Å; W1201-Y1204 PolarHBondContact O-N 2.76Å; Y1204-R1207 PolarHBondContact O-N 3.17Å; Y1204-L1208 PolarHBondContact O-N 2.93Å
1205	I	92.2	Very high	90.6	Very high	25 Å²	25	31.6 Å²	31.6	13%	0.128	16%	0.156	C	C	.	.	H	α-helix	trans	-62.6	-41.3	172.5	-70.9	165.3	0	0	0	110.8	L1087 Y1088 W1201 S1202 Y1203 S1209	L1087-I1205 HydrophobicContact CB-CD1 4.27Å; L1087-I1205 HydrophobicContact CB-CG1 3.69Å; L1087-I1205 HydrophobicContact CD1-CG1 3.84Å; L1087-I1205 HydrophobicContact CG-CG1 4.42Å; Y1088-I1205 HydrophobicContact CD1-CD1 4.03Å; Y1088-I1205 HydrophobicContact CD2-CD1 4.41Å; Y1088-I1205 HydrophobicContact CE1-CD1 3.92Å; Y1088-I1205 HydrophobicContact CE2-CD1 4.32Å; Y1088-I1205 HydrophobicContact CE2-CG2 4.44Å; Y1088-I1205 HydrophobicContact CG-CD1 4.28Å; W1201-I1205 WeakPolarHBondContact O-CB 3.42Å; W1201-I1205 WeakPolarHBondContact O-CD1 3.47Å; W1201-I1205 WeakPolarHBondContact O-CG1 3.06Å; W1201-I1205 PolarHBondContact O-N 2.92Å; S1202-I1205 PolarHBondContact O-N 2.8Å; Y1203-I1205 PolarHBondContact O-N 3.19Å; I1205-S1209 WeakPolarHBondContact O-CB 3.49Å; I1205-S1209 PolarHBondContact O-N 2.86Å; I1205-S1209 PolarHBondContact O-OG 2.92Å
1206	E	90.2	Very high	91	Very high	114 Å²	114	31.5 Å²	31.5	53%	0.533	16%	0.155	S	C	.	.	H	α-helix	trans	-67.9	-39.8	176	-153.4	-150.1	144.7	0	0	112.1	K1016 S1202 Y1203 S1209 S1210	K1016-E1206 IonicContact NZ-OE1 3.47Å; S1202-E1206 PolarHBondContact O-N 2.86Å; Y1203-E1206 PolarHBondContact O-N 2.82Å; E1206-S1209 PolarHBondContact O-N 2.93Å; E1206-S1210 VanDerWaalsContact O-CB 3.23Å; E1206-S1210 WeakPolarHBondContact O-CB 3.43Å; E1206-S1210 PolarHBondContact O-N 2.79Å
1207	R	90.6	Very high	91.3	Very high	53 Å²	53	30 Å²	30	20%	0.2	15%	0.15	C	C	.	.	H	α-helix	trans	-59.6	-47.4	176.9	-67.4	-84.1	-84.1	115.1	-7.3	111	E1048 L1049 I1052 E1105 Y1203 Y1204 S1210 A1211	E1048-R1207 IonicContact OE1-CZ 2.7Å; E1048-R1207 IonicContact OE1-NH1 3.11Å; E1048-R1207 PolarHBondContact OE1-NH1 3.11Å; E1048-R1207 IonicContact OE1-NH2 3.9Å; E1048-R1207 PolarHBondContact OE1-NH2 2.7Å; L1049-R1207 HydrophobicContact CD1-CB 4.03Å; L1049-R1207 HydrophobicContact CD1-CG 4.29Å; I1052-R1207 HydrophobicContact CD1-CB 4.41Å; E1105-R1207 IonicContact OE1-CZ 2.74Å; E1105-R1207 IonicContact OE1-NE 2.7Å; E1105-R1207 IonicContact OE1-NH2 3.61Å; E1105-R1207 PolarHBondContact OE1-NH2 2.93Å; Y1203-R1207 HydrophobicContact CD1-CG 4.13Å; Y1203-R1207 HydrophobicContact CD2-CG 4.32Å; Y1203-R1207 HydrophobicContact CE1-CG 3.74Å; Y1203-R1207 HydrophobicContact CE2-CG 3.97Å; Y1203-R1207 HydrophobicContact CG-CG 4.4Å; Y1203-R1207 WeakPolarHBondContact O-CG 3.37Å; Y1203-R1207 PolarHBondContact O-N 2.89Å; Y1203-R1207 WeakPolarHBondContact OH-CD 3.1Å; Y1203-R1207 PolarHBondContact OH-NE 2.94Å; Y1204-R1207 PolarHBondContact O-N 3.17Å; R1207-S1210 PolarHBondContact O-N 3.34Å; R1207-A1211 PolarHBondContact O-N 2.89Å
1208	L	92.1	Very high	91.8	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-68.8	-43.8	175.8	-176.6	62	0	0	0	111.7	F1055 W1083 L1084 L1087 Y1204 S1210 A1211 I1212	F1055-L1208 HydrophobicContact CB-CD1 4.18Å; F1055-L1208 HydrophobicContact CD1-CD1 3.87Å; F1055-L1208 HydrophobicContact CD2-CD1 4.17Å; F1055-L1208 HydrophobicContact CE1-CD1 4.31Å; F1055-L1208 HydrophobicContact CG-CD1 3.8Å; W1083-L1208 HydrophobicContact CB-CD2 3.97Å; L1084-L1208 HydrophobicContact CD2-CD2 4.11Å; L1084-L1208 HydrophobicContact CG-CD2 4.35Å; L1087-L1208 HydrophobicContact CD1-CB 4.08Å; L1087-L1208 HydrophobicContact CD1-CD2 3.75Å; Y1204-L1208 PolarHBondContact O-N 2.93Å; L1208-S1210 PolarHBondContact O-N 2.89Å; L1208-A1211 WeakPolarHBondContact O-CA 3.44Å; L1208-A1211 WeakPolarHBondContact O-CB 3.43Å; L1208-A1211 PolarHBondContact O-N 2.99Å; L1208-I1212 HydrophobicContact CD1-CD1 4.44Å; L1208-I1212 HydrophobicContact CD2-CD1 4.37Å; L1208-I1212 HydrophobicContact CG-CD1 3.85Å; L1208-I1212 HydrophobicContact CG-CG1 4.44Å; L1208-I1212 WeakPolarHBondContact O-CG1 3.4Å; L1208-I1212 PolarHBondContact O-N 3.41Å
1209	S	93.4	Very high	92	Very high	16 Å²	16	23 Å²	23	11%	0.112	12%	0.117	C	C	.	.	H	α-helix	trans	-57.8	-36.4	175.7	-63.8	0	0	0	0	112.3	I1205 E1206 A1211 I1212 Q1213	I1205-S1209 WeakPolarHBondContact O-CB 3.49Å; I1205-S1209 PolarHBondContact O-N 2.86Å; I1205-S1209 PolarHBondContact O-OG 2.92Å; E1206-S1209 PolarHBondContact O-N 2.93Å; S1209-A1211 VanDerWaalsContact C-N 3.3Å; S1209-A1211 PolarHBondContact O-N 3.31Å; S1209-I1212 PolarHBondContact O-N 3.33Å; S1209-Q1213 WeakPolarHBondContact O-CB 3.35Å; S1209-Q1213 WeakPolarHBondContact O-CG 3.48Å; S1209-Q1213 PolarHBondContact O-N 3.25Å
1210	S	91.1	Very high	92.1	Very high	20 Å²	20	22.9 Å²	22.9	14%	0.14	12%	0.117	C	C	.	.	H	α-helix	trans	-68.8	-25	175.1	-172.5	0	0	0	0	113	E1206 R1207 L1208 K1214	E1206-S1210 VanDerWaalsContact O-CB 3.23Å; E1206-S1210 WeakPolarHBondContact O-CB 3.43Å; E1206-S1210 PolarHBondContact O-N 2.79Å; R1207-S1210 PolarHBondContact O-N 3.34Å; L1208-S1210 PolarHBondContact O-N 2.89Å; S1210-K1214 WeakPolarHBondContact O-CD 3.45Å; S1210-K1214 WeakPolarHBondContact O-CE 3.43Å; S1210-K1214 VanDerWaalsContact O-CG 3.25Å; S1210-K1214 WeakPolarHBondContact O-CG 3.42Å; S1210-K1214 PolarHBondContact O-NZ 3.42Å; S1210-K1214 PolarHBondContact OG-NZ 3.44Å
1211	A	90	Very high	92	Very high	7 Å²	7	22.5 Å²	22.5	6%	0.058	12%	0.115	C	C	.	.	H	α-helix	trans	-79.7	-46.8	169.8	0	0	0	0	0	111.1	I1052 F1055 R1207 L1208 S1209 Q1213 K1214 I1215	I1052-A1211 HydrophobicContact CG2-CB 4.28Å; F1055-A1211 HydrophobicContact CD1-CB 4.41Å; F1055-A1211 HydrophobicContact CE1-CB 4Å; R1207-A1211 PolarHBondContact O-N 2.89Å; L1208-A1211 WeakPolarHBondContact O-CA 3.44Å; L1208-A1211 WeakPolarHBondContact O-CB 3.43Å; L1208-A1211 PolarHBondContact O-N 2.99Å; S1209-A1211 VanDerWaalsContact C-N 3.3Å; S1209-A1211 PolarHBondContact O-N 3.31Å; A1211-Q1213 VanDerWaalsContact C-N 3.28Å; A1211-Q1213 PolarHBondContact O-N 3.29Å; A1211-K1214 PolarHBondContact O-N 3.25Å; A1211-K1214 VanDerWaalsContact O-N 3.15Å; A1211-I1215 WeakPolarHBondContact O-CB 3.49Å; A1211-I1215 WeakPolarHBondContact O-CG1 3.43Å; A1211-I1215 PolarHBondContact O-N 2.87Å
1212	I	93.9	Very high	91.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-55.5	-41.6	174.4	-69.2	166.6	0	0	0	111.2	F1055 A1080 L1084 L1208 S1209 I1216 T1217 V1229 V1232	F1055-I1212 HydrophobicContact CE1-CG1 4.22Å; F1055-I1212 HydrophobicContact CE2-CG1 3.96Å; F1055-I1212 HydrophobicContact CZ-CG1 3.51Å; A1080-I1212 HydrophobicContact CB-CD1 3.95Å; A1080-I1212 HydrophobicContact CB-CG1 4.06Å; L1084-I1212 HydrophobicContact CD1-CD1 3.89Å; L1084-I1212 HydrophobicContact CD2-CD1 4.06Å; L1084-I1212 HydrophobicContact CG-CD1 3.87Å; L1208-I1212 HydrophobicContact CD1-CD1 4.44Å; L1208-I1212 HydrophobicContact CD2-CD1 4.37Å; L1208-I1212 HydrophobicContact CG-CD1 3.85Å; L1208-I1212 HydrophobicContact CG-CG1 4.44Å; L1208-I1212 WeakPolarHBondContact O-CG1 3.4Å; L1208-I1212 PolarHBondContact O-N 3.41Å; S1209-I1212 PolarHBondContact O-N 3.33Å; I1212-I1216 HydrophobicContact CG1-CD1 4.35Å; I1212-I1216 HydrophobicContact CG2-CB 4.42Å; I1212-I1216 HydrophobicContact CG2-CD1 4.22Å; I1212-I1216 WeakPolarHBondContact O-CA 3.32Å; I1212-I1216 VanDerWaalsContact O-CB 3.3Å; I1212-I1216 WeakPolarHBondContact O-CB 3.13Å; I1212-I1216 PolarHBondContact O-N 3.48Å; I1212-T1217 HydrophobicContact CG2-CG2 3.79Å; I1212-T1217 PolarHBondContact O-N 2.85Å; I1212-V1229 HydrophobicContact CG2-CB 4.27Å; I1212-V1229 HydrophobicContact CG2-CG1 4.34Å; I1212-V1229 HydrophobicContact CG2-CG2 4.26Å; I1212-V1232 HydrophobicContact CB-CG1 4.45Å; I1212-V1232 HydrophobicContact CB-CG2 4.42Å; I1212-V1232 HydrophobicContact CD1-CG2 4.2Å; I1212-V1232 HydrophobicContact CG2-CB 4.01Å; I1212-V1232 HydrophobicContact CG2-CG1 3.98Å; I1212-V1232 HydrophobicContact CG2-CG2 3.92Å
1213	Q	93.1	Very high	91.8	Very high	16 Å²	16	22.4 Å²	22.4	8%	0.075	11%	0.108	C	C	.	.	I	π-helix	trans	-58.2	-51.3	174.6	-82.4	178.1	-13.4	0	0	112.3	S1209 A1211 T1217 I1218 V1232 S1233	S1209-Q1213 WeakPolarHBondContact O-CB 3.35Å; S1209-Q1213 WeakPolarHBondContact O-CG 3.48Å; S1209-Q1213 PolarHBondContact O-N 3.25Å; A1211-Q1213 VanDerWaalsContact C-N 3.28Å; A1211-Q1213 PolarHBondContact O-N 3.29Å; Q1213-T1217 WeakPolarHBondContact CA-OG1 3.49Å; Q1213-I1218 HydrophobicContact CB-CD1 4.07Å; Q1213-I1218 HydrophobicContact CB-CG1 4.38Å; Q1213-I1218 WeakPolarHBondContact O-CB 3.39Å; Q1213-I1218 WeakPolarHBondContact O-CG1 3.31Å; Q1213-I1218 PolarHBondContact O-N 3.28Å; Q1213-V1232 HydrophobicContact CG-CG1 3.72Å; Q1213-S1233 PolarHBondContact NE2-O 3.23Å
1214	K	91.5	Very high	91.5	Very high	66 Å²	66	25.9 Å²	25.9	29%	0.287	13%	0.125	S	C	.	.	I	π-helix	trans	-69.3	-34.7	-175.7	-66.2	164.1	-164.5	144.9	0	113	P1013 A1014 S1210 A1211 P1219	P1013-K1214 CarbonylContact C-O 3.59Å; P1013-K1214 WeakPolarHBondContact CA-O 3.4Å; P1013-K1214 WeakPolarHBondContact CB-O 3.5Å; A1014-K1214 PolarHBondContact N-O 3.34Å; A1014-K1214 WeakPolarHBondContact O-CB 3.15Å; A1014-K1214 WeakPolarHBondContact O-CG 3.39Å; S1210-K1214 WeakPolarHBondContact O-CD 3.45Å; S1210-K1214 WeakPolarHBondContact O-CE 3.43Å; S1210-K1214 VanDerWaalsContact O-CG 3.25Å; S1210-K1214 WeakPolarHBondContact O-CG 3.42Å; S1210-K1214 PolarHBondContact O-NZ 3.42Å; S1210-K1214 PolarHBondContact OG-NZ 3.44Å; A1211-K1214 PolarHBondContact O-N 3.25Å; A1211-K1214 VanDerWaalsContact O-N 3.15Å; K1214-P1219 WeakPolarHBondContact O-CD 3.12Å; K1214-P1219 VanDerWaalsContact O-CG 3.28Å; K1214-P1219 WeakPolarHBondContact O-CG 3.37Å
1215	I	91.6	Very high	91.2	Very high	5 Å²	5	26.5 Å²	26.5	3%	0.026	13%	0.129	C	C	.	.	I	π-helix	trans	-99.1	-30.3	-169.7	-60.9	178.5	0	0	0	112.1	P1013 F1041 F1055 Q1056 V1059 F1063 A1211	P1013-I1215 HydrophobicContact CB-CG1 4.4Å; F1041-I1215 HydrophobicContact CD1-CD1 4.16Å; F1041-I1215 HydrophobicContact CE1-CD1 3.9Å; F1041-I1215 HydrophobicContact CE1-CG1 4.05Å; F1055-I1215 HydrophobicContact CE1-CD1 4.48Å; Q1056-I1215 HydrophobicContact CG-CD1 3.74Å; V1059-I1215 HydrophobicContact CG1-CG2 4.04Å; F1063-I1215 HydrophobicContact CE2-CG2 4.1Å; F1063-I1215 HydrophobicContact CZ-CG2 3.91Å; A1211-I1215 WeakPolarHBondContact O-CB 3.49Å; A1211-I1215 WeakPolarHBondContact O-CG1 3.43Å; A1211-I1215 PolarHBondContact O-N 2.87Å
1216	I	93.9	Very high	90.9	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.	I	π-helix	trans	-120.5	-67	-170.6	-47.1	175.8	0	0	0	110.6	F1055 Y1073 V1076 A1080 I1212 P1219 A1220 P1228 V1229	F1055-I1216 HydrophobicContact CE2-CD1 4.16Å; F1055-I1216 HydrophobicContact CZ-CD1 3.8Å; Y1073-I1216 HydrophobicContact CD1-CG2 4.06Å; V1076-I1216 HydrophobicContact CG1-CB 4.46Å; V1076-I1216 HydrophobicContact CG1-CD1 3.53Å; V1076-I1216 HydrophobicContact CG1-CG1 3.61Å; V1076-I1216 HydrophobicContact CG1-CG2 4.08Å; A1080-I1216 HydrophobicContact CB-CD1 3.68Å; I1212-I1216 HydrophobicContact CG1-CD1 4.35Å; I1212-I1216 HydrophobicContact CG2-CB 4.42Å; I1212-I1216 HydrophobicContact CG2-CD1 4.22Å; I1212-I1216 WeakPolarHBondContact O-CA 3.32Å; I1212-I1216 VanDerWaalsContact O-CB 3.3Å; I1212-I1216 WeakPolarHBondContact O-CB 3.13Å; I1212-I1216 PolarHBondContact O-N 3.48Å; I1216-P1219 WeakPolarHBondContact O-CD 3.45Å; I1216-A1220 WeakPolarHBondContact O-CB 3.47Å; I1216-A1220 PolarHBondContact O-N 2.82Å; I1216-P1228 HydrophobicContact CG2-CG 3.73Å; I1216-V1229 HydrophobicContact CG2-CG2 4.35Å
1217	T	93.4	Very high	91.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.14	C	C	.	.	I	π-helix	trans	-77	-37.9	-162	78.1	0	0	0	0	113.6	I1212 Q1213 A1221 N1227 V1229 V1232 H1234	I1212-T1217 HydrophobicContact CG2-CG2 3.79Å; I1212-T1217 PolarHBondContact O-N 2.85Å; Q1213-T1217 WeakPolarHBondContact CA-OG1 3.49Å; T1217-A1221 WeakPolarHBondContact O-CB 3Å; T1217-A1221 PolarHBondContact O-N 2.84Å; T1217-A1221 VanDerWaalsContact O-N 3.11Å; T1217-N1227 VanDerWaalsContact CB-OD1 3.31Å; T1217-N1227 WeakPolarHBondContact CB-OD1 3.29Å; T1217-N1227 WeakPolarHBondContact CG2-OD1 3.32Å; T1217-V1229 HydrophobicContact CG2-CB 4.26Å; T1217-V1232 HydrophobicContact CG2-CG1 4.45Å; T1217-H1234 PolarHBondContact O-CE1 3.26Å
1218	I	93	Very high	91.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-69.8	-47.8	175.3	-59	168.6	0	0	0	110.1	A1014 Q1213 A1220 A1221 L1222 P1235 W1237 L1238	A1014-I1218 HydrophobicContact CB-CB 3.92Å; A1014-I1218 HydrophobicContact CB-CG2 3.37Å; Q1213-I1218 HydrophobicContact CB-CD1 4.07Å; Q1213-I1218 HydrophobicContact CB-CG1 4.38Å; Q1213-I1218 WeakPolarHBondContact O-CB 3.39Å; Q1213-I1218 WeakPolarHBondContact O-CG1 3.31Å; Q1213-I1218 PolarHBondContact O-N 3.28Å; I1218-A1220 PolarHBondContact O-N 2.85Å; I1218-A1221 PolarHBondContact O-N 3.49Å; I1218-L1222 HydrophobicContact CG2-CD1 3.91Å; I1218-L1222 HydrophobicContact CG2-CG 4.31Å; I1218-L1222 WeakPolarHBondContact O-CB 3.45Å; I1218-L1222 VanDerWaalsContact O-CG 3.28Å; I1218-L1222 WeakPolarHBondContact O-CG 3.27Å; I1218-L1222 PolarHBondContact O-N 3.29Å; I1218-P1235 HydrophobicContact CD1-CG 3.86Å; I1218-P1235 HydrophobicContact CG1-CG 4.3Å; I1218-W1237 HydrophobicContact CG2-CH2 4.33Å; I1218-W1237 HydrophobicContact CG2-CZ2 4.41Å; I1218-L1238 HydrophobicContact CB-CD2 4.11Å; I1218-L1238 HydrophobicContact CG1-CD2 3.83Å; I1218-L1238 HydrophobicContact CG2-CD2 4.08Å
1219	P	92.7	Very high	91.2	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-53.8	-47.3	171.3	-31.4	39.7	0	0	0	114.3	A1014 Y1073 K1214 I1216 A1221 L1222 Q1223	A1014-P1219 HydrophobicContact CB-CG 4.2Å; Y1073-P1219 HydrophobicContact CE1-CB 4.43Å; Y1073-P1219 VanDerWaalsContact OH-C 3.32Å; Y1073-P1219 WeakPolarHBondContact OH-CB 3.38Å; K1214-P1219 WeakPolarHBondContact O-CD 3.12Å; K1214-P1219 VanDerWaalsContact O-CG 3.28Å; K1214-P1219 WeakPolarHBondContact O-CG 3.37Å; I1216-P1219 WeakPolarHBondContact O-CD 3.45Å; P1219-A1221 PolarHBondContact O-N 3.45Å; P1219-L1222 PolarHBondContact O-N 2.86Å; P1219-Q1223 PolarHBondContact O-N 3.31Å
1220	A	92.3	Very high	90.9	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-57	-51.6	177.3	0	0	0	0	0	111.9	Y1073 I1216 I1218 L1222 Q1223 Q1224 V1225 P1228	Y1073-A1220 HydrophobicContact CD1-CB 3.91Å; Y1073-A1220 HydrophobicContact CD2-CB 4.05Å; Y1073-A1220 HydrophobicContact CE1-CB 3.82Å; Y1073-A1220 HydrophobicContact CE2-CB 3.98Å; Y1073-A1220 HydrophobicContact CG-CB 4.03Å; Y1073-A1220 PolarHBondContact OH-N 2.92Å; I1216-A1220 WeakPolarHBondContact O-CB 3.47Å; I1216-A1220 PolarHBondContact O-N 2.82Å; I1218-A1220 PolarHBondContact O-N 2.85Å; A1220-L1222 VanDerWaalsContact C-N 3.35Å; A1220-L1222 PolarHBondContact O-N 3.48Å; A1220-Q1223 CarbonylContact O-C 3.57Å; A1220-Q1223 WeakPolarHBondContact O-CA 3.44Å; A1220-Q1223 PolarHBondContact O-N 2.96Å; A1220-Q1223 VanDerWaalsContact O-N 3.12Å; A1220-Q1224 PolarHBondContact O-N 3.46Å; A1220-V1225 CarbonylContact C-O 3.4Å; A1220-V1225 HydrophobicContact CB-CB 4.12Å; A1220-V1225 HydrophobicContact CB-CG1 4.43Å; A1220-V1225 PolarHBondContact O-N 3.01Å; A1220-P1228 HydrophobicContact CB-CG 4Å
1221	A	90	Very high	90.9	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-62.3	-37.5	178.6	0	0	0	0	0	113.5	T1217 I1218 P1219 Q1223 Q1224 L1238 L1242	T1217-A1221 WeakPolarHBondContact O-CB 3Å; T1217-A1221 PolarHBondContact O-N 2.84Å; T1217-A1221 VanDerWaalsContact O-N 3.11Å; I1218-A1221 PolarHBondContact O-N 3.49Å; P1219-A1221 PolarHBondContact O-N 3.45Å; A1221-Q1223 VanDerWaalsContact C-N 3.34Å; A1221-Q1224 PolarHBondContact O-N 2.86Å; A1221-Q1224 VanDerWaalsContact O-N 3.14Å; A1221-Q1224 PolarHBondContact O-NE2 3.12Å; A1221-L1238 HydrophobicContact CB-CD1 4.16Å; A1221-L1238 HydrophobicContact CB-CD2 3.81Å; A1221-L1238 HydrophobicContact CB-CG 4.29Å; A1221-L1242 HydrophobicContact CB-CD1 4.09Å; A1221-L1242 HydrophobicContact CB-CD2 4.34Å
1222	L	87.8	Confident	90.9	Very high	62 Å²	62	32.4 Å²	32.4	33%	0.325	17%	0.173	S	C	.	.	H	α-helix	trans	-64.4	-41	174	-71.2	172.6	0	0	0	110.9	A598 A1014 I1218 P1219 A1220 Q1224 L1238	A598-L1222 HydrophobicContact CB-CD1 4.1Å; A1014-L1222 HydrophobicContact CB-CD1 4.26Å; I1218-L1222 HydrophobicContact CG2-CD1 3.91Å; I1218-L1222 HydrophobicContact CG2-CG 4.31Å; I1218-L1222 WeakPolarHBondContact O-CB 3.45Å; I1218-L1222 VanDerWaalsContact O-CG 3.28Å; I1218-L1222 WeakPolarHBondContact O-CG 3.27Å; I1218-L1222 PolarHBondContact O-N 3.29Å; P1219-L1222 PolarHBondContact O-N 2.86Å; A1220-L1222 VanDerWaalsContact C-N 3.35Å; A1220-L1222 PolarHBondContact O-N 3.48Å; L1222-Q1224 PolarHBondContact O-N 3.48Å; L1222-Q1224 PolarHBondContact O-NE2 3.07Å; L1222-L1238 HydrophobicContact CD2-CD1 4.46Å
1223	Q	89.9	Confident	90.6	Very high	41 Å²	41	36.3 Å²	36.3	19%	0.192	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	6.6	172.4	-66.7	-172.1	-54.2	0	0	114.7	V600 Y1073 P1219 A1220 A1221 V1225	V600-Q1223 PolarHBondContact O-NE2 3.32Å; Y1073-Q1223 PolarHBondContact OH-OE1 3.36Å; P1219-Q1223 PolarHBondContact O-N 3.31Å; A1220-Q1223 CarbonylContact O-C 3.57Å; A1220-Q1223 WeakPolarHBondContact O-CA 3.44Å; A1220-Q1223 PolarHBondContact O-N 2.96Å; A1220-Q1223 VanDerWaalsContact O-N 3.12Å; A1221-Q1223 VanDerWaalsContact C-N 3.34Å; Q1223-V1225 VanDerWaalsContact C-N 3.3Å; Q1223-V1225 PolarHBondContact O-N 3.38Å
1224	Q	85.8	Confident	90.4	Very high	111 Å²	111	36.3 Å²	36.3	52%	0.519	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	21.2	178.4	-45.3	-56.3	-86.8	0	0	115.1	A1220 A1221 L1222	A1220-Q1224 PolarHBondContact O-N 3.46Å; A1221-Q1224 PolarHBondContact O-N 2.86Å; A1221-Q1224 VanDerWaalsContact O-N 3.14Å; A1221-Q1224 PolarHBondContact O-NE2 3.12Å; L1222-Q1224 PolarHBondContact O-N 3.48Å; L1222-Q1224 PolarHBondContact O-NE2 3.07Å
1225	V	87.7	Confident	90.2	Very high	17 Å²	17	34 Å²	34	10%	0.103	19%	0.192	C	C	.	.			trans	-86.1	132	167.2	179.9	0	0	0	0	108.7	L1069 V1070 Y1073 A1220 Q1223	L1069-V1225 HydrophobicContact CB-CG2 4.22Å; V1070-V1225 HydrophobicContact CG2-CG1 4.45Å; Y1073-V1225 HydrophobicContact CD2-CB 4.22Å; Y1073-V1225 HydrophobicContact CD2-CG1 4.16Å; Y1073-V1225 HydrophobicContact CD2-CG2 4.04Å; Y1073-V1225 HydrophobicContact CE2-CG2 4.3Å; A1220-V1225 CarbonylContact C-O 3.4Å; A1220-V1225 HydrophobicContact CB-CB 4.12Å; A1220-V1225 HydrophobicContact CB-CG1 4.43Å; A1220-V1225 PolarHBondContact O-N 3.01Å; Q1223-V1225 VanDerWaalsContact C-N 3.3Å; Q1223-V1225 PolarHBondContact O-N 3.38Å
1226	S	85.7	Confident	89.9	Confident	99 Å²	99	39.8 Å²	39.8	69%	0.692	22%	0.223	S	C	*	.			trans	-59.6	146.7	174.6	50.7	0	0	0	0	111.3	P1228	S1226-P1228 VanDerWaalsContact O-CD 3.27Å; S1226-P1228 WeakPolarHBondContact O-CD 3.4Å
1227	N	92.7	Very high	89.7	Confident	37 Å²	37	41.8 Å²	41.8	20%	0.198	23%	0.23	C	C	.	.			trans	-47	109	-173.6	-171.2	14.3	0	0	0	112.8	T1217 V1229 V1232	T1217-N1227 VanDerWaalsContact CB-OD1 3.31Å; T1217-N1227 WeakPolarHBondContact CB-OD1 3.29Å; T1217-N1227 WeakPolarHBondContact CG2-OD1 3.32Å; N1227-V1229 VanDerWaalsContact C-N 3.3Å; N1227-V1229 PolarHBondContact ND2-O 2.92Å; N1227-V1229 PolarHBondContact O-N 3.01Å; N1227-V1229 PolarHBondContact OD1-N 3.02Å; N1227-V1232 PolarHBondContact ND2-O 3.39Å
1228	P	91.1	Very high	89.3	Confident	22 Å²	22	41.9 Å²	41.9	14%	0.143	23%	0.231	C	C	.	.	S	Bend	trans	-80.5	-13.8	-171.3	34.4	-38.6	0	0	0	112.6	Y1073 A1077 I1216 A1220 S1226	Y1073-P1228 HydrophobicContact CD1-CG 4.43Å; Y1073-P1228 HydrophobicContact CG-CG 4.49Å; A1077-P1228 HydrophobicContact CB-CB 4.12Å; A1077-P1228 WeakPolarHBondContact CB-O 3.15Å; I1216-P1228 HydrophobicContact CG2-CG 3.73Å; A1220-P1228 HydrophobicContact CB-CG 4Å; S1226-P1228 VanDerWaalsContact O-CD 3.27Å; S1226-P1228 WeakPolarHBondContact O-CD 3.4Å
1229	V	94.3	Very high	88.8	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.251	C	S	.	.	S	Bend	trans	-120.9	81	172.5	-174.3	0	0	0	0	108.3	A1077 A1080 L1084 I1212 I1216 T1217 N1227 R1231 V1232	A1077-V1229 HydrophobicContact CB-CG2 3.59Å; A1080-V1229 HydrophobicContact CB-CG2 3.85Å; L1084-V1229 HydrophobicContact CD1-CG1 3.77Å; I1212-V1229 HydrophobicContact CG2-CB 4.27Å; I1212-V1229 HydrophobicContact CG2-CG1 4.34Å; I1212-V1229 HydrophobicContact CG2-CG2 4.26Å; I1216-V1229 HydrophobicContact CG2-CG2 4.35Å; T1217-V1229 HydrophobicContact CG2-CB 4.26Å; N1227-V1229 VanDerWaalsContact C-N 3.3Å; N1227-V1229 PolarHBondContact ND2-O 2.92Å; N1227-V1229 PolarHBondContact O-N 3.01Å; N1227-V1229 PolarHBondContact OD1-N 3.02Å; V1229-R1231 PolarHBondContact O-N 3.2Å; V1229-V1232 HydrophobicContact CG1-CB 4.28Å; V1229-V1232 HydrophobicContact CG1-CG2 4.01Å; V1229-V1232 PolarHBondContact O-N 2.94Å
1230	P	88.2	Confident	88.2	Confident	104 Å²	104	52.9 Å²	52.9	68%	0.675	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.4	-172.4	-26.9	36.3	0	0	0	115	V1232	P1230-V1232 PolarHBondContact O-N 2.83Å
1231	R	89.4	Confident	87.5	Confident	94 Å²	94	56.7 Å²	56.7	36%	0.355	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-21.3	175	-61.1	159.1	83.5	170.6	10.6	113.2	D1081 L1084 D1085 V1229	D1081-R1231 PolarHBondContact O-NH1 2.94Å; D1081-R1231 WeakPolarHBondContact OD1-CD 3.33Å; D1081-R1231 IonicContact OD1-CZ 3.6Å; D1081-R1231 IonicContact OD1-NE 3.58Å; D1081-R1231 IonicContact OD1-NH1 2.86Å; D1081-R1231 PolarHBondContact OD1-NH1 2.94Å; L1084-R1231 HydrophobicContact CD1-CB 4.35Å; D1085-R1231 IonicContact OD1-CZ 3.46Å; D1085-R1231 IonicContact OD1-NH1 2.74Å; D1085-R1231 PolarHBondContact OD1-NH1 3.26Å; D1085-R1231 IonicContact OD1-NH2 3.04Å; D1085-R1231 PolarHBondContact OD1-NH2 3Å; D1085-R1231 IonicContact OD2-NH1 3.92Å; V1229-R1231 PolarHBondContact O-N 3.2Å
1232	V	91.5	Very high	87	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.024	30%	0.303	C	S	.	.	S	Bend	trans	-111	105.3	177.8	178.4	0	0	0	0	108.3	L1084 I1212 Q1213 T1217 N1227 V1229 P1230	L1084-V1232 HydrophobicContact CD1-CG2 3.96Å; I1212-V1232 HydrophobicContact CB-CG1 4.45Å; I1212-V1232 HydrophobicContact CB-CG2 4.42Å; I1212-V1232 HydrophobicContact CD1-CG2 4.2Å; I1212-V1232 HydrophobicContact CG2-CB 4.01Å; I1212-V1232 HydrophobicContact CG2-CG1 3.98Å; I1212-V1232 HydrophobicContact CG2-CG2 3.92Å; Q1213-V1232 HydrophobicContact CG-CG1 3.72Å; T1217-V1232 HydrophobicContact CG2-CG1 4.45Å; N1227-V1232 PolarHBondContact ND2-O 3.39Å; V1229-V1232 HydrophobicContact CG1-CB 4.28Å; V1229-V1232 HydrophobicContact CG1-CG2 4.01Å; V1229-V1232 PolarHBondContact O-N 2.94Å; P1230-V1232 PolarHBondContact O-N 2.83Å
1233	S	87.5	Confident	86.3	Confident	82 Å²	82	58.3 Å²	58.3	57%	0.573	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-65.7	152.7	179.3	54.9	0	0	0	0	112.4	Q1213	Q1213-S1233 PolarHBondContact NE2-O 3.23Å
1234	H	89.1	Confident	85.5	Confident	17 Å²	17	61.3 Å²	61.3	8%	0.079	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-71.2	149.5	167.3	-66.6	-27.1	0	0	0	111	T1217 L1238 L1239	T1217-H1234 PolarHBondContact O-CE1 3.26Å; H1234-L1238 HydrophobicContact CB-CB 4.48Å; H1234-L1238 HydrophobicContact CB-CD2 3.91Å; H1234-L1238 HydrophobicContact CB-CG 4.29Å; H1234-L1239 HydrophobicContact CB-CD2 3.85Å; H1234-L1239 HydrophobicContact CB-CG 3.93Å
1235	P	87.6	Confident	84.6	Confident	16 Å²	16	60.8 Å²	60.8	10%	0.104	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-60.5	150.8	169.7	-22.5	33.7	0	0	0	113	K1016 I1218 W1237 L1238 L1239	K1016-P1235 HydrophobicContact CG-CG 4.45Å; I1218-P1235 HydrophobicContact CD1-CG 3.86Å; I1218-P1235 HydrophobicContact CG1-CG 4.3Å; P1235-W1237 VanDerWaalsContact C-N 3.29Å; P1235-W1237 PolarHBondContact O-N 2.85Å; P1235-L1238 WeakPolarHBondContact O-CA 3.19Å; P1235-L1238 WeakPolarHBondContact O-CB 3.37Å; P1235-L1238 PolarHBondContact O-N 2.96Å; P1235-L1239 PolarHBondContact O-N 2.91Å
1236	D	84.4	Confident	83.4	Confident	127 Å²	127	67.5 Å²	67.5	68%	0.679	35%	0.354	S	S	*	.	H	α-helix	trans	-58.8	-36.2	-174.4	-53	-43.4	0	0	0	113.9	L1238 L1239 R1240	D1236-L1238 VanDerWaalsContact C-N 3.29Å; D1236-L1238 PolarHBondContact O-N 3.07Å; D1236-L1239 PolarHBondContact O-N 3.13Å; D1236-R1240 WeakPolarHBondContact O-CB 3.37Å; D1236-R1240 PolarHBondContact O-N 3.48Å
1237	W	89.1	Confident	82.1	Confident	42 Å²	42	66.8 Å²	66.8	16%	0.159	34%	0.343	C	S	.	.	H	α-helix	trans	-64	-36.5	175.6	71.9	-100.4	0	0	0	111.7	K1016 E1018 I1218 P1235 K1241	K1016-W1237 PolarHBondContact O-NE1 2.94Å; E1018-W1237 HydrophobicContact CB-CB 4.31Å; E1018-W1237 HydrophobicContact CB-CD2 3.81Å; E1018-W1237 HydrophobicContact CB-CE3 4.08Å; E1018-W1237 HydrophobicContact CB-CG 3.91Å; E1018-W1237 HydrophobicContact CG-CD2 4.28Å; E1018-W1237 HydrophobicContact CG-CE3 4.04Å; I1218-W1237 HydrophobicContact CG2-CH2 4.33Å; I1218-W1237 HydrophobicContact CG2-CZ2 4.41Å; P1235-W1237 VanDerWaalsContact C-N 3.29Å; P1235-W1237 PolarHBondContact O-N 2.85Å; W1237-K1241 HydrophobicContact CE3-CD 4.14Å; W1237-K1241 HydrophobicContact CZ3-CD 3.94Å; W1237-K1241 WeakPolarHBondContact O-CB 3.49Å; W1237-K1241 PolarHBondContact O-N 3.32Å
1238	L	84.6	Confident	80.4	Confident	3 Å²	3	71.5 Å²	71.5	2%	0.016	37%	0.373	C	S	.	.	H	α-helix	trans	-74.3	-40	177.5	177.5	62.8	0	0	0	110.6	I1218 A1221 L1222 H1234 P1235 D1236 R1240 K1241 L1242	I1218-L1238 HydrophobicContact CB-CD2 4.11Å; I1218-L1238 HydrophobicContact CG1-CD2 3.83Å; I1218-L1238 HydrophobicContact CG2-CD2 4.08Å; A1221-L1238 HydrophobicContact CB-CD1 4.16Å; A1221-L1238 HydrophobicContact CB-CD2 3.81Å; A1221-L1238 HydrophobicContact CB-CG 4.29Å; L1222-L1238 HydrophobicContact CD2-CD1 4.46Å; H1234-L1238 HydrophobicContact CB-CB 4.48Å; H1234-L1238 HydrophobicContact CB-CD2 3.91Å; H1234-L1238 HydrophobicContact CB-CG 4.29Å; P1235-L1238 WeakPolarHBondContact O-CA 3.19Å; P1235-L1238 WeakPolarHBondContact O-CB 3.37Å; P1235-L1238 PolarHBondContact O-N 2.96Å; D1236-L1238 VanDerWaalsContact C-N 3.29Å; D1236-L1238 PolarHBondContact O-N 3.07Å; L1238-R1240 VanDerWaalsContact C-N 3.34Å; L1238-R1240 PolarHBondContact O-N 2.92Å; L1238-K1241 PolarHBondContact O-N 2.93Å; L1238-L1242 HydrophobicContact CD1-CD1 4.32Å; L1238-L1242 HydrophobicContact CD1-CG 4.14Å; L1238-L1242 HydrophobicContact CG-CD1 4.05Å; L1238-L1242 HydrophobicContact CG-CG 4.35Å; L1238-L1242 WeakPolarHBondContact O-CB 3.28Å; L1238-L1242 WeakPolarHBondContact O-CG 3.47Å; L1238-L1242 PolarHBondContact O-N 3.17Å
1239	L	83.3	Confident	78.1	Confident	82 Å²	82	75.4 Å²	75.4	43%	0.429	40%	0.399	S	S	.	.	H	α-helix	trans	-59.4	-45	172.2	-69.4	174.4	0	0	0	111.4	H1234 P1235 D1236 L1242 A1243	H1234-L1239 HydrophobicContact CB-CD2 3.85Å; H1234-L1239 HydrophobicContact CB-CG 3.93Å; P1235-L1239 PolarHBondContact O-N 2.91Å; D1236-L1239 PolarHBondContact O-N 3.13Å; L1239-L1242 PolarHBondContact O-N 3.22Å; L1239-A1243 WeakPolarHBondContact O-CB 3.49Å; L1239-A1243 PolarHBondContact O-N 3.24Å
1240	R	80.7	Confident	75.7	Confident	149 Å²	149	81.5 Å²	81.5	56%	0.562	43%	0.426	S	S	*	.	H	α-helix	trans	-58.8	-48.8	173.4	-167.6	-168.2	-59.8	142.9	2.4	111.4	D1236 L1238 L1242 A1243 E1244	D1236-R1240 WeakPolarHBondContact O-CB 3.37Å; D1236-R1240 PolarHBondContact O-N 3.48Å; L1238-R1240 VanDerWaalsContact C-N 3.34Å; L1238-R1240 PolarHBondContact O-N 2.92Å; R1240-L1242 VanDerWaalsContact C-N 3.32Å; R1240-L1242 PolarHBondContact O-N 2.87Å; R1240-A1243 PolarHBondContact O-N 3.4Å; R1240-E1244 WeakPolarHBondContact CG-OE1 3.3Å; R1240-E1244 WeakPolarHBondContact O-CB 3.46Å; R1240-E1244 VanDerWaalsContact O-CG 3.32Å; R1240-E1244 WeakPolarHBondContact O-CG 3.48Å; R1240-E1244 PolarHBondContact O-N 3.29Å
1241	K	77.8	Confident	73.3	Confident	81 Å²	81	85.5 Å²	85.5	35%	0.352	44%	0.436	S	S	.	.	H	α-helix	trans	-69	-25.9	-178.9	-161.8	170.8	-149.7	147	0	114.1	E1018 W1237 L1238 K1245	E1018-K1241 IonicContact OE1-NZ 2.86Å; E1018-K1241 PolarHBondContact OE1-NZ 2.86Å; W1237-K1241 HydrophobicContact CE3-CD 4.14Å; W1237-K1241 HydrophobicContact CZ3-CD 3.94Å; W1237-K1241 WeakPolarHBondContact O-CB 3.49Å; W1237-K1241 PolarHBondContact O-N 3.32Å; L1238-K1241 PolarHBondContact O-N 2.93Å; K1241-K1245 WeakPolarHBondContact O-CB 3.41Å; K1241-K1245 WeakPolarHBondContact O-CG 3.4Å; K1241-K1245 PolarHBondContact O-N 3.01Å
1242	L	77.8	Confident	71.1	Confident	34 Å²	34	90.9 Å²	90.9	18%	0.178	46%	0.456	C	S	.	.	H	α-helix	trans	-75.5	-45.3	169.7	-74.2	169.5	0	0	0	110.8	A1221 L1238 L1239 R1240 K1245 M1246	A1221-L1242 HydrophobicContact CB-CD1 4.09Å; A1221-L1242 HydrophobicContact CB-CD2 4.34Å; L1238-L1242 HydrophobicContact CD1-CD1 4.32Å; L1238-L1242 HydrophobicContact CD1-CG 4.14Å; L1238-L1242 HydrophobicContact CG-CD1 4.05Å; L1238-L1242 HydrophobicContact CG-CG 4.35Å; L1238-L1242 WeakPolarHBondContact O-CB 3.28Å; L1238-L1242 WeakPolarHBondContact O-CG 3.47Å; L1238-L1242 PolarHBondContact O-N 3.17Å; L1239-L1242 PolarHBondContact O-N 3.22Å; R1240-L1242 VanDerWaalsContact C-N 3.32Å; R1240-L1242 PolarHBondContact O-N 2.87Å; L1242-K1245 CarbonylContact O-C 3.31Å; L1242-K1245 WeakPolarHBondContact O-CA 3.29Å; L1242-K1245 WeakPolarHBondContact O-CB 3.07Å; L1242-K1245 PolarHBondContact O-N 2.82Å; L1242-M1246 WeakPolarHBondContact O-CG 3.12Å; L1242-M1246 PolarHBondContact O-N 2.84Å
1243	A	74.4	Confident	68.8	Low	62 Å²	62	97.7 Å²	97.7	51%	0.512	49%	0.485	S	S	.	.	H	α-helix	trans	-59.3	-47.8	173.4	0	0	0	0	0	111	L1239 R1240 K1245 M1246 D1247	L1239-A1243 WeakPolarHBondContact O-CB 3.49Å; L1239-A1243 PolarHBondContact O-N 3.24Å; R1240-A1243 PolarHBondContact O-N 3.4Å; A1243-K1245 PolarHBondContact O-N 2.73Å; A1243-K1245 VanDerWaalsContact O-N 3.16Å; A1243-M1246 PolarHBondContact O-N 2.93Å; A1243-M1246 VanDerWaalsContact O-N 3.16Å; A1243-D1247 WeakPolarHBondContact O-CB 3.15Å; A1243-D1247 PolarHBondContact O-N 3.29Å
1244	E	71.7	Confident	66.8	Low	104 Å²	104	99.8 Å²	99.8	49%	0.486	49%	0.489	S	S	.	.	H	α-helix	trans	-57.4	-25.3	170.4	-75.1	171.4	-153.5	0	0	113.2	R1240 K1250	R1240-E1244 WeakPolarHBondContact CG-OE1 3.3Å; R1240-E1244 WeakPolarHBondContact O-CB 3.46Å; R1240-E1244 VanDerWaalsContact O-CG 3.32Å; R1240-E1244 WeakPolarHBondContact O-CG 3.48Å; R1240-E1244 PolarHBondContact O-N 3.29Å; E1244-K1250 WeakPolarHBondContact O-CE 3.18Å; E1244-K1250 PolarHBondContact O-NZ 3.48Å
1245	K	67.2	Low	64.9	Low	100 Å²	100	104.3 Å²	104.3	44%	0.435	52%	0.518	S	S	.	.	H	α-helix	trans	-85.2	-36.4	175.3	-92.8	-178	167.2	-175.1	0	113	K1241 L1242 A1243	K1241-K1245 WeakPolarHBondContact O-CB 3.41Å; K1241-K1245 WeakPolarHBondContact O-CG 3.4Å; K1241-K1245 PolarHBondContact O-N 3.01Å; L1242-K1245 CarbonylContact O-C 3.31Å; L1242-K1245 WeakPolarHBondContact O-CA 3.29Å; L1242-K1245 WeakPolarHBondContact O-CB 3.07Å; L1242-K1245 PolarHBondContact O-N 2.82Å; A1243-K1245 PolarHBondContact O-N 2.73Å; A1243-K1245 VanDerWaalsContact O-N 3.16Å
1246	M	62.3	Low	63.1	Low	158 Å²	158	109.7 Å²	109.7	78%	0.778	54%	0.542	S	S	*	.	H	α-helix	trans	-84.3	-18.4	-179.5	-65.3	-163.7	76.1	0	0	113.2	L1242 A1243 T1248	L1242-M1246 WeakPolarHBondContact O-CG 3.12Å; L1242-M1246 PolarHBondContact O-N 2.84Å; A1243-M1246 PolarHBondContact O-N 2.93Å; A1243-M1246 VanDerWaalsContact O-N 3.16Å; M1246-T1248 PolarHBondContact O-N 3.35Å; M1246-T1248 VanDerWaalsContact O-N 3.15Å
1247	D	60.3	Low	61.6	Low	85 Å²	85	108.1 Å²	108.1	46%	0.455	54%	0.537	S	S	.	.			trans	-58.7	115.7	169	-178.2	7	0	0	0	110.5	A1243 C1249	A1243-D1247 WeakPolarHBondContact O-CB 3.15Å; A1243-D1247 PolarHBondContact O-N 3.29Å; D1247-C1249 VanDerWaalsContact C-N 3.28Å; D1247-C1249 PolarHBondContact O-N 3.34Å; D1247-C1249 WeakPolarHBondContact OD1-CB 3.44Å; D1247-C1249 PolarHBondContact OD1-N 3.4Å
1248	T	55.2	Low	59	Low	136 Å²	136	112.5 Å²	112.5	83%	0.834	56%	0.557	S	S	*	*	S	Bend	trans	-73.9	-15.7	179.1	47.8	0	0	0	0	113.4	M1246 K1250	M1246-T1248 PolarHBondContact O-N 3.35Å; M1246-T1248 VanDerWaalsContact O-N 3.15Å; T1248-K1250 PolarHBondContact O-N 2.78Å
1249	C	44.5	Very low	56.5	Low	104 Å²	104	118.6 Å²	118.6	70%	0.703	59%	0.594	S	S	*	*			trans	-95.1	33	-168.1	-67.6	0	0	0	0	114	D1247 Q1251	D1247-C1249 VanDerWaalsContact C-N 3.28Å; D1247-C1249 PolarHBondContact O-N 3.34Å; D1247-C1249 WeakPolarHBondContact OD1-CB 3.44Å; D1247-C1249 PolarHBondContact OD1-N 3.4Å; C1249-Q1251 PolarHBondContact O-N 3.23Å; C1249-Q1251 VanDerWaalsContact O-N 3.09Å
1250	K	43	Very low	54.1	Low	127 Å²	127	121.8 Å²	121.8	55%	0.552	61%	0.611	S	S	*	*			trans	-63.2	110.3	-174.4	-65.7	-163.2	177.9	-148.1	0	114.7	E1244 T1248 R1252	E1244-K1250 WeakPolarHBondContact O-CE 3.18Å; E1244-K1250 PolarHBondContact O-NZ 3.48Å; T1248-K1250 PolarHBondContact O-N 2.78Å; K1250-R1252 PolarHBondContact O-N 3.01Å
1251	Q	38.7	Very low	51.7	Low	189 Å²	189	124.2 Å²	124.2	88%	0.883	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-64.1	124.5	156.8	-169	168.8	1.1	0	0	109.4	C1249	C1249-Q1251 PolarHBondContact O-N 3.23Å; C1249-Q1251 VanDerWaalsContact O-N 3.09Å
1252	R	41.4	Very low	49.4	Very low	206 Å²	206	127.5 Å²	127.5	78%	0.777	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-71.5	148.4	178.3	-63.8	-176.2	-175.9	178.9	1.6	110.5	K1250 L1254	K1250-R1252 PolarHBondContact O-N 3.01Å; R1252-L1254 PolarHBondContact O-N 2.84Å
1253	K	44.9	Very low	47.1	Very low	148 Å²	148	132 Å²	132	64%	0.643	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-65.9	134.7	173.8	-74	-174.6	174.4	-174.7	0	109.4	T1255 E1256	K1253-T1255 PolarHBondContact O-N 3Å; K1253-E1256 HydrophobicContact CB-CG 4.1Å; K1253-E1256 WeakPolarHBondContact O-CB 3.29Å; K1253-E1256 PolarHBondContact O-N 3.14Å
1254	L	45.5	Very low	44.9	Very low	126 Å²	126	135.4 Å²	135.4	66%	0.66	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-60.1	-32.1	-175	-163.5	70.5	0	0	0	112.5	R1252 E1256 V1257 F1258	R1252-L1254 PolarHBondContact O-N 2.84Å; L1254-E1256 VanDerWaalsContact C-N 3.28Å; L1254-E1256 PolarHBondContact O-N 3.46Å; L1254-V1257 WeakPolarHBondContact O-CB 3.37Å; L1254-V1257 PolarHBondContact O-N 3.22Å; L1254-V1257 VanDerWaalsContact O-N 3.07Å; L1254-F1258 HydrophobicContact CD1-CE2 4Å; L1254-F1258 HydrophobicContact CD2-CE2 4.28Å; L1254-F1258 HydrophobicContact CG-CD2 4.12Å; L1254-F1258 HydrophobicContact CG-CE2 3.81Å; L1254-F1258 WeakPolarHBondContact O-CD2 3.2Å
1255	T	47.8	Very low	42.8	Very low	112 Å²	112	135.9 Å²	135.9	69%	0.687	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-64.9	-25.4	174	47	0	0	0	0	114.1	K1253 V1257 F1258	K1253-T1255 PolarHBondContact O-N 3Å; T1255-V1257 PolarHBondContact O-N 3.48Å; T1255-F1258 PolarHBondContact O-N 3.5Å
1256	E	49.9	Very low	40.9	Very low	129 Å²	129	139 Å²	139	60%	0.603	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-75.3	-11.4	173.6	-62.3	174.1	170	0	0	112.5	K1253 L1254	K1253-E1256 HydrophobicContact CB-CG 4.1Å; K1253-E1256 WeakPolarHBondContact O-CB 3.29Å; K1253-E1256 PolarHBondContact O-N 3.14Å; L1254-E1256 VanDerWaalsContact C-N 3.28Å; L1254-E1256 PolarHBondContact O-N 3.46Å
1257	V	52.8	Low	38.9	Very low	93 Å²	93	140.3 Å²	140.3	56%	0.564	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-28.4	174	-172.4	0	0	0	0	111.3	L1254 T1255	L1254-V1257 WeakPolarHBondContact O-CB 3.37Å; L1254-V1257 PolarHBondContact O-N 3.22Å; L1254-V1257 VanDerWaalsContact O-N 3.07Å; T1255-V1257 PolarHBondContact O-N 3.48Å
1258	F	35.8	Very low	37.2	Very low	134 Å²	134	143.1 Å²	143.1	59%	0.588	74%	0.739	S	S	*	*			trans	-108.6	51.1	-169.4	-66.7	-62.1	0	0	0	114.4	L1254 T1255 L1260	L1254-F1258 HydrophobicContact CD1-CE2 4Å; L1254-F1258 HydrophobicContact CD2-CE2 4.28Å; L1254-F1258 HydrophobicContact CG-CD2 4.12Å; L1254-F1258 HydrophobicContact CG-CE2 3.81Å; L1254-F1258 WeakPolarHBondContact O-CD2 3.2Å; T1255-F1258 PolarHBondContact O-N 3.5Å; F1258-L1260 VanDerWaalsContact C-N 3.29Å; F1258-L1260 PolarHBondContact O-N 2.78Å
1259	V	31.8	Very low	35.7	Very low	132 Å²	132	144.8 Å²	144.8	80%	0.8	74%	0.738	S	S	*	*			trans	-79.6	82	163.1	-174.9	0	0	0	0	108.9
1260	L	33.1	Very low	34.8	Very low	149 Å²	149	149 Å²	149	78%	0.78	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-66.8	134.8	175.4	-78.9	164.7	0	0	0	110.8	F1258	F1258-L1260 VanDerWaalsContact C-N 3.29Å; F1258-L1260 PolarHBondContact O-N 2.78Å
1261	K	29.8	Very low	33.9	Very low	199 Å²	199	152.1 Å²	152.1	87%	0.865	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-72.1	140.7	171.9	-71.4	-179.3	175.2	179.9	0	109.9
1262	N	28.6	Very low	33.3	Very low	151 Å²	151	149.8 Å²	149.8	81%	0.807	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-48	127	-175	-63.3	-1.9	0	0	0	113
1263	P	30.6	Very low	32.6	Very low	127 Å²	127	146.1 Å²	146.1	83%	0.825	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-74.3	143.9	173.8	31.3	-34	0	0	0	111
1264	V	28.6	Very low	31.8	Very low	134 Å²	134	146.6 Å²	146.6	81%	0.812	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-101.9	134.4	177.5	175.1	0	0	0	0	110.1
1265	T	27	Very low	30.9	Very low	115 Å²	115	148.7 Å²	148.7	71%	0.706	78%	0.784	S	S	*	*			trans	-30.4	135.2	177.5	52	0	0	0	0	117.3
1266	N	26.2	Very low	30.3	Very low	164 Å²	164	148.2 Å²	148.2	88%	0.877	78%	0.783	S	S	*	*				-157.4	161.4	116.7	-108.9	-37	0	0	0	113.4
1267	K	22	Very low	29.2	Very low	186 Å²	186	149.3 Å²	149.3	81%	0.809	79%	0.793	S	S	*	*			trans	-93.7	150	-175.2	-53.4	169.9	-178.4	177.6	0	111.2
1268	L	23.3	Very low	28.1	Very low	144 Å²	144	150.6 Å²	150.6	75%	0.754	80%	0.796	S	S	*	*				170.1	136.4	109.2	-92.5	162	0	0	0	114
1269	Q	25	Very low	27.8	Very low	172 Å²	172	153.8 Å²	153.8	80%	0.804	81%	0.813	S	S	*	*			trans	48.6	105.9	148.7	-75.1	169.7	-35.6	0	0	120
1270	E	24.1	Very low	27.8	Very low	191 Å²	191	153.2 Å²	153.2	89%	0.893	81%	0.81	S	S	*	*			trans	-70.5	124.3	160.9	-61.9	146.1	137.3	0	0	110.5
1271	Q	24.9	Very low	27.5	Very low	193 Å²	193	151.5 Å²	151.5	90%	0.902	80%	0.801	S	S	*	*			trans	-131.5	117.3	151.6	-83.5	-165.5	-30.3	0	0	108.7
1272	T	27.2	Very low	27.4	Very low	140 Å²	140	147.1 Å²	147.1	86%	0.859	79%	0.794	S	S	*	*			trans	-84.6	109.9	-175.3	47.1	0	0	0	0	111
1273	T	25.7	Very low	27.2	Very low	130 Å²	130	145.4 Å²	145.4	80%	0.798	79%	0.794	S	S	*	*			trans	-141.4	133.4	156.5	50.7	0	0	0	0	109.7
1274	D	28.2	Very low	26.8	Very low	157 Å²	157	149.5 Å²	149.5	84%	0.84	79%	0.793	S	S	*	*			trans	-53.2	148.7	-171.6	-44	-73.9	0	0	0	115.5
1275	L	26.4	Very low	26.6	Very low	170 Å²	170	150.7 Å²	150.7	89%	0.89	80%	0.795	S	S	*	*			trans	179.9	156	137.7	-93.4	160.1	0	0	0	108.6
1276	P	35.2	Very low	26.5	Very low	103 Å²	103	151.3 Å²	151.3	67%	0.669	79%	0.794	S	S	*	*				-121.3	176.9	-113.9	41.6	-31.6	0	0	0	115.3
1277	D	26.1	Very low	26.4	Very low	152 Å²	152	150.5 Å²	150.5	81%	0.813	78%	0.784	S	S	*	*			trans	-65	151.1	-178.8	-153.9	-9.4	0	0	0	113.8	E1279	D1277-E1279 PolarHBondContact O-N 2.94Å
1278	L	30.2	Very low	26.8	Very low	120 Å²	120	149.3 Å²	149.3	63%	0.628	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-100.3	32.6	-154.9	-152.3	80.1	0	0	0	115.4	T1280 L1281	L1278-T1280 PolarHBondContact O-N 3.49Å; L1278-L1281 HydrophobicContact CD1-CB 4.22Å; L1278-L1281 WeakPolarHBondContact CD2-O 2.82Å; L1278-L1281 HydrophobicContact CG-CB 4.37Å; L1278-L1281 WeakPolarHBondContact CG-O 3.48Å
1279	E	28.8	Very low	27	Very low	200 Å²	200	149.7 Å²	149.7	94%	0.935	79%	0.787	S	S	*	*	G	3₁₀ helix	trans	-68	-16.9	158.3	-72.5	-140.6	132.7	0	0	111.9	D1277 L1281	D1277-E1279 PolarHBondContact O-N 2.94Å; E1279-L1281 VanDerWaalsContact C-N 3.29Å; E1279-L1281 PolarHBondContact O-N 2.85Å
1280	T	33.6	Very low	27	Very low	120 Å²	120	150.7 Å²	150.7	74%	0.736	79%	0.789	S	S	*	*	G	3₁₀ helix	trans	-82.7	3.5	-178.5	-35.3	0	0	0	0	114	L1278	L1278-T1280 PolarHBondContact O-N 3.49Å
1281	L	27.1	Very low	27	Very low	114 Å²	114	146.6 Å²	146.6	60%	0.597	78%	0.782	S	S	*	*	S	Bend	trans	-161.7	114.1	170.4	-99.6	148.4	0	0	0	109	L1278 E1279	L1278-L1281 HydrophobicContact CD1-CB 4.22Å; L1278-L1281 WeakPolarHBondContact CD2-O 2.82Å; L1278-L1281 HydrophobicContact CG-CB 4.37Å; L1278-L1281 WeakPolarHBondContact CG-O 3.48Å; E1279-L1281 VanDerWaalsContact C-N 3.29Å; E1279-L1281 PolarHBondContact O-N 2.85Å
1282	C	26	Very low	27.3	Very low	106 Å²	106	143.9 Å²	143.9	72%	0.716	78%	0.778	S	S	*	*			cis	-143.5	113.6	39.8	-62.3	0	0	0	0	113.1
1283	S	24.3	Very low	27.3	Very low	116 Å²	116	142.9 Å²	142.9	81%	0.811	77%	0.772	S	S	*	*			trans	-63.7	146.7	139.7	-81.2	0	0	0	0	109.6
1284	R	23.9	Very low	27.5	Very low	212 Å²	212	143 Å²	143	80%	0.8	78%	0.775	S	S	*	*			trans	77.1	97.4	177.7	-48.9	179.6	92.8	130.2	3.1	115.9
1285	N	24.4	Very low	27.7	Very low	160 Å²	160	142.5 Å²	142.5	86%	0.856	77%	0.771	S	S	*	*			trans	-45.7	138.9	132.5	-59.8	-56.7	0	0	0	110.1
1286	D	24.2	Very low	27.8	Very low	128 Å²	128	140.4 Å²	140.4	68%	0.684	77%	0.765	S	S	*	*			trans	-165.1	130.6	143.7	-103.1	-38.5	0	0	0	110.9
1287	E	23.1	Very low	27.3	Very low	146 Å²	146	141.1 Å²	141.1	68%	0.682	77%	0.768	S	S	*	*			trans	66.3	148.7	162.5	-55.6	-158.4	146.6	0	0	119.1
1288	K	31	Very low	27.4	Very low	162 Å²	162	145 Å²	145	70%	0.704	77%	0.771	S	S	*	*			cis	-163.8	119.1	-8.1	-113.8	167.1	-173.1	147.3	0	109.4
1289	V	26.9	Very low	27.1	Very low	151 Å²	151	146.4 Å²	146.4	92%	0.915	77%	0.774	S	S	*	*			trans	-140.5	149.8	164.5	-173.5	0	0	0	0	110.7
1290	K	26	Very low	26.8	Very low	193 Å²	193	144.9 Å²	144.9	84%	0.839	77%	0.765	S	S	*	*			trans	-111.5	151.2	-175.4	-51.8	167.3	-176.9	170.9	0	110.9
1291	S	24.3	Very low	26.5	Very low	106 Å²	106	144.2 Å²	144.2	74%	0.741	76%	0.762	S	S	*	*				159.7	160.3	121.3	54.6	0	0	0	0	115.2
1292	T	29.8	Very low	26.4	Very low	135 Å²	135	145.1 Å²	145.1	83%	0.828	77%	0.772	S	S	*	*			trans	49.6	100.6	160.4	46.4	0	0	0	0	119.8
1293	T	27.7	Very low	26.4	Very low	119 Å²	119	147.9 Å²	147.9	73%	0.73	77%	0.772	S	S	*	*			trans	-114.9	140.2	161.9	42.9	0	0	0	0	111
1294	P	29.5	Very low	26.4	Very low	133 Å²	133	154.3 Å²	154.3	86%	0.864	78%	0.778	S	S	*	*			trans	-85.9	137	152.3	33.2	-28.6	0	0	0	109.5
1295	I	33.5	Very low	26.5	Very low	146 Å²	146	152.6 Å²	152.6	75%	0.749	78%	0.777	S	S	*	*			trans	-115.7	131.5	-177.8	-58.8	169.1	0	0	0	108.7
1296	V	27.3	Very low	26.6	Very low	126 Å²	126	156.3 Å²	156.3	76%	0.764	78%	0.779	S	S	*	*			trans	170.2	153	140.1	148.2	0	0	0	0	111.2
1297	T	25.7	Very low	27	Very low	119 Å²	119	154.4 Å²	154.4	73%	0.73	78%	0.776	S	S	*	*			trans	77.7	113.5	-168.8	70.4	0	0	0	0	114
1298	R	28.1	Very low	27.6	Very low	234 Å²	234	152.3 Å²	152.3	88%	0.883	78%	0.775	S	S	*	*			cis	51.2	80.4	13.7	-86.3	-166.9	179.5	-172.3	2.3	112.9
1299	H	23.5	Very low	27.8	Very low	148 Å²	148	152.4 Å²	152.4	69%	0.685	78%	0.783	S	S	*	*			trans	165.7	132.7	141	-91.1	-63.3	0	0	0	108.5
1300	F	22.8	Very low	28.5	Very low	169 Å²	169	147.4 Å²	147.4	74%	0.741	76%	0.762	S	S	*	*			cis	-125.3	154.9	-9.4	-84.8	-92.6	0	0	0	109.7	V1302	F1300-V1302 PolarHBondContact O-N 2.89Å; F1300-V1302 VanDerWaalsContact O-N 3.16Å
1301	P	27.7	Very low	29.6	Very low	106 Å²	106	144.2 Å²	144.2	69%	0.688	76%	0.761	S	S	*	*			trans	-63.3	118.1	160.2	28.7	-32.2	0	0	0	108.5	K1303	P1301-K1303 PolarHBondContact O-N 3.05Å
1302	V	24.9	Very low	30.4	Very low	132 Å²	132	143.3 Å²	143.3	80%	0.8	74%	0.744	S	S	*	*			trans	-60.4	101.6	151.3	177.3	0	0	0	0	104.7	F1300	F1300-V1302 PolarHBondContact O-N 2.89Å; F1300-V1302 VanDerWaalsContact O-N 3.16Å
1303	K	24.8	Very low	31.4	Very low	165 Å²	165	143 Å²	143	72%	0.717	73%	0.731	S	S	*	*			trans	-47.3	145.4	175.6	-66.5	168.4	179.8	170.8	0	107.4	P1301 F1305	P1301-K1303 PolarHBondContact O-N 3.05Å; K1303-F1305 PolarHBondContact O-N 3.45Å
1304	R	25.1	Very low	32.9	Very low	250 Å²	250	139.9 Å²	139.9	94%	0.943	71%	0.714	S	S	*	*			trans	-54.4	96.7	154.9	-75.8	-180	175.4	169.8	-2.8	106	R1306	R1304-R1306 PolarHBondContact O-N 3.04Å; R1304-R1306 VanDerWaalsContact O-N 3.12Å
1305	F	26.1	Very low	34.5	Very low	176 Å²	176	136.2 Å²	136.2	77%	0.772	68%	0.683	S	S	*	*			trans	-57.3	122.4	168.6	-92.5	-90.8	0	0	0	104.7	K1303 S1307	K1303-F1305 PolarHBondContact O-N 3.45Å; F1305-S1307 PolarHBondContact O-N 2.82Å; F1305-S1307 VanDerWaalsContact O-N 3.07Å
1306	R	27.2	Very low	36.1	Very low	238 Å²	238	137 Å²	137	90%	0.898	68%	0.677	S	S	*	*			trans	-50.9	123.9	172	-74.2	177.5	170.9	172	-4.8	105.6	R1304 P1308	R1304-R1306 PolarHBondContact O-N 3.04Å; R1304-R1306 VanDerWaalsContact O-N 3.12Å; R1306-P1308 WeakPolarHBondContact O-CD 3.4Å
1307	S	31.3	Very low	38.3	Very low	89 Å²	89	137.2 Å²	137.2	62%	0.622	67%	0.67	S	S	*	*			trans	-43.4	117	177.3	44.7	0	0	0	0	108.1	F1305 N1309	F1305-S1307 PolarHBondContact O-N 2.82Å; F1305-S1307 VanDerWaalsContact O-N 3.07Å; S1307-N1309 PolarHBondContact O-N 3.41Å; S1307-N1309 PolarHBondContact O-OD1 3.43Å; S1307-N1309 VanDerWaalsContact O-OD1 3.13Å
1308	P	35.9	Very low	40.5	Very low	102 Å²	102	136.6 Å²	136.6	66%	0.662	66%	0.658	S	S	*	*			trans	-61.6	118.5	179.7	23.7	-31.6	0	0	0	107.1	R1306 G1310	R1306-P1308 WeakPolarHBondContact O-CD 3.4Å; P1308-G1310 PolarHBondContact O-N 2.94Å
1309	N	35.5	Very low	42.7	Very low	164 Å²	164	128.3 Å²	128.3	88%	0.877	63%	0.631	S	S	*	*	S	Bend	trans	-75.5	72.5	-175.4	-73.4	-8.6	0	0	0	109.9	S1307	S1307-N1309 PolarHBondContact O-N 3.41Å; S1307-N1309 PolarHBondContact O-OD1 3.43Å; S1307-N1309 VanDerWaalsContact O-OD1 3.13Å
1310	G	42.4	Very low	45.2	Very low	46 Å²	46	122.8 Å²	122.8	47%	0.474	61%	0.614	S	S	.	*	S	Bend	trans	174.6	146.4	177.6	0	0	0	0	0	111.2	P1308	P1308-G1310 PolarHBondContact O-N 2.94Å
1311	P	49.6	Very low	47.6	Very low	125 Å²	125	123 Å²	123	81%	0.812	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-63.7	150.2	176.2	28	-34.8	0	0	0	111.3	K1313	P1311-K1313 PolarHBondContact O-N 2.94Å
1312	F	39.3	Very low	49.7	Very low	88 Å²	88	120.8 Å²	120.8	39%	0.386	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-57.7	132.6	176.6	-74.2	-90.9	0	0	0	111.1	F1347 Y1354	F1312-F1347 HydrophobicContact CD1-CE2 4.36Å; F1312-F1347 HydrophobicContact CD1-CZ 4.38Å; F1312-Y1354 HydrophobicContact CD2-CD1 4.44Å; F1312-Y1354 HydrophobicContact CE2-CD1 4.03Å; F1312-Y1354 AromaticContact CE2-CD2 3.9Å; F1312-Y1354 HydrophobicContact CE2-CD2 3.9Å; F1312-Y1354 HydrophobicContact CE2-CE1 4.38Å; F1312-Y1354 HydrophobicContact CE2-CE2 4.26Å; F1312-Y1354 AromaticContact CE2-CG 3.77Å; F1312-Y1354 HydrophobicContact CE2-CG 3.77Å; F1312-Y1354 HydrophobicContact CZ-CD2 4.49Å
1313	K	51.6	Low	52	Low	129 Å²	129	117.1 Å²	117.1	56%	0.561	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-72.6	165.5	174.7	-73	-168.3	174.2	-169	0	111.7	P1311 E1317	P1311-K1313 PolarHBondContact O-N 2.94Å; K1313-E1317 HydrophobicContact CB-CB 4.29Å; K1313-E1317 WeakPolarHBondContact CB-OE2 3.4Å
1314	S	58.4	Low	53.8	Low	53 Å²	53	113.6 Å²	113.6	37%	0.371	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-61.1	142.8	174	177.1	0	0	0	0	110.7	R1316 E1317 Q1318	S1314-R1316 PolarHBondContact O-N 2.86Å; S1314-R1316 VanDerWaalsContact O-N 3.12Å; S1314-R1316 PolarHBondContact OG-N 2.89Å; S1314-E1317 VanDerWaalsContact CB-OE2 3.31Å; S1314-E1317 WeakPolarHBondContact CB-OE2 3.48Å; S1314-E1317 PolarHBondContact N-OE2 3.18Å; S1314-E1317 WeakPolarHBondContact O-CA 3.19Å; S1314-E1317 WeakPolarHBondContact O-CB 3.42Å; S1314-E1317 PolarHBondContact O-N 3.17Å; S1314-Q1318 PolarHBondContact O-N 3.19Å; S1314-Q1318 VanDerWaalsContact O-N 3.07Å
1315	W	63.5	Low	55.6	Low	55 Å²	55	106.2 Å²	106.2	21%	0.208	55%	0.55	C	S	.	.	H	α-helix	trans	-58.4	-27.5	175.7	67.5	-95.7	0	0	0	112.3	Q1318 L1319 F1340 K1344 F1347	W1315-Q1318 PolarHBondContact O-N 3.29Å; W1315-L1319 VanDerWaalsContact O-CB 3.31Å; W1315-L1319 WeakPolarHBondContact O-CB 3.36Å; W1315-L1319 PolarHBondContact O-N 2.74Å; W1315-F1340 HydrophobicContact CZ3-CE1 4.07Å; W1315-F1340 HydrophobicContact CZ3-CZ 4.09Å; W1315-K1344 HydrophobicContact CD2-CD 4.32Å; W1315-K1344 HydrophobicContact CD2-CG 4.21Å; W1315-K1344 HydrophobicContact CE3-CD 4.02Å; W1315-K1344 HydrophobicContact CE3-CG 4.06Å; W1315-K1344 HydrophobicContact CH2-CD 4.2Å; W1315-K1344 HydrophobicContact CZ2-CD 4.47Å; W1315-K1344 HydrophobicContact CZ3-CD 3.97Å; W1315-K1344 HydrophobicContact CZ3-CG 4.49Å; W1315-F1347 HydrophobicContact CB-CD1 3.73Å; W1315-F1347 HydrophobicContact CB-CE1 3.92Å
1316	R	68.5	Low	57.7	Low	162 Å²	162	103.8 Å²	103.8	61%	0.611	55%	0.545	S	S	*	.	H	α-helix	trans	-70.9	-33.1	172.2	-71.3	-174.2	175.2	-175.7	-4.2	113.5	S1314 Q1318 G1320	S1314-R1316 PolarHBondContact O-N 2.86Å; S1314-R1316 VanDerWaalsContact O-N 3.12Å; S1314-R1316 PolarHBondContact OG-N 2.89Å; R1316-Q1318 VanDerWaalsContact C-N 3.3Å; R1316-G1320 CarbonylContact O-C 3.55Å; R1316-G1320 VanDerWaalsContact O-CA 3.26Å; R1316-G1320 WeakPolarHBondContact O-CA 3.4Å; R1316-G1320 PolarHBondContact O-N 3.15Å; R1316-G1320 VanDerWaalsContact O-N 3.12Å
1317	E	71.4	Confident	59.1	Low	132 Å²	132	96.7 Å²	96.7	62%	0.617	53%	0.525	S	S	*	.	H	α-helix	trans	-75.2	-23.1	174.7	-66.2	174	115.3	0	0	112.2	K1313 S1314	K1313-E1317 HydrophobicContact CB-CB 4.29Å; K1313-E1317 WeakPolarHBondContact CB-OE2 3.4Å; S1314-E1317 VanDerWaalsContact CB-OE2 3.31Å; S1314-E1317 WeakPolarHBondContact CB-OE2 3.48Å; S1314-E1317 PolarHBondContact N-OE2 3.18Å; S1314-E1317 WeakPolarHBondContact O-CA 3.19Å; S1314-E1317 WeakPolarHBondContact O-CB 3.42Å; S1314-E1317 PolarHBondContact O-N 3.17Å
1318	Q	71.9	Confident	60.1	Low	105 Å²	105	93.2 Å²	93.2	49%	0.491	50%	0.502	S	S	.	.	H	α-helix	trans	-108	-19.4	-170.7	-166.4	154.6	-17.5	0	0	114.1	S1314 W1315 R1316 F1347	S1314-Q1318 PolarHBondContact O-N 3.19Å; S1314-Q1318 VanDerWaalsContact O-N 3.07Å; W1315-Q1318 PolarHBondContact O-N 3.29Å; R1316-Q1318 VanDerWaalsContact C-N 3.3Å; Q1318-F1347 HydrophobicContact CB-CZ 4.37Å; Q1318-F1347 HydrophobicContact CG-CE2 4.22Å; Q1318-F1347 HydrophobicContact CG-CZ 4.43Å
1319	L	75.4	Confident	61.3	Low	60 Å²	60	95.5 Å²	95.5	31%	0.314	51%	0.508	S	S	.	.	H	α-helix	trans	-114.2	-14.5	172.2	-60.4	172	0	0	0	113.3	W1315 F1340 A1343 K1344	W1315-L1319 VanDerWaalsContact O-CB 3.31Å; W1315-L1319 WeakPolarHBondContact O-CB 3.36Å; W1315-L1319 PolarHBondContact O-N 2.74Å; L1319-F1340 HydrophobicContact CB-CE2 3.97Å; L1319-F1340 HydrophobicContact CB-CZ 4.18Å; L1319-F1340 WeakPolarHBondContact O-CE2 3.23Å; L1319-A1343 HydrophobicContact CD1-CB 4.46Å; L1319-A1343 HydrophobicContact CD2-CB 4.07Å; L1319-K1344 VanDerWaalsContact CD1-CA 3.48Å; L1319-K1344 HydrophobicContact CD1-CB 3.9Å
1320	G	75.9	Confident	62.4	Low	32 Å²	32	91.6 Å²	91.6	33%	0.33	49%	0.49	S	S	.	.			trans	85	-165.3	-173.2	0	0	0	0	0	113.4	R1316	R1316-G1320 CarbonylContact O-C 3.55Å; R1316-G1320 VanDerWaalsContact O-CA 3.26Å; R1316-G1320 WeakPolarHBondContact O-CA 3.4Å; R1316-G1320 PolarHBondContact O-N 3.15Å; R1316-G1320 VanDerWaalsContact O-N 3.12Å
1321	E	73	Confident	63.4	Low	175 Å²	175	94 Å²	94	82%	0.818	50%	0.5	S	S	*	.	S	Bend	trans	-80	144.8	174.1	-63.1	-158.6	131.8	0	0	111.3	F1340	E1321-F1340 WeakPolarHBondContact O-CE2 3.39Å
1322	P	73.1	Confident	64.5	Low	59 Å²	59	95.5 Å²	95.5	38%	0.383	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-65.6	141	177.3	27.7	-34.3	0	0	0	111.1	N1324 F1340	P1322-N1324 PolarHBondContact O-N 2.75Å; P1322-F1340 HydrophobicContact CB-CD1 4.03Å; P1322-F1340 HydrophobicContact CB-CE1 3.6Å; P1322-F1340 HydrophobicContact CB-CZ 3.98Å
1323	P	72.8	Confident	66.1	Low	54 Å²	54	94.9 Å²	94.9	35%	0.351	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-53.5	138.9	167	-24.3	34	0	0	0	111	W1337 F1340	P1323-W1337 VanDerWaalsContact O-CD1 3.24Å; P1323-F1340 HydrophobicContact CG-CB 4.38Å
1324	N	61.7	Low	67.2	Low	92 Å²	92	92.4 Å²	92.4	49%	0.492	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-70.3	138.5	-179.4	-169.2	22.5	0	0	0	111.2	P1322 D1327	P1322-N1324 PolarHBondContact O-N 2.75Å; N1324-D1327 HydrophobicContact CB-CB 4.4Å
1325	L	62.6	Low	68.1	Low	94 Å²	94	93.8 Å²	93.8	49%	0.492	49%	0.49	S	S	.	.	S	Bend	trans	-72.3	-38.1	-176.1	-171.9	66.7	0	0	0	111.8	D1327 A1328 W1337	L1325-D1327 PolarHBondContact O-N 3.33Å; L1325-A1328 WeakPolarHBondContact O-CB 3.37Å; L1325-A1328 PolarHBondContact O-N 3.43Å; L1325-W1337 HydrophobicContact CD1-CD2 4.19Å; L1325-W1337 HydrophobicContact CD1-CG 4.48Å; L1325-W1337 HydrophobicContact CD1-CZ2 4.21Å
1326	D	70.7	Confident	68.8	Low	126 Å²	126	96 Å²	96	67%	0.674	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-22.5	-179.5	-53	-40.9	0	0	0	112.7	A1328 N1329	D1326-A1328 VanDerWaalsContact C-N 3.32Å; D1326-N1329 PolarHBondContact O-ND2 2.88Å; D1326-N1329 VanDerWaalsContact O-ND2 3.13Å
1327	D	55.6	Low	69.7	Low	89 Å²	89	91.3 Å²	91.3	48%	0.476	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-16.6	176.3	-109.6	-69.1	0	0	0	113.1	N1324 L1325 N1329 K1333	N1324-D1327 HydrophobicContact CB-CB 4.4Å; L1325-D1327 PolarHBondContact O-N 3.33Å; D1327-N1329 PolarHBondContact O-N 3.48Å; D1327-K1333 WeakPolarHBondContact O-CD 3.3Å; D1327-K1333 PolarHBondContact O-NZ 2.88Å; D1327-K1333 IonicContact OD1-NZ 2.66Å; D1327-K1333 PolarHBondContact OD1-NZ 2.81Å
1328	A	53	Low	70	Confident	16 Å²	16	88.5 Å²	88.5	13%	0.132	47%	0.474	C	S	.	.			trans	-79.2	24.9	-165.1	0	0	0	0	0	115.4	L1325 D1326 T1330 K1333	L1325-A1328 WeakPolarHBondContact O-CB 3.37Å; L1325-A1328 PolarHBondContact O-N 3.43Å; D1326-A1328 VanDerWaalsContact C-N 3.32Å; A1328-T1330 PolarHBondContact O-N 2.83Å; A1328-K1333 HydrophobicContact CB-CB 4.4Å
1329	N	62	Low	70.4	Confident	149 Å²	149	85.9 Å²	85.9	80%	0.797	47%	0.47	S	S	*	.			trans	-65.1	11.9	-178.4	-65.1	-45.7	0	0	0	115.5	D1326 D1327	D1326-N1329 PolarHBondContact O-ND2 2.88Å; D1326-N1329 VanDerWaalsContact O-ND2 3.13Å; D1327-N1329 PolarHBondContact O-N 3.48Å
1330	T	57.1	Low	71	Confident	83 Å²	83	84.3 Å²	84.3	51%	0.509	46%	0.46	S	S	.	.	S	Bend	trans	-137.3	139.2	172.4	48.4	0	0	0	0	109.9	A1328 K1332 K1333 L1334	A1328-T1330 PolarHBondContact O-N 2.83Å; T1330-K1332 PolarHBondContact O-N 3.32Å; T1330-K1333 PolarHBondContact O-N 3.41Å; T1330-L1334 PolarHBondContact O-N 2.84Å; T1330-L1334 VanDerWaalsContact O-N 3.08Å
1331	S	64.1	Low	71.2	Confident	97 Å²	97	84.5 Å²	84.5	68%	0.678	45%	0.453	S	S	*	.	H	α-helix	trans	-49.4	-35.2	-177.8	175.9	0	0	0	0	113.5	L1334 T1335	S1331-L1334 PolarHBondContact O-N 3.31Å; S1331-T1335 WeakPolarHBondContact O-CB 3.4Å; S1331-T1335 PolarHBondContact O-N 3.23Å; S1331-T1335 PolarHBondContact O-OG1 3.37Å
1332	K	73.2	Confident	71.5	Confident	155 Å²	155	81.7 Å²	81.7	67%	0.674	44%	0.44	S	S	*	.	H	α-helix	trans	-63.9	-48.2	177.1	-155.1	-177.6	-177.6	-171	0	112.8	T1330 L1334 T1335 E1336	T1330-K1332 PolarHBondContact O-N 3.32Å; K1332-L1334 PolarHBondContact O-N 3.22Å; K1332-T1335 WeakPolarHBondContact O-CB 3.45Å; K1332-T1335 PolarHBondContact O-N 3.41Å; K1332-E1336 WeakPolarHBondContact O-CG 3.4Å; K1332-E1336 PolarHBondContact O-N 3.08Å
1333	K	73.2	Confident	71.9	Confident	75 Å²	75	80.9 Å²	80.9	33%	0.326	44%	0.438	S	S	.	.	H	α-helix	trans	-64.3	-37.4	174	-77.3	-173.1	176.2	-177	0	112.4	D1327 A1328 T1330 T1335 E1336 W1337	D1327-K1333 WeakPolarHBondContact O-CD 3.3Å; D1327-K1333 PolarHBondContact O-NZ 2.88Å; D1327-K1333 IonicContact OD1-NZ 2.66Å; D1327-K1333 PolarHBondContact OD1-NZ 2.81Å; A1328-K1333 HydrophobicContact CB-CB 4.4Å; T1330-K1333 PolarHBondContact O-N 3.41Å; K1333-T1335 VanDerWaalsContact C-N 3.29Å; K1333-T1335 PolarHBondContact O-N 3.01Å; K1333-E1336 PolarHBondContact O-N 3.3Å; K1333-W1337 PolarHBondContact O-N 3.23Å
1334	L	73.6	Confident	72.2	Confident	77 Å²	77	80.3 Å²	80.3	40%	0.403	43%	0.43	S	S	.	.	H	α-helix	trans	-63.6	-36.9	174.2	-173.8	65.7	0	0	0	111.6	T1330 S1331 K1332 W1337 L1338	T1330-L1334 PolarHBondContact O-N 2.84Å; T1330-L1334 VanDerWaalsContact O-N 3.08Å; S1331-L1334 PolarHBondContact O-N 3.31Å; K1332-L1334 PolarHBondContact O-N 3.22Å; L1334-W1337 PolarHBondContact O-N 3.18Å; L1334-L1338 WeakPolarHBondContact O-CB 2.95Å; L1334-L1338 WeakPolarHBondContact O-CG 3.47Å; L1334-L1338 PolarHBondContact O-N 2.68Å
1335	T	76.8	Confident	73.1	Confident	83 Å²	83	83 Å²	83	51%	0.509	43%	0.433	S	S	.	.	H	α-helix	trans	-66.6	-40.2	173.3	-51.1	0	0	0	0	111.5	S1331 K1332 K1333 L1338 A1339	S1331-T1335 WeakPolarHBondContact O-CB 3.4Å; S1331-T1335 PolarHBondContact O-N 3.23Å; S1331-T1335 PolarHBondContact O-OG1 3.37Å; K1332-T1335 WeakPolarHBondContact O-CB 3.45Å; K1332-T1335 PolarHBondContact O-N 3.41Å; K1333-T1335 VanDerWaalsContact C-N 3.29Å; K1333-T1335 PolarHBondContact O-N 3.01Å; T1335-L1338 PolarHBondContact O-N 3.05Å; T1335-A1339 WeakPolarHBondContact O-CB 3.38Å; T1335-A1339 PolarHBondContact O-N 2.82Å
1336	E	80	Confident	73.6	Confident	102 Å²	102	84.6 Å²	84.6	48%	0.477	44%	0.438	S	S	.	.	H	α-helix	trans	-64.6	-39.8	175	-70.5	158.9	-174.2	0	0	111.8	K1332 K1333 A1339 F1340	K1332-E1336 WeakPolarHBondContact O-CG 3.4Å; K1332-E1336 PolarHBondContact O-N 3.08Å; K1333-E1336 PolarHBondContact O-N 3.3Å; E1336-A1339 PolarHBondContact O-N 2.94Å; E1336-F1340 PolarHBondContact O-N 3.32Å
1337	W	87.1	Confident	73.9	Confident	63 Å²	63	79.3 Å²	79.3	24%	0.239	41%	0.409	C	S	.	.	H	α-helix	trans	-63	-46.3	172.6	-174.3	92.9	0	0	0	112.4	P1323 L1325 K1333 L1334 A1339 F1340 H1341	P1323-W1337 VanDerWaalsContact O-CD1 3.24Å; L1325-W1337 HydrophobicContact CD1-CD2 4.19Å; L1325-W1337 HydrophobicContact CD1-CG 4.48Å; L1325-W1337 HydrophobicContact CD1-CZ2 4.21Å; K1333-W1337 PolarHBondContact O-N 3.23Å; L1334-W1337 PolarHBondContact O-N 3.18Å; W1337-A1339 PolarHBondContact O-N 3.05Å; W1337-F1340 PolarHBondContact O-N 3.4Å; W1337-H1341 AromaticContact CE2-CD2 3.72Å; W1337-H1341 AromaticContact CE2-NE2 3.69Å; W1337-H1341 AromaticContact CZ2-CD2 3.83Å; W1337-H1341 AromaticContact CZ2-CE1 3.85Å; W1337-H1341 AromaticContact CZ2-NE2 3.56Å; W1337-H1341 AromaticContact NE1-NE2 3.92Å; W1337-H1341 PolarHBondContact O-CD2 2.87Å; W1337-H1341 PolarHBondContact O-N 3.38Å; W1337-H1341 VanDerWaalsContact O-N 3.11Å
1338	L	77.1	Confident	74.8	Confident	73 Å²	73	78.2 Å²	78.2	38%	0.382	40%	0.401	S	S	.	.	H	α-helix	trans	-61	-43.5	175.2	-81.8	165.5	0	0	0	111.9	L1334 T1335 F1340 H1341 Q1342	L1334-L1338 WeakPolarHBondContact O-CB 2.95Å; L1334-L1338 WeakPolarHBondContact O-CG 3.47Å; L1334-L1338 PolarHBondContact O-N 2.68Å; T1335-L1338 PolarHBondContact O-N 3.05Å; L1338-F1340 PolarHBondContact O-N 3.43Å; L1338-H1341 PolarHBondContact O-N 2.92Å; L1338-Q1342 WeakPolarHBondContact O-CG 3.36Å; L1338-Q1342 PolarHBondContact O-N 3.46Å
1339	A	80.2	Confident	75.1	Confident	50 Å²	50	81.7 Å²	81.7	41%	0.413	42%	0.417	S	S	.	.	H	α-helix	trans	-62.3	-41.3	178.1	0	0	0	0	0	112.2	T1335 E1336 W1337 H1341 Q1342 A1343	T1335-A1339 WeakPolarHBondContact O-CB 3.38Å; T1335-A1339 PolarHBondContact O-N 2.82Å; E1336-A1339 PolarHBondContact O-N 2.94Å; W1337-A1339 PolarHBondContact O-N 3.05Å; A1339-H1341 PolarHBondContact O-N 3.32Å; A1339-Q1342 PolarHBondContact O-N 3Å; A1339-A1343 PolarHBondContact O-N 2.86Å
1340	F	88.7	Confident	75.5	Confident	26 Å²	26	79.7 Å²	79.7	11%	0.114	40%	0.403	C	S	.	.	H	α-helix	trans	-59.3	-46.1	173.1	-178.4	-82.4	0	0	0	111.6	W1315 L1319 E1321 P1322 P1323 E1336 W1337 L1338 A1343 K1344	W1315-F1340 HydrophobicContact CZ3-CE1 4.07Å; W1315-F1340 HydrophobicContact CZ3-CZ 4.09Å; L1319-F1340 HydrophobicContact CB-CE2 3.97Å; L1319-F1340 HydrophobicContact CB-CZ 4.18Å; L1319-F1340 WeakPolarHBondContact O-CE2 3.23Å; E1321-F1340 WeakPolarHBondContact O-CE2 3.39Å; P1322-F1340 HydrophobicContact CB-CD1 4.03Å; P1322-F1340 HydrophobicContact CB-CE1 3.6Å; P1322-F1340 HydrophobicContact CB-CZ 3.98Å; P1323-F1340 HydrophobicContact CG-CB 4.38Å; E1336-F1340 PolarHBondContact O-N 3.32Å; W1337-F1340 PolarHBondContact O-N 3.4Å; L1338-F1340 PolarHBondContact O-N 3.43Å; F1340-A1343 PolarHBondContact O-N 2.97Å; F1340-K1344 PolarHBondContact O-N 3.17Å
1341	H	79.8	Confident	75.8	Confident	36 Å²	36	78.4 Å²	78.4	17%	0.167	39%	0.391	C	S	.	.	H	α-helix	trans	-68	-36.4	179.9	-88.1	-104.6	0	0	0	113.2	W1337 L1338 A1339 K1344 W1345	W1337-H1341 AromaticContact CE2-CD2 3.72Å; W1337-H1341 AromaticContact CE2-NE2 3.69Å; W1337-H1341 AromaticContact CZ2-CD2 3.83Å; W1337-H1341 AromaticContact CZ2-CE1 3.85Å; W1337-H1341 AromaticContact CZ2-NE2 3.56Å; W1337-H1341 AromaticContact NE1-NE2 3.92Å; W1337-H1341 PolarHBondContact O-CD2 2.87Å; W1337-H1341 PolarHBondContact O-N 3.38Å; W1337-H1341 VanDerWaalsContact O-N 3.11Å; L1338-H1341 PolarHBondContact O-N 2.92Å; A1339-H1341 PolarHBondContact O-N 3.32Å; H1341-K1344 WeakPolarHBondContact O-CB 3.24Å; H1341-K1344 PolarHBondContact O-N 3.07Å; H1341-W1345 VanDerWaalsContact O-CD2 3.3Å; H1341-W1345 PolarHBondContact O-N 3.46Å
1342	Q	79.3	Confident	75.4	Confident	117 Å²	117	81.1 Å²	81.1	55%	0.547	39%	0.386	S	S	.	.	H	α-helix	trans	-62.9	-45.2	172.3	-72.8	173.9	-2.5	0	0	112	L1338 A1339 K1344 W1345 H1346	L1338-Q1342 WeakPolarHBondContact O-CG 3.36Å; L1338-Q1342 PolarHBondContact O-N 3.46Å; A1339-Q1342 PolarHBondContact O-N 3Å; Q1342-K1344 VanDerWaalsContact C-N 3.33Å; Q1342-K1344 PolarHBondContact O-N 3.18Å; Q1342-W1345 HydrophobicContact CG-CE3 4.27Å; Q1342-W1345 HydrophobicContact CG-CZ3 4.19Å; Q1342-W1345 PolarHBondContact O-N 3.02Å; Q1342-H1346 PolarHBondContact O-N 3.18Å
1343	A	80.4	Confident	74.6	Confident	42 Å²	42	78.4 Å²	78.4	35%	0.347	38%	0.376	S	S	.	.	H	α-helix	trans	-61.1	-41	175.9	0	0	0	0	0	112.1	L1319 A1339 F1340 H1346 F1347	L1319-A1343 HydrophobicContact CD1-CB 4.46Å; L1319-A1343 HydrophobicContact CD2-CB 4.07Å; A1339-A1343 PolarHBondContact O-N 2.86Å; F1340-A1343 PolarHBondContact O-N 2.97Å; A1343-H1346 PolarHBondContact O-N 3.02Å; A1343-F1347 PolarHBondContact O-N 3.06Å; A1343-F1347 VanDerWaalsContact O-N 3.08Å
1344	K	80.5	Confident	73.5	Confident	41 Å²	41	81.4 Å²	81.4	18%	0.178	39%	0.386	C	S	.	.	H	α-helix	trans	-58.9	-48	174.1	180	-172	172.1	-171.9	0	112.2	W1315 L1319 F1340 H1341 Q1342 H1346 F1347 Q1348	W1315-K1344 HydrophobicContact CD2-CD 4.32Å; W1315-K1344 HydrophobicContact CD2-CG 4.21Å; W1315-K1344 HydrophobicContact CE3-CD 4.02Å; W1315-K1344 HydrophobicContact CE3-CG 4.06Å; W1315-K1344 HydrophobicContact CH2-CD 4.2Å; W1315-K1344 HydrophobicContact CZ2-CD 4.47Å; W1315-K1344 HydrophobicContact CZ3-CD 3.97Å; W1315-K1344 HydrophobicContact CZ3-CG 4.49Å; L1319-K1344 VanDerWaalsContact CD1-CA 3.48Å; L1319-K1344 HydrophobicContact CD1-CB 3.9Å; F1340-K1344 PolarHBondContact O-N 3.17Å; H1341-K1344 WeakPolarHBondContact O-CB 3.24Å; H1341-K1344 PolarHBondContact O-N 3.07Å; Q1342-K1344 VanDerWaalsContact C-N 3.33Å; Q1342-K1344 PolarHBondContact O-N 3.18Å; K1344-H1346 VanDerWaalsContact C-N 3.35Å; K1344-H1346 PolarHBondContact O-N 2.9Å; K1344-F1347 PolarHBondContact O-N 3.16Å; K1344-Q1348 WeakPolarHBondContact O-CG 3.45Å; K1344-Q1348 PolarHBondContact O-N 3.23Å
1345	W	79.5	Confident	72.2	Confident	149 Å²	149	84.6 Å²	84.6	56%	0.564	40%	0.397	S	S	*	.	H	α-helix	trans	-62.6	-41.4	178	-64.6	-35.5	0	0	0	112.1	H1341 Q1342 F1347 Q1348 L1349	H1341-W1345 VanDerWaalsContact O-CD2 3.3Å; H1341-W1345 PolarHBondContact O-N 3.46Å; Q1342-W1345 HydrophobicContact CG-CE3 4.27Å; Q1342-W1345 HydrophobicContact CG-CZ3 4.19Å; Q1342-W1345 PolarHBondContact O-N 3.02Å; W1345-F1347 PolarHBondContact O-N 3.4Å; W1345-Q1348 PolarHBondContact O-N 3.13Å; W1345-L1349 PolarHBondContact O-N 2.67Å
1346	H	73.2	Confident	70.6	Confident	127 Å²	127	85.8 Å²	85.8	59%	0.588	41%	0.405	S	S	*	.	H	α-helix	trans	-62.3	-41.7	179.2	-146.9	-65.5	0	0	0	112	Q1342 A1343 K1344 L1349 E1350	Q1342-H1346 PolarHBondContact O-N 3.18Å; A1343-H1346 PolarHBondContact O-N 3.02Å; K1344-H1346 VanDerWaalsContact C-N 3.35Å; K1344-H1346 PolarHBondContact O-N 2.9Å; H1346-L1349 WeakPolarHBondContact O-CB 3.25Å; H1346-L1349 PolarHBondContact O-N 3.43Å; H1346-E1350 PolarHBondContact O-N 3.37Å
1347	F	77.7	Confident	68.6	Low	16 Å²	16	88.6 Å²	88.6	7%	0.07	42%	0.415	C	S	.	.	H	α-helix	trans	-65.7	-39	175.2	-171.7	-102	0	0	0	112.7	F1312 W1315 Q1318 A1343 K1344 W1345 L1349 E1350 Q1351	F1312-F1347 HydrophobicContact CD1-CE2 4.36Å; F1312-F1347 HydrophobicContact CD1-CZ 4.38Å; W1315-F1347 HydrophobicContact CB-CD1 3.73Å; W1315-F1347 HydrophobicContact CB-CE1 3.92Å; Q1318-F1347 HydrophobicContact CB-CZ 4.37Å; Q1318-F1347 HydrophobicContact CG-CE2 4.22Å; Q1318-F1347 HydrophobicContact CG-CZ 4.43Å; A1343-F1347 PolarHBondContact O-N 3.06Å; A1343-F1347 VanDerWaalsContact O-N 3.08Å; K1344-F1347 PolarHBondContact O-N 3.16Å; W1345-F1347 PolarHBondContact O-N 3.4Å; F1347-L1349 PolarHBondContact O-N 3.4Å; F1347-E1350 PolarHBondContact O-N 3.12Å; F1347-Q1351 HydrophobicContact CE1-CG 4.4Å; F1347-Q1351 VanDerWaalsContact CE1-NE2 3.33Å; F1347-Q1351 PolarHBondContact O-N 3.41Å
1348	Q	73.4	Confident	66.2	Low	65 Å²	65	89.8 Å²	89.8	30%	0.304	43%	0.433	S	S	.	.	H	α-helix	trans	-67.2	-21.9	173.4	-69.5	-179.3	-66.6	0	0	113.2	K1344 W1345 R1352	K1344-Q1348 WeakPolarHBondContact O-CG 3.45Å; K1344-Q1348 PolarHBondContact O-N 3.23Å; W1345-Q1348 PolarHBondContact O-N 3.13Å; Q1348-R1352 PolarHBondContact O-N 3.06Å; Q1348-R1352 PolarHBondContact O-NE 2.71Å
1349	L	60.7	Low	64.4	Low	89 Å²	89	93.3 Å²	93.3	47%	0.466	45%	0.449	S	S	.	.	H	α-helix	trans	-81.2	-42.5	176	-144.7	166.3	0	0	0	110.7	W1345 H1346 F1347 R1352 Q1353	W1345-L1349 PolarHBondContact O-N 2.67Å; H1346-L1349 WeakPolarHBondContact O-CB 3.25Å; H1346-L1349 PolarHBondContact O-N 3.43Å; F1347-L1349 PolarHBondContact O-N 3.4Å; L1349-R1352 PolarHBondContact O-N 3.36Å; L1349-Q1353 HydrophobicContact CD2-CG 4.17Å; L1349-Q1353 PolarHBondContact O-N 2.84Å
1350	E	70.5	Confident	62	Low	107 Å²	107	94 Å²	94	50%	0.5	46%	0.462	S	S	.	.	H	α-helix	trans	-60.3	-44.1	171.9	-72.8	-164.9	127.4	0	0	112.6	H1346 F1347 R1352 Q1353 Y1354	H1346-E1350 PolarHBondContact O-N 3.37Å; F1347-E1350 PolarHBondContact O-N 3.12Å; E1350-R1352 VanDerWaalsContact C-N 3.33Å; E1350-R1352 PolarHBondContact O-N 2.98Å; E1350-Q1353 PolarHBondContact O-N 3.44Å; E1350-Y1354 PolarHBondContact O-N 2.82Å
1351	Q	62.7	Low	59.1	Low	56 Å²	56	100.7 Å²	100.7	26%	0.262	50%	0.499	S	S	.	.	H	α-helix	trans	-57.4	-45.4	175.9	-76.3	-168.6	-14.6	0	0	111.7	F1347 Y1354 F1355	F1347-Q1351 HydrophobicContact CE1-CG 4.4Å; F1347-Q1351 VanDerWaalsContact CE1-NE2 3.33Å; F1347-Q1351 PolarHBondContact O-N 3.41Å; Q1351-Y1354 PolarHBondContact O-N 2.86Å; Q1351-F1355 VanDerWaalsContact O-CD2 3.31Å; Q1351-F1355 WeakPolarHBondContact O-CD2 3.49Å; Q1351-F1355 PolarHBondContact O-N 3.42Å; Q1351-F1355 VanDerWaalsContact O-N 3.16Å
1352	R	55.5	Low	56.6	Low	154 Å²	154	103.4 Å²	103.4	58%	0.581	53%	0.527	S	S	*	.	H	α-helix	trans	-61	-48.9	176	-80.8	-172.8	-88.1	-168.8	-1.9	111.8	Q1348 L1349 E1350 Y1354 F1355 T1356	Q1348-R1352 PolarHBondContact O-N 3.06Å; Q1348-R1352 PolarHBondContact O-NE 2.71Å; L1349-R1352 PolarHBondContact O-N 3.36Å; E1350-R1352 VanDerWaalsContact C-N 3.33Å; E1350-R1352 PolarHBondContact O-N 2.98Å; R1352-Y1354 VanDerWaalsContact C-N 3.25Å; R1352-Y1354 PolarHBondContact O-N 2.84Å; R1352-F1355 PolarHBondContact O-N 2.77Å; R1352-T1356 PolarHBondContact O-N 3.48Å; R1352-T1356 PolarHBondContact O-OG1 3.45Å
1353	Q	56.6	Low	54.2	Low	99 Å²	99	107.7 Å²	107.7	46%	0.463	54%	0.544	S	S	.	.	H	α-helix	trans	-59.8	-32.7	177.8	-70.7	-168	24.8	0	0	113.8	L1349 E1350 K1357	L1349-Q1353 HydrophobicContact CD2-CG 4.17Å; L1349-Q1353 PolarHBondContact O-N 2.84Å; E1350-Q1353 PolarHBondContact O-N 3.44Å; Q1353-K1357 WeakPolarHBondContact O-CG 3.49Å; Q1353-K1357 PolarHBondContact O-N 2.93Å; Q1353-K1357 VanDerWaalsContact O-N 3.17Å
1354	Y	50.9	Low	51.6	Low	138 Å²	138	113 Å²	113	54%	0.541	57%	0.565	S	S	.	*	H	α-helix	trans	-67.2	-47.4	175.4	-176.5	-96.5	0	0	0	111.6	F1312 E1350 Q1351 R1352 T1356 K1357 S1358	F1312-Y1354 HydrophobicContact CD2-CD1 4.44Å; F1312-Y1354 HydrophobicContact CE2-CD1 4.03Å; F1312-Y1354 AromaticContact CE2-CD2 3.9Å; F1312-Y1354 HydrophobicContact CE2-CD2 3.9Å; F1312-Y1354 HydrophobicContact CE2-CE1 4.38Å; F1312-Y1354 HydrophobicContact CE2-CE2 4.26Å; F1312-Y1354 AromaticContact CE2-CG 3.77Å; F1312-Y1354 HydrophobicContact CE2-CG 3.77Å; F1312-Y1354 HydrophobicContact CZ-CD2 4.49Å; E1350-Y1354 PolarHBondContact O-N 2.82Å; Q1351-Y1354 PolarHBondContact O-N 2.86Å; R1352-Y1354 VanDerWaalsContact C-N 3.25Å; R1352-Y1354 PolarHBondContact O-N 2.84Å; Y1354-T1356 PolarHBondContact O-N 3Å; Y1354-K1357 PolarHBondContact O-N 3Å; Y1354-S1358 PolarHBondContact O-N 2.73Å; Y1354-S1358 VanDerWaalsContact O-N 3.1Å
1355	F	45.9	Very low	49	Very low	144 Å²	144	118.9 Å²	118.9	63%	0.632	60%	0.598	S	S	*	*	H	α-helix	trans	-60	-45.5	175.3	-83.2	-71	0	0	0	112.2	Q1351 R1352 K1357 S1358	Q1351-F1355 VanDerWaalsContact O-CD2 3.31Å; Q1351-F1355 WeakPolarHBondContact O-CD2 3.49Å; Q1351-F1355 PolarHBondContact O-N 3.42Å; Q1351-F1355 VanDerWaalsContact O-N 3.16Å; R1352-F1355 PolarHBondContact O-N 2.77Å; F1355-K1357 VanDerWaalsContact C-N 3.32Å; F1355-K1357 PolarHBondContact O-N 2.79Å; F1355-S1358 PolarHBondContact O-N 3.47Å
1356	T	42.3	Very low	46.4	Very low	108 Å²	108	115.3 Å²	115.3	66%	0.663	61%	0.608	S	S	*	*	H	α-helix	trans	-59.2	-42	178	-42.7	0	0	0	0	112	R1352 Y1354	R1352-T1356 PolarHBondContact O-N 3.48Å; R1352-T1356 PolarHBondContact O-OG1 3.45Å; Y1354-T1356 PolarHBondContact O-N 3Å
1357	K	38.9	Very low	44	Very low	160 Å²	160	116.8 Å²	116.8	70%	0.696	62%	0.62	S	S	*	*	H	α-helix	trans	-73.9	-25.2	-179.2	-73.4	174.2	-173.1	166.7	0	113.7	Q1353 Y1354 F1355	Q1353-K1357 WeakPolarHBondContact O-CG 3.49Å; Q1353-K1357 PolarHBondContact O-N 2.93Å; Q1353-K1357 VanDerWaalsContact O-N 3.17Å; Y1354-K1357 PolarHBondContact O-N 3Å; F1355-K1357 VanDerWaalsContact C-N 3.32Å; F1355-K1357 PolarHBondContact O-N 2.79Å
1358	S	37.4	Very low	41.5	Very low	88 Å²	88	121.3 Å²	121.3	62%	0.615	65%	0.654	S	S	*	*	H	α-helix	trans	-76.9	-20.2	180	-166	0	0	0	0	114.1	Y1354 F1355	Y1354-S1358 PolarHBondContact O-N 2.73Å; Y1354-S1358 VanDerWaalsContact O-N 3.1Å; F1355-S1358 PolarHBondContact O-N 3.47Å
1359	M	37.4	Very low	39.2	Very low	147 Å²	147	124.8 Å²	124.8	72%	0.724	68%	0.675	S	S	*	*	S	Bend	trans	-88.3	-16.2	-175	-72.6	-75.3	-79.5	0	0	114.2	N1361	M1359-N1361 PolarHBondContact O-N 2.93Å
1360	G	31.7	Very low	37.5	Very low	66 Å²	66	128.6 Å²	128.6	68%	0.68	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-0.5	-162.7	0	0	0	0	0	118
1361	N	27.4	Very low	35.3	Very low	165 Å²	165	126.9 Å²	126.9	88%	0.882	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.4	22.6	-159	-122.8	24	0	0	0	116.3	M1359	M1359-N1361 PolarHBondContact O-N 2.93Å
1362	A	27.8	Very low	33.4	Very low	93 Å²	93	135.5 Å²	135.5	77%	0.769	73%	0.732	S	S	*	*			trans	-147.9	66.5	-177.7	0	0	0	0	0	114.8
1363	K	28.4	Very low	31.9	Very low	208 Å²	208	132.5 Å²	132.5	90%	0.904	74%	0.735	S	S	*	*			trans	-145.7	88.4	163.8	-79.9	-163.4	175.6	-174.5	0	111.8
1364	I	26.3	Very low	30.2	Very low	152 Å²	152	136 Å²	136	78%	0.779	75%	0.749	S	S	*	*			trans	-143.1	129.7	166.7	-69.9	-173.2	0	0	0	108.7
1365	N	24.3	Very low	29.2	Very low	165 Å²	165	136.8 Å²	136.8	88%	0.882	76%	0.761	S	S	*	*			trans	62.3	144.2	168.9	-60	-5.7	0	0	0	119.7
1366	G	25.2	Very low	29.3	Very low	75 Å²	75	135.5 Å²	135.5	77%	0.773	77%	0.768	S	S	*	*			trans	134.2	84.5	150.7	0	0	0	0	0	116.2
1367	D	23.9	Very low	28.7	Very low	157 Å²	157	135.7 Å²	135.7	84%	0.84	77%	0.773	S	S	*	*			trans	-67.4	-177.9	176.3	-63.6	-73.7	0	0	0	115.6
1368	S	25.2	Very low	28.2	Very low	111 Å²	111	133 Å²	133	78%	0.776	78%	0.782	S	S	*	*			trans	83.1	87.1	161.5	64.7	0	0	0	0	119.1
1369	D	24.5	Very low	27.8	Very low	138 Å²	138	137.9 Å²	137.9	74%	0.738	79%	0.792	S	S	*	*				30.5	106.2	114.5	-128.5	-36.9	0	0	0	118.9
1370	H	25.1	Very low	27.5	Very low	170 Å²	170	142.3 Å²	142.3	79%	0.787	80%	0.8	S	S	*	*				-172.7	144.4	99.6	-89.1	-18.9	0	0	0	111.4
1371	G	24.7	Very low	27.7	Very low	70 Å²	70	146 Å²	146	72%	0.722	80%	0.8	S	S	*	*			trans	-84.2	147.9	-168.2	0	0	0	0	0	115.9
1372	Y	21.6	Very low	27.8	Very low	238 Å²	238	149.8 Å²	149.8	93%	0.933	80%	0.802	S	S	*	*			trans	-135.9	164.6	161.8	-89.1	-82.1	0	0	0	110.7
1373	S	23.5	Very low	28.7	Very low	90 Å²	90	147.9 Å²	147.9	63%	0.629	79%	0.791	S	S	*	*			trans	-125.6	172.9	-155.4	-170.8	0	0	0	0	114.6
1374	F	22.7	Very low	29.5	Very low	172 Å²	172	143.9 Å²	143.9	75%	0.754	78%	0.778	S	S	*	*			trans	81.3	107.3	159.5	-57.9	-67.1	0	0	0	121.8
1375	L	29.2	Very low	30.3	Very low	155 Å²	155	139.4 Å²	139.4	81%	0.812	77%	0.765	S	S	*	*				65.2	-170.7	128.2	-55.3	170.1	0	0	0	116.4
1376	P	47.1	Very low	31.4	Very low	117 Å²	117	138.9 Å²	138.9	76%	0.76	75%	0.75	S	S	*	*				-130	165.3	-109.8	33.2	-10.7	0	0	0	116.1
1377	S	30.3	Very low	32.7	Very low	112 Å²	112	142.1 Å²	142.1	78%	0.783	74%	0.74	S	S	*	*			trans	-143.8	59.7	168.8	-159.8	0	0	0	0	113.7	K1379	S1377-K1379 VanDerWaalsContact C-N 3.35Å; S1377-K1379 PolarHBondContact O-N 2.95Å
1378	A	28.1	Very low	34.3	Very low	105 Å²	105	139.3 Å²	139.3	87%	0.868	73%	0.725	S	S	*	*			trans	-77.1	74.7	177.1	0	0	0	0	0	112.7
1379	K	29.6	Very low	35.8	Very low	190 Å²	190	138.3 Å²	138.3	83%	0.826	71%	0.71	S	S	*	*			trans	-100.2	91.8	172.9	-84	-177.7	177.1	173.6	0	113.2	S1377	S1377-K1379 VanDerWaalsContact C-N 3.35Å; S1377-K1379 PolarHBondContact O-N 2.95Å
1380	R	31.6	Very low	37.4	Very low	240 Å²	240	134.7 Å²	134.7	91%	0.906	69%	0.689	S	S	*	*			trans	61	59.4	153.9	-58.3	-176.9	176.1	-178.6	-1	117.9
1381	Q	34.5	Very low	39.1	Very low	144 Å²	144	127.8 Å²	127.8	67%	0.673	66%	0.659	S	S	*	*			trans	-84.7	128.8	149.1	-72.7	-175	-10.4	0	0	110.2
1382	R	30.4	Very low	41	Very low	244 Å²	244	130.1 Å²	130.1	92%	0.921	65%	0.646	S	S	*	*			trans	-119.9	143.7	171.6	-74.8	-179.4	170.1	178.5	-4.6	108.6
1383	G	46.5	Very low	43.1	Very low	52 Å²	52	122.1 Å²	122.1	54%	0.536	62%	0.622	S	S	.	*	S	Bend	trans	108.4	-171.7	174.4	0	0	0	0	0	114.9	A1385 R1386	G1383-A1385 VanDerWaalsContact C-N 3.26Å; G1383-A1385 PolarHBondContact O-N 2.81Å; G1383-A1385 VanDerWaalsContact O-N 3.09Å; G1383-R1386 PolarHBondContact O-N 3.37Å
1384	L	44.2	Very low	45.2	Very low	124 Å²	124	118.7 Å²	118.7	65%	0.649	60%	0.596	S	S	*	*	H	α-helix	trans	-52.2	-35.5	-166.7	-174.7	65.9	0	0	0	114.6	R1386 Y1387 L1388	L1384-R1386 VanDerWaalsContact C-N 3.28Å; L1384-R1386 PolarHBondContact O-N 3.13Å; L1384-Y1387 HydrophobicContact CD1-CD1 4.26Å; L1384-Y1387 WeakPolarHBondContact O-CB 3.38Å; L1384-Y1387 PolarHBondContact O-N 2.84Å; L1384-Y1387 VanDerWaalsContact O-N 3.08Å; L1384-L1388 HydrophobicContact CD1-CG 4.28Å; L1384-L1388 HydrophobicContact CD2-CD1 4.32Å; L1384-L1388 HydrophobicContact CG-CD1 3.93Å; L1384-L1388 HydrophobicContact CG-CG 4.16Å; L1384-L1388 WeakPolarHBondContact O-CG 2.9Å; L1384-L1388 PolarHBondContact O-N 2.88Å
1385	A	45.1	Very low	47.7	Very low	59 Å²	59	111.9 Å²	111.9	49%	0.488	57%	0.568	S	S	.	*	H	α-helix	trans	-61.9	-32.6	178	0	0	0	0	0	113.3	G1383 N1389	G1383-A1385 VanDerWaalsContact C-N 3.26Å; G1383-A1385 PolarHBondContact O-N 2.81Å; G1383-A1385 VanDerWaalsContact O-N 3.09Å; A1385-N1389 WeakPolarHBondContact O-CB 3.23Å; A1385-N1389 PolarHBondContact O-N 3.15Å; A1385-N1389 VanDerWaalsContact O-N 3.12Å
1386	R	46.9	Very low	49.7	Very low	153 Å²	153	106 Å²	106	58%	0.577	54%	0.535	S	S	*	.	H	α-helix	trans	-72.1	-40.5	172	-176.2	176.1	175.5	-170.5	-3.7	111	G1383 L1384 Q1390	G1383-R1386 PolarHBondContact O-N 3.37Å; L1384-R1386 VanDerWaalsContact C-N 3.28Å; L1384-R1386 PolarHBondContact O-N 3.13Å; R1386-Q1390 WeakPolarHBondContact O-CB 2.87Å; R1386-Q1390 PolarHBondContact O-N 2.97Å
1387	Y	52.7	Low	51	Low	143 Å²	143	104.7 Å²	104.7	56%	0.561	53%	0.526	S	S	*	.	H	α-helix	trans	-58.9	-54.4	175.6	178.4	-96.5	0	0	0	110.5	L1384 N1389 Q1390 T1391	L1384-Y1387 HydrophobicContact CD1-CD1 4.26Å; L1384-Y1387 WeakPolarHBondContact O-CB 3.38Å; L1384-Y1387 PolarHBondContact O-N 2.84Å; L1384-Y1387 VanDerWaalsContact O-N 3.08Å; Y1387-N1389 PolarHBondContact O-N 3.37Å; Y1387-Q1390 PolarHBondContact O-N 3.1Å; Y1387-Q1390 VanDerWaalsContact O-N 3.09Å; Y1387-T1391 WeakPolarHBondContact O-CB 3.4Å; Y1387-T1391 PolarHBondContact O-N 3.42Å; Y1387-T1391 PolarHBondContact O-OG1 3.02Å; Y1387-T1391 VanDerWaalsContact O-OG1 3.06Å
1388	L	56.5	Low	53.3	Low	99 Å²	99	100 Å²	100	52%	0.518	49%	0.493	S	S	.	.	H	α-helix	trans	-58.3	-44.2	179.8	-67.7	172.4	0	0	0	112.8	L1384 R1392	L1384-L1388 HydrophobicContact CD1-CG 4.28Å; L1384-L1388 HydrophobicContact CD2-CD1 4.32Å; L1384-L1388 HydrophobicContact CG-CD1 3.93Å; L1384-L1388 HydrophobicContact CG-CG 4.16Å; L1384-L1388 WeakPolarHBondContact O-CG 2.9Å; L1384-L1388 PolarHBondContact O-N 2.88Å; L1388-R1392 WeakPolarHBondContact O-CB 3.36Å; L1388-R1392 PolarHBondContact O-N 2.83Å
1389	N	57	Low	55.9	Low	89 Å²	89	96.6 Å²	96.6	48%	0.476	46%	0.462	S	S	.	.	H	α-helix	trans	-67.9	-36.1	175.3	-85.4	-24.2	0	0	0	113	A1385 Y1387 V1393	A1385-N1389 WeakPolarHBondContact O-CB 3.23Å; A1385-N1389 PolarHBondContact O-N 3.15Å; A1385-N1389 VanDerWaalsContact O-N 3.12Å; Y1387-N1389 PolarHBondContact O-N 3.37Å; N1389-V1393 WeakPolarHBondContact O-CB 3.45Å; N1389-V1393 VanDerWaalsContact O-CG2 3.28Å; N1389-V1393 WeakPolarHBondContact O-CG2 3.39Å; N1389-V1393 PolarHBondContact O-N 2.99Å
1390	Q	57.7	Low	58.8	Low	63 Å²	63	87.5 Å²	87.5	29%	0.294	42%	0.423	S	S	.	.	H	α-helix	trans	-68.1	-48.4	176.9	-165.7	80	64.8	0	0	110.4	R1386 Y1387 R1392 V1393 N1394 L1428	R1386-Q1390 WeakPolarHBondContact O-CB 2.87Å; R1386-Q1390 PolarHBondContact O-N 2.97Å; Y1387-Q1390 PolarHBondContact O-N 3.1Å; Y1387-Q1390 VanDerWaalsContact O-N 3.09Å; Q1390-R1392 VanDerWaalsContact C-N 3.34Å; Q1390-R1392 PolarHBondContact O-N 3.14Å; Q1390-V1393 PolarHBondContact O-N 3.36Å; Q1390-N1394 WeakPolarHBondContact O-CB 3.43Å; Q1390-N1394 PolarHBondContact O-N 3.41Å; Q1390-N1394 PolarHBondContact O-OD1 3.38Å; Q1390-L1428 HydrophobicContact CG-CD1 4.43Å
1391	T	61.1	Low	61.5	Low	25 Å²	25	76.2 Å²	76.2	15%	0.153	38%	0.38	C	S	.	.	H	α-helix	trans	-61.3	-41.1	175.5	-53.4	0	0	0	0	111.4	Y1387 N1394 L1395	Y1387-T1391 WeakPolarHBondContact O-CB 3.4Å; Y1387-T1391 PolarHBondContact O-N 3.42Å; Y1387-T1391 PolarHBondContact O-OG1 3.02Å; Y1387-T1391 VanDerWaalsContact O-OG1 3.06Å; T1391-N1394 PolarHBondContact O-N 3.5Å; T1391-L1395 HydrophobicContact CG2-CD1 4.3Å; T1391-L1395 WeakPolarHBondContact O-CB 3.2Å; T1391-L1395 PolarHBondContact O-N 3.36Å
1392	R	64.4	Low	64.3	Low	118 Å²	118	69.3 Å²	69.3	45%	0.445	35%	0.348	S	S	.	.	H	α-helix	trans	-64.9	-46.1	175.4	-165.3	178.5	84.1	144.3	7.7	112.1	L1388 Q1390 L1395 F1396	L1388-R1392 WeakPolarHBondContact O-CB 3.36Å; L1388-R1392 PolarHBondContact O-N 2.83Å; Q1390-R1392 VanDerWaalsContact C-N 3.34Å; Q1390-R1392 PolarHBondContact O-N 3.14Å; R1392-L1395 WeakPolarHBondContact O-CB 3.38Å; R1392-L1395 PolarHBondContact O-N 2.87Å; R1392-F1396 HydrophobicContact CG-CD2 4.03Å; R1392-F1396 HydrophobicContact CG-CE2 3.94Å; R1392-F1396 VanDerWaalsContact O-CD2 3.29Å; R1392-F1396 WeakPolarHBondContact O-CD2 3.38Å; R1392-F1396 PolarHBondContact O-N 3.3Å; R1392-F1396 VanDerWaalsContact O-N 3.13Å
1393	V	65.8	Low	67.1	Low	70 Å²	70	57.7 Å²	57.7	42%	0.424	30%	0.304	S	S	.	.	H	α-helix	trans	-61.2	-47	175.8	167.8	0	0	0	0	110.4	N1389 Q1390 L1395 F1396 T1397	N1389-V1393 WeakPolarHBondContact O-CB 3.45Å; N1389-V1393 VanDerWaalsContact O-CG2 3.28Å; N1389-V1393 WeakPolarHBondContact O-CG2 3.39Å; N1389-V1393 PolarHBondContact O-N 2.99Å; Q1390-V1393 PolarHBondContact O-N 3.36Å; V1393-L1395 VanDerWaalsContact C-N 3.33Å; V1393-L1395 PolarHBondContact O-N 2.95Å; V1393-F1396 PolarHBondContact O-N 2.97Å; V1393-T1397 HydrophobicContact CG1-CG2 4.29Å; V1393-T1397 WeakPolarHBondContact O-CG2 3.31Å; V1393-T1397 PolarHBondContact O-N 3.13Å; V1393-T1397 PolarHBondContact O-OG1 2.91Å; V1393-T1397 VanDerWaalsContact O-OG1 3.05Å
1394	N	68.8	Low	69.3	Low	19 Å²	19	55.5 Å²	55.5	10%	0.102	28%	0.28	C	S	.	.	H	α-helix	trans	-59.4	-41	177.4	-68.3	15.9	0	0	0	111.9	Q1390 T1391 F1396 T1397 A1398	Q1390-N1394 WeakPolarHBondContact O-CB 3.43Å; Q1390-N1394 PolarHBondContact O-N 3.41Å; Q1390-N1394 PolarHBondContact O-OD1 3.38Å; T1391-N1394 PolarHBondContact O-N 3.5Å; N1394-F1396 VanDerWaalsContact C-N 3.32Å; N1394-F1396 PolarHBondContact O-N 3.22Å; N1394-T1397 PolarHBondContact O-N 3.27Å; N1394-A1398 WeakPolarHBondContact O-CB 3.42Å; N1394-A1398 PolarHBondContact O-N 3.4Å
1395	L	73.4	Confident	71.6	Confident	29 Å²	29	49.6 Å²	49.6	15%	0.152	25%	0.249	C	C	.	.	H	α-helix	trans	-57.4	-40.2	172.8	-95.3	158.9	0	0	0	112.7	T1391 R1392 V1393 W1400 I1421 V1435	T1391-L1395 HydrophobicContact CG2-CD1 4.3Å; T1391-L1395 WeakPolarHBondContact O-CB 3.2Å; T1391-L1395 PolarHBondContact O-N 3.36Å; R1392-L1395 WeakPolarHBondContact O-CB 3.38Å; R1392-L1395 PolarHBondContact O-N 2.87Å; V1393-L1395 VanDerWaalsContact C-N 3.33Å; V1393-L1395 PolarHBondContact O-N 2.95Å; L1395-W1400 HydrophobicContact CD2-CZ2 3.88Å; L1395-W1400 PolarHBondContact O-NE1 3.26Å; L1395-I1421 HydrophobicContact CD2-CD1 3.52Å; L1395-I1421 HydrophobicContact CG-CD1 3.77Å; L1395-V1435 HydrophobicContact CD2-CG2 3.98Å
1396	F	73	Confident	73.6	Confident	30 Å²	30	47.4 Å²	47.4	13%	0.132	23%	0.229	C	C	.	.	H	α-helix	trans	-83.1	-14.9	179.1	-81.1	-75.2	0	0	0	114.7	R1392 V1393 N1394 V1539 F1544 F1558	R1392-F1396 HydrophobicContact CG-CD2 4.03Å; R1392-F1396 HydrophobicContact CG-CE2 3.94Å; R1392-F1396 VanDerWaalsContact O-CD2 3.29Å; R1392-F1396 WeakPolarHBondContact O-CD2 3.38Å; R1392-F1396 PolarHBondContact O-N 3.3Å; R1392-F1396 VanDerWaalsContact O-N 3.13Å; V1393-F1396 PolarHBondContact O-N 2.97Å; N1394-F1396 VanDerWaalsContact C-N 3.32Å; N1394-F1396 PolarHBondContact O-N 3.22Å; F1396-V1539 HydrophobicContact CD1-CB 4.15Å; F1396-V1539 HydrophobicContact CD1-CG1 3.76Å; F1396-V1539 HydrophobicContact CD1-CG2 4.24Å; F1396-V1539 HydrophobicContact CE1-CG1 3.94Å; F1396-F1544 HydrophobicContact CB-CD2 3.49Å; F1396-F1544 VanDerWaalsContact CB-CD2 3.49Å; F1396-F1544 HydrophobicContact CB-CE2 3.53Å; F1396-F1544 HydrophobicContact CB-CG 4.31Å; F1396-F1544 HydrophobicContact CB-CZ 4.38Å; F1396-F1544 HydrophobicContact CD1-CB 4.33Å; F1396-F1544 AromaticContact CD1-CD2 3.62Å; F1396-F1544 HydrophobicContact CD1-CD2 3.62Å; F1396-F1544 HydrophobicContact CD1-CE2 4.39Å; F1396-F1544 HydrophobicContact CD1-CG 4.37Å; F1396-F1544 HydrophobicContact CD2-CD2 4.33Å; F1396-F1544 HydrophobicContact CD2-CE2 4.36Å; F1396-F1544 HydrophobicContact CE1-CD2 4.44Å; F1396-F1544 AromaticContact CG-CD2 3.56Å; F1396-F1544 HydrophobicContact CG-CD2 3.56Å; F1396-F1544 AromaticContact CG-CE2 3.87Å; F1396-F1544 HydrophobicContact CG-CE2 3.87Å; F1396-F1558 HydrophobicContact CD1-CE1 4.4Å; F1396-F1558 AromaticContact CE1-CE1 3.65Å; F1396-F1558 HydrophobicContact CE1-CE1 3.65Å; F1396-F1558 HydrophobicContact CE1-CZ 4.13Å; F1396-F1558 HydrophobicContact CE2-CZ 4.5Å; F1396-F1558 AromaticContact CZ-CE1 3.86Å; F1396-F1558 HydrophobicContact CZ-CE1 3.86Å; F1396-F1558 AromaticContact CZ-CZ 3.92Å; F1396-F1558 HydrophobicContact CZ-CZ 3.92Å
1397	T	72.7	Confident	75.5	Confident	90 Å²	90	40.6 Å²	40.6	55%	0.552	21%	0.205	S	C	*	.	H	α-helix	trans	-117	-16.7	-174.4	62.9	0	0	0	0	115.8	V1393 N1394	V1393-T1397 HydrophobicContact CG1-CG2 4.29Å; V1393-T1397 WeakPolarHBondContact O-CG2 3.31Å; V1393-T1397 PolarHBondContact O-N 3.13Å; V1393-T1397 PolarHBondContact O-OG1 2.91Å; V1393-T1397 VanDerWaalsContact O-OG1 3.05Å; N1394-T1397 PolarHBondContact O-N 3.27Å
1398	A	79.4	Confident	76.9	Confident	13 Å²	13	35.3 Å²	35.3	11%	0.107	19%	0.186	C	C	.	.	S	Bend	trans	-94.9	159	-178.6	0	0	0	0	0	112.6	N1394 I1421	N1394-A1398 WeakPolarHBondContact O-CB 3.42Å; N1394-A1398 PolarHBondContact O-N 3.4Å; A1398-I1421 HydrophobicContact CB-CG2 3.63Å
1399	V	83.3	Confident	77.6	Confident	34 Å²	34	35.6 Å²	35.6	21%	0.206	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-73.1	129.3	168.9	-175	0	0	0	0	109	L1536 T1538 C1566 H1571	V1399-L1536 HydrophobicContact CG1-CD2 4.01Å; V1399-T1538 HydrophobicContact CB-CG2 4.33Å; V1399-T1538 HydrophobicContact CG2-CG2 3.94Å; V1399-C1566 HydrophobicContact CG1-CB 4.41Å; V1399-H1571 HydrophobicContact CG1-CB 4.32Å
1400	W	89.2	Confident	78.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	124.3	175.3	-63.1	7.7	0	0	0	109.1	L1395 V1419 V1435 L1536 C1537 V1539 F1558 L1563	L1395-W1400 HydrophobicContact CD2-CZ2 3.88Å; L1395-W1400 PolarHBondContact O-NE1 3.26Å; W1400-V1419 HydrophobicContact CB-CB 4.19Å; W1400-V1419 HydrophobicContact CB-CG1 3.95Å; W1400-V1419 HydrophobicContact CD2-CG1 4.31Å; W1400-V1419 HydrophobicContact CE3-CG1 3.96Å; W1400-V1419 HydrophobicContact CG-CB 4.46Å; W1400-V1419 HydrophobicContact CG-CG1 4.36Å; W1400-V1435 HydrophobicContact CH2-CG1 3.86Å; W1400-V1435 HydrophobicContact CZ3-CG1 4.09Å; W1400-L1536 WeakPolarHBondContact O-CA 3.34Å; W1400-C1537 PolarHBondContact N-O 3.03Å; W1400-C1537 PolarHBondContact O-N 2.86Å; W1400-V1539 HydrophobicContact CH2-CG2 3.92Å; W1400-V1539 HydrophobicContact CZ2-CG2 3.34Å; W1400-F1558 HydrophobicContact CH2-CD1 4.28Å; W1400-F1558 HydrophobicContact CH2-CD2 4.13Å; W1400-F1558 HydrophobicContact CH2-CE1 4.16Å; W1400-F1558 HydrophobicContact CH2-CE2 4.02Å; W1400-F1558 HydrophobicContact CH2-CG 4.26Å; W1400-F1558 HydrophobicContact CH2-CZ 4.03Å; W1400-F1558 HydrophobicContact CZ2-CE1 4.37Å; W1400-F1558 HydrophobicContact CZ2-CE2 4.47Å; W1400-F1558 HydrophobicContact CZ2-CZ 4.14Å; W1400-L1563 HydrophobicContact CE3-CD1 4.5Å; W1400-L1563 HydrophobicContact CE3-CD2 4.39Å; W1400-L1563 HydrophobicContact CH2-CD2 3.91Å; W1400-L1563 HydrophobicContact CZ3-CD1 3.94Å; W1400-L1563 HydrophobicContact CZ3-CD2 3.8Å
1401	Q	89.4	Confident	79.2	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.009	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	103.2	169.8	-54	-176	55.6	0	0	108	I1403 V1419 L1420 N1422 L1536 H1571 Y1573 L1574	Q1401-I1403 PolarHBondContact O-N 2.64Å; Q1401-V1419 WeakPolarHBondContact O-CA 3.34Å; Q1401-L1420 HydrophobicContact CB-CB 4.29Å; Q1401-L1420 PolarHBondContact N-O 3.04Å; Q1401-L1420 PolarHBondContact O-N 2.89Å; Q1401-N1422 PolarHBondContact NE2-ND2 2.74Å; Q1401-L1536 HydrophobicContact CB-CD2 4.25Å; Q1401-L1536 HydrophobicContact CG-CD2 3.71Å; Q1401-H1571 PolarHBondContact NE2-CE1 3.09Å; Q1401-Y1573 HydrophobicContact CB-CD2 4.3Å; Q1401-Y1573 HydrophobicContact CB-CE2 4.41Å; Q1401-L1574 HydrophobicContact CB-CD2 4.31Å
1402	V	91.9	Very high	79.8	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	115.1	-174.7	-171.3	0	0	0	0	108.9	I1405 L1417 V1419 C1535 Y1573 P1814	V1402-I1405 HydrophobicContact CG1-CD1 4.22Å; V1402-I1405 HydrophobicContact CG1-CG1 3.77Å; V1402-L1417 HydrophobicContact CG1-CD2 4.13Å; V1402-L1417 HydrophobicContact CG1-CG 4.38Å; V1402-L1417 HydrophobicContact CG2-CD2 4.38Å; V1402-V1419 HydrophobicContact CB-CG1 4.42Å; V1402-V1419 HydrophobicContact CG2-CG1 3.97Å; V1402-C1535 PolarHBondContact N-O 2.65Å; V1402-Y1573 WeakPolarHBondContact O-CE2 3.38Å; V1402-Y1573 PolarHBondContact O-OH 2.74Å; V1402-P1814 HydrophobicContact CB-CB 4.31Å; V1402-P1814 HydrophobicContact CB-CG 3.9Å; V1402-P1814 HydrophobicContact CG1-CB 3.97Å; V1402-P1814 HydrophobicContact CG1-CG 3.6Å; V1402-P1814 WeakPolarHBondContact O-CB 3.43Å
1403	I	90.7	Very high	80.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-45.3	178.4	-55.1	-179.4	0	0	0	110.1	Q1401 W1418 L1420 L1432 L1579 V1707 P1752 I1754 P1814 V1815 G1816	Q1401-I1403 PolarHBondContact O-N 2.64Å; I1403-W1418 HydrophobicContact CB-CB 4.48Å; I1403-W1418 PolarHBondContact N-O 2.91Å; I1403-L1420 HydrophobicContact CD1-CB 4.29Å; I1403-L1432 HydrophobicContact CD1-CD1 3.82Å; I1403-L1579 HydrophobicContact CD1-CD1 3.96Å; I1403-L1579 HydrophobicContact CD1-CD2 4.15Å; I1403-V1707 HydrophobicContact CD1-CG2 4.14Å; I1403-P1752 HydrophobicContact CB-CB 4.4Å; I1403-P1752 HydrophobicContact CD1-CG 4.46Å; I1403-P1752 HydrophobicContact CG2-CB 3.98Å; I1403-I1754 HydrophobicContact CG2-CD1 4.23Å; I1403-I1754 HydrophobicContact CG2-CG1 4.38Å; I1403-P1814 WeakPolarHBondContact O-CB 3.3Å; I1403-V1815 HydrophobicContact CG2-CG1 4.22Å; I1403-V1815 PolarHBondContact O-N 3.45Å; I1403-G1816 PolarHBondContact O-N 3.45Å
1404	E	91.8	Very high	81.5	Confident	5 Å²	5	33.3 Å²	33.3	2%	0.023	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	144.4	-174.7	-170.3	-169.3	169.4	0	0	110.6	V1406 W1418 R1740 P1752 V1753 N1817	E1404-V1406 HydrophobicContact CG-CG2 3.97Å; E1404-V1406 WeakPolarHBondContact OE1-CG2 3.4Å; E1404-W1418 PolarHBondContact O-N 2.91Å; E1404-R1740 IonicContact OE1-CZ 3.51Å; E1404-R1740 VanDerWaalsContact OE1-CZ 3.3Å; E1404-R1740 IonicContact OE1-NE 3.99Å; E1404-R1740 PolarHBondContact OE1-NE 3.28Å; E1404-R1740 IonicContact OE1-NH2 3.43Å; E1404-R1740 PolarHBondContact OE1-NH2 2.86Å; E1404-R1740 IonicContact OE2-CZ 3.45Å; E1404-R1740 IonicContact OE2-NE 3.81Å; E1404-R1740 IonicContact OE2-NH2 2.76Å; E1404-R1740 PolarHBondContact OE2-NH2 2.81Å; E1404-P1752 WeakPolarHBondContact OE2-CA 3.28Å; E1404-V1753 PolarHBondContact OE2-N 3.31Å; E1404-N1817 WeakPolarHBondContact CA-OD1 3.44Å
1405	I	92.3	Very high	82.5	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.1	173.1	-48.8	-168.5	0	0	0	107.7	V1402 Y1415 L1417 L1526 I1529 L1530 P1814 N1817	V1402-I1405 HydrophobicContact CG1-CD1 4.22Å; V1402-I1405 HydrophobicContact CG1-CG1 3.77Å; I1405-Y1415 HydrophobicContact CG2-CD1 3.98Å; I1405-Y1415 HydrophobicContact CG2-CG 4.43Å; I1405-L1417 HydrophobicContact CD1-CD2 4.41Å; I1405-L1417 HydrophobicContact CD1-CG 4.41Å; I1405-L1417 HydrophobicContact CG1-CD2 4.5Å; I1405-L1417 HydrophobicContact CG1-CG 4.07Å; I1405-L1417 HydrophobicContact CG2-CD1 3.85Å; I1405-L1417 HydrophobicContact CG2-CG 4.26Å; I1405-L1526 HydrophobicContact CB-CD1 4.33Å; I1405-L1526 HydrophobicContact CG2-CD1 3.95Å; I1405-I1529 HydrophobicContact CD1-CG2 3.56Å; I1405-I1529 HydrophobicContact CG2-CD1 4.29Å; I1405-L1530 HydrophobicContact CD1-CD2 4.17Å; I1405-P1814 HydrophobicContact CD1-CG 3.98Å; I1405-P1814 HydrophobicContact CG1-CG 3.94Å; I1405-N1817 PolarHBondContact N-OD1 3.34Å; I1405-N1817 PolarHBondContact O-ND2 3.34Å
1406	V	88.4	Confident	83.3	Confident	14 Å²	14	32.9 Å²	32.9	9%	0.085	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	123.9	-173.3	-170.8	0	0	0	0	109.3	E1404 Y1415 T1416	E1404-V1406 HydrophobicContact CG-CG2 3.97Å; E1404-V1406 WeakPolarHBondContact OE1-CG2 3.4Å; V1406-Y1415 CarbonylContact O-C 3.57Å; V1406-Y1415 VanDerWaalsContact O-CA 3.25Å; V1406-Y1415 WeakPolarHBondContact O-CA 3.48Å; V1406-T1416 PolarHBondContact N-O 2.84Å; V1406-T1416 PolarHBondContact O-N 2.85Å
1407	P	87	Confident	84.1	Confident	10 Å²	10	31.5 Å²	31.5	7%	0.065	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	133.8	170.9	29.1	-35.4	0	0	0	110.5	P1409 Y1415 N1733 I1737	P1407-P1409 WeakPolarHBondContact O-CD 3.2Å; P1407-Y1415 HydrophobicContact CB-CD1 4Å; P1407-Y1415 HydrophobicContact CB-CE1 3.7Å; P1407-N1733 WeakPolarHBondContact CG-OD1 3.44Å; P1407-I1737 HydrophobicContact CB-CD1 4.46Å; P1407-I1737 HydrophobicContact CG-CD1 3.78Å; P1407-I1737 HydrophobicContact CG-CG1 3.57Å
1408	D	80.7	Confident	85	Confident	32 Å²	32	28.4 Å²	28.4	17%	0.171	17%	0.172	C	C	.	.			trans	-78.8	118	-177.2	-65.3	-38.2	0	0	0	110.5	G1410 Q1411 H1414 Y1415 T1416	D1408-G1410 PolarHBondContact O-N 3.49Å; D1408-Q1411 HydrophobicContact CB-CB 4.49Å; D1408-Q1411 PolarHBondContact O-N 3.2Å; D1408-H1414 HydrophobicContact CB-CB 4.06Å; D1408-H1414 PolarHBondContact N-O 3.38Å; D1408-H1414 VanDerWaalsContact OD2-C 3.29Å; D1408-Y1415 WeakPolarHBondContact OD2-CA 3.38Å; D1408-Y1415 PolarHBondContact OD2-N 3.33Å; D1408-T1416 PolarHBondContact OD1-N 2.76Å; D1408-T1416 PolarHBondContact OD1-OG1 3.01Å; D1408-T1416 PolarHBondContact OD2-N 3.46Å
1409	P	71.9	Confident	85.5	Confident	104 Å²	104	27.8 Å²	27.8	68%	0.675	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	100	-162.6	26.7	-35.3	0	0	0	112.5	P1407	P1407-P1409 WeakPolarHBondContact O-CD 3.2Å
1410	G	71.9	Confident	85.6	Confident	79 Å²	79	26.2 Å²	26.2	81%	0.814	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	109	4.4	-178.8	0	0	0	0	0	114.7	D1408	D1408-G1410 PolarHBondContact O-N 3.49Å
1411	Q	75.3	Confident	85.2	Confident	118 Å²	118	26.4 Å²	26.4	55%	0.551	16%	0.159	S	C	*	.			trans	-124.1	92.1	173.7	-67.8	-173	-10.8	0	0	109.9	D1408 G1413 H1414	D1408-Q1411 HydrophobicContact CB-CB 4.49Å; D1408-Q1411 PolarHBondContact O-N 3.2Å; Q1411-G1413 PolarHBondContact O-N 3.29Å; Q1411-H1414 HydrophobicContact CB-CB 3.84Å; Q1411-H1414 PolarHBondContact O-N 2.9Å; Q1411-H1414 VanDerWaalsContact O-N 3.1Å
1412	I	74.2	Confident	84.3	Confident	53 Å²	53	28.4 Å²	28.4	27%	0.272	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	130.4	-179.2	-47.9	179.7	0	0	0	108.8	H1414 E1496 T1500 E1727	I1412-H1414 VanDerWaalsContact C-N 3.35Å; I1412-E1496 HydrophobicContact CB-CG 4.13Å; I1412-E1496 HydrophobicContact CG2-CG 3.74Å; I1412-E1496 WeakPolarHBondContact O-CG 3.21Å; I1412-T1500 HydrophobicContact CD1-CG2 4.45Å; I1412-E1727 HydrophobicContact CD1-CB 4.42Å
1413	G	81.1	Confident	83	Confident	3 Å²	3	29.9 Å²	29.9	3%	0.031	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.1	-5.2	-177.8	0	0	0	0	0	115.5	Q1411 V1439	Q1411-G1413 PolarHBondContact O-N 3.29Å; G1413-V1439 PolarHBondContact O-N 3.37Å
1414	H	85.3	Confident	81.4	Confident	65 Å²	65	35.1 Å²	35.1	30%	0.301	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134.6	174.3	-71.5	-113.1	0	0	0	111.3	D1408 Q1411 I1412 I1437	D1408-H1414 HydrophobicContact CB-CB 4.06Å; D1408-H1414 PolarHBondContact N-O 3.38Å; D1408-H1414 VanDerWaalsContact OD2-C 3.29Å; Q1411-H1414 HydrophobicContact CB-CB 3.84Å; Q1411-H1414 PolarHBondContact O-N 2.9Å; Q1411-H1414 VanDerWaalsContact O-N 3.1Å; I1412-H1414 VanDerWaalsContact C-N 3.35Å; H1414-I1437 WeakPolarHBondContact CA-O 3.45Å
1415	Y	90.2	Very high	79.4	Confident	13 Å²	13	44.2 Å²	44.2	5%	0.051	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	126.7	-177.5	-67	-97.5	0	0	0	112.1	I1405 V1406 P1407 D1408 I1437 V1439 L1526 I1529	I1405-Y1415 HydrophobicContact CG2-CD1 3.98Å; I1405-Y1415 HydrophobicContact CG2-CG 4.43Å; V1406-Y1415 CarbonylContact O-C 3.57Å; V1406-Y1415 VanDerWaalsContact O-CA 3.25Å; V1406-Y1415 WeakPolarHBondContact O-CA 3.48Å; P1407-Y1415 HydrophobicContact CB-CD1 4Å; P1407-Y1415 HydrophobicContact CB-CE1 3.7Å; D1408-Y1415 WeakPolarHBondContact OD2-CA 3.38Å; D1408-Y1415 PolarHBondContact OD2-N 3.33Å; Y1415-I1437 PolarHBondContact N-O 3.19Å; Y1415-I1437 PolarHBondContact O-N 3.33Å; Y1415-V1439 HydrophobicContact CD2-CG2 4.04Å; Y1415-V1439 HydrophobicContact CE2-CG2 4.23Å; Y1415-L1526 HydrophobicContact CD1-CD1 4.27Å; Y1415-L1526 HydrophobicContact CE1-CB 3.95Å; Y1415-L1526 HydrophobicContact CE1-CD1 3.91Å; Y1415-L1526 HydrophobicContact CE1-CG 4.45Å; Y1415-L1526 PolarHBondContact OH-N 3.05Å; Y1415-I1529 HydrophobicContact CD1-CD1 3.81Å; Y1415-I1529 HydrophobicContact CD2-CD1 3.5Å; Y1415-I1529 HydrophobicContact CE1-CD1 4.06Å; Y1415-I1529 HydrophobicContact CE2-CD1 3.79Å; Y1415-I1529 HydrophobicContact CG-CD1 3.54Å
1416	T	89.8	Confident	77.4	Confident	26 Å²	26	46.9 Å²	46.9	16%	0.16	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	123	167.6	-62.1	0	0	0	0	110.5	V1406 D1408 A1434	V1406-T1416 PolarHBondContact N-O 2.84Å; V1406-T1416 PolarHBondContact O-N 2.85Å; D1408-T1416 PolarHBondContact OD1-N 2.76Å; D1408-T1416 PolarHBondContact OD1-OG1 3.01Å; D1408-T1416 PolarHBondContact OD2-N 3.46Å; T1416-A1434 HydrophobicContact CG2-CB 4.04Å
1417	L	90.6	Very high	75.6	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.7	171	-83.8	70.9	0	0	0	111.7	V1402 I1405 V1419 A1434 V1435 I1437	V1402-L1417 HydrophobicContact CG1-CD2 4.13Å; V1402-L1417 HydrophobicContact CG1-CG 4.38Å; V1402-L1417 HydrophobicContact CG2-CD2 4.38Å; I1405-L1417 HydrophobicContact CD1-CD2 4.41Å; I1405-L1417 HydrophobicContact CD1-CG 4.41Å; I1405-L1417 HydrophobicContact CG1-CD2 4.5Å; I1405-L1417 HydrophobicContact CG1-CG 4.07Å; I1405-L1417 HydrophobicContact CG2-CD1 3.85Å; I1405-L1417 HydrophobicContact CG2-CG 4.26Å; L1417-V1419 HydrophobicContact CB-CG1 4.34Å; L1417-A1434 CarbonylContact O-C 3.59Å; L1417-A1434 WeakPolarHBondContact O-CA 3.46Å; L1417-V1435 PolarHBondContact N-O 3.46Å; L1417-V1435 PolarHBondContact O-N 3.34Å; L1417-I1437 HydrophobicContact CD1-CB 4Å; L1417-I1437 HydrophobicContact CD1-CD1 3.56Å; L1417-I1437 HydrophobicContact CD1-CG1 3.79Å; L1417-I1437 HydrophobicContact CD2-CD1 3.53Å; L1417-I1437 HydrophobicContact CG-CD1 4.1Å
1418	W	91	Very high	73.9	Confident	26 Å²	26	53.7 Å²	53.7	10%	0.098	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	105.5	170.7	-69.3	95.7	0	0	0	110.3	I1403 E1404 L1432 A1434 S1749 G1750 P1752	I1403-W1418 HydrophobicContact CB-CB 4.48Å; I1403-W1418 PolarHBondContact N-O 2.91Å; E1404-W1418 PolarHBondContact O-N 2.91Å; W1418-L1432 HydrophobicContact CE3-CD1 4.29Å; W1418-L1432 HydrophobicContact CE3-CD2 4.35Å; W1418-L1432 HydrophobicContact CE3-CG 4.22Å; W1418-A1434 HydrophobicContact CE3-CB 4.27Å; W1418-A1434 HydrophobicContact CH2-CB 4.11Å; W1418-A1434 HydrophobicContact CZ2-CB 4.39Å; W1418-A1434 HydrophobicContact CZ3-CB 4.05Å; W1418-S1749 WeakPolarHBondContact CZ2-O 3.43Å; W1418-G1750 VanDerWaalsContact CH2-C 3.42Å; W1418-G1750 WeakPolarHBondContact CH2-O 3.24Å; W1418-P1752 HydrophobicContact CB-CB 3.93Å; W1418-P1752 HydrophobicContact CD2-CB 4.22Å; W1418-P1752 HydrophobicContact CE3-CG 4.45Å; W1418-P1752 HydrophobicContact CG-CB 3.88Å
1419	V	88.9	Confident	72.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.9	-175	-71.3	0	0	0	0	112.6	W1400 Q1401 V1402 L1417 N1433 V1435	W1400-V1419 HydrophobicContact CB-CB 4.19Å; W1400-V1419 HydrophobicContact CB-CG1 3.95Å; W1400-V1419 HydrophobicContact CD2-CG1 4.31Å; W1400-V1419 HydrophobicContact CE3-CG1 3.96Å; W1400-V1419 HydrophobicContact CG-CB 4.46Å; W1400-V1419 HydrophobicContact CG-CG1 4.36Å; Q1401-V1419 WeakPolarHBondContact O-CA 3.34Å; V1402-V1419 HydrophobicContact CB-CG1 4.42Å; V1402-V1419 HydrophobicContact CG2-CG1 3.97Å; L1417-V1419 HydrophobicContact CB-CG1 4.34Å; V1419-N1433 HydrophobicContact CG2-CB 4.28Å; V1419-N1433 PolarHBondContact N-O 3.07Å; V1419-N1433 PolarHBondContact O-N 2.86Å; V1419-V1435 HydrophobicContact CG2-CB 4.44Å; V1419-V1435 HydrophobicContact CG2-CG2 3.67Å
1420	L	86.8	Confident	72.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	125.9	169	-177.2	72.1	0	0	0	109.4	Q1401 I1403 P1430 L1574 L1579 P1705	Q1401-L1420 HydrophobicContact CB-CB 4.29Å; Q1401-L1420 PolarHBondContact N-O 3.04Å; Q1401-L1420 PolarHBondContact O-N 2.89Å; I1403-L1420 HydrophobicContact CD1-CB 4.29Å; L1420-P1430 HydrophobicContact CD1-CB 3.99Å; L1420-L1574 HydrophobicContact CD2-CD2 3.84Å; L1420-L1579 HydrophobicContact CD1-CD2 4.04Å; L1420-L1579 HydrophobicContact CD2-CD2 3.96Å; L1420-L1579 HydrophobicContact CD2-CG 4.29Å; L1420-P1705 HydrophobicContact CD1-CG 3.76Å
1421	I	80.6	Confident	72.7	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	110.2	178.5	-58.9	-178.9	0	0	0	109	L1395 A1398 S1431	L1395-I1421 HydrophobicContact CD2-CD1 3.52Å; L1395-I1421 HydrophobicContact CG-CD1 3.77Å; A1398-I1421 HydrophobicContact CB-CG2 3.63Å; I1421-S1431 PolarHBondContact N-O 2.74Å; I1421-S1431 PolarHBondContact O-N 3.17Å; I1421-S1431 VanDerWaalsContact O-N 3.1Å
1422	N	70.8	Confident	72.9	Confident	43 Å²	43	47.7 Å²	47.7	23%	0.23	28%	0.282	C	S	.	.			trans	-98.3	129.4	171.1	-72.3	-7.4	0	0	0	109.2	Q1401 P1430	Q1401-N1422 PolarHBondContact NE2-ND2 2.74Å; N1422-P1430 VanDerWaalsContact OD1-CB 3.26Å; N1422-P1430 WeakPolarHBondContact OD1-CB 3.41Å; N1422-P1430 WeakPolarHBondContact OD1-CG 3.13Å
1423	S	63.4	Low	73.2	Confident	31 Å²	31	46.5 Å²	46.5	22%	0.217	28%	0.276	C	S	.	.			trans	-126.7	74.8	174	-169.5	0	0	0	0	109.3	E1425 S1426	S1423-E1425 VanDerWaalsContact C-N 3.28Å; S1423-E1425 PolarHBondContact O-N 3.16Å; S1423-S1426 WeakPolarHBondContact O-CB 3.48Å; S1423-S1426 PolarHBondContact O-N 2.65Å; S1423-S1426 WeakPolarHBondContact OG-CB 3.3Å
1424	P	56.6	Low	73.4	Confident	110 Å²	110	48.8 Å²	48.8	71%	0.714	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-60.4	-36.8	-170.9	23	-33.2	0	0	0	112.5	S1426 G1427	P1424-S1426 PolarHBondContact O-N 3.39Å; P1424-G1427 PolarHBondContact O-N 3.06Å
1425	E	51.7	Low	73.3	Confident	197 Å²	197	46.1 Å²	46.1	92%	0.921	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-61.5	-25.1	175.5	-60.1	-174.7	168.8	0	0	113.7	S1423	S1423-E1425 VanDerWaalsContact C-N 3.28Å; S1423-E1425 PolarHBondContact O-N 3.16Å
1426	S	50.4	Low	73.2	Confident	56 Å²	56	49.2 Å²	49.2	39%	0.392	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-86.7	-11.8	-176.4	-163.7	0	0	0	0	113.4	S1423 P1424 L1428	S1423-S1426 WeakPolarHBondContact O-CB 3.48Å; S1423-S1426 PolarHBondContact O-N 2.65Å; S1423-S1426 WeakPolarHBondContact OG-CB 3.3Å; P1424-S1426 PolarHBondContact O-N 3.39Å; S1426-L1428 PolarHBondContact O-N 3.33Å; S1426-L1428 WeakPolarHBondContact OG-CD1 3.45Å
1427	G	50.6	Low	73.1	Confident	74 Å²	74	48 Å²	48	76%	0.763	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	19.9	-173.2	0	0	0	0	0	113.9	P1424	P1424-G1427 PolarHBondContact O-N 3.06Å
1428	L	50.4	Low	72.9	Confident	93 Å²	93	49.3 Å²	49.3	49%	0.487	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-91.8	146.8	178.8	-71.9	174.3	0	0	0	111	Q1390 S1426	Q1390-L1428 HydrophobicContact CG-CD1 4.43Å; S1426-L1428 PolarHBondContact O-N 3.33Å; S1426-L1428 WeakPolarHBondContact OG-CD1 3.45Å
1429	V	58.6	Low	72.7	Confident	87 Å²	87	48.4 Å²	48.4	53%	0.527	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-60.6	139.2	173.5	-178.2	0	0	0	0	109.9	S1431 A1703	V1429-S1431 PolarHBondContact O-N 2.74Å; V1429-A1703 HydrophobicContact CG1-CB 3.83Å; V1429-A1703 WeakPolarHBondContact CG1-O 3.39Å; V1429-A1703 HydrophobicContact CG2-CB 4.21Å
1430	P	66.4	Low	72.6	Confident	44 Å²	44	49.3 Å²	49.3	29%	0.286	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-46.4	125.8	171.6	-33.1	38.5	0	0	0	113.2	L1420 N1422 P1705	L1420-P1430 HydrophobicContact CD1-CB 3.99Å; N1422-P1430 VanDerWaalsContact OD1-CB 3.26Å; N1422-P1430 WeakPolarHBondContact OD1-CB 3.41Å; N1422-P1430 WeakPolarHBondContact OD1-CG 3.13Å; P1430-P1705 HydrophobicContact CB-CG 4.36Å
1431	S	73.1	Confident	72.6	Confident	32 Å²	32	49.8 Å²	49.8	22%	0.224	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	121.4	178.1	69.1	0	0	0	0	111.3	I1421 V1429 N1433	I1421-S1431 PolarHBondContact N-O 2.74Å; I1421-S1431 PolarHBondContact O-N 3.17Å; I1421-S1431 VanDerWaalsContact O-N 3.1Å; V1429-S1431 PolarHBondContact O-N 2.74Å; S1431-N1433 PolarHBondContact O-ND2 3.16Å; S1431-N1433 PolarHBondContact OG-ND2 2.88Å
1432	L	81.5	Confident	72.9	Confident	43 Å²	43	50.7 Å²	50.7	23%	0.225	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	126.6	168.5	177.9	65.3	0	0	0	108.5	I1403 W1418 P1705 P1752	I1403-L1432 HydrophobicContact CD1-CD1 3.82Å; W1418-L1432 HydrophobicContact CE3-CD1 4.29Å; W1418-L1432 HydrophobicContact CE3-CD2 4.35Å; W1418-L1432 HydrophobicContact CE3-CG 4.22Å; L1432-P1705 HydrophobicContact CB-CB 3.91Å; L1432-P1705 HydrophobicContact CB-CG 4.35Å; L1432-P1705 HydrophobicContact CD2-CB 4.45Å; L1432-P1752 HydrophobicContact CD2-CG 3.9Å
1433	N	80.2	Confident	73.9	Confident	28 Å²	28	48.7 Å²	48.7	15%	0.15	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.9	179.3	-54	-91.7	0	0	0	109.6	V1419 S1431 V1435	V1419-N1433 HydrophobicContact CG2-CB 4.28Å; V1419-N1433 PolarHBondContact N-O 3.07Å; V1419-N1433 PolarHBondContact O-N 2.86Å; S1431-N1433 PolarHBondContact O-ND2 3.16Å; S1431-N1433 PolarHBondContact OG-ND2 2.88Å; N1433-V1435 HydrophobicContact CB-CG2 4.42Å
1434	A	84.1	Confident	75.2	Confident	52 Å²	52	48.5 Å²	48.5	43%	0.43	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	135.8	161.5	0	0	0	0	0	108.1	T1416 L1417 W1418	T1416-A1434 HydrophobicContact CG2-CB 4.04Å; L1417-A1434 CarbonylContact O-C 3.59Å; L1417-A1434 WeakPolarHBondContact O-CA 3.46Å; W1418-A1434 HydrophobicContact CE3-CB 4.27Å; W1418-A1434 HydrophobicContact CH2-CB 4.11Å; W1418-A1434 HydrophobicContact CZ2-CB 4.39Å; W1418-A1434 HydrophobicContact CZ3-CB 4.05Å
1435	V	84.5	Confident	76.8	Confident	9 Å²	9	43.3 Å²	43.3	6%	0.055	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	124.8	-178.3	179.7	0	0	0	0	109.6	L1395 W1400 L1417 V1419 N1433 F1558	L1395-V1435 HydrophobicContact CD2-CG2 3.98Å; W1400-V1435 HydrophobicContact CH2-CG1 3.86Å; W1400-V1435 HydrophobicContact CZ3-CG1 4.09Å; L1417-V1435 PolarHBondContact N-O 3.46Å; L1417-V1435 PolarHBondContact O-N 3.34Å; V1419-V1435 HydrophobicContact CG2-CB 4.44Å; V1419-V1435 HydrophobicContact CG2-CG2 3.67Å; N1433-V1435 HydrophobicContact CB-CG2 4.42Å; V1435-F1558 HydrophobicContact CG1-CD2 3.48Å; V1435-F1558 VanDerWaalsContact CG1-CD2 3.48Å; V1435-F1558 HydrophobicContact CG1-CE2 3.67Å
1436	D	87.1	Confident	78.6	Confident	77 Å²	77	33.9 Å²	33.9	41%	0.412	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	133.7	-175.6	-48	-17.3	0	0	0	110.3	S1557 F1558	D1436-S1557 CarbonylContact O-C 3.34Å; D1436-S1557 VanDerWaalsContact O-CA 3.28Å; D1436-S1557 WeakPolarHBondContact O-CA 3.35Å; D1436-F1558 PolarHBondContact O-N 2.76Å
1437	I	87.2	Confident	80.3	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	135.4	177.4	-68	-169.2	0	0	0	111.6	H1414 Y1415 L1417 V1439 F1558 L1563	H1414-I1437 WeakPolarHBondContact CA-O 3.45Å; Y1415-I1437 PolarHBondContact N-O 3.19Å; Y1415-I1437 PolarHBondContact O-N 3.33Å; L1417-I1437 HydrophobicContact CD1-CB 4Å; L1417-I1437 HydrophobicContact CD1-CD1 3.56Å; L1417-I1437 HydrophobicContact CD1-CG1 3.79Å; L1417-I1437 HydrophobicContact CD2-CD1 3.53Å; L1417-I1437 HydrophobicContact CG-CD1 4.1Å; I1437-V1439 HydrophobicContact CG2-CG2 4.19Å; I1437-F1558 VanDerWaalsContact CA-O 3.28Å; I1437-F1558 WeakPolarHBondContact CA-O 3.41Å; I1437-F1558 HydrophobicContact CG1-CB 4.38Å; I1437-L1563 HydrophobicContact CD1-CD1 3.38Å
1438	T	87.4	Confident	81.9	Confident	28 Å²	28	34.5 Å²	34.5	17%	0.172	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	130.8	170.2	42.8	0	0	0	0	111.1	F1558 N1559 L1560	T1438-F1558 PolarHBondContact N-O 2.93Å; T1438-F1558 PolarHBondContact OG1-O 2.84Å; T1438-N1559 PolarHBondContact OG1-OD1 3.47Å; T1438-L1560 PolarHBondContact O-N 3.43Å; T1438-L1560 VanDerWaalsContact O-N 3.1Å
1439	V	86.5	Confident	83.4	Confident	6 Å²	6	33.2 Å²	33.2	4%	0.036	19%	0.185	C	C	.	.			trans	-115.9	121.7	176.5	-175.9	0	0	0	0	109.6	G1413 Y1415 I1437 I1529 L1560	G1413-V1439 PolarHBondContact O-N 3.37Å; Y1415-V1439 HydrophobicContact CD2-CG2 4.04Å; Y1415-V1439 HydrophobicContact CE2-CG2 4.23Å; I1437-V1439 HydrophobicContact CG2-CG2 4.19Å; V1439-I1529 HydrophobicContact CG2-CD1 3.73Å; V1439-I1529 HydrophobicContact CG2-CG1 3.7Å; V1439-L1560 HydrophobicContact CG1-CD2 3.91Å; V1439-L1560 HydrophobicContact CG2-CB 4.33Å; V1439-L1560 HydrophobicContact CG2-CD2 4.19Å
1440	S	85.9	Confident	84.5	Confident	20 Å²	20	32.8 Å²	32.8	14%	0.14	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	152.6	170.1	-65.9	0	0	0	0	112.3	N1442 N1493 V1494	S1440-N1442 WeakPolarHBondContact CB-OD1 3.35Å; S1440-N1442 PolarHBondContact O-N 3.25Å; S1440-N1493 WeakPolarHBondContact CB-OD1 3.49Å; S1440-N1493 PolarHBondContact OG-OD1 2.87Å; S1440-V1494 CarbonylContact C-O 3.56Å; S1440-V1494 WeakPolarHBondContact CA-O 3.41Å; S1440-V1494 WeakPolarHBondContact CB-O 3.03Å
1441	R	87.3	Confident	85.1	Confident	9 Å²	9	32.7 Å²	32.7	3%	0.034	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	105.6	164.2	-167.2	57.6	57.1	157.8	6.9	108.8	F1443 V1494 E1496 Y1499 V1523	R1441-F1443 HydrophobicContact CG-CD1 4.14Å; R1441-F1443 HydrophobicContact CG-CE1 4.5Å; R1441-V1494 PolarHBondContact N-O 3.01Å; R1441-V1494 PolarHBondContact O-N 3.35Å; R1441-E1496 WeakPolarHBondContact CB-OE2 3.15Å; R1441-E1496 IonicContact CZ-OE1 2.75Å; R1441-E1496 IonicContact CZ-OE2 3.48Å; R1441-E1496 IonicContact NE-OE1 3.98Å; R1441-E1496 PolarHBondContact NE-OE1 3.07Å; R1441-E1496 IonicContact NE-OE2 3.78Å; R1441-E1496 PolarHBondContact NE-OE2 3Å; R1441-E1496 VanDerWaalsContact NH2-CD 3.27Å; R1441-E1496 IonicContact NH2-OE1 3.78Å; R1441-E1496 PolarHBondContact NH2-OE1 2.98Å; R1441-E1496 IonicContact NH2-OE2 3.44Å; R1441-E1496 PolarHBondContact NH2-OE2 3.42Å; R1441-Y1499 HydrophobicContact CB-CD1 4.26Å; R1441-Y1499 HydrophobicContact CB-CD2 4.22Å; R1441-Y1499 HydrophobicContact CB-CG 3.89Å; R1441-Y1499 HydrophobicContact CG-CD1 3.91Å; R1441-Y1499 HydrophobicContact CG-CD2 3.82Å; R1441-Y1499 HydrophobicContact CG-CE1 4.1Å; R1441-Y1499 HydrophobicContact CG-CE2 4.02Å; R1441-Y1499 HydrophobicContact CG-CG 3.78Å; R1441-V1523 PolarHBondContact NH1-O 3.24Å
1442	N	87.4	Confident	85.4	Confident	24 Å²	24	37.6 Å²	37.6	13%	0.128	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	129.1	176.4	-66.8	5.2	0	0	0	110.2	S1440 Y1492 N1493 R1528	S1440-N1442 WeakPolarHBondContact CB-OD1 3.35Å; S1440-N1442 PolarHBondContact O-N 3.25Å; N1442-Y1492 VanDerWaalsContact CA-O 3.29Å; N1442-Y1492 WeakPolarHBondContact CA-O 3.47Å; N1442-N1493 WeakPolarHBondContact OD1-CA 3.4Å; N1442-N1493 PolarHBondContact OD1-ND2 2.65Å; N1442-N1493 PolarHBondContact OD1-OD1 2.87Å; N1442-R1528 PolarHBondContact O-NH2 2.84Å
1443	F	90.6	Very high	85.1	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.009	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	161.7	-179.7	60.6	-86.8	0	0	0	111.1	R1441 V1445 Y1492 V1494 Y1499 I1506 L1510 V1518 Y1519 L1521	R1441-F1443 HydrophobicContact CG-CD1 4.14Å; R1441-F1443 HydrophobicContact CG-CE1 4.5Å; F1443-V1445 HydrophobicContact CD2-CG2 3.81Å; F1443-V1445 HydrophobicContact CE2-CG2 3.75Å; F1443-Y1492 HydrophobicContact CD2-CD2 4.26Å; F1443-Y1492 HydrophobicContact CD2-CG 4.27Å; F1443-Y1492 HydrophobicContact CE1-CG 4.41Å; F1443-Y1492 HydrophobicContact CE2-CD1 4.05Å; F1443-Y1492 AromaticContact CE2-CD2 3.82Å; F1443-Y1492 HydrophobicContact CE2-CD2 3.82Å; F1443-Y1492 HydrophobicContact CE2-CE2 4.42Å; F1443-Y1492 AromaticContact CE2-CG 3.6Å; F1443-Y1492 HydrophobicContact CE2-CG 3.6Å; F1443-Y1492 AromaticContact CZ-CD1 3.85Å; F1443-Y1492 HydrophobicContact CZ-CD1 3.85Å; F1443-Y1492 HydrophobicContact CZ-CD2 4.38Å; F1443-Y1492 AromaticContact CZ-CG 3.69Å; F1443-Y1492 HydrophobicContact CZ-CG 3.69Å; F1443-Y1492 PolarHBondContact N-O 3.31Å; F1443-Y1492 PolarHBondContact O-N 2.92Å; F1443-V1494 HydrophobicContact CE1-CG2 3.98Å; F1443-V1494 HydrophobicContact CZ-CG2 4.36Å; F1443-Y1499 HydrophobicContact CE1-CD2 4.46Å; F1443-Y1499 HydrophobicContact CE1-CE2 4.47Å; F1443-I1506 HydrophobicContact CZ-CG2 4.46Å; F1443-L1510 HydrophobicContact CE2-CD1 4.29Å; F1443-L1510 HydrophobicContact CE2-CD2 4.09Å; F1443-V1518 HydrophobicContact CD2-CG1 4.15Å; F1443-Y1519 WeakPolarHBondContact CA-O 3.39Å; F1443-L1521 HydrophobicContact CB-CB 4.44Å; F1443-L1521 HydrophobicContact CB-CD1 4.05Å; F1443-L1521 HydrophobicContact CD1-CD1 3.9Å; F1443-L1521 HydrophobicContact CD2-CD1 4.31Å; F1443-L1521 HydrophobicContact CE1-CD1 4.41Å; F1443-L1521 HydrophobicContact CG-CD1 3.83Å
1444	Y	91.5	Very high	84.8	Confident	26 Å²	26	45.4 Å²	45.4	10%	0.102	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	130	-175.9	-62.2	-83.1	0	0	0	111.1	V1462 L1478 Y1490 E1491 V1518 Y1519 E1520 V1864	Y1444-V1462 HydrophobicContact CE1-CG2 4.47Å; Y1444-L1478 HydrophobicContact CD1-CD1 4.09Å; Y1444-L1478 HydrophobicContact CE1-CD1 3.77Å; Y1444-Y1490 WeakPolarHBondContact CA-O 3.44Å; Y1444-E1491 HydrophobicContact CD1-CB 3.8Å; Y1444-E1491 HydrophobicContact CD1-CG 4.17Å; Y1444-E1491 HydrophobicContact CE1-CB 3.53Å; Y1444-E1491 HydrophobicContact CE1-CG 3.51Å; Y1444-E1491 WeakPolarHBondContact CE1-OE1 3.47Å; Y1444-E1491 PolarHBondContact OH-OE1 2.87Å; Y1444-V1518 CarbonylContact O-C 3.33Å; Y1444-V1518 WeakPolarHBondContact O-CA 3.07Å; Y1444-Y1519 PolarHBondContact N-O 2.94Å; Y1444-Y1519 PolarHBondContact O-N 3.24Å; Y1444-E1520 HydrophobicContact CD2-CB 4.23Å; Y1444-E1520 HydrophobicContact CD2-CG 4.38Å; Y1444-V1864 HydrophobicContact CD2-CG1 3.95Å; Y1444-V1864 HydrophobicContact CD2-CG2 4.28Å
1445	V	90.2	Very high	84.2	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	117.9	179.4	-172.3	0	0	0	0	109.5	F1443 M1447 Y1490 Y1492 L1510 V1515 V1518	F1443-V1445 HydrophobicContact CD2-CG2 3.81Å; F1443-V1445 HydrophobicContact CE2-CG2 3.75Å; V1445-M1447 HydrophobicContact CB-CE 3.79Å; V1445-M1447 HydrophobicContact CG1-CE 3.52Å; V1445-M1447 HydrophobicContact CG1-CG 3.98Å; V1445-Y1490 PolarHBondContact N-O 3.09Å; V1445-Y1490 PolarHBondContact O-N 3.1Å; V1445-Y1492 HydrophobicContact CB-CD2 4.41Å; V1445-Y1492 HydrophobicContact CB-CE2 3.81Å; V1445-Y1492 HydrophobicContact CG2-CD2 3.75Å; V1445-Y1492 HydrophobicContact CG2-CE2 3.4Å; V1445-Y1492 VanDerWaalsContact CG2-CE2 3.4Å; V1445-L1510 HydrophobicContact CG1-CD2 4.26Å; V1445-L1510 HydrophobicContact CG2-CD2 3.52Å; V1445-V1515 HydrophobicContact CG1-CB 4.49Å; V1445-V1515 HydrophobicContact CG1-CG1 3.7Å; V1445-V1515 HydrophobicContact CG1-CG2 4.05Å; V1445-V1518 HydrophobicContact CG1-CG2 4.28Å; V1445-V1518 HydrophobicContact CG2-CG1 4.3Å; V1445-V1518 HydrophobicContact CG2-CG2 4.44Å
1446	N	89.6	Confident	83.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	126.1	172.8	-166	27	0	0	0	108.5	L1480 T1485 Y1487 H1488 L1489 E1516 G1517 Y1519	N1446-L1480 HydrophobicContact CB-CD1 4.44Å; N1446-T1485 PolarHBondContact ND2-O 3.12Å; N1446-Y1487 PolarHBondContact OD1-N 2.84Å; N1446-H1488 PolarHBondContact OD1-N 2.91Å; N1446-L1489 HydrophobicContact CB-CD1 4Å; N1446-E1516 HydrophobicContact CB-CB 4.34Å; N1446-E1516 PolarHBondContact ND2-OE2 3.43Å; N1446-E1516 PolarHBondContact O-N 3.42Å; N1446-G1517 PolarHBondContact N-O 3.11Å; N1446-G1517 PolarHBondContact O-N 3.34Å; N1446-Y1519 HydrophobicContact CB-CE2 4.07Å
1447	M	86.5	Confident	83.3	Confident	6 Å²	6	50.2 Å²	50.2	3%	0.03	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	140.4	-177.2	-59.4	174.3	-157.7	0	0	111	V1445 T1449 K1451 Y1487 H1488 Y1490 Y1492 D1514	V1445-M1447 HydrophobicContact CB-CE 3.79Å; V1445-M1447 HydrophobicContact CG1-CE 3.52Å; V1445-M1447 HydrophobicContact CG1-CG 3.98Å; M1447-T1449 VanDerWaalsContact C-N 3.25Å; M1447-T1449 VanDerWaalsContact CB-O 3.32Å; M1447-T1449 WeakPolarHBondContact CB-O 3.31Å; M1447-T1449 PolarHBondContact O-N 3.05Å; M1447-K1451 HydrophobicContact CE-CD 3.99Å; M1447-K1451 HydrophobicContact CE-CG 4.43Å; M1447-K1451 HydrophobicContact SD-CD 3.96Å; M1447-K1451 HydrophobicContact SD-CG 3.76Å; M1447-Y1487 WeakPolarHBondContact O-CB 3.14Å; M1447-H1488 PolarHBondContact N-O 3.11Å; M1447-H1488 WeakPolarHBondContact O-CB 3.39Å; M1447-H1488 PolarHBondContact O-N 3.47Å; M1447-Y1490 HydrophobicContact CB-CE2 4.48Å; M1447-Y1490 HydrophobicContact CE-CD2 3.67Å; M1447-Y1490 HydrophobicContact CE-CE2 4.4Å; M1447-Y1490 HydrophobicContact CE-CG 4.16Å; M1447-Y1490 HydrophobicContact CG-CD2 4.24Å; M1447-Y1490 HydrophobicContact CG-CE2 4.48Å; M1447-Y1490 HydrophobicContact SD-CD2 3.7Å; M1447-Y1490 HydrophobicContact SD-CE2 3.85Å; M1447-Y1492 HydrophobicContact CE-CE2 4.19Å; M1447-Y1492 VanDerWaalsContact CE-OH 3.3Å; M1447-Y1492 WeakPolarHBondContact CE-OH 3.39Å; M1447-D1514 CarbonylContact C-O 3.55Å; M1447-D1514 WeakPolarHBondContact CA-O 3.21Å
1448	R	83.7	Confident	82.9	Confident	137 Å²	137	53.7 Å²	53.7	52%	0.517	30%	0.302	S	S	.	.	S	Bend	trans	-71.8	-21.9	175.5	-59.8	-178	-177.6	-83.9	-0	112.3	D1514 E1516	R1448-D1514 PolarHBondContact N-O 2.85Å; R1448-E1516 HydrophobicContact CG-CB 4.18Å
1449	T	82.6	Confident	82.8	Confident	66 Å²	66	54.5 Å²	54.5	41%	0.405	30%	0.303	S	S	.	.	S	Bend	trans	-121.2	144.9	178.8	54.9	0	0	0	0	110.4	M1447 D1514	M1447-T1449 VanDerWaalsContact C-N 3.25Å; M1447-T1449 VanDerWaalsContact CB-O 3.32Å; M1447-T1449 WeakPolarHBondContact CB-O 3.31Å; M1447-T1449 PolarHBondContact O-N 3.05Å; T1449-D1514 PolarHBondContact OG1-OD2 3.23Å
1450	P	80.5	Confident	82.7	Confident	77 Å²	77	60.6 Å²	60.6	50%	0.5	33%	0.325	S	S	.	.			trans	-79.9	134.7	-179.6	30.3	-32.5	0	0	0	110.8	H1488	P1450-H1488 VanDerWaalsContact N-CD2 3.27Å
1451	K	79.9	Confident	82.4	Confident	42 Å²	42	61.9 Å²	61.9	18%	0.183	33%	0.328	C	S	.	.			trans	-62.9	146.6	169.5	-77.8	-165.4	165.8	-173.7	0	110.6	M1447 K1453 F1459 Y1490 Y1492 D1509	M1447-K1451 HydrophobicContact CE-CD 3.99Å; M1447-K1451 HydrophobicContact CE-CG 4.43Å; M1447-K1451 HydrophobicContact SD-CD 3.96Å; M1447-K1451 HydrophobicContact SD-CG 3.76Å; K1451-K1453 PolarHBondContact O-N 3.11Å; K1451-F1459 HydrophobicContact CD-CE2 4.25Å; K1451-F1459 HydrophobicContact CD-CZ 4.3Å; K1451-Y1490 HydrophobicContact CB-CE1 4.05Å; K1451-Y1490 HydrophobicContact CB-CE2 4.43Å; K1451-Y1490 HydrophobicContact CG-CE2 4.44Å; K1451-Y1490 PolarHBondContact N-OH 3.33Å; K1451-Y1492 PolarHBondContact NZ-OH 2.77Å; K1451-D1509 IonicContact NZ-OD2 3.41Å
1452	P	78.5	Confident	82	Confident	136 Å²	136	61.8 Å²	61.8	88%	0.883	33%	0.329	S	S	*	.	S	Bend	trans	-69.1	-1	-173	28.4	-37.2	0	0	0	115
1453	K	75	Confident	81.1	Confident	152 Å²	152	61.7 Å²	61.7	66%	0.661	33%	0.33	S	S	*	.	S	Bend	trans	-138.8	135.5	167.8	-64.4	-178.5	179.6	176.1	0	108.2	K1451 S1455	K1451-K1453 PolarHBondContact O-N 3.11Å; K1453-S1455 WeakPolarHBondContact CB-O 3.08Å; K1453-S1455 PolarHBondContact O-N 3.46Å
1454	D	75.7	Confident	79.5	Confident	83 Å²	83	63.9 Å²	63.9	44%	0.444	35%	0.353	S	S	.	.	S	Bend	trans	-73.3	-13.4	177.2	-75.4	-7.8	0	0	0	112.9	K1461	D1454-K1461 HydrophobicContact CB-CB 4.2Å; D1454-K1461 HydrophobicContact CB-CD 3.86Å; D1454-K1461 WeakPolarHBondContact O-CB 3.26Å; D1454-K1461 PolarHBondContact O-N 2.89Å; D1454-K1461 WeakPolarHBondContact OD1-CD 3.42Å; D1454-K1461 WeakPolarHBondContact OD1-CE 3.21Å; D1454-K1461 IonicContact OD1-NZ 2.62Å; D1454-K1461 PolarHBondContact OD1-NZ 3.13Å; D1454-K1461 IonicContact OD2-NZ 3.96Å; D1454-K1461 PolarHBondContact OD2-NZ 2.87Å
1455	S	70.9	Confident	77.4	Confident	78 Å²	78	68.9 Å²	68.9	55%	0.545	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-147.1	150.1	168.2	49.9	0	0	0	0	112	K1453 F1459	K1453-S1455 WeakPolarHBondContact CB-O 3.08Å; K1453-S1455 PolarHBondContact O-N 3.46Å; S1455-F1459 WeakPolarHBondContact CA-O 3.48Å
1456	G	77.8	Confident	75.1	Confident	28 Å²	28	72.8 Å²	72.8	29%	0.289	41%	0.405	S	S	.	.			trans	-138.4	-176.1	174.2	0	0	0	0	0	110.7	L1458 F1459	G1456-L1458 VanDerWaalsContact C-N 3.26Å; G1456-L1458 PolarHBondContact O-N 3.43Å; G1456-F1459 PolarHBondContact N-O 3.11Å
1457	P	74.5	Confident	72.6	Confident	133 Å²	133	77.5 Å²	77.5	86%	0.864	44%	0.438	S	S	*	.	S	Bend	trans	-69	-20.4	-175	27.8	-35.3	0	0	0	114.4
1458	L	79.8	Confident	70	Confident	74 Å²	74	84.4 Å²	84.4	39%	0.387	47%	0.472	S	S	.	.	S	Bend	trans	-123	-2.1	-178.3	-62.3	176.5	0	0	0	113.5	G1456 Y1492 N1493	G1456-L1458 VanDerWaalsContact C-N 3.26Å; G1456-L1458 PolarHBondContact O-N 3.43Å; L1458-Y1492 WeakPolarHBondContact O-CA 3.35Å; L1458-N1493 PolarHBondContact O-N 2.69Å
1459	F	83.5	Confident	67.9	Low	45 Å²	45	81.2 Å²	81.2	20%	0.197	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	150	-174.6	72.3	-94.4	0	0	0	113.8	K1451 S1455 G1456 Y1490 E1491 Y1492	K1451-F1459 HydrophobicContact CD-CE2 4.25Å; K1451-F1459 HydrophobicContact CD-CZ 4.3Å; S1455-F1459 WeakPolarHBondContact CA-O 3.48Å; G1456-F1459 PolarHBondContact N-O 3.11Å; F1459-Y1490 AromaticContact CD2-CD1 3.93Å; F1459-Y1490 HydrophobicContact CD2-CD1 3.93Å; F1459-Y1490 HydrophobicContact CE2-CD1 4.28Å; F1459-E1491 CarbonylContact C-O 3.59Å; F1459-E1491 WeakPolarHBondContact CA-O 3.45Å; F1459-Y1492 HydrophobicContact CB-CD1 3.83Å; F1459-Y1492 HydrophobicContact CB-CD2 4.2Å; F1459-Y1492 HydrophobicContact CB-CE1 3.92Å; F1459-Y1492 HydrophobicContact CB-CE2 4.26Å; F1459-Y1492 HydrophobicContact CB-CG 4Å; F1459-Y1492 HydrophobicContact CD1-CE1 4.49Å; F1459-Y1492 HydrophobicContact CG-CE1 4.43Å
1460	R	84.5	Confident	66	Low	133 Å²	133	86.6 Å²	86.6	50%	0.502	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	129.6	-178.6	-180	179	70.7	137.7	0.2	110.7	Y1490 E1491	R1460-Y1490 CarbonylContact O-C 3.54Å; R1460-Y1490 WeakPolarHBondContact O-CA 3.48Å; R1460-E1491 IonicContact CZ-OE2 3.82Å; R1460-E1491 PolarHBondContact N-O 2.96Å; R1460-E1491 IonicContact NE-OE2 2.7Å; R1460-E1491 PolarHBondContact NE-OE2 2.84Å; R1460-E1491 IonicContact NH2-OE1 2.72Å; R1460-E1491 IonicContact NH2-OE2 3.46Å; R1460-E1491 PolarHBondContact NH2-OE2 3.09Å; R1460-E1491 PolarHBondContact O-N 3.41Å
1461	K	81.1	Confident	63.7	Low	48 Å²	48	88.5 Å²	88.5	21%	0.209	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	131.1	170.5	-170.7	178.8	179.2	-175.6	0	110.4	D1454 S1463 L1489 Y1490	D1454-K1461 HydrophobicContact CB-CB 4.2Å; D1454-K1461 HydrophobicContact CB-CD 3.86Å; D1454-K1461 WeakPolarHBondContact O-CB 3.26Å; D1454-K1461 PolarHBondContact O-N 2.89Å; D1454-K1461 WeakPolarHBondContact OD1-CD 3.42Å; D1454-K1461 WeakPolarHBondContact OD1-CE 3.21Å; D1454-K1461 IonicContact OD1-NZ 2.62Å; D1454-K1461 PolarHBondContact OD1-NZ 3.13Å; D1454-K1461 IonicContact OD2-NZ 3.96Å; D1454-K1461 PolarHBondContact OD2-NZ 2.87Å; K1461-S1463 WeakPolarHBondContact CE-O 3.44Å; K1461-L1489 WeakPolarHBondContact CA-O 3.41Å; K1461-Y1490 HydrophobicContact CB-CD1 3.81Å; K1461-Y1490 HydrophobicContact CB-CE1 3.6Å; K1461-Y1490 HydrophobicContact CD-CE1 4.15Å; K1461-Y1490 HydrophobicContact CG-CD1 4.34Å; K1461-Y1490 HydrophobicContact CG-CE1 3.89Å
1462	V	77.6	Confident	61.5	Low	7 Å²	7	92.4 Å²	92.4	4%	0.042	54%	0.538	C	S	.	.			trans	-108.6	-20.1	178.8	-149.4	0	0	0	0	112	Y1444 A1475 S1476 L1478 L1489 E1491	Y1444-V1462 HydrophobicContact CE1-CG2 4.47Å; V1462-A1475 VanDerWaalsContact O-CB 3.25Å; V1462-A1475 WeakPolarHBondContact O-CB 3.43Å; V1462-S1476 WeakPolarHBondContact CG1-OG 3.44Å; V1462-L1478 HydrophobicContact CB-CD1 4.15Å; V1462-L1478 HydrophobicContact CG1-CD1 3.77Å; V1462-L1478 HydrophobicContact CG1-CG 4.25Å; V1462-L1478 HydrophobicContact CG2-CD1 4.26Å; V1462-L1489 PolarHBondContact N-O 3.04Å; V1462-E1491 HydrophobicContact CG2-CB 3.61Å
1463	S	68.5	Low	59.2	Low	22 Å²	22	94.8 Å²	94.8	15%	0.154	53%	0.529	C	S	.	.	S	Bend	trans	-85.9	117	179.7	58.8	0	0	0	0	113	K1461 H1488 L1489	K1461-S1463 WeakPolarHBondContact CE-O 3.44Å; S1463-H1488 WeakPolarHBondContact OG-CA 3.45Å; S1463-L1489 PolarHBondContact OG-N 3.24Å
1464	G	57.7	Low	57.4	Low	48 Å²	48	91.9 Å²	91.9	50%	0.495	53%	0.528	S	S	.	.	S	Bend	trans	117.2	156.6	166.5	0	0	0	0	0	115.3	V1466 A1475	G1464-V1466 PolarHBondContact O-N 3.42Å; G1464-V1466 VanDerWaalsContact O-N 3.14Å; G1464-A1475 WeakPolarHBondContact O-CB 3.47Å
1465	N	47.9	Very low	56.1	Low	131 Å²	131	89.4 Å²	89.4	70%	0.701	52%	0.519	S	S	*	.			trans	-71.7	105.7	-178.3	-76	-16.5	0	0	0	111.9	S1467	N1465-S1467 PolarHBondContact O-N 3.19Å
1466	V	41.4	Very low	55.2	Low	82 Å²	82	88.1 Å²	88.1	50%	0.497	51%	0.51	S	S	.	.			trans	-86.3	92.5	175.8	-179	0	0	0	0	110	G1464 M1468	G1464-V1466 PolarHBondContact O-N 3.42Å; G1464-V1466 VanDerWaalsContact O-N 3.14Å; V1466-M1468 HydrophobicContact CG1-CG 3.83Å; V1466-M1468 PolarHBondContact O-N 3.36Å
1467	S	36.9	Very low	54.5	Low	100 Å²	100	89.5 Å²	89.5	70%	0.699	52%	0.524	S	S	*	.			trans	-74.7	82.2	178.9	-64.4	0	0	0	0	112.7	N1465	N1465-S1467 PolarHBondContact O-N 3.19Å
1468	M	32.8	Very low	54.7	Low	150 Å²	150	84.5 Å²	84.5	74%	0.739	49%	0.49	S	S	*	.			trans	-113.5	94.1	175.8	-76.7	-69.7	-72.3	0	0	112	V1466	V1466-M1468 HydrophobicContact CG1-CG 3.83Å; V1466-M1468 PolarHBondContact O-N 3.36Å
1469	G	39.2	Very low	54.7	Low	70 Å²	70	83.8 Å²	83.8	72%	0.722	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	80.7	159.6	0	0	0	0	0	117.4	E1471	G1469-E1471 PolarHBondContact O-N 3.43Å
1470	N	41.9	Very low	54.9	Low	179 Å²	179	81.7 Å²	81.7	96%	0.957	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	-17.9	169.4	-75.5	11.1	0	0	0	119.2
1471	E	33.5	Very low	54.9	Low	118 Å²	118	75.4 Å²	75.4	55%	0.551	45%	0.453	S	S	*	.			trans	-98.5	99.2	162.2	-77.6	-167.4	-165.7	0	0	110.1	G1469 R1473	G1469-E1471 PolarHBondContact O-N 3.43Å; E1471-R1473 HydrophobicContact CB-CG 4.4Å; E1471-R1473 PolarHBondContact O-N 3.34Å; E1471-R1473 IonicContact OE1-NH2 3.3Å; E1471-R1473 IonicContact OE2-CZ 3.8Å; E1471-R1473 IonicContact OE2-NE 2.65Å; E1471-R1473 PolarHBondContact OE2-NE 3.01Å; E1471-R1473 IonicContact OE2-NH2 3.68Å; E1471-R1473 PolarHBondContact OE2-NH2 3.16Å
1472	T	32.6	Very low	54.8	Low	124 Å²	124	74.6 Å²	74.6	76%	0.761	45%	0.449	S	S	*	.			trans	-71.7	70.8	167.8	18.2	0	0	0	0	110.9	S1474	T1472-S1474 PolarHBondContact O-N 3.11Å; T1472-S1474 VanDerWaalsContact O-N 3.14Å
1473	R	31	Very low	54.7	Low	186 Å²	186	77 Å²	77	70%	0.702	46%	0.461	S	S	*	.			trans	-71.5	101.3	162.6	-62.8	-172.8	-172.2	-158.6	1.8	107.8	E1471 A1475	E1471-R1473 HydrophobicContact CB-CG 4.4Å; E1471-R1473 PolarHBondContact O-N 3.34Å; E1471-R1473 IonicContact OE1-NH2 3.3Å; E1471-R1473 IonicContact OE2-CZ 3.8Å; E1471-R1473 IonicContact OE2-NE 2.65Å; E1471-R1473 PolarHBondContact OE2-NE 3.01Å; E1471-R1473 IonicContact OE2-NH2 3.68Å; E1471-R1473 PolarHBondContact OE2-NH2 3.16Å; R1473-A1475 PolarHBondContact O-N 3.47Å
1474	S	37.8	Very low	55.1	Low	91 Å²	91	77.6 Å²	77.6	64%	0.636	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-49.7	125.7	165.2	-62	0	0	0	0	108.5	T1472 S1476	T1472-S1474 PolarHBondContact O-N 3.11Å; T1472-S1474 VanDerWaalsContact O-N 3.14Å; S1474-S1476 PolarHBondContact O-N 3.29Å
1475	A	47	Very low	55.9	Low	30 Å²	30	77.7 Å²	77.7	25%	0.248	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-58.4	135.1	171.4	0	0	0	0	0	107.8	V1462 G1464 R1473 G1477	V1462-A1475 VanDerWaalsContact O-CB 3.25Å; V1462-A1475 WeakPolarHBondContact O-CB 3.43Å; G1464-A1475 WeakPolarHBondContact O-CB 3.47Å; R1473-A1475 PolarHBondContact O-N 3.47Å; A1475-G1477 PolarHBondContact O-N 3.27Å
1476	S	52	Low	57.4	Low	52 Å²	52	74.4 Å²	74.4	36%	0.364	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-53.6	117	-169.4	47	0	0	0	0	110.4	V1462 S1474 L1478	V1462-S1476 WeakPolarHBondContact CG1-OG 3.44Å; S1474-S1476 PolarHBondContact O-N 3.29Å; S1476-L1478 PolarHBondContact O-N 2.87Å
1477	G	63.2	Low	59.4	Low	56 Å²	56	75.4 Å²	75.4	58%	0.577	43%	0.433	S	S	*	.			trans	-67.4	79.4	176.8	0	0	0	0	0	110.5	A1475 I1479	A1475-G1477 PolarHBondContact O-N 3.27Å; G1477-I1479 PolarHBondContact O-N 2.82Å
1478	L	79.1	Confident	61.6	Low	29 Å²	29	73.2 Å²	73.2	15%	0.152	41%	0.411	C	S	.	.			trans	-68	126.6	176.8	-74	178.5	0	0	0	109.4	Y1444 V1462 S1476 L1489 N1862 V1864	Y1444-L1478 HydrophobicContact CD1-CD1 4.09Å; Y1444-L1478 HydrophobicContact CE1-CD1 3.77Å; V1462-L1478 HydrophobicContact CB-CD1 4.15Å; V1462-L1478 HydrophobicContact CG1-CD1 3.77Å; V1462-L1478 HydrophobicContact CG1-CG 4.25Å; V1462-L1478 HydrophobicContact CG2-CD1 4.26Å; S1476-L1478 PolarHBondContact O-N 2.87Å; L1478-L1489 HydrophobicContact CB-CD2 3.98Å; L1478-L1489 HydrophobicContact CD1-CD2 3.92Å; L1478-N1862 CarbonylContact C-O 3.49Å; L1478-N1862 VanDerWaalsContact CA-O 3.3Å; L1478-N1862 WeakPolarHBondContact CA-O 3.5Å; L1478-N1862 HydrophobicContact CD2-CB 4.35Å; L1478-V1864 HydrophobicContact CB-CG2 4.15Å; L1478-V1864 HydrophobicContact CD1-CG2 4.24Å; L1478-V1864 HydrophobicContact CD2-CG2 4.34Å; L1478-V1864 HydrophobicContact CG-CG2 4.48Å
1479	I	80.4	Confident	64.2	Low	58 Å²	58	66.2 Å²	66.2	30%	0.297	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-96.9	115.4	178	-53.1	174	0	0	0	107.4	G1477 N1483 N1862 H1863 V1864	G1477-I1479 PolarHBondContact O-N 2.82Å; I1479-N1483 WeakPolarHBondContact CG2-OD1 3.48Å; I1479-N1862 PolarHBondContact N-O 2.98Å; I1479-H1863 WeakPolarHBondContact CG2-CE1 3.44Å; I1479-H1863 WeakPolarHBondContact O-CA 3.4Å; I1479-V1864 PolarHBondContact O-N 3.49Å
1480	L	86	Confident	66.5	Low	1 Å²	1	62.9 Å²	62.9	1%	0.005	34%	0.342	C	S	.	.			trans	-67.5	157.2	175.2	-68.2	175.6	0	0	0	110.9	N1446 R1482 N1483 H1484 V1486 L1489 Y1519 V1864	N1446-L1480 HydrophobicContact CB-CD1 4.44Å; L1480-R1482 PolarHBondContact O-N 2.85Å; L1480-N1483 PolarHBondContact O-N 3.4Å; L1480-H1484 HydrophobicContact CB-CB 3.91Å; L1480-H1484 HydrophobicContact CD1-CB 4.07Å; L1480-V1486 HydrophobicContact CD1-CG2 3.82Å; L1480-V1486 HydrophobicContact CG-CG2 3.92Å; L1480-L1489 HydrophobicContact CD2-CD1 4.08Å; L1480-L1489 HydrophobicContact CD2-CD2 4.36Å; L1480-Y1519 HydrophobicContact CD1-CE2 4.13Å; L1480-Y1519 HydrophobicContact CD2-CD1 4.4Å; L1480-Y1519 HydrophobicContact CD2-CD2 3.84Å; L1480-Y1519 HydrophobicContact CD2-CE1 4.37Å; L1480-Y1519 HydrophobicContact CD2-CE2 3.85Å; L1480-Y1519 HydrophobicContact CD2-CG 4.13Å; L1480-V1864 HydrophobicContact CD2-CB 4.41Å; L1480-V1864 HydrophobicContact CD2-CG2 4.23Å
1481	P	84.4	Confident	68.8	Low	1 Å²	1	56.2 Å²	56.2	1%	0.006	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-48.3	141.2	171	-27	35.4	0	0	0	111.6	N1483 H1484 Y1519 W1866 L1875	P1481-N1483 PolarHBondContact O-N 3.28Å; P1481-H1484 PolarHBondContact O-CD2 2.99Å; P1481-H1484 VanDerWaalsContact O-CG 3.27Å; P1481-H1484 PolarHBondContact O-N 3.48Å; P1481-H1484 VanDerWaalsContact O-N 3.12Å; P1481-Y1519 HydrophobicContact CG-CD1 3.84Å; P1481-Y1519 HydrophobicContact CG-CE1 4.15Å; P1481-W1866 HydrophobicContact CB-CB 4.21Å; P1481-W1866 HydrophobicContact CB-CE3 4.1Å; P1481-W1866 HydrophobicContact CG-CB 3.97Å; P1481-W1866 HydrophobicContact CG-CE3 4.12Å; P1481-L1875 HydrophobicContact CB-CD2 3.62Å
1482	R	79.9	Confident	71.4	Confident	31 Å²	31	51.7 Å²	51.7	12%	0.117	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	49.7	29.2	-178.5	-66.7	-169.6	-178.5	167.1	7.9	115.9	L1480 H1484 L1875 D1882 A1969 D2016	L1480-R1482 PolarHBondContact O-N 2.85Å; R1482-H1484 VanDerWaalsContact C-N 3.26Å; R1482-H1484 PolarHBondContact O-N 3.04Å; R1482-L1875 HydrophobicContact CG-CD2 4.29Å; R1482-D1882 IonicContact CZ-OD1 2.93Å; R1482-D1882 IonicContact CZ-OD2 3.88Å; R1482-D1882 VanDerWaalsContact CZ-OD2 3.3Å; R1482-D1882 VanDerWaalsContact NH1-CG 3.31Å; R1482-D1882 IonicContact NH1-OD1 3.27Å; R1482-D1882 PolarHBondContact NH1-OD1 3.22Å; R1482-D1882 IonicContact NH1-OD2 3.25Å; R1482-D1882 PolarHBondContact NH1-OD2 3.27Å; R1482-D1882 IonicContact NH2-OD1 3.91Å; R1482-D1882 IonicContact NH2-OD2 3.52Å; R1482-D1882 PolarHBondContact NH2-OD2 2.9Å; R1482-A1969 CarbonylContact C-O 3.46Å; R1482-A1969 VanDerWaalsContact C-O 3.28Å; R1482-A1969 VanDerWaalsContact CA-O 3.31Å; R1482-A1969 WeakPolarHBondContact CA-O 3.37Å; R1482-A1969 HydrophobicContact CB-CB 4.14Å; R1482-D2016 IonicContact CZ-OD1 2.67Å; R1482-D2016 IonicContact NE-OD1 3.1Å; R1482-D2016 PolarHBondContact NE-OD1 2.84Å; R1482-D2016 IonicContact NE-OD2 2.71Å; R1482-D2016 IonicContact NH2-OD1 2.83Å; R1482-D2016 PolarHBondContact NH2-OD1 3.06Å
1483	N	74.9	Confident	73.9	Confident	58 Å²	58	48.5 Å²	48.5	31%	0.31	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	56.8	33.8	-178	-60.2	-26.6	0	0	0	113.8	I1479 L1480 P1481	I1479-N1483 WeakPolarHBondContact CG2-OD1 3.48Å; L1480-N1483 PolarHBondContact O-N 3.4Å; P1481-N1483 PolarHBondContact O-N 3.28Å
1484	H	77.8	Confident	76.6	Confident	35 Å²	35	39.9 Å²	39.9	16%	0.162	23%	0.23	C	C	.	.			trans	-54.7	146	174.7	-70.2	175.5	0	0	0	112.4	L1480 P1481 R1482 V1486 Y1519 L1875 K1878	L1480-H1484 HydrophobicContact CB-CB 3.91Å; L1480-H1484 HydrophobicContact CD1-CB 4.07Å; P1481-H1484 PolarHBondContact O-CD2 2.99Å; P1481-H1484 VanDerWaalsContact O-CG 3.27Å; P1481-H1484 PolarHBondContact O-N 3.48Å; P1481-H1484 VanDerWaalsContact O-N 3.12Å; R1482-H1484 VanDerWaalsContact C-N 3.26Å; R1482-H1484 PolarHBondContact O-N 3.04Å; H1484-V1486 PolarHBondContact O-N 2.79Å; H1484-Y1519 AromaticContact ND1-CE1 3.89Å; H1484-Y1519 AromaticContact ND1-CZ 3.91Å; H1484-Y1519 PolarHBondContact ND1-OH 3.45Å; H1484-L1875 PolarHBondContact CE1-O 3.4Å; H1484-L1875 VanDerWaalsContact CE1-O 3.29Å; H1484-K1878 PolarHBondContact ND1-NZ 3.47Å; H1484-K1878 VanDerWaalsContact ND1-NZ 3.2Å
1485	T	75.2	Confident	78.8	Confident	49 Å²	49	38.1 Å²	38.1	30%	0.301	22%	0.216	S	C	.	.			trans	-67.5	112.8	-176.3	46.6	0	0	0	0	112.3	N1446 Y1487 T1959	N1446-T1485 PolarHBondContact ND2-O 3.12Å; T1485-Y1487 WeakPolarHBondContact O-CD2 3.24Å; T1485-Y1487 PolarHBondContact O-N 3.41Å; T1485-Y1487 VanDerWaalsContact OG1-CE2 3.26Å; T1485-Y1487 WeakPolarHBondContact OG1-CE2 3.28Å; T1485-T1959 HydrophobicContact CG2-CG2 3.47Å; T1485-T1959 VanDerWaalsContact CG2-CG2 3.47Å
1486	V	78.2	Confident	80.5	Confident	62 Å²	62	37 Å²	37	38%	0.376	21%	0.206	S	C	.	.			trans	-70.1	112.8	170.9	178.2	0	0	0	0	109.3	L1480 H1484 L1489	L1480-V1486 HydrophobicContact CD1-CG2 3.82Å; L1480-V1486 HydrophobicContact CG-CG2 3.92Å; H1484-V1486 PolarHBondContact O-N 2.79Å; V1486-L1489 HydrophobicContact CG1-CB 3.99Å
1487	Y	83	Confident	81.9	Confident	104 Å²	104	38.1 Å²	38.1	41%	0.408	21%	0.214	S	C	.	.	S	Bend	trans	-94.2	-79.7	174.8	-69.3	-77.6	0	0	0	109.2	N1446 M1447 T1485 E1516	N1446-Y1487 PolarHBondContact OD1-N 2.84Å; M1447-Y1487 WeakPolarHBondContact O-CB 3.14Å; T1485-Y1487 WeakPolarHBondContact O-CD2 3.24Å; T1485-Y1487 PolarHBondContact O-N 3.41Å; T1485-Y1487 VanDerWaalsContact OG1-CE2 3.26Å; T1485-Y1487 WeakPolarHBondContact OG1-CE2 3.28Å; Y1487-E1516 HydrophobicContact CD2-CB 4.34Å; Y1487-E1516 HydrophobicContact CD2-CG 4.02Å; Y1487-E1516 HydrophobicContact CE2-CG 3.9Å
1488	H	83.3	Confident	82.8	Confident	54 Å²	54	38 Å²	38	25%	0.25	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	100.1	171.4	-57.5	-46.4	0	0	0	109	N1446 M1447 P1450 S1463 Y1490	N1446-H1488 PolarHBondContact OD1-N 2.91Å; M1447-H1488 PolarHBondContact N-O 3.11Å; M1447-H1488 WeakPolarHBondContact O-CB 3.39Å; M1447-H1488 PolarHBondContact O-N 3.47Å; P1450-H1488 VanDerWaalsContact N-CD2 3.27Å; S1463-H1488 WeakPolarHBondContact OG-CA 3.45Å; H1488-Y1490 HydrophobicContact CB-CE2 3.68Å; H1488-Y1490 WeakPolarHBondContact O-CD2 3.26Å; H1488-Y1490 WeakPolarHBondContact O-CE2 3.22Å
1489	L	87.3	Confident	83.1	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	124	-174.5	-169.4	66.8	0	0	0	110.6	N1446 K1461 V1462 S1463 L1478 L1480 V1486	N1446-L1489 HydrophobicContact CB-CD1 4Å; K1461-L1489 WeakPolarHBondContact CA-O 3.41Å; V1462-L1489 PolarHBondContact N-O 3.04Å; S1463-L1489 PolarHBondContact OG-N 3.24Å; L1478-L1489 HydrophobicContact CB-CD2 3.98Å; L1478-L1489 HydrophobicContact CD1-CD2 3.92Å; L1480-L1489 HydrophobicContact CD2-CD1 4.08Å; L1480-L1489 HydrophobicContact CD2-CD2 4.36Å; V1486-L1489 HydrophobicContact CG1-CB 3.99Å
1490	Y	88.4	Confident	83.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	120.9	178.1	-62.9	-89.8	0	0	0	110.2	Y1444 V1445 M1447 K1451 F1459 R1460 K1461 H1488 Y1492	Y1444-Y1490 WeakPolarHBondContact CA-O 3.44Å; V1445-Y1490 PolarHBondContact N-O 3.09Å; V1445-Y1490 PolarHBondContact O-N 3.1Å; M1447-Y1490 HydrophobicContact CB-CE2 4.48Å; M1447-Y1490 HydrophobicContact CE-CD2 3.67Å; M1447-Y1490 HydrophobicContact CE-CE2 4.4Å; M1447-Y1490 HydrophobicContact CE-CG 4.16Å; M1447-Y1490 HydrophobicContact CG-CD2 4.24Å; M1447-Y1490 HydrophobicContact CG-CE2 4.48Å; M1447-Y1490 HydrophobicContact SD-CD2 3.7Å; M1447-Y1490 HydrophobicContact SD-CE2 3.85Å; K1451-Y1490 HydrophobicContact CB-CE1 4.05Å; K1451-Y1490 HydrophobicContact CB-CE2 4.43Å; K1451-Y1490 HydrophobicContact CG-CE2 4.44Å; K1451-Y1490 PolarHBondContact N-OH 3.33Å; F1459-Y1490 AromaticContact CD2-CD1 3.93Å; F1459-Y1490 HydrophobicContact CD2-CD1 3.93Å; F1459-Y1490 HydrophobicContact CE2-CD1 4.28Å; R1460-Y1490 CarbonylContact O-C 3.54Å; R1460-Y1490 WeakPolarHBondContact O-CA 3.48Å; K1461-Y1490 HydrophobicContact CB-CD1 3.81Å; K1461-Y1490 HydrophobicContact CB-CE1 3.6Å; K1461-Y1490 HydrophobicContact CD-CE1 4.15Å; K1461-Y1490 HydrophobicContact CG-CD1 4.34Å; K1461-Y1490 HydrophobicContact CG-CE1 3.89Å; H1488-Y1490 HydrophobicContact CB-CE2 3.68Å; H1488-Y1490 WeakPolarHBondContact O-CD2 3.26Å; H1488-Y1490 WeakPolarHBondContact O-CE2 3.22Å; Y1490-Y1492 WeakPolarHBondContact O-CD2 3.45Å
1491	E	89	Confident	82.9	Confident	39 Å²	39	44.6 Å²	44.6	18%	0.182	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	131.7	167.5	179.3	173.8	-114.2	0	0	109.3	Y1444 F1459 R1460 V1462	Y1444-E1491 HydrophobicContact CD1-CB 3.8Å; Y1444-E1491 HydrophobicContact CD1-CG 4.17Å; Y1444-E1491 HydrophobicContact CE1-CB 3.53Å; Y1444-E1491 HydrophobicContact CE1-CG 3.51Å; Y1444-E1491 WeakPolarHBondContact CE1-OE1 3.47Å; Y1444-E1491 PolarHBondContact OH-OE1 2.87Å; F1459-E1491 CarbonylContact C-O 3.59Å; F1459-E1491 WeakPolarHBondContact CA-O 3.45Å; R1460-E1491 IonicContact CZ-OE2 3.82Å; R1460-E1491 PolarHBondContact N-O 2.96Å; R1460-E1491 IonicContact NE-OE2 2.7Å; R1460-E1491 PolarHBondContact NE-OE2 2.84Å; R1460-E1491 IonicContact NH2-OE1 2.72Å; R1460-E1491 IonicContact NH2-OE2 3.46Å; R1460-E1491 PolarHBondContact NH2-OE2 3.09Å; R1460-E1491 PolarHBondContact O-N 3.41Å; V1462-E1491 HydrophobicContact CG2-CB 3.61Å
1492	Y	88	Confident	82.7	Confident	23 Å²	23	47.9 Å²	47.9	9%	0.09	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	139.7	171.7	-72.3	-112.6	0	0	0	109.1	N1442 F1443 V1445 M1447 K1451 L1458 F1459 Y1490	N1442-Y1492 VanDerWaalsContact CA-O 3.29Å; N1442-Y1492 WeakPolarHBondContact CA-O 3.47Å; F1443-Y1492 HydrophobicContact CD2-CD2 4.26Å; F1443-Y1492 HydrophobicContact CD2-CG 4.27Å; F1443-Y1492 HydrophobicContact CE1-CG 4.41Å; F1443-Y1492 HydrophobicContact CE2-CD1 4.05Å; F1443-Y1492 AromaticContact CE2-CD2 3.82Å; F1443-Y1492 HydrophobicContact CE2-CD2 3.82Å; F1443-Y1492 HydrophobicContact CE2-CE2 4.42Å; F1443-Y1492 AromaticContact CE2-CG 3.6Å; F1443-Y1492 HydrophobicContact CE2-CG 3.6Å; F1443-Y1492 AromaticContact CZ-CD1 3.85Å; F1443-Y1492 HydrophobicContact CZ-CD1 3.85Å; F1443-Y1492 HydrophobicContact CZ-CD2 4.38Å; F1443-Y1492 AromaticContact CZ-CG 3.69Å; F1443-Y1492 HydrophobicContact CZ-CG 3.69Å; F1443-Y1492 PolarHBondContact N-O 3.31Å; F1443-Y1492 PolarHBondContact O-N 2.92Å; V1445-Y1492 HydrophobicContact CB-CD2 4.41Å; V1445-Y1492 HydrophobicContact CB-CE2 3.81Å; V1445-Y1492 HydrophobicContact CG2-CD2 3.75Å; V1445-Y1492 HydrophobicContact CG2-CE2 3.4Å; V1445-Y1492 VanDerWaalsContact CG2-CE2 3.4Å; M1447-Y1492 HydrophobicContact CE-CE2 4.19Å; M1447-Y1492 VanDerWaalsContact CE-OH 3.3Å; M1447-Y1492 WeakPolarHBondContact CE-OH 3.39Å; K1451-Y1492 PolarHBondContact NZ-OH 2.77Å; L1458-Y1492 WeakPolarHBondContact O-CA 3.35Å; F1459-Y1492 HydrophobicContact CB-CD1 3.83Å; F1459-Y1492 HydrophobicContact CB-CD2 4.2Å; F1459-Y1492 HydrophobicContact CB-CE1 3.92Å; F1459-Y1492 HydrophobicContact CB-CE2 4.26Å; F1459-Y1492 HydrophobicContact CB-CG 4Å; F1459-Y1492 HydrophobicContact CD1-CE1 4.49Å; F1459-Y1492 HydrophobicContact CG-CE1 4.43Å; Y1490-Y1492 WeakPolarHBondContact O-CD2 3.45Å
1493	N	87	Confident	82.6	Confident	57 Å²	57	46.9 Å²	46.9	31%	0.305	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	98.4	172.3	-177.5	-39.4	0	0	0	106.4	S1440 N1442 L1458 D1561	S1440-N1493 WeakPolarHBondContact CB-OD1 3.49Å; S1440-N1493 PolarHBondContact OG-OD1 2.87Å; N1442-N1493 WeakPolarHBondContact OD1-CA 3.4Å; N1442-N1493 PolarHBondContact OD1-ND2 2.65Å; N1442-N1493 PolarHBondContact OD1-OD1 2.87Å; L1458-N1493 PolarHBondContact O-N 2.69Å; N1493-D1561 PolarHBondContact ND2-OD2 3.31Å
1494	V	87	Confident	82.8	Confident	6 Å²	6	48.3 Å²	48.3	4%	0.036	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	124.6	-173.6	-174.3	0	0	0	0	108.5	S1440 R1441 F1443 E1496 V1498	S1440-V1494 CarbonylContact C-O 3.56Å; S1440-V1494 WeakPolarHBondContact CA-O 3.41Å; S1440-V1494 WeakPolarHBondContact CB-O 3.03Å; R1441-V1494 PolarHBondContact N-O 3.01Å; R1441-V1494 PolarHBondContact O-N 3.35Å; F1443-V1494 HydrophobicContact CE1-CG2 3.98Å; F1443-V1494 HydrophobicContact CZ-CG2 4.36Å; V1494-E1496 PolarHBondContact O-N 3.07Å; V1494-V1498 HydrophobicContact CG1-CB 4.12Å; V1494-V1498 HydrophobicContact CG1-CG1 4.11Å
1495	P	83.7	Confident	83	Confident	53 Å²	53	52.4 Å²	52.4	34%	0.344	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	133.5	173.8	-25.3	34.5	0	0	0	110.7	S1497 V1498 Y1499	P1495-S1497 PolarHBondContact O-N 2.8Å; P1495-S1497 VanDerWaalsContact O-N 3.12Å; P1495-V1498 HydrophobicContact CB-CG2 4.18Å; P1495-V1498 HydrophobicContact CG-CG2 4.45Å; P1495-V1498 WeakPolarHBondContact O-CA 3.35Å; P1495-V1498 WeakPolarHBondContact O-CB 3.14Å; P1495-V1498 PolarHBondContact O-N 3.47Å; P1495-Y1499 PolarHBondContact O-N 3.31Å
1496	E	83.7	Confident	83.3	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.037	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-31.3	-168.9	-169.7	67.1	-141.7	0	0	113.3	I1412 R1441 V1494 Y1499 T1500	I1412-E1496 HydrophobicContact CB-CG 4.13Å; I1412-E1496 HydrophobicContact CG2-CG 3.74Å; I1412-E1496 WeakPolarHBondContact O-CG 3.21Å; R1441-E1496 WeakPolarHBondContact CB-OE2 3.15Å; R1441-E1496 IonicContact CZ-OE1 2.75Å; R1441-E1496 IonicContact CZ-OE2 3.48Å; R1441-E1496 IonicContact NE-OE1 3.98Å; R1441-E1496 PolarHBondContact NE-OE1 3.07Å; R1441-E1496 IonicContact NE-OE2 3.78Å; R1441-E1496 PolarHBondContact NE-OE2 3Å; R1441-E1496 VanDerWaalsContact NH2-CD 3.27Å; R1441-E1496 IonicContact NH2-OE1 3.78Å; R1441-E1496 PolarHBondContact NH2-OE1 2.98Å; R1441-E1496 IonicContact NH2-OE2 3.44Å; R1441-E1496 PolarHBondContact NH2-OE2 3.42Å; V1494-E1496 PolarHBondContact O-N 3.07Å; E1496-Y1499 PolarHBondContact O-N 2.97Å; E1496-T1500 VanDerWaalsContact O-CB 3.31Å; E1496-T1500 WeakPolarHBondContact O-CB 3.49Å; E1496-T1500 PolarHBondContact O-N 2.96Å; E1496-T1500 PolarHBondContact O-OG1 3.14Å
1497	S	80.1	Confident	83.4	Confident	75 Å²	75	51.5 Å²	51.5	52%	0.524	28%	0.279	S	S	.	.	H	α-helix	trans	-60.9	-47.7	171.6	50.2	0	0	0	0	112.5	P1495 T1500 E1501	P1495-S1497 PolarHBondContact O-N 2.8Å; P1495-S1497 VanDerWaalsContact O-N 3.12Å; S1497-T1500 PolarHBondContact O-N 3.33Å; S1497-E1501 WeakPolarHBondContact O-CB 3.39Å; S1497-E1501 PolarHBondContact O-N 2.96Å
1498	V	83.3	Confident	83.4	Confident	52 Å²	52	51.4 Å²	51.4	32%	0.315	29%	0.289	S	S	.	.	H	α-helix	trans	-67	-39.3	177.5	-179	0	0	0	0	110.8	V1494 P1495 H1502	V1494-V1498 HydrophobicContact CG1-CB 4.12Å; V1494-V1498 HydrophobicContact CG1-CG1 4.11Å; P1495-V1498 HydrophobicContact CB-CG2 4.18Å; P1495-V1498 HydrophobicContact CG-CG2 4.45Å; P1495-V1498 WeakPolarHBondContact O-CA 3.35Å; P1495-V1498 WeakPolarHBondContact O-CB 3.14Å; P1495-V1498 PolarHBondContact O-N 3.47Å; V1498-H1502 WeakPolarHBondContact O-CB 3.16Å; V1498-H1502 PolarHBondContact O-CD2 3.46Å; V1498-H1502 PolarHBondContact O-N 3.24Å
1499	Y	84.5	Confident	83.2	Confident	25 Å²	25	51.9 Å²	51.9	10%	0.098	29%	0.294	C	S	.	.	H	α-helix	trans	-62.1	-43.3	173.4	-179.6	-98.5	0	0	0	111.5	R1441 F1443 P1495 E1496 A1503 I1506 L1521	R1441-Y1499 HydrophobicContact CB-CD1 4.26Å; R1441-Y1499 HydrophobicContact CB-CD2 4.22Å; R1441-Y1499 HydrophobicContact CB-CG 3.89Å; R1441-Y1499 HydrophobicContact CG-CD1 3.91Å; R1441-Y1499 HydrophobicContact CG-CD2 3.82Å; R1441-Y1499 HydrophobicContact CG-CE1 4.1Å; R1441-Y1499 HydrophobicContact CG-CE2 4.02Å; R1441-Y1499 HydrophobicContact CG-CG 3.78Å; F1443-Y1499 HydrophobicContact CE1-CD2 4.46Å; F1443-Y1499 HydrophobicContact CE1-CE2 4.47Å; P1495-Y1499 PolarHBondContact O-N 3.31Å; E1496-Y1499 PolarHBondContact O-N 2.97Å; Y1499-A1503 VanDerWaalsContact O-CA 3.24Å; Y1499-A1503 WeakPolarHBondContact O-CA 3.44Å; Y1499-A1503 WeakPolarHBondContact O-CB 3.3Å; Y1499-A1503 PolarHBondContact O-N 2.89Å; Y1499-I1506 HydrophobicContact CD2-CD1 3.76Å; Y1499-I1506 HydrophobicContact CD2-CG2 4.45Å; Y1499-I1506 HydrophobicContact CE2-CD1 4.33Å; Y1499-I1506 HydrophobicContact CE2-CG2 4.06Å; Y1499-L1521 HydrophobicContact CE2-CD1 4.04Å
1500	T	79.7	Confident	83	Confident	48 Å²	48	52.9 Å²	52.9	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-68	-39.8	179.7	-57.5	0	0	0	0	112.2	I1412 E1496 S1497	I1412-T1500 HydrophobicContact CD1-CG2 4.45Å; E1496-T1500 VanDerWaalsContact O-CB 3.31Å; E1496-T1500 WeakPolarHBondContact O-CB 3.49Å; E1496-T1500 PolarHBondContact O-N 2.96Å; E1496-T1500 PolarHBondContact O-OG1 3.14Å; S1497-T1500 PolarHBondContact O-N 3.33Å
1501	E	82.7	Confident	82.8	Confident	154 Å²	154	56.9 Å²	56.9	72%	0.72	33%	0.332	S	S	*	.	H	α-helix	trans	-68.6	-42.7	178.9	-175	167.4	-162.4	0	0	112.2	S1497	S1497-E1501 WeakPolarHBondContact O-CB 3.39Å; S1497-E1501 PolarHBondContact O-N 2.96Å
1502	H	80.7	Confident	82.6	Confident	71 Å²	71	59.9 Å²	59.9	33%	0.329	34%	0.341	S	S	.	.	S	Bend	trans	-99.7	13.2	-177	-66.7	-87.3	0	0	0	114.3	V1498 S1504 E1505 I1506	V1498-H1502 WeakPolarHBondContact O-CB 3.16Å; V1498-H1502 PolarHBondContact O-CD2 3.46Å; V1498-H1502 PolarHBondContact O-N 3.24Å; H1502-S1504 VanDerWaalsContact C-N 3.29Å; H1502-S1504 PolarHBondContact O-N 2.83Å; H1502-S1504 VanDerWaalsContact O-N 3.1Å; H1502-E1505 IonicContact CE1-OE2 3.44Å; H1502-E1505 IonicContact CG-OE2 3.65Å; H1502-E1505 IonicContact ND1-OE2 2.71Å; H1502-E1505 PolarHBondContact ND1-OE2 2.75Å; H1502-E1505 WeakPolarHBondContact O-CB 3.33Å; H1502-E1505 PolarHBondContact O-N 3.01Å; H1502-I1506 HydrophobicContact CB-CD1 4.05Å; H1502-I1506 HydrophobicContact CB-CG1 4.21Å; H1502-I1506 WeakPolarHBondContact O-CG1 3.42Å; H1502-I1506 PolarHBondContact O-N 2.87Å
1503	A	77.6	Confident	82.3	Confident	9 Å²	9	64.8 Å²	64.8	7%	0.074	38%	0.376	C	S	.	.	H	α-helix	trans	-52.1	-41	-168.9	0	0	0	0	0	114.5	Y1499 A1507 N1726	Y1499-A1503 VanDerWaalsContact O-CA 3.24Å; Y1499-A1503 WeakPolarHBondContact O-CA 3.44Å; Y1499-A1503 WeakPolarHBondContact O-CB 3.3Å; Y1499-A1503 PolarHBondContact O-N 2.89Å; A1503-A1507 VanDerWaalsContact O-CB 3.28Å; A1503-A1507 WeakPolarHBondContact O-CB 3.41Å; A1503-A1507 PolarHBondContact O-N 3.22Å; A1503-N1726 HydrophobicContact CB-CB 4.45Å; A1503-N1726 WeakPolarHBondContact CB-ND2 3.36Å
1504	S	79.5	Confident	82.2	Confident	88 Å²	88	63.9 Å²	63.9	62%	0.615	37%	0.371	S	S	*	.	H	α-helix	trans	-70.7	-32.4	178.2	49.8	0	0	0	0	113.6	H1502 T1508	H1502-S1504 VanDerWaalsContact C-N 3.29Å; H1502-S1504 PolarHBondContact O-N 2.83Å; H1502-S1504 VanDerWaalsContact O-N 3.1Å; S1504-T1508 WeakPolarHBondContact O-CB 3.39Å; S1504-T1508 PolarHBondContact O-N 3.14Å; S1504-T1508 PolarHBondContact O-OG1 3.05Å
1505	E	81.8	Confident	82.2	Confident	122 Å²	122	64.8 Å²	64.8	57%	0.57	38%	0.377	S	S	*	.	H	α-helix	trans	-73.7	-43.5	176.4	-58.8	-179	160	0	0	110	H1502 T1508 D1509	H1502-E1505 IonicContact CE1-OE2 3.44Å; H1502-E1505 IonicContact CG-OE2 3.65Å; H1502-E1505 IonicContact ND1-OE2 2.71Å; H1502-E1505 PolarHBondContact ND1-OE2 2.75Å; H1502-E1505 WeakPolarHBondContact O-CB 3.33Å; H1502-E1505 PolarHBondContact O-N 3.01Å; E1505-T1508 WeakPolarHBondContact O-CB 3.46Å; E1505-T1508 PolarHBondContact O-N 2.85Å; E1505-T1508 VanDerWaalsContact O-N 3.1Å; E1505-D1509 PolarHBondContact O-N 2.72Å
1506	I	80	Confident	82.2	Confident	34 Å²	34	63.3 Å²	63.3	17%	0.174	37%	0.365	C	S	.	.	H	α-helix	trans	-60.9	-48.3	175	-64.5	170.6	0	0	0	110.2	F1443 Y1499 H1502 T1508 D1509 L1510	F1443-I1506 HydrophobicContact CZ-CG2 4.46Å; Y1499-I1506 HydrophobicContact CD2-CD1 3.76Å; Y1499-I1506 HydrophobicContact CD2-CG2 4.45Å; Y1499-I1506 HydrophobicContact CE2-CD1 4.33Å; Y1499-I1506 HydrophobicContact CE2-CG2 4.06Å; H1502-I1506 HydrophobicContact CB-CD1 4.05Å; H1502-I1506 HydrophobicContact CB-CG1 4.21Å; H1502-I1506 WeakPolarHBondContact O-CG1 3.42Å; H1502-I1506 PolarHBondContact O-N 2.87Å; I1506-T1508 PolarHBondContact O-N 3.48Å; I1506-D1509 PolarHBondContact O-N 2.79Å; I1506-L1510 HydrophobicContact CG2-CD1 3.68Å; I1506-L1510 HydrophobicContact CG2-CG 4.19Å; I1506-L1510 WeakPolarHBondContact O-CB 3.33Å; I1506-L1510 WeakPolarHBondContact O-CG 3.37Å; I1506-L1510 PolarHBondContact O-N 2.95Å
1507	A	81.4	Confident	82.4	Confident	58 Å²	58	63 Å²	63	48%	0.479	37%	0.365	S	S	.	.	H	α-helix	trans	-58	-30.5	175	0	0	0	0	0	112.9	A1503 A1511	A1503-A1507 VanDerWaalsContact O-CB 3.28Å; A1503-A1507 WeakPolarHBondContact O-CB 3.41Å; A1503-A1507 PolarHBondContact O-N 3.22Å; A1507-A1511 WeakPolarHBondContact O-CB 3.3Å; A1507-A1511 PolarHBondContact O-N 2.75Å
1508	T	82.7	Confident	82.8	Confident	102 Å²	102	60.7 Å²	60.7	63%	0.626	35%	0.347	S	S	*	.	H	α-helix	trans	-77.4	-40.4	178	-55.1	0	0	0	0	112.7	S1504 E1505 I1506 L1510 A1511	S1504-T1508 WeakPolarHBondContact O-CB 3.39Å; S1504-T1508 PolarHBondContact O-N 3.14Å; S1504-T1508 PolarHBondContact O-OG1 3.05Å; E1505-T1508 WeakPolarHBondContact O-CB 3.46Å; E1505-T1508 PolarHBondContact O-N 2.85Å; E1505-T1508 VanDerWaalsContact O-N 3.1Å; I1506-T1508 PolarHBondContact O-N 3.48Å; T1508-L1510 VanDerWaalsContact C-N 3.33Å; T1508-A1511 PolarHBondContact O-N 3.28Å
1509	D	80.1	Confident	83.1	Confident	64 Å²	64	58.2 Å²	58.2	34%	0.342	33%	0.332	S	S	.	.	H	α-helix	trans	-69.8	-30.6	172.7	-164.9	55.8	0	0	0	111.6	K1451 E1505 I1506 R1512	K1451-D1509 IonicContact NZ-OD2 3.41Å; E1505-D1509 PolarHBondContact O-N 2.72Å; I1506-D1509 PolarHBondContact O-N 2.79Å; D1509-R1512 WeakPolarHBondContact O-CD 3.43Å; D1509-R1512 WeakPolarHBondContact O-CG 3.48Å; D1509-R1512 WeakPolarHBondContact OD1-CD 3.26Å; D1509-R1512 IonicContact OD1-CZ 3.23Å; D1509-R1512 IonicContact OD1-NE 2.7Å; D1509-R1512 IonicContact OD1-NH1 2.88Å; D1509-R1512 PolarHBondContact OD1-NH1 3.44Å
1510	L	82.6	Confident	83.3	Confident	23 Å²	23	57.5 Å²	57.5	12%	0.12	33%	0.33	C	S	.	.	H	α-helix	trans	-73.2	-24.5	176	-68.8	176.8	0	0	0	113.7	F1443 V1445 I1506 T1508 R1512 V1518	F1443-L1510 HydrophobicContact CE2-CD1 4.29Å; F1443-L1510 HydrophobicContact CE2-CD2 4.09Å; V1445-L1510 HydrophobicContact CG1-CD2 4.26Å; V1445-L1510 HydrophobicContact CG2-CD2 3.52Å; I1506-L1510 HydrophobicContact CG2-CD1 3.68Å; I1506-L1510 HydrophobicContact CG2-CG 4.19Å; I1506-L1510 WeakPolarHBondContact O-CB 3.33Å; I1506-L1510 WeakPolarHBondContact O-CG 3.37Å; I1506-L1510 PolarHBondContact O-N 2.95Å; T1508-L1510 VanDerWaalsContact C-N 3.33Å; L1510-R1512 VanDerWaalsContact C-N 3.27Å; L1510-R1512 PolarHBondContact O-N 3.27Å; L1510-V1518 HydrophobicContact CB-CG2 4.19Å; L1510-V1518 HydrophobicContact CD1-CG1 4.21Å; L1510-V1518 HydrophobicContact CD2-CG1 4.24Å; L1510-V1518 HydrophobicContact CD2-CG2 3.83Å; L1510-V1518 HydrophobicContact CG-CG2 4.41Å
1511	A	82.7	Confident	83.6	Confident	83 Å²	83	57.4 Å²	57.4	69%	0.686	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	9.3	179.3	0	0	0	0	0	114.5	A1507 T1508	A1507-A1511 WeakPolarHBondContact O-CB 3.3Å; A1507-A1511 PolarHBondContact O-N 2.75Å; T1508-A1511 PolarHBondContact O-N 3.28Å
1512	R	84.8	Confident	83.4	Confident	102 Å²	102	51.3 Å²	51.3	39%	0.385	31%	0.305	S	S	.	.	S	Bend	trans	-75.4	145.8	-177.4	-69.7	166.5	43.4	166.2	-0.2	112.6	D1509 L1510 D1514 V1515	D1509-R1512 WeakPolarHBondContact O-CD 3.43Å; D1509-R1512 WeakPolarHBondContact O-CG 3.48Å; D1509-R1512 WeakPolarHBondContact OD1-CD 3.26Å; D1509-R1512 IonicContact OD1-CZ 3.23Å; D1509-R1512 IonicContact OD1-NE 2.7Å; D1509-R1512 IonicContact OD1-NH1 2.88Å; D1509-R1512 PolarHBondContact OD1-NH1 3.44Å; L1510-R1512 VanDerWaalsContact C-N 3.27Å; L1510-R1512 PolarHBondContact O-N 3.27Å; R1512-D1514 WeakPolarHBondContact CB-OD1 3.36Å; R1512-D1514 IonicContact CZ-OD1 3.59Å; R1512-D1514 IonicContact CZ-OD2 3.71Å; R1512-D1514 IonicContact NE-OD1 2.93Å; R1512-D1514 PolarHBondContact NE-OD1 2.96Å; R1512-D1514 IonicContact NE-OD2 3.28Å; R1512-D1514 IonicContact NH2-OD1 2.75Å; R1512-D1514 PolarHBondContact NH2-OD1 3.48Å; R1512-D1514 IonicContact NH2-OD2 3.71Å; R1512-D1514 PolarHBondContact NH2-OD2 3.48Å; R1512-D1514 PolarHBondContact O-N 3.41Å; R1512-D1514 VanDerWaalsContact O-N 3.12Å; R1512-V1515 HydrophobicContact CB-CG2 4.46Å; R1512-V1515 WeakPolarHBondContact O-CB 3.28Å; R1512-V1515 PolarHBondContact O-N 3.08Å
1513	P	82.6	Confident	83.7	Confident	126 Å²	126	48.1 Å²	48.1	82%	0.818	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-8.1	-177.3	29.6	-36.9	0	0	0	115.1
1514	D	85	Confident	84.1	Confident	39 Å²	39	47.9 Å²	47.9	21%	0.209	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-10.3	169.4	60.3	-32.7	0	0	0	113.8	M1447 R1448 T1449 R1512	M1447-D1514 CarbonylContact C-O 3.55Å; M1447-D1514 WeakPolarHBondContact CA-O 3.21Å; R1448-D1514 PolarHBondContact N-O 2.85Å; T1449-D1514 PolarHBondContact OG1-OD2 3.23Å; R1512-D1514 WeakPolarHBondContact CB-OD1 3.36Å; R1512-D1514 IonicContact CZ-OD1 3.59Å; R1512-D1514 IonicContact CZ-OD2 3.71Å; R1512-D1514 IonicContact NE-OD1 2.93Å; R1512-D1514 PolarHBondContact NE-OD1 2.96Å; R1512-D1514 IonicContact NE-OD2 3.28Å; R1512-D1514 IonicContact NH2-OD1 2.75Å; R1512-D1514 PolarHBondContact NH2-OD1 3.48Å; R1512-D1514 IonicContact NH2-OD2 3.71Å; R1512-D1514 PolarHBondContact NH2-OD2 3.48Å; R1512-D1514 PolarHBondContact O-N 3.41Å; R1512-D1514 VanDerWaalsContact O-N 3.12Å
1515	V	86.5	Confident	84.4	Confident	24 Å²	24	44.2 Å²	44.2	15%	0.145	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	133.8	164.6	-179.6	0	0	0	0	109.2	V1445 R1512 V1518	V1445-V1515 HydrophobicContact CG1-CB 4.49Å; V1445-V1515 HydrophobicContact CG1-CG1 3.7Å; V1445-V1515 HydrophobicContact CG1-CG2 4.05Å; R1512-V1515 HydrophobicContact CB-CG2 4.46Å; R1512-V1515 WeakPolarHBondContact O-CB 3.28Å; R1512-V1515 PolarHBondContact O-N 3.08Å; V1515-V1518 HydrophobicContact CG1-CG2 3.79Å
1516	E	84.2	Confident	84.7	Confident	22 Å²	22	38.5 Å²	38.5	10%	0.103	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-30.6	175.5	-173.4	-90.8	178.9	0	0	112.7	N1446 R1448 Y1487 Y1519 K1878	N1446-E1516 HydrophobicContact CB-CB 4.34Å; N1446-E1516 PolarHBondContact ND2-OE2 3.43Å; N1446-E1516 PolarHBondContact O-N 3.42Å; R1448-E1516 HydrophobicContact CG-CB 4.18Å; Y1487-E1516 HydrophobicContact CD2-CB 4.34Å; Y1487-E1516 HydrophobicContact CD2-CG 4.02Å; Y1487-E1516 HydrophobicContact CE2-CG 3.9Å; E1516-Y1519 PolarHBondContact OE2-OH 3.03Å; E1516-K1878 VanDerWaalsContact OE1-CE 3.31Å; E1516-K1878 WeakPolarHBondContact OE1-CE 3.27Å; E1516-K1878 IonicContact OE1-NZ 2.66Å; E1516-K1878 PolarHBondContact OE1-NZ 2.95Å
1517	G	87	Confident	85.3	Confident	3 Å²	3	36.9 Å²	36.9	3%	0.031	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.6	157.6	174	0	0	0	0	0	112.6	N1446 G1876	N1446-G1517 PolarHBondContact N-O 3.11Å; N1446-G1517 PolarHBondContact O-N 3.34Å; G1517-G1876 WeakPolarHBondContact CA-O 3.2Å
1518	V	89.6	Confident	85.6	Confident	25 Å²	25	35.4 Å²	35.4	15%	0.152	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	116	-178.1	-175.6	0	0	0	0	109.5	F1443 Y1444 V1445 L1510 V1515 L1521 G1876	F1443-V1518 HydrophobicContact CD2-CG1 4.15Å; Y1444-V1518 CarbonylContact O-C 3.33Å; Y1444-V1518 WeakPolarHBondContact O-CA 3.07Å; V1445-V1518 HydrophobicContact CG1-CG2 4.28Å; V1445-V1518 HydrophobicContact CG2-CG1 4.3Å; V1445-V1518 HydrophobicContact CG2-CG2 4.44Å; L1510-V1518 HydrophobicContact CB-CG2 4.19Å; L1510-V1518 HydrophobicContact CD1-CG1 4.21Å; L1510-V1518 HydrophobicContact CD2-CG1 4.24Å; L1510-V1518 HydrophobicContact CD2-CG2 3.83Å; L1510-V1518 HydrophobicContact CG-CG2 4.41Å; V1515-V1518 HydrophobicContact CG1-CG2 3.79Å; V1518-L1521 HydrophobicContact CG1-CB 4.33Å; V1518-L1521 HydrophobicContact CG1-CD2 4.47Å; V1518-G1876 PolarHBondContact N-O 3.04Å; V1518-G1876 WeakPolarHBondContact O-CA 3.46Å
1519	Y	89.4	Confident	85.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	152.6	-168.7	-52.4	-98.1	0	0	0	111.1	F1443 Y1444 N1446 L1480 P1481 H1484 E1516 L1521 V1864 L1875	F1443-Y1519 WeakPolarHBondContact CA-O 3.39Å; Y1444-Y1519 PolarHBondContact N-O 2.94Å; Y1444-Y1519 PolarHBondContact O-N 3.24Å; N1446-Y1519 HydrophobicContact CB-CE2 4.07Å; L1480-Y1519 HydrophobicContact CD1-CE2 4.13Å; L1480-Y1519 HydrophobicContact CD2-CD1 4.4Å; L1480-Y1519 HydrophobicContact CD2-CD2 3.84Å; L1480-Y1519 HydrophobicContact CD2-CE1 4.37Å; L1480-Y1519 HydrophobicContact CD2-CE2 3.85Å; L1480-Y1519 HydrophobicContact CD2-CG 4.13Å; P1481-Y1519 HydrophobicContact CG-CD1 3.84Å; P1481-Y1519 HydrophobicContact CG-CE1 4.15Å; H1484-Y1519 AromaticContact ND1-CE1 3.89Å; H1484-Y1519 AromaticContact ND1-CZ 3.91Å; H1484-Y1519 PolarHBondContact ND1-OH 3.45Å; E1516-Y1519 PolarHBondContact OE2-OH 3.03Å; Y1519-L1521 PolarHBondContact O-N 2.85Å; Y1519-V1864 HydrophobicContact CG-CG1 4.49Å; Y1519-L1875 VanDerWaalsContact CE1-C 3.4Å; Y1519-L1875 WeakPolarHBondContact CE1-O 3.39Å
1520	E	88.9	Confident	86.4	Confident	10 Å²	10	27.5 Å²	27.5	5%	0.047	16%	0.164	C	C	.	.	S	Bend	trans	65.8	8.7	-176.4	-78.6	-169.3	-146.5	0	0	116.2	Y1444 G1522 V1523 R1528 V1864 L1865 D1874	Y1444-E1520 HydrophobicContact CD2-CB 4.23Å; Y1444-E1520 HydrophobicContact CD2-CG 4.38Å; E1520-G1522 VanDerWaalsContact C-N 3.27Å; E1520-G1522 PolarHBondContact O-N 2.61Å; E1520-V1523 HydrophobicContact CB-CG2 3.87Å; E1520-V1523 HydrophobicContact CG-CG2 3.84Å; E1520-V1523 WeakPolarHBondContact O-CG2 3.07Å; E1520-V1523 PolarHBondContact O-N 3.06Å; E1520-R1528 IonicContact OE2-CZ 3.53Å; E1520-R1528 IonicContact OE2-NH1 2.72Å; E1520-R1528 PolarHBondContact OE2-NH1 3.22Å; E1520-R1528 IonicContact OE2-NH2 2.73Å; E1520-R1528 PolarHBondContact OE2-NH2 2.7Å; E1520-V1864 HydrophobicContact CG-CG1 3.95Å; E1520-L1865 HydrophobicContact CG-CB 3.95Å; E1520-L1865 WeakPolarHBondContact CG-O 3.41Å; E1520-L1865 PolarHBondContact OE1-N 2.91Å; E1520-D1874 PolarHBondContact N-OD2 2.95Å
1521	L	85.5	Confident	86.7	Confident	47 Å²	47	27.7 Å²	27.7	25%	0.246	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-34.7	177.3	-164.9	71.6	0	0	0	111.5	F1443 Y1499 V1518 Y1519 V1523	F1443-L1521 HydrophobicContact CB-CB 4.44Å; F1443-L1521 HydrophobicContact CB-CD1 4.05Å; F1443-L1521 HydrophobicContact CD1-CD1 3.9Å; F1443-L1521 HydrophobicContact CD2-CD1 4.31Å; F1443-L1521 HydrophobicContact CE1-CD1 4.41Å; F1443-L1521 HydrophobicContact CG-CD1 3.83Å; Y1499-L1521 HydrophobicContact CE2-CD1 4.04Å; V1518-L1521 HydrophobicContact CG1-CB 4.33Å; V1518-L1521 HydrophobicContact CG1-CD2 4.47Å; Y1519-L1521 PolarHBondContact O-N 2.85Å; L1521-V1523 VanDerWaalsContact C-N 3.34Å; L1521-V1523 PolarHBondContact O-N 3.09Å
1522	G	79.1	Confident	86.8	Confident	25 Å²	25	27.3 Å²	27.3	26%	0.258	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	9.4	179.6	0	0	0	0	0	116.3	E1520 P1524 V1728 C1867	E1520-G1522 VanDerWaalsContact C-N 3.27Å; E1520-G1522 PolarHBondContact O-N 2.61Å; G1522-P1524 WeakPolarHBondContact O-CD 3.21Å; G1522-V1728 WeakPolarHBondContact O-CG1 3.39Å; G1522-C1867 CarbonylContact C-O 3.49Å
1523	V	85.8	Confident	86.8	Confident	4 Å²	4	22.4 Å²	22.4	2%	0.024	13%	0.129	C	C	.	.			trans	-76.5	124	-179.6	-179.8	0	0	0	0	111.1	R1441 E1520 L1521 S1525 R1528 C1867	R1441-V1523 PolarHBondContact NH1-O 3.24Å; E1520-V1523 HydrophobicContact CB-CG2 3.87Å; E1520-V1523 HydrophobicContact CG-CG2 3.84Å; E1520-V1523 WeakPolarHBondContact O-CG2 3.07Å; E1520-V1523 PolarHBondContact O-N 3.06Å; L1521-V1523 VanDerWaalsContact C-N 3.34Å; L1521-V1523 PolarHBondContact O-N 3.09Å; V1523-S1525 PolarHBondContact O-N 3.23Å; V1523-R1528 HydrophobicContact CG1-CB 4.18Å; V1523-C1867 HydrophobicContact CG2-CB 3.99Å
1524	P	87.6	Confident	86.9	Confident	4 Å²	4	16.4 Å²	16.4	3%	0.026	9%	0.09	C	C	.	.			trans	-65.8	129.3	174.6	-19.5	31.7	0	0	0	111.7	G1522 L1526 F1527 R1528 V1728 W1730 L2013	G1522-P1524 WeakPolarHBondContact O-CD 3.21Å; P1524-L1526 VanDerWaalsContact C-N 3.29Å; P1524-L1526 PolarHBondContact O-N 2.96Å; P1524-F1527 HydrophobicContact CB-CB 4.13Å; P1524-F1527 HydrophobicContact CG-CB 4.44Å; P1524-F1527 WeakPolarHBondContact O-CB 3.11Å; P1524-F1527 PolarHBondContact O-N 3.43Å; P1524-R1528 PolarHBondContact O-N 3.36Å; P1524-V1728 HydrophobicContact CB-CG1 4.43Å; P1524-V1728 HydrophobicContact CG-CG1 4.02Å; P1524-W1730 HydrophobicContact CB-CB 3.9Å; P1524-W1730 HydrophobicContact CB-CD2 4.17Å; P1524-W1730 HydrophobicContact CB-CE3 4.1Å; P1524-W1730 HydrophobicContact CB-CG 4.12Å; P1524-W1730 HydrophobicContact CG-CB 3.87Å; P1524-W1730 HydrophobicContact CG-CD2 4.22Å; P1524-W1730 HydrophobicContact CG-CG 3.9Å; P1524-L2013 HydrophobicContact CG-CD2 4.16Å
1525	S	85.9	Confident	87.1	Confident	11 Å²	11	14.6 Å²	14.6	8%	0.077	8%	0.08	C	C	.	.	H	α-helix	trans	-60.8	-36.9	-175.6	-50.5	0	0	0	0	112.6	V1523 F1527 R1528 I1529	V1523-S1525 PolarHBondContact O-N 3.23Å; S1525-F1527 PolarHBondContact O-N 3.15Å; S1525-R1528 PolarHBondContact O-N 2.63Å; S1525-I1529 WeakPolarHBondContact O-CG1 3.45Å; S1525-I1529 PolarHBondContact O-N 2.93Å
1526	L	88.4	Confident	87.2	Confident	2 Å²	2	13.4 Å²	13.4	1%	0.01	7%	0.073	C	C	.	.	H	α-helix	trans	-61.4	-41.6	173	-179.1	61.4	0	0	0	112.5	I1405 Y1415 P1524 R1528 I1529 L1530 W1730 N1733 I1736	I1405-L1526 HydrophobicContact CB-CD1 4.33Å; I1405-L1526 HydrophobicContact CG2-CD1 3.95Å; Y1415-L1526 HydrophobicContact CD1-CD1 4.27Å; Y1415-L1526 HydrophobicContact CE1-CB 3.95Å; Y1415-L1526 HydrophobicContact CE1-CD1 3.91Å; Y1415-L1526 HydrophobicContact CE1-CG 4.45Å; Y1415-L1526 PolarHBondContact OH-N 3.05Å; P1524-L1526 VanDerWaalsContact C-N 3.29Å; P1524-L1526 PolarHBondContact O-N 2.96Å; L1526-R1528 VanDerWaalsContact C-N 3.35Å; L1526-I1529 PolarHBondContact O-N 2.82Å; L1526-L1530 HydrophobicContact CD1-CD1 4.39Å; L1526-L1530 HydrophobicContact CD1-CG 4.4Å; L1526-L1530 HydrophobicContact CG-CD1 4.1Å; L1526-L1530 WeakPolarHBondContact O-CG 3.12Å; L1526-L1530 PolarHBondContact O-N 2.75Å; L1526-W1730 HydrophobicContact CB-CE3 4.29Å; L1526-W1730 HydrophobicContact CB-CZ3 4.13Å; L1526-W1730 HydrophobicContact CD2-CE3 4.24Å; L1526-W1730 HydrophobicContact CD2-CZ3 3.93Å; L1526-W1730 HydrophobicContact CG-CE3 4.48Å; L1526-W1730 HydrophobicContact CG-CZ3 3.96Å; L1526-N1733 HydrophobicContact CD2-CB 4.38Å; L1526-I1736 HydrophobicContact CD2-CD1 3.63Å
1527	F	90.8	Very high	87.4	Confident	1 Å²	1	12.4 Å²	12.4	0%	0.004	7%	0.068	C	C	.	.	H	α-helix	trans	-63.6	-42	175.3	-177.7	-98.3	0	0	0	111	P1524 S1525 I1529 L1530 M1531 W1730 L1848 D1851 L1852 A1855 L2013 F2014	P1524-F1527 HydrophobicContact CB-CB 4.13Å; P1524-F1527 HydrophobicContact CG-CB 4.44Å; P1524-F1527 WeakPolarHBondContact O-CB 3.11Å; P1524-F1527 PolarHBondContact O-N 3.43Å; S1525-F1527 PolarHBondContact O-N 3.15Å; F1527-I1529 VanDerWaalsContact C-N 3.29Å; F1527-I1529 PolarHBondContact O-N 3.12Å; F1527-L1530 PolarHBondContact O-N 3.29Å; F1527-M1531 VanDerWaalsContact O-CB 3.31Å; F1527-M1531 WeakPolarHBondContact O-CB 3.21Å; F1527-M1531 PolarHBondContact O-N 3.1Å; F1527-W1730 HydrophobicContact CB-CE3 4.43Å; F1527-W1730 HydrophobicContact CB-CH2 3.99Å; F1527-W1730 HydrophobicContact CB-CZ2 4.46Å; F1527-W1730 HydrophobicContact CB-CZ3 3.98Å; F1527-W1730 AromaticContact CD2-CH2 3.9Å; F1527-W1730 HydrophobicContact CD2-CH2 3.9Å; F1527-W1730 HydrophobicContact CD2-CZ2 4.04Å; F1527-W1730 HydrophobicContact CG-CH2 4.46Å; F1527-L1848 HydrophobicContact CD2-CD1 4.4Å; F1527-L1848 HydrophobicContact CE2-CD1 4.45Å; F1527-D1851 HydrophobicContact CE2-CB 4.03Å; F1527-D1851 HydrophobicContact CZ-CB 4.29Å; F1527-L1852 HydrophobicContact CD2-CD2 4.05Å; F1527-L1852 HydrophobicContact CE2-CD2 3.53Å; F1527-L1852 HydrophobicContact CE2-CG 3.84Å; F1527-L1852 HydrophobicContact CZ-CD2 4.02Å; F1527-L1852 HydrophobicContact CZ-CG 4.48Å; F1527-A1855 HydrophobicContact CE1-CB 3.89Å; F1527-A1855 HydrophobicContact CZ-CB 3.75Å; F1527-L2013 HydrophobicContact CB-CD1 4.18Å; F1527-L2013 HydrophobicContact CD1-CD1 4.05Å; F1527-L2013 HydrophobicContact CD2-CD1 3.4Å; F1527-L2013 HydrophobicContact CE1-CD1 4.32Å; F1527-L2013 HydrophobicContact CE2-CD1 3.69Å; F1527-L2013 HydrophobicContact CG-CD1 3.6Å; F1527-L2013 HydrophobicContact CZ-CD1 4.16Å; F1527-F2014 AromaticContact CE1-CE2 3.95Å; F1527-F2014 HydrophobicContact CE1-CE2 3.95Å; F1527-F2014 HydrophobicContact CE1-CZ 4.31Å; F1527-F2014 AromaticContact CZ-CE2 3.83Å; F1527-F2014 HydrophobicContact CZ-CE2 3.83Å
1528	R	89.2	Confident	87.3	Confident	26 Å²	26	14 Å²	14	10%	0.098	8%	0.078	C	C	.	.	H	α-helix	trans	-60.2	-36	175.8	-161	-179.6	-74.6	-82.3	11.4	112.1	N1442 E1520 V1523 P1524 S1525 L1526 K1532 L1560	N1442-R1528 PolarHBondContact O-NH2 2.84Å; E1520-R1528 IonicContact OE2-CZ 3.53Å; E1520-R1528 IonicContact OE2-NH1 2.72Å; E1520-R1528 PolarHBondContact OE2-NH1 3.22Å; E1520-R1528 IonicContact OE2-NH2 2.73Å; E1520-R1528 PolarHBondContact OE2-NH2 2.7Å; V1523-R1528 HydrophobicContact CG1-CB 4.18Å; P1524-R1528 PolarHBondContact O-N 3.36Å; S1525-R1528 PolarHBondContact O-N 2.63Å; L1526-R1528 VanDerWaalsContact C-N 3.35Å; R1528-K1532 WeakPolarHBondContact O-CB 3.23Å; R1528-K1532 PolarHBondContact O-N 3.43Å; R1528-L1560 HydrophobicContact CG-CD2 4.45Å
1529	I	88.8	Confident	87	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-67.8	-52.9	171.5	-56.6	163.3	0	0	0	111.2	I1405 Y1415 V1439 S1525 L1526 F1527 M1531 K1532 V1533 L1560	I1405-I1529 HydrophobicContact CD1-CG2 3.56Å; I1405-I1529 HydrophobicContact CG2-CD1 4.29Å; Y1415-I1529 HydrophobicContact CD1-CD1 3.81Å; Y1415-I1529 HydrophobicContact CD2-CD1 3.5Å; Y1415-I1529 HydrophobicContact CE1-CD1 4.06Å; Y1415-I1529 HydrophobicContact CE2-CD1 3.79Å; Y1415-I1529 HydrophobicContact CG-CD1 3.54Å; V1439-I1529 HydrophobicContact CG2-CD1 3.73Å; V1439-I1529 HydrophobicContact CG2-CG1 3.7Å; S1525-I1529 WeakPolarHBondContact O-CG1 3.45Å; S1525-I1529 PolarHBondContact O-N 2.93Å; L1526-I1529 PolarHBondContact O-N 2.82Å; F1527-I1529 VanDerWaalsContact C-N 3.29Å; F1527-I1529 PolarHBondContact O-N 3.12Å; I1529-M1531 VanDerWaalsContact C-N 3.25Å; I1529-M1531 PolarHBondContact O-N 3.4Å; I1529-K1532 PolarHBondContact O-N 3.42Å; I1529-K1532 VanDerWaalsContact O-N 3.13Å; I1529-V1533 HydrophobicContact CG2-CB 4.14Å; I1529-V1533 HydrophobicContact CG2-CG2 3.85Å; I1529-V1533 WeakPolarHBondContact O-CB 3.39Å; I1529-V1533 PolarHBondContact O-N 2.95Å; I1529-L1560 HydrophobicContact CG1-CD1 4.29Å; I1529-L1560 HydrophobicContact CG1-CD2 4.4Å; I1529-L1560 HydrophobicContact CG2-CD1 4.41Å
1530	L	89.9	Confident	86.4	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-59.6	-36	-177.2	-69.6	169.8	0	0	0	112.4	I1405 L1526 F1527 G1534 W1730 L1732 I1813 P1814 N1817 L1852 R1856	I1405-L1530 HydrophobicContact CD1-CD2 4.17Å; L1526-L1530 HydrophobicContact CD1-CD1 4.39Å; L1526-L1530 HydrophobicContact CD1-CG 4.4Å; L1526-L1530 HydrophobicContact CG-CD1 4.1Å; L1526-L1530 WeakPolarHBondContact O-CG 3.12Å; L1526-L1530 PolarHBondContact O-N 2.75Å; F1527-L1530 PolarHBondContact O-N 3.29Å; L1530-G1534 PolarHBondContact O-N 3.07Å; L1530-W1730 HydrophobicContact CD1-CH2 4.22Å; L1530-W1730 HydrophobicContact CD1-CZ3 4.3Å; L1530-L1732 HydrophobicContact CD1-CD2 4.35Å; L1530-I1813 HydrophobicContact CD2-CG2 4.43Å; L1530-P1814 HydrophobicContact CD2-CG 4.35Å; L1530-N1817 HydrophobicContact CD2-CB 4.03Å; L1530-L1852 HydrophobicContact CB-CD2 4.12Å; L1530-R1856 PolarHBondContact O-NH2 3.25Å
1531	M	88.5	Confident	85.4	Confident	27 Å²	27	24.9 Å²	24.9	13%	0.133	12%	0.12	C	C	.	.	H	α-helix	trans	-65.1	-47.8	173.9	-176.3	-172.3	67.9	0	0	112.4	F1527 I1529 L1852 A1855 R1856 V1859 L1865	F1527-M1531 VanDerWaalsContact O-CB 3.31Å; F1527-M1531 WeakPolarHBondContact O-CB 3.21Å; F1527-M1531 PolarHBondContact O-N 3.1Å; I1529-M1531 VanDerWaalsContact C-N 3.25Å; I1529-M1531 PolarHBondContact O-N 3.4Å; M1531-L1852 HydrophobicContact CB-CD2 4.25Å; M1531-A1855 HydrophobicContact CG-CB 4.25Å; M1531-A1855 HydrophobicContact SD-CB 3.67Å; M1531-R1856 HydrophobicContact CG-CG 3.97Å; M1531-R1856 PolarHBondContact O-NE 2.94Å; M1531-V1859 HydrophobicContact CE-CG2 4.15Å; M1531-V1859 HydrophobicContact SD-CG2 3.97Å; M1531-L1865 HydrophobicContact CE-CD1 4.17Å; M1531-L1865 HydrophobicContact SD-CD1 3.82Å
1532	K	85	Confident	84.4	Confident	75 Å²	75	28.6 Å²	28.6	33%	0.326	14%	0.136	S	C	.	.	H	α-helix	trans	-88.4	-33.9	-169.7	177.3	166.3	173	163.2	0	115.1	R1528 I1529 L1560 D1561	R1528-K1532 WeakPolarHBondContact O-CB 3.23Å; R1528-K1532 PolarHBondContact O-N 3.43Å; I1529-K1532 PolarHBondContact O-N 3.42Å; I1529-K1532 VanDerWaalsContact O-N 3.13Å; K1532-L1560 HydrophobicContact CD-CD1 4.35Å; K1532-L1560 HydrophobicContact CD-CD2 4.45Å; K1532-L1560 HydrophobicContact CD-CG 4.09Å; K1532-L1560 WeakPolarHBondContact CE-O 3.28Å; K1532-D1561 IonicContact NZ-OD1 3.06Å; K1532-D1561 PolarHBondContact NZ-OD1 3.19Å
1533	V	84.5	Confident	83.5	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-41.3	-174.2	-174.7	0	0	0	0	111.6	I1529 C1537 L1560 L1563	I1529-V1533 HydrophobicContact CG2-CB 4.14Å; I1529-V1533 HydrophobicContact CG2-CG2 3.85Å; I1529-V1533 WeakPolarHBondContact O-CB 3.39Å; I1529-V1533 PolarHBondContact O-N 2.95Å; V1533-C1537 HydrophobicContact CG1-CB 3.65Å; V1533-C1537 VanDerWaalsContact CG1-SG 3.54Å; V1533-L1560 HydrophobicContact CG2-CD1 3.43Å; V1533-L1560 VanDerWaalsContact CG2-CD1 3.43Å; V1533-L1563 HydrophobicContact CG1-CD1 4.42Å; V1533-L1563 HydrophobicContact CG2-CD1 4.5Å
1534	G	86.3	Confident	82	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.138	C	C	.	.			trans	61	-158.1	-178.9	0	0	0	0	0	114.8	L1530 H1812	L1530-G1534 PolarHBondContact O-N 3.07Å; G1534-H1812 CarbonylContact C-O 3.33Å; G1534-H1812 WeakPolarHBondContact CA-O 3.35Å
1535	C	89	Confident	80.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-74.7	-22.6	178.5	65.4	0	0	0	0	114.7	V1402 Y1573 H1812 I1813	V1402-C1535 PolarHBondContact N-O 2.65Å; C1535-Y1573 HydrophobicContact CB-CD1 4.35Å; C1535-Y1573 HydrophobicContact CB-CD2 3.74Å; C1535-Y1573 HydrophobicContact CB-CE1 4.32Å; C1535-Y1573 HydrophobicContact CB-CE2 3.71Å; C1535-Y1573 HydrophobicContact CB-CG 4.06Å; C1535-Y1573 WeakPolarHBondContact O-CD2 3.49Å; C1535-Y1573 VanDerWaalsContact O-CE2 3.25Å; C1535-Y1573 WeakPolarHBondContact O-CE2 3.47Å; C1535-H1812 PolarHBondContact N-O 3.42Å; C1535-I1813 WeakPolarHBondContact CB-O 3.26Å
1536	L	88.3	Confident	79.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	127	-173.8	-73.1	172.8	0	0	0	110.1	V1399 W1400 Q1401 F1565 C1566 L1568 H1571 Y1573	V1399-L1536 HydrophobicContact CG1-CD2 4.01Å; W1400-L1536 WeakPolarHBondContact O-CA 3.34Å; Q1401-L1536 HydrophobicContact CB-CD2 4.25Å; Q1401-L1536 HydrophobicContact CG-CD2 3.71Å; L1536-F1565 WeakPolarHBondContact O-CD2 3.44Å; L1536-C1566 HydrophobicContact CB-CB 4.16Å; L1536-C1566 WeakPolarHBondContact CB-O 3.45Å; L1536-C1566 PolarHBondContact O-N 2.95Å; L1536-L1568 HydrophobicContact CD1-CD2 3.64Å; L1536-L1568 HydrophobicContact CD1-CG 4.26Å; L1536-H1571 WeakPolarHBondContact CD1-O 3.25Å; L1536-Y1573 HydrophobicContact CD2-CD2 4.01Å; L1536-Y1573 HydrophobicContact CG-CD2 4.11Å
1537	C	88.7	Confident	77.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	168.3	177.2	65.8	0	0	0	0	113	W1400 V1533 C1564	W1400-C1537 PolarHBondContact N-O 3.03Å; W1400-C1537 PolarHBondContact O-N 2.86Å; V1533-C1537 HydrophobicContact CG1-CB 3.65Å; V1533-C1537 VanDerWaalsContact CG1-SG 3.54Å; C1537-C1564 CarbonylContact C-O 3.47Å; C1537-C1564 WeakPolarHBondContact CA-O 2.9Å; C1537-C1564 VanDerWaalsContact CB-O 3.31Å; C1537-C1564 WeakPolarHBondContact CB-O 3.26Å
1538	T	85	Confident	75.2	Confident	38 Å²	38	52.5 Å²	52.5	23%	0.233	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	150.9	169.4	47.8	0	0	0	0	109.7	V1399 C1564 C1566	V1399-T1538 HydrophobicContact CB-CG2 4.33Å; V1399-T1538 HydrophobicContact CG2-CG2 3.94Å; T1538-C1564 PolarHBondContact N-O 3.06Å; T1538-C1564 PolarHBondContact O-N 3.41Å; T1538-C1566 VanDerWaalsContact CG2-SG 3.56Å; T1538-C1566 PolarHBondContact OG1-SG 2.76Å
1539	V	82.3	Confident	73	Confident	8 Å²	8	59.6 Å²	59.6	5%	0.048	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	135.6	165.3	-167.5	0	0	0	0	109.5	F1396 W1400 A1543 F1558 Q1562 L1563	F1396-V1539 HydrophobicContact CD1-CB 4.15Å; F1396-V1539 HydrophobicContact CD1-CG1 3.76Å; F1396-V1539 HydrophobicContact CD1-CG2 4.24Å; F1396-V1539 HydrophobicContact CE1-CG1 3.94Å; W1400-V1539 HydrophobicContact CH2-CG2 3.92Å; W1400-V1539 HydrophobicContact CZ2-CG2 3.34Å; V1539-A1543 HydrophobicContact CG1-CB 4.45Å; V1539-F1558 HydrophobicContact CG1-CD1 4.42Å; V1539-F1558 HydrophobicContact CG1-CE1 4.08Å; V1539-F1558 HydrophobicContact CG2-CD1 4.44Å; V1539-F1558 HydrophobicContact CG2-CE1 3.84Å; V1539-Q1562 WeakPolarHBondContact CA-O 3.47Å; V1539-L1563 HydrophobicContact CB-CD2 4.38Å; V1539-L1563 HydrophobicContact CG2-CD2 3.97Å
1540	D	76.2	Confident	70.4	Confident	48 Å²	48	61.8 Å²	61.8	26%	0.257	30%	0.296	S	S	.	.			trans	-61.4	144.6	177.6	168.7	49.9	0	0	0	112.3	E1542 A1543 F1544 Q1562	D1540-E1542 VanDerWaalsContact CG-N 3.35Å; D1540-E1542 PolarHBondContact OD1-N 3.36Å; D1540-E1542 VanDerWaalsContact OD2-CA 3.31Å; D1540-E1542 WeakPolarHBondContact OD2-CA 3.33Å; D1540-E1542 VanDerWaalsContact OD2-CB 3.25Å; D1540-E1542 WeakPolarHBondContact OD2-CB 3.48Å; D1540-E1542 PolarHBondContact OD2-N 3.27Å; D1540-A1543 HydrophobicContact CB-CB 4.09Å; D1540-A1543 PolarHBondContact OD2-N 2.84Å; D1540-F1544 WeakPolarHBondContact O-CB 3.48Å; D1540-F1544 PolarHBondContact O-N 2.92Å; D1540-Q1562 PolarHBondContact N-O 3.42Å
1541	R	68.4	Low	68	Low	206 Å²	206	67 Å²	67	78%	0.777	33%	0.333	S	S	*	.	H	α-helix	trans	-72.7	-26	-179.8	-71.5	-177.8	170.1	-173.6	-2.6	112.8	R1545	R1541-R1545 VanDerWaalsContact O-CG 3.31Å; R1541-R1545 WeakPolarHBondContact O-CG 3.3Å; R1541-R1545 PolarHBondContact O-N 2.77Å; R1541-R1545 VanDerWaalsContact O-N 3.07Å
1542	E	64.2	Low	65.4	Low	125 Å²	125	70.1 Å²	70.1	58%	0.584	35%	0.353	S	S	*	.	H	α-helix	trans	-78.5	-41.4	173.5	-50.9	-157.2	147.4	0	0	111	D1540 F1544 R1545 N1546	D1540-E1542 VanDerWaalsContact CG-N 3.35Å; D1540-E1542 PolarHBondContact OD1-N 3.36Å; D1540-E1542 VanDerWaalsContact OD2-CA 3.31Å; D1540-E1542 WeakPolarHBondContact OD2-CA 3.33Å; D1540-E1542 VanDerWaalsContact OD2-CB 3.25Å; D1540-E1542 WeakPolarHBondContact OD2-CB 3.48Å; D1540-E1542 PolarHBondContact OD2-N 3.27Å; E1542-F1544 VanDerWaalsContact C-N 3.31Å; E1542-F1544 PolarHBondContact O-N 3.46Å; E1542-R1545 WeakPolarHBondContact O-CB 3.4Å; E1542-R1545 PolarHBondContact O-N 3.22Å; E1542-R1545 VanDerWaalsContact O-N 3.15Å; E1542-N1546 PolarHBondContact O-N 3.05Å; E1542-N1546 PolarHBondContact O-ND2 3.14Å
1543	A	61	Low	63.1	Low	11 Å²	11	70.7 Å²	70.7	9%	0.091	37%	0.366	C	S	.	.	H	α-helix	trans	-54.7	-45.2	167.9	0	0	0	0	0	112	V1539 D1540 N1546 N1547 Q1562	V1539-A1543 HydrophobicContact CG1-CB 4.45Å; D1540-A1543 HydrophobicContact CB-CB 4.09Å; D1540-A1543 PolarHBondContact OD2-N 2.84Å; A1543-N1546 PolarHBondContact O-N 2.99Å; A1543-N1547 WeakPolarHBondContact O-CB 3.36Å; A1543-N1547 PolarHBondContact O-N 3.23Å; A1543-Q1562 HydrophobicContact CB-CB 3.98Å; A1543-Q1562 HydrophobicContact CB-CG 4.01Å
1544	F	55.3	Low	61.1	Low	54 Å²	54	77.8 Å²	77.8	24%	0.237	40%	0.404	C	S	.	.	H	α-helix	trans	-63.7	-39.3	175	-179.5	-125.5	0	0	0	113.3	F1396 D1540 E1542 Q1548	F1396-F1544 HydrophobicContact CB-CD2 3.49Å; F1396-F1544 VanDerWaalsContact CB-CD2 3.49Å; F1396-F1544 HydrophobicContact CB-CE2 3.53Å; F1396-F1544 HydrophobicContact CB-CG 4.31Å; F1396-F1544 HydrophobicContact CB-CZ 4.38Å; F1396-F1544 HydrophobicContact CD1-CB 4.33Å; F1396-F1544 AromaticContact CD1-CD2 3.62Å; F1396-F1544 HydrophobicContact CD1-CD2 3.62Å; F1396-F1544 HydrophobicContact CD1-CE2 4.39Å; F1396-F1544 HydrophobicContact CD1-CG 4.37Å; F1396-F1544 HydrophobicContact CD2-CD2 4.33Å; F1396-F1544 HydrophobicContact CD2-CE2 4.36Å; F1396-F1544 HydrophobicContact CE1-CD2 4.44Å; F1396-F1544 AromaticContact CG-CD2 3.56Å; F1396-F1544 HydrophobicContact CG-CD2 3.56Å; F1396-F1544 AromaticContact CG-CE2 3.87Å; F1396-F1544 HydrophobicContact CG-CE2 3.87Å; D1540-F1544 WeakPolarHBondContact O-CB 3.48Å; D1540-F1544 PolarHBondContact O-N 2.92Å; E1542-F1544 VanDerWaalsContact C-N 3.31Å; E1542-F1544 PolarHBondContact O-N 3.46Å; F1544-Q1548 PolarHBondContact O-N 3.05Å
1545	R	54.2	Low	59.2	Low	171 Å²	171	85.2 Å²	85.2	65%	0.645	44%	0.439	S	S	*	.	H	α-helix	trans	-63.6	-48	174.8	-81.7	171	166.8	176.8	-4.4	111.8	R1541 E1542 N1547 Q1548	R1541-R1545 VanDerWaalsContact O-CG 3.31Å; R1541-R1545 WeakPolarHBondContact O-CG 3.3Å; R1541-R1545 PolarHBondContact O-N 2.77Å; R1541-R1545 VanDerWaalsContact O-N 3.07Å; E1542-R1545 WeakPolarHBondContact O-CB 3.4Å; E1542-R1545 PolarHBondContact O-N 3.22Å; E1542-R1545 VanDerWaalsContact O-N 3.15Å; R1545-N1547 VanDerWaalsContact C-N 3.3Å; R1545-N1547 PolarHBondContact O-N 3.2Å; R1545-Q1548 PolarHBondContact O-N 3.44Å
1546	N	56.4	Low	57.7	Low	116 Å²	116	88.1 Å²	88.1	62%	0.62	47%	0.469	S	S	*	.	H	α-helix	trans	-60.9	-41.2	-179.7	-69.6	-25.5	0	0	0	111.3	E1542 A1543 Q1548 H1549 G1550	E1542-N1546 PolarHBondContact O-N 3.05Å; E1542-N1546 PolarHBondContact O-ND2 3.14Å; A1543-N1546 PolarHBondContact O-N 2.99Å; N1546-Q1548 PolarHBondContact O-N 2.81Å; N1546-H1549 PolarHBondContact O-N 3.06Å; N1546-H1549 VanDerWaalsContact O-N 3.13Å; N1546-G1550 PolarHBondContact O-N 3.16Å
1547	N	52.8	Low	56.8	Low	78 Å²	78	90.4 Å²	90.4	42%	0.417	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-7.3	176	-77.2	-11.6	0	0	0	115.1	A1543 R1545	A1543-N1547 WeakPolarHBondContact O-CB 3.36Å; A1543-N1547 PolarHBondContact O-N 3.23Å; R1545-N1547 VanDerWaalsContact C-N 3.3Å; R1545-N1547 PolarHBondContact O-N 3.2Å
1548	Q	46.5	Very low	56.4	Low	120 Å²	120	91.2 Å²	91.2	56%	0.561	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-14.3	170.2	-71.3	-173.6	30.1	0	0	114	F1544 R1545 N1546	F1544-Q1548 PolarHBondContact O-N 3.05Å; R1545-Q1548 PolarHBondContact O-N 3.44Å; N1546-Q1548 PolarHBondContact O-N 2.81Å
1549	H	42.4	Very low	56.3	Low	175 Å²	175	93 Å²	93	81%	0.81	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-12.1	179.1	-67.3	-29.2	0	0	0	114	N1546	N1546-H1549 PolarHBondContact O-N 3.06Å; N1546-H1549 VanDerWaalsContact O-N 3.13Å
1550	G	34.2	Very low	56.4	Low	46 Å²	46	93.1 Å²	93.1	47%	0.474	50%	0.497	S	S	.	.	S	Bend	trans	-73.5	147.1	170.2	0	0	0	0	0	113.5	N1546 V1552	N1546-G1550 PolarHBondContact O-N 3.16Å; G1550-V1552 PolarHBondContact O-N 3.26Å
1551	S	38.6	Very low	56.6	Low	110 Å²	110	94.9 Å²	94.9	77%	0.769	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-69.8	123.6	161.1	-179	0	0	0	0	108	S1553	S1551-S1553 PolarHBondContact O-N 3.08Å
1552	V	33.6	Very low	57.1	Low	92 Å²	92	87.3 Å²	87.3	56%	0.558	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-54.3	120	-177	178.9	0	0	0	0	110.8	G1550	G1550-V1552 PolarHBondContact O-N 3.26Å
1553	S	37.8	Very low	58.2	Low	86 Å²	86	81.5 Å²	81.5	60%	0.601	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-73	133.3	158.3	44.7	0	0	0	0	108.7	S1551 E1555	S1551-S1553 PolarHBondContact O-N 3.08Å; S1553-E1555 PolarHBondContact O-N 3.3Å
1554	D	42.9	Very low	59.2	Low	149 Å²	149	83.7 Å²	83.7	80%	0.797	47%	0.466	S	S	*	.	S	Bend	trans	-72.5	-0.5	-179.8	-86.8	-28.1	0	0	0	113.2
1555	E	46.1	Very low	60.5	Low	157 Å²	157	84.8 Å²	84.8	73%	0.734	47%	0.471	S	S	*	.			trans	-83.8	116.2	175.4	-69.7	169.8	-176.4	0	0	109.9	S1553 S1557	S1553-E1555 PolarHBondContact O-N 3.3Å; E1555-S1557 VanDerWaalsContact C-N 3.27Å; E1555-S1557 PolarHBondContact O-N 3.32Å
1556	G	56.5	Low	61.8	Low	61 Å²	61	77.3 Å²	77.3	63%	0.629	45%	0.445	S	S	*	.			trans	-84.3	15.2	-171	0	0	0	0	0	115.9
1557	S	71	Confident	62.8	Low	47 Å²	47	73.9 Å²	73.9	33%	0.329	43%	0.43	S	S	.	.			trans	-88.9	151.4	-173.9	52	0	0	0	0	113.5	D1436 E1555	D1436-S1557 CarbonylContact O-C 3.34Å; D1436-S1557 VanDerWaalsContact O-CA 3.28Å; D1436-S1557 WeakPolarHBondContact O-CA 3.35Å; E1555-S1557 VanDerWaalsContact C-N 3.27Å; E1555-S1557 PolarHBondContact O-N 3.32Å
1558	F	79.4	Confident	64.1	Low	18 Å²	18	72.4 Å²	72.4	8%	0.079	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.1	174.6	-69	-103.5	0	0	0	111	F1396 W1400 V1435 D1436 I1437 T1438 V1539	F1396-F1558 HydrophobicContact CD1-CE1 4.4Å; F1396-F1558 AromaticContact CE1-CE1 3.65Å; F1396-F1558 HydrophobicContact CE1-CE1 3.65Å; F1396-F1558 HydrophobicContact CE1-CZ 4.13Å; F1396-F1558 HydrophobicContact CE2-CZ 4.5Å; F1396-F1558 AromaticContact CZ-CE1 3.86Å; F1396-F1558 HydrophobicContact CZ-CE1 3.86Å; F1396-F1558 AromaticContact CZ-CZ 3.92Å; F1396-F1558 HydrophobicContact CZ-CZ 3.92Å; W1400-F1558 HydrophobicContact CH2-CD1 4.28Å; W1400-F1558 HydrophobicContact CH2-CD2 4.13Å; W1400-F1558 HydrophobicContact CH2-CE1 4.16Å; W1400-F1558 HydrophobicContact CH2-CE2 4.02Å; W1400-F1558 HydrophobicContact CH2-CG 4.26Å; W1400-F1558 HydrophobicContact CH2-CZ 4.03Å; W1400-F1558 HydrophobicContact CZ2-CE1 4.37Å; W1400-F1558 HydrophobicContact CZ2-CE2 4.47Å; W1400-F1558 HydrophobicContact CZ2-CZ 4.14Å; V1435-F1558 HydrophobicContact CG1-CD2 3.48Å; V1435-F1558 VanDerWaalsContact CG1-CD2 3.48Å; V1435-F1558 HydrophobicContact CG1-CE2 3.67Å; D1436-F1558 PolarHBondContact O-N 2.76Å; I1437-F1558 VanDerWaalsContact CA-O 3.28Å; I1437-F1558 WeakPolarHBondContact CA-O 3.41Å; I1437-F1558 HydrophobicContact CG1-CB 4.38Å; T1438-F1558 PolarHBondContact N-O 2.93Å; T1438-F1558 PolarHBondContact OG1-O 2.84Å; V1539-F1558 HydrophobicContact CG1-CD1 4.42Å; V1539-F1558 HydrophobicContact CG1-CE1 4.08Å; V1539-F1558 HydrophobicContact CG2-CD1 4.44Å; V1539-F1558 HydrophobicContact CG2-CE1 3.84Å
1559	N	82.6	Confident	65.4	Low	76 Å²	76	71.4 Å²	71.4	41%	0.406	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	142.2	168.2	-84.3	-42.7	0	0	0	110	T1438 D1561 Q1562	T1438-N1559 PolarHBondContact OG1-OD1 3.47Å; N1559-D1561 PolarHBondContact O-N 3.02Å; N1559-Q1562 HydrophobicContact CB-CG 4.3Å; N1559-Q1562 VanDerWaalsContact N-OE1 3.12Å; N1559-Q1562 WeakPolarHBondContact O-CB 3.21Å; N1559-Q1562 PolarHBondContact O-N 3.07Å
1560	L	84.2	Confident	66.9	Low	10 Å²	10	70 Å²	70	5%	0.052	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-51.5	-29.1	179.4	179.7	60.5	0	0	0	114.2	T1438 V1439 R1528 I1529 K1532 V1533 Q1562	T1438-L1560 PolarHBondContact O-N 3.43Å; T1438-L1560 VanDerWaalsContact O-N 3.1Å; V1439-L1560 HydrophobicContact CG1-CD2 3.91Å; V1439-L1560 HydrophobicContact CG2-CB 4.33Å; V1439-L1560 HydrophobicContact CG2-CD2 4.19Å; R1528-L1560 HydrophobicContact CG-CD2 4.45Å; I1529-L1560 HydrophobicContact CG1-CD1 4.29Å; I1529-L1560 HydrophobicContact CG1-CD2 4.4Å; I1529-L1560 HydrophobicContact CG2-CD1 4.41Å; K1532-L1560 HydrophobicContact CD-CD1 4.35Å; K1532-L1560 HydrophobicContact CD-CD2 4.45Å; K1532-L1560 HydrophobicContact CD-CG 4.09Å; K1532-L1560 WeakPolarHBondContact CE-O 3.28Å; V1533-L1560 HydrophobicContact CG2-CD1 3.43Å; V1533-L1560 VanDerWaalsContact CG2-CD1 3.43Å; L1560-Q1562 VanDerWaalsContact C-N 3.27Å; L1560-Q1562 PolarHBondContact O-N 3.06Å
1561	D	80.3	Confident	68.9	Low	84 Å²	84	70 Å²	70	45%	0.449	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-75.3	-10.4	178.4	-63.9	-35.9	0	0	0	114.5	N1493 K1532 N1559 L1563	N1493-D1561 PolarHBondContact ND2-OD2 3.31Å; K1532-D1561 IonicContact NZ-OD1 3.06Å; K1532-D1561 PolarHBondContact NZ-OD1 3.19Å; N1559-D1561 PolarHBondContact O-N 3.02Å; D1561-L1563 VanDerWaalsContact C-N 3.34Å
1562	Q	80.2	Confident	70.9	Confident	48 Å²	48	68.1 Å²	68.1	22%	0.224	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-87.6	-0.4	176.6	-60.5	173.4	-25.5	0	0	113.2	V1539 D1540 A1543 N1559 L1560	V1539-Q1562 WeakPolarHBondContact CA-O 3.47Å; D1540-Q1562 PolarHBondContact N-O 3.42Å; A1543-Q1562 HydrophobicContact CB-CB 3.98Å; A1543-Q1562 HydrophobicContact CB-CG 4.01Å; N1559-Q1562 HydrophobicContact CB-CG 4.3Å; N1559-Q1562 VanDerWaalsContact N-OE1 3.12Å; N1559-Q1562 WeakPolarHBondContact O-CB 3.21Å; N1559-Q1562 PolarHBondContact O-N 3.07Å; L1560-Q1562 VanDerWaalsContact C-N 3.27Å; L1560-Q1562 PolarHBondContact O-N 3.06Å
1563	L	86.2	Confident	73.4	Confident	3 Å²	3	63.8 Å²	63.8	2%	0.016	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.7	-177.5	-59.3	-175.7	0	0	0	111.9	W1400 I1437 V1533 V1539 D1561	W1400-L1563 HydrophobicContact CE3-CD1 4.5Å; W1400-L1563 HydrophobicContact CE3-CD2 4.39Å; W1400-L1563 HydrophobicContact CH2-CD2 3.91Å; W1400-L1563 HydrophobicContact CZ3-CD1 3.94Å; W1400-L1563 HydrophobicContact CZ3-CD2 3.8Å; I1437-L1563 HydrophobicContact CD1-CD1 3.38Å; V1533-L1563 HydrophobicContact CG1-CD1 4.42Å; V1533-L1563 HydrophobicContact CG2-CD1 4.5Å; V1539-L1563 HydrophobicContact CB-CD2 4.38Å; V1539-L1563 HydrophobicContact CG2-CD2 3.97Å; D1561-L1563 VanDerWaalsContact C-N 3.34Å
1564	C	81.6	Confident	75.6	Confident	57 Å²	57	60.1 Å²	60.1	39%	0.385	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	133.5	176.4	-59.9	0	0	0	0	110.7	C1537 T1538	C1537-C1564 CarbonylContact C-O 3.47Å; C1537-C1564 WeakPolarHBondContact CA-O 2.9Å; C1537-C1564 VanDerWaalsContact CB-O 3.31Å; C1537-C1564 WeakPolarHBondContact CB-O 3.26Å; T1538-C1564 PolarHBondContact N-O 3.06Å; T1538-C1564 PolarHBondContact O-N 3.41Å
1565	F	83.9	Confident	76.8	Confident	77 Å²	77	56.3 Å²	56.3	34%	0.338	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	138.6	170.1	170.3	-106.1	0	0	0	111.8	L1536 H1812	L1536-F1565 WeakPolarHBondContact O-CD2 3.44Å; F1565-H1812 HydrophobicContact CE2-CB 4Å; F1565-H1812 HydrophobicContact CZ-CB 4.23Å; F1565-H1812 AromaticContact CZ-CD2 3.42Å; F1565-H1812 VanDerWaalsContact CZ-CD2 3.42Å; F1565-H1812 WeakPolarHBondContact CZ-CD2 3.44Å; F1565-H1812 AromaticContact CZ-CG 3.92Å
1566	C	80.2	Confident	77.6	Confident	13 Å²	13	52 Å²	52	9%	0.088	33%	0.33	C	S	.	.			trans	-112.7	139.3	172.7	-75.9	0	0	0	0	110.6	V1399 L1536 T1538	V1399-C1566 HydrophobicContact CG1-CB 4.41Å; L1536-C1566 HydrophobicContact CB-CB 4.16Å; L1536-C1566 WeakPolarHBondContact CB-O 3.45Å; L1536-C1566 PolarHBondContact O-N 2.95Å; T1538-C1566 VanDerWaalsContact CG2-SG 3.56Å; T1538-C1566 PolarHBondContact OG1-SG 2.76Å
1567	S	77.6	Confident	77.7	Confident	44 Å²	44	54.9 Å²	54.9	31%	0.308	32%	0.322	S	S	.	.			trans	-75.1	145	-178.8	-178.5	0	0	0	0	111.8	A1569 Q1570 H1571	S1567-A1569 PolarHBondContact O-N 3.1Å; S1567-A1569 VanDerWaalsContact O-N 3.12Å; S1567-A1569 PolarHBondContact OG-N 2.95Å; S1567-Q1570 WeakPolarHBondContact O-CB 3.3Å; S1567-Q1570 PolarHBondContact O-N 2.73Å; S1567-H1571 PolarHBondContact O-N 3.43Å
1568	L	80.2	Confident	77.4	Confident	48 Å²	48	53.7 Å²	53.7	25%	0.251	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-24.8	168.9	-76.4	173.2	0	0	0	113.6	L1536 Q1570 H1571 Y1573 R1809	L1536-L1568 HydrophobicContact CD1-CD2 3.64Å; L1536-L1568 HydrophobicContact CD1-CG 4.26Å; L1568-Q1570 PolarHBondContact O-N 2.6Å; L1568-H1571 WeakPolarHBondContact CA-O 3.13Å; L1568-H1571 CarbonylContact O-C 3.55Å; L1568-Y1573 VanDerWaalsContact CD2-CB 3.44Å; L1568-R1809 HydrophobicContact CD1-CB 3.93Å; L1568-R1809 WeakPolarHBondContact CD1-O 2.82Å
1569	A	73.4	Confident	77.3	Confident	98 Å²	98	53.5 Å²	53.5	81%	0.81	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-14.1	174.3	0	0	0	0	0	113.5	S1567	S1567-A1569 PolarHBondContact O-N 3.1Å; S1567-A1569 VanDerWaalsContact O-N 3.12Å; S1567-A1569 PolarHBondContact OG-N 2.95Å
1570	Q	75.1	Confident	77.2	Confident	147 Å²	147	52 Å²	52	69%	0.687	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-34.7	176.5	-63.4	167.9	-37.1	0	0	111.9	S1567 L1568	S1567-Q1570 WeakPolarHBondContact O-CB 3.3Å; S1567-Q1570 PolarHBondContact O-N 2.73Å; L1568-Q1570 PolarHBondContact O-N 2.6Å
1571	H	75.8	Confident	77.3	Confident	46 Å²	46	53.1 Å²	53.1	21%	0.213	31%	0.307	C	S	.	.	S	Bend	trans	-150.5	132.1	176.4	-163.9	-67.9	0	0	0	109.6	V1399 Q1401 L1536 S1567 L1568	V1399-H1571 HydrophobicContact CG1-CB 4.32Å; Q1401-H1571 PolarHBondContact NE2-CE1 3.09Å; L1536-H1571 WeakPolarHBondContact CD1-O 3.25Å; S1567-H1571 PolarHBondContact O-N 3.43Å; L1568-H1571 WeakPolarHBondContact CA-O 3.13Å; L1568-H1571 CarbonylContact O-C 3.55Å
1572	P	79.8	Confident	77.7	Confident	69 Å²	69	49.3 Å²	49.3	45%	0.448	29%	0.286	S	S	.	.			trans	-69.4	141.3	174.3	29.4	-35	0	0	0	111	S1575	P1572-S1575 WeakPolarHBondContact CG-OG 3.49Å
1573	Y	87.4	Confident	78.3	Confident	1 Å²	1	47.2 Å²	47.2	0%	0.004	28%	0.276	C	S	.	.	S	Bend	trans	-89.7	119.2	174.8	176.9	-104.4	0	0	0	110.9	Q1401 V1402 C1535 L1536 L1568 S1575 L1805 A1808 R1809 P1814 V1815	Q1401-Y1573 HydrophobicContact CB-CD2 4.3Å; Q1401-Y1573 HydrophobicContact CB-CE2 4.41Å; V1402-Y1573 WeakPolarHBondContact O-CE2 3.38Å; V1402-Y1573 PolarHBondContact O-OH 2.74Å; C1535-Y1573 HydrophobicContact CB-CD1 4.35Å; C1535-Y1573 HydrophobicContact CB-CD2 3.74Å; C1535-Y1573 HydrophobicContact CB-CE1 4.32Å; C1535-Y1573 HydrophobicContact CB-CE2 3.71Å; C1535-Y1573 HydrophobicContact CB-CG 4.06Å; C1535-Y1573 WeakPolarHBondContact O-CD2 3.49Å; C1535-Y1573 VanDerWaalsContact O-CE2 3.25Å; C1535-Y1573 WeakPolarHBondContact O-CE2 3.47Å; L1536-Y1573 HydrophobicContact CD2-CD2 4.01Å; L1536-Y1573 HydrophobicContact CG-CD2 4.11Å; L1568-Y1573 VanDerWaalsContact CD2-CB 3.44Å; Y1573-S1575 PolarHBondContact O-N 2.97Å; Y1573-L1805 HydrophobicContact CE1-CD2 4.09Å; Y1573-A1808 HydrophobicContact CE1-CB 4.01Å; Y1573-R1809 HydrophobicContact CD1-CG 3.99Å; Y1573-R1809 PolarHBondContact O-NE 3.14Å; Y1573-R1809 VanDerWaalsContact O-NE 3.08Å; Y1573-P1814 WeakPolarHBondContact OH-CA 3.02Å; Y1573-V1815 PolarHBondContact OH-N 3.42Å
1574	L	83.8	Confident	78.6	Confident	9 Å²	9	47 Å²	47	5%	0.047	28%	0.276	C	S	.	.	S	Bend	trans	46.9	56.5	176.2	-58.8	-178.3	0	0	0	112.6	Q1401 L1420 L1579 L1805 R1809 V1815	Q1401-L1574 HydrophobicContact CB-CD2 4.31Å; L1420-L1574 HydrophobicContact CD2-CD2 3.84Å; L1574-L1579 HydrophobicContact CD1-CD1 4.23Å; L1574-L1579 HydrophobicContact CD2-CD1 3.84Å; L1574-L1805 HydrophobicContact CB-CD2 4.09Å; L1574-L1805 HydrophobicContact CD1-CD2 3.76Å; L1574-R1809 PolarHBondContact O-NH2 3.33Å; L1574-V1815 HydrophobicContact CD1-CG1 4.19Å
1575	S	68.5	Low	79.1	Confident	69 Å²	69	44.3 Å²	44.3	48%	0.483	26%	0.257	S	S	.	.			trans	-89.5	122.9	175.4	55.9	0	0	0	0	111.8	P1572 Y1573	P1572-S1575 WeakPolarHBondContact CG-OG 3.49Å; Y1573-S1575 PolarHBondContact O-N 2.97Å
1576	G	61.5	Low	79.4	Confident	66 Å²	66	40.7 Å²	40.7	68%	0.68	24%	0.241	S	C	*	.	S	Bend	trans	79.8	164.6	-179.6	0	0	0	0	0	114	S1578	G1576-S1578 PolarHBondContact O-N 3.42Å; G1576-S1578 PolarHBondContact O-OG 2.88Å
1577	R	59.4	Low	79.6	Confident	123 Å²	123	42.3 Å²	42.3	46%	0.464	25%	0.246	S	C	.	.	S	Bend	trans	-67.3	62.5	179.9	-70.3	-169.7	176.8	125.5	2.3	113	E1650 E1798	R1577-E1650 IonicContact CZ-OE2 2.75Å; R1577-E1650 IonicContact NH1-OE1 3.82Å; R1577-E1650 IonicContact NH1-OE2 2.63Å; R1577-E1650 PolarHBondContact NH1-OE2 3.45Å; R1577-E1650 IonicContact NH2-OE2 3.68Å; R1577-E1650 PolarHBondContact NH2-OE2 3.04Å; R1577-E1798 IonicContact CZ-OE2 3.14Å; R1577-E1798 IonicContact NE-OE2 3.76Å; R1577-E1798 IonicContact NH2-OE2 2.77Å; R1577-E1798 PolarHBondContact NH2-OE2 2.93Å
1578	S	64.3	Low	79.7	Confident	22 Å²	22	41.6 Å²	41.6	15%	0.154	24%	0.238	C	C	.	.			trans	-85.7	-11.8	177.3	53.9	0	0	0	0	113.3	G1576	G1576-S1578 PolarHBondContact O-N 3.42Å; G1576-S1578 PolarHBondContact O-OG 2.88Å
1579	L	77	Confident	79.4	Confident	14 Å²	14	40.8 Å²	40.8	7%	0.073	23%	0.234	C	C	.	.	S	Bend	trans	-122.6	147.8	179.7	-64.1	171.5	0	0	0	109.7	I1403 L1420 L1574 P1705 V1707	I1403-L1579 HydrophobicContact CD1-CD1 3.96Å; I1403-L1579 HydrophobicContact CD1-CD2 4.15Å; L1420-L1579 HydrophobicContact CD1-CD2 4.04Å; L1420-L1579 HydrophobicContact CD2-CD2 3.96Å; L1420-L1579 HydrophobicContact CD2-CG 4.29Å; L1574-L1579 HydrophobicContact CD1-CD1 4.23Å; L1574-L1579 HydrophobicContact CD2-CD1 3.84Å; L1579-P1705 HydrophobicContact CD2-CG 4.09Å; L1579-V1707 HydrophobicContact CB-CG2 4.2Å; L1579-V1707 HydrophobicContact CD1-CG2 3.97Å; L1579-V1707 HydrophobicContact CD2-CG2 3.92Å; L1579-V1707 HydrophobicContact CG-CG2 4.25Å
1580	R	80.9	Confident	78.7	Confident	45 Å²	45	40.4 Å²	40.4	17%	0.17	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	128.7	173.3	-86.6	178.6	173.4	161.1	-1.9	111	W1612 M1685 Q1701 S1702 A1704 P1705 I1706 V1707	R1580-W1612 HydrophobicContact CB-CE3 4.24Å; R1580-W1612 HydrophobicContact CB-CH2 4Å; R1580-W1612 HydrophobicContact CB-CZ3 3.72Å; R1580-W1612 HydrophobicContact CG-CE3 4.25Å; R1580-W1612 HydrophobicContact CG-CZ3 4.24Å; R1580-M1685 PolarHBondContact NH1-SD 3.34Å; R1580-Q1701 PolarHBondContact NH2-O 3.04Å; R1580-S1702 PolarHBondContact NH1-O 2.59Å; R1580-S1702 PolarHBondContact NH2-O 3.22Å; R1580-A1704 HydrophobicContact CG-CB 4.17Å; R1580-P1705 PolarHBondContact N-O 3.25Å; R1580-I1706 HydrophobicContact CB-CG1 4.17Å; R1580-I1706 CarbonylContact O-C 3.53Å; R1580-I1706 WeakPolarHBondContact O-CA 3.05Å; R1580-V1707 PolarHBondContact O-N 3.38Å
1581	H	85.4	Confident	77.4	Confident	33 Å²	33	37.8 Å²	37.8	15%	0.153	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	112.9	-173.1	-55	124.2	0	0	0	112.1	P1611 W1612 L1709 E1798	H1581-P1611 WeakPolarHBondContact O-CD 3.44Å; H1581-W1612 WeakPolarHBondContact O-CZ3 3.42Å; H1581-L1709 HydrophobicContact CB-CD1 3.74Å; H1581-L1709 HydrophobicContact CB-CG 4Å; H1581-E1798 IonicContact ND1-OE1 3.23Å
1582	L	89.4	Confident	75.9	Confident	4 Å²	4	42 Å²	42	2%	0.021	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	116.3	170.9	177.1	153.1	0	0	0	108	L1608 W1612 L1681 I1706 V1707 I1708 L1709	L1582-L1608 HydrophobicContact CD1-CD1 4.07Å; L1582-L1608 HydrophobicContact CD2-CD1 3.34Å; L1582-L1608 HydrophobicContact CG-CD1 3.68Å; L1582-W1612 HydrophobicContact CB-CH2 4.24Å; L1582-L1681 HydrophobicContact CD1-CD1 3.99Å; L1582-I1706 HydrophobicContact CB-CG2 4.03Å; L1582-V1707 PolarHBondContact N-O 3.21Å; L1582-I1708 HydrophobicContact CD2-CG1 4.19Å; L1582-I1708 HydrophobicContact CD2-CG2 4.06Å; L1582-I1708 CarbonylContact O-C 3.57Å; L1582-I1708 WeakPolarHBondContact O-CA 3.1Å; L1582-L1709 PolarHBondContact O-N 2.9Å
1583	F	92.7	Very high	74	Confident	3 Å²	3	41 Å²	41	1%	0.013	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	129.4	-175.8	178.8	-96.6	0	0	0	110.9	F1585 L1608 I1609 L1709 L1756 F1794	F1583-F1585 HydrophobicContact CE1-CB 3.58Å; F1583-F1585 HydrophobicContact CZ-CB 3.86Å; F1583-L1608 CarbonylContact O-C 3.28Å; F1583-L1608 WeakPolarHBondContact O-CA 2.88Å; F1583-I1609 HydrophobicContact CB-CB 4.45Å; F1583-I1609 HydrophobicContact CD1-CB 4.47Å; F1583-I1609 HydrophobicContact CD1-CD1 4.4Å; F1583-I1609 PolarHBondContact N-O 3.17Å; F1583-I1609 PolarHBondContact O-N 2.98Å; F1583-L1709 HydrophobicContact CD2-CB 4.29Å; F1583-L1756 HydrophobicContact CE2-CD1 4.36Å; F1583-F1794 HydrophobicContact CB-CD2 3.75Å; F1583-F1794 HydrophobicContact CB-CE2 4.2Å; F1583-F1794 HydrophobicContact CD1-CB 3.8Å; F1583-F1794 AromaticContact CD1-CD2 3.8Å; F1583-F1794 HydrophobicContact CD1-CD2 3.8Å; F1583-F1794 HydrophobicContact CD1-CG 4.21Å; F1583-F1794 HydrophobicContact CD2-CD2 4.34Å; F1583-F1794 HydrophobicContact CE1-CB 3.63Å; F1583-F1794 HydrophobicContact CE1-CD2 4.48Å; F1583-F1794 HydrophobicContact CG-CB 4.32Å; F1583-F1794 AromaticContact CG-CD2 3.7Å; F1583-F1794 HydrophobicContact CG-CD2 3.7Å; F1583-F1794 HydrophobicContact CG-CG 4.49Å; F1583-F1794 HydrophobicContact CZ-CB 4.03Å
1584	L	93.2	Very high	71.2	Confident	0 Å²	0	45 Å²	45	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	113.1	178	179.1	62.7	0	0	0	109.8	L1607 L1608 V1674 I1708 L1709 L1710 H1711 L1745 L1748	L1584-L1607 WeakPolarHBondContact CA-O 3.32Å; L1584-L1608 HydrophobicContact CD1-CB 4.34Å; L1584-V1674 HydrophobicContact CD1-CG1 4.45Å; L1584-I1708 HydrophobicContact CB-CG2 4.04Å; L1584-I1708 HydrophobicContact CD2-CG2 4.4Å; L1584-L1709 PolarHBondContact N-O 3.23Å; L1584-L1710 HydrophobicContact CB-CD1 4.45Å; L1584-L1710 HydrophobicContact CD2-CD1 4.14Å; L1584-L1710 HydrophobicContact CG-CD1 4.12Å; L1584-L1710 WeakPolarHBondContact O-CA 3.32Å; L1584-H1711 PolarHBondContact O-N 2.8Å; L1584-L1745 HydrophobicContact CD2-CD1 3.89Å; L1584-L1748 HydrophobicContact CD2-CD2 4.09Å
1585	F	92.1	Very high	68.8	Low	0 Å²	0	49.7 Å²	49.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.2	171.5	172.3	-89.7	0	0	0	109.7	F1583 L1605 Y1606 L1607 H1711 A1786 R1789	F1583-F1585 HydrophobicContact CE1-CB 3.58Å; F1583-F1585 HydrophobicContact CZ-CB 3.86Å; F1585-L1605 HydrophobicContact CD1-CD2 4.29Å; F1585-L1605 HydrophobicContact CE1-CD2 4.36Å; F1585-Y1606 WeakPolarHBondContact O-CA 3.15Å; F1585-L1607 HydrophobicContact CB-CB 4.19Å; F1585-L1607 HydrophobicContact CB-CD2 4.48Å; F1585-L1607 HydrophobicContact CD1-CB 4.23Å; F1585-L1607 PolarHBondContact N-O 3.24Å; F1585-L1607 PolarHBondContact O-N 3.46Å; F1585-H1711 CarbonylContact C-O 3.57Å; F1585-H1711 WeakPolarHBondContact CA-O 3.39Å; F1585-H1711 HydrophobicContact CD2-CB 4.04Å; F1585-H1711 AromaticContact CD2-CE1 3Å; F1585-H1711 WeakPolarHBondContact CD2-CE1 3.24Å; F1585-H1711 AromaticContact CD2-CG 3.96Å; F1585-H1711 AromaticContact CD2-ND1 3.49Å; F1585-H1711 WeakPolarHBondContact CD2-ND1 2.94Å; F1585-H1711 AromaticContact CE2-CE1 3.03Å; F1585-H1711 WeakPolarHBondContact CE2-CE1 3.46Å; F1585-H1711 AromaticContact CE2-ND1 3.47Å; F1585-H1711 WeakPolarHBondContact CE2-ND1 3.49Å; F1585-H1711 AromaticContact CG-CE1 3.99Å; F1585-A1786 VanDerWaalsContact CE1-O 3.29Å; F1585-A1786 WeakPolarHBondContact CE1-O 3.35Å; F1585-R1789 HydrophobicContact CE2-CG 4.22Å; F1585-R1789 HydrophobicContact CZ-CB 4.25Å; F1585-R1789 HydrophobicContact CZ-CG 4.16Å
1586	H	89.7	Confident	66.9	Low	1 Å²	1	53.6 Å²	53.6	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	122.1	176	174.1	-111	0	0	0	109.3	L1605 Y1606 H1711 S1712 S1713 P1743	H1586-L1605 WeakPolarHBondContact CA-O 3.38Å; H1586-Y1606 AromaticContact CD2-CD1 3.86Å; H1586-Y1606 AromaticContact CD2-CE1 3.52Å; H1586-Y1606 AromaticContact CD2-CE2 3.72Å; H1586-Y1606 AromaticContact CD2-CZ 3.46Å; H1586-Y1606 VanDerWaalsContact CD2-CZ 3.46Å; H1586-Y1606 AromaticContact NE2-CE2 3.98Å; H1586-Y1606 AromaticContact NE2-CZ 3.69Å; H1586-H1711 PolarHBondContact N-O 2.75Å; H1586-S1712 PolarHBondContact ND1-OG 2.69Å; H1586-S1712 WeakPolarHBondContact O-CA 3.29Å; H1586-S1713 PolarHBondContact O-N 3.09Å; H1586-P1743 HydrophobicContact CB-CB 4.04Å; H1586-P1743 HydrophobicContact CB-CG 4.14Å
1587	Y	85.3	Confident	65.7	Low	46 Å²	46	56.3 Å²	56.3	18%	0.18	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.8	174.3	178.5	-95.6	0	0	0	109.6	L1589 Q1604 L1605 W1782 A1786	Y1587-L1589 HydrophobicContact CE1-CB 4.39Å; Y1587-L1589 HydrophobicContact CE1-CD1 4.27Å; Y1587-L1589 WeakPolarHBondContact OH-CD1 3.48Å; Y1587-Q1604 CarbonylContact O-C 3.49Å; Y1587-Q1604 VanDerWaalsContact O-CA 3.31Å; Y1587-Q1604 WeakPolarHBondContact O-CA 3.36Å; Y1587-L1605 PolarHBondContact N-O 2.71Å; Y1587-L1605 PolarHBondContact O-N 3.1Å; Y1587-W1782 HydrophobicContact CD1-CE3 4.22Å; Y1587-W1782 HydrophobicContact CD1-CZ3 4.17Å; Y1587-W1782 HydrophobicContact CE1-CE3 4.05Å; Y1587-W1782 HydrophobicContact CE1-CZ3 4.42Å; Y1587-A1786 HydrophobicContact CD1-CB 3.55Å; Y1587-A1786 HydrophobicContact CE1-CB 4Å; Y1587-A1786 HydrophobicContact CG-CB 3.88Å
1588	Q	79.4	Confident	64.5	Low	30 Å²	30	62 Å²	62	14%	0.14	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	120.9	178.6	176.2	173.9	-45.5	0	0	109.2	P1590 S1601 Q1604 S1713	Q1588-P1590 WeakPolarHBondContact O-CD 3.38Å; Q1588-S1601 WeakPolarHBondContact CG-OG 3.38Å; Q1588-S1601 PolarHBondContact NE2-OG 3.24Å; Q1588-S1601 PolarHBondContact OE1-OG 2.85Å; Q1588-Q1604 HydrophobicContact CB-CG 4.25Å; Q1588-Q1604 HydrophobicContact CG-CG 4.04Å; Q1588-S1713 PolarHBondContact N-OG 3.13Å
1589	L	73.7	Confident	63.5	Low	31 Å²	31	70.1 Å²	70.1	16%	0.162	38%	0.38	C	S	.	.			trans	-72.9	127.4	179.6	-169	68.6	0	0	0	109.8	Y1587 S1591 R1603	Y1587-L1589 HydrophobicContact CE1-CB 4.39Å; Y1587-L1589 HydrophobicContact CE1-CD1 4.27Å; Y1587-L1589 WeakPolarHBondContact OH-CD1 3.48Å; L1589-S1591 PolarHBondContact O-N 2.88Å; L1589-R1603 HydrophobicContact CB-CB 3.98Å; L1589-R1603 HydrophobicContact CD2-CB 4.27Å; L1589-R1603 PolarHBondContact N-O 3.27Å
1590	P	57.6	Low	62.2	Low	89 Å²	89	72.9 Å²	72.9	58%	0.578	40%	0.395	S	S	*	.			trans	-62.8	130.9	177.8	-24.6	35.4	0	0	0	112.6	Q1588 V1592	Q1588-P1590 WeakPolarHBondContact O-CD 3.38Å; P1590-V1592 PolarHBondContact O-N 2.96Å
1591	S	47.8	Very low	60.9	Low	93 Å²	93	71.3 Å²	71.3	65%	0.65	39%	0.391	S	S	*	.			trans	-75.8	107	176	-61.6	0	0	0	0	110.6	L1589 G1593	L1589-S1591 PolarHBondContact O-N 2.88Å; S1591-G1593 PolarHBondContact O-N 3.12Å
1592	V	44.7	Very low	60	Low	134 Å²	134	74.8 Å²	74.8	81%	0.812	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	119.2	-178	-178	0	0	0	0	111.5	P1590	P1590-V1592 PolarHBondContact O-N 2.96Å
1593	G	40.4	Very low	59.7	Low	47 Å²	47	78.2 Å²	78.2	49%	0.485	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	13.3	150.7	0	0	0	0	0	119.8	S1591	S1591-G1593 PolarHBondContact O-N 3.12Å
1594	Q	29.7	Very low	59.4	Low	87 Å²	87	78 Å²	78	41%	0.407	42%	0.419	S	S	.	.			trans	-135	120.2	179.5	-80.2	-179.4	95.8	0	0	115.6	G1156 P1158 M1596	G1156-Q1594 PolarHBondContact O-NE2 3.48Å; P1158-Q1594 HydrophobicContact CB-CG 3.86Å; P1158-Q1594 HydrophobicContact CG-CG 3.81Å; Q1594-M1596 PolarHBondContact O-N 3.41Å
1595	A	32.9	Very low	59.3	Low	107 Å²	107	78 Å²	78	88%	0.884	42%	0.419	S	S	*	.			trans	-96.4	70.5	169.4	0	0	0	0	0	111.8
1596	M	28.8	Very low	59.4	Low	150 Å²	150	78.1 Å²	78.1	74%	0.739	42%	0.419	S	S	*	.			trans	-137.1	117.5	170.4	-66.6	-160.7	77.8	0	0	113.3	Q1594 R1598	Q1594-M1596 PolarHBondContact O-N 3.41Å; M1596-R1598 PolarHBondContact O-N 2.66Å
1597	T	35	Very low	59.6	Low	123 Å²	123	78 Å²	78	76%	0.755	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	34.1	78.2	152.5	59.3	0	0	0	0	118.3	K1599	T1597-K1599 VanDerWaalsContact C-N 3.3Å; T1597-K1599 PolarHBondContact O-N 3.45Å
1598	R	34.8	Very low	60	Low	242 Å²	242	75.9 Å²	75.9	91%	0.913	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	26.9	139.6	-137.6	-174.2	-154.7	-170.5	8.8	119.3	M1596	M1596-R1598 PolarHBondContact O-N 2.66Å
1599	K	42.8	Very low	60.6	Low	193 Å²	193	74.5 Å²	74.5	84%	0.839	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-72.8	130.7	161.3	-82	-175.7	173.6	178.6	0	108.9	T1597	T1597-K1599 VanDerWaalsContact C-N 3.3Å; T1597-K1599 PolarHBondContact O-N 3.45Å
1600	D	50.7	Low	61.4	Low	72 Å²	72	73 Å²	73	39%	0.385	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-54.9	139	175.1	-84.2	-80	0	0	0	111.6	Q1602 R1671 Q1744	D1600-Q1602 PolarHBondContact O-N 3.41Å; D1600-R1671 IonicContact OD1-CZ 3.55Å; D1600-R1671 VanDerWaalsContact OD1-CZ 3.26Å; D1600-R1671 IonicContact OD1-NH1 2.81Å; D1600-R1671 PolarHBondContact OD1-NH1 3.26Å; D1600-R1671 IonicContact OD1-NH2 3.44Å; D1600-R1671 PolarHBondContact OD1-NH2 2.81Å; D1600-R1671 IonicContact OD2-NH1 3.14Å; D1600-Q1744 PolarHBondContact OD1-NE2 2.84Å
1601	S	52.5	Low	62.6	Low	12 Å²	12	69.9 Å²	69.9	8%	0.084	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-64.1	123.3	177.4	43.2	0	0	0	0	110.5	Q1588 R1603 Q1604	Q1588-S1601 WeakPolarHBondContact CG-OG 3.38Å; Q1588-S1601 PolarHBondContact NE2-OG 3.24Å; Q1588-S1601 PolarHBondContact OE1-OG 2.85Å; S1601-R1603 PolarHBondContact O-N 2.95Å; S1601-R1603 VanDerWaalsContact O-N 3.13Å; S1601-Q1604 PolarHBondContact O-NE2 2.67Å; S1601-Q1604 PolarHBondContact OG-NE2 3.27Å
1602	Q	66.5	Low	64.2	Low	107 Å²	107	69.7 Å²	69.7	50%	0.5	36%	0.361	S	S	.	.	S	Bend	trans	-74.8	-2.2	-168.6	-66.1	-168.6	-1.9	0	0	115.3	D1600 D1622 S1623	D1600-Q1602 PolarHBondContact O-N 3.41Å; Q1602-D1622 WeakPolarHBondContact O-CA 3.37Å; Q1602-S1623 PolarHBondContact O-N 3.34Å; Q1602-S1623 PolarHBondContact OE1-OG 3.03Å
1603	R	82.8	Confident	66	Low	75 Å²	75	65.9 Å²	65.9	28%	0.283	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	100.8	-179.7	-74.3	-179.2	174.8	-177.5	4	110.8	L1589 S1601 I1621 D1622 L1779 W1782	L1589-R1603 HydrophobicContact CB-CB 3.98Å; L1589-R1603 HydrophobicContact CD2-CB 4.27Å; L1589-R1603 PolarHBondContact N-O 3.27Å; S1601-R1603 PolarHBondContact O-N 2.95Å; S1601-R1603 VanDerWaalsContact O-N 3.13Å; R1603-I1621 VanDerWaalsContact CA-O 3.3Å; R1603-I1621 WeakPolarHBondContact CA-O 3.41Å; R1603-D1622 IonicContact NE-OD1 3.22Å; R1603-D1622 IonicContact NE-OD2 2.82Å; R1603-L1779 PolarHBondContact NH1-O 3.25Å; R1603-W1782 HydrophobicContact CB-CH2 3.95Å; R1603-W1782 HydrophobicContact CB-CZ2 3.74Å; R1603-W1782 HydrophobicContact CB-CZ3 4.49Å; R1603-W1782 HydrophobicContact CG-CH2 4.43Å; R1603-W1782 HydrophobicContact CG-CZ2 3.72Å
1604	Q	87	Confident	68.2	Low	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	145.9	177.1	-66	160.1	30.6	0	0	109	Y1587 Q1588 S1601 Y1606 I1621	Y1587-Q1604 CarbonylContact O-C 3.49Å; Y1587-Q1604 VanDerWaalsContact O-CA 3.31Å; Y1587-Q1604 WeakPolarHBondContact O-CA 3.36Å; Q1588-Q1604 HydrophobicContact CB-CG 4.25Å; Q1588-Q1604 HydrophobicContact CG-CG 4.04Å; S1601-Q1604 PolarHBondContact O-NE2 2.67Å; S1601-Q1604 PolarHBondContact OG-NE2 3.27Å; Q1604-Y1606 HydrophobicContact CB-CE2 4.12Å; Q1604-I1621 HydrophobicContact CB-CB 4.21Å; Q1604-I1621 HydrophobicContact CB-CD1 4.32Å; Q1604-I1621 PolarHBondContact N-O 3.21Å; Q1604-I1621 PolarHBondContact O-N 3.31Å; Q1604-I1621 VanDerWaalsContact O-O 3.1Å
1605	L	91.6	Very high	70.8	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	124.1	172.8	-176.1	152.4	0	0	0	109.2	F1585 H1586 Y1587 L1607 V1618 V1620 L1629 W1782 A1786 V1787	F1585-L1605 HydrophobicContact CD1-CD2 4.29Å; F1585-L1605 HydrophobicContact CE1-CD2 4.36Å; H1586-L1605 WeakPolarHBondContact CA-O 3.38Å; Y1587-L1605 PolarHBondContact N-O 2.71Å; Y1587-L1605 PolarHBondContact O-N 3.1Å; L1605-L1607 HydrophobicContact CD2-CB 4.07Å; L1605-V1618 HydrophobicContact CD1-CG1 4.41Å; L1605-V1618 HydrophobicContact CD2-CG1 4.41Å; L1605-V1618 HydrophobicContact CG-CG1 4.28Å; L1605-V1620 HydrophobicContact CD1-CG2 4.14Å; L1605-V1620 HydrophobicContact CG-CG2 4.45Å; L1605-L1629 HydrophobicContact CD1-CD2 4.11Å; L1605-W1782 HydrophobicContact CB-CH2 4.44Å; L1605-W1782 HydrophobicContact CB-CZ3 4.07Å; L1605-A1786 HydrophobicContact CD1-CB 4.12Å; L1605-V1787 HydrophobicContact CD1-CB 4.28Å
1606	Y	93.3	Very high	73.5	Confident	1 Å²	1	60.9 Å²	60.9	0%	0.004	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.3	172.2	-65.3	-106.4	0	0	0	108.6	F1585 H1586 Q1604 V1618 C1619 I1621 R1671 V1674 P1743 L1745	F1585-Y1606 WeakPolarHBondContact O-CA 3.15Å; H1586-Y1606 AromaticContact CD2-CD1 3.86Å; H1586-Y1606 AromaticContact CD2-CE1 3.52Å; H1586-Y1606 AromaticContact CD2-CE2 3.72Å; H1586-Y1606 AromaticContact CD2-CZ 3.46Å; H1586-Y1606 VanDerWaalsContact CD2-CZ 3.46Å; H1586-Y1606 AromaticContact NE2-CE2 3.98Å; H1586-Y1606 AromaticContact NE2-CZ 3.69Å; Q1604-Y1606 HydrophobicContact CB-CE2 4.12Å; Y1606-V1618 CarbonylContact O-C 3.46Å; Y1606-V1618 WeakPolarHBondContact O-CA 3.14Å; Y1606-C1619 PolarHBondContact N-O 2.9Å; Y1606-C1619 PolarHBondContact O-N 2.95Å; Y1606-I1621 HydrophobicContact CD2-CD1 3.95Å; Y1606-I1621 HydrophobicContact CE2-CD1 3.56Å; Y1606-R1671 WeakPolarHBondContact OH-CG 3.27Å; Y1606-R1671 PolarHBondContact OH-NE 3.03Å; Y1606-V1674 HydrophobicContact CD1-CG1 4.4Å; Y1606-V1674 HydrophobicContact CD1-CG2 4.32Å; Y1606-V1674 HydrophobicContact CG-CG2 4.09Å; Y1606-P1743 HydrophobicContact CE1-CB 3.74Å; Y1606-P1743 WeakPolarHBondContact CE1-O 3.29Å; Y1606-P1743 PolarHBondContact OH-O 3Å; Y1606-L1745 HydrophobicContact CD1-CD1 4.03Å; Y1606-L1745 HydrophobicContact CE1-CD1 3.81Å; Y1606-L1745 HydrophobicContact CE1-CD2 4.24Å; Y1606-L1745 HydrophobicContact CE1-CG 3.93Å
1607	L	93.7	Very high	76.6	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	115.7	172.3	167.5	67.3	0	0	0	108.3	L1584 F1585 L1605 I1609 V1618 F1659 G1790 I1791	L1584-L1607 WeakPolarHBondContact CA-O 3.32Å; F1585-L1607 HydrophobicContact CB-CB 4.19Å; F1585-L1607 HydrophobicContact CB-CD2 4.48Å; F1585-L1607 HydrophobicContact CD1-CB 4.23Å; F1585-L1607 PolarHBondContact N-O 3.24Å; F1585-L1607 PolarHBondContact O-N 3.46Å; L1605-L1607 HydrophobicContact CD2-CB 4.07Å; L1607-I1609 HydrophobicContact CD1-CD1 3.97Å; L1607-I1609 HydrophobicContact CD1-CG1 3.82Å; L1607-I1609 HydrophobicContact CD2-CD1 4.08Å; L1607-I1609 HydrophobicContact CG-CD1 4.09Å; L1607-I1609 HydrophobicContact CG-CG1 4.12Å; L1607-V1618 HydrophobicContact CD1-CG2 3.79Å; L1607-F1659 HydrophobicContact CD1-CD1 4.48Å; L1607-F1659 HydrophobicContact CD1-CE1 4.08Å; L1607-G1790 VanDerWaalsContact CD2-C 3.41Å; L1607-I1791 HydrophobicContact CD2-CG1 4.3Å
1608	L	93.8	Very high	79.4	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	113.2	-179.2	164.2	62.1	0	0	0	108.6	L1582 F1583 L1584 V1610 G1616 Y1617 W1677 I1678	L1582-L1608 HydrophobicContact CD1-CD1 4.07Å; L1582-L1608 HydrophobicContact CD2-CD1 3.34Å; L1582-L1608 HydrophobicContact CG-CD1 3.68Å; F1583-L1608 CarbonylContact O-C 3.28Å; F1583-L1608 WeakPolarHBondContact O-CA 2.88Å; L1584-L1608 HydrophobicContact CD1-CB 4.34Å; L1608-V1610 HydrophobicContact CD1-CG2 4.47Å; L1608-G1616 CarbonylContact O-C 3.51Å; L1608-G1616 WeakPolarHBondContact O-CA 3.33Å; L1608-Y1617 HydrophobicContact CD2-CD2 4.32Å; L1608-Y1617 HydrophobicContact CG-CD2 4.21Å; L1608-Y1617 PolarHBondContact N-O 3.02Å; L1608-Y1617 PolarHBondContact O-N 2.81Å; L1608-W1677 HydrophobicContact CD2-CB 3.72Å; L1608-W1677 HydrophobicContact CD2-CE3 4.24Å; L1608-I1678 HydrophobicContact CD1-CG1 4.4Å; L1608-I1678 HydrophobicContact CD2-CG1 3.94Å
1609	I	92.5	Very high	82.2	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	135	179.4	-60.9	170.5	0	0	0	110.3	F1583 L1607 L1657 F1794	F1583-I1609 HydrophobicContact CB-CB 4.45Å; F1583-I1609 HydrophobicContact CD1-CB 4.47Å; F1583-I1609 HydrophobicContact CD1-CD1 4.4Å; F1583-I1609 PolarHBondContact N-O 3.17Å; F1583-I1609 PolarHBondContact O-N 2.98Å; L1607-I1609 HydrophobicContact CD1-CD1 3.97Å; L1607-I1609 HydrophobicContact CD1-CG1 3.82Å; L1607-I1609 HydrophobicContact CD2-CD1 4.08Å; L1607-I1609 HydrophobicContact CG-CD1 4.09Å; L1607-I1609 HydrophobicContact CG-CG1 4.12Å; I1609-L1657 HydrophobicContact CD1-CD1 4.16Å; I1609-L1657 HydrophobicContact CG2-CD1 3.81Å; I1609-L1657 HydrophobicContact CG2-CD2 4.07Å; I1609-F1794 HydrophobicContact CB-CD2 4.05Å; I1609-F1794 HydrophobicContact CB-CE2 4Å; I1609-F1794 HydrophobicContact CB-CG 4.49Å; I1609-F1794 HydrophobicContact CB-CZ 4.41Å; I1609-F1794 HydrophobicContact CD1-CB 3.78Å; I1609-F1794 HydrophobicContact CD1-CD1 3.68Å; I1609-F1794 HydrophobicContact CD1-CD2 3.91Å; I1609-F1794 HydrophobicContact CD1-CE1 4.25Å; I1609-F1794 HydrophobicContact CD1-CE2 4.45Å; I1609-F1794 HydrophobicContact CD1-CG 3.48Å; I1609-F1794 VanDerWaalsContact CD1-CG 3.48Å; I1609-F1794 HydrophobicContact CG2-CD1 4.43Å; I1609-F1794 HydrophobicContact CG2-CD2 4.01Å; I1609-F1794 HydrophobicContact CG2-CE1 3.98Å; I1609-F1794 HydrophobicContact CG2-CE2 3.51Å; I1609-F1794 HydrophobicContact CG2-CG 4.44Å; I1609-F1794 HydrophobicContact CG2-CZ 3.49Å; I1609-F1794 VanDerWaalsContact CG2-CZ 3.49Å
1610	V	89.9	Confident	84.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	92.7	-178.3	-174	0	0	0	0	108.1	L1608 W1612 T1613 R1614 C1615 Y1617 L1681	L1608-V1610 HydrophobicContact CD1-CG2 4.47Å; V1610-W1612 HydrophobicContact CG1-CD2 3.97Å; V1610-W1612 HydrophobicContact CG1-CE3 4.46Å; V1610-W1612 HydrophobicContact CG1-CG 4.46Å; V1610-W1612 HydrophobicContact CG1-CH2 4.21Å; V1610-W1612 HydrophobicContact CG1-CZ2 3.67Å; V1610-W1612 PolarHBondContact O-N 3.42Å; V1610-T1613 WeakPolarHBondContact CB-OG1 3.43Å; V1610-T1613 HydrophobicContact CG1-CG2 3.87Å; V1610-T1613 WeakPolarHBondContact CG1-OG1 3.26Å; V1610-T1613 PolarHBondContact O-N 3.26Å; V1610-T1613 PolarHBondContact O-OG1 3.33Å; V1610-R1614 PolarHBondContact O-N 3.36Å; V1610-C1615 PolarHBondContact N-O 2.9Å; V1610-Y1617 HydrophobicContact CG2-CD2 4.43Å; V1610-Y1617 HydrophobicContact CG2-CE2 4.1Å; V1610-L1681 HydrophobicContact CG1-CD2 4.15Å; V1610-L1681 HydrophobicContact CG2-CD1 3.57Å; V1610-L1681 HydrophobicContact CG2-CD2 4.19Å
1611	P	84.3	Confident	86.3	Confident	23 Å²	23	25.6 Å²	25.6	15%	0.149	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-56.8	-46.5	-168.4	-27.6	35.1	0	0	0	113.4	H1581 T1613 R1614 P1654 F1794	H1581-P1611 WeakPolarHBondContact O-CD 3.44Å; P1611-T1613 VanDerWaalsContact C-N 3.26Å; P1611-T1613 PolarHBondContact O-N 3.14Å; P1611-R1614 PolarHBondContact O-N 2.93Å; P1611-P1654 HydrophobicContact CB-CG 4.21Å; P1611-F1794 HydrophobicContact CG-CE2 4Å; P1611-F1794 HydrophobicContact CG-CZ 4.14Å
1612	W	80.2	Confident	87.9	Confident	89 Å²	89	25.1 Å²	25.1	34%	0.337	11%	0.114	S	C	.	.	G	3₁₀ helix	trans	-72.3	-10.3	-175.8	64.2	84	0	0	0	114.9	R1580 H1581 L1582 V1610 I1706	R1580-W1612 HydrophobicContact CB-CE3 4.24Å; R1580-W1612 HydrophobicContact CB-CH2 4Å; R1580-W1612 HydrophobicContact CB-CZ3 3.72Å; R1580-W1612 HydrophobicContact CG-CE3 4.25Å; R1580-W1612 HydrophobicContact CG-CZ3 4.24Å; H1581-W1612 WeakPolarHBondContact O-CZ3 3.42Å; L1582-W1612 HydrophobicContact CB-CH2 4.24Å; V1610-W1612 HydrophobicContact CG1-CD2 3.97Å; V1610-W1612 HydrophobicContact CG1-CE3 4.46Å; V1610-W1612 HydrophobicContact CG1-CG 4.46Å; V1610-W1612 HydrophobicContact CG1-CH2 4.21Å; V1610-W1612 HydrophobicContact CG1-CZ2 3.67Å; V1610-W1612 PolarHBondContact O-N 3.42Å; W1612-I1706 HydrophobicContact CH2-CD1 4.39Å; W1612-I1706 HydrophobicContact CH2-CG1 4.33Å; W1612-I1706 HydrophobicContact CH2-CG2 4.27Å; W1612-I1706 HydrophobicContact CZ2-CD1 4.06Å; W1612-I1706 HydrophobicContact CZ2-CG1 4.42Å
1613	T	83.6	Confident	88.4	Confident	55 Å²	55	22.6 Å²	22.6	34%	0.337	11%	0.108	S	C	.	.	G	3₁₀ helix	trans	-101.8	-0.9	168.3	64.5	0	0	0	0	112.6	V1610 P1611 C1615	V1610-T1613 WeakPolarHBondContact CB-OG1 3.43Å; V1610-T1613 HydrophobicContact CG1-CG2 3.87Å; V1610-T1613 WeakPolarHBondContact CG1-OG1 3.26Å; V1610-T1613 PolarHBondContact O-N 3.26Å; V1610-T1613 PolarHBondContact O-OG1 3.33Å; P1611-T1613 VanDerWaalsContact C-N 3.26Å; P1611-T1613 PolarHBondContact O-N 3.14Å; T1613-C1615 PolarHBondContact O-N 3.41Å; T1613-C1615 PolarHBondContact O-SG 3.28Å
1614	R	85.2	Confident	88.2	Confident	104 Å²	104	21.8 Å²	21.8	39%	0.392	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	34.5	-174	-61	-173.1	172.4	-146	-7.8	112.8	V1610 P1611 P1654 D1655 T1656 N1658	V1610-R1614 PolarHBondContact O-N 3.36Å; P1611-R1614 PolarHBondContact O-N 2.93Å; R1614-P1654 HydrophobicContact CG-CB 4.19Å; R1614-D1655 IonicContact CZ-OD2 2.69Å; R1614-D1655 IonicContact NH1-OD2 2.77Å; R1614-D1655 PolarHBondContact NH1-OD2 2.97Å; R1614-D1655 IonicContact NH2-OD1 3.16Å; R1614-D1655 IonicContact NH2-OD2 3.88Å; R1614-D1655 PolarHBondContact NH2-OD2 2.93Å; R1614-T1656 WeakPolarHBondContact CB-O 3.44Å; R1614-N1658 PolarHBondContact O-N 3.44Å
1615	C	85.4	Confident	87.5	Confident	31 Å²	31	27.7 Å²	27.7	21%	0.209	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	134	-177.8	-63.5	0	0	0	0	112	V1610 T1613 Y1617 N1658	V1610-C1615 PolarHBondContact N-O 2.9Å; T1613-C1615 PolarHBondContact O-N 3.41Å; T1613-C1615 PolarHBondContact O-SG 3.28Å; C1615-Y1617 HydrophobicContact CB-CE2 3.81Å; C1615-N1658 CarbonylContact C-O 3.55Å; C1615-N1658 WeakPolarHBondContact CA-O 3.24Å
1616	G	89.9	Confident	86.8	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	149.7	159.6	0	0	0	0	0	110.5	L1608 N1658 F1659 E1660	L1608-G1616 CarbonylContact O-C 3.51Å; L1608-G1616 WeakPolarHBondContact O-CA 3.33Å; G1616-N1658 PolarHBondContact N-O 2.88Å; G1616-F1659 CarbonylContact O-C 3.58Å; G1616-F1659 VanDerWaalsContact O-CA 3.31Å; G1616-F1659 WeakPolarHBondContact O-CA 3.33Å; G1616-E1660 PolarHBondContact O-N 3.41Å
1617	Y	94.1	Very high	86.2	Confident	37 Å²	37	35.7 Å²	35.7	15%	0.145	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	123.9	174.9	-57.7	-94	0	0	0	107.9	L1608 V1610 C1615 E1660 W1677	L1608-Y1617 HydrophobicContact CD2-CD2 4.32Å; L1608-Y1617 HydrophobicContact CG-CD2 4.21Å; L1608-Y1617 PolarHBondContact N-O 3.02Å; L1608-Y1617 PolarHBondContact O-N 2.81Å; V1610-Y1617 HydrophobicContact CG2-CD2 4.43Å; V1610-Y1617 HydrophobicContact CG2-CE2 4.1Å; C1615-Y1617 HydrophobicContact CB-CE2 3.81Å; Y1617-E1660 CarbonylContact C-O 3.56Å; Y1617-E1660 WeakPolarHBondContact CA-O 3.37Å; Y1617-E1660 HydrophobicContact CD1-CB 3.81Å; Y1617-E1660 HydrophobicContact CD1-CG 4.47Å; Y1617-E1660 WeakPolarHBondContact CD1-OE2 3.23Å; Y1617-E1660 HydrophobicContact CE1-CB 4.23Å; Y1617-E1660 VanDerWaalsContact CE1-OE2 3.28Å; Y1617-E1660 WeakPolarHBondContact CE1-OE2 3.36Å; Y1617-W1677 AromaticContact CD1-CD1 3.79Å; Y1617-W1677 AromaticContact CD1-CD2 3.85Å; Y1617-W1677 HydrophobicContact CD1-CD2 3.85Å; Y1617-W1677 AromaticContact CD1-CE2 3.55Å; Y1617-W1677 HydrophobicContact CD1-CE3 4.46Å; Y1617-W1677 HydrophobicContact CD1-CG 4.03Å; Y1617-W1677 AromaticContact CD1-CZ2 3.97Å; Y1617-W1677 HydrophobicContact CD1-CZ2 3.97Å; Y1617-W1677 AromaticContact CD1-NE1 3.49Å; Y1617-W1677 AromaticContact CE1-CD1 3.93Å; Y1617-W1677 HydrophobicContact CE1-CG 4.46Å; Y1617-W1677 AromaticContact CE1-NE1 3.86Å; Y1617-W1677 HydrophobicContact CG-CD2 4.05Å; Y1617-W1677 HydrophobicContact CG-CE3 4.28Å; Y1617-W1677 HydrophobicContact CG-CG 4.34Å
1618	V	93.6	Very high	85.7	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.7	178.9	-169.5	0	0	0	0	108.8	L1605 Y1606 L1607 V1620 L1629 L1632 F1659 E1660 V1661 R1662	L1605-V1618 HydrophobicContact CD1-CG1 4.41Å; L1605-V1618 HydrophobicContact CD2-CG1 4.41Å; L1605-V1618 HydrophobicContact CG-CG1 4.28Å; Y1606-V1618 CarbonylContact O-C 3.46Å; Y1606-V1618 WeakPolarHBondContact O-CA 3.14Å; L1607-V1618 HydrophobicContact CD1-CG2 3.79Å; V1618-V1620 HydrophobicContact CG1-CG2 4.09Å; V1618-L1629 HydrophobicContact CG1-CD1 4.01Å; V1618-L1632 HydrophobicContact CG2-CD1 3.67Å; V1618-F1659 HydrophobicContact CG2-CD1 4.07Å; V1618-E1660 PolarHBondContact N-O 3.42Å; V1618-V1661 HydrophobicContact CB-CG2 4.33Å; V1618-V1661 HydrophobicContact CG2-CG2 4.49Å; V1618-V1661 CarbonylContact O-C 3.24Å; V1618-R1662 PolarHBondContact O-N 2.91Å
1619	C	93.2	Very high	85.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	104.7	167.7	-173.5	0	0	0	0	108.7	Y1606 R1662 G1670 V1674 W1677	Y1606-C1619 PolarHBondContact N-O 2.9Å; Y1606-C1619 PolarHBondContact O-N 2.95Å; C1619-R1662 WeakPolarHBondContact CA-O 3.41Å; C1619-G1670 VanDerWaalsContact SG-CA 3.55Å; C1619-V1674 HydrophobicContact CB-CG2 3.71Å; C1619-W1677 HydrophobicContact CB-CH2 4.12Å; C1619-W1677 HydrophobicContact CB-CZ3 3.83Å
1620	V	91.5	Very high	85	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	128.6	168	-170.6	0	0	0	0	108	L1605 V1618 D1622 L1629 R1662 I1663 E1664 W1782 Q1783	L1605-V1620 HydrophobicContact CD1-CG2 4.14Å; L1605-V1620 HydrophobicContact CG-CG2 4.45Å; V1618-V1620 HydrophobicContact CG1-CG2 4.09Å; V1620-D1622 HydrophobicContact CG1-CB 4.25Å; V1620-L1629 HydrophobicContact CG2-CD1 3.73Å; V1620-L1629 HydrophobicContact CG2-CD2 4.45Å; V1620-L1629 HydrophobicContact CG2-CG 4.28Å; V1620-R1662 PolarHBondContact N-O 3.26Å; V1620-I1663 HydrophobicContact CB-CG1 4.24Å; V1620-I1663 HydrophobicContact CB-CG2 4.47Å; V1620-I1663 HydrophobicContact CG2-CG1 4.49Å; V1620-I1663 WeakPolarHBondContact O-CA 3.37Å; V1620-E1664 PolarHBondContact O-N 3.47Å; V1620-W1782 HydrophobicContact CG1-CH2 3.97Å; V1620-W1782 HydrophobicContact CG1-CZ2 4.12Å; V1620-Q1783 HydrophobicContact CG1-CG 4.31Å
1621	I	88.2	Confident	84.8	Confident	2 Å²	2	46 Å²	46	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	108.5	164.9	-68.2	147.1	0	0	0	106.1	R1603 Q1604 Y1606 E1664 A1667	R1603-I1621 VanDerWaalsContact CA-O 3.3Å; R1603-I1621 WeakPolarHBondContact CA-O 3.41Å; Q1604-I1621 HydrophobicContact CB-CB 4.21Å; Q1604-I1621 HydrophobicContact CB-CD1 4.32Å; Q1604-I1621 PolarHBondContact N-O 3.21Å; Q1604-I1621 PolarHBondContact O-N 3.31Å; Q1604-I1621 VanDerWaalsContact O-O 3.1Å; Y1606-I1621 HydrophobicContact CD2-CD1 3.95Å; Y1606-I1621 HydrophobicContact CE2-CD1 3.56Å; I1621-E1664 VanDerWaalsContact CA-O 3.29Å; I1621-E1664 WeakPolarHBondContact CA-O 3.33Å; I1621-A1667 HydrophobicContact CD1-CB 4.32Å; I1621-A1667 HydrophobicContact CG2-CB 4.07Å
1622	D	85	Confident	85	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.011	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	125.5	172.9	-161.9	-38.6	0	0	0	106.7	Q1602 R1603 V1620 A1624 R1625 E1664 W1782 Q1783	Q1602-D1622 WeakPolarHBondContact O-CA 3.37Å; R1603-D1622 IonicContact NE-OD1 3.22Å; R1603-D1622 IonicContact NE-OD2 2.82Å; V1620-D1622 HydrophobicContact CG1-CB 4.25Å; D1622-A1624 PolarHBondContact O-N 3.03Å; D1622-A1624 VanDerWaalsContact O-N 3.12Å; D1622-A1624 PolarHBondContact OD1-N 2.86Å; D1622-R1625 PolarHBondContact O-N 3.4Å; D1622-E1664 PolarHBondContact N-O 3.03Å; D1622-E1664 VanDerWaalsContact N-O 3.16Å; D1622-W1782 HydrophobicContact CB-CZ2 4.15Å; D1622-W1782 WeakPolarHBondContact OD2-CZ2 3.29Å; D1622-W1782 PolarHBondContact OD2-NE1 2.92Å; D1622-Q1783 PolarHBondContact OD2-NE2 3.47Å
1623	S	77.2	Confident	85.3	Confident	55 Å²	55	44.3 Å²	44.3	39%	0.385	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.5	-178.8	52.1	0	0	0	0	112.6	Q1602 R1625	Q1602-S1623 PolarHBondContact O-N 3.34Å; Q1602-S1623 PolarHBondContact OE1-OG 3.03Å; S1623-R1625 VanDerWaalsContact C-N 3.34Å
1624	A	79.3	Confident	85.5	Confident	57 Å²	57	45.9 Å²	45.9	47%	0.471	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-8.4	175.2	0	0	0	0	0	114.6	D1622 I1626	D1622-A1624 PolarHBondContact O-N 3.03Å; D1622-A1624 VanDerWaalsContact O-N 3.12Å; D1622-A1624 PolarHBondContact OD1-N 2.86Å; A1624-I1626 HydrophobicContact CB-CB 4.5Å; A1624-I1626 HydrophobicContact CB-CD1 3.7Å; A1624-I1626 HydrophobicContact CB-CG1 3.81Å; A1624-I1626 PolarHBondContact O-N 3.42Å
1625	R	71.9	Confident	85.7	Confident	124 Å²	124	42.1 Å²	42.1	47%	0.468	23%	0.23	S	C	.	.			trans	52.1	19.4	-171.8	-62.9	-175.3	167.2	-111	-12.7	115.3	D1622 S1623 I1663 E1664 S1665	D1622-R1625 PolarHBondContact O-N 3.4Å; S1623-R1625 VanDerWaalsContact C-N 3.34Å; R1625-I1663 HydrophobicContact CB-CG2 4.33Å; R1625-E1664 IonicContact CZ-OE2 3.88Å; R1625-E1664 IonicContact NH1-OE2 2.76Å; R1625-E1664 IonicContact NH2-OE2 3.28Å; R1625-E1664 PolarHBondContact NH2-OE2 3.33Å; R1625-S1665 PolarHBondContact NE-OG 3.01Å; R1625-S1665 PolarHBondContact NH2-OG 3.16Å
1626	I	77	Confident	85.9	Confident	77 Å²	77	40.7 Å²	40.7	40%	0.395	22%	0.22	S	C	.	.			trans	-68.3	133.8	179.7	-69.7	170.8	0	0	0	109.7	A1624 Q1628 Q1783	A1624-I1626 HydrophobicContact CB-CB 4.5Å; A1624-I1626 HydrophobicContact CB-CD1 3.7Å; A1624-I1626 HydrophobicContact CB-CG1 3.81Å; A1624-I1626 PolarHBondContact O-N 3.42Å; I1626-Q1628 HydrophobicContact CG2-CG 3.76Å; I1626-Q1783 PolarHBondContact O-NE2 2.6Å; I1626-Q1783 PolarHBondContact O-OE1 2.75Å
1627	N	80.8	Confident	85.8	Confident	93 Å²	93	45 Å²	45	50%	0.497	24%	0.243	S	C	.	.			trans	-99.1	117.8	165.8	-166.1	4.7	0	0	0	109.9	L1629 I1663	N1627-L1629 WeakPolarHBondContact OD1-CB 3.34Å; N1627-L1629 PolarHBondContact OD1-N 2.87Å; N1627-L1629 VanDerWaalsContact OD1-N 3.11Å; N1627-I1663 HydrophobicContact CB-CD1 3.33Å; N1627-I1663 VanDerWaalsContact CG-CD1 3.47Å
1628	Q	83.8	Confident	85.3	Confident	59 Å²	59	50.4 Å²	50.4	28%	0.276	26%	0.263	S	S	.	.			trans	-123.5	9.4	170.1	-79.5	175.6	8.7	0	0	112.5	I1626 L1780 Q1784	I1626-Q1628 HydrophobicContact CG2-CG 3.76Å; Q1628-L1780 VanDerWaalsContact OE1-C 3.3Å; Q1628-L1780 PolarHBondContact OE1-O 3.01Å; Q1628-Q1784 WeakPolarHBondContact O-CG 3.18Å; Q1628-Q1784 PolarHBondContact O-NE2 3.02Å
1629	L	85.8	Confident	84.8	Confident	22 Å²	22	50.7 Å²	50.7	12%	0.115	27%	0.265	C	S	.	.			trans	-60.8	136.6	175.1	-63.3	169.9	0	0	0	110.2	L1605 V1618 V1620 N1627 L1632 V1661 Q1783 V1787	L1605-L1629 HydrophobicContact CD1-CD2 4.11Å; V1618-L1629 HydrophobicContact CG1-CD1 4.01Å; V1620-L1629 HydrophobicContact CG2-CD1 3.73Å; V1620-L1629 HydrophobicContact CG2-CD2 4.45Å; V1620-L1629 HydrophobicContact CG2-CG 4.28Å; N1627-L1629 WeakPolarHBondContact OD1-CB 3.34Å; N1627-L1629 PolarHBondContact OD1-N 2.87Å; N1627-L1629 VanDerWaalsContact OD1-N 3.11Å; L1629-L1632 HydrophobicContact CB-CD2 4.43Å; L1629-V1661 HydrophobicContact CD1-CG1 3.62Å; L1629-V1661 HydrophobicContact CD1-CG2 4.3Å; L1629-Q1783 HydrophobicContact CD2-CB 4.07Å; L1629-V1787 HydrophobicContact CD2-CB 3.79Å; L1629-V1787 HydrophobicContact CD2-CG1 3.73Å; L1629-V1787 HydrophobicContact CD2-CG2 4.15Å
1630	P	85.4	Confident	84.2	Confident	45 Å²	45	51.6 Å²	51.6	29%	0.292	27%	0.271	S	S	.	.			trans	-74.4	179.2	173.3	36.1	-36.7	0	0	0	110.1	L1632 L1635 V1787	P1630-L1632 HydrophobicContact CG-CD2 4.35Å; P1630-L1632 PolarHBondContact O-N 2.79Å; P1630-L1635 HydrophobicContact CG-CB 4.46Å; P1630-L1635 HydrophobicContact CG-CD2 3.81Å; P1630-V1787 HydrophobicContact CG-CG1 4.44Å
1631	D	85.1	Confident	83.7	Confident	92 Å²	92	55 Å²	55	49%	0.492	30%	0.298	S	S	.	.			trans	-58.8	107.9	165	-174.9	-36.7	0	0	0	109.3	N1633 V1634 L1635	D1631-N1633 VanDerWaalsContact C-N 3.3Å; D1631-N1633 PolarHBondContact O-N 2.58Å; D1631-N1633 WeakPolarHBondContact OD1-CA 3.22Å; D1631-N1633 VanDerWaalsContact OD1-CB 3.28Å; D1631-N1633 WeakPolarHBondContact OD1-CB 3.46Å; D1631-N1633 PolarHBondContact OD1-N 3.41Å; D1631-V1634 HydrophobicContact CB-CB 4.08Å; D1631-V1634 HydrophobicContact CB-CG2 4.13Å; D1631-V1634 PolarHBondContact O-N 2.99Å; D1631-V1634 PolarHBondContact OD1-N 3.34Å; D1631-L1635 WeakPolarHBondContact O-CB 3.37Å; D1631-L1635 PolarHBondContact O-N 2.93Å
1632	L	89.6	Confident	83.1	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.042	32%	0.319	C	S	.	.	H	α-helix	trans	-71.7	-25.7	-175.6	-60.1	-178.4	0	0	0	112.2	V1618 L1629 P1630 L1635 Y1636 F1659 V1661 V1787	V1618-L1632 HydrophobicContact CG2-CD1 3.67Å; L1629-L1632 HydrophobicContact CB-CD2 4.43Å; P1630-L1632 HydrophobicContact CG-CD2 4.35Å; P1630-L1632 PolarHBondContact O-N 2.79Å; L1632-L1635 HydrophobicContact CD2-CD2 4.5Å; L1632-Y1636 WeakPolarHBondContact O-CB 3.4Å; L1632-Y1636 PolarHBondContact O-N 3.49Å; L1632-F1659 HydrophobicContact CB-CB 4.1Å; L1632-F1659 HydrophobicContact CB-CD1 4.17Å; L1632-F1659 HydrophobicContact CB-CD2 3.49Å; L1632-F1659 VanDerWaalsContact CB-CD2 3.49Å; L1632-F1659 HydrophobicContact CB-CE1 4.49Å; L1632-F1659 HydrophobicContact CB-CE2 3.87Å; L1632-F1659 HydrophobicContact CB-CG 3.66Å; L1632-F1659 HydrophobicContact CB-CZ 4.35Å; L1632-F1659 HydrophobicContact CD1-CB 3.8Å; L1632-F1659 HydrophobicContact CD1-CD1 3.86Å; L1632-F1659 HydrophobicContact CD1-CG 3.82Å; L1632-F1659 HydrophobicContact CG-CG 4.41Å; L1632-F1659 WeakPolarHBondContact O-CE2 3.44Å; L1632-V1661 HydrophobicContact CD1-CG2 3.75Å; L1632-V1787 HydrophobicContact CD2-CB 4.37Å; L1632-V1787 HydrophobicContact CD2-CG1 3.72Å; L1632-V1787 HydrophobicContact CD2-CG2 3.72Å
1633	N	86.8	Confident	82.4	Confident	68 Å²	68	61.9 Å²	61.9	36%	0.364	33%	0.333	S	S	.	.	H	α-helix	trans	-70.2	-47.6	175.7	-50.8	-32.2	0	0	0	109.3	D1631 Y1636 L1637 L1657 F1659	D1631-N1633 VanDerWaalsContact C-N 3.3Å; D1631-N1633 PolarHBondContact O-N 2.58Å; D1631-N1633 WeakPolarHBondContact OD1-CA 3.22Å; D1631-N1633 VanDerWaalsContact OD1-CB 3.28Å; D1631-N1633 WeakPolarHBondContact OD1-CB 3.46Å; D1631-N1633 PolarHBondContact OD1-N 3.41Å; N1633-Y1636 PolarHBondContact O-N 2.89Å; N1633-L1637 WeakPolarHBondContact O-CB 3.42Å; N1633-L1637 VanDerWaalsContact O-CG 3.32Å; N1633-L1637 WeakPolarHBondContact O-CG 3.37Å; N1633-L1637 PolarHBondContact O-N 3.27Å; N1633-L1657 PolarHBondContact OD1-O 2.82Å; N1633-F1659 WeakPolarHBondContact OD1-CD2 3.47Å
1634	V	87.1	Confident	82.2	Confident	87 Å²	87	62.6 Å²	62.6	53%	0.527	33%	0.33	S	S	.	.	H	α-helix	trans	-66.3	-41.3	176.9	175.8	0	0	0	0	111.2	D1631 R1638	D1631-V1634 HydrophobicContact CB-CB 4.08Å; D1631-V1634 HydrophobicContact CB-CG2 4.13Å; D1631-V1634 PolarHBondContact O-N 2.99Å; D1631-V1634 PolarHBondContact OD1-N 3.34Å; V1634-R1638 VanDerWaalsContact O-CB 3.27Å; V1634-R1638 WeakPolarHBondContact O-CB 3.28Å; V1634-R1638 PolarHBondContact O-N 3.21Å
1635	L	88.2	Confident	81.6	Confident	25 Å²	25	64.5 Å²	64.5	13%	0.131	34%	0.337	C	S	.	.	H	α-helix	trans	-62.2	-45	174.8	-174.5	65.9	0	0	0	111.2	P1630 D1631 L1632 R1638 Q1639 V1787 K1788 I1791	P1630-L1635 HydrophobicContact CG-CB 4.46Å; P1630-L1635 HydrophobicContact CG-CD2 3.81Å; D1631-L1635 WeakPolarHBondContact O-CB 3.37Å; D1631-L1635 PolarHBondContact O-N 2.93Å; L1632-L1635 HydrophobicContact CD2-CD2 4.5Å; L1635-R1638 PolarHBondContact O-N 2.8Å; L1635-Q1639 WeakPolarHBondContact O-CG 3.37Å; L1635-Q1639 PolarHBondContact O-N 3.06Å; L1635-V1787 HydrophobicContact CD2-CG1 3.92Å; L1635-K1788 HydrophobicContact CD1-CG 4.4Å; L1635-K1788 HydrophobicContact CD2-CB 4.24Å; L1635-I1791 HydrophobicContact CD2-CD1 4.01Å; L1635-I1791 HydrophobicContact CG-CD1 4.36Å
1636	Y	90.8	Very high	81.1	Confident	1 Å²	1	66.9 Å²	66.9	0%	0.004	35%	0.353	C	S	.	.	H	α-helix	trans	-60	-52.9	177.3	177.7	-112	0	0	0	111.8	L1632 N1633 R1638 Q1639 C1640 P1653 P1654 L1657 F1659 I1791 F1794 L1795	L1632-Y1636 WeakPolarHBondContact O-CB 3.4Å; L1632-Y1636 PolarHBondContact O-N 3.49Å; N1633-Y1636 PolarHBondContact O-N 2.89Å; Y1636-R1638 VanDerWaalsContact C-N 3.29Å; Y1636-R1638 PolarHBondContact O-N 2.82Å; Y1636-Q1639 PolarHBondContact O-N 3.48Å; Y1636-Q1639 VanDerWaalsContact O-N 3.1Å; Y1636-C1640 VanDerWaalsContact CE2-SG 3.56Å; Y1636-C1640 PolarHBondContact O-N 3.49Å; Y1636-C1640 PolarHBondContact O-SG 3.44Å; Y1636-P1653 WeakPolarHBondContact OH-CB 3.29Å; Y1636-P1654 WeakPolarHBondContact CE1-O 3.47Å; Y1636-P1654 WeakPolarHBondContact OH-CD 3.28Å; Y1636-P1654 PolarHBondContact OH-O 2.71Å; Y1636-P1654 VanDerWaalsContact OH-O 3.07Å; Y1636-L1657 HydrophobicContact CD1-CB 4.07Å; Y1636-L1657 HydrophobicContact CD1-CD1 4.36Å; Y1636-L1657 HydrophobicContact CD1-CG 4.22Å; Y1636-L1657 HydrophobicContact CD2-CD1 3.9Å; Y1636-L1657 HydrophobicContact CE1-CB 3.99Å; Y1636-L1657 HydrophobicContact CE1-CD1 3.98Å; Y1636-L1657 HydrophobicContact CE1-CG 3.69Å; Y1636-L1657 HydrophobicContact CE2-CD1 3.5Å; Y1636-L1657 HydrophobicContact CE2-CG 4.15Å; Y1636-L1657 HydrophobicContact CG-CD1 4.31Å; Y1636-F1659 HydrophobicContact CG-CE2 4.41Å; Y1636-F1659 HydrophobicContact CG-CZ 4.46Å; Y1636-I1791 HydrophobicContact CD2-CG2 4.02Å; Y1636-F1794 HydrophobicContact CE2-CD1 4.01Å; Y1636-F1794 AromaticContact CE2-CE1 3.91Å; Y1636-F1794 HydrophobicContact CE2-CE1 3.91Å; Y1636-L1795 HydrophobicContact CE2-CD2 3.73Å; Y1636-L1795 HydrophobicContact CE2-CG 4.35Å
1637	L	86.7	Confident	79.6	Confident	92 Å²	92	67.7 Å²	67.7	48%	0.482	35%	0.354	S	S	.	.	H	α-helix	trans	-58.2	-40.6	177.3	-70.8	168.9	0	0	0	112	N1633 Q1639 C1640 A1641	N1633-L1637 WeakPolarHBondContact O-CB 3.42Å; N1633-L1637 VanDerWaalsContact O-CG 3.32Å; N1633-L1637 WeakPolarHBondContact O-CG 3.37Å; N1633-L1637 PolarHBondContact O-N 3.27Å; L1637-Q1639 PolarHBondContact O-N 3.44Å; L1637-C1640 PolarHBondContact O-N 2.92Å; L1637-A1641 WeakPolarHBondContact O-CB 3.29Å; L1637-A1641 PolarHBondContact O-N 2.98Å
1638	R	85.3	Confident	78	Confident	150 Å²	150	72 Å²	72	57%	0.566	37%	0.371	S	S	*	.	H	α-helix	trans	-68	-31.1	177.3	-168.2	174.9	-174.6	-172.6	0.6	113.1	V1634 L1635 Y1636 K1642	V1634-R1638 VanDerWaalsContact O-CB 3.27Å; V1634-R1638 WeakPolarHBondContact O-CB 3.28Å; V1634-R1638 PolarHBondContact O-N 3.21Å; L1635-R1638 PolarHBondContact O-N 2.8Å; Y1636-R1638 VanDerWaalsContact C-N 3.29Å; Y1636-R1638 PolarHBondContact O-N 2.82Å; R1638-K1642 WeakPolarHBondContact O-CG 3.42Å; R1638-K1642 PolarHBondContact O-N 2.75Å
1639	Q	81.2	Confident	75.9	Confident	6 Å²	6	77.1 Å²	77.1	3%	0.028	40%	0.401	C	S	.	.	H	α-helix	trans	-79.2	-36.3	172	-63.6	-56.8	-44.9	0	0	111.9	L1635 Y1636 L1637 K1642 C1643 I1791 L1795	L1635-Q1639 WeakPolarHBondContact O-CG 3.37Å; L1635-Q1639 PolarHBondContact O-N 3.06Å; Y1636-Q1639 PolarHBondContact O-N 3.48Å; Y1636-Q1639 VanDerWaalsContact O-N 3.1Å; L1637-Q1639 PolarHBondContact O-N 3.44Å; Q1639-K1642 PolarHBondContact O-N 3.1Å; Q1639-C1643 PolarHBondContact O-N 3.04Å; Q1639-I1791 HydrophobicContact CB-CG2 3.96Å; Q1639-I1791 HydrophobicContact CG-CG2 4.01Å; Q1639-L1795 HydrophobicContact CB-CD1 3.51Å
1640	C	82.4	Confident	74.3	Confident	19 Å²	19	81.3 Å²	81.3	13%	0.128	42%	0.42	C	S	.	.	H	α-helix	trans	-58.4	-51.1	173.7	-65.2	0	0	0	0	111	Y1636 L1637 K1642 C1643 F1644 L1795	Y1636-C1640 VanDerWaalsContact CE2-SG 3.56Å; Y1636-C1640 PolarHBondContact O-N 3.49Å; Y1636-C1640 PolarHBondContact O-SG 3.44Å; L1637-C1640 PolarHBondContact O-N 2.92Å; C1640-K1642 PolarHBondContact O-N 2.72Å; C1640-C1643 PolarHBondContact O-N 3.13Å; C1640-C1643 VanDerWaalsContact O-N 3.16Å; C1640-F1644 PolarHBondContact O-N 2.92Å; C1640-L1795 VanDerWaalsContact SG-CD2 3.59Å
1641	A	79.7	Confident	73.3	Confident	70 Å²	70	85 Å²	85	58%	0.579	43%	0.433	S	S	*	.	H	α-helix	trans	-64.1	-23.2	178.5	0	0	0	0	0	113.7	L1637	L1637-A1641 WeakPolarHBondContact O-CB 3.29Å; L1637-A1641 PolarHBondContact O-N 2.98Å
1642	K	76.6	Confident	72.8	Confident	102 Å²	102	81.9 Å²	81.9	44%	0.443	42%	0.415	S	S	.	.	H	α-helix	trans	-78.7	-42.3	171.3	-82.5	-170	169.8	-157.1	0	112.7	R1638 Q1639 C1640 E1764	R1638-K1642 WeakPolarHBondContact O-CG 3.42Å; R1638-K1642 PolarHBondContact O-N 2.75Å; Q1639-K1642 PolarHBondContact O-N 3.1Å; C1640-K1642 PolarHBondContact O-N 2.72Å; K1642-E1764 IonicContact NZ-OE1 2.79Å; K1642-E1764 PolarHBondContact NZ-OE1 2.87Å
1643	C	69	Low	72.2	Confident	47 Å²	47	81.7 Å²	81.7	32%	0.318	41%	0.414	S	S	.	.	H	α-helix	trans	-84.4	-25.2	-175.7	-68	0	0	0	0	113.9	Q1639 C1640	Q1639-C1643 PolarHBondContact O-N 3.04Å; C1640-C1643 PolarHBondContact O-N 3.13Å; C1640-C1643 VanDerWaalsContact O-N 3.16Å
1644	F	73.2	Confident	72	Confident	71 Å²	71	78.8 Å²	78.8	31%	0.311	40%	0.399	S	S	.	.			trans	-138.4	73.8	-175.2	-54.8	-86.6	0	0	0	111	C1640 H1646 F1647 P1653 L1795	C1640-F1644 PolarHBondContact O-N 2.92Å; F1644-H1646 PolarHBondContact O-N 3.47Å; F1644-F1647 HydrophobicContact CB-CD2 3.65Å; F1644-F1647 HydrophobicContact CB-CE2 3.96Å; F1644-F1647 HydrophobicContact CG-CD2 4.31Å; F1644-F1647 HydrophobicContact CG-CE2 4.13Å; F1644-P1653 HydrophobicContact CD2-CG 3.83Å; F1644-P1653 HydrophobicContact CE2-CG 3.71Å; F1644-P1653 HydrophobicContact CZ-CG 4.3Å; F1644-L1795 HydrophobicContact CE2-CB 4.16Å; F1644-L1795 HydrophobicContact CE2-CD2 4.16Å; F1644-L1795 WeakPolarHBondContact CZ-O 3.4Å
1645	P	66.9	Low	71.6	Confident	96 Å²	96	79.3 Å²	79.3	62%	0.623	40%	0.399	S	S	*	.	S	Bend	trans	-71.2	-14.3	-178.6	29.6	-36.3	0	0	0	114.1
1646	H	61.6	Low	71.2	Confident	174 Å²	174	81.4 Å²	81.4	81%	0.806	41%	0.413	S	S	*	.	S	Bend	trans	-127.3	101.4	178	-60.5	-28.4	0	0	0	108.5	F1644	F1644-H1646 PolarHBondContact O-N 3.47Å
1647	F	44.9	Very low	71	Confident	94 Å²	94	81.5 Å²	81.5	41%	0.412	41%	0.414	S	S	.	.			trans	-113.8	102.6	-171.1	-147.1	-81.6	0	0	0	111.1	F1644 P1653	F1644-F1647 HydrophobicContact CB-CD2 3.65Å; F1644-F1647 HydrophobicContact CB-CE2 3.96Å; F1644-F1647 HydrophobicContact CG-CD2 4.31Å; F1644-F1647 HydrophobicContact CG-CE2 4.13Å; F1647-P1653 HydrophobicContact CE2-CG 3.61Å; F1647-P1653 HydrophobicContact CZ-CG 3.86Å; F1647-P1653 WeakPolarHBondContact CZ-O 3.35Å
1648	E	47.6	Very low	71	Confident	183 Å²	183	82 Å²	82	86%	0.855	42%	0.416	S	S	*	.			trans	-107.8	105	173.4	-64.8	-163.4	157.2	0	0	110.2	E1650	E1648-E1650 PolarHBondContact O-N 3.13Å
1649	N	39.9	Very low	71.2	Confident	167 Å²	167	76.4 Å²	76.4	89%	0.893	40%	0.396	S	S	*	.	S	Bend	trans	12.6	86	170.3	-69	-28	0	0	0	118.4
1650	E	53.4	Low	71.6	Confident	110 Å²	110	79.3 Å²	79.3	51%	0.514	41%	0.41	S	S	.	.			trans	-133.3	159.8	165.7	-98.3	-87.6	158.8	0	0	109.3	R1577 E1648 F1652	R1577-E1650 IonicContact CZ-OE2 2.75Å; R1577-E1650 IonicContact NH1-OE1 3.82Å; R1577-E1650 IonicContact NH1-OE2 2.63Å; R1577-E1650 PolarHBondContact NH1-OE2 3.45Å; R1577-E1650 IonicContact NH2-OE2 3.68Å; R1577-E1650 PolarHBondContact NH2-OE2 3.04Å; E1648-E1650 PolarHBondContact O-N 3.13Å; E1650-F1652 PolarHBondContact O-N 2.91Å
1651	E	64.2	Low	72	Confident	124 Å²	124	81.1 Å²	81.1	58%	0.579	42%	0.42	S	S	*	.	S	Bend	trans	-72.1	-9	-172.7	-67.1	-174.4	96.8	0	0	114.6	Q1701	E1651-Q1701 PolarHBondContact OE2-NE2 2.84Å; E1651-Q1701 VanDerWaalsContact OE2-NE2 3.09Å; E1651-Q1701 PolarHBondContact OE2-OE1 3.44Å
1652	F	73.6	Confident	72.4	Confident	26 Å²	26	83.1 Å²	83.1	11%	0.114	41%	0.413	C	S	.	.	S	Bend	trans	-140.7	142.6	-177	174.7	-85.4	0	0	0	111.5	E1650 F1794 E1798	E1650-F1652 PolarHBondContact O-N 2.91Å; F1652-F1794 HydrophobicContact CD2-CZ 4.29Å; F1652-F1794 HydrophobicContact CE2-CD2 4.49Å; F1652-F1794 HydrophobicContact CE2-CE1 4.17Å; F1652-F1794 AromaticContact CE2-CE2 3.77Å; F1652-F1794 HydrophobicContact CE2-CE2 3.77Å; F1652-F1794 AromaticContact CE2-CZ 3.57Å; F1652-F1794 HydrophobicContact CE2-CZ 3.57Å; F1652-F1794 HydrophobicContact CZ-CZ 4.46Å; F1652-F1794 WeakPolarHBondContact CZ-O 3.06Å; F1652-E1798 HydrophobicContact CD1-CB 4.23Å; F1652-E1798 HydrophobicContact CD1-CG 3.76Å; F1652-E1798 HydrophobicContact CD2-CG 4.21Å; F1652-E1798 HydrophobicContact CE1-CB 4.06Å; F1652-E1798 HydrophobicContact CE1-CG 3.79Å; F1652-E1798 HydrophobicContact CE2-CG 4.21Å; F1652-E1798 HydrophobicContact CG-CG 4.01Å; F1652-E1798 HydrophobicContact CZ-CG 4.02Å
1653	P	78.3	Confident	73	Confident	3 Å²	3	79.9 Å²	79.9	2%	0.019	40%	0.4	C	S	.	.	S	Bend	cis	-63.4	149.9	-16.9	25.6	-37.2	0	0	0	113.1	Y1636 F1644 F1647 L1795	Y1636-P1653 WeakPolarHBondContact OH-CB 3.29Å; F1644-P1653 HydrophobicContact CD2-CG 3.83Å; F1644-P1653 HydrophobicContact CE2-CG 3.71Å; F1644-P1653 HydrophobicContact CZ-CG 4.3Å; F1647-P1653 HydrophobicContact CE2-CG 3.61Å; F1647-P1653 HydrophobicContact CZ-CG 3.86Å; F1647-P1653 WeakPolarHBondContact CZ-O 3.35Å; P1653-L1795 HydrophobicContact CB-CD2 3.65Å; P1653-L1795 HydrophobicContact CG-CD2 3.97Å
1654	P	80.9	Confident	74	Confident	7 Å²	7	79.1 Å²	79.1	5%	0.045	39%	0.392	C	S	.	.			trans	-62.6	136.9	177.1	-23.6	33.7	0	0	0	113.7	P1611 R1614 Y1636 T1656 L1657	P1611-P1654 HydrophobicContact CB-CG 4.21Å; R1614-P1654 HydrophobicContact CG-CB 4.19Å; Y1636-P1654 WeakPolarHBondContact CE1-O 3.47Å; Y1636-P1654 WeakPolarHBondContact OH-CD 3.28Å; Y1636-P1654 PolarHBondContact OH-O 2.71Å; Y1636-P1654 VanDerWaalsContact OH-O 3.07Å; P1654-T1656 PolarHBondContact O-N 2.8Å; P1654-L1657 HydrophobicContact CB-CD2 4.4Å; P1654-L1657 HydrophobicContact CG-CD2 4.22Å
1655	D	80.2	Confident	74.5	Confident	98 Å²	98	78.4 Å²	78.4	52%	0.524	40%	0.396	S	S	.	.	S	Bend	trans	-50.1	-29.8	178.5	-10.4	-53.6	0	0	0	114.1	R1614	R1614-D1655 IonicContact CZ-OD2 2.69Å; R1614-D1655 IonicContact NH1-OD2 2.77Å; R1614-D1655 PolarHBondContact NH1-OD2 2.97Å; R1614-D1655 IonicContact NH2-OD1 3.16Å; R1614-D1655 IonicContact NH2-OD2 3.88Å; R1614-D1655 PolarHBondContact NH2-OD2 2.93Å
1656	T	79.8	Confident	75.2	Confident	69 Å²	69	76.9 Å²	76.9	42%	0.423	38%	0.382	S	S	.	.			trans	-144.1	134.4	177.6	58	0	0	0	0	110.4	R1614 P1654	R1614-T1656 WeakPolarHBondContact CB-O 3.44Å; P1654-T1656 PolarHBondContact O-N 2.8Å
1657	L	85.7	Confident	76.2	Confident	4 Å²	4	69.1 Å²	69.1	2%	0.021	35%	0.348	C	S	.	.			trans	-112.1	132.2	162.2	-74.1	-179.1	0	0	0	109.7	I1609 N1633 Y1636 P1654 F1659 F1794	I1609-L1657 HydrophobicContact CD1-CD1 4.16Å; I1609-L1657 HydrophobicContact CG2-CD1 3.81Å; I1609-L1657 HydrophobicContact CG2-CD2 4.07Å; N1633-L1657 PolarHBondContact OD1-O 2.82Å; Y1636-L1657 HydrophobicContact CD1-CB 4.07Å; Y1636-L1657 HydrophobicContact CD1-CD1 4.36Å; Y1636-L1657 HydrophobicContact CD1-CG 4.22Å; Y1636-L1657 HydrophobicContact CD2-CD1 3.9Å; Y1636-L1657 HydrophobicContact CE1-CB 3.99Å; Y1636-L1657 HydrophobicContact CE1-CD1 3.98Å; Y1636-L1657 HydrophobicContact CE1-CG 3.69Å; Y1636-L1657 HydrophobicContact CE2-CD1 3.5Å; Y1636-L1657 HydrophobicContact CE2-CG 4.15Å; Y1636-L1657 HydrophobicContact CG-CD1 4.31Å; P1654-L1657 HydrophobicContact CB-CD2 4.4Å; P1654-L1657 HydrophobicContact CG-CD2 4.22Å; L1657-F1659 HydrophobicContact CB-CD2 4.38Å; L1657-F1659 HydrophobicContact CB-CE2 3.73Å; L1657-F1659 HydrophobicContact CB-CZ 4Å; L1657-F1659 HydrophobicContact CD1-CE2 4.48Å; L1657-F1659 HydrophobicContact CD1-CZ 3.92Å; L1657-F1794 HydrophobicContact CD1-CD1 4.37Å; L1657-F1794 HydrophobicContact CD1-CE1 3.85Å; L1657-F1794 HydrophobicContact CD1-CZ 4.49Å
1658	N	86.1	Confident	78.1	Confident	101 Å²	101	67.6 Å²	67.6	54%	0.54	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	127.3	168.5	-63.1	-69.5	0	0	0	109.4	R1614 C1615 G1616	R1614-N1658 PolarHBondContact O-N 3.44Å; C1615-N1658 CarbonylContact C-O 3.55Å; C1615-N1658 WeakPolarHBondContact CA-O 3.24Å; G1616-N1658 PolarHBondContact N-O 2.88Å
1659	F	91.1	Very high	79.9	Confident	33 Å²	33	62 Å²	62	15%	0.145	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	118.3	-177.7	-68	-92.7	0	0	0	113.2	L1607 G1616 V1618 L1632 N1633 Y1636 L1657 I1791	L1607-F1659 HydrophobicContact CD1-CD1 4.48Å; L1607-F1659 HydrophobicContact CD1-CE1 4.08Å; G1616-F1659 CarbonylContact O-C 3.58Å; G1616-F1659 VanDerWaalsContact O-CA 3.31Å; G1616-F1659 WeakPolarHBondContact O-CA 3.33Å; V1618-F1659 HydrophobicContact CG2-CD1 4.07Å; L1632-F1659 HydrophobicContact CB-CB 4.1Å; L1632-F1659 HydrophobicContact CB-CD1 4.17Å; L1632-F1659 HydrophobicContact CB-CD2 3.49Å; L1632-F1659 VanDerWaalsContact CB-CD2 3.49Å; L1632-F1659 HydrophobicContact CB-CE1 4.49Å; L1632-F1659 HydrophobicContact CB-CE2 3.87Å; L1632-F1659 HydrophobicContact CB-CG 3.66Å; L1632-F1659 HydrophobicContact CB-CZ 4.35Å; L1632-F1659 HydrophobicContact CD1-CB 3.8Å; L1632-F1659 HydrophobicContact CD1-CD1 3.86Å; L1632-F1659 HydrophobicContact CD1-CG 3.82Å; L1632-F1659 HydrophobicContact CG-CG 4.41Å; L1632-F1659 WeakPolarHBondContact O-CE2 3.44Å; N1633-F1659 WeakPolarHBondContact OD1-CD2 3.47Å; Y1636-F1659 HydrophobicContact CG-CE2 4.41Å; Y1636-F1659 HydrophobicContact CG-CZ 4.46Å; L1657-F1659 HydrophobicContact CB-CD2 4.38Å; L1657-F1659 HydrophobicContact CB-CE2 3.73Å; L1657-F1659 HydrophobicContact CB-CZ 4Å; L1657-F1659 HydrophobicContact CD1-CE2 4.48Å; L1657-F1659 HydrophobicContact CD1-CZ 3.92Å; F1659-I1791 HydrophobicContact CE1-CD1 4.48Å; F1659-I1791 HydrophobicContact CZ-CD1 4.14Å; F1659-I1791 HydrophobicContact CZ-CG1 4.44Å
1660	E	88.9	Confident	82.1	Confident	68 Å²	68	54 Å²	54	32%	0.318	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	110.9	163.6	-172.7	-171.1	158.3	0	0	109.2	G1616 Y1617 V1618 R1662 W1677	G1616-E1660 PolarHBondContact O-N 3.41Å; Y1617-E1660 CarbonylContact C-O 3.56Å; Y1617-E1660 WeakPolarHBondContact CA-O 3.37Å; Y1617-E1660 HydrophobicContact CD1-CB 3.81Å; Y1617-E1660 HydrophobicContact CD1-CG 4.47Å; Y1617-E1660 WeakPolarHBondContact CD1-OE2 3.23Å; Y1617-E1660 HydrophobicContact CE1-CB 4.23Å; Y1617-E1660 VanDerWaalsContact CE1-OE2 3.28Å; Y1617-E1660 WeakPolarHBondContact CE1-OE2 3.36Å; V1618-E1660 PolarHBondContact N-O 3.42Å; E1660-R1662 IonicContact OE1-CZ 3.14Å; E1660-R1662 IonicContact OE1-NE 2.7Å; E1660-R1662 PolarHBondContact OE1-NE 3.06Å; E1660-R1662 IonicContact OE1-NH2 2.71Å; E1660-R1662 PolarHBondContact OE1-NH2 2.79Å; E1660-W1677 HydrophobicContact CG-CZ2 4.47Å
1661	V	90.4	Very high	83.7	Confident	56 Å²	56	49.6 Å²	49.6	34%	0.339	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	132.2	177.4	-179.6	0	0	0	0	110.4	V1618 L1629 L1632 I1663	V1618-V1661 HydrophobicContact CB-CG2 4.33Å; V1618-V1661 HydrophobicContact CG2-CG2 4.49Å; V1618-V1661 CarbonylContact O-C 3.24Å; L1629-V1661 HydrophobicContact CD1-CG1 3.62Å; L1629-V1661 HydrophobicContact CD1-CG2 4.3Å; L1632-V1661 HydrophobicContact CD1-CG2 3.75Å; V1661-I1663 HydrophobicContact CG1-CG1 4.28Å
1662	R	89	Confident	84.9	Confident	112 Å²	112	50.7 Å²	50.7	42%	0.423	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.7	168.8	-66.5	-171	-175.1	-120.1	-4.1	110.6	V1618 C1619 V1620 E1660 W1677	V1618-R1662 PolarHBondContact O-N 2.91Å; C1619-R1662 WeakPolarHBondContact CA-O 3.41Å; V1620-R1662 PolarHBondContact N-O 3.26Å; E1660-R1662 IonicContact OE1-CZ 3.14Å; E1660-R1662 IonicContact OE1-NE 2.7Å; E1660-R1662 PolarHBondContact OE1-NE 3.06Å; E1660-R1662 IonicContact OE1-NH2 2.71Å; E1660-R1662 PolarHBondContact OE1-NH2 2.79Å; R1662-W1677 HydrophobicContact CB-CH2 4.23Å; R1662-W1677 HydrophobicContact CB-CZ2 4.46Å; R1662-W1677 HydrophobicContact CG-CH2 4.2Å; R1662-W1677 HydrophobicContact CG-CZ2 3.94Å
1663	I	89.3	Confident	85.6	Confident	34 Å²	34	50.3 Å²	50.3	17%	0.174	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	121.6	-176.7	-55.5	178.3	0	0	0	108.2	V1620 R1625 N1627 V1661	V1620-I1663 HydrophobicContact CB-CG1 4.24Å; V1620-I1663 HydrophobicContact CB-CG2 4.47Å; V1620-I1663 HydrophobicContact CG2-CG1 4.49Å; V1620-I1663 WeakPolarHBondContact O-CA 3.37Å; R1625-I1663 HydrophobicContact CB-CG2 4.33Å; N1627-I1663 HydrophobicContact CB-CD1 3.33Å; N1627-I1663 VanDerWaalsContact CG-CD1 3.47Å; V1661-I1663 HydrophobicContact CG1-CG1 4.28Å
1664	E	90.2	Very high	86.1	Confident	31 Å²	31	50.2 Å²	50.2	15%	0.145	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	148.4	-178.3	-67.1	-63.3	174.6	0	0	111.6	V1620 I1621 D1622 R1625 I1669 I1673	V1620-E1664 PolarHBondContact O-N 3.47Å; I1621-E1664 VanDerWaalsContact CA-O 3.29Å; I1621-E1664 WeakPolarHBondContact CA-O 3.33Å; D1622-E1664 PolarHBondContact N-O 3.03Å; D1622-E1664 VanDerWaalsContact N-O 3.16Å; R1625-E1664 IonicContact CZ-OE2 3.88Å; R1625-E1664 IonicContact NH1-OE2 2.76Å; R1625-E1664 IonicContact NH2-OE2 3.28Å; R1625-E1664 PolarHBondContact NH2-OE2 3.33Å; E1664-I1669 HydrophobicContact CG-CG2 3.96Å; E1664-I1673 HydrophobicContact CG-CD1 3.89Å; E1664-I1673 WeakPolarHBondContact OE1-CD1 3.35Å
1665	S	83	Confident	86.5	Confident	56 Å²	56	52.6 Å²	52.6	39%	0.392	27%	0.265	S	S	.	.	S	Bend	trans	-90.9	-13.5	172.4	53.2	0	0	0	0	113.3	R1625	R1625-S1665 PolarHBondContact NE-OG 3.01Å; R1625-S1665 PolarHBondContact NH2-OG 3.16Å
1666	D	82	Confident	86.8	Confident	65 Å²	65	56.6 Å²	56.6	35%	0.348	27%	0.273	S	S	.	.			trans	-113.9	116.4	-178.6	177.9	-4.6	0	0	0	109.3	V1668 I1669 G1670	D1666-V1668 PolarHBondContact O-N 2.86Å; D1666-V1668 WeakPolarHBondContact OD1-CA 3.27Å; D1666-V1668 VanDerWaalsContact OD1-CB 3.29Å; D1666-V1668 WeakPolarHBondContact OD1-CB 3.13Å; D1666-V1668 PolarHBondContact OD1-N 3.19Å; D1666-I1669 HydrophobicContact CB-CB 4.13Å; D1666-I1669 HydrophobicContact CB-CD1 3.98Å; D1666-I1669 HydrophobicContact CB-CG1 4.02Å; D1666-I1669 PolarHBondContact O-N 3.44Å; D1666-I1669 VanDerWaalsContact O-N 3.09Å; D1666-I1669 WeakPolarHBondContact OD2-CG1 3.38Å; D1666-G1670 PolarHBondContact O-N 3.5Å
1667	A	81.4	Confident	87.2	Confident	10 Å²	10	54.5 Å²	54.5	8%	0.083	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-31.6	178.3	0	0	0	0	0	112.6	I1621 R1671	I1621-A1667 HydrophobicContact CD1-CB 4.32Å; I1621-A1667 HydrophobicContact CG2-CB 4.07Å; A1667-R1671 VanDerWaalsContact O-CB 3.23Å; A1667-R1671 WeakPolarHBondContact O-CB 3.4Å; A1667-R1671 VanDerWaalsContact O-CD 3.29Å; A1667-R1671 WeakPolarHBondContact O-CD 3.31Å; A1667-R1671 WeakPolarHBondContact O-CG 3.45Å; A1667-R1671 PolarHBondContact O-N 3Å
1668	V	84.6	Confident	87.2	Confident	62 Å²	62	54.3 Å²	54.3	38%	0.376	26%	0.256	S	S	.	.	H	α-helix	trans	-69.8	-36.6	176.7	-174.3	0	0	0	0	110.9	D1666 R1672	D1666-V1668 PolarHBondContact O-N 2.86Å; D1666-V1668 WeakPolarHBondContact OD1-CA 3.27Å; D1666-V1668 VanDerWaalsContact OD1-CB 3.29Å; D1666-V1668 WeakPolarHBondContact OD1-CB 3.13Å; D1666-V1668 PolarHBondContact OD1-N 3.19Å; V1668-R1672 VanDerWaalsContact O-CB 3.29Å; V1668-R1672 WeakPolarHBondContact O-CB 3.38Å; V1668-R1672 WeakPolarHBondContact O-CD 3.31Å; V1668-R1672 WeakPolarHBondContact O-CG 3.13Å; V1668-R1672 PolarHBondContact O-N 3.35Å
1669	I	86.1	Confident	87	Confident	66 Å²	66	52.1 Å²	52.1	34%	0.338	25%	0.247	S	C	.	.	H	α-helix	trans	-70.3	-47	174.1	-65.7	176.2	0	0	0	110.2	E1664 D1666 R1671 R1672 I1673	E1664-I1669 HydrophobicContact CG-CG2 3.96Å; D1666-I1669 HydrophobicContact CB-CB 4.13Å; D1666-I1669 HydrophobicContact CB-CD1 3.98Å; D1666-I1669 HydrophobicContact CB-CG1 4.02Å; D1666-I1669 PolarHBondContact O-N 3.44Å; D1666-I1669 VanDerWaalsContact O-N 3.09Å; D1666-I1669 WeakPolarHBondContact OD2-CG1 3.38Å; I1669-R1671 PolarHBondContact O-N 3.34Å; I1669-R1672 CarbonylContact O-C 3.58Å; I1669-R1672 WeakPolarHBondContact O-CB 3.3Å; I1669-R1672 PolarHBondContact O-N 3.44Å; I1669-R1672 VanDerWaalsContact O-N 3.16Å; I1669-I1673 HydrophobicContact CG2-CD1 3.96Å; I1669-I1673 HydrophobicContact CG2-CG1 4.5Å; I1669-I1673 WeakPolarHBondContact O-CG1 3.41Å; I1669-I1673 PolarHBondContact O-N 2.91Å
1670	G	86.3	Confident	86.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.1	-48.2	176.6	0	0	0	0	0	112.7	C1619 D1666 R1672 I1673 V1674	C1619-G1670 VanDerWaalsContact SG-CA 3.55Å; D1666-G1670 PolarHBondContact O-N 3.5Å; G1670-R1672 VanDerWaalsContact C-N 3.34Å; G1670-R1672 PolarHBondContact O-N 2.98Å; G1670-I1673 WeakPolarHBondContact O-CB 3.25Å; G1670-I1673 PolarHBondContact O-N 2.95Å; G1670-I1673 VanDerWaalsContact O-N 3.07Å; G1670-V1674 PolarHBondContact O-N 3.25Å
1671	R	87.7	Confident	85.6	Confident	16 Å²	16	51.7 Å²	51.7	6%	0.06	25%	0.254	C	S	.	.	H	α-helix	trans	-59.1	-41.3	174	-71.7	163.5	-167.1	162.8	4.3	112.2	D1600 Y1606 A1667 I1669 I1673 V1674 Q1675 L1745	D1600-R1671 IonicContact OD1-CZ 3.55Å; D1600-R1671 VanDerWaalsContact OD1-CZ 3.26Å; D1600-R1671 IonicContact OD1-NH1 2.81Å; D1600-R1671 PolarHBondContact OD1-NH1 3.26Å; D1600-R1671 IonicContact OD1-NH2 3.44Å; D1600-R1671 PolarHBondContact OD1-NH2 2.81Å; D1600-R1671 IonicContact OD2-NH1 3.14Å; Y1606-R1671 WeakPolarHBondContact OH-CG 3.27Å; Y1606-R1671 PolarHBondContact OH-NE 3.03Å; A1667-R1671 VanDerWaalsContact O-CB 3.23Å; A1667-R1671 WeakPolarHBondContact O-CB 3.4Å; A1667-R1671 VanDerWaalsContact O-CD 3.29Å; A1667-R1671 WeakPolarHBondContact O-CD 3.31Å; A1667-R1671 WeakPolarHBondContact O-CG 3.45Å; A1667-R1671 PolarHBondContact O-N 3Å; I1669-R1671 PolarHBondContact O-N 3.34Å; R1671-I1673 VanDerWaalsContact C-N 3.34Å; R1671-I1673 PolarHBondContact O-N 3.07Å; R1671-V1674 PolarHBondContact O-N 3.24Å; R1671-Q1675 WeakPolarHBondContact O-CB 3.4Å; R1671-Q1675 PolarHBondContact O-N 3.01Å; R1671-L1745 HydrophobicContact CB-CD2 3.94Å; R1671-L1745 HydrophobicContact CG-CD2 4.16Å; R1671-L1745 WeakPolarHBondContact O-CD2 3.23Å
1672	R	87.9	Confident	84.4	Confident	147 Å²	147	51.1 Å²	51.1	56%	0.555	25%	0.252	S	S	*	.	H	α-helix	trans	-65.5	-32.1	174.2	-77.9	169.5	177.6	176	1.5	113.1	V1668 I1669 G1670 R1676	V1668-R1672 VanDerWaalsContact O-CB 3.29Å; V1668-R1672 WeakPolarHBondContact O-CB 3.38Å; V1668-R1672 WeakPolarHBondContact O-CD 3.31Å; V1668-R1672 WeakPolarHBondContact O-CG 3.13Å; V1668-R1672 PolarHBondContact O-N 3.35Å; I1669-R1672 CarbonylContact O-C 3.58Å; I1669-R1672 WeakPolarHBondContact O-CB 3.3Å; I1669-R1672 PolarHBondContact O-N 3.44Å; I1669-R1672 VanDerWaalsContact O-N 3.16Å; G1670-R1672 VanDerWaalsContact C-N 3.34Å; G1670-R1672 PolarHBondContact O-N 2.98Å; R1672-R1676 WeakPolarHBondContact O-CB 3.48Å; R1672-R1676 WeakPolarHBondContact O-CD 3.39Å; R1672-R1676 WeakPolarHBondContact O-CG 3.25Å; R1672-R1676 PolarHBondContact O-N 2.86Å
1673	I	88.7	Confident	83.4	Confident	19 Å²	19	53.3 Å²	53.3	10%	0.097	26%	0.264	C	S	.	.	H	α-helix	trans	-69.5	-50.6	174.8	-74.8	170.3	0	0	0	110.3	E1664 I1669 G1670 R1671 Q1675 R1676 W1677	E1664-I1673 HydrophobicContact CG-CD1 3.89Å; E1664-I1673 WeakPolarHBondContact OE1-CD1 3.35Å; I1669-I1673 HydrophobicContact CG2-CD1 3.96Å; I1669-I1673 HydrophobicContact CG2-CG1 4.5Å; I1669-I1673 WeakPolarHBondContact O-CG1 3.41Å; I1669-I1673 PolarHBondContact O-N 2.91Å; G1670-I1673 WeakPolarHBondContact O-CB 3.25Å; G1670-I1673 PolarHBondContact O-N 2.95Å; G1670-I1673 VanDerWaalsContact O-N 3.07Å; R1671-I1673 VanDerWaalsContact C-N 3.34Å; R1671-I1673 PolarHBondContact O-N 3.07Å; I1673-Q1675 VanDerWaalsContact C-N 3.31Å; I1673-Q1675 PolarHBondContact O-N 3.3Å; I1673-R1676 WeakPolarHBondContact O-CA 3.44Å; I1673-R1676 WeakPolarHBondContact O-CB 3.4Å; I1673-R1676 PolarHBondContact O-N 3.45Å; I1673-W1677 HydrophobicContact CG2-CD2 4Å; I1673-W1677 HydrophobicContact CG2-CE3 4.06Å; I1673-W1677 HydrophobicContact CG2-CH2 3.77Å; I1673-W1677 HydrophobicContact CG2-CZ2 3.72Å; I1673-W1677 HydrophobicContact CG2-CZ3 3.94Å; I1673-W1677 PolarHBondContact O-N 3.44Å
1674	V	89.3	Confident	81.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.3	-42.1	176.6	179.3	0	0	0	0	111.1	L1584 Y1606 C1619 G1670 R1671 R1676 W1677 I1678 L1745	L1584-V1674 HydrophobicContact CD1-CG1 4.45Å; Y1606-V1674 HydrophobicContact CD1-CG1 4.4Å; Y1606-V1674 HydrophobicContact CD1-CG2 4.32Å; Y1606-V1674 HydrophobicContact CG-CG2 4.09Å; C1619-V1674 HydrophobicContact CB-CG2 3.71Å; G1670-V1674 PolarHBondContact O-N 3.25Å; R1671-V1674 PolarHBondContact O-N 3.24Å; V1674-R1676 VanDerWaalsContact C-N 3.34Å; V1674-R1676 PolarHBondContact O-N 3.08Å; V1674-W1677 HydrophobicContact CB-CE3 4.39Å; V1674-W1677 HydrophobicContact CG2-CE3 4.05Å; V1674-W1677 HydrophobicContact CG2-CZ3 3.99Å; V1674-W1677 PolarHBondContact O-N 2.87Å; V1674-I1678 HydrophobicContact CG1-CD1 4.07Å; V1674-I1678 WeakPolarHBondContact O-CG1 3.37Å; V1674-I1678 PolarHBondContact O-N 2.9Å; V1674-L1745 HydrophobicContact CB-CD1 4.49Å; V1674-L1745 HydrophobicContact CB-CD2 4.05Å; V1674-L1745 HydrophobicContact CG1-CD1 3.7Å; V1674-L1745 HydrophobicContact CG1-CD2 4.13Å
1675	Q	88.1	Confident	79.8	Confident	58 Å²	58	55.7 Å²	55.7	27%	0.271	28%	0.282	S	S	.	.	H	α-helix	trans	-59.2	-40.6	172.2	173.6	164.7	27.5	0	0	112.8	R1671 I1673 T1679 V1747	R1671-Q1675 WeakPolarHBondContact O-CB 3.4Å; R1671-Q1675 PolarHBondContact O-N 3.01Å; I1673-Q1675 VanDerWaalsContact C-N 3.31Å; I1673-Q1675 PolarHBondContact O-N 3.3Å; Q1675-T1679 WeakPolarHBondContact O-CB 3.2Å; Q1675-T1679 PolarHBondContact O-N 3.47Å; Q1675-T1679 PolarHBondContact O-OG1 3.14Å; Q1675-V1747 HydrophobicContact CB-CG1 4.21Å; Q1675-V1747 HydrophobicContact CG-CB 4.03Å; Q1675-V1747 HydrophobicContact CG-CG1 4.16Å
1676	R	87	Confident	78.2	Confident	181 Å²	181	54.9 Å²	54.9	68%	0.683	28%	0.283	S	S	*	.	H	α-helix	trans	-66.9	-41.9	175.4	-79.2	168	177.4	-175.5	-0.7	112.2	R1672 I1673 V1674 T1679 S1680	R1672-R1676 WeakPolarHBondContact O-CB 3.48Å; R1672-R1676 WeakPolarHBondContact O-CD 3.39Å; R1672-R1676 WeakPolarHBondContact O-CG 3.25Å; R1672-R1676 PolarHBondContact O-N 2.86Å; I1673-R1676 WeakPolarHBondContact O-CA 3.44Å; I1673-R1676 WeakPolarHBondContact O-CB 3.4Å; I1673-R1676 PolarHBondContact O-N 3.45Å; V1674-R1676 VanDerWaalsContact C-N 3.34Å; V1674-R1676 PolarHBondContact O-N 3.08Å; R1676-T1679 PolarHBondContact O-N 3.46Å; R1676-S1680 WeakPolarHBondContact O-CB 3.37Å; R1676-S1680 PolarHBondContact O-N 3.2Å
1677	W	88	Confident	76.6	Confident	25 Å²	25	54.7 Å²	54.7	10%	0.095	29%	0.29	C	S	.	.	H	α-helix	trans	-57.8	-53.9	175	-71.7	-41.4	0	0	0	110.8	L1608 Y1617 C1619 E1660 R1662 I1673 V1674 T1679 S1680 L1681	L1608-W1677 HydrophobicContact CD2-CB 3.72Å; L1608-W1677 HydrophobicContact CD2-CE3 4.24Å; Y1617-W1677 AromaticContact CD1-CD1 3.79Å; Y1617-W1677 AromaticContact CD1-CD2 3.85Å; Y1617-W1677 HydrophobicContact CD1-CD2 3.85Å; Y1617-W1677 AromaticContact CD1-CE2 3.55Å; Y1617-W1677 HydrophobicContact CD1-CE3 4.46Å; Y1617-W1677 HydrophobicContact CD1-CG 4.03Å; Y1617-W1677 AromaticContact CD1-CZ2 3.97Å; Y1617-W1677 HydrophobicContact CD1-CZ2 3.97Å; Y1617-W1677 AromaticContact CD1-NE1 3.49Å; Y1617-W1677 AromaticContact CE1-CD1 3.93Å; Y1617-W1677 HydrophobicContact CE1-CG 4.46Å; Y1617-W1677 AromaticContact CE1-NE1 3.86Å; Y1617-W1677 HydrophobicContact CG-CD2 4.05Å; Y1617-W1677 HydrophobicContact CG-CE3 4.28Å; Y1617-W1677 HydrophobicContact CG-CG 4.34Å; C1619-W1677 HydrophobicContact CB-CH2 4.12Å; C1619-W1677 HydrophobicContact CB-CZ3 3.83Å; E1660-W1677 HydrophobicContact CG-CZ2 4.47Å; R1662-W1677 HydrophobicContact CB-CH2 4.23Å; R1662-W1677 HydrophobicContact CB-CZ2 4.46Å; R1662-W1677 HydrophobicContact CG-CH2 4.2Å; R1662-W1677 HydrophobicContact CG-CZ2 3.94Å; I1673-W1677 HydrophobicContact CG2-CD2 4Å; I1673-W1677 HydrophobicContact CG2-CE3 4.06Å; I1673-W1677 HydrophobicContact CG2-CH2 3.77Å; I1673-W1677 HydrophobicContact CG2-CZ2 3.72Å; I1673-W1677 HydrophobicContact CG2-CZ3 3.94Å; I1673-W1677 PolarHBondContact O-N 3.44Å; V1674-W1677 HydrophobicContact CB-CE3 4.39Å; V1674-W1677 HydrophobicContact CG2-CE3 4.05Å; V1674-W1677 HydrophobicContact CG2-CZ3 3.99Å; V1674-W1677 PolarHBondContact O-N 2.87Å; W1677-T1679 PolarHBondContact O-N 2.73Å; W1677-S1680 PolarHBondContact O-N 3.37Å; W1677-S1680 VanDerWaalsContact O-N 3.17Å; W1677-L1681 WeakPolarHBondContact O-CD1 3.46Å; W1677-L1681 WeakPolarHBondContact O-CG 3.13Å; W1677-L1681 PolarHBondContact O-N 3.36Å
1678	I	86.3	Confident	74.7	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-56.5	-47.5	177.6	-63.6	168.1	0	0	0	111.1	L1608 V1674 S1680 L1681 V1747 F1751	L1608-I1678 HydrophobicContact CD1-CG1 4.4Å; L1608-I1678 HydrophobicContact CD2-CG1 3.94Å; V1674-I1678 HydrophobicContact CG1-CD1 4.07Å; V1674-I1678 WeakPolarHBondContact O-CG1 3.37Å; V1674-I1678 PolarHBondContact O-N 2.9Å; I1678-S1680 VanDerWaalsContact C-N 3.34Å; I1678-S1680 PolarHBondContact O-N 2.97Å; I1678-L1681 PolarHBondContact O-N 3.11Å; I1678-V1747 HydrophobicContact CB-CG1 4.39Å; I1678-V1747 HydrophobicContact CB-CG2 4.34Å; I1678-V1747 HydrophobicContact CD1-CG1 3.94Å; I1678-V1747 HydrophobicContact CG2-CG1 4.32Å; I1678-V1747 HydrophobicContact CG2-CG2 3.73Å; I1678-F1751 HydrophobicContact CG2-CE2 4.11Å; I1678-F1751 HydrophobicContact CG2-CZ 4.48Å
1679	T	81.8	Confident	72.7	Confident	55 Å²	55	66.8 Å²	66.8	34%	0.337	33%	0.332	S	S	.	.	H	α-helix	trans	-65.4	-34.8	179.9	-51.5	0	0	0	0	112.8	Q1675 R1676 W1677 K1683	Q1675-T1679 WeakPolarHBondContact O-CB 3.2Å; Q1675-T1679 PolarHBondContact O-N 3.47Å; Q1675-T1679 PolarHBondContact O-OG1 3.14Å; R1676-T1679 PolarHBondContact O-N 3.46Å; W1677-T1679 PolarHBondContact O-N 2.73Å; T1679-K1683 PolarHBondContact O-N 3.39Å
1680	S	78.8	Confident	70.8	Confident	75 Å²	75	71.4 Å²	71.4	52%	0.524	35%	0.352	S	S	.	.	H	α-helix	trans	-72.2	-39.3	-178.7	-168.8	0	0	0	0	112.1	R1676 W1677 I1678 C1682 K1683 S1684	R1676-S1680 WeakPolarHBondContact O-CB 3.37Å; R1676-S1680 PolarHBondContact O-N 3.2Å; W1677-S1680 PolarHBondContact O-N 3.37Å; W1677-S1680 VanDerWaalsContact O-N 3.17Å; I1678-S1680 VanDerWaalsContact C-N 3.34Å; I1678-S1680 PolarHBondContact O-N 2.97Å; S1680-C1682 VanDerWaalsContact C-N 3.33Å; S1680-C1682 PolarHBondContact O-N 3.19Å; S1680-K1683 PolarHBondContact O-N 3.2Å; S1680-S1684 PolarHBondContact O-N 2.88Å
1681	L	72.5	Confident	68.7	Low	17 Å²	17	78.2 Å²	78.2	9%	0.089	39%	0.389	C	S	.	.	H	α-helix	trans	-56.3	-47.7	176	-70.1	160.9	0	0	0	110.8	L1582 V1610 W1677 I1678 K1683 S1684	L1582-L1681 HydrophobicContact CD1-CD1 3.99Å; V1610-L1681 HydrophobicContact CG1-CD2 4.15Å; V1610-L1681 HydrophobicContact CG2-CD1 3.57Å; V1610-L1681 HydrophobicContact CG2-CD2 4.19Å; W1677-L1681 WeakPolarHBondContact O-CD1 3.46Å; W1677-L1681 WeakPolarHBondContact O-CG 3.13Å; W1677-L1681 PolarHBondContact O-N 3.36Å; I1678-L1681 PolarHBondContact O-N 3.11Å; L1681-K1683 PolarHBondContact O-N 3.13Å; L1681-S1684 PolarHBondContact O-N 3.42Å; L1681-S1684 VanDerWaalsContact O-N 3.16Å; L1681-S1684 PolarHBondContact O-OG 3.24Å
1682	C	65.1	Low	66.2	Low	44 Å²	44	81.9 Å²	81.9	30%	0.297	42%	0.417	S	S	.	.	H	α-helix	trans	-64	-39	178.5	-59.8	0	0	0	0	113.1	S1680 S1684 F1751	S1680-C1682 VanDerWaalsContact C-N 3.33Å; S1680-C1682 PolarHBondContact O-N 3.19Å; C1682-S1684 VanDerWaalsContact C-N 3.31Å; C1682-S1684 PolarHBondContact O-N 2.76Å; C1682-F1751 VanDerWaalsContact SG-CZ 3.51Å
1683	K	66.2	Low	63.9	Low	157 Å²	157	83.9 Å²	83.9	68%	0.683	43%	0.429	S	S	*	.	H	α-helix	trans	-65.2	-33	174.3	-72.5	-174.7	178.5	-173.7	0	112.9	T1679 S1680 L1681 M1685	T1679-K1683 PolarHBondContact O-N 3.39Å; S1680-K1683 PolarHBondContact O-N 3.2Å; L1681-K1683 PolarHBondContact O-N 3.13Å; K1683-M1685 VanDerWaalsContact C-N 3.32Å; K1683-M1685 PolarHBondContact O-N 3.17Å
1684	S	55.1	Low	61.4	Low	61 Å²	61	91.8 Å²	91.8	43%	0.427	47%	0.466	S	S	.	.	H	α-helix	trans	-66.5	-30.1	-176.6	77.2	0	0	0	0	113.7	S1680 L1681 C1682 R1688	S1680-S1684 PolarHBondContact O-N 2.88Å; L1681-S1684 PolarHBondContact O-N 3.42Å; L1681-S1684 VanDerWaalsContact O-N 3.16Å; L1681-S1684 PolarHBondContact O-OG 3.24Å; C1682-S1684 VanDerWaalsContact C-N 3.31Å; C1682-S1684 PolarHBondContact O-N 2.76Å; S1684-R1688 PolarHBondContact O-N 3.46Å
1685	M	49.8	Very low	58.8	Low	54 Å²	54	100.1 Å²	100.1	27%	0.266	51%	0.505	S	S	.	.	H	α-helix	trans	-67.6	-50.4	179.1	-58.4	-146.3	-54.9	0	0	111.7	R1580 K1683 A1687 R1688 E1689 I1706	R1580-M1685 PolarHBondContact NH1-SD 3.34Å; K1683-M1685 VanDerWaalsContact C-N 3.32Å; K1683-M1685 PolarHBondContact O-N 3.17Å; M1685-A1687 PolarHBondContact O-N 2.83Å; M1685-A1687 VanDerWaalsContact O-N 3.15Å; M1685-R1688 PolarHBondContact O-N 2.69Å; M1685-E1689 PolarHBondContact O-N 3.21Å; M1685-I1706 HydrophobicContact CE-CD1 3.84Å; M1685-I1706 HydrophobicContact CE-CG1 4.3Å; M1685-I1706 HydrophobicContact SD-CD1 4.23Å
1686	G	49.6	Very low	56.2	Low	39 Å²	39	105.9 Å²	105.9	40%	0.402	54%	0.538	S	S	.	.	H	α-helix	trans	-64.5	-19	-179.5	0	0	0	0	0	114.6
1687	A	47.3	Very low	53.5	Low	61 Å²	61	103.6 Å²	103.6	50%	0.504	54%	0.538	S	S	.	.	H	α-helix	trans	-79.1	-35.7	171.3	0	0	0	0	0	112.8	M1685	M1685-A1687 PolarHBondContact O-N 2.83Å; M1685-A1687 VanDerWaalsContact O-N 3.15Å
1688	R	41.6	Very low	50.9	Low	204 Å²	204	109.6 Å²	109.6	77%	0.77	58%	0.577	S	S	*	*	H	α-helix	trans	-69.1	-38.8	178.7	-86.1	-175.3	165.1	178.7	-4.8	112.4	S1684 M1685 Q1690 N1691 S1692	S1684-R1688 PolarHBondContact O-N 3.46Å; M1685-R1688 PolarHBondContact O-N 2.69Å; R1688-Q1690 PolarHBondContact O-N 3.45Å; R1688-Q1690 VanDerWaalsContact O-N 3.1Å; R1688-N1691 PolarHBondContact O-N 2.98Å; R1688-N1691 VanDerWaalsContact O-N 3.08Å; R1688-S1692 PolarHBondContact O-N 2.98Å; R1688-S1692 VanDerWaalsContact O-N 3.09Å; R1688-S1692 PolarHBondContact O-OG 2.97Å
1689	E	42.5	Very low	48.5	Very low	123 Å²	123	113.7 Å²	113.7	58%	0.575	61%	0.606	S	S	*	*	H	α-helix	trans	-59.7	-21.3	178.6	-67.6	-169.5	139.7	0	0	114.5	M1685	M1685-E1689 PolarHBondContact O-N 3.21Å
1690	Q	46.2	Very low	46.5	Very low	162 Å²	162	117.2 Å²	117.2	76%	0.757	63%	0.633	S	S	*	*	H	α-helix	trans	-83.3	-26.6	177	-64.6	-165.6	0.6	0	0	113.5	R1688	R1688-Q1690 PolarHBondContact O-N 3.45Å; R1688-Q1690 VanDerWaalsContact O-N 3.1Å
1691	N	42.3	Very low	44.8	Very low	143 Å²	143	118.9 Å²	118.9	77%	0.765	63%	0.633	S	S	*	*	H	α-helix	trans	-98.5	-26.9	-177	-74.1	-1.1	0	0	0	113.4	R1688 K1693	R1688-N1691 PolarHBondContact O-N 2.98Å; R1688-N1691 VanDerWaalsContact O-N 3.08Å; N1691-K1693 VanDerWaalsContact C-N 3.26Å; N1691-K1693 PolarHBondContact O-N 3.28Å
1692	S	36.9	Very low	43.7	Very low	93 Å²	93	122.2 Å²	122.2	65%	0.65	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	68.4	179.8	63.8	0	0	0	0	112.5	R1688	R1688-S1692 PolarHBondContact O-N 2.98Å; R1688-S1692 VanDerWaalsContact O-N 3.09Å; R1688-S1692 PolarHBondContact O-OG 2.97Å
1693	K	37.8	Very low	43.4	Very low	189 Å²	189	121.3 Å²	121.3	82%	0.822	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.5	-5.6	173.7	-102.5	-175.1	177.8	177.8	0	115.8	N1691	N1691-K1693 VanDerWaalsContact C-N 3.26Å; N1691-K1693 PolarHBondContact O-N 3.28Å
1694	E	36.6	Very low	43.5	Very low	185 Å²	185	114.7 Å²	114.7	86%	0.864	63%	0.628	S	S	*	*	S	Bend	trans	-131.8	73.7	175.7	-66.3	-173.1	154.5	0	0	110
1695	E	34.7	Very low	44.5	Very low	176 Å²	176	112.8 Å²	112.8	82%	0.822	61%	0.613	S	S	*	*			trans	-171.5	129.3	148.5	-109.4	165.9	-158.3	0	0	110.4	I1697	E1695-I1697 PolarHBondContact O-N 2.9Å
1696	N	33	Very low	46.1	Very low	179 Å²	179	110.9 Å²	110.9	96%	0.957	60%	0.604	S	S	*	*			trans	-87.7	89.4	-178.6	-81.3	-30.2	0	0	0	110.8
1697	I	31.3	Very low	48	Very low	133 Å²	133	109 Å²	109	68%	0.682	59%	0.585	S	S	*	*			trans	-122.1	126.9	167.4	-61	-178.7	0	0	0	109.6	E1695 S1699	E1695-I1697 PolarHBondContact O-N 2.9Å; I1697-S1699 PolarHBondContact O-N 2.81Å; I1697-S1699 VanDerWaalsContact O-N 3.13Å
1698	T	32.4	Very low	50	Low	151 Å²	151	106.2 Å²	106.2	93%	0.926	56%	0.562	S	S	*	*			trans	-82.6	84.5	-175.4	48.3	0	0	0	0	111.9
1699	S	36.2	Very low	52.4	Low	87 Å²	87	96.5 Å²	96.5	61%	0.608	53%	0.525	S	S	*	.			trans	-141	88.9	170	59.8	0	0	0	0	111.2	I1697 Q1701	I1697-S1699 PolarHBondContact O-N 2.81Å; I1697-S1699 VanDerWaalsContact O-N 3.13Å; S1699-Q1701 PolarHBondContact O-N 3.34Å
1700	S	40.3	Very low	54.7	Low	129 Å²	129	90.7 Å²	90.7	90%	0.902	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	13.3	-170.3	55.1	0	0	0	0	115.9
1701	Q	43.7	Very low	56.5	Low	110 Å²	110	83.6 Å²	83.6	51%	0.514	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-1.2	-176.6	-63	-169.4	9.5	0	0	114.8	R1580 E1651 S1699 A1703	R1580-Q1701 PolarHBondContact NH2-O 3.04Å; E1651-Q1701 PolarHBondContact OE2-NE2 2.84Å; E1651-Q1701 VanDerWaalsContact OE2-NE2 3.09Å; E1651-Q1701 PolarHBondContact OE2-OE1 3.44Å; S1699-Q1701 PolarHBondContact O-N 3.34Å; Q1701-A1703 VanDerWaalsContact C-N 3.26Å; Q1701-A1703 PolarHBondContact O-N 3.4Å; Q1701-A1703 VanDerWaalsContact O-N 3.09Å
1702	S	49	Very low	58.3	Low	86 Å²	86	77 Å²	77	60%	0.601	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.4	-164.5	62.5	0	0	0	0	115.7	R1580	R1580-S1702 PolarHBondContact NH1-O 2.59Å; R1580-S1702 PolarHBondContact NH2-O 3.22Å
1703	A	58.7	Low	59.5	Low	26 Å²	26	73.7 Å²	73.7	22%	0.215	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	13.8	-162.6	0	0	0	0	0	116.1	V1429 Q1701	V1429-A1703 HydrophobicContact CG1-CB 3.83Å; V1429-A1703 WeakPolarHBondContact CG1-O 3.39Å; V1429-A1703 HydrophobicContact CG2-CB 4.21Å; Q1701-A1703 VanDerWaalsContact C-N 3.26Å; Q1701-A1703 PolarHBondContact O-N 3.4Å; Q1701-A1703 VanDerWaalsContact O-N 3.09Å
1704	A	68.8	Low	60.2	Low	18 Å²	18	68 Å²	68	15%	0.149	39%	0.385	C	S	.	.			trans	-66.2	139.6	-179.2	0	0	0	0	0	113.3	R1580	R1580-A1704 HydrophobicContact CG-CB 4.17Å
1705	P	76.9	Confident	60.6	Low	20 Å²	20	61.8 Å²	61.8	13%	0.13	36%	0.362	C	S	.	.			trans	-69.6	158.6	178.7	25.5	-30.6	0	0	0	113.2	L1420 P1430 L1432 L1579 R1580	L1420-P1705 HydrophobicContact CD1-CG 3.76Å; P1430-P1705 HydrophobicContact CB-CG 4.36Å; L1432-P1705 HydrophobicContact CB-CB 3.91Å; L1432-P1705 HydrophobicContact CB-CG 4.35Å; L1432-P1705 HydrophobicContact CD2-CB 4.45Å; L1579-P1705 HydrophobicContact CD2-CG 4.09Å; R1580-P1705 PolarHBondContact N-O 3.25Å
1706	I	82.9	Confident	61	Low	15 Å²	15	58 Å²	58	8%	0.077	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	137.6	-168	-59.2	171.1	0	0	0	111.5	R1580 L1582 W1612 M1685	R1580-I1706 HydrophobicContact CB-CG1 4.17Å; R1580-I1706 CarbonylContact O-C 3.53Å; R1580-I1706 WeakPolarHBondContact O-CA 3.05Å; L1582-I1706 HydrophobicContact CB-CG2 4.03Å; W1612-I1706 HydrophobicContact CH2-CD1 4.39Å; W1612-I1706 HydrophobicContact CH2-CG1 4.33Å; W1612-I1706 HydrophobicContact CH2-CG2 4.27Å; W1612-I1706 HydrophobicContact CZ2-CD1 4.06Å; W1612-I1706 HydrophobicContact CZ2-CG1 4.42Å; M1685-I1706 HydrophobicContact CE-CD1 3.84Å; M1685-I1706 HydrophobicContact CE-CG1 4.3Å; M1685-I1706 HydrophobicContact SD-CD1 4.23Å
1707	V	88.4	Confident	61.3	Low	0 Å²	0	55.1 Å²	55.1	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	147.1	172.8	-177	0	0	0	0	109.6	I1403 L1579 R1580 L1582 P1752 I1754	I1403-V1707 HydrophobicContact CD1-CG2 4.14Å; L1579-V1707 HydrophobicContact CB-CG2 4.2Å; L1579-V1707 HydrophobicContact CD1-CG2 3.97Å; L1579-V1707 HydrophobicContact CD2-CG2 3.92Å; L1579-V1707 HydrophobicContact CG-CG2 4.25Å; R1580-V1707 PolarHBondContact O-N 3.38Å; L1582-V1707 PolarHBondContact N-O 3.21Å; V1707-P1752 HydrophobicContact CB-CG 4.27Å; V1707-P1752 HydrophobicContact CG1-CB 4.29Å; V1707-P1752 HydrophobicContact CG1-CG 4.08Å; V1707-P1752 HydrophobicContact CG2-CG 3.86Å; V1707-I1754 HydrophobicContact CG1-CD1 3.79Å; V1707-I1754 HydrophobicContact CG1-CG1 3.96Å
1708	I	90.6	Very high	61.6	Low	1 Å²	1	56.3 Å²	56.3	1%	0.005	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.8	178.7	-53.3	-174.5	0	0	0	109.7	L1582 L1584 L1748 F1751 P1752 V1753 I1754	L1582-I1708 HydrophobicContact CD2-CG1 4.19Å; L1582-I1708 HydrophobicContact CD2-CG2 4.06Å; L1582-I1708 CarbonylContact O-C 3.57Å; L1582-I1708 WeakPolarHBondContact O-CA 3.1Å; L1584-I1708 HydrophobicContact CB-CG2 4.04Å; L1584-I1708 HydrophobicContact CD2-CG2 4.4Å; I1708-L1748 HydrophobicContact CD1-CD2 3.54Å; I1708-L1748 HydrophobicContact CG2-CD2 4.33Å; I1708-F1751 HydrophobicContact CD1-CB 3.78Å; I1708-F1751 HydrophobicContact CD1-CD2 4.01Å; I1708-F1751 HydrophobicContact CD1-CG 3.91Å; I1708-F1751 HydrophobicContact CG1-CB 4.02Å; I1708-F1751 HydrophobicContact CG1-CG 4.32Å; I1708-P1752 PolarHBondContact N-O 3.17Å; I1708-P1752 VanDerWaalsContact N-O 3.09Å; I1708-V1753 HydrophobicContact CB-CG2 4.39Å; I1708-V1753 WeakPolarHBondContact O-CA 3.43Å; I1708-I1754 PolarHBondContact O-N 3.22Å
1709	L	91.7	Very high	61.7	Low	0 Å²	0	57.2 Å²	57.2	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	112.6	168.8	-57.3	-173	0	0	0	108.4	H1581 L1582 F1583 L1584 I1754 L1756 L1801	H1581-L1709 HydrophobicContact CB-CD1 3.74Å; H1581-L1709 HydrophobicContact CB-CG 4Å; L1582-L1709 PolarHBondContact O-N 2.9Å; F1583-L1709 HydrophobicContact CD2-CB 4.29Å; L1584-L1709 PolarHBondContact N-O 3.23Å; L1709-I1754 HydrophobicContact CD2-CB 3.97Å; L1709-I1754 HydrophobicContact CD2-CD1 4.18Å; L1709-L1756 HydrophobicContact CB-CD1 4.1Å; L1709-L1756 HydrophobicContact CB-CG 4.44Å; L1709-L1756 HydrophobicContact CD1-CD1 4.28Å; L1709-L1801 HydrophobicContact CD1-CD2 4.13Å; L1709-L1801 HydrophobicContact CD2-CD1 4Å; L1709-L1801 HydrophobicContact CD2-CD2 4.07Å
1710	L	89.7	Confident	62	Low	1 Å²	1	60.6 Å²	60.6	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	132.3	-175	177.2	60.8	0	0	0	111.3	L1584 R1739 P1743 V1753 I1754 Q1755 L1756	L1584-L1710 HydrophobicContact CB-CD1 4.45Å; L1584-L1710 HydrophobicContact CD2-CD1 4.14Å; L1584-L1710 HydrophobicContact CG-CD1 4.12Å; L1584-L1710 WeakPolarHBondContact O-CA 3.32Å; L1710-R1739 WeakPolarHBondContact CD2-O 3.24Å; L1710-P1743 HydrophobicContact CD1-CG 3.66Å; L1710-P1743 HydrophobicContact CD2-CG 4.12Å; L1710-V1753 HydrophobicContact CB-CG1 3.66Å; L1710-V1753 HydrophobicContact CD2-CG1 3.83Å; L1710-V1753 HydrophobicContact CG-CG1 4.4Å; L1710-I1754 PolarHBondContact N-O 2.74Å; L1710-Q1755 CarbonylContact O-C 3.53Å; L1710-Q1755 VanDerWaalsContact O-CA 3.29Å; L1710-Q1755 WeakPolarHBondContact O-CA 3.39Å; L1710-L1756 PolarHBondContact O-N 2.74Å
1711	H	85.1	Confident	61.9	Low	13 Å²	13	60.6 Å²	60.6	6%	0.06	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	125.8	157.8	-179.1	-74.6	0	0	0	108.8	L1584 F1585 H1586 L1756 Y1793	L1584-H1711 PolarHBondContact O-N 2.8Å; F1585-H1711 CarbonylContact C-O 3.57Å; F1585-H1711 WeakPolarHBondContact CA-O 3.39Å; F1585-H1711 HydrophobicContact CD2-CB 4.04Å; F1585-H1711 AromaticContact CD2-CE1 3Å; F1585-H1711 WeakPolarHBondContact CD2-CE1 3.24Å; F1585-H1711 AromaticContact CD2-CG 3.96Å; F1585-H1711 AromaticContact CD2-ND1 3.49Å; F1585-H1711 WeakPolarHBondContact CD2-ND1 2.94Å; F1585-H1711 AromaticContact CE2-CE1 3.03Å; F1585-H1711 WeakPolarHBondContact CE2-CE1 3.46Å; F1585-H1711 AromaticContact CE2-ND1 3.47Å; F1585-H1711 WeakPolarHBondContact CE2-ND1 3.49Å; F1585-H1711 AromaticContact CG-CE1 3.99Å; H1586-H1711 PolarHBondContact N-O 2.75Å; H1711-L1756 PolarHBondContact CD2-O 3.48Å; H1711-Y1793 AromaticContact CD2-CD1 3.32Å; H1711-Y1793 WeakPolarHBondContact CD2-CD1 3.41Å; H1711-Y1793 AromaticContact CD2-CE1 3.23Å; H1711-Y1793 WeakPolarHBondContact CD2-CE1 3.24Å; H1711-Y1793 AromaticContact CG-CD1 3.87Å
1712	S	78.8	Confident	61.7	Low	5 Å²	5	60.7 Å²	60.7	4%	0.035	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	136.4	179.8	-166.7	0	0	0	0	110.6	H1586 N1742	H1586-S1712 PolarHBondContact ND1-OG 2.69Å; H1586-S1712 WeakPolarHBondContact O-CA 3.29Å; S1712-N1742 PolarHBondContact OG-O 3.42Å
1713	S	63	Low	61.5	Low	24 Å²	24	59.1 Å²	59.1	17%	0.168	35%	0.348	C	S	.	.			trans	-76.2	117.8	174.3	53.1	0	0	0	0	110.9	H1586 Q1588 S1715	H1586-S1713 PolarHBondContact O-N 3.09Å; Q1588-S1713 PolarHBondContact N-OG 3.13Å; S1713-S1715 PolarHBondContact O-N 3.18Å
1714	L	52.4	Low	60.9	Low	68 Å²	68	59.7 Å²	59.7	36%	0.356	36%	0.356	S	S	.	.			trans	-90.2	99.1	-177.5	-83.8	157.3	0	0	0	111.1	A1716 N1742 E1822	L1714-A1716 PolarHBondContact O-N 3.17Å; L1714-N1742 HydrophobicContact CD2-CB 4.49Å; L1714-E1822 PolarHBondContact N-OE1 3.45Å; L1714-E1822 VanDerWaalsContact N-OE1 3.08Å
1715	S	45.2	Very low	60.2	Low	55 Å²	55	65.2 Å²	65.2	39%	0.385	39%	0.39	S	S	.	.			trans	-65.5	106.2	171.7	56.6	0	0	0	0	110.4	S1713 T1717	S1713-S1715 PolarHBondContact O-N 3.18Å; S1715-T1717 PolarHBondContact O-N 3.23Å
1716	A	42.6	Very low	59.1	Low	97 Å²	97	67.1 Å²	67.1	80%	0.802	40%	0.4	S	S	*	.			trans	-69.7	30.4	-172.2	0	0	0	0	0	115.8	L1714 Q1718	L1714-A1716 PolarHBondContact O-N 3.17Å; A1716-Q1718 VanDerWaalsContact C-N 3.28Å; A1716-Q1718 PolarHBondContact O-N 3.11Å
1717	T	38.7	Very low	57.9	Low	119 Å²	119	69.7 Å²	69.7	73%	0.73	41%	0.411	S	S	*	.			trans	-87.9	67.6	168.4	57.5	0	0	0	0	109.7	S1715 Q1719	S1715-T1717 PolarHBondContact O-N 3.23Å; T1717-Q1719 PolarHBondContact O-N 3.17Å; T1717-Q1719 VanDerWaalsContact O-N 3.16Å
1718	Q	39.1	Very low	56.6	Low	157 Å²	157	71.5 Å²	71.5	73%	0.734	42%	0.423	S	S	*	.			trans	-64.6	112.3	166	-76	176.8	-53.2	0	0	108	A1716	A1716-Q1718 VanDerWaalsContact C-N 3.28Å; A1716-Q1718 PolarHBondContact O-N 3.11Å
1719	Q	34.4	Very low	55.4	Low	170 Å²	170	74.9 Å²	74.9	79%	0.794	44%	0.441	S	S	*	.			trans	-82.3	128.4	152.9	-64.3	-167.9	-70.3	0	0	106.2	T1717 I1721	T1717-Q1719 PolarHBondContact O-N 3.17Å; T1717-Q1719 VanDerWaalsContact O-N 3.16Å; Q1719-I1721 PolarHBondContact O-N 3.21Å
1720	D	41	Very low	54.6	Low	159 Å²	159	75.9 Å²	75.9	85%	0.85	44%	0.444	S	S	*	.			trans	-58.5	100.1	170.9	-61.6	-53.8	0	0	0	109.1	S1722	D1720-S1722 PolarHBondContact O-N 3.2Å; D1720-S1722 VanDerWaalsContact O-N 3.17Å
1721	I	39.8	Very low	53.7	Low	128 Å²	128	79 Å²	79	66%	0.656	46%	0.464	S	S	*	.			trans	-66.4	112.6	158.9	-59.7	176	0	0	0	103.5	Q1719 S1723	Q1719-I1721 PolarHBondContact O-N 3.21Å; I1721-S1723 VanDerWaalsContact C-N 3.32Å; I1721-S1723 PolarHBondContact O-N 3.25Å
1722	S	39.8	Very low	53.4	Low	112 Å²	112	78.7 Å²	78.7	78%	0.783	46%	0.463	S	S	*	.			trans	-61	94.5	-177.6	58.3	0	0	0	0	110.1	D1720	D1720-S1722 PolarHBondContact O-N 3.2Å; D1720-S1722 VanDerWaalsContact O-N 3.17Å
1723	S	44	Very low	53.4	Low	54 Å²	54	79.3 Å²	79.3	38%	0.378	47%	0.466	S	S	.	.			trans	-54.6	145.2	166	53.5	0	0	0	0	108.3	I1721	I1721-S1723 VanDerWaalsContact C-N 3.32Å; I1721-S1723 PolarHBondContact O-N 3.25Å
1724	G	46.4	Very low	53.9	Low	37 Å²	37	81.3 Å²	81.3	38%	0.381	48%	0.475	S	S	.	.			trans	-57.4	145.5	175.2	0	0	0	0	0	109.6	N1726 E1727	G1724-N1726 PolarHBondContact O-N 2.93Å; G1724-E1727 PolarHBondContact O-N 3.4Å
1725	P	52.7	Low	54.9	Low	134 Å²	134	80.3 Å²	80.3	87%	0.87	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-0.5	-175.3	26.3	-35.7	0	0	0	114.8
1726	N	55.1	Low	56.6	Low	61 Å²	61	77.8 Å²	77.8	33%	0.326	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-8.1	179.9	-49.5	-17.7	0	0	0	112.6	A1503 G1724	A1503-N1726 HydrophobicContact CB-CB 4.45Å; A1503-N1726 WeakPolarHBondContact CB-ND2 3.36Å; G1724-N1726 PolarHBondContact O-N 2.93Å
1727	E	58	Low	58.2	Low	68 Å²	68	74.6 Å²	74.6	32%	0.318	42%	0.42	S	S	.	.			trans	-87.3	116.1	-176.4	-169.7	165.9	-157.2	0	0	111	I1412 G1724 N1729	I1412-E1727 HydrophobicContact CD1-CB 4.42Å; G1724-E1727 PolarHBondContact O-N 3.4Å; E1727-N1729 PolarHBondContact O-N 2.84Å
1728	V	60.7	Low	59.9	Low	39 Å²	39	69.9 Å²	69.9	24%	0.236	40%	0.395	C	S	.	.			trans	-68	93	175.4	176.9	0	0	0	0	109	G1522 P1524	G1522-V1728 WeakPolarHBondContact O-CG1 3.39Å; P1524-V1728 HydrophobicContact CB-CG1 4.43Å; P1524-V1728 HydrophobicContact CG-CG1 4.02Å
1729	N	65.7	Low	61.7	Low	72 Å²	72	63.1 Å²	63.1	39%	0.385	36%	0.363	S	S	.	.			trans	-72.4	135.8	-173.9	-159.3	-1.8	0	0	0	111.4	E1727 D1734 S1869	E1727-N1729 PolarHBondContact O-N 2.84Å; N1729-D1734 PolarHBondContact OD1-OD2 2.83Å; N1729-S1869 WeakPolarHBondContact O-CB 2.99Å; N1729-S1869 PolarHBondContact O-OG 3.24Å
1730	W	73.4	Confident	63.7	Low	21 Å²	21	56.6 Å²	56.6	8%	0.08	33%	0.331	C	S	.	.			trans	-145.3	122.5	-178.4	-174.8	49.9	0	0	0	109.9	P1524 L1526 F1527 L1530 L1732 N1733 L1848 L2013	P1524-W1730 HydrophobicContact CB-CB 3.9Å; P1524-W1730 HydrophobicContact CB-CD2 4.17Å; P1524-W1730 HydrophobicContact CB-CE3 4.1Å; P1524-W1730 HydrophobicContact CB-CG 4.12Å; P1524-W1730 HydrophobicContact CG-CB 3.87Å; P1524-W1730 HydrophobicContact CG-CD2 4.22Å; P1524-W1730 HydrophobicContact CG-CG 3.9Å; L1526-W1730 HydrophobicContact CB-CE3 4.29Å; L1526-W1730 HydrophobicContact CB-CZ3 4.13Å; L1526-W1730 HydrophobicContact CD2-CE3 4.24Å; L1526-W1730 HydrophobicContact CD2-CZ3 3.93Å; L1526-W1730 HydrophobicContact CG-CE3 4.48Å; L1526-W1730 HydrophobicContact CG-CZ3 3.96Å; F1527-W1730 HydrophobicContact CB-CE3 4.43Å; F1527-W1730 HydrophobicContact CB-CH2 3.99Å; F1527-W1730 HydrophobicContact CB-CZ2 4.46Å; F1527-W1730 HydrophobicContact CB-CZ3 3.98Å; F1527-W1730 AromaticContact CD2-CH2 3.9Å; F1527-W1730 HydrophobicContact CD2-CH2 3.9Å; F1527-W1730 HydrophobicContact CD2-CZ2 4.04Å; F1527-W1730 HydrophobicContact CG-CH2 4.46Å; L1530-W1730 HydrophobicContact CD1-CH2 4.22Å; L1530-W1730 HydrophobicContact CD1-CZ3 4.3Å; W1730-L1732 VanDerWaalsContact C-N 3.26Å; W1730-L1732 HydrophobicContact CD2-CB 4.27Å; W1730-L1732 HydrophobicContact CE3-CB 4.07Å; W1730-L1732 HydrophobicContact CH2-CB 4.21Å; W1730-L1732 HydrophobicContact CH2-CD2 3.69Å; W1730-L1732 HydrophobicContact CZ2-CB 4.39Å; W1730-L1732 HydrophobicContact CZ2-CD2 4.35Å; W1730-L1732 HydrophobicContact CZ3-CB 4.04Å; W1730-L1732 HydrophobicContact CZ3-CD2 3.93Å; W1730-L1732 HydrophobicContact CZ3-CG 4.42Å; W1730-L1732 PolarHBondContact O-N 3.29Å; W1730-N1733 VanDerWaalsContact O-CB 3.28Å; W1730-N1733 WeakPolarHBondContact O-CB 3.41Å; W1730-N1733 PolarHBondContact O-N 2.69Å; W1730-L1848 HydrophobicContact CH2-CD1 3.8Å; W1730-L1848 HydrophobicContact CZ2-CD1 3.8Å; W1730-L2013 HydrophobicContact CZ2-CD1 3.9Å
1731	P	71.1	Confident	65.2	Low	65 Å²	65	55.3 Å²	55.3	42%	0.422	31%	0.314	S	S	.	.	H	α-helix	trans	-55.6	-30.9	-166	-31.2	36.4	0	0	0	116.4	N1733 D1734 E1735	P1731-N1733 VanDerWaalsContact C-N 3.26Å; P1731-N1733 PolarHBondContact O-N 3.17Å; P1731-D1734 PolarHBondContact O-N 2.8Å; P1731-E1735 PolarHBondContact O-N 3.32Å
1732	L	79	Confident	66.2	Low	8 Å²	8	50.5 Å²	50.5	4%	0.042	29%	0.29	C	S	.	.	H	α-helix	trans	-65.2	-30.1	178.3	-175.5	57.6	0	0	0	112.7	L1530 W1730 E1735 I1736 P1819 L1848	L1530-L1732 HydrophobicContact CD1-CD2 4.35Å; W1730-L1732 VanDerWaalsContact C-N 3.26Å; W1730-L1732 HydrophobicContact CD2-CB 4.27Å; W1730-L1732 HydrophobicContact CE3-CB 4.07Å; W1730-L1732 HydrophobicContact CH2-CB 4.21Å; W1730-L1732 HydrophobicContact CH2-CD2 3.69Å; W1730-L1732 HydrophobicContact CZ2-CB 4.39Å; W1730-L1732 HydrophobicContact CZ2-CD2 4.35Å; W1730-L1732 HydrophobicContact CZ3-CB 4.04Å; W1730-L1732 HydrophobicContact CZ3-CD2 3.93Å; W1730-L1732 HydrophobicContact CZ3-CG 4.42Å; W1730-L1732 PolarHBondContact O-N 3.29Å; L1732-E1735 HydrophobicContact CD1-CB 4.43Å; L1732-E1735 PolarHBondContact O-N 3.34Å; L1732-I1736 HydrophobicContact CD1-CD1 4.28Å; L1732-I1736 HydrophobicContact CD1-CG1 4.39Å; L1732-I1736 HydrophobicContact CG-CD1 4.01Å; L1732-I1736 VanDerWaalsContact O-CD1 3.31Å; L1732-I1736 WeakPolarHBondContact O-CD1 3.37Å; L1732-I1736 VanDerWaalsContact O-CG1 3.27Å; L1732-I1736 WeakPolarHBondContact O-CG1 3.3Å; L1732-I1736 PolarHBondContact O-N 2.98Å; L1732-P1819 HydrophobicContact CD1-CG 4.07Å; L1732-P1819 HydrophobicContact CD2-CG 4.33Å; L1732-L1848 HydrophobicContact CD2-CD2 3.98Å
1733	N	78.8	Confident	67.9	Low	18 Å²	18	45.2 Å²	45.2	10%	0.096	25%	0.253	C	S	.	.	H	α-helix	trans	-66.5	-46.6	177.1	-153.7	50.3	0	0	0	110.2	P1407 L1526 W1730 P1731 I1736 I1737	P1407-N1733 WeakPolarHBondContact CG-OD1 3.44Å; L1526-N1733 HydrophobicContact CD2-CB 4.38Å; W1730-N1733 VanDerWaalsContact O-CB 3.28Å; W1730-N1733 WeakPolarHBondContact O-CB 3.41Å; W1730-N1733 PolarHBondContact O-N 2.69Å; P1731-N1733 VanDerWaalsContact C-N 3.26Å; P1731-N1733 PolarHBondContact O-N 3.17Å; N1733-I1736 PolarHBondContact O-N 3.44Å; N1733-I1737 VanDerWaalsContact O-CG1 3.32Å; N1733-I1737 WeakPolarHBondContact O-CG1 3.26Å; N1733-I1737 PolarHBondContact O-N 3.24Å; N1733-I1737 VanDerWaalsContact O-N 3.11Å
1734	D	73.2	Confident	69.5	Low	66 Å²	66	46.6 Å²	46.6	35%	0.353	25%	0.253	S	S	.	.	H	α-helix	trans	-65.7	-37.4	173.1	-86.2	-34.4	0	0	0	112.8	N1729 P1731 G1738	N1729-D1734 PolarHBondContact OD1-OD2 2.83Å; P1731-D1734 PolarHBondContact O-N 2.8Å; D1734-G1738 WeakPolarHBondContact O-CA 3.42Å; D1734-G1738 PolarHBondContact O-N 3.44Å
1735	E	75	Confident	71.3	Confident	47 Å²	47	45 Å²	45	22%	0.22	24%	0.236	C	C	.	.	H	α-helix	trans	-59	-48.7	172.4	-80.6	-173	-146.7	0	0	111	P1731 L1732 I1737 G1738 R1739	P1731-E1735 PolarHBondContact O-N 3.32Å; L1732-E1735 HydrophobicContact CD1-CB 4.43Å; L1732-E1735 PolarHBondContact O-N 3.34Å; E1735-I1737 PolarHBondContact O-N 3.26Å; E1735-G1738 CarbonylContact O-C 3.55Å; E1735-G1738 PolarHBondContact O-N 3.3Å; E1735-R1739 WeakPolarHBondContact O-CB 3.25Å; E1735-R1739 WeakPolarHBondContact O-CG 3.41Å; E1735-R1739 PolarHBondContact O-N 3.23Å; E1735-R1739 IonicContact OE2-CZ 2.8Å; E1735-R1739 IonicContact OE2-NE 3.33Å; E1735-R1739 IonicContact OE2-NH2 3.47Å; E1735-R1739 PolarHBondContact OE2-NH2 2.75Å
1736	I	79.5	Confident	72.7	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-63.5	-44.1	-178.7	-66.7	156.1	0	0	0	111.4	L1526 L1732 N1733 G1738 R1740 N1817	L1526-I1736 HydrophobicContact CD2-CD1 3.63Å; L1732-I1736 HydrophobicContact CD1-CD1 4.28Å; L1732-I1736 HydrophobicContact CD1-CG1 4.39Å; L1732-I1736 HydrophobicContact CG-CD1 4.01Å; L1732-I1736 VanDerWaalsContact O-CD1 3.31Å; L1732-I1736 WeakPolarHBondContact O-CD1 3.37Å; L1732-I1736 VanDerWaalsContact O-CG1 3.27Å; L1732-I1736 WeakPolarHBondContact O-CG1 3.3Å; L1732-I1736 PolarHBondContact O-N 2.98Å; N1733-I1736 PolarHBondContact O-N 3.44Å; I1736-G1738 VanDerWaalsContact C-N 3.33Å; I1736-G1738 PolarHBondContact O-N 2.94Å; I1736-R1740 PolarHBondContact O-N 2.65Å; I1736-N1817 WeakPolarHBondContact CD1-ND2 3.48Å
1737	I	77	Confident	74	Confident	29 Å²	29	40.7 Å²	40.7	15%	0.149	21%	0.211	C	C	.	.	H	α-helix	trans	-62.8	-42.7	174.9	-66.4	168.1	0	0	0	110.4	P1407 N1733 E1735 R1740 R1741	P1407-I1737 HydrophobicContact CB-CD1 4.46Å; P1407-I1737 HydrophobicContact CG-CD1 3.78Å; P1407-I1737 HydrophobicContact CG-CG1 3.57Å; N1733-I1737 VanDerWaalsContact O-CG1 3.32Å; N1733-I1737 WeakPolarHBondContact O-CG1 3.26Å; N1733-I1737 PolarHBondContact O-N 3.24Å; N1733-I1737 VanDerWaalsContact O-N 3.11Å; E1735-I1737 PolarHBondContact O-N 3.26Å; I1737-R1740 PolarHBondContact O-N 2.72Å; I1737-R1741 HydrophobicContact CG2-CG 4.36Å; I1737-R1741 WeakPolarHBondContact O-CB 3.25Å; I1737-R1741 VanDerWaalsContact O-CG 3.29Å; I1737-R1741 WeakPolarHBondContact O-CG 3.32Å; I1737-R1741 PolarHBondContact O-N 2.7Å
1738	G	74.4	Confident	75.3	Confident	21 Å²	21	37.5 Å²	37.5	22%	0.216	20%	0.196	C	C	.	.	H	α-helix	trans	-62.4	-49.2	177.7	0	0	0	0	0	112.9	D1734 E1735 I1736 R1740 R1741 N1742	D1734-G1738 WeakPolarHBondContact O-CA 3.42Å; D1734-G1738 PolarHBondContact O-N 3.44Å; E1735-G1738 CarbonylContact O-C 3.55Å; E1735-G1738 PolarHBondContact O-N 3.3Å; I1736-G1738 VanDerWaalsContact C-N 3.33Å; I1736-G1738 PolarHBondContact O-N 2.94Å; G1738-R1740 VanDerWaalsContact C-N 3.27Å; G1738-R1740 PolarHBondContact O-N 2.94Å; G1738-R1741 CarbonylContact O-C 3.52Å; G1738-R1741 PolarHBondContact O-N 2.85Å; G1738-R1741 VanDerWaalsContact O-N 3.13Å; G1738-N1742 WeakPolarHBondContact O-CB 3.4Å; G1738-N1742 PolarHBondContact O-N 2.93Å
1739	R	76	Confident	76.1	Confident	15 Å²	15	40.2 Å²	40.2	6%	0.057	22%	0.217	C	C	.	.	H	α-helix	trans	-50.8	-46	175.7	-73.1	166.2	-160.3	-158.1	-3.5	111.6	L1710 E1735 P1743 Q1755 G1816 I1818	L1710-R1739 WeakPolarHBondContact CD2-O 3.24Å; E1735-R1739 WeakPolarHBondContact O-CB 3.25Å; E1735-R1739 WeakPolarHBondContact O-CG 3.41Å; E1735-R1739 PolarHBondContact O-N 3.23Å; E1735-R1739 IonicContact OE2-CZ 2.8Å; E1735-R1739 IonicContact OE2-NE 3.33Å; E1735-R1739 IonicContact OE2-NH2 3.47Å; E1735-R1739 PolarHBondContact OE2-NH2 2.75Å; R1739-P1743 WeakPolarHBondContact O-CD 3.1Å; R1739-Q1755 HydrophobicContact CG-CB 4.42Å; R1739-G1816 PolarHBondContact NH1-O 2.95Å; R1739-I1818 PolarHBondContact NH1-O 2.87Å; R1739-I1818 PolarHBondContact NH2-O 2.65Å
1740	R	77	Confident	76.7	Confident	32 Å²	32	38.8 Å²	38.8	12%	0.121	22%	0.22	C	C	.	.	H	α-helix	trans	-75.9	-34.5	179.5	-72.8	172.6	160.6	-81.9	-7.7	113.2	E1404 I1736 I1737 G1738 L1748 F1751	E1404-R1740 IonicContact OE1-CZ 3.51Å; E1404-R1740 VanDerWaalsContact OE1-CZ 3.3Å; E1404-R1740 IonicContact OE1-NE 3.99Å; E1404-R1740 PolarHBondContact OE1-NE 3.28Å; E1404-R1740 IonicContact OE1-NH2 3.43Å; E1404-R1740 PolarHBondContact OE1-NH2 2.86Å; E1404-R1740 IonicContact OE2-CZ 3.45Å; E1404-R1740 IonicContact OE2-NE 3.81Å; E1404-R1740 IonicContact OE2-NH2 2.76Å; E1404-R1740 PolarHBondContact OE2-NH2 2.81Å; I1736-R1740 PolarHBondContact O-N 2.65Å; I1737-R1740 PolarHBondContact O-N 2.72Å; G1738-R1740 VanDerWaalsContact C-N 3.27Å; G1738-R1740 PolarHBondContact O-N 2.94Å; R1740-L1748 PolarHBondContact NH1-O 3.33Å; R1740-F1751 PolarHBondContact NH1-O 3.05Å; R1740-F1751 PolarHBondContact NH2-O 3.41Å
1741	R	73.2	Confident	77.2	Confident	132 Å²	132	39.5 Å²	39.5	50%	0.498	22%	0.223	S	C	.	.	H	α-helix	trans	-74.8	-28.3	175.6	-75.1	178.8	-179	167.3	3.1	113.6	I1737 G1738 Q1744	I1737-R1741 HydrophobicContact CG2-CG 4.36Å; I1737-R1741 WeakPolarHBondContact O-CB 3.25Å; I1737-R1741 VanDerWaalsContact O-CG 3.29Å; I1737-R1741 WeakPolarHBondContact O-CG 3.32Å; I1737-R1741 PolarHBondContact O-N 2.7Å; G1738-R1741 CarbonylContact O-C 3.52Å; G1738-R1741 PolarHBondContact O-N 2.85Å; G1738-R1741 VanDerWaalsContact O-N 3.13Å; R1741-Q1744 VanDerWaalsContact O-CA 3.25Å; R1741-Q1744 WeakPolarHBondContact O-CA 3.47Å; R1741-Q1744 WeakPolarHBondContact O-CG 3.47Å; R1741-Q1744 PolarHBondContact O-N 2.92Å
1742	N	60.2	Low	78	Confident	28 Å²	28	36.4 Å²	36.4	15%	0.15	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	47.4	-166.7	-159.8	37.3	0	0	0	113.2	S1712 L1714 G1738	S1712-N1742 PolarHBondContact OG-O 3.42Å; L1714-N1742 HydrophobicContact CD2-CB 4.49Å; G1738-N1742 WeakPolarHBondContact O-CB 3.4Å; G1738-N1742 PolarHBondContact O-N 2.93Å
1743	P	76.3	Confident	78.5	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.006	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn		-114.7	11	112.8	-14.2	32	0	0	0	115.3	H1586 Y1606 L1710 R1739 L1745 L1748	H1586-P1743 HydrophobicContact CB-CB 4.04Å; H1586-P1743 HydrophobicContact CB-CG 4.14Å; Y1606-P1743 HydrophobicContact CE1-CB 3.74Å; Y1606-P1743 WeakPolarHBondContact CE1-O 3.29Å; Y1606-P1743 PolarHBondContact OH-O 3Å; L1710-P1743 HydrophobicContact CD1-CG 3.66Å; L1710-P1743 HydrophobicContact CD2-CG 4.12Å; R1739-P1743 WeakPolarHBondContact O-CD 3.1Å; P1743-L1745 VanDerWaalsContact C-N 3.28Å; P1743-L1745 HydrophobicContact CB-CD1 4.19Å; P1743-L1745 HydrophobicContact CB-CG 4.29Å; P1743-L1745 PolarHBondContact O-N 2.81Å; P1743-L1748 HydrophobicContact CG-CD1 4.01Å
1744	Q	77.6	Confident	79	Confident	82 Å²	82	35.6 Å²	35.6	38%	0.383	20%	0.199	S	C	.	.			trans	53.1	37.7	-176.1	-58.2	-166.3	48.6	0	0	114.6	D1600 R1741 P1746	D1600-Q1744 PolarHBondContact OD1-NE2 2.84Å; R1741-Q1744 VanDerWaalsContact O-CA 3.25Å; R1741-Q1744 WeakPolarHBondContact O-CA 3.47Å; R1741-Q1744 WeakPolarHBondContact O-CG 3.47Å; R1741-Q1744 PolarHBondContact O-N 2.92Å; Q1744-P1746 WeakPolarHBondContact O-CD 3.47Å
1745	L	84.5	Confident	79.5	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.021	19%	0.186	C	C	.	.			trans	-109.1	103.1	179	-71	174.6	0	0	0	110.6	L1584 Y1606 R1671 V1674 P1743 V1747 L1748	L1584-L1745 HydrophobicContact CD2-CD1 3.89Å; Y1606-L1745 HydrophobicContact CD1-CD1 4.03Å; Y1606-L1745 HydrophobicContact CE1-CD1 3.81Å; Y1606-L1745 HydrophobicContact CE1-CD2 4.24Å; Y1606-L1745 HydrophobicContact CE1-CG 3.93Å; R1671-L1745 HydrophobicContact CB-CD2 3.94Å; R1671-L1745 HydrophobicContact CG-CD2 4.16Å; R1671-L1745 WeakPolarHBondContact O-CD2 3.23Å; V1674-L1745 HydrophobicContact CB-CD1 4.49Å; V1674-L1745 HydrophobicContact CB-CD2 4.05Å; V1674-L1745 HydrophobicContact CG1-CD1 3.7Å; V1674-L1745 HydrophobicContact CG1-CD2 4.13Å; P1743-L1745 VanDerWaalsContact C-N 3.28Å; P1743-L1745 HydrophobicContact CB-CD1 4.19Å; P1743-L1745 HydrophobicContact CB-CG 4.29Å; P1743-L1745 PolarHBondContact O-N 2.81Å; L1745-V1747 HydrophobicContact CB-CG1 4.24Å; L1745-V1747 PolarHBondContact O-N 3.43Å; L1745-L1748 HydrophobicContact CB-CD1 4Å; L1745-L1748 HydrophobicContact CB-CG 3.92Å; L1745-L1748 WeakPolarHBondContact O-CB 3.49Å; L1745-L1748 WeakPolarHBondContact O-CG 3.5Å; L1745-L1748 PolarHBondContact O-N 3Å
1746	P	81.5	Confident	79.8	Confident	87 Å²	87	31.1 Å²	31.1	57%	0.565	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-59.5	-22.7	-177	-26.4	35.5	0	0	0	114.5	Q1744 L1748 S1749	Q1744-P1746 WeakPolarHBondContact O-CD 3.47Å; P1746-L1748 PolarHBondContact O-N 3.22Å; P1746-S1749 PolarHBondContact O-N 3.29Å; P1746-S1749 PolarHBondContact O-OG 2.84Å
1747	V	82.9	Confident	79.1	Confident	18 Å²	18	32 Å²	32	11%	0.109	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-63.4	-23.2	176.1	61.5	0	0	0	0	113.3	Q1675 I1678 L1745 S1749 G1750 F1751	Q1675-V1747 HydrophobicContact CB-CG1 4.21Å; Q1675-V1747 HydrophobicContact CG-CB 4.03Å; Q1675-V1747 HydrophobicContact CG-CG1 4.16Å; I1678-V1747 HydrophobicContact CB-CG1 4.39Å; I1678-V1747 HydrophobicContact CB-CG2 4.34Å; I1678-V1747 HydrophobicContact CD1-CG1 3.94Å; I1678-V1747 HydrophobicContact CG2-CG1 4.32Å; I1678-V1747 HydrophobicContact CG2-CG2 3.73Å; L1745-V1747 HydrophobicContact CB-CG1 4.24Å; L1745-V1747 PolarHBondContact O-N 3.43Å; V1747-S1749 PolarHBondContact O-N 3.28Å; V1747-G1750 PolarHBondContact O-N 3.28Å; V1747-F1751 HydrophobicContact CG2-CD2 4.32Å; V1747-F1751 HydrophobicContact CG2-CE2 3.77Å; V1747-F1751 WeakPolarHBondContact O-CD2 3.36Å
1748	L	84.6	Confident	78	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-64.5	-21.1	178.7	-61.6	178.1	0	0	0	113	L1584 I1708 R1740 P1743 L1745 P1746 G1750 F1751 V1753	L1584-L1748 HydrophobicContact CD2-CD2 4.09Å; I1708-L1748 HydrophobicContact CD1-CD2 3.54Å; I1708-L1748 HydrophobicContact CG2-CD2 4.33Å; R1740-L1748 PolarHBondContact NH1-O 3.33Å; P1743-L1748 HydrophobicContact CG-CD1 4.01Å; L1745-L1748 HydrophobicContact CB-CD1 4Å; L1745-L1748 HydrophobicContact CB-CG 3.92Å; L1745-L1748 WeakPolarHBondContact O-CB 3.49Å; L1745-L1748 WeakPolarHBondContact O-CG 3.5Å; L1745-L1748 PolarHBondContact O-N 3Å; P1746-L1748 PolarHBondContact O-N 3.22Å; L1748-G1750 PolarHBondContact O-N 3.14Å; L1748-F1751 PolarHBondContact O-N 2.98Å; L1748-F1751 VanDerWaalsContact O-O 3.11Å; L1748-V1753 HydrophobicContact CB-CG2 4.38Å; L1748-V1753 HydrophobicContact CD2-CG2 4.41Å
1749	S	78.3	Confident	76.8	Confident	95 Å²	95	33.3 Å²	33.3	66%	0.664	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-68.6	-17.7	172.5	66.8	0	0	0	0	113.5	W1418 P1746 V1747	W1418-S1749 WeakPolarHBondContact CZ2-O 3.43Å; P1746-S1749 PolarHBondContact O-N 3.29Å; P1746-S1749 PolarHBondContact O-OG 2.84Å; V1747-S1749 PolarHBondContact O-N 3.28Å
1750	G	77.4	Confident	75.1	Confident	43 Å²	43	35.3 Å²	35.3	44%	0.443	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-90.8	6.8	178.8	0	0	0	0	0	115.3	W1418 V1747 L1748	W1418-G1750 VanDerWaalsContact CH2-C 3.42Å; W1418-G1750 WeakPolarHBondContact CH2-O 3.24Å; V1747-G1750 PolarHBondContact O-N 3.28Å; L1748-G1750 PolarHBondContact O-N 3.14Å
1751	F	84.1	Confident	73.5	Confident	35 Å²	35	38.7 Å²	38.7	15%	0.154	23%	0.227	C	C	.	.	S	Bend	trans	-143	156.3	-177.7	-62.5	-87.9	0	0	0	111.6	I1678 C1682 I1708 R1740 V1747 L1748	I1678-F1751 HydrophobicContact CG2-CE2 4.11Å; I1678-F1751 HydrophobicContact CG2-CZ 4.48Å; C1682-F1751 VanDerWaalsContact SG-CZ 3.51Å; I1708-F1751 HydrophobicContact CD1-CB 3.78Å; I1708-F1751 HydrophobicContact CD1-CD2 4.01Å; I1708-F1751 HydrophobicContact CD1-CG 3.91Å; I1708-F1751 HydrophobicContact CG1-CB 4.02Å; I1708-F1751 HydrophobicContact CG1-CG 4.32Å; R1740-F1751 PolarHBondContact NH1-O 3.05Å; R1740-F1751 PolarHBondContact NH2-O 3.41Å; V1747-F1751 HydrophobicContact CG2-CD2 4.32Å; V1747-F1751 HydrophobicContact CG2-CE2 3.77Å; V1747-F1751 WeakPolarHBondContact O-CD2 3.36Å; L1748-F1751 PolarHBondContact O-N 2.98Å; L1748-F1751 VanDerWaalsContact O-O 3.11Å
1752	P	87.5	Confident	71.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.226	C	C	.	.			trans	-69.3	142.6	160	30	-33.3	0	0	0	110.7	I1403 E1404 W1418 L1432 V1707 I1708	I1403-P1752 HydrophobicContact CB-CB 4.4Å; I1403-P1752 HydrophobicContact CD1-CG 4.46Å; I1403-P1752 HydrophobicContact CG2-CB 3.98Å; E1404-P1752 WeakPolarHBondContact OE2-CA 3.28Å; W1418-P1752 HydrophobicContact CB-CB 3.93Å; W1418-P1752 HydrophobicContact CD2-CB 4.22Å; W1418-P1752 HydrophobicContact CE3-CG 4.45Å; W1418-P1752 HydrophobicContact CG-CB 3.88Å; L1432-P1752 HydrophobicContact CD2-CG 3.9Å; V1707-P1752 HydrophobicContact CB-CG 4.27Å; V1707-P1752 HydrophobicContact CG1-CB 4.29Å; V1707-P1752 HydrophobicContact CG1-CG 4.08Å; V1707-P1752 HydrophobicContact CG2-CG 3.86Å; I1708-P1752 PolarHBondContact N-O 3.17Å; I1708-P1752 VanDerWaalsContact N-O 3.09Å
1753	V	88.6	Confident	70.8	Confident	6 Å²	6	39 Å²	39	4%	0.036	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	120.6	-175.8	-176.5	0	0	0	0	109.2	E1404 I1708 L1710 L1748	E1404-V1753 PolarHBondContact OE2-N 3.31Å; I1708-V1753 HydrophobicContact CB-CG2 4.39Å; I1708-V1753 WeakPolarHBondContact O-CA 3.43Å; L1710-V1753 HydrophobicContact CB-CG1 3.66Å; L1710-V1753 HydrophobicContact CD2-CG1 3.83Å; L1710-V1753 HydrophobicContact CG-CG1 4.4Å; L1748-V1753 HydrophobicContact CB-CG2 4.38Å; L1748-V1753 HydrophobicContact CD2-CG2 4.41Å
1754	I	89.5	Confident	68.7	Low	4 Å²	4	44 Å²	44	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	121.3	175.4	-55.6	172.2	0	0	0	107.7	I1403 V1707 I1708 L1709 L1710 L1801 V1815	I1403-I1754 HydrophobicContact CG2-CD1 4.23Å; I1403-I1754 HydrophobicContact CG2-CG1 4.38Å; V1707-I1754 HydrophobicContact CG1-CD1 3.79Å; V1707-I1754 HydrophobicContact CG1-CG1 3.96Å; I1708-I1754 PolarHBondContact O-N 3.22Å; L1709-I1754 HydrophobicContact CD2-CB 3.97Å; L1709-I1754 HydrophobicContact CD2-CD1 4.18Å; L1710-I1754 PolarHBondContact N-O 2.74Å; I1754-L1801 HydrophobicContact CD1-CD1 3.8Å; I1754-L1801 HydrophobicContact CG2-CD1 4.08Å; I1754-V1815 HydrophobicContact CD1-CG1 3.57Å; I1754-V1815 HydrophobicContact CD1-CG2 4.48Å; I1754-V1815 HydrophobicContact CG1-CG1 4.09Å; I1754-V1815 HydrophobicContact CG2-CG2 4.13Å
1755	Q	85.4	Confident	66.4	Low	17 Å²	17	45.7 Å²	45.7	8%	0.079	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	124.2	177.2	-171.1	-170.3	3.6	0	0	110.9	L1710 R1739 Q1804 V1820	L1710-Q1755 CarbonylContact O-C 3.53Å; L1710-Q1755 VanDerWaalsContact O-CA 3.29Å; L1710-Q1755 WeakPolarHBondContact O-CA 3.39Å; R1739-Q1755 HydrophobicContact CG-CB 4.42Å; Q1755-Q1804 PolarHBondContact O-NE2 2.7Å; Q1755-Q1804 PolarHBondContact O-OE1 2.93Å; Q1755-V1820 HydrophobicContact CB-CG2 3.97Å; Q1755-V1820 VanDerWaalsContact CD-CG2 3.48Å; Q1755-V1820 HydrophobicContact CG-CG2 3.86Å
1756	L	80.3	Confident	63.7	Low	2 Å²	2	53.6 Å²	53.6	1%	0.01	33%	0.331	C	S	.	.			trans	-91.3	135.8	173.1	-54.9	-177.3	0	0	0	110.3	F1583 L1709 L1710 H1711 R1800 L1801	F1583-L1756 HydrophobicContact CE2-CD1 4.36Å; L1709-L1756 HydrophobicContact CB-CD1 4.1Å; L1709-L1756 HydrophobicContact CB-CG 4.44Å; L1709-L1756 HydrophobicContact CD1-CD1 4.28Å; L1710-L1756 PolarHBondContact O-N 2.74Å; H1711-L1756 PolarHBondContact CD2-O 3.48Å; L1756-R1800 HydrophobicContact CD1-CB 4.44Å; L1756-R1800 HydrophobicContact CD2-CB 4.15Å; L1756-L1801 HydrophobicContact CD2-CB 4.35Å
1757	G	64.2	Low	61.1	Low	19 Å²	19	58.3 Å²	58.3	20%	0.196	35%	0.35	C	S	.	.			trans	-121	-173.8	-175.2	0	0	0	0	0	115.5	R1800	G1757-R1800 WeakPolarHBondContact O-CD 3.29Å; G1757-R1800 PolarHBondContact O-NE 3.06Å
1758	G	55	Low	58.4	Low	24 Å²	24	60.1 Å²	60.1	25%	0.247	37%	0.372	C	S	.	.			trans	81.7	157	174.5	0	0	0	0	0	115.9	Y1793 R1800 S1821	G1758-Y1793 VanDerWaalsContact O-CE1 3.29Å; G1758-Y1793 WeakPolarHBondContact O-CE1 3.37Å; G1758-Y1793 PolarHBondContact O-OH 3.14Å; G1758-R1800 PolarHBondContact O-NH2 2.87Å; G1758-S1821 PolarHBondContact N-O 2.74Å; G1758-S1821 VanDerWaalsContact N-O 3.11Å
1759	T	49.8	Very low	55.7	Low	55 Å²	55	68 Å²	68	34%	0.337	42%	0.415	S	S	.	.			trans	-130.9	114.9	-173.6	22.4	0	0	0	0	110.3	R1789 Y1793 A1823	T1759-R1789 VanDerWaalsContact CG2-NH2 3.32Å; T1759-Y1793 WeakPolarHBondContact CG2-OH 3.18Å; T1759-A1823 WeakPolarHBondContact OG1-CB 3.24Å; T1759-A1823 PolarHBondContact OG1-O 2.88Å
1760	M	39	Very low	53.1	Low	57 Å²	57	71.3 Å²	71.3	28%	0.281	42%	0.424	S	S	.	.			trans	-128.3	88.7	168.5	-76.9	-172.2	80.5	0	0	109	E1762 P1839	M1760-E1762 HydrophobicContact CE-CG 4.45Å; M1760-P1839 HydrophobicContact SD-CB 4.21Å; M1760-P1839 HydrophobicContact SD-CG 4.38Å
1761	D	44.2	Very low	50.7	Low	103 Å²	103	78 Å²	78	55%	0.551	44%	0.443	S	S	*	.			trans	-96.5	73.9	166.9	-82.7	-48.3	0	0	0	110	G1763 R1792	D1761-G1763 PolarHBondContact O-N 2.72Å; D1761-R1792 IonicContact OD1-CZ 2.62Å; D1761-R1792 IonicContact OD1-NH1 3.04Å; D1761-R1792 PolarHBondContact OD1-NH1 3.34Å
1762	E	37.6	Very low	47.9	Very low	102 Å²	102	87.7 Å²	87.7	48%	0.477	48%	0.481	S	S	.	.			trans	-58.8	127.3	165.4	-67.5	-174.7	162.6	0	0	109.3	M1760 R1792	M1760-E1762 HydrophobicContact CE-CG 4.45Å; E1762-R1792 PolarHBondContact O-NH2 3.11Å; E1762-R1792 VanDerWaalsContact O-NH2 3.09Å
1763	G	38.5	Very low	45.1	Very low	65 Å²	65	92 Å²	92	67%	0.67	51%	0.51	S	S	*	.			trans	-69.4	150.7	-177.7	0	0	0	0	0	112.7	D1761 S1765	D1761-G1763 PolarHBondContact O-N 2.72Å; G1763-S1765 PolarHBondContact O-N 3.06Å
1764	E	32.5	Very low	42.4	Very low	105 Å²	105	99.1 Å²	99.1	49%	0.491	56%	0.555	S	S	.	*			trans	-83.4	87.3	-173	-60.9	-168.5	112.6	0	0	111.2	K1642 Q1766 K1788	K1642-E1764 IonicContact NZ-OE1 2.79Å; K1642-E1764 PolarHBondContact NZ-OE1 2.87Å; E1764-Q1766 PolarHBondContact O-N 2.91Å; E1764-K1788 VanDerWaalsContact CD-NZ 3.27Å; E1764-K1788 IonicContact OE1-NZ 3.78Å; E1764-K1788 PolarHBondContact OE1-NZ 3.23Å; E1764-K1788 IonicContact OE2-NZ 2.7Å; E1764-K1788 PolarHBondContact OE2-NZ 3.49Å
1765	S	28.2	Very low	39.7	Very low	118 Å²	118	102.9 Å²	102.9	83%	0.825	57%	0.574	S	S	*	*			trans	-69	82.8	178.8	44.5	0	0	0	0	113.2	G1763	G1763-S1765 PolarHBondContact O-N 3.06Å
1766	Q	28.4	Very low	37.5	Very low	170 Å²	170	105.4 Å²	105.4	79%	0.794	60%	0.599	S	S	*	*			trans	-125.8	128.5	160.6	-64.8	-162.4	-63.1	0	0	110.1	E1764	E1764-Q1766 PolarHBondContact O-N 2.91Å
1767	I	27.6	Very low	35.7	Very low	185 Å²	185	112 Å²	112	95%	0.949	62%	0.624	S	S	*	*			trans	-85	123.9	-172.5	-61.4	165	0	0	0	108.8
1768	G	26.2	Very low	34.7	Very low	57 Å²	57	114.7 Å²	114.7	59%	0.588	64%	0.64	S	S	*	*	S	Bend	trans	135.8	104.7	174.3	0	0	0	0	0	113.4
1769	D	26.6	Very low	34.5	Very low	167 Å²	167	117.8 Å²	117.8	89%	0.893	65%	0.651	S	S	*	*			trans	45.1	81.8	150.3	-51.2	-17.4	0	0	0	118.9
1770	L	25.2	Very low	35	Very low	164 Å²	164	119.3 Å²	119.3	86%	0.859	66%	0.656	S	S	*	*			trans	-149.1	145.8	139	-154.5	61.5	0	0	0	111.9
1771	E	25.8	Very low	36.4	Very low	183 Å²	183	119.6 Å²	119.6	86%	0.855	66%	0.659	S	S	*	*			trans	-80	147.7	-170.6	-63.6	175.9	114.8	0	0	113.4	S1773	E1771-S1773 PolarHBondContact O-N 2.94Å
1772	Y	26.4	Very low	38.2	Very low	239 Å²	239	115.1 Å²	115.1	94%	0.937	63%	0.634	S	S	*	*			trans	-84	96.6	-177.7	-80.8	-104.3	0	0	0	112.2
1773	S	27.7	Very low	40.4	Very low	89 Å²	89	110.3 Å²	110.3	62%	0.622	61%	0.612	S	S	*	*			trans	-132.3	120.5	157.7	58.8	0	0	0	0	110.8	E1771 D1775	E1771-S1773 PolarHBondContact O-N 2.94Å; S1773-D1775 PolarHBondContact O-N 3.09Å
1774	T	31.9	Very low	42.5	Very low	157 Å²	157	110.8 Å²	110.8	96%	0.963	60%	0.597	S	S	*	*			trans	-73.3	75.9	173.4	19.3	0	0	0	0	110.2
1775	D	33.9	Very low	44.6	Very low	82 Å²	82	109.9 Å²	109.9	44%	0.439	60%	0.598	S	S	.	*			trans	-73.5	152.1	-165.7	-153.1	-19.9	0	0	0	113.4	S1773 Y1777 S1778	S1773-D1775 PolarHBondContact O-N 3.09Å; D1775-Y1777 HydrophobicContact CB-CD2 3.98Å; D1775-Y1777 PolarHBondContact O-N 2.93Å; D1775-Y1777 WeakPolarHBondContact OD1-CD2 3.24Å; D1775-Y1777 VanDerWaalsContact OD2-CD2 3.28Å; D1775-Y1777 WeakPolarHBondContact OD2-CD2 3.41Å; D1775-Y1777 VanDerWaalsContact OD2-CE2 3.22Å; D1775-Y1777 WeakPolarHBondContact OD2-CE2 3.35Å; D1775-S1778 PolarHBondContact O-N 3.07Å; D1775-S1778 VanDerWaalsContact O-N 3.09Å; D1775-S1778 PolarHBondContact O-OG 2.67Å
1776	A	39.1	Very low	47.2	Very low	71 Å²	71	104.3 Å²	104.3	59%	0.587	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-62.9	-16.5	-176.3	0	0	0	0	0	113.1	S1778 L1779	A1776-S1778 PolarHBondContact O-N 2.91Å; A1776-S1778 VanDerWaalsContact O-N 3.11Å; A1776-L1779 PolarHBondContact O-N 2.7Å; A1776-L1779 VanDerWaalsContact O-N 3.09Å
1777	Y	41.7	Very low	50.1	Low	140 Å²	140	96.2 Å²	96.2	55%	0.549	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-60.3	-14.5	171.4	-56.7	-80.5	0	0	0	113.9	D1775 L1779 L1780 N1781	D1775-Y1777 HydrophobicContact CB-CD2 3.98Å; D1775-Y1777 PolarHBondContact O-N 2.93Å; D1775-Y1777 WeakPolarHBondContact OD1-CD2 3.24Å; D1775-Y1777 VanDerWaalsContact OD2-CD2 3.28Å; D1775-Y1777 WeakPolarHBondContact OD2-CD2 3.41Å; D1775-Y1777 VanDerWaalsContact OD2-CE2 3.22Å; D1775-Y1777 WeakPolarHBondContact OD2-CE2 3.35Å; Y1777-L1779 VanDerWaalsContact C-N 3.3Å; Y1777-L1779 PolarHBondContact O-N 3.06Å; Y1777-L1780 HydrophobicContact CD1-CD1 3.64Å; Y1777-L1780 HydrophobicContact CE1-CD1 4.2Å; Y1777-L1780 HydrophobicContact CG-CD1 4.49Å; Y1777-L1780 WeakPolarHBondContact O-CB 2.97Å; Y1777-L1780 PolarHBondContact O-N 3.1Å; Y1777-L1780 VanDerWaalsContact O-N 3.13Å; Y1777-N1781 WeakPolarHBondContact O-CB 3.36Å; Y1777-N1781 PolarHBondContact O-N 3.21Å
1778	S	44.1	Very low	52.8	Low	75 Å²	75	90.6 Å²	90.6	52%	0.524	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-61.2	-34.4	169.8	54.7	0	0	0	0	113.5	D1775 A1776 L1780 W1782	D1775-S1778 PolarHBondContact O-N 3.07Å; D1775-S1778 VanDerWaalsContact O-N 3.09Å; D1775-S1778 PolarHBondContact O-OG 2.67Å; A1776-S1778 PolarHBondContact O-N 2.91Å; A1776-S1778 VanDerWaalsContact O-N 3.11Å; S1778-L1780 VanDerWaalsContact C-N 3.33Å; S1778-W1782 PolarHBondContact O-N 2.86Å
1779	L	50.2	Low	55.4	Low	90 Å²	90	91.2 Å²	91.2	47%	0.471	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-17.6	173.2	-84.5	164.4	0	0	0	113.6	R1603 A1776 Y1777	R1603-L1779 PolarHBondContact NH1-O 3.25Å; A1776-L1779 PolarHBondContact O-N 2.7Å; A1776-L1779 VanDerWaalsContact O-N 3.09Å; Y1777-L1779 VanDerWaalsContact C-N 3.3Å; Y1777-L1779 PolarHBondContact O-N 3.06Å
1780	L	59.6	Low	58.2	Low	86 Å²	86	83.3 Å²	83.3	45%	0.45	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-60.1	171.5	-67.1	169.3	0	0	0	109.2	Q1628 Y1777 S1778 W1782	Q1628-L1780 VanDerWaalsContact OE1-C 3.3Å; Q1628-L1780 PolarHBondContact OE1-O 3.01Å; Y1777-L1780 HydrophobicContact CD1-CD1 3.64Å; Y1777-L1780 HydrophobicContact CE1-CD1 4.2Å; Y1777-L1780 HydrophobicContact CG-CD1 4.49Å; Y1777-L1780 WeakPolarHBondContact O-CB 2.97Å; Y1777-L1780 PolarHBondContact O-N 3.1Å; Y1777-L1780 VanDerWaalsContact O-N 3.13Å; S1778-L1780 VanDerWaalsContact C-N 3.33Å; L1780-W1782 VanDerWaalsContact O-CD1 3.3Å; L1780-W1782 PolarHBondContact O-N 3.15Å
1781	N	68.5	Low	61.2	Low	64 Å²	64	75.5 Å²	75.5	34%	0.342	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	19.5	-178.5	-65.6	-19.9	0	0	0	114.7	Y1777 Q1783 Q1784 T1785	Y1777-N1781 WeakPolarHBondContact O-CB 3.36Å; Y1777-N1781 PolarHBondContact O-N 3.21Å; N1781-Q1783 PolarHBondContact O-N 2.82Å; N1781-Q1784 HydrophobicContact CB-CG 4.44Å; N1781-Q1784 WeakPolarHBondContact O-CB 3.33Å; N1781-Q1784 PolarHBondContact O-N 3.44Å; N1781-T1785 PolarHBondContact O-N 3.13Å
1782	W	81.5	Confident	63.9	Low	8 Å²	8	68.6 Å²	68.6	3%	0.03	36%	0.358	C	S	.	.	H	α-helix	trans	-53.8	-34.8	-173.6	76.5	-91.6	0	0	0	113	Y1587 R1603 L1605 V1620 D1622 S1778 L1780 Q1784 T1785 A1786	Y1587-W1782 HydrophobicContact CD1-CE3 4.22Å; Y1587-W1782 HydrophobicContact CD1-CZ3 4.17Å; Y1587-W1782 HydrophobicContact CE1-CE3 4.05Å; Y1587-W1782 HydrophobicContact CE1-CZ3 4.42Å; R1603-W1782 HydrophobicContact CB-CH2 3.95Å; R1603-W1782 HydrophobicContact CB-CZ2 3.74Å; R1603-W1782 HydrophobicContact CB-CZ3 4.49Å; R1603-W1782 HydrophobicContact CG-CH2 4.43Å; R1603-W1782 HydrophobicContact CG-CZ2 3.72Å; L1605-W1782 HydrophobicContact CB-CH2 4.44Å; L1605-W1782 HydrophobicContact CB-CZ3 4.07Å; V1620-W1782 HydrophobicContact CG1-CH2 3.97Å; V1620-W1782 HydrophobicContact CG1-CZ2 4.12Å; D1622-W1782 HydrophobicContact CB-CZ2 4.15Å; D1622-W1782 WeakPolarHBondContact OD2-CZ2 3.29Å; D1622-W1782 PolarHBondContact OD2-NE1 2.92Å; S1778-W1782 PolarHBondContact O-N 2.86Å; L1780-W1782 VanDerWaalsContact O-CD1 3.3Å; L1780-W1782 PolarHBondContact O-N 3.15Å; W1782-Q1784 VanDerWaalsContact C-N 3.34Å; W1782-Q1784 PolarHBondContact O-N 2.97Å; W1782-T1785 PolarHBondContact O-N 3.47Å; W1782-A1786 HydrophobicContact CE3-CB 4.37Å; W1782-A1786 VanDerWaalsContact O-CB 3.25Å; W1782-A1786 WeakPolarHBondContact O-CB 3.5Å; W1782-A1786 PolarHBondContact O-N 2.75Å
1783	Q	85	Confident	66.7	Low	1 Å²	1	57.6 Å²	57.6	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-37	177.5	-58.4	-177	6.8	0	0	112.2	V1620 D1622 I1626 L1629 N1781 V1787	V1620-Q1783 HydrophobicContact CG1-CG 4.31Å; D1622-Q1783 PolarHBondContact OD2-NE2 3.47Å; I1626-Q1783 PolarHBondContact O-NE2 2.6Å; I1626-Q1783 PolarHBondContact O-OE1 2.75Å; L1629-Q1783 HydrophobicContact CD2-CB 4.07Å; N1781-Q1783 PolarHBondContact O-N 2.82Å; Q1783-V1787 WeakPolarHBondContact O-CB 3.44Å; Q1783-V1787 WeakPolarHBondContact O-CG1 3.36Å; Q1783-V1787 PolarHBondContact O-N 2.83Å
1784	Q	82.5	Confident	69.6	Low	76 Å²	76	53.4 Å²	53.4	36%	0.355	29%	0.285	S	S	.	.	H	α-helix	trans	-69.4	-46.6	178.5	-54.9	-163.7	-10	0	0	110.9	Q1628 N1781 W1782 V1787 K1788	Q1628-Q1784 WeakPolarHBondContact O-CG 3.18Å; Q1628-Q1784 PolarHBondContact O-NE2 3.02Å; N1781-Q1784 HydrophobicContact CB-CG 4.44Å; N1781-Q1784 WeakPolarHBondContact O-CB 3.33Å; N1781-Q1784 PolarHBondContact O-N 3.44Å; W1782-Q1784 VanDerWaalsContact C-N 3.34Å; W1782-Q1784 PolarHBondContact O-N 2.97Å; Q1784-V1787 PolarHBondContact O-N 3.19Å; Q1784-K1788 WeakPolarHBondContact O-CB 3.4Å; Q1784-K1788 PolarHBondContact O-N 3.18Å
1785	T	77.4	Confident	72.2	Confident	86 Å²	86	46 Å²	46	53%	0.528	24%	0.24	S	C	.	.	H	α-helix	trans	-61.1	-46.6	176.2	-51.7	0	0	0	0	111	N1781 W1782 R1789	N1781-T1785 PolarHBondContact O-N 3.13Å; W1782-T1785 PolarHBondContact O-N 3.47Å; T1785-R1789 VanDerWaalsContact O-CB 3.29Å; T1785-R1789 WeakPolarHBondContact O-CB 3.09Å; T1785-R1789 PolarHBondContact O-N 2.92Å
1786	A	82.8	Confident	74.5	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-43	178.7	0	0	0	0	0	112.8	F1585 Y1587 L1605 W1782 G1790	F1585-A1786 VanDerWaalsContact CE1-O 3.29Å; F1585-A1786 WeakPolarHBondContact CE1-O 3.35Å; Y1587-A1786 HydrophobicContact CD1-CB 3.55Å; Y1587-A1786 HydrophobicContact CE1-CB 4Å; Y1587-A1786 HydrophobicContact CG-CB 3.88Å; L1605-A1786 HydrophobicContact CD1-CB 4.12Å; W1782-A1786 HydrophobicContact CE3-CB 4.37Å; W1782-A1786 VanDerWaalsContact O-CB 3.25Å; W1782-A1786 WeakPolarHBondContact O-CB 3.5Å; W1782-A1786 PolarHBondContact O-N 2.75Å; A1786-G1790 PolarHBondContact O-N 3.18Å
1787	V	88.4	Confident	76.7	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-78.4	-34.4	-179.4	84.7	0	0	0	0	113	L1605 L1629 P1630 L1632 L1635 Q1783 Q1784 R1789 G1790 I1791	L1605-V1787 HydrophobicContact CD1-CB 4.28Å; L1629-V1787 HydrophobicContact CD2-CB 3.79Å; L1629-V1787 HydrophobicContact CD2-CG1 3.73Å; L1629-V1787 HydrophobicContact CD2-CG2 4.15Å; P1630-V1787 HydrophobicContact CG-CG1 4.44Å; L1632-V1787 HydrophobicContact CD2-CB 4.37Å; L1632-V1787 HydrophobicContact CD2-CG1 3.72Å; L1632-V1787 HydrophobicContact CD2-CG2 3.72Å; L1635-V1787 HydrophobicContact CD2-CG1 3.92Å; Q1783-V1787 WeakPolarHBondContact O-CB 3.44Å; Q1783-V1787 WeakPolarHBondContact O-CG1 3.36Å; Q1783-V1787 PolarHBondContact O-N 2.83Å; Q1784-V1787 PolarHBondContact O-N 3.19Å; V1787-R1789 VanDerWaalsContact C-N 3.3Å; V1787-R1789 PolarHBondContact O-N 3.17Å; V1787-G1790 PolarHBondContact O-N 3.39Å; V1787-I1791 HydrophobicContact CG2-CD1 4.34Å; V1787-I1791 WeakPolarHBondContact O-CB 3.46Å; V1787-I1791 PolarHBondContact O-N 3.17Å
1788	K	83.4	Confident	78.5	Confident	67 Å²	67	36.6 Å²	36.6	29%	0.291	19%	0.187	S	C	.	.	H	α-helix	trans	-58.7	-44.5	169.7	-177.3	179	-179.7	-178.1	0	110.1	L1635 E1764 Q1784 R1792	L1635-K1788 HydrophobicContact CD1-CG 4.4Å; L1635-K1788 HydrophobicContact CD2-CB 4.24Å; E1764-K1788 VanDerWaalsContact CD-NZ 3.27Å; E1764-K1788 IonicContact OE1-NZ 3.78Å; E1764-K1788 PolarHBondContact OE1-NZ 3.23Å; E1764-K1788 IonicContact OE2-NZ 2.7Å; E1764-K1788 PolarHBondContact OE2-NZ 3.49Å; Q1784-K1788 WeakPolarHBondContact O-CB 3.4Å; Q1784-K1788 PolarHBondContact O-N 3.18Å; K1788-R1792 WeakPolarHBondContact O-CB 3.32Å; K1788-R1792 PolarHBondContact O-N 3.17Å
1789	R	81	Confident	80	Confident	70 Å²	70	36.6 Å²	36.6	26%	0.264	19%	0.191	S	C	.	.	H	α-helix	trans	-62.5	-51.8	173.3	-170.8	169.5	178.2	161.7	-1.5	111.3	F1585 T1759 T1785 V1787 I1791 R1792 Y1793	F1585-R1789 HydrophobicContact CE2-CG 4.22Å; F1585-R1789 HydrophobicContact CZ-CB 4.25Å; F1585-R1789 HydrophobicContact CZ-CG 4.16Å; T1759-R1789 VanDerWaalsContact CG2-NH2 3.32Å; T1785-R1789 VanDerWaalsContact O-CB 3.29Å; T1785-R1789 WeakPolarHBondContact O-CB 3.09Å; T1785-R1789 PolarHBondContact O-N 2.92Å; V1787-R1789 VanDerWaalsContact C-N 3.3Å; V1787-R1789 PolarHBondContact O-N 3.17Å; R1789-I1791 VanDerWaalsContact C-N 3.29Å; R1789-I1791 PolarHBondContact O-N 3.02Å; R1789-R1792 PolarHBondContact O-N 2.68Å; R1789-R1792 VanDerWaalsContact O-N 3.08Å; R1789-Y1793 HydrophobicContact CG-CD2 3.6Å; R1789-Y1793 HydrophobicContact CG-CE2 3.53Å; R1789-Y1793 VanDerWaalsContact NE-CE2 3.35Å; R1789-Y1793 PolarHBondContact NH2-OH 2.79Å; R1789-Y1793 VanDerWaalsContact O-CD2 3.31Å; R1789-Y1793 WeakPolarHBondContact O-CD2 3.41Å; R1789-Y1793 PolarHBondContact O-N 3.1Å
1790	G	85.9	Confident	81.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-55.7	-40.5	179.6	0	0	0	0	0	113.9	L1607 A1786 V1787 F1794	L1607-G1790 VanDerWaalsContact CD2-C 3.41Å; A1786-G1790 PolarHBondContact O-N 3.18Å; V1787-G1790 PolarHBondContact O-N 3.39Å; G1790-F1794 PolarHBondContact O-N 3.4Å
1791	I	88	Confident	82.7	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-68.6	-43	174.6	-77.5	163.4	0	0	0	111.9	L1607 L1635 Y1636 Q1639 F1659 V1787 R1789 Y1793 F1794 L1795	L1607-I1791 HydrophobicContact CD2-CG1 4.3Å; L1635-I1791 HydrophobicContact CD2-CD1 4.01Å; L1635-I1791 HydrophobicContact CG-CD1 4.36Å; Y1636-I1791 HydrophobicContact CD2-CG2 4.02Å; Q1639-I1791 HydrophobicContact CB-CG2 3.96Å; Q1639-I1791 HydrophobicContact CG-CG2 4.01Å; F1659-I1791 HydrophobicContact CE1-CD1 4.48Å; F1659-I1791 HydrophobicContact CZ-CD1 4.14Å; F1659-I1791 HydrophobicContact CZ-CG1 4.44Å; V1787-I1791 HydrophobicContact CG2-CD1 4.34Å; V1787-I1791 WeakPolarHBondContact O-CB 3.46Å; V1787-I1791 PolarHBondContact O-N 3.17Å; R1789-I1791 VanDerWaalsContact C-N 3.29Å; R1789-I1791 PolarHBondContact O-N 3.02Å; I1791-Y1793 VanDerWaalsContact C-N 3.31Å; I1791-Y1793 PolarHBondContact O-N 3.13Å; I1791-F1794 WeakPolarHBondContact O-CB 3.36Å; I1791-F1794 PolarHBondContact O-N 3.43Å; I1791-L1795 HydrophobicContact CG2-CD1 4.2Å; I1791-L1795 WeakPolarHBondContact O-CG 2.77Å; I1791-L1795 PolarHBondContact O-N 3.32Å
1792	R	83.1	Confident	83.4	Confident	39 Å²	39	30.9 Å²	30.9	15%	0.147	16%	0.156	C	C	.	.	H	α-helix	trans	-60.7	-40.9	175.6	-161.2	-178.5	-163.1	167.2	7.7	111.3	D1761 E1762 K1788 R1789 L1795 Q1796	D1761-R1792 IonicContact OD1-CZ 2.62Å; D1761-R1792 IonicContact OD1-NH1 3.04Å; D1761-R1792 PolarHBondContact OD1-NH1 3.34Å; E1762-R1792 PolarHBondContact O-NH2 3.11Å; E1762-R1792 VanDerWaalsContact O-NH2 3.09Å; K1788-R1792 WeakPolarHBondContact O-CB 3.32Å; K1788-R1792 PolarHBondContact O-N 3.17Å; R1789-R1792 PolarHBondContact O-N 2.68Å; R1789-R1792 VanDerWaalsContact O-N 3.08Å; R1792-L1795 PolarHBondContact O-N 3Å; R1792-Q1796 WeakPolarHBondContact O-CB 3.32Å; R1792-Q1796 WeakPolarHBondContact O-CG 3.36Å; R1792-Q1796 PolarHBondContact O-N 3Å; R1792-Q1796 VanDerWaalsContact O-N 3.15Å
1793	Y	85.3	Confident	83.2	Confident	7 Å²	7	34.2 Å²	34.2	3%	0.027	17%	0.169	C	C	.	.	H	α-helix	trans	-69.8	-33.2	176.6	-87	-99.7	0	0	0	113.5	H1711 G1758 T1759 R1789 I1791 S1797	H1711-Y1793 AromaticContact CD2-CD1 3.32Å; H1711-Y1793 WeakPolarHBondContact CD2-CD1 3.41Å; H1711-Y1793 AromaticContact CD2-CE1 3.23Å; H1711-Y1793 WeakPolarHBondContact CD2-CE1 3.24Å; H1711-Y1793 AromaticContact CG-CD1 3.87Å; G1758-Y1793 VanDerWaalsContact O-CE1 3.29Å; G1758-Y1793 WeakPolarHBondContact O-CE1 3.37Å; G1758-Y1793 PolarHBondContact O-OH 3.14Å; T1759-Y1793 WeakPolarHBondContact CG2-OH 3.18Å; R1789-Y1793 HydrophobicContact CG-CD2 3.6Å; R1789-Y1793 HydrophobicContact CG-CE2 3.53Å; R1789-Y1793 VanDerWaalsContact NE-CE2 3.35Å; R1789-Y1793 PolarHBondContact NH2-OH 2.79Å; R1789-Y1793 VanDerWaalsContact O-CD2 3.31Å; R1789-Y1793 WeakPolarHBondContact O-CD2 3.41Å; R1789-Y1793 PolarHBondContact O-N 3.1Å; I1791-Y1793 VanDerWaalsContact C-N 3.31Å; I1791-Y1793 PolarHBondContact O-N 3.13Å; Y1793-S1797 PolarHBondContact O-N 3.07Å
1794	F	89.3	Confident	83.2	Confident	1 Å²	1	35 Å²	35	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-63.6	-49.9	170.2	170.6	-111.8	0	0	0	111.6	F1583 I1609 P1611 Y1636 F1652 L1657 G1790 I1791 Q1796 S1797	F1583-F1794 HydrophobicContact CB-CD2 3.75Å; F1583-F1794 HydrophobicContact CB-CE2 4.2Å; F1583-F1794 HydrophobicContact CD1-CB 3.8Å; F1583-F1794 AromaticContact CD1-CD2 3.8Å; F1583-F1794 HydrophobicContact CD1-CD2 3.8Å; F1583-F1794 HydrophobicContact CD1-CG 4.21Å; F1583-F1794 HydrophobicContact CD2-CD2 4.34Å; F1583-F1794 HydrophobicContact CE1-CB 3.63Å; F1583-F1794 HydrophobicContact CE1-CD2 4.48Å; F1583-F1794 HydrophobicContact CG-CB 4.32Å; F1583-F1794 AromaticContact CG-CD2 3.7Å; F1583-F1794 HydrophobicContact CG-CD2 3.7Å; F1583-F1794 HydrophobicContact CG-CG 4.49Å; F1583-F1794 HydrophobicContact CZ-CB 4.03Å; I1609-F1794 HydrophobicContact CB-CD2 4.05Å; I1609-F1794 HydrophobicContact CB-CE2 4Å; I1609-F1794 HydrophobicContact CB-CG 4.49Å; I1609-F1794 HydrophobicContact CB-CZ 4.41Å; I1609-F1794 HydrophobicContact CD1-CB 3.78Å; I1609-F1794 HydrophobicContact CD1-CD1 3.68Å; I1609-F1794 HydrophobicContact CD1-CD2 3.91Å; I1609-F1794 HydrophobicContact CD1-CE1 4.25Å; I1609-F1794 HydrophobicContact CD1-CE2 4.45Å; I1609-F1794 HydrophobicContact CD1-CG 3.48Å; I1609-F1794 VanDerWaalsContact CD1-CG 3.48Å; I1609-F1794 HydrophobicContact CG2-CD1 4.43Å; I1609-F1794 HydrophobicContact CG2-CD2 4.01Å; I1609-F1794 HydrophobicContact CG2-CE1 3.98Å; I1609-F1794 HydrophobicContact CG2-CE2 3.51Å; I1609-F1794 HydrophobicContact CG2-CG 4.44Å; I1609-F1794 HydrophobicContact CG2-CZ 3.49Å; I1609-F1794 VanDerWaalsContact CG2-CZ 3.49Å; P1611-F1794 HydrophobicContact CG-CE2 4Å; P1611-F1794 HydrophobicContact CG-CZ 4.14Å; Y1636-F1794 HydrophobicContact CE2-CD1 4.01Å; Y1636-F1794 AromaticContact CE2-CE1 3.91Å; Y1636-F1794 HydrophobicContact CE2-CE1 3.91Å; F1652-F1794 HydrophobicContact CD2-CZ 4.29Å; F1652-F1794 HydrophobicContact CE2-CD2 4.49Å; F1652-F1794 HydrophobicContact CE2-CE1 4.17Å; F1652-F1794 AromaticContact CE2-CE2 3.77Å; F1652-F1794 HydrophobicContact CE2-CE2 3.77Å; F1652-F1794 AromaticContact CE2-CZ 3.57Å; F1652-F1794 HydrophobicContact CE2-CZ 3.57Å; F1652-F1794 HydrophobicContact CZ-CZ 4.46Å; F1652-F1794 WeakPolarHBondContact CZ-O 3.06Å; L1657-F1794 HydrophobicContact CD1-CD1 4.37Å; L1657-F1794 HydrophobicContact CD1-CE1 3.85Å; L1657-F1794 HydrophobicContact CD1-CZ 4.49Å; G1790-F1794 PolarHBondContact O-N 3.4Å; I1791-F1794 WeakPolarHBondContact O-CB 3.36Å; I1791-F1794 PolarHBondContact O-N 3.43Å; F1794-Q1796 PolarHBondContact O-N 2.92Å; F1794-S1797 VanDerWaalsContact O-CB 3.24Å; F1794-S1797 WeakPolarHBondContact O-CB 3.44Å; F1794-S1797 PolarHBondContact O-N 3.14Å; F1794-S1797 PolarHBondContact O-OG 2.66Å
1795	L	86.2	Confident	83.4	Confident	3 Å²	3	32 Å²	32	2%	0.016	16%	0.159	C	C	.	.	H	α-helix	trans	-60.6	-30.8	-179.9	-70.5	173.2	0	0	0	112.8	Y1636 Q1639 C1640 F1644 P1653 I1791 R1792	Y1636-L1795 HydrophobicContact CE2-CD2 3.73Å; Y1636-L1795 HydrophobicContact CE2-CG 4.35Å; Q1639-L1795 HydrophobicContact CB-CD1 3.51Å; C1640-L1795 VanDerWaalsContact SG-CD2 3.59Å; F1644-L1795 HydrophobicContact CE2-CB 4.16Å; F1644-L1795 HydrophobicContact CE2-CD2 4.16Å; F1644-L1795 WeakPolarHBondContact CZ-O 3.4Å; P1653-L1795 HydrophobicContact CB-CD2 3.65Å; P1653-L1795 HydrophobicContact CG-CD2 3.97Å; I1791-L1795 HydrophobicContact CG2-CD1 4.2Å; I1791-L1795 WeakPolarHBondContact O-CG 2.77Å; I1791-L1795 PolarHBondContact O-N 3.32Å; R1792-L1795 PolarHBondContact O-N 3Å
1796	Q	81.5	Confident	83.7	Confident	42 Å²	42	31.7 Å²	31.7	20%	0.196	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	4.8	175.1	-68.2	171.9	-21.3	0	0	113.7	R1792 F1794 R1800	R1792-Q1796 WeakPolarHBondContact O-CB 3.32Å; R1792-Q1796 WeakPolarHBondContact O-CG 3.36Å; R1792-Q1796 PolarHBondContact O-N 3Å; R1792-Q1796 VanDerWaalsContact O-N 3.15Å; F1794-Q1796 PolarHBondContact O-N 2.92Å; Q1796-R1800 WeakPolarHBondContact O-CB 2.57Å; Q1796-R1800 WeakPolarHBondContact O-CG 2.62Å; Q1796-R1800 PolarHBondContact O-N 3.41Å; Q1796-R1800 VanDerWaalsContact O-N 3.11Å; Q1796-R1800 VanDerWaalsContact OE1-NH2 3.15Å
1797	S	84.7	Confident	83.8	Confident	4 Å²	4	32.1 Å²	32.1	3%	0.028	15%	0.154	C	C	.	.	H	α-helix	trans	-74.2	-40.4	-167.5	74.3	0	0	0	0	114.5	Y1793 F1794 L1801	Y1793-S1797 PolarHBondContact O-N 3.07Å; F1794-S1797 VanDerWaalsContact O-CB 3.24Å; F1794-S1797 WeakPolarHBondContact O-CB 3.44Å; F1794-S1797 PolarHBondContact O-N 3.14Å; F1794-S1797 PolarHBondContact O-OG 2.66Å; S1797-L1801 WeakPolarHBondContact O-CB 2.66Å; S1797-L1801 PolarHBondContact O-N 2.89Å
1798	E	81.2	Confident	83.9	Confident	49 Å²	49	32.1 Å²	32.1	23%	0.229	15%	0.154	C	C	.	.	H	α-helix	trans	-67.5	-42	177.4	-65.6	-148.6	143	0	0	111.2	R1577 H1581 F1652 R1800 L1801 E1802	R1577-E1798 IonicContact CZ-OE2 3.14Å; R1577-E1798 IonicContact NE-OE2 3.76Å; R1577-E1798 IonicContact NH2-OE2 2.77Å; R1577-E1798 PolarHBondContact NH2-OE2 2.93Å; H1581-E1798 IonicContact ND1-OE1 3.23Å; F1652-E1798 HydrophobicContact CD1-CB 4.23Å; F1652-E1798 HydrophobicContact CD1-CG 3.76Å; F1652-E1798 HydrophobicContact CD2-CG 4.21Å; F1652-E1798 HydrophobicContact CE1-CB 4.06Å; F1652-E1798 HydrophobicContact CE1-CG 3.79Å; F1652-E1798 HydrophobicContact CE2-CG 4.21Å; F1652-E1798 HydrophobicContact CG-CG 4.01Å; F1652-E1798 HydrophobicContact CZ-CG 4.02Å; E1798-R1800 PolarHBondContact O-N 3.4Å; E1798-L1801 PolarHBondContact O-N 3.2Å; E1798-E1802 PolarHBondContact O-N 3.24Å
1799	A	75.2	Confident	84.2	Confident	75 Å²	75	31.5 Å²	31.5	62%	0.62	15%	0.15	S	C	*	.	H	α-helix	trans	-62.4	-41.6	176.3	0	0	0	0	0	112.9	R1803	A1799-R1803 PolarHBondContact O-N 3.4Å
1800	R	81	Confident	84.5	Confident	31 Å²	31	29.7 Å²	29.7	12%	0.117	14%	0.143	C	C	.	.	H	α-helix	trans	-63.8	-41.4	172.8	-78.8	-173.5	172.2	95.1	6	112.2	L1756 G1757 G1758 Q1796 E1798 Q1804	L1756-R1800 HydrophobicContact CD1-CB 4.44Å; L1756-R1800 HydrophobicContact CD2-CB 4.15Å; G1757-R1800 WeakPolarHBondContact O-CD 3.29Å; G1757-R1800 PolarHBondContact O-NE 3.06Å; G1758-R1800 PolarHBondContact O-NH2 2.87Å; Q1796-R1800 WeakPolarHBondContact O-CB 2.57Å; Q1796-R1800 WeakPolarHBondContact O-CG 2.62Å; Q1796-R1800 PolarHBondContact O-N 3.41Å; Q1796-R1800 VanDerWaalsContact O-N 3.11Å; Q1796-R1800 VanDerWaalsContact OE1-NH2 3.15Å; E1798-R1800 PolarHBondContact O-N 3.4Å; R1800-Q1804 WeakPolarHBondContact O-CG 3.46Å; R1800-Q1804 PolarHBondContact O-N 2.97Å; R1800-Q1804 VanDerWaalsContact O-N 3.09Å
1801	L	84.6	Confident	84.7	Confident	7 Å²	7	29.7 Å²	29.7	4%	0.037	14%	0.143	C	C	.	.	H	α-helix	trans	-64.6	-45.3	178.9	177.7	64.2	0	0	0	111.3	L1709 I1754 L1756 S1797 E1798 R1803 Q1804 L1805 V1815	L1709-L1801 HydrophobicContact CD1-CD2 4.13Å; L1709-L1801 HydrophobicContact CD2-CD1 4Å; L1709-L1801 HydrophobicContact CD2-CD2 4.07Å; I1754-L1801 HydrophobicContact CD1-CD1 3.8Å; I1754-L1801 HydrophobicContact CG2-CD1 4.08Å; L1756-L1801 HydrophobicContact CD2-CB 4.35Å; S1797-L1801 WeakPolarHBondContact O-CB 2.66Å; S1797-L1801 PolarHBondContact O-N 2.89Å; E1798-L1801 PolarHBondContact O-N 3.2Å; L1801-R1803 PolarHBondContact O-N 3.32Å; L1801-Q1804 CarbonylContact O-C 3.56Å; L1801-Q1804 WeakPolarHBondContact O-CB 3.27Å; L1801-Q1804 PolarHBondContact O-N 2.77Å; L1801-L1805 HydrophobicContact CD1-CD1 4.35Å; L1801-L1805 HydrophobicContact CD1-CG 4.33Å; L1801-L1805 HydrophobicContact CG-CD1 3.99Å; L1801-L1805 HydrophobicContact CG-CG 4.4Å; L1801-L1805 WeakPolarHBondContact O-CG 3.02Å; L1801-L1805 PolarHBondContact O-N 3.39Å; L1801-V1815 HydrophobicContact CD1-CG2 4.45Å
1802	E	82.7	Confident	84.8	Confident	82 Å²	82	32.1 Å²	32.1	38%	0.383	15%	0.154	S	C	.	.	H	α-helix	trans	-66.8	-39.2	-178.6	-161.5	61	-145.2	0	0	111.4	E1798 Q1804 L1805 E1806 R1809	E1798-E1802 PolarHBondContact O-N 3.24Å; E1802-Q1804 VanDerWaalsContact C-N 3.3Å; E1802-Q1804 PolarHBondContact O-N 3.03Å; E1802-L1805 CarbonylContact O-C 3.57Å; E1802-L1805 WeakPolarHBondContact O-CA 3.06Å; E1802-L1805 WeakPolarHBondContact O-CB 3.28Å; E1802-L1805 PolarHBondContact O-N 3.05Å; E1802-L1805 WeakPolarHBondContact OE2-CD1 3.28Å; E1802-E1806 WeakPolarHBondContact O-CG 3.18Å; E1802-E1806 PolarHBondContact O-N 3.03Å; E1802-R1809 IonicContact OE1-CZ 2.81Å; E1802-R1809 VanDerWaalsContact OE1-CZ 3.26Å; E1802-R1809 IonicContact OE1-NH1 3.71Å; E1802-R1809 PolarHBondContact OE1-NH1 2.89Å; E1802-R1809 IonicContact OE1-NH2 3.9Å; E1802-R1809 PolarHBondContact OE1-NH2 3.39Å
1803	R	78.1	Confident	85.1	Confident	77 Å²	77	30.3 Å²	30.3	29%	0.291	15%	0.147	S	C	.	.	H	α-helix	trans	-62.5	-35.6	172.4	-174.1	54.4	172.4	-174.9	-0.7	112.6	A1799 L1801 E1806 L1807 E1998	A1799-R1803 PolarHBondContact O-N 3.4Å; L1801-R1803 PolarHBondContact O-N 3.32Å; R1803-E1806 WeakPolarHBondContact CD-OE2 3.06Å; R1803-E1806 IonicContact CZ-OE2 2.74Å; R1803-E1806 IonicContact NE-OE2 2.87Å; R1803-E1806 IonicContact NH1-OE2 3.41Å; R1803-E1806 PolarHBondContact NH1-OE2 2.89Å; R1803-L1807 PolarHBondContact O-N 3.06Å; R1803-E1998 IonicContact CZ-OE1 3.8Å; R1803-E1998 IonicContact NH2-OE1 3.57Å; R1803-E1998 PolarHBondContact NH2-OE1 2.85Å
1804	Q	84.9	Confident	85.5	Confident	19 Å²	19	30 Å²	30	9%	0.089	15%	0.146	C	C	.	.	H	α-helix	trans	-68	-35.4	170.4	-75	-177.6	-19.2	0	0	112.5	Q1755 R1800 L1801 E1802 L1807 A1808 V1815 I1818	Q1755-Q1804 PolarHBondContact O-NE2 2.7Å; Q1755-Q1804 PolarHBondContact O-OE1 2.93Å; R1800-Q1804 WeakPolarHBondContact O-CG 3.46Å; R1800-Q1804 PolarHBondContact O-N 2.97Å; R1800-Q1804 VanDerWaalsContact O-N 3.09Å; L1801-Q1804 CarbonylContact O-C 3.56Å; L1801-Q1804 WeakPolarHBondContact O-CB 3.27Å; L1801-Q1804 PolarHBondContact O-N 2.77Å; E1802-Q1804 VanDerWaalsContact C-N 3.3Å; E1802-Q1804 PolarHBondContact O-N 3.03Å; Q1804-L1807 PolarHBondContact O-N 2.88Å; Q1804-A1808 VanDerWaalsContact O-CB 3.22Å; Q1804-A1808 WeakPolarHBondContact O-CB 2.86Å; Q1804-A1808 PolarHBondContact O-N 3.35Å; Q1804-V1815 HydrophobicContact CB-CG2 3.91Å; Q1804-I1818 HydrophobicContact CB-CD1 4.3Å; Q1804-I1818 WeakPolarHBondContact O-CD1 3.25Å
1805	L	86.4	Confident	85.5	Confident	13 Å²	13	30 Å²	30	7%	0.068	15%	0.146	C	C	.	.	H	α-helix	trans	-70.1	-37.3	175.8	-72.4	169.1	0	0	0	112.2	Y1573 L1574 L1801 E1802 A1808 R1809 V1815	Y1573-L1805 HydrophobicContact CE1-CD2 4.09Å; L1574-L1805 HydrophobicContact CB-CD2 4.09Å; L1574-L1805 HydrophobicContact CD1-CD2 3.76Å; L1801-L1805 HydrophobicContact CD1-CD1 4.35Å; L1801-L1805 HydrophobicContact CD1-CG 4.33Å; L1801-L1805 HydrophobicContact CG-CD1 3.99Å; L1801-L1805 HydrophobicContact CG-CG 4.4Å; L1801-L1805 WeakPolarHBondContact O-CG 3.02Å; L1801-L1805 PolarHBondContact O-N 3.39Å; E1802-L1805 CarbonylContact O-C 3.57Å; E1802-L1805 WeakPolarHBondContact O-CA 3.06Å; E1802-L1805 WeakPolarHBondContact O-CB 3.28Å; E1802-L1805 PolarHBondContact O-N 3.05Å; E1802-L1805 WeakPolarHBondContact OE2-CD1 3.28Å; L1805-A1808 PolarHBondContact O-N 3.31Å; L1805-R1809 WeakPolarHBondContact O-CB 3.05Å; L1805-R1809 VanDerWaalsContact O-CD 3.3Å; L1805-R1809 WeakPolarHBondContact O-CD 3.22Å; L1805-R1809 WeakPolarHBondContact O-CG 3.22Å; L1805-R1809 PolarHBondContact O-N 2.72Å; L1805-V1815 HydrophobicContact CD2-CB 3.91Å; L1805-V1815 HydrophobicContact CD2-CG1 4.02Å; L1805-V1815 HydrophobicContact CD2-CG2 3.86Å; L1805-V1815 HydrophobicContact CG-CG2 4.21Å
1806	E	84.2	Confident	85.6	Confident	79 Å²	79	30 Å²	30	37%	0.369	15%	0.147	S	C	.	.	H	α-helix	trans	-56.8	-50.2	169.2	-68.4	178	161.3	0	0	111.2	E1802 R1803 R1809 Y1810 L1995	E1802-E1806 WeakPolarHBondContact O-CG 3.18Å; E1802-E1806 PolarHBondContact O-N 3.03Å; R1803-E1806 WeakPolarHBondContact CD-OE2 3.06Å; R1803-E1806 IonicContact CZ-OE2 2.74Å; R1803-E1806 IonicContact NE-OE2 2.87Å; R1803-E1806 IonicContact NH1-OE2 3.41Å; R1803-E1806 PolarHBondContact NH1-OE2 2.89Å; E1806-R1809 PolarHBondContact O-N 3.14Å; E1806-Y1810 PolarHBondContact O-N 3Å; E1806-L1995 HydrophobicContact CB-CD1 3.98Å; E1806-L1995 WeakPolarHBondContact O-CD1 3.06Å
1807	L	85.9	Confident	86	Confident	9 Å²	9	28 Å²	28	5%	0.047	14%	0.137	C	C	.	.	H	α-helix	trans	-64.6	-41.4	178	-173.4	64.9	0	0	0	112.2	R1803 Q1804 R1809 Y1810 L1811 I1818 A1845 L1995	R1803-L1807 PolarHBondContact O-N 3.06Å; Q1804-L1807 PolarHBondContact O-N 2.88Å; L1807-R1809 VanDerWaalsContact C-N 3.35Å; L1807-R1809 PolarHBondContact O-N 3.45Å; L1807-Y1810 PolarHBondContact O-N 3.06Å; L1807-L1811 HydrophobicContact CD1-CD1 3.79Å; L1807-L1811 HydrophobicContact CD1-CG 3.9Å; L1807-L1811 HydrophobicContact CG-CD1 4.01Å; L1807-L1811 HydrophobicContact CG-CG 4.33Å; L1807-L1811 WeakPolarHBondContact O-CB 2.96Å; L1807-L1811 WeakPolarHBondContact O-CG 3.06Å; L1807-L1811 PolarHBondContact O-N 2.68Å; L1807-I1818 HydrophobicContact CB-CD1 4.32Å; L1807-I1818 HydrophobicContact CD2-CD1 4.41Å; L1807-I1818 HydrophobicContact CD2-CG2 4.18Å; L1807-I1818 HydrophobicContact CG-CD1 4.42Å; L1807-A1845 HydrophobicContact CD2-CB 4.05Å; L1807-L1995 HydrophobicContact CD1-CD2 4.09Å
1808	A	88.8	Confident	86.1	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-58.5	-45.3	174.7	0	0	0	0	0	111.8	Y1573 Q1804 L1805 H1812 I1813 V1815 I1818	Y1573-A1808 HydrophobicContact CE1-CB 4.01Å; Q1804-A1808 VanDerWaalsContact O-CB 3.22Å; Q1804-A1808 WeakPolarHBondContact O-CB 2.86Å; Q1804-A1808 PolarHBondContact O-N 3.35Å; L1805-A1808 PolarHBondContact O-N 3.31Å; A1808-H1812 CarbonylContact O-C 3.5Å; A1808-H1812 VanDerWaalsContact O-CA 3.32Å; A1808-H1812 WeakPolarHBondContact O-CA 3.2Å; A1808-H1812 PolarHBondContact O-N 3.16Å; A1808-I1813 WeakPolarHBondContact CB-O 3.13Å; A1808-I1813 PolarHBondContact O-N 2.92Å; A1808-V1815 HydrophobicContact CB-CB 3.94Å; A1808-V1815 HydrophobicContact CB-CG2 4.34Å; A1808-I1818 HydrophobicContact CB-CD1 3.89Å
1809	R	89.6	Confident	86	Confident	55 Å²	55	25.8 Å²	25.8	21%	0.208	13%	0.127	C	C	.	.	H	α-helix	trans	-62.7	-53.3	175.7	-69.3	161.8	-167.5	144	-0.2	109.9	L1568 Y1573 L1574 E1802 L1805 E1806 L1807 L1811 H1812	L1568-R1809 HydrophobicContact CD1-CB 3.93Å; L1568-R1809 WeakPolarHBondContact CD1-O 2.82Å; Y1573-R1809 HydrophobicContact CD1-CG 3.99Å; Y1573-R1809 PolarHBondContact O-NE 3.14Å; Y1573-R1809 VanDerWaalsContact O-NE 3.08Å; L1574-R1809 PolarHBondContact O-NH2 3.33Å; E1802-R1809 IonicContact OE1-CZ 2.81Å; E1802-R1809 VanDerWaalsContact OE1-CZ 3.26Å; E1802-R1809 IonicContact OE1-NH1 3.71Å; E1802-R1809 PolarHBondContact OE1-NH1 2.89Å; E1802-R1809 IonicContact OE1-NH2 3.9Å; E1802-R1809 PolarHBondContact OE1-NH2 3.39Å; L1805-R1809 WeakPolarHBondContact O-CB 3.05Å; L1805-R1809 VanDerWaalsContact O-CD 3.3Å; L1805-R1809 WeakPolarHBondContact O-CD 3.22Å; L1805-R1809 WeakPolarHBondContact O-CG 3.22Å; L1805-R1809 PolarHBondContact O-N 2.72Å; E1806-R1809 PolarHBondContact O-N 3.14Å; L1807-R1809 VanDerWaalsContact C-N 3.35Å; L1807-R1809 PolarHBondContact O-N 3.45Å; R1809-L1811 PolarHBondContact O-N 3.15Å; R1809-H1812 PolarHBondContact O-N 3.46Å; R1809-H1812 VanDerWaalsContact O-N 3.14Å; R1809-H1812 PolarHBondContact O-ND1 3.27Å
1810	Y	88.9	Confident	85.6	Confident	31 Å²	31	23.3 Å²	23.3	12%	0.122	10%	0.104	C	C	.	.	H	α-helix	trans	-62.9	-44.7	-176.5	-176	-118.5	0	0	0	113.4	E1806 L1807 H1812 F1853 W1984 N1993 L1995 A1996 Q1999	E1806-Y1810 PolarHBondContact O-N 3Å; L1807-Y1810 PolarHBondContact O-N 3.06Å; Y1810-H1812 PolarHBondContact O-N 3.36Å; Y1810-F1853 HydrophobicContact CD1-CZ 4.34Å; Y1810-F1853 HydrophobicContact CE1-CE2 4.01Å; Y1810-F1853 AromaticContact CE1-CZ 3.98Å; Y1810-F1853 HydrophobicContact CE1-CZ 3.98Å; Y1810-F1853 HydrophobicContact CE2-CZ 4.48Å; Y1810-W1984 VanDerWaalsContact OH-CD1 3.24Å; Y1810-N1993 VanDerWaalsContact CD2-ND2 3.31Å; Y1810-N1993 WeakPolarHBondContact CD2-ND2 3.01Å; Y1810-N1993 WeakPolarHBondContact CE2-ND2 3.47Å; Y1810-L1995 HydrophobicContact CD1-CB 3.52Å; Y1810-L1995 HydrophobicContact CD1-CD1 4.42Å; Y1810-L1995 HydrophobicContact CE1-CB 4.01Å; Y1810-L1995 WeakPolarHBondContact CE1-O 3.25Å; Y1810-L1995 HydrophobicContact CG-CB 3.96Å; Y1810-L1995 HydrophobicContact CG-CD1 4.25Å; Y1810-A1996 WeakPolarHBondContact OH-CA 3.34Å; Y1810-A1996 VanDerWaalsContact OH-CB 3.3Å; Y1810-A1996 WeakPolarHBondContact OH-CB 3.06Å; Y1810-Q1999 HydrophobicContact CE1-CG 3.97Å
1811	L	89	Confident	84.6	Confident	1 Å²	1	24 Å²	24	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-78.8	-4.5	177.2	-59.3	-172.2	0	0	0	113.7	L1807 R1809 I1813 F1853 R1856	L1807-L1811 HydrophobicContact CD1-CD1 3.79Å; L1807-L1811 HydrophobicContact CD1-CG 3.9Å; L1807-L1811 HydrophobicContact CG-CD1 4.01Å; L1807-L1811 HydrophobicContact CG-CG 4.33Å; L1807-L1811 WeakPolarHBondContact O-CB 2.96Å; L1807-L1811 WeakPolarHBondContact O-CG 3.06Å; L1807-L1811 PolarHBondContact O-N 2.68Å; R1809-L1811 PolarHBondContact O-N 3.15Å; L1811-I1813 VanDerWaalsContact C-N 3.34Å; L1811-I1813 HydrophobicContact CB-CD1 4Å; L1811-I1813 HydrophobicContact CB-CG1 3.98Å; L1811-I1813 HydrophobicContact CD1-CD1 3.95Å; L1811-I1813 PolarHBondContact O-N 3.05Å; L1811-F1853 HydrophobicContact CD2-CD2 4.27Å; L1811-F1853 HydrophobicContact CD2-CE2 3.42Å; L1811-F1853 VanDerWaalsContact CD2-CE2 3.42Å; L1811-F1853 HydrophobicContact CD2-CZ 3.93Å; L1811-R1856 PolarHBondContact O-NH1 2.84Å
1812	H	89.5	Confident	83	Confident	50 Å²	50	29.4 Å²	29.4	23%	0.231	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	46.4	-172.6	-56.2	-17.9	0	0	0	113.2	G1534 C1535 F1565 A1808 R1809 Y1810 R1856	G1534-H1812 CarbonylContact C-O 3.33Å; G1534-H1812 WeakPolarHBondContact CA-O 3.35Å; C1535-H1812 PolarHBondContact N-O 3.42Å; F1565-H1812 HydrophobicContact CE2-CB 4Å; F1565-H1812 HydrophobicContact CZ-CB 4.23Å; F1565-H1812 AromaticContact CZ-CD2 3.42Å; F1565-H1812 VanDerWaalsContact CZ-CD2 3.42Å; F1565-H1812 WeakPolarHBondContact CZ-CD2 3.44Å; F1565-H1812 AromaticContact CZ-CG 3.92Å; A1808-H1812 CarbonylContact O-C 3.5Å; A1808-H1812 VanDerWaalsContact O-CA 3.32Å; A1808-H1812 WeakPolarHBondContact O-CA 3.2Å; A1808-H1812 PolarHBondContact O-N 3.16Å; R1809-H1812 PolarHBondContact O-N 3.46Å; R1809-H1812 VanDerWaalsContact O-N 3.14Å; R1809-H1812 PolarHBondContact O-ND1 3.27Å; Y1810-H1812 PolarHBondContact O-N 3.36Å; H1812-R1856 PolarHBondContact O-NH2 2.9Å
1813	I	90.7	Very high	81.3	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.139	C	C	.	.			trans	-122.8	152.4	178.1	58.9	-175.5	0	0	0	112.2	L1530 C1535 A1808 L1811 V1815 I1818 L1848 L1852	L1530-I1813 HydrophobicContact CD2-CG2 4.43Å; C1535-I1813 WeakPolarHBondContact CB-O 3.26Å; A1808-I1813 WeakPolarHBondContact CB-O 3.13Å; A1808-I1813 PolarHBondContact O-N 2.92Å; L1811-I1813 VanDerWaalsContact C-N 3.34Å; L1811-I1813 HydrophobicContact CB-CD1 4Å; L1811-I1813 HydrophobicContact CB-CG1 3.98Å; L1811-I1813 HydrophobicContact CD1-CD1 3.95Å; L1811-I1813 PolarHBondContact O-N 3.05Å; I1813-V1815 PolarHBondContact O-N 3.11Å; I1813-I1818 HydrophobicContact CD1-CG1 3.86Å; I1813-I1818 HydrophobicContact CG1-CG1 4.21Å; I1813-L1848 HydrophobicContact CD1-CD2 4.13Å; I1813-L1852 HydrophobicContact CG2-CD1 3.39Å
1814	P	92.3	Very high	79.4	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.146	C	C	.	.			trans	-60.4	134	173.4	-23	36.2	0	0	0	111.3	V1402 I1403 I1405 L1530 Y1573 G1816 N1817	V1402-P1814 HydrophobicContact CB-CB 4.31Å; V1402-P1814 HydrophobicContact CB-CG 3.9Å; V1402-P1814 HydrophobicContact CG1-CB 3.97Å; V1402-P1814 HydrophobicContact CG1-CG 3.6Å; V1402-P1814 WeakPolarHBondContact O-CB 3.43Å; I1403-P1814 WeakPolarHBondContact O-CB 3.3Å; I1405-P1814 HydrophobicContact CD1-CG 3.98Å; I1405-P1814 HydrophobicContact CG1-CG 3.94Å; L1530-P1814 HydrophobicContact CD2-CG 4.35Å; Y1573-P1814 WeakPolarHBondContact OH-CA 3.02Å; P1814-G1816 VanDerWaalsContact C-N 3.29Å; P1814-G1816 PolarHBondContact O-N 3.2Å; P1814-N1817 WeakPolarHBondContact CB-OD1 3.44Å; P1814-N1817 PolarHBondContact O-N 3.11Å
1815	V	89.7	Confident	77.1	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.012	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-59.8	-34.4	-173.4	63.1	0	0	0	0	113.5	I1403 Y1573 L1574 I1754 L1801 Q1804 L1805 A1808 I1813 N1817 I1818	I1403-V1815 HydrophobicContact CG2-CG1 4.22Å; I1403-V1815 PolarHBondContact O-N 3.45Å; Y1573-V1815 PolarHBondContact OH-N 3.42Å; L1574-V1815 HydrophobicContact CD1-CG1 4.19Å; I1754-V1815 HydrophobicContact CD1-CG1 3.57Å; I1754-V1815 HydrophobicContact CD1-CG2 4.48Å; I1754-V1815 HydrophobicContact CG1-CG1 4.09Å; I1754-V1815 HydrophobicContact CG2-CG2 4.13Å; L1801-V1815 HydrophobicContact CD1-CG2 4.45Å; Q1804-V1815 HydrophobicContact CB-CG2 3.91Å; L1805-V1815 HydrophobicContact CD2-CB 3.91Å; L1805-V1815 HydrophobicContact CD2-CG1 4.02Å; L1805-V1815 HydrophobicContact CD2-CG2 3.86Å; L1805-V1815 HydrophobicContact CG-CG2 4.21Å; A1808-V1815 HydrophobicContact CB-CB 3.94Å; A1808-V1815 HydrophobicContact CB-CG2 4.34Å; I1813-V1815 PolarHBondContact O-N 3.11Å; V1815-N1817 PolarHBondContact O-N 2.87Å; V1815-I1818 HydrophobicContact CG2-CD1 4.43Å; V1815-I1818 PolarHBondContact O-N 3.12Å
1816	G	88.3	Confident	74.7	Confident	2 Å²	2	38.1 Å²	38.1	2%	0.021	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-67.4	-19.5	176.2	0	0	0	0	0	114.6	I1403 R1739 P1814	I1403-G1816 PolarHBondContact O-N 3.45Å; R1739-G1816 PolarHBondContact NH1-O 2.95Å; P1814-G1816 VanDerWaalsContact C-N 3.29Å; P1814-G1816 PolarHBondContact O-N 3.2Å
1817	N	91.1	Very high	72.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-93.5	5.8	-179.2	-66.3	98.8	0	0	0	113.9	E1404 I1405 L1530 I1736 P1814 V1815	E1404-N1817 WeakPolarHBondContact CA-OD1 3.44Å; I1405-N1817 PolarHBondContact N-OD1 3.34Å; I1405-N1817 PolarHBondContact O-ND2 3.34Å; L1530-N1817 HydrophobicContact CD2-CB 4.03Å; I1736-N1817 WeakPolarHBondContact CD1-ND2 3.48Å; P1814-N1817 WeakPolarHBondContact CB-OD1 3.44Å; P1814-N1817 PolarHBondContact O-N 3.11Å; V1815-N1817 PolarHBondContact O-N 2.87Å
1818	I	86	Confident	70.1	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.015	25%	0.246	C	C	.	.			trans	-69.6	132.6	176.3	-70.8	175.8	0	0	0	110.7	R1739 Q1804 L1807 A1808 I1813 V1815 A1845	R1739-I1818 PolarHBondContact NH1-O 2.87Å; R1739-I1818 PolarHBondContact NH2-O 2.65Å; Q1804-I1818 HydrophobicContact CB-CD1 4.3Å; Q1804-I1818 WeakPolarHBondContact O-CD1 3.25Å; L1807-I1818 HydrophobicContact CB-CD1 4.32Å; L1807-I1818 HydrophobicContact CD2-CD1 4.41Å; L1807-I1818 HydrophobicContact CD2-CG2 4.18Å; L1807-I1818 HydrophobicContact CG-CD1 4.42Å; A1808-I1818 HydrophobicContact CB-CD1 3.89Å; I1813-I1818 HydrophobicContact CD1-CG1 3.86Å; I1813-I1818 HydrophobicContact CG1-CG1 4.21Å; V1815-I1818 HydrophobicContact CG2-CD1 4.43Å; V1815-I1818 PolarHBondContact O-N 3.12Å; I1818-A1845 HydrophobicContact CG2-CB 4.23Å
1819	P	78.6	Confident	67.4	Low	5 Å²	5	51.4 Å²	51.4	3%	0.032	28%	0.284	C	S	.	.			trans	-65	132.5	167.1	-20.5	32.1	0	0	0	111.5	L1732 S1842 N1844 A1845 L1848	L1732-P1819 HydrophobicContact CD1-CG 4.07Å; L1732-P1819 HydrophobicContact CD2-CG 4.33Å; P1819-S1842 PolarHBondContact O-OG 2.85Å; P1819-N1844 HydrophobicContact CB-CB 3.66Å; P1819-N1844 HydrophobicContact CG-CB 4.42Å; P1819-A1845 HydrophobicContact CB-CB 4.23Å; P1819-A1845 HydrophobicContact CG-CB 4.22Å; P1819-L1848 HydrophobicContact CG-CB 4.33Å; P1819-L1848 HydrophobicContact CG-CD2 3.65Å
1820	V	68.6	Low	64.6	Low	22 Å²	22	54.9 Å²	54.9	13%	0.133	31%	0.312	C	S	.	.			trans	-125.3	132.8	-179.4	-95.3	0	0	0	0	111.3	Q1755	Q1755-V1820 HydrophobicContact CB-CG2 3.97Å; Q1755-V1820 VanDerWaalsContact CD-CG2 3.48Å; Q1755-V1820 HydrophobicContact CG-CG2 3.86Å
1821	S	58.5	Low	61.8	Low	46 Å²	46	58.3 Å²	58.3	32%	0.322	35%	0.346	S	S	.	.			trans	-95	139.9	-175.9	179.1	0	0	0	0	112.2	G1758	G1758-S1821 PolarHBondContact N-O 2.74Å; G1758-S1821 VanDerWaalsContact N-O 3.11Å
1822	E	52.5	Low	59.1	Low	121 Å²	121	63.6 Å²	63.6	57%	0.565	38%	0.381	S	S	*	.			trans	-81.5	106.7	151.7	-62.1	-170.1	173.2	0	0	107.2	L1714	L1714-E1822 PolarHBondContact N-OE1 3.45Å; L1714-E1822 VanDerWaalsContact N-OE1 3.08Å
1823	A	44.9	Very low	56.3	Low	46 Å²	46	67 Å²	67	38%	0.38	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-76.2	139.6	-175.9	0	0	0	0	0	111.1	T1759	T1759-A1823 WeakPolarHBondContact OG1-CB 3.24Å; T1759-A1823 PolarHBondContact OG1-O 2.88Å
1824	P	39.9	Very low	53.3	Low	67 Å²	67	76 Å²	76	44%	0.435	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-67.1	154.6	-171.1	27.6	-35.8	0	0	0	113.1	P1826 T2481	P1824-P1826 WeakPolarHBondContact O-CD 3.32Å; P1824-T2481 HydrophobicContact CG-CG2 4.09Å
1825	L	36	Very low	50.3	Low	153 Å²	153	83.4 Å²	83.4	80%	0.801	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-64.9	122.9	-178.1	-67.9	168.4	0	0	0	111.9
1826	P	36.3	Very low	47.5	Very low	108 Å²	108	90.1 Å²	90.1	70%	0.701	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-68.5	138.3	168.3	-18.2	32.6	0	0	0	111.3	P1824	P1824-P1826 WeakPolarHBondContact O-CD 3.32Å
1827	V	38.3	Very low	44.8	Very low	74 Å²	74	97.6 Å²	97.6	45%	0.448	56%	0.561	S	S	.	*			trans	-95.1	101.9	175.4	-179.5	0	0	0	0	108.9	L1829 V2482	V1827-L1829 HydrophobicContact CG1-CD1 4.39Å; V1827-L1829 PolarHBondContact O-N 2.95Å; V1827-V2482 HydrophobicContact CG2-CG2 3.8Å
1828	L	34.2	Very low	42.1	Very low	140 Å²	140	102.9 Å²	102.9	73%	0.733	60%	0.595	S	S	*	*			trans	-83.8	109.3	-173.6	-163.9	80.8	0	0	0	111.8
1829	L	33.5	Very low	40	Very low	153 Å²	153	106.3 Å²	106.3	80%	0.801	62%	0.617	S	S	*	*			trans	-134.9	13.4	177.2	-77.4	177.2	0	0	0	115.2	V1827	V1827-L1829 HydrophobicContact CG1-CD1 4.39Å; V1827-L1829 PolarHBondContact O-N 2.95Å
1830	T	30	Very low	38.3	Very low	128 Å²	128	109.9 Å²	109.9	79%	0.785	65%	0.647	S	S	*	*	S	Bend	trans	-158	164.2	164.9	21.4	0	0	0	0	111
1831	A	30	Very low	37.3	Very low	102 Å²	102	110 Å²	110	84%	0.843	65%	0.649	S	S	*	*			trans	-87.2	122.4	-177.3	0	0	0	0	0	112
1832	P	32.9	Very low	37.5	Very low	112 Å²	112	108.5 Å²	108.5	73%	0.727	64%	0.639	S	S	*	*			trans	-90.5	152.3	177.8	35	-33.5	0	0	0	113
1833	S	29.7	Very low	38.1	Very low	121 Å²	121	103.9 Å²	103.9	85%	0.846	62%	0.618	S	S	*	*			trans	-80.5	174.1	171.7	44.6	0	0	0	0	112.7
1834	Q	28.1	Very low	39.4	Very low	190 Å²	190	104.9 Å²	104.9	89%	0.888	62%	0.616	S	S	*	*			trans	-81.1	124.1	-170.9	-64.7	166.3	-32.6	0	0	112.6
1835	D	28.5	Very low	41.2	Very low	157 Å²	157	101.7 Å²	101.7	84%	0.84	60%	0.596	S	S	*	*				-168.7	141.5	129	-103.4	-26.4	0	0	0	110.8	Q1837	D1835-Q1837 PolarHBondContact O-N 2.68Å
1836	I	31	Very low	43.3	Very low	143 Å²	143	94.4 Å²	94.4	73%	0.733	56%	0.558	S	S	*	*			trans	-88.1	91.3	-172.1	-54.1	175.1	0	0	0	110
1837	Q	32.7	Very low	45.5	Very low	159 Å²	159	90.6 Å²	90.6	74%	0.743	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-77.9	139.7	173.4	-70.3	-169.9	-13.3	0	0	112.1	D1835	D1835-Q1837 PolarHBondContact O-N 2.68Å
1838	P	34.4	Very low	47.9	Very low	111 Å²	111	87.4 Å²	87.4	72%	0.721	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-70.5	154.5	177.7	30	-35.3	0	0	0	112.1	A1840	P1838-A1840 PolarHBondContact O-N 2.99Å
1839	P	41.8	Very low	50.4	Low	75 Å²	75	80.7 Å²	80.7	49%	0.487	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-67.3	123.9	-178.1	27	-34.5	0	0	0	112	M1760	M1760-P1839 HydrophobicContact SD-CB 4.21Å; M1760-P1839 HydrophobicContact SD-CG 4.38Å
1840	A	43.1	Very low	53.1	Low	79 Å²	79	73.4 Å²	73.4	65%	0.653	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-62.5	155.6	177.6	0	0	0	0	0	113.1	P1838	P1838-A1840 PolarHBondContact O-N 2.99Å
1841	S	47.9	Very low	56.1	Low	24 Å²	24	67.6 Å²	67.6	17%	0.168	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-71.6	158.3	175.4	60.4	0	0	0	0	112.5	I1846 E1998	S1841-I1846 WeakPolarHBondContact OG-CD1 3.33Å; S1841-E1998 VanDerWaalsContact CB-OE2 3.27Å; S1841-E1998 WeakPolarHBondContact CB-OE2 3.31Å; S1841-E1998 VanDerWaalsContact OG-CD 3.24Å; S1841-E1998 PolarHBondContact OG-OE2 3.49Å
1842	S	61.6	Low	59	Low	16 Å²	16	62.8 Å²	62.8	11%	0.112	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-75.2	126.2	179.3	33	0	0	0	0	111	P1819 N1844 A1845 I1846	P1819-S1842 PolarHBondContact O-OG 2.85Å; S1842-N1844 PolarHBondContact O-N 2.8Å; S1842-N1844 VanDerWaalsContact O-N 3.09Å; S1842-A1845 WeakPolarHBondContact O-CA 3.32Å; S1842-A1845 WeakPolarHBondContact O-CB 3.23Å; S1842-A1845 PolarHBondContact O-N 3.39Å; S1842-A1845 WeakPolarHBondContact OG-CB 3.24Å; S1842-I1846 PolarHBondContact O-N 3.49Å
1843	I	65.7	Low	61.8	Low	24 Å²	24	58.9 Å²	58.9	12%	0.123	33%	0.333	C	S	.	.	H	α-helix	trans	-45.5	-46.7	176.7	-61.1	177	0	0	0	112	A1845 I1846 E1847 Y2002 Q2005 P2436	I1843-A1845 PolarHBondContact O-N 2.72Å; I1843-A1845 VanDerWaalsContact O-N 3.16Å; I1843-I1846 CarbonylContact O-C 3.59Å; I1843-I1846 WeakPolarHBondContact O-CA 3.45Å; I1843-I1846 WeakPolarHBondContact O-CB 3.46Å; I1843-I1846 PolarHBondContact O-N 3.21Å; I1843-E1847 HydrophobicContact CG2-CG 4.15Å; I1843-E1847 PolarHBondContact O-N 2.67Å; I1843-Y2002 HydrophobicContact CD1-CE1 4.34Å; I1843-Y2002 HydrophobicContact CG1-CE1 4.02Å; I1843-Q2005 VanDerWaalsContact CG2-NE2 3.28Å; I1843-P2436 HydrophobicContact CD1-CB 3.83Å
1844	N	71.9	Confident	64.9	Low	66 Å²	66	53.2 Å²	53.2	35%	0.353	29%	0.293	S	S	.	.	H	α-helix	trans	-56.6	-31.9	179	-57.5	19.6	0	0	0	113.1	P1819 S1842 L1848	P1819-N1844 HydrophobicContact CB-CB 3.66Å; P1819-N1844 HydrophobicContact CG-CB 4.42Å; S1842-N1844 PolarHBondContact O-N 2.8Å; S1842-N1844 VanDerWaalsContact O-N 3.09Å; N1844-L1848 VanDerWaalsContact O-CB 3.25Å; N1844-L1848 WeakPolarHBondContact O-CB 3.24Å; N1844-L1848 PolarHBondContact O-N 2.87Å
1845	A	77.1	Confident	67.9	Low	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-80.4	-27.2	175.8	0	0	0	0	0	112.5	L1807 I1818 P1819 S1842 I1843 G1849	L1807-A1845 HydrophobicContact CD2-CB 4.05Å; I1818-A1845 HydrophobicContact CG2-CB 4.23Å; P1819-A1845 HydrophobicContact CB-CB 4.23Å; P1819-A1845 HydrophobicContact CG-CB 4.22Å; S1842-A1845 WeakPolarHBondContact O-CA 3.32Å; S1842-A1845 WeakPolarHBondContact O-CB 3.23Å; S1842-A1845 PolarHBondContact O-N 3.39Å; S1842-A1845 WeakPolarHBondContact OG-CB 3.24Å; I1843-A1845 PolarHBondContact O-N 2.72Å; I1843-A1845 VanDerWaalsContact O-N 3.16Å; A1845-G1849 PolarHBondContact O-N 3.36Å
1846	I	80.2	Confident	70.9	Confident	1 Å²	1	39 Å²	39	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-74.4	-45.9	173.5	-45.8	172.9	0	0	0	109.8	S1841 S1842 I1843 L1848 G1849 C1850 Q1999 Y2002	S1841-I1846 WeakPolarHBondContact OG-CD1 3.33Å; S1842-I1846 PolarHBondContact O-N 3.49Å; I1843-I1846 CarbonylContact O-C 3.59Å; I1843-I1846 WeakPolarHBondContact O-CA 3.45Å; I1843-I1846 WeakPolarHBondContact O-CB 3.46Å; I1843-I1846 PolarHBondContact O-N 3.21Å; I1846-L1848 PolarHBondContact O-N 2.88Å; I1846-G1849 WeakPolarHBondContact O-CA 3.12Å; I1846-G1849 PolarHBondContact O-N 3.5Å; I1846-C1850 PolarHBondContact O-N 3.04Å; I1846-C1850 PolarHBondContact O-SG 2.62Å; I1846-Q1999 PolarHBondContact O-OE1 2.66Å; I1846-Y2002 HydrophobicContact CD1-CD2 3.34Å; I1846-Y2002 HydrophobicContact CD1-CE2 3.55Å; I1846-Y2002 HydrophobicContact CD1-CG 3.87Å; I1846-Y2002 HydrophobicContact CG2-CD2 4.35Å; I1846-Y2002 HydrophobicContact CG2-CG 4.34Å
1847	E	84	Confident	73.8	Confident	27 Å²	27	34.1 Å²	34.1	13%	0.126	19%	0.194	C	C	.	.	H	α-helix	trans	-57.3	-45.6	171.2	-72.1	-179.8	139	0	0	111.7	I1843 G1849 C1850 D1851 W2006 S2009	I1843-E1847 HydrophobicContact CG2-CG 4.15Å; I1843-E1847 PolarHBondContact O-N 2.67Å; E1847-G1849 VanDerWaalsContact C-N 3.29Å; E1847-G1849 PolarHBondContact O-N 3.32Å; E1847-C1850 PolarHBondContact O-N 3.1Å; E1847-D1851 PolarHBondContact O-N 3.42Å; E1847-W2006 HydrophobicContact CG-CB 4.46Å; E1847-S2009 WeakPolarHBondContact OE1-CB 3.43Å; E1847-S2009 PolarHBondContact OE1-OG 2.85Å
1848	L	87.1	Confident	76.6	Confident	7 Å²	7	26.6 Å²	26.6	4%	0.037	16%	0.159	C	C	.	.	H	α-helix	trans	-60.5	-38.1	172.7	176.4	65.6	0	0	0	112.2	F1527 W1730 L1732 I1813 P1819 N1844 I1846 L1852	F1527-L1848 HydrophobicContact CD2-CD1 4.4Å; F1527-L1848 HydrophobicContact CE2-CD1 4.45Å; W1730-L1848 HydrophobicContact CH2-CD1 3.8Å; W1730-L1848 HydrophobicContact CZ2-CD1 3.8Å; L1732-L1848 HydrophobicContact CD2-CD2 3.98Å; I1813-L1848 HydrophobicContact CD1-CD2 4.13Å; P1819-L1848 HydrophobicContact CG-CB 4.33Å; P1819-L1848 HydrophobicContact CG-CD2 3.65Å; N1844-L1848 VanDerWaalsContact O-CB 3.25Å; N1844-L1848 WeakPolarHBondContact O-CB 3.24Å; N1844-L1848 PolarHBondContact O-N 2.87Å; I1846-L1848 PolarHBondContact O-N 2.88Å; L1848-L1852 HydrophobicContact CD1-CD1 3.9Å; L1848-L1852 HydrophobicContact CD1-CG 4.05Å; L1848-L1852 HydrophobicContact CD2-CD1 4.46Å; L1848-L1852 HydrophobicContact CG-CD1 3.82Å; L1848-L1852 HydrophobicContact CG-CG 4.38Å; L1848-L1852 WeakPolarHBondContact O-CB 3.42Å; L1848-L1852 VanDerWaalsContact O-CG 3.25Å; L1848-L1852 WeakPolarHBondContact O-CG 3.4Å; L1848-L1852 PolarHBondContact O-N 3.33Å
1849	G	88.2	Confident	79	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60	-52.7	174.9	0	0	0	0	0	111.6	A1845 I1846 E1847 D1851 L1852 F1853	A1845-G1849 PolarHBondContact O-N 3.36Å; I1846-G1849 WeakPolarHBondContact O-CA 3.12Å; I1846-G1849 PolarHBondContact O-N 3.5Å; E1847-G1849 VanDerWaalsContact C-N 3.29Å; E1847-G1849 PolarHBondContact O-N 3.32Å; G1849-D1851 PolarHBondContact O-N 2.91Å; G1849-L1852 PolarHBondContact O-N 3.47Å; G1849-F1853 WeakPolarHBondContact O-CB 3.36Å; G1849-F1853 WeakPolarHBondContact O-CD2 3.36Å; G1849-F1853 WeakPolarHBondContact O-CG 3.31Å; G1849-F1853 PolarHBondContact O-N 2.78Å
1850	C	89.8	Confident	81.1	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-57.9	-47.4	175.4	-66.7	0	0	0	0	112.3	I1846 E1847 L1852 F1853 Y1854 W1984 Q1999 W2006	I1846-C1850 PolarHBondContact O-N 3.04Å; I1846-C1850 PolarHBondContact O-SG 2.62Å; E1847-C1850 PolarHBondContact O-N 3.1Å; C1850-L1852 PolarHBondContact O-N 3.07Å; C1850-F1853 PolarHBondContact O-N 2.95Å; C1850-Y1854 VanDerWaalsContact O-CB 3.27Å; C1850-Y1854 WeakPolarHBondContact O-CB 3.29Å; C1850-Y1854 PolarHBondContact O-N 3.14Å; C1850-W1984 HydrophobicContact CB-CH2 4.27Å; C1850-W1984 VanDerWaalsContact SG-CH2 3.6Å; C1850-Q1999 VanDerWaalsContact N-OE1 3.17Å; C1850-Q1999 PolarHBondContact SG-OE1 2.93Å; C1850-W2006 HydrophobicContact CB-CB 4.09Å; C1850-W2006 HydrophobicContact CB-CD2 3.35Å; C1850-W2006 VanDerWaalsContact CB-CE2 3.42Å; C1850-W2006 HydrophobicContact CB-CE3 4.04Å; C1850-W2006 HydrophobicContact CB-CG 3.34Å; C1850-W2006 HydrophobicContact CB-CZ2 4.15Å
1851	D	92.2	Very high	83	Confident	6 Å²	6	28.5 Å²	28.5	3%	0.032	14%	0.14	C	C	.	.	H	α-helix	trans	-57.9	-46.1	176.6	-81.1	-16.9	0	0	0	111.5	F1527 E1847 G1849 A1855 W2006 S2012 L2013 F2014	F1527-D1851 HydrophobicContact CE2-CB 4.03Å; F1527-D1851 HydrophobicContact CZ-CB 4.29Å; E1847-D1851 PolarHBondContact O-N 3.42Å; G1849-D1851 PolarHBondContact O-N 2.91Å; D1851-A1855 WeakPolarHBondContact O-CB 3.33Å; D1851-A1855 PolarHBondContact O-N 2.97Å; D1851-W2006 PolarHBondContact OD1-NE1 3.04Å; D1851-S2012 PolarHBondContact OD1-OG 2.86Å; D1851-L2013 PolarHBondContact OD1-N 2.97Å; D1851-L2013 WeakPolarHBondContact OD2-CB 3.5Å; D1851-L2013 PolarHBondContact OD2-N 3.38Å; D1851-F2014 HydrophobicContact CB-CD2 4.21Å
1852	L	91.1	Very high	84.8	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-68.5	-42.7	179.7	-75.6	168.9	0	0	0	112.9	F1527 L1530 M1531 I1813 L1848 G1849 C1850 R1856	F1527-L1852 HydrophobicContact CD2-CD2 4.05Å; F1527-L1852 HydrophobicContact CE2-CD2 3.53Å; F1527-L1852 HydrophobicContact CE2-CG 3.84Å; F1527-L1852 HydrophobicContact CZ-CD2 4.02Å; F1527-L1852 HydrophobicContact CZ-CG 4.48Å; L1530-L1852 HydrophobicContact CB-CD2 4.12Å; M1531-L1852 HydrophobicContact CB-CD2 4.25Å; I1813-L1852 HydrophobicContact CG2-CD1 3.39Å; L1848-L1852 HydrophobicContact CD1-CD1 3.9Å; L1848-L1852 HydrophobicContact CD1-CG 4.05Å; L1848-L1852 HydrophobicContact CD2-CD1 4.46Å; L1848-L1852 HydrophobicContact CG-CD1 3.82Å; L1848-L1852 HydrophobicContact CG-CG 4.38Å; L1848-L1852 WeakPolarHBondContact O-CB 3.42Å; L1848-L1852 VanDerWaalsContact O-CG 3.25Å; L1848-L1852 WeakPolarHBondContact O-CG 3.4Å; L1848-L1852 PolarHBondContact O-N 3.33Å; G1849-L1852 PolarHBondContact O-N 3.47Å; C1850-L1852 PolarHBondContact O-N 3.07Å; L1852-R1856 WeakPolarHBondContact O-CB 3.46Å; L1852-R1856 WeakPolarHBondContact O-CD 3.47Å; L1852-R1856 WeakPolarHBondContact O-CG 3.37Å; L1852-R1856 PolarHBondContact O-N 3.38Å
1853	F	92.6	Very high	86	Confident	29 Å²	29	30.9 Å²	30.9	13%	0.127	15%	0.149	C	C	.	.	H	α-helix	trans	-63.1	-46.2	175.4	-76.8	-57.2	0	0	0	110.4	Y1810 L1811 G1849 C1850 R1856 H1857 M1980 W1984 Q1999	Y1810-F1853 HydrophobicContact CD1-CZ 4.34Å; Y1810-F1853 HydrophobicContact CE1-CE2 4.01Å; Y1810-F1853 AromaticContact CE1-CZ 3.98Å; Y1810-F1853 HydrophobicContact CE1-CZ 3.98Å; Y1810-F1853 HydrophobicContact CE2-CZ 4.48Å; L1811-F1853 HydrophobicContact CD2-CD2 4.27Å; L1811-F1853 HydrophobicContact CD2-CE2 3.42Å; L1811-F1853 VanDerWaalsContact CD2-CE2 3.42Å; L1811-F1853 HydrophobicContact CD2-CZ 3.93Å; G1849-F1853 WeakPolarHBondContact O-CB 3.36Å; G1849-F1853 WeakPolarHBondContact O-CD2 3.36Å; G1849-F1853 WeakPolarHBondContact O-CG 3.31Å; G1849-F1853 PolarHBondContact O-N 2.78Å; C1850-F1853 PolarHBondContact O-N 2.95Å; F1853-R1856 PolarHBondContact O-N 3.02Å; F1853-H1857 WeakPolarHBondContact O-CB 3.49Å; F1853-H1857 PolarHBondContact O-CD2 2.7Å; F1853-H1857 VanDerWaalsContact O-CD2 3.3Å; F1853-H1857 PolarHBondContact O-N 2.96Å; F1853-M1980 HydrophobicContact CB-CG 4.25Å; F1853-M1980 HydrophobicContact CB-SD 3.66Å; F1853-W1984 HydrophobicContact CB-CZ2 3.93Å; F1853-W1984 AromaticContact CD2-CE2 3.87Å; F1853-W1984 AromaticContact CD2-CZ2 3.6Å; F1853-W1984 HydrophobicContact CD2-CZ2 3.6Å; F1853-W1984 AromaticContact CD2-NE1 3.57Å; F1853-W1984 HydrophobicContact CE2-CZ2 4.42Å; F1853-W1984 AromaticContact CE2-NE1 3.72Å; F1853-W1984 HydrophobicContact CG-CZ2 4.05Å; F1853-W1984 AromaticContact CG-NE1 3.91Å; F1853-Q1999 HydrophobicContact CE2-CG 4.37Å
1854	Y	94.2	Very high	87.1	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.008	14%	0.144	C	C	.	.	H	α-helix	trans	-67	-43.7	-178.1	-165.3	-132.9	0	0	0	111.7	C1850 R1856 H1857 L1858 W1866 A1973 I1976 L1977 M1980 W2006 F2014 L2019	C1850-Y1854 VanDerWaalsContact O-CB 3.27Å; C1850-Y1854 WeakPolarHBondContact O-CB 3.29Å; C1850-Y1854 PolarHBondContact O-N 3.14Å; Y1854-R1856 PolarHBondContact O-N 3.02Å; Y1854-H1857 PolarHBondContact O-N 3.12Å; Y1854-L1858 HydrophobicContact CD1-CD1 3.84Å; Y1854-L1858 HydrophobicContact CD2-CG 4.45Å; Y1854-L1858 HydrophobicContact CE1-CD1 3.77Å; Y1854-L1858 HydrophobicContact CE1-CG 4.41Å; Y1854-L1858 HydrophobicContact CE2-CD2 4.35Å; Y1854-L1858 HydrophobicContact CE2-CG 4.3Å; Y1854-L1858 HydrophobicContact CG-CD1 4.28Å; Y1854-L1858 WeakPolarHBondContact O-CB 3.4Å; Y1854-L1858 VanDerWaalsContact O-CG 3.32Å; Y1854-L1858 WeakPolarHBondContact O-CG 3.38Å; Y1854-L1858 PolarHBondContact O-N 3.04Å; Y1854-W1866 HydrophobicContact CE1-CH2 4.21Å; Y1854-W1866 AromaticContact CE1-CZ2 3.67Å; Y1854-W1866 HydrophobicContact CE1-CZ2 3.67Å; Y1854-A1973 PolarHBondContact OH-O 2.94Å; Y1854-I1976 HydrophobicContact CD2-CG2 4.43Å; Y1854-I1976 HydrophobicContact CE2-CB 4.46Å; Y1854-I1976 HydrophobicContact CE2-CG2 4.05Å; Y1854-L1977 HydrophobicContact CD2-CD1 4.34Å; Y1854-L1977 HydrophobicContact CE2-CB 3.88Å; Y1854-L1977 HydrophobicContact CE2-CD1 4.03Å; Y1854-M1980 VanDerWaalsContact CA-SD 3.58Å; Y1854-M1980 HydrophobicContact CD2-CE 4.09Å; Y1854-M1980 HydrophobicContact CD2-SD 4.11Å; Y1854-M1980 HydrophobicContact CG-CE 4.34Å; Y1854-M1980 HydrophobicContact CG-SD 4.37Å; Y1854-M1980 PolarHBondContact N-SD 3.48Å; Y1854-M1980 VanDerWaalsContact N-SD 3.39Å; Y1854-W2006 AromaticContact CD1-CH2 3.72Å; Y1854-W2006 HydrophobicContact CD1-CH2 3.72Å; Y1854-W2006 HydrophobicContact CD1-CZ2 4.03Å; Y1854-W2006 HydrophobicContact CE1-CH2 4.33Å; Y1854-W2006 AromaticContact CG-CH2 3.87Å; Y1854-W2006 HydrophobicContact CG-CH2 3.87Å; Y1854-W2006 HydrophobicContact CG-CZ2 4.28Å; Y1854-F2014 HydrophobicContact CD1-CB 3.82Å; Y1854-F2014 HydrophobicContact CD1-CD1 4.06Å; Y1854-F2014 AromaticContact CD1-CG 3.9Å; Y1854-F2014 HydrophobicContact CD1-CG 3.9Å; Y1854-F2014 HydrophobicContact CE1-CB 4.24Å; Y1854-F2014 HydrophobicContact CE1-CD1 4.4Å; Y1854-L2019 WeakPolarHBondContact OH-CD1 3.43Å
1855	A	91.3	Very high	88	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-57.7	-47.9	173.5	0	0	0	0	0	112.5	F1527 M1531 D1851 H1857 L1858 V1859 F2014	F1527-A1855 HydrophobicContact CE1-CB 3.89Å; F1527-A1855 HydrophobicContact CZ-CB 3.75Å; M1531-A1855 HydrophobicContact CG-CB 4.25Å; M1531-A1855 HydrophobicContact SD-CB 3.67Å; D1851-A1855 WeakPolarHBondContact O-CB 3.33Å; D1851-A1855 PolarHBondContact O-N 2.97Å; A1855-H1857 VanDerWaalsContact C-N 3.29Å; A1855-H1857 PolarHBondContact O-N 2.86Å; A1855-L1858 PolarHBondContact O-N 3.41Å; A1855-V1859 WeakPolarHBondContact O-CG2 3.34Å; A1855-V1859 PolarHBondContact O-N 3.21Å; A1855-F2014 HydrophobicContact CB-CE2 3.68Å; A1855-F2014 HydrophobicContact CB-CZ 3.53Å
1856	R	91.9	Very high	88.6	Confident	50 Å²	50	27 Å²	27	19%	0.189	13%	0.128	C	C	.	.	H	α-helix	trans	-62.5	-36.4	177.4	-71.9	167.8	-179.6	156.1	-1.3	111.9	L1530 M1531 L1811 H1812 L1852 F1853 Y1854 K1860	L1530-R1856 PolarHBondContact O-NH2 3.25Å; M1531-R1856 HydrophobicContact CG-CG 3.97Å; M1531-R1856 PolarHBondContact O-NE 2.94Å; L1811-R1856 PolarHBondContact O-NH1 2.84Å; H1812-R1856 PolarHBondContact O-NH2 2.9Å; L1852-R1856 WeakPolarHBondContact O-CB 3.46Å; L1852-R1856 WeakPolarHBondContact O-CD 3.47Å; L1852-R1856 WeakPolarHBondContact O-CG 3.37Å; L1852-R1856 PolarHBondContact O-N 3.38Å; F1853-R1856 PolarHBondContact O-N 3.02Å; Y1854-R1856 PolarHBondContact O-N 3.02Å; R1856-K1860 WeakPolarHBondContact O-CB 3.42Å; R1856-K1860 PolarHBondContact O-N 3.3Å; R1856-K1860 VanDerWaalsContact O-N 3.11Å
1857	H	90.9	Very high	88.8	Confident	40 Å²	40	26.9 Å²	26.9	19%	0.185	13%	0.128	C	C	.	.	H	α-helix	trans	-68.6	-41.5	173.7	-93.5	-94	0	0	0	112.7	F1853 Y1854 A1855 K1860 H1861 I1976	F1853-H1857 WeakPolarHBondContact O-CB 3.49Å; F1853-H1857 PolarHBondContact O-CD2 2.7Å; F1853-H1857 VanDerWaalsContact O-CD2 3.3Å; F1853-H1857 PolarHBondContact O-N 2.96Å; Y1854-H1857 PolarHBondContact O-N 3.12Å; A1855-H1857 VanDerWaalsContact C-N 3.29Å; A1855-H1857 PolarHBondContact O-N 2.86Å; H1857-K1860 PolarHBondContact O-N 2.78Å; H1857-H1861 PolarHBondContact O-CD2 3.44Å; H1857-H1861 PolarHBondContact O-N 3.1Å; H1857-I1976 HydrophobicContact CB-CG2 3.72Å
1858	L	90.8	Very high	88.7	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64	-50.5	176.5	-73.1	170.9	0	0	0	111.7	Y1854 A1855 K1860 H1861 N1862 H1863 L1865 W1866 I1976 F2014	Y1854-L1858 HydrophobicContact CD1-CD1 3.84Å; Y1854-L1858 HydrophobicContact CD2-CG 4.45Å; Y1854-L1858 HydrophobicContact CE1-CD1 3.77Å; Y1854-L1858 HydrophobicContact CE1-CG 4.41Å; Y1854-L1858 HydrophobicContact CE2-CD2 4.35Å; Y1854-L1858 HydrophobicContact CE2-CG 4.3Å; Y1854-L1858 HydrophobicContact CG-CD1 4.28Å; Y1854-L1858 WeakPolarHBondContact O-CB 3.4Å; Y1854-L1858 VanDerWaalsContact O-CG 3.32Å; Y1854-L1858 WeakPolarHBondContact O-CG 3.38Å; Y1854-L1858 PolarHBondContact O-N 3.04Å; A1855-L1858 PolarHBondContact O-N 3.41Å; L1858-K1860 VanDerWaalsContact C-N 3.31Å; L1858-K1860 PolarHBondContact O-N 3.45Å; L1858-H1861 CarbonylContact O-C 3.52Å; L1858-H1861 WeakPolarHBondContact O-CA 3.33Å; L1858-H1861 PolarHBondContact O-N 3.46Å; L1858-N1862 PolarHBondContact O-N 2.82Å; L1858-H1863 HydrophobicContact CB-CB 3.98Å; L1858-H1863 HydrophobicContact CD2-CB 3.84Å; L1858-H1863 HydrophobicContact CG-CB 4.49Å; L1858-H1863 PolarHBondContact O-N 2.87Å; L1858-L1865 HydrophobicContact CB-CD2 3.65Å; L1858-L1865 HydrophobicContact CD1-CD2 3.96Å; L1858-L1865 HydrophobicContact CG-CD2 4.48Å; L1858-W1866 HydrophobicContact CD1-CH2 3.63Å; L1858-W1866 HydrophobicContact CD1-CZ2 4.07Å; L1858-W1866 HydrophobicContact CD1-CZ3 3.88Å; L1858-W1866 HydrophobicContact CD2-CH2 3.58Å; L1858-W1866 HydrophobicContact CD2-CZ3 3.88Å; L1858-W1866 HydrophobicContact CG-CH2 4.28Å; L1858-I1976 HydrophobicContact CD2-CD1 3.98Å; L1858-I1976 HydrophobicContact CD2-CG2 4.19Å; L1858-F2014 HydrophobicContact CD1-CD1 3.8Å; L1858-F2014 HydrophobicContact CD1-CE1 3.67Å
1859	V	86.1	Confident	87.8	Confident	70 Å²	70	28.8 Å²	28.8	42%	0.424	14%	0.144	S	C	.	.	H	α-helix	trans	-58.3	-42.3	176.2	174.2	0	0	0	0	111.2	M1531 A1855 H1861 N1862 L1865	M1531-V1859 HydrophobicContact CE-CG2 4.15Å; M1531-V1859 HydrophobicContact SD-CG2 3.97Å; A1855-V1859 WeakPolarHBondContact O-CG2 3.34Å; A1855-V1859 PolarHBondContact O-N 3.21Å; V1859-H1861 PolarHBondContact O-N 3.22Å; V1859-N1862 PolarHBondContact O-N 2.99Å; V1859-L1865 HydrophobicContact CG2-CD1 4.02Å; V1859-L1865 HydrophobicContact CG2-CD2 4.06Å; V1859-L1865 HydrophobicContact CG2-CG 4.26Å
1860	K	85	Confident	87	Confident	158 Å²	158	31.8 Å²	31.8	69%	0.687	17%	0.165	S	C	*	.	H	α-helix	trans	-61	-22.9	176	-178.6	-179.6	178.3	-175.3	0	113.5	R1856 H1857 L1858	R1856-K1860 WeakPolarHBondContact O-CB 3.42Å; R1856-K1860 PolarHBondContact O-N 3.3Å; R1856-K1860 VanDerWaalsContact O-N 3.11Å; H1857-K1860 PolarHBondContact O-N 2.78Å; L1858-K1860 VanDerWaalsContact C-N 3.31Å; L1858-K1860 PolarHBondContact O-N 3.45Å
1861	H	83.3	Confident	85.9	Confident	77 Å²	77	33.4 Å²	33.4	36%	0.356	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	17	175.6	-72.5	-64.1	0	0	0	113.3	H1857 L1858 V1859 H1863 I1976	H1857-H1861 PolarHBondContact O-CD2 3.44Å; H1857-H1861 PolarHBondContact O-N 3.1Å; L1858-H1861 CarbonylContact O-C 3.52Å; L1858-H1861 WeakPolarHBondContact O-CA 3.33Å; L1858-H1861 PolarHBondContact O-N 3.46Å; V1859-H1861 PolarHBondContact O-N 3.22Å; H1861-H1863 VanDerWaalsContact C-N 3.26Å; H1861-H1863 PolarHBondContact O-N 2.97Å; H1861-I1976 HydrophobicContact CB-CD1 3.61Å; H1861-I1976 HydrophobicContact CB-CG1 4.35Å
1862	N	84.8	Confident	85.2	Confident	80 Å²	80	38.7 Å²	38.7	43%	0.428	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	26.9	-179.4	-53.8	-44	0	0	0	114.7	L1478 I1479 L1858 V1859	L1478-N1862 CarbonylContact C-O 3.49Å; L1478-N1862 VanDerWaalsContact CA-O 3.3Å; L1478-N1862 WeakPolarHBondContact CA-O 3.5Å; L1478-N1862 HydrophobicContact CD2-CB 4.35Å; I1479-N1862 PolarHBondContact N-O 2.98Å; L1858-N1862 PolarHBondContact O-N 2.82Å; V1859-N1862 PolarHBondContact O-N 2.99Å
1863	H	87	Confident	84.9	Confident	10 Å²	10	38.9 Å²	38.9	5%	0.046	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-80.5	136.7	170.4	-80.3	-95.9	0	0	0	111.3	I1479 L1858 H1861 I1976	I1479-H1863 WeakPolarHBondContact CG2-CE1 3.44Å; I1479-H1863 WeakPolarHBondContact O-CA 3.4Å; L1858-H1863 HydrophobicContact CB-CB 3.98Å; L1858-H1863 HydrophobicContact CD2-CB 3.84Å; L1858-H1863 HydrophobicContact CG-CB 4.49Å; L1858-H1863 PolarHBondContact O-N 2.87Å; H1861-H1863 VanDerWaalsContact C-N 3.26Å; H1861-H1863 PolarHBondContact O-N 2.97Å; H1863-I1976 WeakPolarHBondContact CD2-CD1 3.31Å; H1863-I1976 WeakPolarHBondContact NE2-CD1 3.49Å
1864	V	88.9	Confident	84.6	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.006	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-73.8	137.2	166.1	174.2	0	0	0	0	108.7	Y1444 L1478 I1479 L1480 Y1519 E1520	Y1444-V1864 HydrophobicContact CD2-CG1 3.95Å; Y1444-V1864 HydrophobicContact CD2-CG2 4.28Å; L1478-V1864 HydrophobicContact CB-CG2 4.15Å; L1478-V1864 HydrophobicContact CD1-CG2 4.24Å; L1478-V1864 HydrophobicContact CD2-CG2 4.34Å; L1478-V1864 HydrophobicContact CG-CG2 4.48Å; I1479-V1864 PolarHBondContact O-N 3.49Å; L1480-V1864 HydrophobicContact CD2-CB 4.41Å; L1480-V1864 HydrophobicContact CD2-CG2 4.23Å; Y1519-V1864 HydrophobicContact CG-CG1 4.49Å; E1520-V1864 HydrophobicContact CG-CG1 3.95Å
1865	L	90.9	Very high	84.2	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-85.7	121	-170.3	-55.2	176.8	0	0	0	112	E1520 M1531 L1858 V1859 C1867 F2014	E1520-L1865 HydrophobicContact CG-CB 3.95Å; E1520-L1865 WeakPolarHBondContact CG-O 3.41Å; E1520-L1865 PolarHBondContact OE1-N 2.91Å; M1531-L1865 HydrophobicContact CE-CD1 4.17Å; M1531-L1865 HydrophobicContact SD-CD1 3.82Å; L1858-L1865 HydrophobicContact CB-CD2 3.65Å; L1858-L1865 HydrophobicContact CD1-CD2 3.96Å; L1858-L1865 HydrophobicContact CG-CD2 4.48Å; V1859-L1865 HydrophobicContact CG2-CD1 4.02Å; V1859-L1865 HydrophobicContact CG2-CD2 4.06Å; V1859-L1865 HydrophobicContact CG2-CG 4.26Å; L1865-C1867 HydrophobicContact CB-CB 4.19Å; L1865-C1867 PolarHBondContact O-N 3.41Å; L1865-F2014 HydrophobicContact CB-CE1 4Å; L1865-F2014 HydrophobicContact CB-CZ 4.21Å; L1865-F2014 HydrophobicContact CD1-CZ 4.33Å; L1865-F2014 HydrophobicContact CD2-CE1 3.8Å; L1865-F2014 HydrophobicContact CD2-CZ 3.98Å; L1865-F2014 HydrophobicContact CG-CE1 4.4Å; L1865-F2014 HydrophobicContact CG-CZ 4.4Å
1866	W	90.4	Very high	83.7	Confident	5 Å²	5	39 Å²	39	2%	0.019	21%	0.207	C	C	.	.			trans	-78.1	30.5	171.6	56.8	92	0	0	0	113.3	P1481 Y1854 L1858 S1868 P1873 D1874 L1875 A1973 F2014 L2019	P1481-W1866 HydrophobicContact CB-CB 4.21Å; P1481-W1866 HydrophobicContact CB-CE3 4.1Å; P1481-W1866 HydrophobicContact CG-CB 3.97Å; P1481-W1866 HydrophobicContact CG-CE3 4.12Å; Y1854-W1866 HydrophobicContact CE1-CH2 4.21Å; Y1854-W1866 AromaticContact CE1-CZ2 3.67Å; Y1854-W1866 HydrophobicContact CE1-CZ2 3.67Å; L1858-W1866 HydrophobicContact CD1-CH2 3.63Å; L1858-W1866 HydrophobicContact CD1-CZ2 4.07Å; L1858-W1866 HydrophobicContact CD1-CZ3 3.88Å; L1858-W1866 HydrophobicContact CD2-CH2 3.58Å; L1858-W1866 HydrophobicContact CD2-CZ3 3.88Å; L1858-W1866 HydrophobicContact CG-CH2 4.28Å; W1866-S1868 PolarHBondContact O-N 3.49Å; W1866-P1873 HydrophobicContact CB-CB 4.14Å; W1866-P1873 HydrophobicContact CG-CB 4.18Å; W1866-D1874 WeakPolarHBondContact CA-O 3.21Å; W1866-D1874 WeakPolarHBondContact CB-O 3.06Å; W1866-D1874 PolarHBondContact O-N 3.13Å; W1866-L1875 HydrophobicContact CB-CD2 4.48Å; W1866-A1973 HydrophobicContact CH2-CB 3.6Å; W1866-A1973 HydrophobicContact CZ2-CB 4.24Å; W1866-A1973 HydrophobicContact CZ3-CB 4.47Å; W1866-F2014 HydrophobicContact CD2-CD1 4.41Å; W1866-F2014 AromaticContact NE1-CD1 3.95Å; W1866-F2014 PolarHBondContact NE1-O 3.15Å; W1866-F2014 VanDerWaalsContact NE1-O 3.08Å; W1866-L2019 HydrophobicContact CZ2-CD1 3.89Å
1867	C	84.1	Confident	82.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.219	C	C	.	.			trans	-71.9	120.7	-168	155.8	0	0	0	0	111.9	G1522 V1523 L1865 L2013 F2014	G1522-C1867 CarbonylContact C-O 3.49Å; V1523-C1867 HydrophobicContact CG2-CB 3.99Å; L1865-C1867 HydrophobicContact CB-CB 4.19Å; L1865-C1867 PolarHBondContact O-N 3.41Å; C1867-L2013 CarbonylContact C-O 3.59Å; C1867-L2013 VanDerWaalsContact CA-O 3.24Å; C1867-L2013 WeakPolarHBondContact CA-O 3.34Å; C1867-F2014 HydrophobicContact CB-CE1 4.06Å; C1867-F2014 HydrophobicContact CB-CE2 4.17Å; C1867-F2014 HydrophobicContact CB-CZ 3.73Å
1868	S	81.2	Confident	82.1	Confident	17 Å²	17	39.6 Å²	39.6	12%	0.119	22%	0.223	C	C	.	.			trans	-140.4	135.9	-171.1	174.1	0	0	0	0	110.8	W1866 S1870 R1872 L2013	W1866-S1868 PolarHBondContact O-N 3.49Å; S1868-S1870 PolarHBondContact O-N 2.96Å; S1868-S1870 PolarHBondContact OG-N 3.36Å; S1868-S1870 PolarHBondContact OG-O 3.4Å; S1868-S1870 PolarHBondContact OG-OG 2.7Å; S1868-R1872 WeakPolarHBondContact CB-O 3.13Å; S1868-R1872 PolarHBondContact OG-O 3.42Å; S1868-L2013 PolarHBondContact N-O 2.97Å; S1868-L2013 WeakPolarHBondContact O-CA 3.43Å; S1868-L2013 WeakPolarHBondContact O-CD2 3.25Å
1869	S	68.4	Low	81.1	Confident	56 Å²	56	41.7 Å²	41.7	39%	0.392	23%	0.233	S	C	.	.	S	Bend	trans	-84.5	8.8	172.1	59.6	0	0	0	0	114	N1729	N1729-S1869 WeakPolarHBondContact O-CB 2.99Å; N1729-S1869 PolarHBondContact O-OG 3.24Å
1870	S	72.4	Confident	80.2	Confident	63 Å²	63	41.4 Å²	41.4	44%	0.441	23%	0.231	S	C	.	.	S	Bend	trans	-111.4	160.9	172.2	75	0	0	0	0	110.7	S1868 R1872	S1868-S1870 PolarHBondContact O-N 2.96Å; S1868-S1870 PolarHBondContact OG-N 3.36Å; S1868-S1870 PolarHBondContact OG-O 3.4Å; S1868-S1870 PolarHBondContact OG-OG 2.7Å; S1870-R1872 PolarHBondContact O-N 3.23Å
1871	G	67.2	Low	79.1	Confident	34 Å²	34	39.7 Å²	39.7	35%	0.351	23%	0.23	S	C	.	.	S	Bend	trans	-68.5	26.7	176.6	0	0	0	0	0	115.7	P2010	G1871-P2010 WeakPolarHBondContact CA-O 3.4Å; G1871-P2010 PolarHBondContact N-O 3.33Å
1872	R	76.8	Confident	78	Confident	118 Å²	118	37 Å²	37	45%	0.445	22%	0.218	S	C	.	.	S	Bend	trans	-133.1	129	173.9	-63	-175.1	-176.4	-171.6	-2.6	109.2	S1868 S1870 E1879	S1868-R1872 WeakPolarHBondContact CB-O 3.13Å; S1868-R1872 PolarHBondContact OG-O 3.42Å; S1870-R1872 PolarHBondContact O-N 3.23Å; R1872-E1879 HydrophobicContact CB-CB 4.42Å; R1872-E1879 HydrophobicContact CB-CG 4.24Å
1873	P	85.1	Confident	76.9	Confident	4 Å²	4	36.4 Å²	36.4	3%	0.026	21%	0.213	C	C	.	.			trans	-65.4	149.4	174.8	26.9	-33.3	0	0	0	111.2	W1866 L1875 E1879 Y2015	W1866-P1873 HydrophobicContact CB-CB 4.14Å; W1866-P1873 HydrophobicContact CG-CB 4.18Å; P1873-L1875 HydrophobicContact CB-CD2 4.13Å; P1873-L1875 HydrophobicContact CB-CG 4.14Å; P1873-L1875 HydrophobicContact CG-CD1 3.98Å; P1873-L1875 HydrophobicContact CG-CD2 4.19Å; P1873-L1875 HydrophobicContact CG-CG 3.87Å; P1873-L1875 PolarHBondContact O-N 3.36Å; P1873-L1875 VanDerWaalsContact O-N 3.12Å; P1873-E1879 VanDerWaalsContact O-CB 3.23Å; P1873-E1879 WeakPolarHBondContact O-CB 3.25Å; P1873-E1879 VanDerWaalsContact O-CG 3.26Å; P1873-E1879 WeakPolarHBondContact O-CG 3.42Å; P1873-Y2015 WeakPolarHBondContact CB-O 3.29Å; P1873-Y2015 WeakPolarHBondContact CD-O 3.4Å
1874	D	86.2	Confident	75.6	Confident	20 Å²	20	41.4 Å²	41.4	11%	0.107	23%	0.231	C	C	.	.			trans	-75.2	96.9	168.7	176	-0.6	0	0	0	109.6	E1520 W1866 G1876	E1520-D1874 PolarHBondContact N-OD2 2.95Å; W1866-D1874 WeakPolarHBondContact CA-O 3.21Å; W1866-D1874 WeakPolarHBondContact CB-O 3.06Å; W1866-D1874 PolarHBondContact O-N 3.13Å; D1874-G1876 PolarHBondContact OD1-N 3.31Å
1875	L	85.1	Confident	74.1	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.01	23%	0.233	C	C	.	.			trans	-102.9	21	177	-57.8	-179.5	0	0	0	111.6	P1481 R1482 H1484 Y1519 W1866 P1873 K1878 E1879	P1481-L1875 HydrophobicContact CB-CD2 3.62Å; R1482-L1875 HydrophobicContact CG-CD2 4.29Å; H1484-L1875 PolarHBondContact CE1-O 3.4Å; H1484-L1875 VanDerWaalsContact CE1-O 3.29Å; Y1519-L1875 VanDerWaalsContact CE1-C 3.4Å; Y1519-L1875 WeakPolarHBondContact CE1-O 3.39Å; W1866-L1875 HydrophobicContact CB-CD2 4.48Å; P1873-L1875 HydrophobicContact CB-CD2 4.13Å; P1873-L1875 HydrophobicContact CB-CG 4.14Å; P1873-L1875 HydrophobicContact CG-CD1 3.98Å; P1873-L1875 HydrophobicContact CG-CD2 4.19Å; P1873-L1875 HydrophobicContact CG-CG 3.87Å; P1873-L1875 PolarHBondContact O-N 3.36Å; P1873-L1875 VanDerWaalsContact O-N 3.12Å; L1875-K1878 HydrophobicContact CB-CB 4.4Å; L1875-E1879 WeakPolarHBondContact CA-OE2 3.38Å; L1875-E1879 HydrophobicContact CB-CB 4.28Å; L1875-E1879 WeakPolarHBondContact CB-OE2 3.25Å; L1875-E1879 HydrophobicContact CD1-CB 4.19Å; L1875-E1879 HydrophobicContact CG-CB 4.23Å; L1875-E1879 PolarHBondContact N-OE2 3.14Å
1876	G	81	Confident	72.4	Confident	11 Å²	11	44 Å²	44	11%	0.113	25%	0.245	C	C	.	.	S	Bend	trans	76.6	18	-178.9	0	0	0	0	0	114.8	G1517 V1518 D1874	G1517-G1876 WeakPolarHBondContact CA-O 3.2Å; V1518-G1876 PolarHBondContact N-O 3.04Å; V1518-G1876 WeakPolarHBondContact O-CA 3.46Å; D1874-G1876 PolarHBondContact OD1-N 3.31Å
1877	G	75.2	Confident	70.7	Confident	43 Å²	43	44.4 Å²	44.4	44%	0.443	25%	0.247	S	C	.	.	S	Bend	trans	106.7	-0.2	-176.9	0	0	0	0	0	114.5	E1879 T1880	G1877-E1879 VanDerWaalsContact CA-OE1 3.23Å; G1877-E1879 WeakPolarHBondContact CA-OE1 3.21Å; G1877-E1879 WeakPolarHBondContact CA-OE2 3.48Å; G1877-E1879 PolarHBondContact N-OE1 3.46Å; G1877-E1879 PolarHBondContact N-OE2 3.23Å; G1877-T1880 PolarHBondContact O-OG1 3.13Å
1878	K	74.5	Confident	69.2	Low	61 Å²	61	47.2 Å²	47.2	27%	0.265	26%	0.26	S	S	.	.			trans	-93.9	-9.1	-180	-54.7	-172.3	-156.7	159.1	0	113.4	H1484 E1516 L1875 T1880 D1881	H1484-K1878 PolarHBondContact ND1-NZ 3.47Å; H1484-K1878 VanDerWaalsContact ND1-NZ 3.2Å; E1516-K1878 VanDerWaalsContact OE1-CE 3.31Å; E1516-K1878 WeakPolarHBondContact OE1-CE 3.27Å; E1516-K1878 IonicContact OE1-NZ 2.66Å; E1516-K1878 PolarHBondContact OE1-NZ 2.95Å; L1875-K1878 HydrophobicContact CB-CB 4.4Å; K1878-T1880 PolarHBondContact O-N 3.43Å; K1878-D1881 WeakPolarHBondContact O-CB 3.4Å; K1878-D1881 PolarHBondContact O-N 3.47Å
1879	E	70.6	Confident	67.8	Low	43 Å²	43	46.7 Å²	46.7	20%	0.201	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-1.9	172.2	67.5	-70.6	154	0	0	114	R1872 P1873 L1875 G1877	R1872-E1879 HydrophobicContact CB-CB 4.42Å; R1872-E1879 HydrophobicContact CB-CG 4.24Å; P1873-E1879 VanDerWaalsContact O-CB 3.23Å; P1873-E1879 WeakPolarHBondContact O-CB 3.25Å; P1873-E1879 VanDerWaalsContact O-CG 3.26Å; P1873-E1879 WeakPolarHBondContact O-CG 3.42Å; L1875-E1879 WeakPolarHBondContact CA-OE2 3.38Å; L1875-E1879 HydrophobicContact CB-CB 4.28Å; L1875-E1879 WeakPolarHBondContact CB-OE2 3.25Å; L1875-E1879 HydrophobicContact CD1-CB 4.19Å; L1875-E1879 HydrophobicContact CG-CB 4.23Å; L1875-E1879 PolarHBondContact N-OE2 3.14Å; G1877-E1879 VanDerWaalsContact CA-OE1 3.23Å; G1877-E1879 WeakPolarHBondContact CA-OE1 3.21Å; G1877-E1879 WeakPolarHBondContact CA-OE2 3.48Å; G1877-E1879 PolarHBondContact N-OE1 3.46Å; G1877-E1879 PolarHBondContact N-OE2 3.23Å
1880	T	66.6	Low	67.1	Low	64 Å²	64	45.9 Å²	45.9	39%	0.393	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-35.2	164	48.6	0	0	0	0	113.1	G1877 K1878 Q1883	G1877-T1880 PolarHBondContact O-OG1 3.13Å; K1878-T1880 PolarHBondContact O-N 3.43Å; T1880-Q1883 PolarHBondContact O-NE2 3.21Å
1881	D	61	Low	66	Low	122 Å²	122	47.2 Å²	47.2	65%	0.652	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-23.4	-169.1	-53.8	-6.7	0	0	0	110.5	K1878 Q1883	K1878-D1881 WeakPolarHBondContact O-CB 3.4Å; K1878-D1881 PolarHBondContact O-N 3.47Å; D1881-Q1883 PolarHBondContact O-N 2.54Å
1882	D	61.8	Low	65	Low	22 Å²	22	48.4 Å²	48.4	12%	0.118	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-1.4	175.4	-105.1	28	0	0	0	116.2	R1482 R1884 L1885	R1482-D1882 IonicContact CZ-OD1 2.93Å; R1482-D1882 IonicContact CZ-OD2 3.88Å; R1482-D1882 VanDerWaalsContact CZ-OD2 3.3Å; R1482-D1882 VanDerWaalsContact NH1-CG 3.31Å; R1482-D1882 IonicContact NH1-OD1 3.27Å; R1482-D1882 PolarHBondContact NH1-OD1 3.22Å; R1482-D1882 IonicContact NH1-OD2 3.25Å; R1482-D1882 PolarHBondContact NH1-OD2 3.27Å; R1482-D1882 IonicContact NH2-OD1 3.91Å; R1482-D1882 IonicContact NH2-OD2 3.52Å; R1482-D1882 PolarHBondContact NH2-OD2 2.9Å; D1882-R1884 PolarHBondContact O-N 3.48Å; D1882-L1885 VanDerWaalsContact O-CB 3.3Å; D1882-L1885 WeakPolarHBondContact O-CB 3.15Å; D1882-L1885 PolarHBondContact O-N 3.17Å
1883	Q	60.4	Low	64	Low	66 Å²	66	43 Å²	43	31%	0.308	23%	0.229	S	C	.	.	H	α-helix	trans	-54.8	-40.4	176.7	-73.3	171.6	58.2	0	0	111	T1880 D1881 L1885 L1886 L1887 L2501	T1880-Q1883 PolarHBondContact O-NE2 3.21Å; D1881-Q1883 PolarHBondContact O-N 2.54Å; Q1883-L1885 VanDerWaalsContact C-N 3.25Å; Q1883-L1885 PolarHBondContact O-N 3.17Å; Q1883-L1886 PolarHBondContact O-N 3.41Å; Q1883-L1886 VanDerWaalsContact O-N 3.16Å; Q1883-L1887 VanDerWaalsContact O-CG 3.28Å; Q1883-L1887 WeakPolarHBondContact O-CG 3.26Å; Q1883-L1887 PolarHBondContact O-N 3.16Å; Q1883-L2501 HydrophobicContact CB-CD2 4.27Å; Q1883-L2501 HydrophobicContact CG-CD2 4.39Å
1884	R	59.3	Low	63	Low	116 Å²	116	44.3 Å²	44.3	44%	0.438	24%	0.237	S	C	.	.	H	α-helix	trans	-55.6	-36.6	176.2	-174.7	175.8	-177.1	126.9	16.7	113.5	D1882 L1887 E1888 D2507	D1882-R1884 PolarHBondContact O-N 3.48Å; R1884-L1887 PolarHBondContact O-N 3.26Å; R1884-E1888 HydrophobicContact CG-CG 4.49Å; R1884-E1888 IonicContact CZ-OE1 3.9Å; R1884-E1888 VanDerWaalsContact CZ-OE1 3.26Å; R1884-E1888 IonicContact NE-OE1 3.74Å; R1884-E1888 PolarHBondContact NE-OE1 3.37Å; R1884-E1888 IonicContact NH2-OE1 3.43Å; R1884-E1888 PolarHBondContact NH2-OE1 3.14Å; R1884-E1888 PolarHBondContact O-N 3.43Å; R1884-D2507 IonicContact CZ-OD2 2.94Å; R1884-D2507 IonicContact NH1-OD2 2.68Å; R1884-D2507 PolarHBondContact NH1-OD2 2.95Å; R1884-D2507 IonicContact NH2-OD2 3.25Å; R1884-D2507 PolarHBondContact NH2-OD2 3.21Å
1885	L	57.3	Low	62.4	Low	8 Å²	8	43.8 Å²	43.8	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-62.9	-47	179.1	-105.5	164.5	0	0	0	111.1	D1882 Q1883 M1889 E1966 P2017 A2018 R2021	D1882-L1885 VanDerWaalsContact O-CB 3.3Å; D1882-L1885 WeakPolarHBondContact O-CB 3.15Å; D1882-L1885 PolarHBondContact O-N 3.17Å; Q1883-L1885 VanDerWaalsContact C-N 3.25Å; Q1883-L1885 PolarHBondContact O-N 3.17Å; L1885-M1889 VanDerWaalsContact O-CG 3.23Å; L1885-M1889 WeakPolarHBondContact O-CG 3.38Å; L1885-E1966 HydrophobicContact CD1-CG 4.5Å; L1885-E1966 VanDerWaalsContact CD2-CD 3.47Å; L1885-E1966 HydrophobicContact CD2-CG 4.14Å; L1885-E1966 WeakPolarHBondContact CD2-OE1 3.23Å; L1885-E1966 HydrophobicContact CG-CG 4.37Å; L1885-E1966 WeakPolarHBondContact CG-OE1 2.99Å; L1885-P2017 HydrophobicContact CB-CB 4.4Å; L1885-P2017 HydrophobicContact CB-CG 4.42Å; L1885-P2017 HydrophobicContact CD1-CG 4.41Å; L1885-A2018 HydrophobicContact CD1-CB 3.93Å; L1885-A2018 HydrophobicContact CD2-CB 4.42Å; L1885-R2021 HydrophobicContact CD2-CB 4.24Å; L1885-R2021 HydrophobicContact CD2-CG 4.48Å
1886	L	56.7	Low	62.1	Low	49 Å²	49	46.6 Å²	46.6	26%	0.257	25%	0.248	S	C	.	.	H	α-helix	trans	-64.5	-48.6	176.2	-61.3	171.9	0	0	0	110.6	Q1883 E1888 M1889 P2017 Q2498	Q1883-L1886 PolarHBondContact O-N 3.41Å; Q1883-L1886 VanDerWaalsContact O-N 3.16Å; L1886-E1888 VanDerWaalsContact C-N 3.33Å; L1886-E1888 PolarHBondContact O-N 3.25Å; L1886-M1889 PolarHBondContact O-N 3.2Å; L1886-M1889 VanDerWaalsContact O-N 3.15Å; L1886-P2017 HydrophobicContact CD2-CB 3.92Å; L1886-P2017 HydrophobicContact CD2-CG 4.4Å; L1886-Q2498 PolarHBondContact O-OE1 2.86Å; L1886-Q2498 VanDerWaalsContact O-OE1 3.05Å
1887	L	53.9	Low	62.2	Low	14 Å²	14	47.9 Å²	47.9	7%	0.073	25%	0.252	C	S	.	.	H	α-helix	trans	-50.6	-46.5	-178.9	-70.8	-173.1	0	0	0	114	Q1883 R1884 M1889 Q2498 L2501 Q2502 L2505	Q1883-L1887 VanDerWaalsContact O-CG 3.28Å; Q1883-L1887 WeakPolarHBondContact O-CG 3.26Å; Q1883-L1887 PolarHBondContact O-N 3.16Å; R1884-L1887 PolarHBondContact O-N 3.26Å; L1887-M1889 VanDerWaalsContact C-N 3.28Å; L1887-M1889 PolarHBondContact O-N 3.17Å; L1887-Q2498 HydrophobicContact CD2-CB 4.43Å; L1887-Q2498 WeakPolarHBondContact CD2-O 3.5Å; L1887-L2501 HydrophobicContact CD1-CG 4.3Å; L1887-L2501 HydrophobicContact CD2-CB 3.72Å; L1887-L2501 HydrophobicContact CD2-CD2 3.92Å; L1887-L2501 HydrophobicContact CD2-CG 3.81Å; L1887-L2501 HydrophobicContact CG-CD2 4.49Å; L1887-L2501 HydrophobicContact CG-CG 4.48Å; L1887-Q2502 HydrophobicContact CB-CG 3.99Å; L1887-Q2502 HydrophobicContact CD2-CB 4.34Å; L1887-Q2502 HydrophobicContact CD2-CG 3.92Å; L1887-Q2502 VanDerWaalsContact CD2-N 3.29Å; L1887-Q2502 HydrophobicContact CG-CG 4.42Å; L1887-Q2502 WeakPolarHBondContact O-CG 3.4Å; L1887-Q2502 PolarHBondContact O-NE2 2.9Å; L1887-L2505 HydrophobicContact CD1-CB 4.06Å; L1887-L2505 HydrophobicContact CD1-CD1 4.16Å
1888	E	52.5	Low	62.8	Low	58 Å²	58	48.4 Å²	48.4	27%	0.271	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-8.6	-172.7	-67.8	-178.3	-179.7	0	0	113.8	R1884 L1886 S1892 R2021	R1884-E1888 HydrophobicContact CG-CG 4.49Å; R1884-E1888 IonicContact CZ-OE1 3.9Å; R1884-E1888 VanDerWaalsContact CZ-OE1 3.26Å; R1884-E1888 IonicContact NE-OE1 3.74Å; R1884-E1888 PolarHBondContact NE-OE1 3.37Å; R1884-E1888 IonicContact NH2-OE1 3.43Å; R1884-E1888 PolarHBondContact NH2-OE1 3.14Å; R1884-E1888 PolarHBondContact O-N 3.43Å; L1886-E1888 VanDerWaalsContact C-N 3.33Å; L1886-E1888 PolarHBondContact O-N 3.25Å; E1888-S1892 PolarHBondContact O-OG 2.87Å; E1888-R2021 VanDerWaalsContact CB-NH2 3.27Å; E1888-R2021 IonicContact OE2-CZ 2.79Å; E1888-R2021 VanDerWaalsContact OE2-CZ 3.23Å; E1888-R2021 IonicContact OE2-NH1 3.34Å; E1888-R2021 PolarHBondContact OE2-NH1 3.23Å; E1888-R2021 IonicContact OE2-NH2 2.72Å; E1888-R2021 PolarHBondContact OE2-NH2 3.29Å
1889	M	51.7	Low	63.5	Low	6 Å²	6	49.8 Å²	49.8	3%	0.03	25%	0.248	C	C	.	.	H	α-helix	trans	-83.7	-43.6	-165.7	-79.3	176.3	68.4	0	0	115.9	L1885 L1886 L1887 S1892 G1893 P2017 R2020 R2021	L1885-M1889 VanDerWaalsContact O-CG 3.23Å; L1885-M1889 WeakPolarHBondContact O-CG 3.38Å; L1886-M1889 PolarHBondContact O-N 3.2Å; L1886-M1889 VanDerWaalsContact O-N 3.15Å; L1887-M1889 VanDerWaalsContact C-N 3.28Å; L1887-M1889 PolarHBondContact O-N 3.17Å; M1889-S1892 PolarHBondContact O-N 3.08Å; M1889-G1893 PolarHBondContact O-N 3.07Å; M1889-P2017 HydrophobicContact SD-CB 4.49Å; M1889-R2020 HydrophobicContact CE-CB 4.41Å; M1889-R2020 HydrophobicContact CE-CG 3.83Å; M1889-R2021 HydrophobicContact CE-CB 4.26Å; M1889-R2021 HydrophobicContact CG-CG 4.22Å; M1889-R2021 HydrophobicContact SD-CB 3.99Å; M1889-R2021 HydrophobicContact SD-CG 4.33Å
1890	E	53.7	Low	64.3	Low	40 Å²	40	51.3 Å²	51.3	19%	0.187	26%	0.262	C	S	.	.	H	α-helix	trans	-72.8	-42.1	-161.2	-63.5	-166.8	169.8	0	0	115	Q2495 Q2498	E1890-Q2495 WeakPolarHBondContact OE2-CA 3.22Å; E1890-Q2495 WeakPolarHBondContact OE2-CB 3.32Å; E1890-Q2495 WeakPolarHBondContact OE2-CG 3.45Å; E1890-Q2495 PolarHBondContact OE2-NE2 3.35Å; E1890-Q2498 PolarHBondContact OE1-NE2 3.19Å
1891	E	48.9	Very low	65.4	Low	91 Å²	91	48.8 Å²	48.8	43%	0.425	25%	0.248	S	C	.	.	H	α-helix	trans	-74.8	-31.7	174.6	-64.8	-148.7	108.4	0	0	112.8	R2553	E1891-R2553 IonicContact OE1-CZ 2.67Å; E1891-R2553 IonicContact OE1-NH1 3.64Å; E1891-R2553 PolarHBondContact OE1-NH1 2.84Å; E1891-R2553 IonicContact OE1-NH2 2.97Å; E1891-R2553 PolarHBondContact OE1-NH2 3.36Å
1892	S	47.4	Very low	66.7	Low	58 Å²	58	43.9 Å²	43.9	41%	0.406	22%	0.222	S	C	.	.	H	α-helix	trans	-85.2	-16.4	-175.6	76	0	0	0	0	113.7	E1888 M1889 K2028	E1888-S1892 PolarHBondContact O-OG 2.87Å; M1889-S1892 PolarHBondContact O-N 3.08Å; S1892-K2028 PolarHBondContact O-NZ 2.97Å
1893	G	54.5	Low	68	Low	5 Å²	5	44 Å²	44	5%	0.052	22%	0.221	C	C	.	.	H	α-helix	trans	-77.6	-27.8	178.3	0	0	0	0	0	114.8	M1889 V1895	M1889-G1893 PolarHBondContact O-N 3.07Å; G1893-V1895 WeakPolarHBondContact O-CG2 3.19Å; G1893-V1895 PolarHBondContact O-N 3.24Å; G1893-V1895 VanDerWaalsContact O-N 3.07Å
1894	V	65.4	Low	69.2	Low	31 Å²	31	42.4 Å²	42.4	19%	0.188	22%	0.216	C	C	.	.			trans	-70	106.1	174	-178.1	0	0	0	0	108.9	E1896 P2431	V1894-E1896 HydrophobicContact CG1-CB 4.39Å; V1894-P2431 HydrophobicContact CG2-CB 4.17Å
1895	V	72.4	Confident	70.6	Confident	9 Å²	9	38.9 Å²	38.9	6%	0.055	20%	0.203	C	C	.	.			trans	-100.5	81	178.3	-168.5	0	0	0	0	108.9	G1893 K2028 F2031 N2049 F2050	G1893-V1895 WeakPolarHBondContact O-CG2 3.19Å; G1893-V1895 PolarHBondContact O-N 3.24Å; G1893-V1895 VanDerWaalsContact O-N 3.07Å; V1895-K2028 HydrophobicContact CG1-CD 4.47Å; V1895-K2028 HydrophobicContact CG1-CG 4.13Å; V1895-K2028 HydrophobicContact CG2-CB 4.28Å; V1895-K2028 HydrophobicContact CG2-CD 3.57Å; V1895-K2028 HydrophobicContact CG2-CG 3.77Å; V1895-F2031 HydrophobicContact CG1-CD1 3.74Å; V1895-F2031 HydrophobicContact CG1-CE1 3.79Å; V1895-N2049 VanDerWaalsContact O-CA 3.28Å; V1895-N2049 WeakPolarHBondContact O-CA 3.45Å; V1895-F2050 HydrophobicContact CB-CD1 4.2Å; V1895-F2050 HydrophobicContact CB-CE1 3.83Å; V1895-F2050 HydrophobicContact CB-CZ 4.06Å; V1895-F2050 HydrophobicContact CG1-CE1 4.32Å; V1895-F2050 HydrophobicContact CG2-CD1 4.43Å; V1895-F2050 HydrophobicContact CG2-CE1 3.69Å; V1895-F2050 HydrophobicContact CG2-CE2 3.92Å; V1895-F2050 HydrophobicContact CG2-CZ 3.4Å; V1895-F2050 VanDerWaalsContact CG2-CZ 3.4Å
1896	E	80	Confident	72.1	Confident	61 Å²	61	38.6 Å²	38.6	29%	0.285	20%	0.201	S	C	.	.			trans	-100.6	133.7	176	-173.7	170.9	110.5	0	0	111.3	V1894 Y2047	V1894-E1896 HydrophobicContact CG1-CB 4.39Å; E1896-Y2047 HydrophobicContact CG-CD2 4.36Å; E1896-Y2047 HydrophobicContact CG-CE2 3.5Å; E1896-Y2047 WeakPolarHBondContact OE2-CE2 3.47Å; E1896-Y2047 PolarHBondContact OE2-OH 2.76Å
1897	I	83.1	Confident	73.8	Confident	38 Å²	38	36.2 Å²	36.2	20%	0.195	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.1	166.8	-57.5	-179.5	0	0	0	106.7	F2031 L2032 V2035 Y2047 A2048	I1897-F2031 HydrophobicContact CD1-CE1 4.09Å; I1897-F2031 HydrophobicContact CD1-CZ 4.5Å; I1897-F2031 HydrophobicContact CG1-CE1 4.43Å; I1897-L2032 HydrophobicContact CD1-CD2 4.05Å; I1897-V2035 HydrophobicContact CD1-CB 4.15Å; I1897-V2035 HydrophobicContact CD1-CG1 3.77Å; I1897-V2035 HydrophobicContact CD1-CG2 3.82Å; I1897-Y2047 CarbonylContact O-C 3.58Å; I1897-Y2047 VanDerWaalsContact O-CA 3.28Å; I1897-Y2047 WeakPolarHBondContact O-CA 3.47Å; I1897-A2048 HydrophobicContact CB-CB 4.41Å; I1897-A2048 PolarHBondContact N-O 3.34Å; I1897-A2048 PolarHBondContact O-N 2.79Å
1898	N	88.1	Confident	75.6	Confident	54 Å²	54	35.6 Å²	35.6	29%	0.289	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	120.9	-178	-177.6	31.5	0	0	0	110	Y2047 W2100 M2101	N1898-Y2047 HydrophobicContact CB-CD2 4.38Å; N1898-W2100 PolarHBondContact OD1-NE1 3.23Å; N1898-M2101 PolarHBondContact ND2-O 3.15Å
1899	R	88.3	Confident	77.4	Confident	90 Å²	90	33.3 Å²	33.3	34%	0.34	18%	0.175	S	C	.	.			trans	-112.2	101	173.3	-62.6	-166.6	-171.6	171.6	0.9	108.8	Y1903 D2044 V2045 I2046	R1899-Y1903 WeakPolarHBondContact CB-OH 3.25Å; R1899-Y1903 PolarHBondContact O-OH 3.42Å; R1899-D2044 IonicContact NH1-OD1 3.32Å; R1899-D2044 PolarHBondContact NH1-OD1 3.38Å; R1899-V2045 WeakPolarHBondContact CD-O 3.47Å; R1899-V2045 WeakPolarHBondContact CG-O 3.29Å; R1899-V2045 PolarHBondContact NE-O 3.26Å; R1899-I2046 PolarHBondContact N-O 2.87Å
1900	P	88.3	Confident	79.1	Confident	76 Å²	76	33.2 Å²	33.2	49%	0.494	17%	0.174	S	C	.	.			trans	-71.9	137.3	174.9	29.2	-34.3	0	0	0	111	W2100 L2368	P1900-W2100 CarbonylContact C-O 3.58Å; P1900-W2100 VanDerWaalsContact CA-O 3.25Å; P1900-W2100 WeakPolarHBondContact CA-O 3.48Å; P1900-L2368 HydrophobicContact CB-CD2 3.87Å
1901	G	89.7	Confident	80.4	Confident	10 Å²	10	32.7 Å²	32.7	10%	0.103	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.8	173	-180	0	0	0	0	0	113.6	W2100 L2368	G1901-W2100 PolarHBondContact N-O 3.09Å; G1901-W2100 PolarHBondContact O-N 3.3Å; G1901-L2368 CarbonylContact C-O 3.4Å; G1901-L2368 WeakPolarHBondContact CA-O 3.46Å
1902	L	87	Confident	81.8	Confident	20 Å²	20	28.8 Å²	28.8	11%	0.105	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	128.7	165.3	-169.4	155.7	0	0	0	109.7	P1904 I2099 Y2184 L2368 E2369	L1902-P1904 HydrophobicContact CD2-CB 3.93Å; L1902-P1904 HydrophobicContact CD2-CG 4.37Å; L1902-I2099 HydrophobicContact CB-CG1 4.43Å; L1902-I2099 HydrophobicContact CD1-CD1 4.13Å; L1902-I2099 HydrophobicContact CD1-CG1 3.77Å; L1902-I2099 HydrophobicContact CG-CG1 3.89Å; L1902-Y2184 HydrophobicContact CD1-CE1 4.14Å; L1902-Y2184 WeakPolarHBondContact CD1-OH 3.42Å; L1902-L2368 PolarHBondContact N-O 2.94Å; L1902-E2369 HydrophobicContact CB-CB 4.11Å; L1902-E2369 HydrophobicContact CD1-CB 3.94Å; L1902-E2369 HydrophobicContact CD1-CG 4.37Å
1903	Y	90.2	Very high	83.2	Confident	25 Å²	25	28.3 Å²	28.3	10%	0.098	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	99.5	-179.4	-63.7	-85.2	0	0	0	109.7	R1899 Y1905 N1907 D2044 I2046 Q2097 L2098 W2100	R1899-Y1903 WeakPolarHBondContact CB-OH 3.25Å; R1899-Y1903 PolarHBondContact O-OH 3.42Å; Y1903-Y1905 VanDerWaalsContact C-N 3.27Å; Y1903-Y1905 PolarHBondContact O-N 2.85Å; Y1903-N1907 VanDerWaalsContact CB-OD1 3.24Å; Y1903-N1907 WeakPolarHBondContact CB-OD1 3.28Å; Y1903-N1907 PolarHBondContact O-ND2 2.86Å; Y1903-D2044 HydrophobicContact CE1-CB 4.28Å; Y1903-I2046 HydrophobicContact CD1-CD1 3.77Å; Y1903-I2046 HydrophobicContact CD1-CG1 3.95Å; Y1903-I2046 HydrophobicContact CD2-CD1 3.66Å; Y1903-I2046 HydrophobicContact CD2-CG1 4.06Å; Y1903-I2046 HydrophobicContact CD2-CG2 4.13Å; Y1903-I2046 HydrophobicContact CE1-CD1 4.13Å; Y1903-I2046 HydrophobicContact CE1-CG1 3.78Å; Y1903-I2046 HydrophobicContact CE2-CB 4.32Å; Y1903-I2046 HydrophobicContact CE2-CD1 4.03Å; Y1903-I2046 HydrophobicContact CE2-CG1 3.89Å; Y1903-I2046 HydrophobicContact CE2-CG2 3.67Å; Y1903-I2046 HydrophobicContact CG-CD1 3.52Å; Y1903-I2046 HydrophobicContact CG-CG1 4.08Å; Y1903-Q2097 WeakPolarHBondContact O-CA 3.21Å; Y1903-L2098 PolarHBondContact N-O 2.86Å; Y1903-L2098 PolarHBondContact O-N 3.42Å; Y1903-W2100 HydrophobicContact CD2-CB 4.39Å; Y1903-W2100 HydrophobicContact CE2-CB 4.35Å
1904	P	85.2	Confident	84.4	Confident	31 Å²	31	31.1 Å²	31.1	20%	0.201	16%	0.162	C	C	.	.			trans	-86.3	9	-169.5	36.8	-38.3	0	0	0	114.3	L1902 T2240	L1902-P1904 HydrophobicContact CD2-CB 3.93Å; L1902-P1904 HydrophobicContact CD2-CG 4.37Å; P1904-T2240 HydrophobicContact CB-CG2 3.82Å; P1904-T2240 HydrophobicContact CG-CG2 4.17Å; P1904-T2240 WeakPolarHBondContact O-CG2 3.27Å
1905	Y	88.4	Confident	85.3	Confident	43 Å²	43	30.1 Å²	30.1	17%	0.169	16%	0.156	C	C	.	.	S	Bend	trans	-103.8	174.4	178	-51.5	-73.4	0	0	0	110.6	Y1903 N1907 H2058 I2060 R2096 D2238 T2240	Y1903-Y1905 VanDerWaalsContact C-N 3.27Å; Y1903-Y1905 PolarHBondContact O-N 2.85Å; Y1905-N1907 PolarHBondContact O-N 3.21Å; Y1905-N1907 VanDerWaalsContact O-N 3.16Å; Y1905-N1907 PolarHBondContact O-ND2 2.82Å; Y1905-H2058 AromaticContact CD2-ND1 3.74Å; Y1905-H2058 AromaticContact CE2-ND1 3.49Å; Y1905-H2058 WeakPolarHBondContact CE2-ND1 3.46Å; Y1905-I2060 HydrophobicContact CD1-CG1 4.35Å; Y1905-R2096 CarbonylContact C-O 3.58Å; Y1905-R2096 VanDerWaalsContact C-O 3.25Å; Y1905-R2096 CarbonylContact O-C 3.56Å; Y1905-D2238 WeakPolarHBondContact CE1-OD2 3.37Å; Y1905-D2238 PolarHBondContact OH-OD2 3.46Å; Y1905-D2238 VanDerWaalsContact OH-OD2 3.13Å; Y1905-T2240 HydrophobicContact CE1-CG2 4.42Å
1906	V	88.7	Confident	85.8	Confident	1 Å²	1	30 Å²	30	1%	0.006	16%	0.156	C	C	.	.			trans	-64.9	116.8	168.1	-179.7	0	0	0	0	109.7	V1908 T2057 R2059 I2060 L2062 A2065 W2095	V1906-V1908 HydrophobicContact CG1-CG2 4.35Å; V1906-T2057 WeakPolarHBondContact O-CB 3.32Å; V1906-T2057 WeakPolarHBondContact O-CG2 3.47Å; V1906-T2057 PolarHBondContact O-N 3.49Å; V1906-T2057 PolarHBondContact O-OG1 2.87Å; V1906-R2059 PolarHBondContact N-O 2.88Å; V1906-I2060 WeakPolarHBondContact CG2-O 3.4Å; V1906-L2062 HydrophobicContact CG1-CD1 3.77Å; V1906-A2065 HydrophobicContact CB-CB 3.59Å; V1906-A2065 HydrophobicContact CG1-CB 3.52Å; V1906-A2065 HydrophobicContact CG2-CB 4.17Å; V1906-W2095 WeakPolarHBondContact CA-O 3.42Å
1907	N	92.9	Very high	86.1	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	137.5	176.5	-52.5	-71.1	0	0	0	109	Y1903 Y1905 I2046 M2055 S2056 S2094 W2095 L2098	Y1903-N1907 VanDerWaalsContact CB-OD1 3.24Å; Y1903-N1907 WeakPolarHBondContact CB-OD1 3.28Å; Y1903-N1907 PolarHBondContact O-ND2 2.86Å; Y1905-N1907 PolarHBondContact O-N 3.21Å; Y1905-N1907 VanDerWaalsContact O-N 3.16Å; Y1905-N1907 PolarHBondContact O-ND2 2.82Å; N1907-I2046 HydrophobicContact CB-CD1 4.18Å; N1907-I2046 VanDerWaalsContact OD1-CD1 3.3Å; N1907-I2046 WeakPolarHBondContact OD1-CD1 3.34Å; N1907-M2055 CarbonylContact C-O 3.58Å; N1907-M2055 VanDerWaalsContact CA-O 3.22Å; N1907-M2055 WeakPolarHBondContact CA-O 3.5Å; N1907-S2056 WeakPolarHBondContact OD1-CA 3.35Å; N1907-S2056 WeakPolarHBondContact OD1-CB 3.45Å; N1907-S2094 CarbonylContact O-C 3.45Å; N1907-S2094 WeakPolarHBondContact O-CA 3.36Å; N1907-S2094 WeakPolarHBondContact O-CB 3.39Å; N1907-W2095 HydrophobicContact CB-CE3 4.33Å; N1907-W2095 PolarHBondContact N-O 3Å; N1907-W2095 PolarHBondContact ND2-O 3.27Å; N1907-W2095 PolarHBondContact O-N 2.99Å; N1907-L2098 HydrophobicContact CB-CB 4.34Å; N1907-L2098 HydrophobicContact CB-CD2 4.12Å; N1907-L2098 WeakPolarHBondContact ND2-CB 3.48Å; N1907-L2098 PolarHBondContact ND2-N 2.82Å
1908	V	90.6	Very high	86.2	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.1	-175.8	178.6	0	0	0	0	109.9	V1906 L1910 I2054 M2055 T2057 V2069 Y2091	V1906-V1908 HydrophobicContact CG1-CG2 4.35Å; V1908-L1910 HydrophobicContact CG1-CD2 3.75Å; V1908-L1910 HydrophobicContact CG1-CG 4.24Å; V1908-I2054 WeakPolarHBondContact O-CA 3.17Å; V1908-M2055 HydrophobicContact CB-CG 4.48Å; V1908-M2055 PolarHBondContact N-O 3.17Å; V1908-M2055 PolarHBondContact O-N 3.17Å; V1908-T2057 HydrophobicContact CG2-CG2 3.88Å; V1908-V2069 HydrophobicContact CB-CG2 4.42Å; V1908-V2069 HydrophobicContact CG2-CG2 4.21Å; V1908-Y2091 HydrophobicContact CG1-CD2 3.67Å; V1908-Y2091 HydrophobicContact CG1-CE2 3.89Å
1909	E	91.3	Very high	86.1	Confident	10 Å²	10	23.2 Å²	23.2	5%	0.047	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	125.3	166.8	-177.6	170.8	-153.6	0	0	110	R2052 I2054 V2092 T2093 W2095	E1909-R2052 VanDerWaalsContact OE1-CD 3.25Å; E1909-R2052 WeakPolarHBondContact OE1-CD 3.06Å; E1909-R2052 IonicContact OE1-CZ 2.97Å; E1909-R2052 IonicContact OE1-NE 3.16Å; E1909-R2052 IonicContact OE1-NH1 3.28Å; E1909-R2052 PolarHBondContact OE1-NH1 2.89Å; E1909-R2052 IonicContact OE2-NH1 3.92Å; E1909-I2054 HydrophobicContact CB-CG1 4.01Å; E1909-I2054 HydrophobicContact CG-CD1 4.5Å; E1909-I2054 HydrophobicContact CG-CG1 3.94Å; E1909-V2092 HydrophobicContact CB-CB 4.29Å; E1909-V2092 HydrophobicContact CG-CB 4.06Å; E1909-V2092 HydrophobicContact CG-CG2 4.34Å; E1909-V2092 PolarHBondContact O-N 3.27Å; E1909-T2093 HydrophobicContact CB-CG2 3.94Å; E1909-T2093 PolarHBondContact N-O 2.82Å; E1909-W2095 HydrophobicContact CB-CH2 3.94Å; E1909-W2095 HydrophobicContact CB-CZ3 3.9Å
1910	L	87.2	Confident	85.9	Confident	4 Å²	4	19 Å²	19	2%	0.021	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.6	171.9	-57.1	-177.6	0	0	0	110.3	V1908 R2052 L2053 M2055 V2069 L2089 Q2090	V1908-L1910 HydrophobicContact CG1-CD2 3.75Å; V1908-L1910 HydrophobicContact CG1-CG 4.24Å; L1910-R2052 CarbonylContact O-C 3.51Å; L1910-R2052 WeakPolarHBondContact O-CA 3.04Å; L1910-L2053 PolarHBondContact N-O 3.37Å; L1910-L2053 PolarHBondContact O-N 3.03Å; L1910-M2055 HydrophobicContact CD1-CE 3.74Å; L1910-V2069 HydrophobicContact CD1-CG1 4.04Å; L1910-V2069 HydrophobicContact CD2-CG1 4.04Å; L1910-L2089 HydrophobicContact CB-CD2 4.23Å; L1910-L2089 HydrophobicContact CD1-CD2 4.11Å; L1910-Q2090 CarbonylContact C-O 3.59Å; L1910-Q2090 VanDerWaalsContact CA-O 3.25Å; L1910-Q2090 WeakPolarHBondContact CA-O 3.19Å
1911	E	81.4	Confident	85.7	Confident	29 Å²	29	16.5 Å²	16.5	14%	0.136	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	148.6	165	-167.6	175.8	124.8	0	0	109.4	S2051 L2089 Q2090 V2092 F2440	E1911-S2051 CarbonylContact C-O 3.57Å; E1911-S2051 VanDerWaalsContact CA-O 3.32Å; E1911-S2051 WeakPolarHBondContact CA-O 3.43Å; E1911-S2051 WeakPolarHBondContact CG-O 3.38Å; E1911-L2089 WeakPolarHBondContact O-CA 3.33Å; E1911-Q2090 PolarHBondContact N-O 2.8Å; E1911-Q2090 PolarHBondContact O-N 3.41Å; E1911-V2092 HydrophobicContact CB-CG2 3.74Å; E1911-F2440 HydrophobicContact CG-CE2 3.89Å; E1911-F2440 WeakPolarHBondContact OE1-CD2 3.43Å; E1911-F2440 WeakPolarHBondContact OE1-CE2 3.28Å; E1911-F2440 WeakPolarHBondContact OE2-CE2 3.34Å
1912	F	78.3	Confident	85.3	Confident	9 Å²	9	16.4 Å²	16.4	4%	0.039	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	142.6	172	39.2	-82.1	0	0	0	113.1	F2031 N2049 F2050 S2051 R2052 L2053 L2087 D2088 L2089	F1912-F2031 HydrophobicContact CE2-CD2 4.26Å; F1912-F2031 HydrophobicContact CE2-CE2 4.16Å; F1912-F2031 HydrophobicContact CZ-CD2 4.38Å; F1912-F2031 AromaticContact CZ-CE2 3.84Å; F1912-F2031 HydrophobicContact CZ-CE2 3.84Å; F1912-N2049 WeakPolarHBondContact CE2-O 3.22Å; F1912-N2049 WeakPolarHBondContact CZ-O 3.41Å; F1912-F2050 VanDerWaalsContact CE2-C 3.5Å; F1912-S2051 PolarHBondContact N-O 2.93Å; F1912-R2052 WeakPolarHBondContact CE1-O 3.42Å; F1912-R2052 WeakPolarHBondContact CZ-O 3.49Å; F1912-L2053 HydrophobicContact CD1-CB 4.25Å; F1912-L2053 HydrophobicContact CE1-CB 3.52Å; F1912-L2053 HydrophobicContact CZ-CB 4.44Å; F1912-L2087 HydrophobicContact CB-CD1 4.43Å; F1912-L2087 HydrophobicContact CB-CD2 4.47Å; F1912-L2087 HydrophobicContact CB-CG 4.36Å; F1912-D2088 WeakPolarHBondContact CA-O 3.1Å; F1912-D2088 WeakPolarHBondContact CB-O 3.32Å; F1912-L2089 HydrophobicContact CB-CD2 3.91Å; F1912-L2089 HydrophobicContact CB-CG 4.41Å; F1912-L2089 HydrophobicContact CD1-CD2 3.91Å; F1912-L2089 HydrophobicContact CG-CD2 4.32Å
1913	T	76.3	Confident	85	Confident	48 Å²	48	15.9 Å²	15.9	29%	0.294	8%	0.084	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	175	-179.4	69.4	0	0	0	0	110.4	L1915 D2088	T1913-L1915 PolarHBondContact O-N 3.12Å; T1913-D2088 PolarHBondContact N-O 2.93Å
1914	N	78.9	Confident	84.4	Confident	65 Å²	65	18.7 Å²	18.7	35%	0.348	10%	0.101	S	C	.	.			trans	59.9	11.9	174.9	-63.4	-32.4	0	0	0	117.1	A1916 V1917 N1918	N1914-A1916 VanDerWaalsContact C-N 3.33Å; N1914-A1916 PolarHBondContact O-N 2.89Å; N1914-V1917 HydrophobicContact CB-CB 4.39Å; N1914-V1917 WeakPolarHBondContact O-CB 3.45Å; N1914-V1917 PolarHBondContact O-N 2.95Å; N1914-N1918 WeakPolarHBondContact O-CB 3.39Å; N1914-N1918 PolarHBondContact O-N 2.8Å
1915	L	85.2	Confident	83.9	Confident	10 Å²	10	22.9 Å²	22.9	5%	0.052	11%	0.113	C	C	.	.	H	α-helix	trans	-49.6	-48.6	178	177.6	60.2	0	0	0	112.9	T1913 V1917 T1919 M2027 V2030 F2031 F2050 L2087	T1913-L1915 PolarHBondContact O-N 3.12Å; L1915-V1917 PolarHBondContact O-N 3.43Å; L1915-T1919 WeakPolarHBondContact O-CB 3.23Å; L1915-T1919 PolarHBondContact O-N 3.16Å; L1915-T1919 PolarHBondContact O-OG1 2.78Å; L1915-M2027 HydrophobicContact CD2-CE 4.03Å; L1915-M2027 HydrophobicContact CG-CB 4.46Å; L1915-M2027 HydrophobicContact CG-CE 4.14Å; L1915-M2027 HydrophobicContact CG-CG 4.36Å; L1915-V2030 HydrophobicContact CD1-CG1 4.18Å; L1915-F2031 HydrophobicContact CD2-CB 4.4Å; L1915-F2050 HydrophobicContact CD2-CB 4.41Å; L1915-F2050 HydrophobicContact CD2-CD1 3.74Å; L1915-F2050 HydrophobicContact CD2-CE1 4.22Å; L1915-F2050 HydrophobicContact CD2-CG 4.17Å; L1915-L2087 HydrophobicContact CB-CD1 4.17Å; L1915-L2087 HydrophobicContact CD1-CD1 4.02Å
1916	A	83.1	Confident	83.1	Confident	6 Å²	6	21 Å²	21	5%	0.05	11%	0.105	C	C	.	.	H	α-helix	trans	-62.2	-39.6	178.1	0	0	0	0	0	113.5	N1914 L1920 Y2004 M2027	N1914-A1916 VanDerWaalsContact C-N 3.33Å; N1914-A1916 PolarHBondContact O-N 2.89Å; A1916-L1920 PolarHBondContact O-N 2.88Å; A1916-Y2004 HydrophobicContact CB-CD1 4.36Å; A1916-Y2004 HydrophobicContact CB-CD2 3.46Å; A1916-Y2004 VanDerWaalsContact CB-CD2 3.46Å; A1916-Y2004 HydrophobicContact CB-CE2 3.93Å; A1916-Y2004 HydrophobicContact CB-CG 3.71Å; A1916-M2027 HydrophobicContact CB-CE 4.12Å; A1916-M2027 HydrophobicContact CB-CG 4.45Å; A1916-M2027 HydrophobicContact CB-SD 3.6Å; A1916-M2027 VanDerWaalsContact CB-SD 3.6Å
1917	V	85	Confident	82	Confident	9 Å²	9	22.7 Å²	22.7	6%	0.055	12%	0.116	C	C	.	.	H	α-helix	trans	-70	-48.6	-179.6	178.7	0	0	0	0	109.7	N1914 L1915 T1919 L1920 I1921 V1981 V1985 I2000 F2003	N1914-V1917 HydrophobicContact CB-CB 4.39Å; N1914-V1917 WeakPolarHBondContact O-CB 3.45Å; N1914-V1917 PolarHBondContact O-N 2.95Å; L1915-V1917 PolarHBondContact O-N 3.43Å; V1917-T1919 PolarHBondContact O-N 3.04Å; V1917-L1920 PolarHBondContact O-N 2.93Å; V1917-I1921 HydrophobicContact CG1-CD1 4.07Å; V1917-I1921 VanDerWaalsContact O-CG1 3.32Å; V1917-I1921 WeakPolarHBondContact O-CG1 3.45Å; V1917-I1921 PolarHBondContact O-N 2.89Å; V1917-V1981 HydrophobicContact CG1-CG1 4.01Å; V1917-V1985 HydrophobicContact CG1-CG2 4.06Å; V1917-I2000 HydrophobicContact CB-CG2 4.48Å; V1917-I2000 HydrophobicContact CG1-CG2 4Å; V1917-I2000 HydrophobicContact CG2-CG2 3.79Å; V1917-F2003 HydrophobicContact CG2-CD1 4.49Å
1918	N	85.7	Confident	80.7	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-54.4	-51.5	172.8	179.6	78.1	0	0	0	110.8	N1914 L1920 I1921 I1922 L2083 H2086	N1914-N1918 WeakPolarHBondContact O-CB 3.39Å; N1914-N1918 PolarHBondContact O-N 2.8Å; N1918-L1920 VanDerWaalsContact C-N 3.34Å; N1918-L1920 PolarHBondContact O-N 3.32Å; N1918-I1921 PolarHBondContact O-N 2.98Å; N1918-I1921 VanDerWaalsContact O-N 3.14Å; N1918-I1922 VanDerWaalsContact O-CG1 3.3Å; N1918-I1922 WeakPolarHBondContact O-CG1 3.43Å; N1918-I1922 PolarHBondContact O-N 3.11Å; N1918-L2083 PolarHBondContact ND2-O 2.93Å; N1918-L2083 PolarHBondContact OD1-O 3.06Å; N1918-H2086 HydrophobicContact CB-CB 4.01Å; N1918-H2086 WeakPolarHBondContact OD1-CB 2.95Å; N1918-H2086 PolarHBondContact OD1-N 3.26Å; N1918-H2086 VanDerWaalsContact OD1-N 3.07Å
1919	T	87	Confident	79.1	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-54	-44.3	176.3	-68.1	0	0	0	0	112.9	L1915 V1917 I1922 A1923 I1926 L2026 M2027 V2030	L1915-T1919 WeakPolarHBondContact O-CB 3.23Å; L1915-T1919 PolarHBondContact O-N 3.16Å; L1915-T1919 PolarHBondContact O-OG1 2.78Å; V1917-T1919 PolarHBondContact O-N 3.04Å; T1919-I1922 PolarHBondContact O-N 3.2Å; T1919-A1923 WeakPolarHBondContact O-CA 3.32Å; T1919-A1923 PolarHBondContact O-N 3.29Å; T1919-I1926 HydrophobicContact CG2-CD1 4.19Å; T1919-L2026 HydrophobicContact CG2-CB 3.47Å; T1919-L2026 VanDerWaalsContact CG2-CB 3.47Å; T1919-M2027 HydrophobicContact CG2-CG 4.04Å; T1919-V2030 HydrophobicContact CG2-CG2 4.18Å
1920	L	84.4	Confident	77.5	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-66.6	-41.5	177.5	-82	164.7	0	0	0	112.3	A1916 V1917 N1918 I1922 A1923 F1974 L1977 R1978 V1981 F2003 V2023	A1916-L1920 PolarHBondContact O-N 2.88Å; V1917-L1920 PolarHBondContact O-N 2.93Å; N1918-L1920 VanDerWaalsContact C-N 3.34Å; N1918-L1920 PolarHBondContact O-N 3.32Å; L1920-I1922 VanDerWaalsContact C-N 3.35Å; L1920-I1922 PolarHBondContact O-N 3.24Å; L1920-A1923 WeakPolarHBondContact O-CB 3.24Å; L1920-A1923 PolarHBondContact O-N 2.81Å; L1920-F1974 HydrophobicContact CD2-CD2 4.29Å; L1920-F1974 HydrophobicContact CD2-CE2 3.55Å; L1920-F1974 HydrophobicContact CD2-CZ 3.72Å; L1920-L1977 HydrophobicContact CD2-CD2 4.49Å; L1920-R1978 HydrophobicContact CD2-CB 4.35Å; L1920-R1978 WeakPolarHBondContact O-CD 3.43Å; L1920-R1978 WeakPolarHBondContact O-CG 3.34Å; L1920-R1978 PolarHBondContact O-NE 2.77Å; L1920-V1981 HydrophobicContact CD1-CG2 4.24Å; L1920-F2003 HydrophobicContact CD1-CD1 4.39Å; L1920-F2003 HydrophobicContact CD1-CE1 3.29Å; L1920-F2003 HydrophobicContact CD1-CZ 3.39Å; L1920-V2023 HydrophobicContact CD2-CG2 4.18Å
1921	I	82.3	Confident	75.6	Confident	25 Å²	25	40.3 Å²	40.3	13%	0.128	22%	0.219	C	C	.	.	H	α-helix	trans	-58.9	-48.6	175.6	-64.8	162.9	0	0	0	110	V1917 N1918 A1923 R1978 L1982 V1985 H2086	V1917-I1921 HydrophobicContact CG1-CD1 4.07Å; V1917-I1921 VanDerWaalsContact O-CG1 3.32Å; V1917-I1921 WeakPolarHBondContact O-CG1 3.45Å; V1917-I1921 PolarHBondContact O-N 2.89Å; N1918-I1921 PolarHBondContact O-N 2.98Å; N1918-I1921 VanDerWaalsContact O-N 3.14Å; I1921-A1923 PolarHBondContact O-N 3.36Å; I1921-R1978 PolarHBondContact O-NE 3.1Å; I1921-R1978 PolarHBondContact O-NH2 3.43Å; I1921-L1982 HydrophobicContact CB-CD2 4.49Å; I1921-L1982 HydrophobicContact CG1-CD2 4.01Å; I1921-L1982 HydrophobicContact CG2-CD2 4.29Å; I1921-V1985 HydrophobicContact CD1-CG1 4.33Å; I1921-V1985 HydrophobicContact CD1-CG2 4.21Å; I1921-H2086 HydrophobicContact CD1-CB 4.04Å
1922	I	83.1	Confident	73.8	Confident	8 Å²	8	41 Å²	41	4%	0.041	23%	0.23	C	C	.	.	H	α-helix	trans	-84.9	-1.6	-175.5	67.7	149.4	0	0	0	115.2	N1918 T1919 L1920 N1924 R1925 I1926 V2030 L2083	N1918-I1922 VanDerWaalsContact O-CG1 3.3Å; N1918-I1922 WeakPolarHBondContact O-CG1 3.43Å; N1918-I1922 PolarHBondContact O-N 3.11Å; T1919-I1922 PolarHBondContact O-N 3.2Å; L1920-I1922 VanDerWaalsContact C-N 3.35Å; L1920-I1922 PolarHBondContact O-N 3.24Å; I1922-N1924 VanDerWaalsContact C-N 3.25Å; I1922-N1924 PolarHBondContact O-N 2.91Å; I1922-R1925 WeakPolarHBondContact O-CB 3.28Å; I1922-R1925 PolarHBondContact O-N 2.9Å; I1922-I1926 HydrophobicContact CD1-CD1 4.36Å; I1922-I1926 HydrophobicContact CD1-CG1 4.13Å; I1922-I1926 HydrophobicContact CG1-CD1 4.4Å; I1922-I1926 HydrophobicContact CG1-CG1 4.43Å; I1922-V2030 HydrophobicContact CD1-CG1 4.16Å; I1922-V2030 HydrophobicContact CD1-CG2 3.6Å; I1922-V2030 HydrophobicContact CG1-CG2 4.34Å; I1922-L2083 HydrophobicContact CD1-CB 3.71Å; I1922-L2083 HydrophobicContact CD1-CD2 3.74Å; I1922-L2083 HydrophobicContact CD1-CG 4.27Å; I1922-L2083 WeakPolarHBondContact CD1-O 2.82Å
1923	A	80.1	Confident	71.8	Confident	8 Å²	8	45.7 Å²	45.7	7%	0.066	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-47.2	-41.7	-168.6	0	0	0	0	0	115	T1919 L1920 I1921 R1925 I1926 P1927 F1974 L2026	T1919-A1923 WeakPolarHBondContact O-CA 3.32Å; T1919-A1923 PolarHBondContact O-N 3.29Å; L1920-A1923 WeakPolarHBondContact O-CB 3.24Å; L1920-A1923 PolarHBondContact O-N 2.81Å; I1921-A1923 PolarHBondContact O-N 3.36Å; A1923-R1925 PolarHBondContact O-N 2.97Å; A1923-I1926 PolarHBondContact O-N 2.65Å; A1923-I1926 VanDerWaalsContact O-N 3.14Å; A1923-P1927 WeakPolarHBondContact O-CD 3.19Å; A1923-F1974 HydrophobicContact CB-CE1 3.95Å; A1923-F1974 HydrophobicContact CB-CZ 3.82Å; A1923-L2026 HydrophobicContact CB-CD1 4.47Å
1924	N	77.5	Confident	70.1	Confident	84 Å²	84	50 Å²	50	45%	0.449	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-63.8	-21.3	179	-71	60.1	0	0	0	114.7	I1922 R1978	I1922-N1924 VanDerWaalsContact C-N 3.25Å; I1922-N1924 PolarHBondContact O-N 2.91Å; N1924-R1978 PolarHBondContact OD1-NE 3.28Å; N1924-R1978 PolarHBondContact OD1-NH1 3.31Å; N1924-R1978 PolarHBondContact OD1-NH2 3.17Å
1925	R	74.1	Confident	67.9	Low	120 Å²	120	52.7 Å²	52.7	45%	0.453	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-88.4	-17.1	175.7	-63.9	-175.7	-177.3	158.7	2.7	113.3	I1922 A1923 E1928 L2083	I1922-R1925 WeakPolarHBondContact O-CB 3.28Å; I1922-R1925 PolarHBondContact O-N 2.9Å; A1923-R1925 PolarHBondContact O-N 2.97Å; R1925-E1928 WeakPolarHBondContact CA-OE2 3.08Å; R1925-E1928 WeakPolarHBondContact O-CB 3.37Å; R1925-E1928 PolarHBondContact O-N 2.68Å; R1925-E1928 VanDerWaalsContact O-N 3.14Å; R1925-L2083 HydrophobicContact CB-CD2 4.41Å
1926	I	72.8	Confident	65.8	Low	2 Å²	2	55 Å²	55	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-61.3	-40.5	-175.3	-60.4	175.9	0	0	0	112.3	T1919 I1922 A1923 E1928 L1929 L2026 K2029 V2030	T1919-I1926 HydrophobicContact CG2-CD1 4.19Å; I1922-I1926 HydrophobicContact CD1-CD1 4.36Å; I1922-I1926 HydrophobicContact CD1-CG1 4.13Å; I1922-I1926 HydrophobicContact CG1-CD1 4.4Å; I1922-I1926 HydrophobicContact CG1-CG1 4.43Å; A1923-I1926 PolarHBondContact O-N 2.65Å; A1923-I1926 VanDerWaalsContact O-N 3.14Å; I1926-E1928 VanDerWaalsContact C-N 3.27Å; I1926-E1928 PolarHBondContact O-N 3.14Å; I1926-L1929 WeakPolarHBondContact O-CB 3.4Å; I1926-L1929 PolarHBondContact O-N 3.33Å; I1926-L2026 HydrophobicContact CB-CD2 4.47Å; I1926-L2026 HydrophobicContact CD1-CB 4.05Å; I1926-L2026 HydrophobicContact CD1-CD2 4.01Å; I1926-L2026 HydrophobicContact CD1-CG 4.47Å; I1926-L2026 HydrophobicContact CG2-CD2 4.07Å; I1926-K2029 HydrophobicContact CG2-CB 4.19Å; I1926-K2029 HydrophobicContact CG2-CD 3.9Å; I1926-V2030 HydrophobicContact CD1-CG2 3.52Å; I1926-V2030 HydrophobicContact CG1-CG2 4.13Å
1927	P	65.7	Low	63.9	Low	37 Å²	37	59.1 Å²	59.1	24%	0.24	33%	0.327	C	S	.	.	H	α-helix	trans	-62.2	-30.7	175.4	-24.7	35.6	0	0	0	114.2	A1923 L1929 E1930	A1923-P1927 WeakPolarHBondContact O-CD 3.19Å; P1927-L1929 PolarHBondContact O-N 2.71Å; P1927-E1930 PolarHBondContact O-N 2.83Å
1928	E	64.3	Low	61.8	Low	126 Å²	126	64.4 Å²	64.4	59%	0.589	36%	0.356	S	S	*	.	H	α-helix	trans	-63.9	-25.3	179.6	-52.2	-179.8	134	0	0	111.7	R1925 I1926	R1925-E1928 WeakPolarHBondContact CA-OE2 3.08Å; R1925-E1928 WeakPolarHBondContact O-CB 3.37Å; R1925-E1928 PolarHBondContact O-N 2.68Å; R1925-E1928 VanDerWaalsContact O-N 3.14Å; I1926-E1928 VanDerWaalsContact C-N 3.27Å; I1926-E1928 PolarHBondContact O-N 3.14Å
1929	L	57.4	Low	59.6	Low	83 Å²	83	73.4 Å²	73.4	44%	0.435	39%	0.389	S	S	.	.	H	α-helix	trans	-76	-25.3	178.9	-53.5	170.4	0	0	0	113.5	I1926 P1927 G1931 L2083	I1926-L1929 WeakPolarHBondContact O-CB 3.4Å; I1926-L1929 PolarHBondContact O-N 3.33Å; P1927-L1929 PolarHBondContact O-N 2.71Å; L1929-G1931 VanDerWaalsContact C-N 3.26Å; L1929-G1931 PolarHBondContact O-N 2.71Å; L1929-L2083 HydrophobicContact CD1-CD1 3.39Å; L1929-L2083 HydrophobicContact CD1-CD2 3.97Å; L1929-L2083 HydrophobicContact CD1-CG 4.32Å; L1929-L2083 HydrophobicContact CD2-CD1 3.86Å; L1929-L2083 HydrophobicContact CD2-CD2 4.27Å; L1929-L2083 HydrophobicContact CG-CD1 4.26Å
1930	E	57	Low	57.4	Low	107 Å²	107	77.6 Å²	77.6	50%	0.5	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	1.1	-174	-57.5	-166.4	115.9	0	0	112.6	P1927 A1932 K2029	P1927-E1930 PolarHBondContact O-N 2.83Å; E1930-A1932 HydrophobicContact CB-CB 4.36Å; E1930-A1932 PolarHBondContact O-N 3.31Å; E1930-A1932 VanDerWaalsContact O-N 3.14Å; E1930-K2029 WeakPolarHBondContact OE1-CE 3.41Å; E1930-K2029 IonicContact OE1-NZ 2.75Å; E1930-K2029 PolarHBondContact OE1-NZ 2.69Å; E1930-K2029 IonicContact OE2-NZ 3.21Å; E1930-K2029 PolarHBondContact OE2-NZ 3.24Å
1931	G	48	Very low	55.2	Low	68 Å²	68	79.4 Å²	79.4	70%	0.701	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	6.5	-169.5	0	0	0	0	0	113.4	L1929 T1933	L1929-G1931 VanDerWaalsContact C-N 3.26Å; L1929-G1931 PolarHBondContact O-N 2.71Å; G1931-T1933 PolarHBondContact O-N 3.2Å
1932	A	42.9	Very low	53.2	Low	44 Å²	44	81.8 Å²	81.8	36%	0.364	45%	0.448	S	S	.	.			trans	-67	121.8	177.3	0	0	0	0	0	109.6	E1930	E1930-A1932 HydrophobicContact CB-CB 4.36Å; E1930-A1932 PolarHBondContact O-N 3.31Å; E1930-A1932 VanDerWaalsContact O-N 3.14Å
1933	T	38.1	Very low	51.2	Low	108 Å²	108	85.8 Å²	85.8	66%	0.663	48%	0.482	S	S	*	.			trans	-65.2	148.9	169.8	49.2	0	0	0	0	110.2	G1931 L1935	G1931-T1933 PolarHBondContact O-N 3.2Å; T1933-L1935 PolarHBondContact O-N 2.89Å
1934	L	39.1	Very low	49.2	Very low	137 Å²	137	91.9 Å²	91.9	72%	0.717	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	47.8	-171.9	-74.9	160.3	0	0	0	115
1935	L	33.5	Very low	47.3	Very low	123 Å²	123	95.4 Å²	95.4	64%	0.644	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-5	-177.2	-73.9	172.3	0	0	0	114	T1933	T1933-L1935 PolarHBondContact O-N 2.89Å
1936	S	40	Very low	45.7	Very low	58 Å²	58	94.3 Å²	94.3	41%	0.406	53%	0.527	S	S	.	.	S	Bend	trans	-110.8	161.3	171.8	48.9	0	0	0	0	112.2	D1938	S1936-D1938 PolarHBondContact O-N 3.07Å; S1936-D1938 VanDerWaalsContact O-N 3.11Å
1937	F	43.8	Very low	44.1	Very low	92 Å²	92	100 Å²	100	40%	0.404	56%	0.557	S	S	.	*	S	Bend	trans	66.9	-88.1	178.7	-46.3	-66.5	0	0	0	115.6	R1939 L1940	F1937-R1939 PolarHBondContact O-N 3.29Å; F1937-L1940 PolarHBondContact O-N 2.67Å
1938	D	41.2	Very low	42.9	Very low	121 Å²	121	105.4 Å²	105.4	65%	0.647	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-62.7	-22.4	-166.2	-104	-17.5	0	0	0	114.5	S1936 L1940	S1936-D1938 PolarHBondContact O-N 3.07Å; S1936-D1938 VanDerWaalsContact O-N 3.11Å; D1938-L1940 VanDerWaalsContact C-N 3.34Å; D1938-L1940 PolarHBondContact O-N 3.29Å
1939	R	39.1	Very low	41.9	Very low	188 Å²	188	104.4 Å²	104.4	71%	0.709	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-81.8	-1.1	177.5	-77.4	-172.9	172.5	-169.8	-0.6	115.4	F1937 S1941	F1937-R1939 PolarHBondContact O-N 3.29Å; R1939-S1941 PolarHBondContact O-N 3.37Å
1940	L	40.6	Very low	41.1	Very low	89 Å²	89	105 Å²	105	47%	0.466	58%	0.575	S	S	.	*	G	3₁₀ helix	trans	-83.7	11.3	175.5	-67.5	173.7	0	0	0	113.5	F1937 D1938 A1942 A1968	F1937-L1940 PolarHBondContact O-N 2.67Å; D1938-L1940 VanDerWaalsContact C-N 3.34Å; D1938-L1940 PolarHBondContact O-N 3.29Å; L1940-A1942 PolarHBondContact O-N 2.95Å; L1940-A1968 HydrophobicContact CD1-CB 4.32Å
1941	S	39	Very low	40.3	Very low	40 Å²	40	106.1 Å²	106.1	28%	0.28	58%	0.584	S	S	.	*			trans	-63.8	99.8	168.3	-175.1	0	0	0	0	111.3	R1939 A1943 D1944	R1939-S1941 PolarHBondContact O-N 3.37Å; S1941-A1943 PolarHBondContact O-N 2.9Å; S1941-D1944 WeakPolarHBondContact CB-OD2 3.46Å; S1941-D1944 PolarHBondContact O-N 2.74Å; S1941-D1944 PolarHBondContact OG-OD2 3.05Å
1942	A	40.4	Very low	40	Very low	75 Å²	75	109.4 Å²	109.4	62%	0.62	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-9.9	173.3	0	0	0	0	0	113.5	L1940	L1940-A1942 PolarHBondContact O-N 2.95Å
1943	A	41.1	Very low	39.6	Very low	91 Å²	91	114.9 Å²	114.9	75%	0.752	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-22.6	-179	0	0	0	0	0	113.9	S1941	S1941-A1943 PolarHBondContact O-N 2.9Å
1944	D	37.9	Very low	39.4	Very low	137 Å²	137	113.1 Å²	113.1	73%	0.733	61%	0.607	S	S	*	*	S	Bend	trans	-94.8	8.1	-172.6	-63.2	-70.9	0	0	0	113.9	S1941	S1941-D1944 WeakPolarHBondContact CB-OD2 3.46Å; S1941-D1944 PolarHBondContact O-N 2.74Å; S1941-D1944 PolarHBondContact OG-OD2 3.05Å
1945	R	37.3	Very low	38.9	Very low	157 Å²	157	111.8 Å²	111.8	59%	0.592	60%	0.604	S	S	*	*	S	Bend	trans	-121.3	137.2	175	-76.3	-171.7	167.6	-176	-7.1	111.9	E1949	R1945-E1949 IonicContact NE-OE2 2.72Å
1946	T	40.6	Very low	39.2	Very low	97 Å²	97	111.8 Å²	111.8	60%	0.595	61%	0.605	S	S	*	*			trans	-70.4	143.9	174.6	47.8	0	0	0	0	110.8	E1948 E1949	T1946-E1948 PolarHBondContact O-N 3.03Å; T1946-E1949 PolarHBondContact O-N 2.93Å
1947	L	38.2	Very low	39	Very low	123 Å²	123	114.6 Å²	114.6	64%	0.644	61%	0.614	S	S	*	*	H	α-helix	trans	-55.3	-28.4	-175.3	-161.8	75.2	0	0	0	113.5	Q1950 L1951	L1947-Q1950 PolarHBondContact O-N 3.11Å; L1947-L1951 HydrophobicContact CG-CD1 4.33Å; L1947-L1951 PolarHBondContact O-N 2.94Å; L1947-L1951 VanDerWaalsContact O-N 3.16Å
1948	E	41.8	Very low	38.8	Very low	150 Å²	150	111.9 Å²	111.9	70%	0.701	61%	0.612	S	S	*	*	H	α-helix	trans	-64	-33.2	176.3	-108.8	176.3	157.5	0	0	113.8	T1946 N1952	T1946-E1948 PolarHBondContact O-N 3.03Å; E1948-N1952 PolarHBondContact O-ND2 2.9Å
1949	E	43.7	Very low	38.7	Very low	105 Å²	105	108.4 Å²	108.4	49%	0.491	60%	0.596	S	S	.	*	H	α-helix	trans	-73.4	-36.9	174.7	-67.8	-163.4	147.8	0	0	111.6	R1945 T1946	R1945-E1949 IonicContact NE-OE2 2.72Å; T1946-E1949 PolarHBondContact O-N 2.93Å
1950	Q	39.2	Very low	38.9	Very low	95 Å²	95	105.8 Å²	105.8	44%	0.444	59%	0.591	S	S	.	*	H	α-helix	trans	-68.5	-38.8	-178.1	-68.8	177.9	-16.3	0	0	112.2	L1947	L1947-Q1950 PolarHBondContact O-N 3.11Å
1951	L	40.7	Very low	39	Very low	131 Å²	131	105 Å²	105	69%	0.686	59%	0.587	S	S	*	*	H	α-helix	trans	-69.4	-34.4	179.8	-78.2	163.9	0	0	0	113.5	L1947 Q1953	L1947-L1951 HydrophobicContact CG-CD1 4.33Å; L1947-L1951 PolarHBondContact O-N 2.94Å; L1947-L1951 VanDerWaalsContact O-N 3.16Å; L1951-Q1953 PolarHBondContact O-N 3.1Å
1952	N	41.2	Very low	39.5	Very low	136 Å²	136	105 Å²	105	73%	0.727	59%	0.585	S	S	*	*	H	α-helix	trans	-78.6	-12.2	-170.9	-82.3	-56	0	0	0	115.3	E1948	E1948-N1952 PolarHBondContact O-ND2 2.9Å
1953	Q	35.6	Very low	39.8	Very low	159 Å²	159	104.8 Å²	104.8	74%	0.743	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	-1.7	-178.6	-66.3	-165.6	-12.1	0	0	115.1	L1951 V1955	L1951-Q1953 PolarHBondContact O-N 3.1Å; Q1953-V1955 PolarHBondContact O-N 3.31Å
1954	G	32.6	Very low	40.2	Very low	72 Å²	72	109.2 Å²	109.2	74%	0.742	58%	0.578	S	S	*	*			trans	65.4	-6.1	158.4	0	0	0	0	0	119
1955	V	29.9	Very low	41.2	Very low	109 Å²	109	104.9 Å²	104.9	66%	0.661	55%	0.554	S	S	*	*			trans	-127.5	113	-176.7	-172	0	0	0	0	110.5	Q1953 L1957	Q1953-V1955 PolarHBondContact O-N 3.31Å; V1955-L1957 VanDerWaalsContact C-N 3.26Å; V1955-L1957 HydrophobicContact CB-CD1 4.41Å; V1955-L1957 HydrophobicContact CG1-CD1 4.1Å; V1955-L1957 HydrophobicContact CG1-CG 4.02Å; V1955-L1957 PolarHBondContact O-N 2.89Å
1956	N	38.9	Very low	42.4	Very low	123 Å²	123	99.2 Å²	99.2	66%	0.658	54%	0.535	S	S	*	.			trans	-83.7	64.3	-172.8	-140.8	0.9	0	0	0	111.8	G1958 T1959	N1956-G1958 VanDerWaalsContact C-N 3.32Å; N1956-G1958 PolarHBondContact O-N 2.95Å; N1956-T1959 PolarHBondContact O-OG1 3.26Å; N1956-T1959 VanDerWaalsContact O-OG1 3.06Å
1957	L	35.2	Very low	43.6	Very low	116 Å²	116	96.2 Å²	96.2	61%	0.607	52%	0.516	S	S	*	.	H	α-helix	trans	-60.7	-34	-173.1	-87.4	141	0	0	0	114.1	V1955 T1959 H1960 I1961	V1955-L1957 VanDerWaalsContact C-N 3.26Å; V1955-L1957 HydrophobicContact CB-CD1 4.41Å; V1955-L1957 HydrophobicContact CG1-CD1 4.1Å; V1955-L1957 HydrophobicContact CG1-CG 4.02Å; V1955-L1957 PolarHBondContact O-N 2.89Å; L1957-T1959 PolarHBondContact O-N 2.83Å; L1957-H1960 PolarHBondContact O-N 2.84Å; L1957-I1961 PolarHBondContact O-N 3.38Å
1958	G	39.6	Very low	44.8	Very low	35 Å²	35	90.5 Å²	90.5	36%	0.361	49%	0.487	S	S	.	.	H	α-helix	trans	-60.5	-43	-175.3	0	0	0	0	0	113.6	N1956 H1960 I1961 T1962	N1956-G1958 VanDerWaalsContact C-N 3.32Å; N1956-G1958 PolarHBondContact O-N 2.95Å; G1958-H1960 VanDerWaalsContact C-N 3.31Å; G1958-H1960 PolarHBondContact O-N 3.27Å; G1958-I1961 PolarHBondContact O-N 3.44Å; G1958-I1961 VanDerWaalsContact O-N 3.12Å; G1958-T1962 PolarHBondContact O-N 2.95Å; G1958-T1962 VanDerWaalsContact O-N 3.13Å; G1958-T1962 PolarHBondContact O-OG1 3.32Å
1959	T	40.8	Very low	46.1	Very low	49 Å²	49	83.7 Å²	83.7	30%	0.301	46%	0.456	S	S	.	.	H	α-helix	trans	-70	-27.5	-178	48.6	0	0	0	0	113.2	T1485 N1956 L1957 T1962 S1963	T1485-T1959 HydrophobicContact CG2-CG2 3.47Å; T1485-T1959 VanDerWaalsContact CG2-CG2 3.47Å; N1956-T1959 PolarHBondContact O-OG1 3.26Å; N1956-T1959 VanDerWaalsContact O-OG1 3.06Å; L1957-T1959 PolarHBondContact O-N 2.83Å; T1959-T1962 WeakPolarHBondContact CA-OG1 3.4Å; T1959-T1962 PolarHBondContact O-OG1 3.34Å; T1959-S1963 PolarHBondContact O-N 3.03Å
1960	H	41.9	Very low	47.6	Very low	133 Å²	133	78.7 Å²	78.7	62%	0.616	43%	0.433	S	S	*	.	H	α-helix	trans	-77.4	-20.3	172.5	-79.7	-74.9	0	0	0	113.2	L1957 G1958 S1963 Y1964	L1957-H1960 PolarHBondContact O-N 2.84Å; G1958-H1960 VanDerWaalsContact C-N 3.31Å; G1958-H1960 PolarHBondContact O-N 3.27Å; H1960-S1963 PolarHBondContact O-OG 3Å; H1960-S1963 VanDerWaalsContact O-OG 3.08Å; H1960-Y1964 WeakPolarHBondContact O-CD2 3.43Å
1961	I	44.4	Very low	49.4	Very low	71 Å²	71	76.2 Å²	76.2	36%	0.364	43%	0.426	S	S	.	.	H	α-helix	trans	-79.3	-47.6	172.8	-65.6	167.8	0	0	0	109.3	L1957 G1958 S1963 Y1964 D1965 A1968	L1957-I1961 PolarHBondContact O-N 3.38Å; G1958-I1961 PolarHBondContact O-N 3.44Å; G1958-I1961 VanDerWaalsContact O-N 3.12Å; I1961-S1963 PolarHBondContact O-N 3Å; I1961-S1963 VanDerWaalsContact O-N 3.16Å; I1961-Y1964 PolarHBondContact O-N 3.32Å; I1961-D1965 HydrophobicContact CG2-CB 4.24Å; I1961-D1965 PolarHBondContact O-N 2.62Å; I1961-A1968 HydrophobicContact CG2-CB 4.11Å
1962	T	48.9	Very low	51.1	Low	41 Å²	41	70.8 Å²	70.8	25%	0.252	40%	0.4	S	S	.	.	H	α-helix	trans	-65.3	-17.4	-179.7	50.9	0	0	0	0	114.6	G1958 T1959 Y1964 A1968	G1958-T1962 PolarHBondContact O-N 2.95Å; G1958-T1962 VanDerWaalsContact O-N 3.13Å; G1958-T1962 PolarHBondContact O-OG1 3.32Å; T1959-T1962 WeakPolarHBondContact CA-OG1 3.4Å; T1959-T1962 PolarHBondContact O-OG1 3.34Å; T1962-Y1964 VanDerWaalsContact C-N 3.33Å; T1962-A1968 HydrophobicContact CG2-CB 4.34Å
1963	S	46.7	Very low	53.3	Low	70 Å²	70	64.6 Å²	64.6	49%	0.49	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-11	173.7	61.3	0	0	0	0	114.3	T1959 H1960 I1961	T1959-S1963 PolarHBondContact O-N 3.03Å; H1960-S1963 PolarHBondContact O-OG 3Å; H1960-S1963 VanDerWaalsContact O-OG 3.08Å; I1961-S1963 PolarHBondContact O-N 3Å; I1961-S1963 VanDerWaalsContact O-N 3.16Å
1964	Y	49.8	Very low	55.7	Low	184 Å²	184	58.4 Å²	58.4	72%	0.722	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.8	-27.8	-178.2	-65.6	-67.4	0	0	0	113.8	H1960 I1961 T1962	H1960-Y1964 WeakPolarHBondContact O-CD2 3.43Å; I1961-Y1964 PolarHBondContact O-N 3.32Å; T1962-Y1964 VanDerWaalsContact C-N 3.33Å
1965	D	57.6	Low	58.2	Low	46 Å²	46	61.6 Å²	61.6	25%	0.246	33%	0.328	C	S	.	.			trans	-98.2	96.3	169.5	-177.1	16.5	0	0	0	111.1	I1961 T1967 A1968 A1969	I1961-D1965 HydrophobicContact CG2-CB 4.24Å; I1961-D1965 PolarHBondContact O-N 2.62Å; D1965-T1967 PolarHBondContact O-N 3.11Å; D1965-T1967 VanDerWaalsContact O-N 3.12Å; D1965-T1967 WeakPolarHBondContact OD1-CA 3.41Å; D1965-T1967 WeakPolarHBondContact OD1-CB 3.48Å; D1965-T1967 PolarHBondContact OD1-N 2.86Å; D1965-T1967 PolarHBondContact OD1-OG1 3.38Å; D1965-A1968 HydrophobicContact CB-CB 4.02Å; D1965-A1968 PolarHBondContact O-N 3.37Å; D1965-A1968 VanDerWaalsContact O-N 3.1Å; D1965-A1968 WeakPolarHBondContact OD2-CB 3.47Å; D1965-A1968 PolarHBondContact OD2-N 2.94Å; D1965-A1969 PolarHBondContact O-N 3.45Å
1966	E	63.5	Low	61	Low	38 Å²	38	56.6 Å²	56.6	18%	0.178	30%	0.297	C	S	.	.	H	α-helix	trans	-45.4	-38	169.9	-51.7	160.8	154.9	0	0	112.4	L1885 A1969 C1970 A2018 R2021 K2025	L1885-E1966 HydrophobicContact CD1-CG 4.5Å; L1885-E1966 VanDerWaalsContact CD2-CD 3.47Å; L1885-E1966 HydrophobicContact CD2-CG 4.14Å; L1885-E1966 WeakPolarHBondContact CD2-OE1 3.23Å; L1885-E1966 HydrophobicContact CG-CG 4.37Å; L1885-E1966 WeakPolarHBondContact CG-OE1 2.99Å; E1966-A1969 PolarHBondContact O-N 2.85Å; E1966-C1970 PolarHBondContact O-N 2.94Å; E1966-C1970 PolarHBondContact O-SG 2.9Å; E1966-A2018 HydrophobicContact CB-CB 4.41Å; E1966-R2021 IonicContact OE1-CZ 2.69Å; E1966-R2021 IonicContact OE1-NH1 2.72Å; E1966-R2021 PolarHBondContact OE1-NH1 3.05Å; E1966-R2021 WeakPolarHBondContact OE2-CD 3.44Å; E1966-R2021 IonicContact OE2-CZ 3.1Å; E1966-R2021 IonicContact OE2-NE 3.99Å; E1966-R2021 IonicContact OE2-NH1 2.75Å; E1966-R2021 PolarHBondContact OE2-NH1 2.87Å; E1966-K2025 IonicContact OE2-NZ 3.69Å; E1966-K2025 PolarHBondContact OE2-NZ 3.15Å
1967	T	65.6	Low	63.5	Low	35 Å²	35	50.7 Å²	50.7	22%	0.215	27%	0.266	C	S	.	.	H	α-helix	trans	-71	-41.4	-175.9	-23.9	0	0	0	0	111	D1965 S1971 T2022	D1965-T1967 PolarHBondContact O-N 3.11Å; D1965-T1967 VanDerWaalsContact O-N 3.12Å; D1965-T1967 WeakPolarHBondContact OD1-CA 3.41Å; D1965-T1967 WeakPolarHBondContact OD1-CB 3.48Å; D1965-T1967 PolarHBondContact OD1-N 2.86Å; D1965-T1967 PolarHBondContact OD1-OG1 3.38Å; T1967-S1971 PolarHBondContact O-N 3.47Å; T1967-T2022 HydrophobicContact CG2-CG2 3.71Å
1968	A	63.2	Low	66.1	Low	3 Å²	3	47.4 Å²	47.4	3%	0.025	25%	0.246	C	C	.	.	H	α-helix	trans	-67.5	-39.2	172.5	0	0	0	0	0	111.5	L1940 I1961 T1962 D1965 S1971	L1940-A1968 HydrophobicContact CD1-CB 4.32Å; I1961-A1968 HydrophobicContact CG2-CB 4.11Å; T1962-A1968 HydrophobicContact CG2-CB 4.34Å; D1965-A1968 HydrophobicContact CB-CB 4.02Å; D1965-A1968 PolarHBondContact O-N 3.37Å; D1965-A1968 VanDerWaalsContact O-N 3.1Å; D1965-A1968 WeakPolarHBondContact OD2-CB 3.47Å; D1965-A1968 PolarHBondContact OD2-N 2.94Å; A1968-S1971 VanDerWaalsContact O-CB 3.31Å; A1968-S1971 WeakPolarHBondContact O-CB 3.47Å; A1968-S1971 PolarHBondContact O-N 2.86Å; A1968-S1971 PolarHBondContact O-OG 2.74Å
1969	A	68.4	Low	68.4	Low	6 Å²	6	48.7 Å²	48.7	5%	0.05	24%	0.244	C	C	.	.	H	α-helix	trans	-63.1	-46.7	180	0	0	0	0	0	112.5	R1482 D1965 E1966	R1482-A1969 CarbonylContact C-O 3.46Å; R1482-A1969 VanDerWaalsContact C-O 3.28Å; R1482-A1969 VanDerWaalsContact CA-O 3.31Å; R1482-A1969 WeakPolarHBondContact CA-O 3.37Å; R1482-A1969 HydrophobicContact CB-CB 4.14Å; D1965-A1969 PolarHBondContact O-N 3.45Å; E1966-A1969 PolarHBondContact O-N 2.85Å
1970	C	76.6	Confident	70.9	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.007	23%	0.23	C	C	.	.	H	α-helix	trans	-85.7	-0.1	179.3	71	0	0	0	0	114.9	E1966 A1972 A1973 F1974 A2018 L2019 T2022	E1966-C1970 PolarHBondContact O-N 2.94Å; E1966-C1970 PolarHBondContact O-SG 2.9Å; C1970-A1972 PolarHBondContact O-N 2.82Å; C1970-A1973 WeakPolarHBondContact O-CB 3.4Å; C1970-A1973 PolarHBondContact O-N 3.06Å; C1970-F1974 PolarHBondContact O-N 3Å; C1970-A2018 HydrophobicContact CB-CB 4.42Å; C1970-L2019 HydrophobicContact CB-CD2 3.73Å; C1970-L2019 HydrophobicContact CB-CG 4.01Å; C1970-T2022 PolarHBondContact SG-OG1 3.04Å
1971	S	75.7	Confident	73.1	Confident	43 Å²	43	40.1 Å²	40.1	30%	0.301	20%	0.201	S	C	.	.	H	α-helix	trans	-49.9	-45.5	-172.7	58.3	0	0	0	0	115.4	T1967 A1968 F1974 R1975	T1967-S1971 PolarHBondContact O-N 3.47Å; A1968-S1971 VanDerWaalsContact O-CB 3.31Å; A1968-S1971 WeakPolarHBondContact O-CB 3.47Å; A1968-S1971 PolarHBondContact O-N 2.86Å; A1968-S1971 PolarHBondContact O-OG 2.74Å; S1971-F1974 PolarHBondContact O-N 3.4Å; S1971-R1975 PolarHBondContact O-N 2.69Å
1972	A	78	Confident	75.2	Confident	16 Å²	16	39.5 Å²	39.5	13%	0.132	20%	0.198	C	C	.	.	H	α-helix	trans	-65.7	-43.6	178.9	0	0	0	0	0	111.9	C1970 R1975 I1976	C1970-A1972 PolarHBondContact O-N 2.82Å; A1972-R1975 PolarHBondContact O-N 3.44Å; A1972-I1976 WeakPolarHBondContact O-CG1 2.9Å; A1972-I1976 PolarHBondContact O-N 2.82Å
1973	A	85.7	Confident	77.1	Confident	7 Å²	7	39.2 Å²	39.2	6%	0.058	20%	0.2	C	C	.	.	H	α-helix	trans	-66.6	-37.5	176.9	0	0	0	0	0	112.2	Y1854 W1866 C1970 I1976 L1977 L2019	Y1854-A1973 PolarHBondContact OH-O 2.94Å; W1866-A1973 HydrophobicContact CH2-CB 3.6Å; W1866-A1973 HydrophobicContact CZ2-CB 4.24Å; W1866-A1973 HydrophobicContact CZ3-CB 4.47Å; C1970-A1973 WeakPolarHBondContact O-CB 3.4Å; C1970-A1973 PolarHBondContact O-N 3.06Å; A1973-I1976 PolarHBondContact O-N 3.1Å; A1973-L1977 WeakPolarHBondContact O-CB 3.38Å; A1973-L1977 PolarHBondContact O-N 2.87Å; A1973-L2019 HydrophobicContact CB-CD1 4.11Å; A1973-L2019 HydrophobicContact CB-CD2 4.15Å
1974	F	87.7	Confident	79.2	Confident	28 Å²	28	36.1 Å²	36.1	12%	0.123	18%	0.178	C	C	.	.	H	α-helix	trans	-63.7	-40.3	173.3	176.3	-89.9	0	0	0	112.1	L1920 A1923 C1970 S1971 I1976 L1977 R1978 L2019 T2022 V2023 L2026	L1920-F1974 HydrophobicContact CD2-CD2 4.29Å; L1920-F1974 HydrophobicContact CD2-CE2 3.55Å; L1920-F1974 HydrophobicContact CD2-CZ 3.72Å; A1923-F1974 HydrophobicContact CB-CE1 3.95Å; A1923-F1974 HydrophobicContact CB-CZ 3.82Å; C1970-F1974 PolarHBondContact O-N 3Å; S1971-F1974 PolarHBondContact O-N 3.4Å; F1974-I1976 VanDerWaalsContact C-N 3.3Å; F1974-I1976 PolarHBondContact O-N 2.91Å; F1974-L1977 WeakPolarHBondContact O-CB 3.22Å; F1974-L1977 PolarHBondContact O-N 2.75Å; F1974-R1978 WeakPolarHBondContact O-CB 3.37Å; F1974-R1978 PolarHBondContact O-N 2.8Å; F1974-L2019 HydrophobicContact CB-CD2 3.87Å; F1974-T2022 HydrophobicContact CD2-CG2 3.77Å; F1974-T2022 HydrophobicContact CE2-CG2 3.96Å; F1974-T2022 HydrophobicContact CG-CG2 4.42Å; F1974-V2023 HydrophobicContact CD2-CG2 4.26Å; F1974-V2023 HydrophobicContact CE2-CG2 3.92Å; F1974-L2026 HydrophobicContact CE1-CD1 4.37Å; F1974-L2026 HydrophobicContact CE2-CD1 3.8Å; F1974-L2026 HydrophobicContact CZ-CD1 3.45Å; F1974-L2026 VanDerWaalsContact CZ-CD1 3.45Å
1975	R	84.9	Confident	80.9	Confident	139 Å²	139	28.5 Å²	28.5	53%	0.525	15%	0.151	S	C	.	.	H	α-helix	trans	-62.9	-37.5	174.2	-173.2	175.7	66.3	173.9	-0.4	112	S1971 A1972 N1979	S1971-R1975 PolarHBondContact O-N 2.69Å; A1972-R1975 PolarHBondContact O-N 3.44Å; R1975-N1979 PolarHBondContact O-N 2.9Å; R1975-N1979 PolarHBondContact O-ND2 3.16Å; R1975-N1979 PolarHBondContact O-OD1 3.14Å
1976	I	88.7	Confident	82.2	Confident	4 Å²	4	32.4 Å²	32.4	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-70.5	-42.4	176.8	-65.5	169.2	0	0	0	111	Y1854 H1857 L1858 H1861 H1863 A1972 A1973 F1974 R1978 N1979 M1980	Y1854-I1976 HydrophobicContact CD2-CG2 4.43Å; Y1854-I1976 HydrophobicContact CE2-CB 4.46Å; Y1854-I1976 HydrophobicContact CE2-CG2 4.05Å; H1857-I1976 HydrophobicContact CB-CG2 3.72Å; L1858-I1976 HydrophobicContact CD2-CD1 3.98Å; L1858-I1976 HydrophobicContact CD2-CG2 4.19Å; H1861-I1976 HydrophobicContact CB-CD1 3.61Å; H1861-I1976 HydrophobicContact CB-CG1 4.35Å; H1863-I1976 WeakPolarHBondContact CD2-CD1 3.31Å; H1863-I1976 WeakPolarHBondContact NE2-CD1 3.49Å; A1972-I1976 WeakPolarHBondContact O-CG1 2.9Å; A1972-I1976 PolarHBondContact O-N 2.82Å; A1973-I1976 PolarHBondContact O-N 3.1Å; F1974-I1976 VanDerWaalsContact C-N 3.3Å; F1974-I1976 PolarHBondContact O-N 2.91Å; I1976-R1978 PolarHBondContact O-N 3.25Å; I1976-N1979 PolarHBondContact O-N 2.79Å; I1976-N1979 VanDerWaalsContact O-N 3.17Å; I1976-M1980 PolarHBondContact O-N 2.92Å
1977	L	90.4	Very high	83.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-55.9	-48.6	173.9	-177	72.3	0	0	0	111.1	Y1854 L1920 A1973 F1974 N1979 M1980 V1981 F2003 W2006 L2007 V2023	Y1854-L1977 HydrophobicContact CD2-CD1 4.34Å; Y1854-L1977 HydrophobicContact CE2-CB 3.88Å; Y1854-L1977 HydrophobicContact CE2-CD1 4.03Å; L1920-L1977 HydrophobicContact CD2-CD2 4.49Å; A1973-L1977 WeakPolarHBondContact O-CB 3.38Å; A1973-L1977 PolarHBondContact O-N 2.87Å; F1974-L1977 WeakPolarHBondContact O-CB 3.22Å; F1974-L1977 PolarHBondContact O-N 2.75Å; L1977-N1979 PolarHBondContact O-N 2.7Å; L1977-M1980 HydrophobicContact CD1-CE 4.11Å; L1977-M1980 WeakPolarHBondContact O-CB 3.28Å; L1977-M1980 PolarHBondContact O-N 2.93Å; L1977-V1981 PolarHBondContact O-N 2.97Å; L1977-V1981 VanDerWaalsContact O-N 3.12Å; L1977-F2003 HydrophobicContact CD1-CE2 3.72Å; L1977-F2003 HydrophobicContact CD1-CZ 4Å; L1977-F2003 HydrophobicContact CD2-CZ 4.36Å; L1977-F2003 HydrophobicContact CG-CE2 4.31Å; L1977-F2003 HydrophobicContact CG-CZ 4.16Å; L1977-W2006 HydrophobicContact CD1-CH2 4.05Å; L1977-W2006 HydrophobicContact CD1-CZ3 3.73Å; L1977-L2007 HydrophobicContact CD2-CD1 4.36Å; L1977-V2023 HydrophobicContact CD2-CG2 4.21Å
1978	R	90	Very high	84.2	Confident	47 Å²	47	32.5 Å²	32.5	18%	0.177	16%	0.164	C	C	.	.	H	α-helix	trans	-59.8	-42.6	174.7	-179.4	174.8	-178.6	-103.2	-0.3	112.4	L1920 I1921 N1924 F1974 I1976 M1980 V1981 L1982	L1920-R1978 HydrophobicContact CD2-CB 4.35Å; L1920-R1978 WeakPolarHBondContact O-CD 3.43Å; L1920-R1978 WeakPolarHBondContact O-CG 3.34Å; L1920-R1978 PolarHBondContact O-NE 2.77Å; I1921-R1978 PolarHBondContact O-NE 3.1Å; I1921-R1978 PolarHBondContact O-NH2 3.43Å; N1924-R1978 PolarHBondContact OD1-NE 3.28Å; N1924-R1978 PolarHBondContact OD1-NH1 3.31Å; N1924-R1978 PolarHBondContact OD1-NH2 3.17Å; F1974-R1978 WeakPolarHBondContact O-CB 3.37Å; F1974-R1978 PolarHBondContact O-N 2.8Å; I1976-R1978 PolarHBondContact O-N 3.25Å; R1978-M1980 VanDerWaalsContact C-N 3.31Å; R1978-M1980 PolarHBondContact O-N 3.37Å; R1978-V1981 PolarHBondContact O-N 2.96Å; R1978-L1982 HydrophobicContact CG-CD1 3.91Å; R1978-L1982 HydrophobicContact CG-CG 4.42Å; R1978-L1982 WeakPolarHBondContact O-CB 2.98Å; R1978-L1982 VanDerWaalsContact O-CG 3.26Å; R1978-L1982 WeakPolarHBondContact O-CG 3.41Å; R1978-L1982 PolarHBondContact O-N 3.27Å
1979	N	88.7	Confident	85.1	Confident	62 Å²	62	37.2 Å²	37.2	33%	0.332	19%	0.192	S	C	.	.	H	α-helix	trans	-65	-32.9	178	-72.7	-14.8	0	0	0	113	R1975 I1976 L1977 A1983	R1975-N1979 PolarHBondContact O-N 2.9Å; R1975-N1979 PolarHBondContact O-ND2 3.16Å; R1975-N1979 PolarHBondContact O-OD1 3.14Å; I1976-N1979 PolarHBondContact O-N 2.79Å; I1976-N1979 VanDerWaalsContact O-N 3.17Å; L1977-N1979 PolarHBondContact O-N 2.7Å; N1979-A1983 PolarHBondContact O-N 3.13Å
1980	M	92	Very high	85.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.8	-49.4	174.5	179	179.5	75.9	0	0	111.4	F1853 Y1854 I1976 L1977 R1978 L1982 A1983 W1984 F2003 W2006	F1853-M1980 HydrophobicContact CB-CG 4.25Å; F1853-M1980 HydrophobicContact CB-SD 3.66Å; Y1854-M1980 VanDerWaalsContact CA-SD 3.58Å; Y1854-M1980 HydrophobicContact CD2-CE 4.09Å; Y1854-M1980 HydrophobicContact CD2-SD 4.11Å; Y1854-M1980 HydrophobicContact CG-CE 4.34Å; Y1854-M1980 HydrophobicContact CG-SD 4.37Å; Y1854-M1980 PolarHBondContact N-SD 3.48Å; Y1854-M1980 VanDerWaalsContact N-SD 3.39Å; I1976-M1980 PolarHBondContact O-N 2.92Å; L1977-M1980 HydrophobicContact CD1-CE 4.11Å; L1977-M1980 WeakPolarHBondContact O-CB 3.28Å; L1977-M1980 PolarHBondContact O-N 2.93Å; R1978-M1980 VanDerWaalsContact C-N 3.31Å; R1978-M1980 PolarHBondContact O-N 3.37Å; M1980-L1982 VanDerWaalsContact C-N 3.32Å; M1980-L1982 PolarHBondContact O-N 3.26Å; M1980-A1983 WeakPolarHBondContact O-CA 2.83Å; M1980-A1983 WeakPolarHBondContact O-CB 3.14Å; M1980-A1983 PolarHBondContact O-N 3.26Å; M1980-W1984 HydrophobicContact CE-CH2 3.56Å; M1980-W1984 HydrophobicContact CE-CZ2 4Å; M1980-W1984 HydrophobicContact CE-CZ3 4.21Å; M1980-W1984 HydrophobicContact CG-CD2 4.5Å; M1980-W1984 HydrophobicContact CG-CH2 4.09Å; M1980-W1984 HydrophobicContact CG-CZ2 3.66Å; M1980-W1984 PolarHBondContact O-N 3.44Å; M1980-W1984 VanDerWaalsContact O-N 3.15Å; M1980-W1984 HydrophobicContact SD-CH2 3.97Å; M1980-W1984 HydrophobicContact SD-CZ2 3.75Å; M1980-F2003 HydrophobicContact CE-CE2 4.39Å; M1980-W2006 HydrophobicContact CE-CH2 4.18Å; M1980-W2006 HydrophobicContact CE-CZ3 4.17Å
1981	V	89.4	Confident	86.2	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-62.4	-39.5	177.3	176.1	0	0	0	0	111.4	V1917 L1920 L1977 R1978 A1983 W1984 V1985 F2003	V1917-V1981 HydrophobicContact CG1-CG1 4.01Å; L1920-V1981 HydrophobicContact CD1-CG2 4.24Å; L1977-V1981 PolarHBondContact O-N 2.97Å; L1977-V1981 VanDerWaalsContact O-N 3.12Å; R1978-V1981 PolarHBondContact O-N 2.96Å; V1981-A1983 PolarHBondContact O-N 3.36Å; V1981-W1984 HydrophobicContact CG2-CE3 4.38Å; V1981-W1984 HydrophobicContact CG2-CZ3 4.31Å; V1981-W1984 PolarHBondContact O-N 3.39Å; V1981-V1985 HydrophobicContact CG1-CG2 4.26Å; V1981-V1985 WeakPolarHBondContact O-CB 3.4Å; V1981-V1985 VanDerWaalsContact O-CG2 3.28Å; V1981-V1985 WeakPolarHBondContact O-CG2 3.4Å; V1981-V1985 PolarHBondContact O-N 3.27Å; V1981-F2003 HydrophobicContact CG2-CD1 4.32Å; V1981-F2003 HydrophobicContact CG2-CD2 3.72Å; V1981-F2003 HydrophobicContact CG2-CE1 4.19Å; V1981-F2003 HydrophobicContact CG2-CE2 3.51Å; V1981-F2003 HydrophobicContact CG2-CG 4.12Å; V1981-F2003 HydrophobicContact CG2-CZ 3.79Å
1982	L	88.7	Confident	86.4	Confident	58 Å²	58	55.5 Å²	55.5	30%	0.304	27%	0.266	S	S	.	.	H	α-helix	trans	-62.6	-28.1	173.2	-75	169.8	0	0	0	113.3	I1921 R1978 M1980 R1986	I1921-L1982 HydrophobicContact CB-CD2 4.49Å; I1921-L1982 HydrophobicContact CG1-CD2 4.01Å; I1921-L1982 HydrophobicContact CG2-CD2 4.29Å; R1978-L1982 HydrophobicContact CG-CD1 3.91Å; R1978-L1982 HydrophobicContact CG-CG 4.42Å; R1978-L1982 WeakPolarHBondContact O-CB 2.98Å; R1978-L1982 VanDerWaalsContact O-CG 3.26Å; R1978-L1982 WeakPolarHBondContact O-CG 3.41Å; R1978-L1982 PolarHBondContact O-N 3.27Å; M1980-L1982 VanDerWaalsContact C-N 3.32Å; M1980-L1982 PolarHBondContact O-N 3.26Å; L1982-R1986 VanDerWaalsContact O-CB 3.31Å; L1982-R1986 WeakPolarHBondContact O-CB 3.28Å; L1982-R1986 PolarHBondContact O-N 2.65Å; L1982-R1986 VanDerWaalsContact O-N 3.1Å
1983	A	87.8	Confident	86.7	Confident	36 Å²	36	56.4 Å²	56.4	30%	0.298	27%	0.269	S	S	.	.	H	α-helix	trans	-72.3	-45.1	173.7	0	0	0	0	0	111.5	N1979 M1980 V1981 R1986 D1987	N1979-A1983 PolarHBondContact O-N 3.13Å; M1980-A1983 WeakPolarHBondContact O-CA 2.83Å; M1980-A1983 WeakPolarHBondContact O-CB 3.14Å; M1980-A1983 PolarHBondContact O-N 3.26Å; V1981-A1983 PolarHBondContact O-N 3.36Å; A1983-R1986 WeakPolarHBondContact O-CB 3.35Å; A1983-R1986 PolarHBondContact O-N 3.39Å; A1983-D1987 PolarHBondContact O-N 3.35Å
1984	W	90.6	Very high	86.4	Confident	4 Å²	4	59.5 Å²	59.5	2%	0.015	29%	0.288	C	S	.	.	H	α-helix	trans	-64.9	-40.8	175.2	-56.8	-30.5	0	0	0	112.4	Y1810 C1850 F1853 M1980 V1981 R1986 D1987 V1988 Q1999 I2000 F2003	Y1810-W1984 VanDerWaalsContact OH-CD1 3.24Å; C1850-W1984 HydrophobicContact CB-CH2 4.27Å; C1850-W1984 VanDerWaalsContact SG-CH2 3.6Å; F1853-W1984 HydrophobicContact CB-CZ2 3.93Å; F1853-W1984 AromaticContact CD2-CE2 3.87Å; F1853-W1984 AromaticContact CD2-CZ2 3.6Å; F1853-W1984 HydrophobicContact CD2-CZ2 3.6Å; F1853-W1984 AromaticContact CD2-NE1 3.57Å; F1853-W1984 HydrophobicContact CE2-CZ2 4.42Å; F1853-W1984 AromaticContact CE2-NE1 3.72Å; F1853-W1984 HydrophobicContact CG-CZ2 4.05Å; F1853-W1984 AromaticContact CG-NE1 3.91Å; M1980-W1984 HydrophobicContact CE-CH2 3.56Å; M1980-W1984 HydrophobicContact CE-CZ2 4Å; M1980-W1984 HydrophobicContact CE-CZ3 4.21Å; M1980-W1984 HydrophobicContact CG-CD2 4.5Å; M1980-W1984 HydrophobicContact CG-CH2 4.09Å; M1980-W1984 HydrophobicContact CG-CZ2 3.66Å; M1980-W1984 PolarHBondContact O-N 3.44Å; M1980-W1984 VanDerWaalsContact O-N 3.15Å; M1980-W1984 HydrophobicContact SD-CH2 3.97Å; M1980-W1984 HydrophobicContact SD-CZ2 3.75Å; V1981-W1984 HydrophobicContact CG2-CE3 4.38Å; V1981-W1984 HydrophobicContact CG2-CZ3 4.31Å; V1981-W1984 PolarHBondContact O-N 3.39Å; W1984-R1986 PolarHBondContact O-N 2.72Å; W1984-D1987 PolarHBondContact O-N 3.03Å; W1984-V1988 PolarHBondContact O-N 3.11Å; W1984-Q1999 HydrophobicContact CD2-CB 3.88Å; W1984-Q1999 HydrophobicContact CE3-CB 3.93Å; W1984-Q1999 HydrophobicContact CG-CB 4.4Å; W1984-Q1999 HydrophobicContact CH2-CB 4.26Å; W1984-Q1999 HydrophobicContact CZ2-CB 4.23Å; W1984-Q1999 HydrophobicContact CZ3-CB 4.11Å; W1984-I2000 HydrophobicContact CB-CD1 3.86Å; W1984-I2000 HydrophobicContact CB-CG1 3.71Å; W1984-I2000 HydrophobicContact CE3-CG1 4.32Å; W1984-F2003 HydrophobicContact CH2-CD2 4.39Å; W1984-F2003 HydrophobicContact CZ3-CB 4.13Å; W1984-F2003 AromaticContact CZ3-CD2 3.78Å; W1984-F2003 HydrophobicContact CZ3-CD2 3.78Å; W1984-F2003 HydrophobicContact CZ3-CG 4.3Å
1985	V	85.7	Confident	86.1	Confident	25 Å²	25	58.6 Å²	58.6	15%	0.152	29%	0.285	C	S	.	.	H	α-helix	trans	-61.6	-36.2	176	170.1	0	0	0	0	110.4	V1917 I1921 V1981 T1989 I2000	V1917-V1985 HydrophobicContact CG1-CG2 4.06Å; I1921-V1985 HydrophobicContact CD1-CG1 4.33Å; I1921-V1985 HydrophobicContact CD1-CG2 4.21Å; V1981-V1985 HydrophobicContact CG1-CG2 4.26Å; V1981-V1985 WeakPolarHBondContact O-CB 3.4Å; V1981-V1985 VanDerWaalsContact O-CG2 3.28Å; V1981-V1985 WeakPolarHBondContact O-CG2 3.4Å; V1981-V1985 PolarHBondContact O-N 3.27Å; V1985-T1989 WeakPolarHBondContact O-CB 3.38Å; V1985-T1989 VanDerWaalsContact O-CG2 3.31Å; V1985-T1989 WeakPolarHBondContact O-CG2 3.36Å; V1985-T1989 PolarHBondContact O-N 3.13Å; V1985-T1989 PolarHBondContact O-OG1 3Å; V1985-I2000 HydrophobicContact CG2-CD1 3.9Å; V1985-I2000 HydrophobicContact CG2-CG1 4.36Å
1986	R	85.8	Confident	86.2	Confident	127 Å²	127	52 Å²	52	48%	0.479	26%	0.26	S	S	.	.	H	α-helix	trans	-65.4	-42.6	170.7	-176.8	-175.6	174.7	178.3	-1.4	112.1	L1982 A1983 W1984 T1989 Q1990	L1982-R1986 VanDerWaalsContact O-CB 3.31Å; L1982-R1986 WeakPolarHBondContact O-CB 3.28Å; L1982-R1986 PolarHBondContact O-N 2.65Å; L1982-R1986 VanDerWaalsContact O-N 3.1Å; A1983-R1986 WeakPolarHBondContact O-CB 3.35Å; A1983-R1986 PolarHBondContact O-N 3.39Å; W1984-R1986 PolarHBondContact O-N 2.72Å; R1986-T1989 PolarHBondContact O-N 3Å; R1986-T1989 PolarHBondContact O-OG1 3.19Å; R1986-Q1990 HydrophobicContact CG-CG 3.99Å; R1986-Q1990 VanDerWaalsContact NH2-OE1 3.08Å; R1986-Q1990 VanDerWaalsContact O-CB 3.25Å; R1986-Q1990 WeakPolarHBondContact O-CB 3.34Å; R1986-Q1990 WeakPolarHBondContact O-CG 3.43Å; R1986-Q1990 PolarHBondContact O-N 2.94Å
1987	D	85.8	Confident	85.8	Confident	39 Å²	39	55 Å²	55	21%	0.209	28%	0.276	C	S	.	.	H	α-helix	trans	-68	-36.5	-179	-71.7	-11.5	0	0	0	112.6	A1983 W1984 Y1991 Q1992 N1993 A1996	A1983-D1987 PolarHBondContact O-N 3.35Å; W1984-D1987 PolarHBondContact O-N 3.03Å; D1987-Y1991 HydrophobicContact CB-CD2 4.18Å; D1987-Y1991 CarbonylContact O-C 3.48Å; D1987-Y1991 WeakPolarHBondContact O-CA 3.37Å; D1987-Y1991 WeakPolarHBondContact O-CB 3.02Å; D1987-Y1991 PolarHBondContact O-N 3.16Å; D1987-Y1991 WeakPolarHBondContact OD1-CE2 3.39Å; D1987-Q1992 PolarHBondContact O-N 2.86Å; D1987-N1993 PolarHBondContact O-N 3.16Å; D1987-A1996 HydrophobicContact CB-CB 3.73Å
1988	V	84	Confident	85.3	Confident	37 Å²	37	56.4 Å²	56.4	22%	0.224	28%	0.282	C	S	.	.	H	α-helix	trans	-65.9	-50.1	170.2	176.4	0	0	0	0	110.8	W1984 Q1992 A1996 D1997 I2000	W1984-V1988 PolarHBondContact O-N 3.11Å; V1988-Q1992 WeakPolarHBondContact O-CA 3.48Å; V1988-Q1992 PolarHBondContact O-N 3.3Å; V1988-A1996 HydrophobicContact CG2-CB 3.66Å; V1988-D1997 HydrophobicContact CG2-CB 3.77Å; V1988-D1997 VanDerWaalsContact CG2-N 3.3Å; V1988-I2000 HydrophobicContact CB-CD1 4.35Å; V1988-I2000 HydrophobicContact CG2-CD1 3.59Å
1989	T	82.2	Confident	85.1	Confident	101 Å²	101	54.2 Å²	54.2	62%	0.62	27%	0.274	S	S	*	.	H	α-helix	trans	-74.9	-26.4	-174.2	53.9	0	0	0	0	114.8	V1985 R1986	V1985-T1989 WeakPolarHBondContact O-CB 3.38Å; V1985-T1989 VanDerWaalsContact O-CG2 3.31Å; V1985-T1989 WeakPolarHBondContact O-CG2 3.36Å; V1985-T1989 PolarHBondContact O-N 3.13Å; V1985-T1989 PolarHBondContact O-OG1 3Å; R1986-T1989 PolarHBondContact O-N 3Å; R1986-T1989 PolarHBondContact O-OG1 3.19Å
1990	Q	85.7	Confident	84.8	Confident	110 Å²	110	51.8 Å²	51.8	51%	0.514	26%	0.261	S	S	.	.	H	α-helix	trans	-102.6	-28.9	-178.6	-61.6	-169.2	-7.5	0	0	114.1	R1986	R1986-Q1990 HydrophobicContact CG-CG 3.99Å; R1986-Q1990 VanDerWaalsContact NH2-OE1 3.08Å; R1986-Q1990 VanDerWaalsContact O-CB 3.25Å; R1986-Q1990 WeakPolarHBondContact O-CB 3.34Å; R1986-Q1990 WeakPolarHBondContact O-CG 3.43Å; R1986-Q1990 PolarHBondContact O-N 2.94Å
1991	Y	82.8	Confident	84.2	Confident	150 Å²	150	54.7 Å²	54.7	59%	0.588	28%	0.276	S	S	*	.	H	α-helix	trans	-120.8	-1.3	-176.7	-46.7	-53.9	0	0	0	113.9	D1987 N1993	D1987-Y1991 HydrophobicContact CB-CD2 4.18Å; D1987-Y1991 CarbonylContact O-C 3.48Å; D1987-Y1991 WeakPolarHBondContact O-CA 3.37Å; D1987-Y1991 WeakPolarHBondContact O-CB 3.02Å; D1987-Y1991 PolarHBondContact O-N 3.16Å; D1987-Y1991 WeakPolarHBondContact OD1-CE2 3.39Å; Y1991-N1993 PolarHBondContact O-N 3.31Å; Y1991-N1993 VanDerWaalsContact O-N 3.16Å
1992	Q	80.5	Confident	83.9	Confident	174 Å²	174	55.7 Å²	55.7	81%	0.813	28%	0.28	S	S	*	.			trans	52.6	34.1	-178	-62.3	-178.3	-22.5	0	0	112.7	D1987 V1988 P1994	D1987-Q1992 PolarHBondContact O-N 2.86Å; V1988-Q1992 WeakPolarHBondContact O-CA 3.48Å; V1988-Q1992 PolarHBondContact O-N 3.3Å; Q1992-P1994 VanDerWaalsContact O-CD 3.26Å; Q1992-P1994 WeakPolarHBondContact O-CD 3.21Å
1993	N	83.4	Confident	83.7	Confident	36 Å²	36	53 Å²	53	19%	0.193	27%	0.266	C	S	.	.			trans	-75.9	111.3	-173.8	178.3	4.2	0	0	0	111.1	Y1810 D1987 Y1991 L1995 A1996 D1997	Y1810-N1993 VanDerWaalsContact CD2-ND2 3.31Å; Y1810-N1993 WeakPolarHBondContact CD2-ND2 3.01Å; Y1810-N1993 WeakPolarHBondContact CE2-ND2 3.47Å; D1987-N1993 PolarHBondContact O-N 3.16Å; Y1991-N1993 PolarHBondContact O-N 3.31Å; Y1991-N1993 VanDerWaalsContact O-N 3.16Å; N1993-L1995 PolarHBondContact O-N 2.85Å; N1993-L1995 WeakPolarHBondContact OD1-CB 3.39Å; N1993-L1995 PolarHBondContact OD1-N 3.04Å; N1993-A1996 HydrophobicContact CB-CB 4.05Å; N1993-A1996 WeakPolarHBondContact O-CB 3.32Å; N1993-A1996 PolarHBondContact O-N 2.9Å; N1993-A1996 VanDerWaalsContact O-N 3.09Å; N1993-D1997 PolarHBondContact O-N 3.34Å
1994	P	78.6	Confident	83.5	Confident	72 Å²	72	52.4 Å²	52.4	47%	0.468	26%	0.256	S	S	.	.	H	α-helix	trans	-67.2	-23.8	-177.6	29.1	-35.9	0	0	0	112.7	Q1992 A1996 D1997 E1998	Q1992-P1994 VanDerWaalsContact O-CD 3.26Å; Q1992-P1994 WeakPolarHBondContact O-CD 3.21Å; P1994-A1996 VanDerWaalsContact C-N 3.35Å; P1994-D1997 PolarHBondContact O-N 3.31Å; P1994-E1998 WeakPolarHBondContact O-CG 3.42Å; P1994-E1998 PolarHBondContact O-N 3.01Å
1995	L	83.4	Confident	83.1	Confident	8 Å²	8	53.5 Å²	53.5	4%	0.042	26%	0.261	C	S	.	.	H	α-helix	trans	-75.6	-25.8	176.2	-61.3	174.6	0	0	0	112.2	E1806 L1807 Y1810 N1993 Q1999	E1806-L1995 HydrophobicContact CB-CD1 3.98Å; E1806-L1995 WeakPolarHBondContact O-CD1 3.06Å; L1807-L1995 HydrophobicContact CD1-CD2 4.09Å; Y1810-L1995 HydrophobicContact CD1-CB 3.52Å; Y1810-L1995 HydrophobicContact CD1-CD1 4.42Å; Y1810-L1995 HydrophobicContact CE1-CB 4.01Å; Y1810-L1995 WeakPolarHBondContact CE1-O 3.25Å; Y1810-L1995 HydrophobicContact CG-CB 3.96Å; Y1810-L1995 HydrophobicContact CG-CD1 4.25Å; N1993-L1995 PolarHBondContact O-N 2.85Å; N1993-L1995 WeakPolarHBondContact OD1-CB 3.39Å; N1993-L1995 PolarHBondContact OD1-N 3.04Å; L1995-Q1999 WeakPolarHBondContact O-CG 3.46Å; L1995-Q1999 PolarHBondContact O-N 2.89Å
1996	A	84.9	Confident	83.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-72.5	-36.1	170	0	0	0	0	0	110.9	Y1810 D1987 V1988 N1993 P1994 Q1999 I2000	Y1810-A1996 WeakPolarHBondContact OH-CA 3.34Å; Y1810-A1996 VanDerWaalsContact OH-CB 3.3Å; Y1810-A1996 WeakPolarHBondContact OH-CB 3.06Å; D1987-A1996 HydrophobicContact CB-CB 3.73Å; V1988-A1996 HydrophobicContact CG2-CB 3.66Å; N1993-A1996 HydrophobicContact CB-CB 4.05Å; N1993-A1996 WeakPolarHBondContact O-CB 3.32Å; N1993-A1996 PolarHBondContact O-N 2.9Å; N1993-A1996 VanDerWaalsContact O-N 3.09Å; P1994-A1996 VanDerWaalsContact C-N 3.35Å; A1996-Q1999 PolarHBondContact O-N 2.97Å; A1996-I2000 WeakPolarHBondContact O-CG1 3.31Å; A1996-I2000 PolarHBondContact O-N 3.17Å
1997	D	81.9	Confident	83.1	Confident	68 Å²	68	46.9 Å²	46.9	36%	0.364	23%	0.234	S	C	.	.	H	α-helix	trans	-67.4	-44.1	176.5	-155.4	46.2	0	0	0	111.4	V1988 N1993 P1994 Q1999 I2000 I2001	V1988-D1997 HydrophobicContact CG2-CB 3.77Å; V1988-D1997 VanDerWaalsContact CG2-N 3.3Å; N1993-D1997 PolarHBondContact O-N 3.34Å; P1994-D1997 PolarHBondContact O-N 3.31Å; D1997-Q1999 VanDerWaalsContact C-N 3.29Å; D1997-Q1999 PolarHBondContact O-N 2.72Å; D1997-I2000 PolarHBondContact O-N 3.4Å; D1997-I2001 WeakPolarHBondContact O-CB 3.45Å; D1997-I2001 VanDerWaalsContact O-CG1 3.27Å; D1997-I2001 WeakPolarHBondContact O-CG1 3.47Å; D1997-I2001 PolarHBondContact O-N 2.98Å
1998	E	79.7	Confident	82.8	Confident	29 Å²	29	46.3 Å²	46.3	14%	0.136	23%	0.229	C	C	.	.	H	α-helix	trans	-52.8	-42.9	169.8	-75.4	177.2	-166.2	0	0	112.2	R1803 S1841 P1994 Y2002	R1803-E1998 IonicContact CZ-OE1 3.8Å; R1803-E1998 IonicContact NH2-OE1 3.57Å; R1803-E1998 PolarHBondContact NH2-OE1 2.85Å; S1841-E1998 VanDerWaalsContact CB-OE2 3.27Å; S1841-E1998 WeakPolarHBondContact CB-OE2 3.31Å; S1841-E1998 VanDerWaalsContact OG-CD 3.24Å; S1841-E1998 PolarHBondContact OG-OE2 3.49Å; P1994-E1998 WeakPolarHBondContact O-CG 3.42Å; P1994-E1998 PolarHBondContact O-N 3.01Å; E1998-Y2002 WeakPolarHBondContact O-CD2 3.42Å; E1998-Y2002 PolarHBondContact O-N 3.24Å
1999	Q	84.9	Confident	82.4	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-66.8	-38.7	176.1	-63.2	-71.7	-50.9	0	0	112.4	Y1810 I1846 C1850 F1853 W1984 L1995 A1996 D1997 F2003	Y1810-Q1999 HydrophobicContact CE1-CG 3.97Å; I1846-Q1999 PolarHBondContact O-OE1 2.66Å; C1850-Q1999 VanDerWaalsContact N-OE1 3.17Å; C1850-Q1999 PolarHBondContact SG-OE1 2.93Å; F1853-Q1999 HydrophobicContact CE2-CG 4.37Å; W1984-Q1999 HydrophobicContact CD2-CB 3.88Å; W1984-Q1999 HydrophobicContact CE3-CB 3.93Å; W1984-Q1999 HydrophobicContact CG-CB 4.4Å; W1984-Q1999 HydrophobicContact CH2-CB 4.26Å; W1984-Q1999 HydrophobicContact CZ2-CB 4.23Å; W1984-Q1999 HydrophobicContact CZ3-CB 4.11Å; L1995-Q1999 WeakPolarHBondContact O-CG 3.46Å; L1995-Q1999 PolarHBondContact O-N 2.89Å; A1996-Q1999 PolarHBondContact O-N 2.97Å; D1997-Q1999 VanDerWaalsContact C-N 3.29Å; D1997-Q1999 PolarHBondContact O-N 2.72Å; Q1999-F2003 WeakPolarHBondContact O-CA 3.33Å; Q1999-F2003 VanDerWaalsContact O-CB 3.27Å; Q1999-F2003 WeakPolarHBondContact O-CB 3.48Å; Q1999-F2003 PolarHBondContact O-N 2.85Å
2000	I	83.3	Confident	82	Confident	11 Å²	11	42.8 Å²	42.8	6%	0.056	21%	0.209	C	C	.	.	H	α-helix	trans	-66.7	-44	177.7	-71.1	159	0	0	0	111.5	V1917 W1984 V1985 V1988 A1996 D1997 F2003	V1917-I2000 HydrophobicContact CB-CG2 4.48Å; V1917-I2000 HydrophobicContact CG1-CG2 4Å; V1917-I2000 HydrophobicContact CG2-CG2 3.79Å; W1984-I2000 HydrophobicContact CB-CD1 3.86Å; W1984-I2000 HydrophobicContact CB-CG1 3.71Å; W1984-I2000 HydrophobicContact CE3-CG1 4.32Å; V1985-I2000 HydrophobicContact CG2-CD1 3.9Å; V1985-I2000 HydrophobicContact CG2-CG1 4.36Å; V1988-I2000 HydrophobicContact CB-CD1 4.35Å; V1988-I2000 HydrophobicContact CG2-CD1 3.59Å; A1996-I2000 WeakPolarHBondContact O-CG1 3.31Å; A1996-I2000 PolarHBondContact O-N 3.17Å; D1997-I2000 PolarHBondContact O-N 3.4Å; I2000-F2003 WeakPolarHBondContact O-CB 3.34Å; I2000-F2003 PolarHBondContact O-N 2.88Å
2001	I	78.9	Confident	81.4	Confident	62 Å²	62	44.8 Å²	44.8	32%	0.318	21%	0.212	S	C	.	.	H	α-helix	trans	-58.4	-54.4	180	-71.3	165	0	0	0	109.8	D1997 N2439	D1997-I2001 WeakPolarHBondContact O-CB 3.45Å; D1997-I2001 VanDerWaalsContact O-CG1 3.27Å; D1997-I2001 WeakPolarHBondContact O-CG1 3.47Å; D1997-I2001 PolarHBondContact O-N 2.98Å; I2001-N2439 HydrophobicContact CG2-CB 3.82Å; I2001-N2439 VanDerWaalsContact CG2-ND2 3.32Å; I2001-N2439 WeakPolarHBondContact CG2-ND2 3.35Å; I2001-N2439 PolarHBondContact O-ND2 2.97Å
2002	Y	82.4	Confident	81.4	Confident	22 Å²	22	37.7 Å²	37.7	9%	0.086	18%	0.184	C	C	.	.	H	α-helix	trans	-85.6	-5	-176.7	-69.6	-87.7	0	0	0	114.5	I1843 I1846 E1998 Y2004 Q2005 W2006 N2439	I1843-Y2002 HydrophobicContact CD1-CE1 4.34Å; I1843-Y2002 HydrophobicContact CG1-CE1 4.02Å; I1846-Y2002 HydrophobicContact CD1-CD2 3.34Å; I1846-Y2002 HydrophobicContact CD1-CE2 3.55Å; I1846-Y2002 HydrophobicContact CD1-CG 3.87Å; I1846-Y2002 HydrophobicContact CG2-CD2 4.35Å; I1846-Y2002 HydrophobicContact CG2-CG 4.34Å; E1998-Y2002 WeakPolarHBondContact O-CD2 3.42Å; E1998-Y2002 PolarHBondContact O-N 3.24Å; Y2002-Y2004 PolarHBondContact O-N 3.02Å; Y2002-Y2004 VanDerWaalsContact O-N 3.14Å; Y2002-Q2005 WeakPolarHBondContact O-CA 3.27Å; Y2002-Q2005 WeakPolarHBondContact O-CB 3.37Å; Y2002-Q2005 PolarHBondContact O-N 3.34Å; Y2002-W2006 PolarHBondContact O-N 3.08Å; Y2002-N2439 HydrophobicContact CD1-CB 4.07Å; Y2002-N2439 WeakPolarHBondContact CD1-OD1 3.35Å; Y2002-N2439 HydrophobicContact CE1-CB 3.67Å; Y2002-N2439 HydrophobicContact CE2-CB 4.46Å
2003	F	85.5	Confident	81.6	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-45.7	-47.7	178.4	165.2	-102.8	0	0	0	112.8	V1917 L1920 L1977 M1980 V1981 W1984 Q1999 I2000 W2006 L2007	V1917-F2003 HydrophobicContact CG2-CD1 4.49Å; L1920-F2003 HydrophobicContact CD1-CD1 4.39Å; L1920-F2003 HydrophobicContact CD1-CE1 3.29Å; L1920-F2003 HydrophobicContact CD1-CZ 3.39Å; L1977-F2003 HydrophobicContact CD1-CE2 3.72Å; L1977-F2003 HydrophobicContact CD1-CZ 4Å; L1977-F2003 HydrophobicContact CD2-CZ 4.36Å; L1977-F2003 HydrophobicContact CG-CE2 4.31Å; L1977-F2003 HydrophobicContact CG-CZ 4.16Å; M1980-F2003 HydrophobicContact CE-CE2 4.39Å; V1981-F2003 HydrophobicContact CG2-CD1 4.32Å; V1981-F2003 HydrophobicContact CG2-CD2 3.72Å; V1981-F2003 HydrophobicContact CG2-CE1 4.19Å; V1981-F2003 HydrophobicContact CG2-CE2 3.51Å; V1981-F2003 HydrophobicContact CG2-CG 4.12Å; V1981-F2003 HydrophobicContact CG2-CZ 3.79Å; W1984-F2003 HydrophobicContact CH2-CD2 4.39Å; W1984-F2003 HydrophobicContact CZ3-CB 4.13Å; W1984-F2003 AromaticContact CZ3-CD2 3.78Å; W1984-F2003 HydrophobicContact CZ3-CD2 3.78Å; W1984-F2003 HydrophobicContact CZ3-CG 4.3Å; Q1999-F2003 WeakPolarHBondContact O-CA 3.33Å; Q1999-F2003 VanDerWaalsContact O-CB 3.27Å; Q1999-F2003 WeakPolarHBondContact O-CB 3.48Å; Q1999-F2003 PolarHBondContact O-N 2.85Å; I2000-F2003 WeakPolarHBondContact O-CB 3.34Å; I2000-F2003 PolarHBondContact O-N 2.88Å; F2003-W2006 HydrophobicContact CD2-CE3 4.02Å; F2003-W2006 HydrophobicContact CD2-CZ3 4.22Å; F2003-W2006 HydrophobicContact CE2-CE3 4.01Å; F2003-W2006 AromaticContact CE2-CZ3 3.8Å; F2003-W2006 HydrophobicContact CE2-CZ3 3.8Å; F2003-W2006 PolarHBondContact O-N 3.3Å; F2003-L2007 HydrophobicContact CE1-CD2 4.36Å; F2003-L2007 HydrophobicContact CZ-CD2 4.11Å; F2003-L2007 PolarHBondContact O-N 3.45Å
2004	Y	83.9	Confident	82	Confident	24 Å²	24	28.1 Å²	28.1	9%	0.094	14%	0.138	C	C	.	.	H	α-helix	trans	-72.3	-31.3	-177.1	-166.5	-122.3	0	0	0	111.9	A1916 Y2002 L2007 R2008 V2023 M2027 E2432	A1916-Y2004 HydrophobicContact CB-CD1 4.36Å; A1916-Y2004 HydrophobicContact CB-CD2 3.46Å; A1916-Y2004 VanDerWaalsContact CB-CD2 3.46Å; A1916-Y2004 HydrophobicContact CB-CE2 3.93Å; A1916-Y2004 HydrophobicContact CB-CG 3.71Å; Y2002-Y2004 PolarHBondContact O-N 3.02Å; Y2002-Y2004 VanDerWaalsContact O-N 3.14Å; Y2004-L2007 HydrophobicContact CD2-CD2 4.37Å; Y2004-R2008 VanDerWaalsContact CD1-CZ 3.46Å; Y2004-R2008 VanDerWaalsContact CD1-NE 3.33Å; Y2004-R2008 HydrophobicContact CE2-CG 4.47Å; Y2004-R2008 VanDerWaalsContact O-CG 3.31Å; Y2004-R2008 WeakPolarHBondContact O-CG 3.5Å; Y2004-R2008 PolarHBondContact O-N 3.16Å; Y2004-R2008 PolarHBondContact O-NE 3.2Å; Y2004-V2023 HydrophobicContact CE2-CG1 4.08Å; Y2004-M2027 HydrophobicContact CD2-SD 4.4Å; Y2004-M2027 HydrophobicContact CE1-CE 3.94Å; Y2004-M2027 HydrophobicContact CE1-SD 4.39Å; Y2004-M2027 HydrophobicContact CE2-CE 4.21Å; Y2004-M2027 HydrophobicContact CE2-SD 3.58Å; Y2004-M2027 VanDerWaalsContact CE2-SD 3.58Å; Y2004-M2027 VanDerWaalsContact CZ-SD 3.56Å; Y2004-M2027 WeakPolarHBondContact OH-CE 3.34Å; Y2004-M2027 PolarHBondContact OH-SD 3.29Å; Y2004-E2432 WeakPolarHBondContact CE1-OE2 3.48Å; Y2004-E2432 PolarHBondContact OH-OE1 3.43Å; Y2004-E2432 PolarHBondContact OH-OE2 3.42Å
2005	Q	80.8	Confident	82.4	Confident	27 Å²	27	25.4 Å²	25.4	13%	0.126	12%	0.119	C	C	.	.	H	α-helix	trans	-63.5	-46.2	170.5	-172	-175.6	-47.4	0	0	111	I1843 Y2002 L2007 R2008 S2009 A2434 N2439	I1843-Q2005 VanDerWaalsContact CG2-NE2 3.28Å; Y2002-Q2005 WeakPolarHBondContact O-CA 3.27Å; Y2002-Q2005 WeakPolarHBondContact O-CB 3.37Å; Y2002-Q2005 PolarHBondContact O-N 3.34Å; Q2005-L2007 PolarHBondContact O-N 3.27Å; Q2005-R2008 PolarHBondContact O-N 2.96Å; Q2005-R2008 VanDerWaalsContact O-N 3.14Å; Q2005-S2009 WeakPolarHBondContact O-CB 3.24Å; Q2005-S2009 PolarHBondContact O-N 3.41Å; Q2005-A2434 HydrophobicContact CG-CB 4.13Å; Q2005-N2439 PolarHBondContact OE1-OD1 3.1Å
2006	W	87.6	Confident	82.6	Confident	5 Å²	5	25.2 Å²	25.2	2%	0.019	12%	0.118	C	C	.	.	H	α-helix	trans	-57.1	-49	177.1	164.9	82.7	0	0	0	112.4	E1847 C1850 D1851 Y1854 L1977 M1980 Y2002 F2003 R2008 S2009 S2012 F2014	E1847-W2006 HydrophobicContact CG-CB 4.46Å; C1850-W2006 HydrophobicContact CB-CB 4.09Å; C1850-W2006 HydrophobicContact CB-CD2 3.35Å; C1850-W2006 VanDerWaalsContact CB-CE2 3.42Å; C1850-W2006 HydrophobicContact CB-CE3 4.04Å; C1850-W2006 HydrophobicContact CB-CG 3.34Å; C1850-W2006 HydrophobicContact CB-CZ2 4.15Å; D1851-W2006 PolarHBondContact OD1-NE1 3.04Å; Y1854-W2006 AromaticContact CD1-CH2 3.72Å; Y1854-W2006 HydrophobicContact CD1-CH2 3.72Å; Y1854-W2006 HydrophobicContact CD1-CZ2 4.03Å; Y1854-W2006 HydrophobicContact CE1-CH2 4.33Å; Y1854-W2006 AromaticContact CG-CH2 3.87Å; Y1854-W2006 HydrophobicContact CG-CH2 3.87Å; Y1854-W2006 HydrophobicContact CG-CZ2 4.28Å; L1977-W2006 HydrophobicContact CD1-CH2 4.05Å; L1977-W2006 HydrophobicContact CD1-CZ3 3.73Å; M1980-W2006 HydrophobicContact CE-CH2 4.18Å; M1980-W2006 HydrophobicContact CE-CZ3 4.17Å; Y2002-W2006 PolarHBondContact O-N 3.08Å; F2003-W2006 HydrophobicContact CD2-CE3 4.02Å; F2003-W2006 HydrophobicContact CD2-CZ3 4.22Å; F2003-W2006 HydrophobicContact CE2-CE3 4.01Å; F2003-W2006 AromaticContact CE2-CZ3 3.8Å; F2003-W2006 HydrophobicContact CE2-CZ3 3.8Å; F2003-W2006 PolarHBondContact O-N 3.3Å; W2006-R2008 PolarHBondContact O-N 2.8Å; W2006-S2009 WeakPolarHBondContact O-CB 3.19Å; W2006-S2009 PolarHBondContact O-N 2.93Å; W2006-S2012 PolarHBondContact NE1-OG 3.2Å; W2006-F2014 HydrophobicContact CZ2-CB 4.21Å
2007	L	84.2	Confident	82.4	Confident	8 Å²	8	25.4 Å²	25.4	4%	0.042	12%	0.119	C	C	.	.	H	α-helix	trans	-59.4	-19.7	179.4	-177.4	63.3	0	0	0	113.6	L1977 F2003 Y2004 Q2005 L2019 V2023	L1977-L2007 HydrophobicContact CD2-CD1 4.36Å; F2003-L2007 HydrophobicContact CE1-CD2 4.36Å; F2003-L2007 HydrophobicContact CZ-CD2 4.11Å; F2003-L2007 PolarHBondContact O-N 3.45Å; Y2004-L2007 HydrophobicContact CD2-CD2 4.37Å; Q2005-L2007 PolarHBondContact O-N 3.27Å; L2007-L2019 HydrophobicContact CD1-CB 4.43Å; L2007-V2023 HydrophobicContact CD2-CB 3.95Å; L2007-V2023 HydrophobicContact CD2-CG1 4.07Å; L2007-V2023 HydrophobicContact CD2-CG2 3.76Å
2008	R	79	Confident	82.3	Confident	28 Å²	28	22.1 Å²	22.1	11%	0.106	10%	0.102	C	C	.	.	H	α-helix	trans	-104.8	-10.1	-179.9	-62.1	175.5	-64.3	154.4	5	113.6	Y2004 Q2005 W2006 P2010 R2020 E2432	Y2004-R2008 VanDerWaalsContact CD1-CZ 3.46Å; Y2004-R2008 VanDerWaalsContact CD1-NE 3.33Å; Y2004-R2008 HydrophobicContact CE2-CG 4.47Å; Y2004-R2008 VanDerWaalsContact O-CG 3.31Å; Y2004-R2008 WeakPolarHBondContact O-CG 3.5Å; Y2004-R2008 PolarHBondContact O-N 3.16Å; Y2004-R2008 PolarHBondContact O-NE 3.2Å; Q2005-R2008 PolarHBondContact O-N 2.96Å; Q2005-R2008 VanDerWaalsContact O-N 3.14Å; W2006-R2008 PolarHBondContact O-N 2.8Å; R2008-P2010 VanDerWaalsContact O-CD 3.28Å; R2008-P2010 WeakPolarHBondContact O-CD 3.47Å; R2008-R2020 HydrophobicContact CG-CG 4.2Å; R2008-E2432 WeakPolarHBondContact CD-OE2 3.41Å; R2008-E2432 IonicContact CZ-OE2 3.21Å; R2008-E2432 IonicContact NE-OE2 3.8Å; R2008-E2432 PolarHBondContact NH1-O 3.06Å; R2008-E2432 IonicContact NH1-OE2 2.87Å; R2008-E2432 PolarHBondContact NH1-OE2 3.29Å
2009	S	76.3	Confident	82.5	Confident	17 Å²	17	20.9 Å²	20.9	12%	0.119	10%	0.096	C	C	.	.			trans	-79.2	113.2	-175.6	-170.5	0	0	0	0	109.8	E1847 Q2005 W2006 R2011 S2012	E1847-S2009 WeakPolarHBondContact OE1-CB 3.43Å; E1847-S2009 PolarHBondContact OE1-OG 2.85Å; Q2005-S2009 WeakPolarHBondContact O-CB 3.24Å; Q2005-S2009 PolarHBondContact O-N 3.41Å; W2006-S2009 WeakPolarHBondContact O-CB 3.19Å; W2006-S2009 PolarHBondContact O-N 2.93Å; S2009-R2011 PolarHBondContact O-N 2.89Å; S2009-S2012 WeakPolarHBondContact O-CB 3.19Å; S2009-S2012 PolarHBondContact O-N 2.98Å
2010	P	74.2	Confident	82.4	Confident	46 Å²	46	22.8 Å²	22.8	30%	0.299	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	8.6	174.4	32.3	-36.8	0	0	0	112.9	G1871 R2008 Y2015	G1871-P2010 WeakPolarHBondContact CA-O 3.4Å; G1871-P2010 PolarHBondContact N-O 3.33Å; R2008-P2010 VanDerWaalsContact O-CD 3.28Å; R2008-P2010 WeakPolarHBondContact O-CD 3.47Å; P2010-Y2015 HydrophobicContact CB-CD1 4.36Å; P2010-Y2015 HydrophobicContact CB-CE1 4.41Å
2011	R	72	Confident	82.1	Confident	152 Å²	152	23.5 Å²	23.5	57%	0.574	11%	0.105	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-9.2	172.7	-60.6	175.6	65.5	117.9	1.6	112.6	S2009	S2009-R2011 PolarHBondContact O-N 2.89Å
2012	S	83.6	Confident	82.1	Confident	2 Å²	2	20.8 Å²	20.8	1%	0.014	9%	0.091	C	C	.	.	S	Bend	trans	-64.3	137.3	164.2	159.4	0	0	0	0	108.7	D1851 W2006 S2009 F2014 Y2015	D1851-S2012 PolarHBondContact OD1-OG 2.86Å; W2006-S2012 PolarHBondContact NE1-OG 3.2Å; S2009-S2012 WeakPolarHBondContact O-CB 3.19Å; S2009-S2012 PolarHBondContact O-N 2.98Å; S2012-F2014 PolarHBondContact O-N 2.89Å; S2012-F2014 VanDerWaalsContact O-N 3.17Å; S2012-F2014 PolarHBondContact OG-N 2.99Å; S2012-F2014 VanDerWaalsContact OG-N 3.07Å; S2012-Y2015 PolarHBondContact O-N 3.46Å
2013	L	85.8	Confident	82.2	Confident	2 Å²	2	19.7 Å²	19.7	1%	0.01	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.6	176.2	-68.5	174.5	0	0	0	113	P1524 F1527 W1730 D1851 C1867 S1868	P1524-L2013 HydrophobicContact CG-CD2 4.16Å; F1527-L2013 HydrophobicContact CB-CD1 4.18Å; F1527-L2013 HydrophobicContact CD1-CD1 4.05Å; F1527-L2013 HydrophobicContact CD2-CD1 3.4Å; F1527-L2013 HydrophobicContact CE1-CD1 4.32Å; F1527-L2013 HydrophobicContact CE2-CD1 3.69Å; F1527-L2013 HydrophobicContact CG-CD1 3.6Å; F1527-L2013 HydrophobicContact CZ-CD1 4.16Å; W1730-L2013 HydrophobicContact CZ2-CD1 3.9Å; D1851-L2013 PolarHBondContact OD1-N 2.97Å; D1851-L2013 WeakPolarHBondContact OD2-CB 3.5Å; D1851-L2013 PolarHBondContact OD2-N 3.38Å; C1867-L2013 CarbonylContact C-O 3.59Å; C1867-L2013 VanDerWaalsContact CA-O 3.24Å; C1867-L2013 WeakPolarHBondContact CA-O 3.34Å; S1868-L2013 PolarHBondContact N-O 2.97Å; S1868-L2013 WeakPolarHBondContact O-CA 3.43Å; S1868-L2013 WeakPolarHBondContact O-CD2 3.25Å
2014	F	90.2	Very high	82	Confident	6 Å²	6	20.5 Å²	20.5	3%	0.026	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	14.8	-175.3	-73.4	-85.4	0	0	0	114.7	F1527 D1851 Y1854 A1855 L1858 L1865 W1866 C1867 W2006 S2012 D2016	F1527-F2014 AromaticContact CE1-CE2 3.95Å; F1527-F2014 HydrophobicContact CE1-CE2 3.95Å; F1527-F2014 HydrophobicContact CE1-CZ 4.31Å; F1527-F2014 AromaticContact CZ-CE2 3.83Å; F1527-F2014 HydrophobicContact CZ-CE2 3.83Å; D1851-F2014 HydrophobicContact CB-CD2 4.21Å; Y1854-F2014 HydrophobicContact CD1-CB 3.82Å; Y1854-F2014 HydrophobicContact CD1-CD1 4.06Å; Y1854-F2014 AromaticContact CD1-CG 3.9Å; Y1854-F2014 HydrophobicContact CD1-CG 3.9Å; Y1854-F2014 HydrophobicContact CE1-CB 4.24Å; Y1854-F2014 HydrophobicContact CE1-CD1 4.4Å; A1855-F2014 HydrophobicContact CB-CE2 3.68Å; A1855-F2014 HydrophobicContact CB-CZ 3.53Å; L1858-F2014 HydrophobicContact CD1-CD1 3.8Å; L1858-F2014 HydrophobicContact CD1-CE1 3.67Å; L1865-F2014 HydrophobicContact CB-CE1 4Å; L1865-F2014 HydrophobicContact CB-CZ 4.21Å; L1865-F2014 HydrophobicContact CD1-CZ 4.33Å; L1865-F2014 HydrophobicContact CD2-CE1 3.8Å; L1865-F2014 HydrophobicContact CD2-CZ 3.98Å; L1865-F2014 HydrophobicContact CG-CE1 4.4Å; L1865-F2014 HydrophobicContact CG-CZ 4.4Å; W1866-F2014 HydrophobicContact CD2-CD1 4.41Å; W1866-F2014 AromaticContact NE1-CD1 3.95Å; W1866-F2014 PolarHBondContact NE1-O 3.15Å; W1866-F2014 VanDerWaalsContact NE1-O 3.08Å; C1867-F2014 HydrophobicContact CB-CE1 4.06Å; C1867-F2014 HydrophobicContact CB-CE2 4.17Å; C1867-F2014 HydrophobicContact CB-CZ 3.73Å; W2006-F2014 HydrophobicContact CZ2-CB 4.21Å; S2012-F2014 PolarHBondContact O-N 2.89Å; S2012-F2014 VanDerWaalsContact O-N 3.17Å; S2012-F2014 PolarHBondContact OG-N 2.99Å; S2012-F2014 VanDerWaalsContact OG-N 3.07Å; F2014-D2016 PolarHBondContact O-N 3.16Å
2015	Y	87.8	Confident	81.8	Confident	15 Å²	15	22.9 Å²	22.9	6%	0.059	10%	0.102	C	C	.	.			trans	-54.7	112.9	179.2	-178.8	-102.5	0	0	0	112.3	P1873 P2010 S2012 R2020	P1873-Y2015 WeakPolarHBondContact CB-O 3.29Å; P1873-Y2015 WeakPolarHBondContact CD-O 3.4Å; P2010-Y2015 HydrophobicContact CB-CD1 4.36Å; P2010-Y2015 HydrophobicContact CB-CE1 4.41Å; S2012-Y2015 PolarHBondContact O-N 3.46Å; Y2015-R2020 PolarHBondContact OH-NH1 2.86Å
2016	D	87.3	Confident	81.9	Confident	5 Å²	5	22.9 Å²	22.9	3%	0.027	10%	0.102	C	C	.	.			trans	-124.5	115.9	173.9	176.1	1.5	0	0	0	109.2	R1482 F2014 A2018 L2019 R2020	R1482-D2016 IonicContact CZ-OD1 2.67Å; R1482-D2016 IonicContact NE-OD1 3.1Å; R1482-D2016 PolarHBondContact NE-OD1 2.84Å; R1482-D2016 IonicContact NE-OD2 2.71Å; R1482-D2016 IonicContact NH2-OD1 2.83Å; R1482-D2016 PolarHBondContact NH2-OD1 3.06Å; F2014-D2016 PolarHBondContact O-N 3.16Å; D2016-A2018 PolarHBondContact O-N 2.91Å; D2016-A2018 WeakPolarHBondContact OD1-CB 3.37Å; D2016-A2018 PolarHBondContact OD1-N 3.38Å; D2016-L2019 HydrophobicContact CB-CB 4.16Å; D2016-L2019 HydrophobicContact CB-CD1 4.05Å; D2016-L2019 HydrophobicContact CB-CG 4.22Å; D2016-L2019 PolarHBondContact O-N 2.89Å; D2016-R2020 PolarHBondContact O-N 2.84Å; D2016-R2020 VanDerWaalsContact O-N 3.08Å
2017	P	80.5	Confident	81.8	Confident	3 Å²	3	22.9 Å²	22.9	2%	0.019	10%	0.103	C	C	.	.	H	α-helix	trans	-62.6	-27.6	179.7	25.8	-33.5	0	0	0	112.9	L1885 L1886 M1889 R2021	L1885-P2017 HydrophobicContact CB-CB 4.4Å; L1885-P2017 HydrophobicContact CB-CG 4.42Å; L1885-P2017 HydrophobicContact CD1-CG 4.41Å; L1886-P2017 HydrophobicContact CD2-CB 3.92Å; L1886-P2017 HydrophobicContact CD2-CG 4.4Å; M1889-P2017 HydrophobicContact SD-CB 4.49Å; P2017-R2021 WeakPolarHBondContact O-CB 3.44Å; P2017-R2021 PolarHBondContact O-N 3.28Å
2018	A	79.8	Confident	81.8	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-70.1	-39.9	176.3	0	0	0	0	0	112.3	L1885 E1966 C1970 D2016 T2022	L1885-A2018 HydrophobicContact CD1-CB 3.93Å; L1885-A2018 HydrophobicContact CD2-CB 4.42Å; E1966-A2018 HydrophobicContact CB-CB 4.41Å; C1970-A2018 HydrophobicContact CB-CB 4.42Å; D2016-A2018 PolarHBondContact O-N 2.91Å; D2016-A2018 WeakPolarHBondContact OD1-CB 3.37Å; D2016-A2018 PolarHBondContact OD1-N 3.38Å; A2018-T2022 VanDerWaalsContact O-CB 3.27Å; A2018-T2022 WeakPolarHBondContact O-CB 3.49Å; A2018-T2022 PolarHBondContact O-N 2.87Å; A2018-T2022 PolarHBondContact O-OG1 3.05Å
2019	L	83.9	Confident	82	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-65.5	-46.1	173.5	-77.6	174.1	0	0	0	111.2	Y1854 W1866 C1970 A1973 F1974 L2007 D2016 T2022 V2023	Y1854-L2019 WeakPolarHBondContact OH-CD1 3.43Å; W1866-L2019 HydrophobicContact CZ2-CD1 3.89Å; C1970-L2019 HydrophobicContact CB-CD2 3.73Å; C1970-L2019 HydrophobicContact CB-CG 4.01Å; A1973-L2019 HydrophobicContact CB-CD1 4.11Å; A1973-L2019 HydrophobicContact CB-CD2 4.15Å; F1974-L2019 HydrophobicContact CB-CD2 3.87Å; L2007-L2019 HydrophobicContact CD1-CB 4.43Å; D2016-L2019 HydrophobicContact CB-CB 4.16Å; D2016-L2019 HydrophobicContact CB-CD1 4.05Å; D2016-L2019 HydrophobicContact CB-CG 4.22Å; D2016-L2019 PolarHBondContact O-N 2.89Å; L2019-T2022 PolarHBondContact O-N 2.81Å; L2019-V2023 PolarHBondContact O-N 3.39Å
2020	R	82.9	Confident	82.4	Confident	41 Å²	41	27.8 Å²	27.8	16%	0.155	12%	0.122	C	C	.	.	H	α-helix	trans	-56.4	-51	174.1	179.8	-177.2	168.5	-161.5	-2.5	111.1	M1889 R2008 Y2015 D2016 T2022 V2023 Q2024	M1889-R2020 HydrophobicContact CE-CB 4.41Å; M1889-R2020 HydrophobicContact CE-CG 3.83Å; R2008-R2020 HydrophobicContact CG-CG 4.2Å; Y2015-R2020 PolarHBondContact OH-NH1 2.86Å; D2016-R2020 PolarHBondContact O-N 2.84Å; D2016-R2020 VanDerWaalsContact O-N 3.08Å; R2020-T2022 VanDerWaalsContact C-N 3.32Å; R2020-T2022 PolarHBondContact O-N 3.26Å; R2020-V2023 PolarHBondContact O-N 3.24Å; R2020-Q2024 WeakPolarHBondContact O-CB 3.45Å; R2020-Q2024 PolarHBondContact O-N 2.73Å
2021	R	77.5	Confident	83.1	Confident	27 Å²	27	25.7 Å²	25.7	10%	0.102	11%	0.108	C	C	.	.	H	α-helix	trans	-62.3	-37.4	179.5	-168	174.4	-168.3	-162.1	10.2	112.1	L1885 E1888 M1889 E1966 P2017 Q2024 K2025	L1885-R2021 HydrophobicContact CD2-CB 4.24Å; L1885-R2021 HydrophobicContact CD2-CG 4.48Å; E1888-R2021 VanDerWaalsContact CB-NH2 3.27Å; E1888-R2021 IonicContact OE2-CZ 2.79Å; E1888-R2021 VanDerWaalsContact OE2-CZ 3.23Å; E1888-R2021 IonicContact OE2-NH1 3.34Å; E1888-R2021 PolarHBondContact OE2-NH1 3.23Å; E1888-R2021 IonicContact OE2-NH2 2.72Å; E1888-R2021 PolarHBondContact OE2-NH2 3.29Å; M1889-R2021 HydrophobicContact CE-CB 4.26Å; M1889-R2021 HydrophobicContact CG-CG 4.22Å; M1889-R2021 HydrophobicContact SD-CB 3.99Å; M1889-R2021 HydrophobicContact SD-CG 4.33Å; E1966-R2021 IonicContact OE1-CZ 2.69Å; E1966-R2021 IonicContact OE1-NH1 2.72Å; E1966-R2021 PolarHBondContact OE1-NH1 3.05Å; E1966-R2021 WeakPolarHBondContact OE2-CD 3.44Å; E1966-R2021 IonicContact OE2-CZ 3.1Å; E1966-R2021 IonicContact OE2-NE 3.99Å; E1966-R2021 IonicContact OE2-NH1 2.75Å; E1966-R2021 PolarHBondContact OE2-NH1 2.87Å; P2017-R2021 WeakPolarHBondContact O-CB 3.44Å; P2017-R2021 PolarHBondContact O-N 3.28Å; R2021-Q2024 PolarHBondContact O-N 2.88Å; R2021-K2025 HydrophobicContact CG-CD 4.16Å; R2021-K2025 HydrophobicContact CG-CG 4.44Å; R2021-K2025 VanDerWaalsContact O-CB 3.28Å; R2021-K2025 WeakPolarHBondContact O-CB 3.48Å; R2021-K2025 WeakPolarHBondContact O-CG 3.46Å; R2021-K2025 PolarHBondContact O-N 3.26Å
2022	T	79.7	Confident	83.7	Confident	4 Å²	4	22.4 Å²	22.4	3%	0.025	10%	0.102	C	C	.	.	H	α-helix	trans	-64.5	-48	175.7	-66.3	0	0	0	0	111.8	T1967 C1970 F1974 A2018 L2019 R2020 Q2024 K2025 L2026	T1967-T2022 HydrophobicContact CG2-CG2 3.71Å; C1970-T2022 PolarHBondContact SG-OG1 3.04Å; F1974-T2022 HydrophobicContact CD2-CG2 3.77Å; F1974-T2022 HydrophobicContact CE2-CG2 3.96Å; F1974-T2022 HydrophobicContact CG-CG2 4.42Å; A2018-T2022 VanDerWaalsContact O-CB 3.27Å; A2018-T2022 WeakPolarHBondContact O-CB 3.49Å; A2018-T2022 PolarHBondContact O-N 2.87Å; A2018-T2022 PolarHBondContact O-OG1 3.05Å; L2019-T2022 PolarHBondContact O-N 2.81Å; R2020-T2022 VanDerWaalsContact C-N 3.32Å; R2020-T2022 PolarHBondContact O-N 3.26Å; T2022-Q2024 PolarHBondContact O-N 2.87Å; T2022-K2025 PolarHBondContact O-N 3.46Å; T2022-L2026 HydrophobicContact CG2-CD1 4.38Å; T2022-L2026 WeakPolarHBondContact O-CG 3.43Å; T2022-L2026 PolarHBondContact O-N 3.4Å; T2022-L2026 VanDerWaalsContact O-N 3.08Å
2023	V	84.1	Confident	83.7	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.3	-44.7	175.9	173.8	0	0	0	0	110.9	L1920 F1974 L1977 Y2004 L2007 L2019 R2020 L2026 M2027	L1920-V2023 HydrophobicContact CD2-CG2 4.18Å; F1974-V2023 HydrophobicContact CD2-CG2 4.26Å; F1974-V2023 HydrophobicContact CE2-CG2 3.92Å; L1977-V2023 HydrophobicContact CD2-CG2 4.21Å; Y2004-V2023 HydrophobicContact CE2-CG1 4.08Å; L2007-V2023 HydrophobicContact CD2-CB 3.95Å; L2007-V2023 HydrophobicContact CD2-CG1 4.07Å; L2007-V2023 HydrophobicContact CD2-CG2 3.76Å; L2019-V2023 PolarHBondContact O-N 3.39Å; R2020-V2023 PolarHBondContact O-N 3.24Å; V2023-L2026 PolarHBondContact O-N 3.21Å; V2023-M2027 HydrophobicContact CG1-CG 4.36Å; V2023-M2027 HydrophobicContact CG1-SD 3.84Å; V2023-M2027 WeakPolarHBondContact O-CG 3.33Å; V2023-M2027 PolarHBondContact O-N 2.96Å
2024	Q	81.7	Confident	83.7	Confident	16 Å²	16	24.9 Å²	24.9	8%	0.075	11%	0.112	C	C	.	.	H	α-helix	trans	-65.4	-41.2	179.2	-158.9	-173	35	0	0	112.8	R2020 R2021 T2022 L2026 M2027 K2028 F2050 E2432	R2020-Q2024 WeakPolarHBondContact O-CB 3.45Å; R2020-Q2024 PolarHBondContact O-N 2.73Å; R2021-Q2024 PolarHBondContact O-N 2.88Å; T2022-Q2024 PolarHBondContact O-N 2.87Å; Q2024-L2026 VanDerWaalsContact C-N 3.31Å; Q2024-L2026 PolarHBondContact O-N 3.14Å; Q2024-M2027 PolarHBondContact O-N 2.93Å; Q2024-K2028 PolarHBondContact O-N 2.71Å; Q2024-F2050 HydrophobicContact CG-CE2 4.11Å; Q2024-E2432 PolarHBondContact NE2-OE1 2.83Å
2025	K	79.1	Confident	83.4	Confident	75 Å²	75	25.2 Å²	25.2	33%	0.326	12%	0.115	S	C	.	.	H	α-helix	trans	-56.7	-42.9	171.9	-80.5	167.8	172.8	174.6	0	111.2	E1966 R2021 T2022 K2029	E1966-K2025 IonicContact OE2-NZ 3.69Å; E1966-K2025 PolarHBondContact OE2-NZ 3.15Å; R2021-K2025 HydrophobicContact CG-CD 4.16Å; R2021-K2025 HydrophobicContact CG-CG 4.44Å; R2021-K2025 VanDerWaalsContact O-CB 3.28Å; R2021-K2025 WeakPolarHBondContact O-CB 3.48Å; R2021-K2025 WeakPolarHBondContact O-CG 3.46Å; R2021-K2025 PolarHBondContact O-N 3.26Å; T2022-K2025 PolarHBondContact O-N 3.46Å; K2025-K2029 PolarHBondContact O-N 3.32Å
2026	L	83.2	Confident	83.1	Confident	27 Å²	27	27.4 Å²	27.4	14%	0.141	13%	0.128	C	C	.	.	H	α-helix	trans	-72.2	-38.8	177.3	-65.4	174.1	0	0	0	112.3	T1919 A1923 I1926 F1974 T2022 V2023 Q2024 K2028 K2029 V2030	T1919-L2026 HydrophobicContact CG2-CB 3.47Å; T1919-L2026 VanDerWaalsContact CG2-CB 3.47Å; A1923-L2026 HydrophobicContact CB-CD1 4.47Å; I1926-L2026 HydrophobicContact CB-CD2 4.47Å; I1926-L2026 HydrophobicContact CD1-CB 4.05Å; I1926-L2026 HydrophobicContact CD1-CD2 4.01Å; I1926-L2026 HydrophobicContact CD1-CG 4.47Å; I1926-L2026 HydrophobicContact CG2-CD2 4.07Å; F1974-L2026 HydrophobicContact CE1-CD1 4.37Å; F1974-L2026 HydrophobicContact CE2-CD1 3.8Å; F1974-L2026 HydrophobicContact CZ-CD1 3.45Å; F1974-L2026 VanDerWaalsContact CZ-CD1 3.45Å; T2022-L2026 HydrophobicContact CG2-CD1 4.38Å; T2022-L2026 WeakPolarHBondContact O-CG 3.43Å; T2022-L2026 PolarHBondContact O-N 3.4Å; T2022-L2026 VanDerWaalsContact O-N 3.08Å; V2023-L2026 PolarHBondContact O-N 3.21Å; Q2024-L2026 VanDerWaalsContact C-N 3.31Å; Q2024-L2026 PolarHBondContact O-N 3.14Å; L2026-K2028 VanDerWaalsContact C-N 3.3Å; L2026-K2028 PolarHBondContact O-N 2.54Å; L2026-K2029 PolarHBondContact O-N 3.47Å; L2026-V2030 WeakPolarHBondContact O-CG2 3.44Å; L2026-V2030 PolarHBondContact O-N 2.87Å
2027	M	85.2	Confident	82.8	Confident	5 Å²	5	28.8 Å²	28.8	3%	0.025	13%	0.134	C	C	.	.	H	α-helix	trans	-58.9	-42.8	174.4	-74.1	166.9	59.8	0	0	111.1	L1915 A1916 T1919 Y2004 V2023 Q2024 K2029 V2030 F2031 F2050	L1915-M2027 HydrophobicContact CD2-CE 4.03Å; L1915-M2027 HydrophobicContact CG-CB 4.46Å; L1915-M2027 HydrophobicContact CG-CE 4.14Å; L1915-M2027 HydrophobicContact CG-CG 4.36Å; A1916-M2027 HydrophobicContact CB-CE 4.12Å; A1916-M2027 HydrophobicContact CB-CG 4.45Å; A1916-M2027 HydrophobicContact CB-SD 3.6Å; A1916-M2027 VanDerWaalsContact CB-SD 3.6Å; T1919-M2027 HydrophobicContact CG2-CG 4.04Å; Y2004-M2027 HydrophobicContact CD2-SD 4.4Å; Y2004-M2027 HydrophobicContact CE1-CE 3.94Å; Y2004-M2027 HydrophobicContact CE1-SD 4.39Å; Y2004-M2027 HydrophobicContact CE2-CE 4.21Å; Y2004-M2027 HydrophobicContact CE2-SD 3.58Å; Y2004-M2027 VanDerWaalsContact CE2-SD 3.58Å; Y2004-M2027 VanDerWaalsContact CZ-SD 3.56Å; Y2004-M2027 WeakPolarHBondContact OH-CE 3.34Å; Y2004-M2027 PolarHBondContact OH-SD 3.29Å; V2023-M2027 HydrophobicContact CG1-CG 4.36Å; V2023-M2027 HydrophobicContact CG1-SD 3.84Å; V2023-M2027 WeakPolarHBondContact O-CG 3.33Å; V2023-M2027 PolarHBondContact O-N 2.96Å; Q2024-M2027 PolarHBondContact O-N 2.93Å; M2027-K2029 PolarHBondContact O-N 3.34Å; M2027-V2030 PolarHBondContact O-N 3.18Å; M2027-F2031 VanDerWaalsContact O-CB 3.24Å; M2027-F2031 WeakPolarHBondContact O-CB 3.31Å; M2027-F2031 PolarHBondContact O-N 2.77Å; M2027-F2050 HydrophobicContact CB-CE1 4.46Å; M2027-F2050 HydrophobicContact CB-CZ 4.06Å; M2027-F2050 HydrophobicContact CE-CD2 4.21Å; M2027-F2050 HydrophobicContact CE-CE2 4.26Å
2028	K	84.2	Confident	82.8	Confident	72 Å²	72	28.7 Å²	28.7	31%	0.313	13%	0.133	S	C	.	.	H	α-helix	trans	-58.4	-43	174.8	-169	162.1	-166.3	162.6	0	112.2	S1892 V1895 Q2024 L2026 L2032 F2050	S1892-K2028 PolarHBondContact O-NZ 2.97Å; V1895-K2028 HydrophobicContact CG1-CD 4.47Å; V1895-K2028 HydrophobicContact CG1-CG 4.13Å; V1895-K2028 HydrophobicContact CG2-CB 4.28Å; V1895-K2028 HydrophobicContact CG2-CD 3.57Å; V1895-K2028 HydrophobicContact CG2-CG 3.77Å; Q2024-K2028 PolarHBondContact O-N 2.71Å; L2026-K2028 VanDerWaalsContact C-N 3.3Å; L2026-K2028 PolarHBondContact O-N 2.54Å; K2028-L2032 HydrophobicContact CG-CD1 4.09Å; K2028-L2032 WeakPolarHBondContact O-CB 3.08Å; K2028-L2032 VanDerWaalsContact O-CG 3.24Å; K2028-L2032 WeakPolarHBondContact O-CG 3.36Å; K2028-L2032 PolarHBondContact O-N 3.34Å; K2028-F2050 HydrophobicContact CB-CZ 4.17Å
2029	K	83.2	Confident	82.8	Confident	82 Å²	82	30.8 Å²	30.8	36%	0.357	15%	0.146	S	C	.	.	H	α-helix	trans	-63.8	-46.7	175.3	-67.5	-174.3	-175.1	-170.6	0	112.3	I1926 E1930 K2025 L2026 M2027 K2033	I1926-K2029 HydrophobicContact CG2-CB 4.19Å; I1926-K2029 HydrophobicContact CG2-CD 3.9Å; E1930-K2029 WeakPolarHBondContact OE1-CE 3.41Å; E1930-K2029 IonicContact OE1-NZ 2.75Å; E1930-K2029 PolarHBondContact OE1-NZ 2.69Å; E1930-K2029 IonicContact OE2-NZ 3.21Å; E1930-K2029 PolarHBondContact OE2-NZ 3.24Å; K2025-K2029 PolarHBondContact O-N 3.32Å; L2026-K2029 PolarHBondContact O-N 3.47Å; M2027-K2029 PolarHBondContact O-N 3.34Å; K2029-K2033 PolarHBondContact O-N 3.36Å; K2029-K2033 VanDerWaalsContact O-N 3.1Å
2030	V	85.4	Confident	82.6	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-63.3	-46.3	179.1	175.5	0	0	0	0	111.1	L1915 T1919 I1922 I1926 L2026 M2027 K2033 L2034 F2084	L1915-V2030 HydrophobicContact CD1-CG1 4.18Å; T1919-V2030 HydrophobicContact CG2-CG2 4.18Å; I1922-V2030 HydrophobicContact CD1-CG1 4.16Å; I1922-V2030 HydrophobicContact CD1-CG2 3.6Å; I1922-V2030 HydrophobicContact CG1-CG2 4.34Å; I1926-V2030 HydrophobicContact CD1-CG2 3.52Å; I1926-V2030 HydrophobicContact CG1-CG2 4.13Å; L2026-V2030 WeakPolarHBondContact O-CG2 3.44Å; L2026-V2030 PolarHBondContact O-N 2.87Å; M2027-V2030 PolarHBondContact O-N 3.18Å; V2030-K2033 PolarHBondContact O-N 3.41Å; V2030-L2034 PolarHBondContact O-N 2.88Å; V2030-F2084 HydrophobicContact CG1-CD1 4.15Å; V2030-F2084 HydrophobicContact CG1-CE1 3.85Å; V2030-F2084 WeakPolarHBondContact O-CE1 3.44Å
2031	F	87.3	Confident	82.3	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.009	18%	0.177	C	C	.	.	H	α-helix	trans	-63.2	-44.8	178.6	172.7	-104.8	0	0	0	112.8	V1895 I1897 F1912 L1915 M2027 K2033 L2034 V2035 A2048 N2049 F2050	V1895-F2031 HydrophobicContact CG1-CD1 3.74Å; V1895-F2031 HydrophobicContact CG1-CE1 3.79Å; I1897-F2031 HydrophobicContact CD1-CE1 4.09Å; I1897-F2031 HydrophobicContact CD1-CZ 4.5Å; I1897-F2031 HydrophobicContact CG1-CE1 4.43Å; F1912-F2031 HydrophobicContact CE2-CD2 4.26Å; F1912-F2031 HydrophobicContact CE2-CE2 4.16Å; F1912-F2031 HydrophobicContact CZ-CD2 4.38Å; F1912-F2031 AromaticContact CZ-CE2 3.84Å; F1912-F2031 HydrophobicContact CZ-CE2 3.84Å; L1915-F2031 HydrophobicContact CD2-CB 4.4Å; M2027-F2031 VanDerWaalsContact O-CB 3.24Å; M2027-F2031 WeakPolarHBondContact O-CB 3.31Å; M2027-F2031 PolarHBondContact O-N 2.77Å; F2031-K2033 VanDerWaalsContact C-N 3.28Å; F2031-K2033 PolarHBondContact O-N 3.04Å; F2031-L2034 WeakPolarHBondContact O-CB 3.45Å; F2031-L2034 PolarHBondContact O-N 2.9Å; F2031-L2034 VanDerWaalsContact O-N 3.11Å; F2031-V2035 HydrophobicContact CE1-CG2 4.27Å; F2031-V2035 HydrophobicContact CE2-CG2 4.1Å; F2031-V2035 HydrophobicContact CZ-CG2 3.94Å; F2031-V2035 WeakPolarHBondContact O-CG2 3.42Å; F2031-V2035 PolarHBondContact O-N 2.87Å; F2031-A2048 HydrophobicContact CE2-CB 4.1Å; F2031-A2048 HydrophobicContact CZ-CB 3.57Å; F2031-N2049 WeakPolarHBondContact CE2-O 3.28Å; F2031-N2049 WeakPolarHBondContact CZ-O 3.13Å; F2031-F2050 HydrophobicContact CB-CD1 4.29Å; F2031-F2050 HydrophobicContact CB-CE1 3.96Å; F2031-F2050 HydrophobicContact CD1-CD1 4.26Å; F2031-F2050 HydrophobicContact CD1-CE1 4.14Å; F2031-F2050 HydrophobicContact CG-CD1 4.1Å; F2031-F2050 HydrophobicContact CG-CE1 4.1Å
2032	L	85.4	Confident	82.3	Confident	84 Å²	84	43.3 Å²	43.3	44%	0.44	21%	0.206	S	C	.	.	H	α-helix	trans	-63.3	-35	176.1	-71.1	171.6	0	0	0	112	I1897 K2028 V2035 D2036	I1897-L2032 HydrophobicContact CD1-CD2 4.05Å; K2028-L2032 HydrophobicContact CG-CD1 4.09Å; K2028-L2032 WeakPolarHBondContact O-CB 3.08Å; K2028-L2032 VanDerWaalsContact O-CG 3.24Å; K2028-L2032 WeakPolarHBondContact O-CG 3.36Å; K2028-L2032 PolarHBondContact O-N 3.34Å; L2032-V2035 PolarHBondContact O-N 2.99Å; L2032-D2036 WeakPolarHBondContact O-CB 3.4Å; L2032-D2036 PolarHBondContact O-N 3.26Å
2033	K	84.4	Confident	82.4	Confident	54 Å²	54	43.8 Å²	43.8	24%	0.235	21%	0.209	C	C	.	.	H	α-helix	trans	-73.2	-26.9	173.6	-176.1	55.2	-167.6	164.5	0	113.2	K2029 V2030 F2031 D2036 E2037 L2083 F2084	K2029-K2033 PolarHBondContact O-N 3.36Å; K2029-K2033 VanDerWaalsContact O-N 3.1Å; V2030-K2033 PolarHBondContact O-N 3.41Å; F2031-K2033 VanDerWaalsContact C-N 3.28Å; F2031-K2033 PolarHBondContact O-N 3.04Å; K2033-D2036 HydrophobicContact CD-CB 4.27Å; K2033-D2036 WeakPolarHBondContact CD-OD2 3.44Å; K2033-D2036 IonicContact NZ-OD2 2.76Å; K2033-D2036 PolarHBondContact NZ-OD2 2.88Å; K2033-E2037 HydrophobicContact CD-CG 4.48Å; K2033-E2037 WeakPolarHBondContact CE-OE1 3.33Å; K2033-E2037 IonicContact NZ-OE1 2.74Å; K2033-E2037 PolarHBondContact NZ-OE1 2.84Å; K2033-E2037 WeakPolarHBondContact O-CG 3.22Å; K2033-E2037 PolarHBondContact O-N 2.83Å; K2033-L2083 HydrophobicContact CB-CD1 4.36Å; K2033-L2083 HydrophobicContact CG-CD1 3.66Å; K2033-F2084 HydrophobicContact CB-CZ 4.48Å; K2033-F2084 HydrophobicContact CG-CZ 4.28Å
2034	L	84.8	Confident	82.4	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-64.3	-46.9	169.8	178.3	64.4	0	0	0	110.5	V2030 F2031 E2037 I2038 L2076 F2084 L2087	V2030-L2034 PolarHBondContact O-N 2.88Å; F2031-L2034 WeakPolarHBondContact O-CB 3.45Å; F2031-L2034 PolarHBondContact O-N 2.9Å; F2031-L2034 VanDerWaalsContact O-N 3.11Å; L2034-E2037 PolarHBondContact O-N 3.16Å; L2034-I2038 HydrophobicContact CD1-CD1 4.42Å; L2034-I2038 HydrophobicContact CG-CD1 4Å; L2034-I2038 WeakPolarHBondContact O-CD1 3.49Å; L2034-I2038 VanDerWaalsContact O-CG1 3.28Å; L2034-I2038 WeakPolarHBondContact O-CG1 3.04Å; L2034-I2038 PolarHBondContact O-N 3.05Å; L2034-L2076 HydrophobicContact CD1-CD1 3.93Å; L2034-L2076 HydrophobicContact CD1-CD2 4Å; L2034-F2084 VanDerWaalsContact CA-CZ 3.5Å; L2034-F2084 HydrophobicContact CB-CD1 4.19Å; L2034-F2084 HydrophobicContact CB-CE1 3.62Å; L2034-F2084 HydrophobicContact CB-CZ 3.88Å; L2034-F2084 HydrophobicContact CD1-CD1 4Å; L2034-F2084 HydrophobicContact CD1-CD2 4.13Å; L2034-F2084 HydrophobicContact CD1-CE1 4.14Å; L2034-F2084 HydrophobicContact CD1-CE2 4.26Å; L2034-F2084 HydrophobicContact CD1-CG 4Å; L2034-F2084 HydrophobicContact CD1-CZ 4.26Å; L2034-F2084 HydrophobicContact CG-CE1 4.43Å; L2034-L2087 HydrophobicContact CD1-CD2 4.31Å; L2034-L2087 HydrophobicContact CD2-CD2 3.59Å
2035	V	84.3	Confident	82.8	Confident	13 Å²	13	45.9 Å²	45.9	8%	0.079	22%	0.22	C	C	.	.	H	α-helix	trans	-62.5	-43.3	177.6	173.5	0	0	0	0	111.6	I1897 F2031 L2032 I2038 T2039 V2045 A2048	I1897-V2035 HydrophobicContact CD1-CB 4.15Å; I1897-V2035 HydrophobicContact CD1-CG1 3.77Å; I1897-V2035 HydrophobicContact CD1-CG2 3.82Å; F2031-V2035 HydrophobicContact CE1-CG2 4.27Å; F2031-V2035 HydrophobicContact CE2-CG2 4.1Å; F2031-V2035 HydrophobicContact CZ-CG2 3.94Å; F2031-V2035 WeakPolarHBondContact O-CG2 3.42Å; F2031-V2035 PolarHBondContact O-N 2.87Å; L2032-V2035 PolarHBondContact O-N 2.99Å; V2035-I2038 PolarHBondContact O-N 3.26Å; V2035-T2039 WeakPolarHBondContact O-CG2 3.45Å; V2035-T2039 PolarHBondContact O-N 2.99Å; V2035-T2039 PolarHBondContact O-OG1 3.25Å; V2035-V2045 HydrophobicContact CG1-CB 4.49Å; V2035-V2045 HydrophobicContact CG1-CG1 4.33Å; V2035-V2045 HydrophobicContact CG1-CG2 4.29Å; V2035-A2048 HydrophobicContact CG2-CB 4.34Å
2036	D	81.3	Confident	83.3	Confident	61 Å²	61	42.3 Å²	42.3	33%	0.326	21%	0.205	S	C	.	.	H	α-helix	trans	-56.6	-50.3	173.3	175.2	60	0	0	0	111.9	L2032 K2033 I2038 T2039 H2040	L2032-D2036 WeakPolarHBondContact O-CB 3.4Å; L2032-D2036 PolarHBondContact O-N 3.26Å; K2033-D2036 HydrophobicContact CD-CB 4.27Å; K2033-D2036 WeakPolarHBondContact CD-OD2 3.44Å; K2033-D2036 IonicContact NZ-OD2 2.76Å; K2033-D2036 PolarHBondContact NZ-OD2 2.88Å; D2036-I2038 PolarHBondContact O-N 3.34Å; D2036-T2039 PolarHBondContact O-N 3.42Å; D2036-T2039 PolarHBondContact O-OG1 3.46Å; D2036-H2040 PolarHBondContact O-N 3.24Å; D2036-H2040 PolarHBondContact O-ND1 2.65Å; D2036-H2040 IonicContact OD1-CE1 2.66Å; D2036-H2040 PolarHBondContact OD1-CE1 2.7Å; D2036-H2040 VanDerWaalsContact OD1-CE1 3.26Å; D2036-H2040 IonicContact OD1-ND1 3.6Å; D2036-H2040 IonicContact OD2-CE1 3.64Å
2037	E	81.2	Confident	83.7	Confident	33 Å²	33	41.5 Å²	41.5	15%	0.154	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-39.1	175.1	-71.6	-71.7	147.4	0	0	112.7	K2033 L2034 T2039 H2040 F2041 R2079 F2084	K2033-E2037 HydrophobicContact CD-CG 4.48Å; K2033-E2037 WeakPolarHBondContact CE-OE1 3.33Å; K2033-E2037 IonicContact NZ-OE1 2.74Å; K2033-E2037 PolarHBondContact NZ-OE1 2.84Å; K2033-E2037 WeakPolarHBondContact O-CG 3.22Å; K2033-E2037 PolarHBondContact O-N 2.83Å; L2034-E2037 PolarHBondContact O-N 3.16Å; E2037-T2039 VanDerWaalsContact C-N 3.35Å; E2037-T2039 PolarHBondContact O-N 2.89Å; E2037-H2040 WeakPolarHBondContact O-CB 3.2Å; E2037-H2040 PolarHBondContact O-N 2.79Å; E2037-F2041 WeakPolarHBondContact O-CD2 3.16Å; E2037-F2041 WeakPolarHBondContact O-CE2 3.22Å; E2037-R2079 IonicContact OE2-CZ 3.81Å; E2037-R2079 IonicContact OE2-NH1 2.99Å; E2037-R2079 PolarHBondContact OE2-NH1 2.76Å; E2037-F2084 HydrophobicContact CG-CE2 4.21Å
2038	I	80.9	Confident	83.8	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-58.9	-47.5	174.8	-66.2	154.2	0	0	0	110.5	L2034 V2035 D2036 H2040 F2041 V2043 V2045 L2053 F2072	L2034-I2038 HydrophobicContact CD1-CD1 4.42Å; L2034-I2038 HydrophobicContact CG-CD1 4Å; L2034-I2038 WeakPolarHBondContact O-CD1 3.49Å; L2034-I2038 VanDerWaalsContact O-CG1 3.28Å; L2034-I2038 WeakPolarHBondContact O-CG1 3.04Å; L2034-I2038 PolarHBondContact O-N 3.05Å; V2035-I2038 PolarHBondContact O-N 3.26Å; D2036-I2038 PolarHBondContact O-N 3.34Å; I2038-H2040 PolarHBondContact O-N 3.44Å; I2038-F2041 PolarHBondContact O-N 3.23Å; I2038-V2043 HydrophobicContact CG2-CB 4.34Å; I2038-V2043 HydrophobicContact CG2-CG1 3.99Å; I2038-V2045 HydrophobicContact CB-CG2 3.94Å; I2038-V2045 HydrophobicContact CD1-CG2 4.47Å; I2038-V2045 HydrophobicContact CG2-CG2 3.43Å; I2038-V2045 VanDerWaalsContact CG2-CG2 3.43Å; I2038-L2053 HydrophobicContact CD1-CD1 4.1Å; I2038-L2053 HydrophobicContact CD1-CD2 3.48Å; I2038-L2053 VanDerWaalsContact CD1-CD2 3.48Å; I2038-L2053 HydrophobicContact CD1-CG 4.45Å; I2038-F2072 HydrophobicContact CB-CZ 4.41Å; I2038-F2072 HydrophobicContact CD1-CZ 4.31Å; I2038-F2072 HydrophobicContact CG1-CE1 4.14Å; I2038-F2072 HydrophobicContact CG1-CE2 3.96Å; I2038-F2072 HydrophobicContact CG1-CZ 3.36Å
2039	T	79.6	Confident	84	Confident	44 Å²	44	38.3 Å²	38.3	27%	0.27	19%	0.186	S	C	.	.	H	α-helix	trans	-65.3	-25.3	-178.4	57.7	0	0	0	0	113.4	V2035 D2036 E2037 F2041 H2042 V2045	V2035-T2039 WeakPolarHBondContact O-CG2 3.45Å; V2035-T2039 PolarHBondContact O-N 2.99Å; V2035-T2039 PolarHBondContact O-OG1 3.25Å; D2036-T2039 PolarHBondContact O-N 3.42Å; D2036-T2039 PolarHBondContact O-OG1 3.46Å; E2037-T2039 VanDerWaalsContact C-N 3.35Å; E2037-T2039 PolarHBondContact O-N 2.89Å; T2039-F2041 PolarHBondContact O-N 2.82Å; T2039-H2042 PolarHBondContact O-N 2.82Å; T2039-V2045 HydrophobicContact CG2-CG2 4.12Å
2040	H	79	Confident	84	Confident	122 Å²	122	35.5 Å²	35.5	57%	0.565	17%	0.174	S	C	*	.	H	α-helix	trans	-67.4	-17	172.1	-78.5	78.2	0	0	0	113.8	D2036 E2037 I2038 H2042	D2036-H2040 PolarHBondContact O-N 3.24Å; D2036-H2040 PolarHBondContact O-ND1 2.65Å; D2036-H2040 IonicContact OD1-CE1 2.66Å; D2036-H2040 PolarHBondContact OD1-CE1 2.7Å; D2036-H2040 VanDerWaalsContact OD1-CE1 3.26Å; D2036-H2040 IonicContact OD1-ND1 3.6Å; D2036-H2040 IonicContact OD2-CE1 3.64Å; E2037-H2040 WeakPolarHBondContact O-CB 3.2Å; E2037-H2040 PolarHBondContact O-N 2.79Å; I2038-H2040 PolarHBondContact O-N 3.44Å; H2040-H2042 VanDerWaalsContact C-N 3.31Å; H2040-H2042 PolarHBondContact O-N 3Å
2041	F	77.5	Confident	83.7	Confident	56 Å²	56	35.6 Å²	35.6	25%	0.246	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	13.9	177.7	-69.7	-69.9	0	0	0	114.5	E2037 I2038 T2039 V2043 R2068 F2072 L2075	E2037-F2041 WeakPolarHBondContact O-CD2 3.16Å; E2037-F2041 WeakPolarHBondContact O-CE2 3.22Å; I2038-F2041 PolarHBondContact O-N 3.23Å; T2039-F2041 PolarHBondContact O-N 2.82Å; F2041-V2043 VanDerWaalsContact C-N 3.34Å; F2041-V2043 HydrophobicContact CB-CG2 4.46Å; F2041-R2068 PolarHBondContact O-NH2 3.42Å; F2041-F2072 AromaticContact CD2-CD2 3.8Å; F2041-F2072 HydrophobicContact CD2-CD2 3.8Å; F2041-F2072 AromaticContact CD2-CE2 3.75Å; F2041-F2072 HydrophobicContact CD2-CE2 3.75Å; F2041-F2072 HydrophobicContact CE2-CD2 4.23Å; F2041-F2072 HydrophobicContact CE2-CE2 4.07Å; F2041-F2072 HydrophobicContact CG-CD2 4.34Å; F2041-L2075 HydrophobicContact CD1-CD2 4.4Å; F2041-L2075 HydrophobicContact CE1-CD2 3.38Å; F2041-L2075 HydrophobicContact CE2-CD2 4.16Å; F2041-L2075 HydrophobicContact CZ-CD2 3.24Å
2042	H	76.5	Confident	83.6	Confident	155 Å²	155	38.3 Å²	38.3	72%	0.718	19%	0.185	S	C	*	.	S	Bend	trans	52.8	52.1	-173.1	-57.3	-66	0	0	0	111.9	T2039 H2040 H2058 R2068	T2039-H2042 PolarHBondContact O-N 2.82Å; H2040-H2042 VanDerWaalsContact C-N 3.31Å; H2040-H2042 PolarHBondContact O-N 3Å; H2042-H2058 PolarHBondContact O-CD2 2.86Å; H2042-H2058 VanDerWaalsContact O-CD2 3.27Å; H2042-R2068 PolarHBondContact O-NH2 2.72Å
2043	V	81.8	Confident	83.7	Confident	14 Å²	14	34.4 Å²	34.4	9%	0.085	17%	0.165	C	C	.	.			trans	-131.7	119.5	178.1	167.9	0	0	0	0	106.9	I2038 F2041 V2045 M2055	I2038-V2043 HydrophobicContact CG2-CB 4.34Å; I2038-V2043 HydrophobicContact CG2-CG1 3.99Å; F2041-V2043 VanDerWaalsContact C-N 3.34Å; F2041-V2043 HydrophobicContact CB-CG2 4.46Å; V2043-V2045 PolarHBondContact O-N 2.65Å; V2043-M2055 HydrophobicContact CG1-CB 3.73Å; V2043-M2055 HydrophobicContact CG1-CG 4.12Å; V2043-M2055 HydrophobicContact CG1-SD 3.76Å
2044	D	84.3	Confident	84.1	Confident	59 Å²	59	32 Å²	32	32%	0.316	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	118.2	179.8	-89.7	-47.7	0	0	0	111.5	R1899 Y1903 I2046 M2055 S2056 H2058	R1899-D2044 IonicContact NH1-OD1 3.32Å; R1899-D2044 PolarHBondContact NH1-OD1 3.38Å; Y1903-D2044 HydrophobicContact CE1-CB 4.28Å; D2044-I2046 PolarHBondContact O-N 2.9Å; D2044-M2055 CarbonylContact O-C 3.56Å; D2044-M2055 VanDerWaalsContact O-CA 3.29Å; D2044-M2055 WeakPolarHBondContact O-CA 3.36Å; D2044-S2056 PolarHBondContact N-O 3.17Å; D2044-S2056 PolarHBondContact O-N 2.92Å; D2044-H2058 PolarHBondContact N-NE2 3.21Å; D2044-H2058 IonicContact OD2-CE1 3.63Å; D2044-H2058 PolarHBondContact OD2-CE1 3.14Å; D2044-H2058 IonicContact OD2-NE2 3.8Å
2045	V	89.3	Confident	84.3	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	109.6	170.4	177	0	0	0	0	108.8	R1899 V2035 I2038 T2039 V2043 A2048 L2053	R1899-V2045 WeakPolarHBondContact CD-O 3.47Å; R1899-V2045 WeakPolarHBondContact CG-O 3.29Å; R1899-V2045 PolarHBondContact NE-O 3.26Å; V2035-V2045 HydrophobicContact CG1-CB 4.49Å; V2035-V2045 HydrophobicContact CG1-CG1 4.33Å; V2035-V2045 HydrophobicContact CG1-CG2 4.29Å; I2038-V2045 HydrophobicContact CB-CG2 3.94Å; I2038-V2045 HydrophobicContact CD1-CG2 4.47Å; I2038-V2045 HydrophobicContact CG2-CG2 3.43Å; I2038-V2045 VanDerWaalsContact CG2-CG2 3.43Å; T2039-V2045 HydrophobicContact CG2-CG2 4.12Å; V2043-V2045 PolarHBondContact O-N 2.65Å; V2045-A2048 HydrophobicContact CG1-CB 3.94Å; V2045-L2053 HydrophobicContact CB-CD1 4.5Å; V2045-L2053 HydrophobicContact CG1-CD1 3.77Å; V2045-L2053 HydrophobicContact CG2-CD1 4.14Å
2046	I	90.9	Very high	84.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-52.2	-177.5	-56.6	178.9	0	0	0	109.7	R1899 Y1903 N1907 D2044 I2054 L2098 W2100	R1899-I2046 PolarHBondContact N-O 2.87Å; Y1903-I2046 HydrophobicContact CD1-CD1 3.77Å; Y1903-I2046 HydrophobicContact CD1-CG1 3.95Å; Y1903-I2046 HydrophobicContact CD2-CD1 3.66Å; Y1903-I2046 HydrophobicContact CD2-CG1 4.06Å; Y1903-I2046 HydrophobicContact CD2-CG2 4.13Å; Y1903-I2046 HydrophobicContact CE1-CD1 4.13Å; Y1903-I2046 HydrophobicContact CE1-CG1 3.78Å; Y1903-I2046 HydrophobicContact CE2-CB 4.32Å; Y1903-I2046 HydrophobicContact CE2-CD1 4.03Å; Y1903-I2046 HydrophobicContact CE2-CG1 3.89Å; Y1903-I2046 HydrophobicContact CE2-CG2 3.67Å; Y1903-I2046 HydrophobicContact CG-CD1 3.52Å; Y1903-I2046 HydrophobicContact CG-CG1 4.08Å; N1907-I2046 HydrophobicContact CB-CD1 4.18Å; N1907-I2046 VanDerWaalsContact OD1-CD1 3.3Å; N1907-I2046 WeakPolarHBondContact OD1-CD1 3.34Å; D2044-I2046 PolarHBondContact O-N 2.9Å; I2046-I2054 HydrophobicContact CB-CB 4.35Å; I2046-I2054 HydrophobicContact CB-CG2 4.21Å; I2046-I2054 WeakPolarHBondContact CB-O 3.42Å; I2046-I2054 HydrophobicContact CD1-CG2 4.22Å; I2046-I2054 PolarHBondContact N-O 3.22Å; I2046-L2098 HydrophobicContact CD1-CD2 4.26Å; I2046-W2100 HydrophobicContact CG2-CB 3.89Å; I2046-W2100 HydrophobicContact CG2-CD2 3.98Å; I2046-W2100 HydrophobicContact CG2-CG 3.51Å
2047	Y	91.3	Very high	85	Confident	11 Å²	11	28.7 Å²	28.7	4%	0.043	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	140.8	178.5	-177.4	-96.5	0	0	0	109.6	E1896 I1897 N1898 N2049 R2052 L2053 I2054 W2100	E1896-Y2047 HydrophobicContact CG-CD2 4.36Å; E1896-Y2047 HydrophobicContact CG-CE2 3.5Å; E1896-Y2047 WeakPolarHBondContact OE2-CE2 3.47Å; E1896-Y2047 PolarHBondContact OE2-OH 2.76Å; I1897-Y2047 CarbonylContact O-C 3.58Å; I1897-Y2047 VanDerWaalsContact O-CA 3.28Å; I1897-Y2047 WeakPolarHBondContact O-CA 3.47Å; N1898-Y2047 HydrophobicContact CB-CD2 4.38Å; Y2047-N2049 HydrophobicContact CE1-CB 4.19Å; Y2047-N2049 PolarHBondContact OH-ND2 3.15Å; Y2047-R2052 HydrophobicContact CE1-CB 4.46Å; Y2047-L2053 CarbonylContact O-C 3.36Å; Y2047-L2053 WeakPolarHBondContact O-CA 3.17Å; Y2047-I2054 PolarHBondContact N-O 3.07Å; Y2047-I2054 PolarHBondContact O-N 3.35Å; Y2047-W2100 HydrophobicContact CD1-CZ2 4.49Å; Y2047-W2100 AromaticContact CD2-CZ2 3.61Å; Y2047-W2100 HydrophobicContact CD2-CZ2 3.61Å; Y2047-W2100 HydrophobicContact CE2-CZ2 4.42Å; Y2047-W2100 HydrophobicContact CG-CH2 4.35Å; Y2047-W2100 AromaticContact CG-CZ2 3.65Å; Y2047-W2100 HydrophobicContact CG-CZ2 3.65Å
2048	A	87.8	Confident	85.2	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	138.5	167.8	0	0	0	0	0	112.2	I1897 F2031 V2035 V2045 R2052 L2053	I1897-A2048 HydrophobicContact CB-CB 4.41Å; I1897-A2048 PolarHBondContact N-O 3.34Å; I1897-A2048 PolarHBondContact O-N 2.79Å; F2031-A2048 HydrophobicContact CE2-CB 4.1Å; F2031-A2048 HydrophobicContact CZ-CB 3.57Å; V2035-A2048 HydrophobicContact CG2-CB 4.34Å; V2045-A2048 HydrophobicContact CG1-CB 3.94Å; A2048-R2052 CarbonylContact C-O 3.53Å; A2048-R2052 VanDerWaalsContact CA-O 3.24Å; A2048-R2052 WeakPolarHBondContact CA-O 3.49Å; A2048-L2053 HydrophobicContact CB-CD1 4.06Å
2049	N	86.9	Confident	85.4	Confident	9 Å²	9	34.4 Å²	34.4	5%	0.048	16%	0.158	C	C	.	.			trans	-134.8	-158.7	171.3	71.5	22.7	0	0	0	111.6	V1895 F1912 F2031 Y2047 S2051 R2052	V1895-N2049 VanDerWaalsContact O-CA 3.28Å; V1895-N2049 WeakPolarHBondContact O-CA 3.45Å; F1912-N2049 WeakPolarHBondContact CE2-O 3.22Å; F1912-N2049 WeakPolarHBondContact CZ-O 3.41Å; F2031-N2049 WeakPolarHBondContact CE2-O 3.28Å; F2031-N2049 WeakPolarHBondContact CZ-O 3.13Å; Y2047-N2049 HydrophobicContact CE1-CB 4.19Å; Y2047-N2049 PolarHBondContact OH-ND2 3.15Å; N2049-S2051 PolarHBondContact O-N 3.46Å; N2049-S2051 WeakPolarHBondContact OD1-CA 3.41Å; N2049-S2051 PolarHBondContact OD1-N 3.35Å; N2049-S2051 PolarHBondContact OD1-OG 3.46Å; N2049-R2052 PolarHBondContact N-O 2.81Å; N2049-R2052 PolarHBondContact OD1-N 2.83Å
2050	F	83.4	Confident	85.6	Confident	23 Å²	23	33.4 Å²	33.4	10%	0.101	15%	0.151	C	C	.	.	S	Bend	trans	-77.9	4.8	177.1	-79.9	-12.8	0	0	0	115.7	V1895 F1912 L1915 Q2024 M2027 K2028 F2031	V1895-F2050 HydrophobicContact CB-CD1 4.2Å; V1895-F2050 HydrophobicContact CB-CE1 3.83Å; V1895-F2050 HydrophobicContact CB-CZ 4.06Å; V1895-F2050 HydrophobicContact CG1-CE1 4.32Å; V1895-F2050 HydrophobicContact CG2-CD1 4.43Å; V1895-F2050 HydrophobicContact CG2-CE1 3.69Å; V1895-F2050 HydrophobicContact CG2-CE2 3.92Å; V1895-F2050 HydrophobicContact CG2-CZ 3.4Å; V1895-F2050 VanDerWaalsContact CG2-CZ 3.4Å; F1912-F2050 VanDerWaalsContact CE2-C 3.5Å; L1915-F2050 HydrophobicContact CD2-CB 4.41Å; L1915-F2050 HydrophobicContact CD2-CD1 3.74Å; L1915-F2050 HydrophobicContact CD2-CE1 4.22Å; L1915-F2050 HydrophobicContact CD2-CG 4.17Å; Q2024-F2050 HydrophobicContact CG-CE2 4.11Å; M2027-F2050 HydrophobicContact CB-CE1 4.46Å; M2027-F2050 HydrophobicContact CB-CZ 4.06Å; M2027-F2050 HydrophobicContact CE-CD2 4.21Å; M2027-F2050 HydrophobicContact CE-CE2 4.26Å; K2028-F2050 HydrophobicContact CB-CZ 4.17Å; F2031-F2050 HydrophobicContact CB-CD1 4.29Å; F2031-F2050 HydrophobicContact CB-CE1 3.96Å; F2031-F2050 HydrophobicContact CD1-CD1 4.26Å; F2031-F2050 HydrophobicContact CD1-CE1 4.14Å; F2031-F2050 HydrophobicContact CG-CD1 4.1Å; F2031-F2050 HydrophobicContact CG-CE1 4.1Å
2051	S	79.1	Confident	85.6	Confident	4 Å²	4	30.3 Å²	30.3	3%	0.028	14%	0.137	C	C	.	.	S	Bend	trans	-137.4	-29.6	-179.2	60.9	0	0	0	0	115	E1911 F1912 N2049	E1911-S2051 CarbonylContact C-O 3.57Å; E1911-S2051 VanDerWaalsContact CA-O 3.32Å; E1911-S2051 WeakPolarHBondContact CA-O 3.43Å; E1911-S2051 WeakPolarHBondContact CG-O 3.38Å; F1912-S2051 PolarHBondContact N-O 2.93Å; N2049-S2051 PolarHBondContact O-N 3.46Å; N2049-S2051 WeakPolarHBondContact OD1-CA 3.41Å; N2049-S2051 PolarHBondContact OD1-N 3.35Å; N2049-S2051 PolarHBondContact OD1-OG 3.46Å
2052	R	85.6	Confident	85.9	Confident	58 Å²	58	27.6 Å²	27.6	22%	0.219	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	148.5	-172.3	-68.1	173.9	176.5	-137.8	12.7	112.3	E1909 L1910 F1912 Y2047 A2048 N2049	E1909-R2052 VanDerWaalsContact OE1-CD 3.25Å; E1909-R2052 WeakPolarHBondContact OE1-CD 3.06Å; E1909-R2052 IonicContact OE1-CZ 2.97Å; E1909-R2052 IonicContact OE1-NE 3.16Å; E1909-R2052 IonicContact OE1-NH1 3.28Å; E1909-R2052 PolarHBondContact OE1-NH1 2.89Å; E1909-R2052 IonicContact OE2-NH1 3.92Å; L1910-R2052 CarbonylContact O-C 3.51Å; L1910-R2052 WeakPolarHBondContact O-CA 3.04Å; F1912-R2052 WeakPolarHBondContact CE1-O 3.42Å; F1912-R2052 WeakPolarHBondContact CZ-O 3.49Å; Y2047-R2052 HydrophobicContact CE1-CB 4.46Å; A2048-R2052 CarbonylContact C-O 3.53Å; A2048-R2052 VanDerWaalsContact CA-O 3.24Å; A2048-R2052 WeakPolarHBondContact CA-O 3.49Å; N2049-R2052 PolarHBondContact N-O 2.81Å; N2049-R2052 PolarHBondContact OD1-N 2.83Å
2053	L	88.1	Confident	86.2	Confident	3 Å²	3	22 Å²	22	2%	0.016	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	114.8	176.7	163.2	63.7	0	0	0	109.1	L1910 F1912 I2038 V2045 Y2047 A2048 M2055	L1910-L2053 PolarHBondContact N-O 3.37Å; L1910-L2053 PolarHBondContact O-N 3.03Å; F1912-L2053 HydrophobicContact CD1-CB 4.25Å; F1912-L2053 HydrophobicContact CE1-CB 3.52Å; F1912-L2053 HydrophobicContact CZ-CB 4.44Å; I2038-L2053 HydrophobicContact CD1-CD1 4.1Å; I2038-L2053 HydrophobicContact CD1-CD2 3.48Å; I2038-L2053 VanDerWaalsContact CD1-CD2 3.48Å; I2038-L2053 HydrophobicContact CD1-CG 4.45Å; V2045-L2053 HydrophobicContact CB-CD1 4.5Å; V2045-L2053 HydrophobicContact CG1-CD1 3.77Å; V2045-L2053 HydrophobicContact CG2-CD1 4.14Å; Y2047-L2053 CarbonylContact O-C 3.36Å; Y2047-L2053 WeakPolarHBondContact O-CA 3.17Å; A2048-L2053 HydrophobicContact CB-CD1 4.06Å; L2053-M2055 HydrophobicContact CD1-CE 4.3Å; L2053-M2055 HydrophobicContact CD2-CE 3.49Å; L2053-M2055 VanDerWaalsContact CD2-CE 3.49Å; L2053-M2055 HydrophobicContact CG-CE 3.75Å
2054	I	91.8	Very high	86.2	Confident	3 Å²	3	24.6 Å²	24.6	2%	0.015	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.3	174	-52.5	179.6	0	0	0	108.4	V1908 E1909 I2046 Y2047 W2095 L2098 W2100	V1908-I2054 WeakPolarHBondContact O-CA 3.17Å; E1909-I2054 HydrophobicContact CB-CG1 4.01Å; E1909-I2054 HydrophobicContact CG-CD1 4.5Å; E1909-I2054 HydrophobicContact CG-CG1 3.94Å; I2046-I2054 HydrophobicContact CB-CB 4.35Å; I2046-I2054 HydrophobicContact CB-CG2 4.21Å; I2046-I2054 WeakPolarHBondContact CB-O 3.42Å; I2046-I2054 HydrophobicContact CD1-CG2 4.22Å; I2046-I2054 PolarHBondContact N-O 3.22Å; Y2047-I2054 PolarHBondContact N-O 3.07Å; Y2047-I2054 PolarHBondContact O-N 3.35Å; I2054-W2095 HydrophobicContact CD1-CH2 4.3Å; I2054-W2095 HydrophobicContact CD1-CZ3 4.44Å; I2054-W2095 HydrophobicContact CG2-CZ3 4.03Å; I2054-L2098 HydrophobicContact CG2-CD2 4.23Å; I2054-W2100 HydrophobicContact CD1-CE3 4.32Å; I2054-W2100 HydrophobicContact CD1-CH2 3.44Å; I2054-W2100 VanDerWaalsContact CD1-CH2 3.44Å; I2054-W2100 HydrophobicContact CD1-CZ2 4.17Å; I2054-W2100 HydrophobicContact CD1-CZ3 3.53Å
2055	M	90.4	Very high	86.2	Confident	5 Å²	5	21.8 Å²	21.8	3%	0.025	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	142.3	-176.2	65.4	175.3	70.1	0	0	113.6	N1907 V1908 L1910 V2043 D2044 L2053 V2069	N1907-M2055 CarbonylContact C-O 3.58Å; N1907-M2055 VanDerWaalsContact CA-O 3.22Å; N1907-M2055 WeakPolarHBondContact CA-O 3.5Å; V1908-M2055 HydrophobicContact CB-CG 4.48Å; V1908-M2055 PolarHBondContact N-O 3.17Å; V1908-M2055 PolarHBondContact O-N 3.17Å; L1910-M2055 HydrophobicContact CD1-CE 3.74Å; V2043-M2055 HydrophobicContact CG1-CB 3.73Å; V2043-M2055 HydrophobicContact CG1-CG 4.12Å; V2043-M2055 HydrophobicContact CG1-SD 3.76Å; D2044-M2055 CarbonylContact O-C 3.56Å; D2044-M2055 VanDerWaalsContact O-CA 3.29Å; D2044-M2055 WeakPolarHBondContact O-CA 3.36Å; L2053-M2055 HydrophobicContact CD1-CE 4.3Å; L2053-M2055 HydrophobicContact CD2-CE 3.49Å; L2053-M2055 VanDerWaalsContact CD2-CE 3.49Å; L2053-M2055 HydrophobicContact CG-CE 3.75Å; M2055-V2069 HydrophobicContact SD-CG2 4.18Å
2056	S	91	Very high	86.1	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	119.3	168.5	155.2	0	0	0	0	109.9	N1907 D2044 H2058	N1907-S2056 WeakPolarHBondContact OD1-CA 3.35Å; N1907-S2056 WeakPolarHBondContact OD1-CB 3.45Å; D2044-S2056 PolarHBondContact N-O 3.17Å; D2044-S2056 PolarHBondContact O-N 2.92Å; S2056-H2058 VanDerWaalsContact C-N 3.33Å; S2056-H2058 PolarHBondContact O-CD2 3.31Å; S2056-H2058 VanDerWaalsContact O-CD2 3.25Å; S2056-H2058 PolarHBondContact O-N 2.85Å; S2056-H2058 PolarHBondContact OG-CE1 2.9Å; S2056-H2058 PolarHBondContact OG-NE2 3.17Å
2057	T	88.9	Confident	85.7	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.006	13%	0.13	C	C	.	.			trans	-81.6	-7.4	-176.1	64.8	0	0	0	0	114.3	V1906 V1908 R2059 A2065 R2068 V2069	V1906-T2057 WeakPolarHBondContact O-CB 3.32Å; V1906-T2057 WeakPolarHBondContact O-CG2 3.47Å; V1906-T2057 PolarHBondContact O-N 3.49Å; V1906-T2057 PolarHBondContact O-OG1 2.87Å; V1908-T2057 HydrophobicContact CG2-CG2 3.88Å; T2057-R2059 PolarHBondContact O-N 3.2Å; T2057-R2059 PolarHBondContact OG1-N 3.47Å; T2057-A2065 HydrophobicContact CG2-CB 4.11Å; T2057-A2065 WeakPolarHBondContact OG1-CB 3.38Å; T2057-R2068 WeakPolarHBondContact O-CD 3.3Å; T2057-R2068 PolarHBondContact O-NH1 2.88Å; T2057-V2069 HydrophobicContact CG2-CG2 3.9Å
2058	H	85.5	Confident	85.3	Confident	51 Å²	51	28.3 Å²	28.3	24%	0.236	14%	0.138	C	C	.	.	S	Bend	trans	48.5	39.6	-170.3	-50	-89.2	0	0	0	113.1	Y1905 H2042 D2044 S2056	Y1905-H2058 AromaticContact CD2-ND1 3.74Å; Y1905-H2058 AromaticContact CE2-ND1 3.49Å; Y1905-H2058 WeakPolarHBondContact CE2-ND1 3.46Å; H2042-H2058 PolarHBondContact O-CD2 2.86Å; H2042-H2058 VanDerWaalsContact O-CD2 3.27Å; D2044-H2058 PolarHBondContact N-NE2 3.21Å; D2044-H2058 IonicContact OD2-CE1 3.63Å; D2044-H2058 PolarHBondContact OD2-CE1 3.14Å; D2044-H2058 IonicContact OD2-NE2 3.8Å; S2056-H2058 VanDerWaalsContact C-N 3.33Å; S2056-H2058 PolarHBondContact O-CD2 3.31Å; S2056-H2058 VanDerWaalsContact O-CD2 3.25Å; S2056-H2058 PolarHBondContact O-N 2.85Å; S2056-H2058 PolarHBondContact OG-CE1 2.9Å; S2056-H2058 PolarHBondContact OG-NE2 3.17Å
2059	R	85	Confident	85.2	Confident	104 Å²	104	28.8 Å²	28.8	39%	0.392	14%	0.141	S	C	.	.			trans	-129.3	143.8	172.1	-63.6	-61.2	-175.8	-129.6	8.6	109	V1906 T2057 E2064 A2065	V1906-R2059 PolarHBondContact N-O 2.88Å; T2057-R2059 PolarHBondContact O-N 3.2Å; T2057-R2059 PolarHBondContact OG1-N 3.47Å; R2059-E2064 HydrophobicContact CB-CB 4.03Å; R2059-E2064 WeakPolarHBondContact CD-OE2 3.43Å; R2059-E2064 HydrophobicContact CG-CB 3.99Å; R2059-A2065 HydrophobicContact CB-CB 3.96Å
2060	I	83.2	Confident	84.9	Confident	23 Å²	23	33.6 Å²	33.6	12%	0.118	17%	0.167	C	C	.	.	S	Bend	trans	-97.1	-38.3	-175.4	-59	170.6	0	0	0	110.4	Y1905 V1906 W2124 A2239 T2240	Y1905-I2060 HydrophobicContact CD1-CG1 4.35Å; V1906-I2060 WeakPolarHBondContact CG2-O 3.4Å; I2060-W2124 HydrophobicContact CG2-CE3 3.92Å; I2060-W2124 HydrophobicContact CG2-CH2 3.59Å; I2060-W2124 HydrophobicContact CG2-CZ3 3.22Å; I2060-A2239 HydrophobicContact CD1-CB 4.44Å; I2060-T2240 HydrophobicContact CD1-CG2 4.46Å
2061	E	79.5	Confident	84.8	Confident	57 Å²	57	39.6 Å²	39.6	27%	0.266	19%	0.19	S	C	.	.	S	Bend	trans	-85.7	133.5	175	-59.1	-170.4	170.7	0	0	110.7	E2064 A2065 H2196	E2061-E2064 HydrophobicContact CB-CG 4.49Å; E2061-E2064 PolarHBondContact O-N 3.38Å; E2061-A2065 PolarHBondContact O-N 3.22Å; E2061-A2065 VanDerWaalsContact O-N 3.15Å; E2061-H2196 IonicContact OE1-CE1 3.99Å; E2061-H2196 PolarHBondContact OE1-CE1 3.16Å
2062	L	83.5	Confident	84.8	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.7	-38.1	-178.1	179.7	63.1	0	0	0	113.6	V1906 A2065 L2066 A2111 L2116	V1906-L2062 HydrophobicContact CG1-CD1 3.77Å; L2062-A2065 WeakPolarHBondContact O-CB 3.33Å; L2062-A2065 PolarHBondContact O-N 2.62Å; L2062-L2066 HydrophobicContact CD1-CD1 4.03Å; L2062-L2066 HydrophobicContact CD1-CD2 4.41Å; L2062-L2066 HydrophobicContact CD1-CG 3.96Å; L2062-L2066 HydrophobicContact CG-CD1 3.95Å; L2062-L2066 HydrophobicContact CG-CG 4.32Å; L2062-L2066 WeakPolarHBondContact O-CG 3.08Å; L2062-L2066 PolarHBondContact O-N 3.25Å; L2062-A2111 HydrophobicContact CD1-CB 4.12Å; L2062-A2111 HydrophobicContact CD2-CB 4.12Å; L2062-L2116 HydrophobicContact CB-CD2 4.31Å; L2062-L2116 HydrophobicContact CD2-CD1 4.03Å; L2062-L2116 HydrophobicContact CD2-CD2 4.15Å; L2062-L2116 HydrophobicContact CD2-CG 4.09Å; L2062-L2116 HydrophobicContact CG-CD1 4.15Å; L2062-L2116 HydrophobicContact CG-CD2 4.46Å
2063	P	82.1	Confident	84.5	Confident	37 Å²	37	38 Å²	38	24%	0.24	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-41.1	174.4	-24.2	35.8	0	0	0	114.1	A2065 A2067 L2116 G2119	P2063-A2065 VanDerWaalsContact C-N 3.25Å; P2063-A2065 PolarHBondContact O-N 2.86Å; P2063-A2067 VanDerWaalsContact O-CB 3.31Å; P2063-A2067 WeakPolarHBondContact O-CB 3.29Å; P2063-A2067 PolarHBondContact O-N 2.98Å; P2063-A2067 VanDerWaalsContact O-N 3.08Å; P2063-L2116 HydrophobicContact CG-CD1 4.22Å; P2063-L2116 HydrophobicContact CG-CD2 3.77Å; P2063-G2119 WeakPolarHBondContact CG-O 3.31Å
2064	E	82.3	Confident	84	Confident	69 Å²	69	44 Å²	44	32%	0.322	21%	0.213	S	C	.	.	H	α-helix	trans	-64.4	-33.5	175.6	-71	-167.1	160.7	0	0	111.2	R2059 E2061 R2068 K2236	R2059-E2064 HydrophobicContact CB-CB 4.03Å; R2059-E2064 WeakPolarHBondContact CD-OE2 3.43Å; R2059-E2064 HydrophobicContact CG-CB 3.99Å; E2061-E2064 HydrophobicContact CB-CG 4.49Å; E2061-E2064 PolarHBondContact O-N 3.38Å; E2064-R2068 PolarHBondContact O-N 3.31Å; E2064-K2236 IonicContact OE1-NZ 2.7Å; E2064-K2236 PolarHBondContact OE1-NZ 3.36Å; E2064-K2236 IonicContact OE2-NZ 3.86Å
2065	A	85.8	Confident	83.3	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-70.3	-51.9	178.3	0	0	0	0	0	112.5	V1906 T2057 R2059 E2061 L2062 P2063 R2068 V2069	V1906-A2065 HydrophobicContact CB-CB 3.59Å; V1906-A2065 HydrophobicContact CG1-CB 3.52Å; V1906-A2065 HydrophobicContact CG2-CB 4.17Å; T2057-A2065 HydrophobicContact CG2-CB 4.11Å; T2057-A2065 WeakPolarHBondContact OG1-CB 3.38Å; R2059-A2065 HydrophobicContact CB-CB 3.96Å; E2061-A2065 PolarHBondContact O-N 3.22Å; E2061-A2065 VanDerWaalsContact O-N 3.15Å; L2062-A2065 WeakPolarHBondContact O-CB 3.33Å; L2062-A2065 PolarHBondContact O-N 2.62Å; P2063-A2065 VanDerWaalsContact C-N 3.25Å; P2063-A2065 PolarHBondContact O-N 2.86Å; A2065-R2068 WeakPolarHBondContact O-CB 3.02Å; A2065-R2068 PolarHBondContact O-N 2.88Å; A2065-V2069 PolarHBondContact O-N 2.95Å
2066	L	86.2	Confident	82.6	Confident	32 Å²	32	45.7 Å²	45.7	17%	0.168	22%	0.222	C	C	.	.	H	α-helix	trans	-61.8	-45.6	179.5	-67.9	172.3	0	0	0	111.2	L2062 R2068 V2069 D2070 Y2091 V2113 L2116	L2062-L2066 HydrophobicContact CD1-CD1 4.03Å; L2062-L2066 HydrophobicContact CD1-CD2 4.41Å; L2062-L2066 HydrophobicContact CD1-CG 3.96Å; L2062-L2066 HydrophobicContact CG-CD1 3.95Å; L2062-L2066 HydrophobicContact CG-CG 4.32Å; L2062-L2066 WeakPolarHBondContact O-CG 3.08Å; L2062-L2066 PolarHBondContact O-N 3.25Å; L2066-R2068 PolarHBondContact O-N 2.93Å; L2066-V2069 WeakPolarHBondContact O-CA 3.49Å; L2066-V2069 WeakPolarHBondContact O-CB 3.41Å; L2066-V2069 PolarHBondContact O-N 2.81Å; L2066-D2070 PolarHBondContact O-N 3.38Å; L2066-Y2091 HydrophobicContact CD2-CD2 3.99Å; L2066-Y2091 HydrophobicContact CD2-CE2 3.77Å; L2066-V2113 HydrophobicContact CD1-CG2 4.33Å; L2066-L2116 HydrophobicContact CD1-CD1 4.08Å
2067	A	82.5	Confident	81.8	Confident	59 Å²	59	51.6 Å²	51.6	49%	0.488	25%	0.245	S	C	.	.	H	α-helix	trans	-59.9	-30.9	176.7	0	0	0	0	0	113.3	P2063 Y2071	P2063-A2067 VanDerWaalsContact O-CB 3.31Å; P2063-A2067 WeakPolarHBondContact O-CB 3.29Å; P2063-A2067 PolarHBondContact O-N 2.98Å; P2063-A2067 VanDerWaalsContact O-N 3.08Å; A2067-Y2071 VanDerWaalsContact O-CB 3.28Å; A2067-Y2071 WeakPolarHBondContact O-CB 3.46Å; A2067-Y2071 PolarHBondContact O-N 3.09Å; A2067-Y2071 VanDerWaalsContact O-N 3.07Å
2068	R	83.7	Confident	80.9	Confident	56 Å²	56	55.9 Å²	55.9	21%	0.211	27%	0.271	C	S	.	.	H	α-helix	trans	-70.4	-37.4	173.6	-170.2	178	-175.4	172	0.3	112	F2041 H2042 T2057 E2064 A2065 L2066 F2072	F2041-R2068 PolarHBondContact O-NH2 3.42Å; H2042-R2068 PolarHBondContact O-NH2 2.72Å; T2057-R2068 WeakPolarHBondContact O-CD 3.3Å; T2057-R2068 PolarHBondContact O-NH1 2.88Å; E2064-R2068 PolarHBondContact O-N 3.31Å; A2065-R2068 WeakPolarHBondContact O-CB 3.02Å; A2065-R2068 PolarHBondContact O-N 2.88Å; L2066-R2068 PolarHBondContact O-N 2.93Å; R2068-F2072 WeakPolarHBondContact O-CB 3.43Å; R2068-F2072 PolarHBondContact O-N 2.85Å
2069	V	84.4	Confident	80	Confident	10 Å²	10	59 Å²	59	6%	0.061	28%	0.28	C	S	.	.	H	α-helix	trans	-72	-40.6	177.2	173	0	0	0	0	111.7	V1908 L1910 M2055 T2057 A2065 L2066 F2072 T2073	V1908-V2069 HydrophobicContact CB-CG2 4.42Å; V1908-V2069 HydrophobicContact CG2-CG2 4.21Å; L1910-V2069 HydrophobicContact CD1-CG1 4.04Å; L1910-V2069 HydrophobicContact CD2-CG1 4.04Å; M2055-V2069 HydrophobicContact SD-CG2 4.18Å; T2057-V2069 HydrophobicContact CG2-CG2 3.9Å; A2065-V2069 PolarHBondContact O-N 2.95Å; L2066-V2069 WeakPolarHBondContact O-CA 3.49Å; L2066-V2069 WeakPolarHBondContact O-CB 3.41Å; L2066-V2069 PolarHBondContact O-N 2.81Å; V2069-F2072 PolarHBondContact O-N 2.89Å; V2069-T2073 WeakPolarHBondContact O-CB 3.22Å; V2069-T2073 PolarHBondContact O-N 3.42Å; V2069-T2073 PolarHBondContact O-OG1 2.83Å
2070	D	81.9	Confident	78.4	Confident	111 Å²	111	63.2 Å²	63.2	59%	0.594	31%	0.305	S	S	*	.	H	α-helix	trans	-63	-47.7	174.3	-72.7	-31.8	0	0	0	111.2	L2066 F2072 T2073 Q2074	L2066-D2070 PolarHBondContact O-N 3.38Å; D2070-F2072 VanDerWaalsContact C-N 3.33Å; D2070-F2072 PolarHBondContact O-N 3.15Å; D2070-T2073 PolarHBondContact O-N 3.21Å; D2070-Q2074 WeakPolarHBondContact O-CB 3.37Å; D2070-Q2074 PolarHBondContact O-N 3.2Å
2071	Y	80.3	Confident	77.3	Confident	148 Å²	148	65.2 Å²	65.2	58%	0.58	33%	0.331	S	S	*	.	H	α-helix	trans	-58	-44.4	174.9	175.9	-101.2	0	0	0	112	A2067 Q2074 L2075	A2067-Y2071 VanDerWaalsContact O-CB 3.28Å; A2067-Y2071 WeakPolarHBondContact O-CB 3.46Å; A2067-Y2071 PolarHBondContact O-N 3.09Å; A2067-Y2071 VanDerWaalsContact O-N 3.07Å; Y2071-Q2074 PolarHBondContact O-N 2.86Å; Y2071-L2075 WeakPolarHBondContact O-CB 3.37Å; Y2071-L2075 PolarHBondContact O-N 2.82Å
2072	F	79.4	Confident	76.5	Confident	15 Å²	15	63.3 Å²	63.3	7%	0.066	32%	0.323	C	S	.	.	H	α-helix	trans	-61.7	-46	175.5	168.3	-100.5	0	0	0	112.4	I2038 F2041 R2068 V2069 D2070 Q2074 L2075 L2076	I2038-F2072 HydrophobicContact CB-CZ 4.41Å; I2038-F2072 HydrophobicContact CD1-CZ 4.31Å; I2038-F2072 HydrophobicContact CG1-CE1 4.14Å; I2038-F2072 HydrophobicContact CG1-CE2 3.96Å; I2038-F2072 HydrophobicContact CG1-CZ 3.36Å; F2041-F2072 AromaticContact CD2-CD2 3.8Å; F2041-F2072 HydrophobicContact CD2-CD2 3.8Å; F2041-F2072 AromaticContact CD2-CE2 3.75Å; F2041-F2072 HydrophobicContact CD2-CE2 3.75Å; F2041-F2072 HydrophobicContact CE2-CD2 4.23Å; F2041-F2072 HydrophobicContact CE2-CE2 4.07Å; F2041-F2072 HydrophobicContact CG-CD2 4.34Å; R2068-F2072 WeakPolarHBondContact O-CB 3.43Å; R2068-F2072 PolarHBondContact O-N 2.85Å; V2069-F2072 PolarHBondContact O-N 2.89Å; D2070-F2072 VanDerWaalsContact C-N 3.33Å; D2070-F2072 PolarHBondContact O-N 3.15Å; F2072-Q2074 VanDerWaalsContact C-N 3.32Å; F2072-Q2074 PolarHBondContact O-N 2.66Å; F2072-L2075 WeakPolarHBondContact O-CB 3.37Å; F2072-L2075 PolarHBondContact O-N 2.82Å; F2072-L2075 VanDerWaalsContact O-N 3.12Å; F2072-L2076 HydrophobicContact CD1-CD1 4.32Å; F2072-L2076 HydrophobicContact CE1-CD1 3.47Å; F2072-L2076 VanDerWaalsContact CE1-CD1 3.47Å; F2072-L2076 HydrophobicContact CE1-CG 4.02Å; F2072-L2076 HydrophobicContact CE2-CD1 4.23Å; F2072-L2076 HydrophobicContact CE2-CD2 4.07Å; F2072-L2076 HydrophobicContact CE2-CG 3.94Å; F2072-L2076 HydrophobicContact CZ-CD1 3.4Å; F2072-L2076 HydrophobicContact CZ-CD2 3.9Å; F2072-L2076 HydrophobicContact CZ-CG 3.62Å; F2072-L2076 PolarHBondContact O-N 2.7Å
2073	T	79.6	Confident	76	Confident	15 Å²	15	63.8 Å²	63.8	9%	0.092	33%	0.326	C	S	.	.	H	α-helix	trans	-63.7	-39.3	178.8	-57.1	0	0	0	0	111.3	V2069 D2070 R2077 L2089	V2069-T2073 WeakPolarHBondContact O-CB 3.22Å; V2069-T2073 PolarHBondContact O-N 3.42Å; V2069-T2073 PolarHBondContact O-OG1 2.83Å; D2070-T2073 PolarHBondContact O-N 3.21Å; T2073-R2077 WeakPolarHBondContact O-CG 3.48Å; T2073-R2077 PolarHBondContact O-N 3.33Å; T2073-L2089 HydrophobicContact CG2-CB 4.14Å; T2073-L2089 HydrophobicContact CG2-CD1 4.47Å
2074	Q	78	Confident	76	Confident	127 Å²	127	62.2 Å²	62.2	59%	0.593	32%	0.315	S	S	*	.	H	α-helix	trans	-67.1	-37.5	173	-166	173.4	29.1	0	0	111.8	D2070 Y2071 F2072 R2077 T2078	D2070-Q2074 WeakPolarHBondContact O-CB 3.37Å; D2070-Q2074 PolarHBondContact O-N 3.2Å; Y2071-Q2074 PolarHBondContact O-N 2.86Å; F2072-Q2074 VanDerWaalsContact C-N 3.32Å; F2072-Q2074 PolarHBondContact O-N 2.66Å; Q2074-R2077 PolarHBondContact O-N 2.69Å; Q2074-T2078 HydrophobicContact CG-CG2 4.24Å; Q2074-T2078 WeakPolarHBondContact O-CB 3.19Å; Q2074-T2078 VanDerWaalsContact O-CG2 3.3Å; Q2074-T2078 WeakPolarHBondContact O-CG2 3.49Å; Q2074-T2078 PolarHBondContact O-N 3.03Å; Q2074-T2078 PolarHBondContact O-OG1 3.46Å
2075	L	76.5	Confident	75.6	Confident	35 Å²	35	61.9 Å²	61.9	18%	0.183	32%	0.318	C	S	.	.	H	α-helix	trans	-66.6	-43.7	177.8	-163.2	83.3	0	0	0	112.1	F2041 Y2071 F2072 R2077 T2078 R2079	F2041-L2075 HydrophobicContact CD1-CD2 4.4Å; F2041-L2075 HydrophobicContact CE1-CD2 3.38Å; F2041-L2075 HydrophobicContact CE2-CD2 4.16Å; F2041-L2075 HydrophobicContact CZ-CD2 3.24Å; Y2071-L2075 WeakPolarHBondContact O-CB 3.37Å; Y2071-L2075 PolarHBondContact O-N 2.82Å; F2072-L2075 WeakPolarHBondContact O-CB 3.37Å; F2072-L2075 PolarHBondContact O-N 2.82Å; F2072-L2075 VanDerWaalsContact O-N 3.12Å; L2075-R2077 PolarHBondContact O-N 2.71Å; L2075-T2078 PolarHBondContact O-N 3.19Å; L2075-R2079 HydrophobicContact CG-CB 4.47Å; L2075-R2079 WeakPolarHBondContact O-CB 3.36Å; L2075-R2079 PolarHBondContact O-N 2.89Å
2076	L	76.2	Confident	75.1	Confident	10 Å²	10	65.8 Å²	65.8	5%	0.052	34%	0.336	C	S	.	.	H	α-helix	trans	-55.8	-39	173.7	-76.2	-178.6	0	0	0	112.2	L2034 F2072 T2082 F2084 L2089	L2034-L2076 HydrophobicContact CD1-CD1 3.93Å; L2034-L2076 HydrophobicContact CD1-CD2 4Å; F2072-L2076 HydrophobicContact CD1-CD1 4.32Å; F2072-L2076 HydrophobicContact CE1-CD1 3.47Å; F2072-L2076 VanDerWaalsContact CE1-CD1 3.47Å; F2072-L2076 HydrophobicContact CE1-CG 4.02Å; F2072-L2076 HydrophobicContact CE2-CD1 4.23Å; F2072-L2076 HydrophobicContact CE2-CD2 4.07Å; F2072-L2076 HydrophobicContact CE2-CG 3.94Å; F2072-L2076 HydrophobicContact CZ-CD1 3.4Å; F2072-L2076 HydrophobicContact CZ-CD2 3.9Å; F2072-L2076 HydrophobicContact CZ-CG 3.62Å; F2072-L2076 PolarHBondContact O-N 2.7Å; L2076-T2082 PolarHBondContact O-OG1 2.81Å; L2076-F2084 HydrophobicContact CD2-CD2 3.82Å; L2076-F2084 HydrophobicContact CD2-CE2 4.46Å; L2076-F2084 HydrophobicContact CD2-CG 4.47Å; L2076-L2089 HydrophobicContact CD1-CD1 3.43Å; L2076-L2089 VanDerWaalsContact CD1-CD1 3.43Å
2077	R	73	Confident	74.8	Confident	124 Å²	124	64.7 Å²	64.7	47%	0.468	33%	0.33	S	S	.	.	H	α-helix	trans	-79.1	-26.6	-179.6	-70	171.9	173.1	170.5	-2.1	113.9	T2073 Q2074 L2075 D2088	T2073-R2077 WeakPolarHBondContact O-CG 3.48Å; T2073-R2077 PolarHBondContact O-N 3.33Å; Q2074-R2077 PolarHBondContact O-N 2.69Å; L2075-R2077 PolarHBondContact O-N 2.71Å; R2077-D2088 IonicContact CZ-OD1 3.57Å; R2077-D2088 IonicContact NH2-OD1 3.82Å; R2077-D2088 PolarHBondContact NH2-OD1 3.44Å
2078	T	69.9	Low	74.5	Confident	90 Å²	90	63.8 Å²	63.8	55%	0.552	32%	0.317	S	S	*	.	H	α-helix	trans	-106.7	-26.4	-171.1	54	0	0	0	0	115.3	Q2074 L2075 Q2080	Q2074-T2078 HydrophobicContact CG-CG2 4.24Å; Q2074-T2078 WeakPolarHBondContact O-CB 3.19Å; Q2074-T2078 VanDerWaalsContact O-CG2 3.3Å; Q2074-T2078 WeakPolarHBondContact O-CG2 3.49Å; Q2074-T2078 PolarHBondContact O-N 3.03Å; Q2074-T2078 PolarHBondContact O-OG1 3.46Å; L2075-T2078 PolarHBondContact O-N 3.19Å; T2078-Q2080 PolarHBondContact O-N 2.95Å
2079	R	67.2	Low	74.3	Confident	116 Å²	116	62 Å²	62	44%	0.438	31%	0.312	S	S	.	.	S	Bend	trans	-67.6	113.9	-175.4	-173.6	-179	-171.6	-159.9	2.4	110.4	E2037 L2075 G2081 T2082	E2037-R2079 IonicContact OE2-CZ 3.81Å; E2037-R2079 IonicContact OE2-NH1 2.99Å; E2037-R2079 PolarHBondContact OE2-NH1 2.76Å; L2075-R2079 HydrophobicContact CG-CB 4.47Å; L2075-R2079 WeakPolarHBondContact O-CB 3.36Å; L2075-R2079 PolarHBondContact O-N 2.89Å; R2079-G2081 PolarHBondContact O-N 2.99Å; R2079-T2082 HydrophobicContact CB-CG2 3.78Å; R2079-T2082 HydrophobicContact CG-CG2 4.14Å; R2079-T2082 WeakPolarHBondContact O-CB 3.21Å; R2079-T2082 VanDerWaalsContact O-CG2 3.26Å; R2079-T2082 WeakPolarHBondContact O-CG2 3.43Å; R2079-T2082 PolarHBondContact O-N 2.8Å; R2079-T2082 PolarHBondContact O-OG1 3.2Å
2080	Q	52.2	Low	74.2	Confident	193 Å²	193	65.9 Å²	65.9	90%	0.902	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	134	-176.3	-66.1	-174.9	-1.6	0	0	111.4	T2078	T2078-Q2080 PolarHBondContact O-N 2.95Å
2081	G	58.3	Low	74.2	Confident	66 Å²	66	64.9 Å²	64.9	68%	0.68	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	-3.4	-178	0	0	0	0	0	115.5	R2079	R2079-G2081 PolarHBondContact O-N 2.99Å
2082	T	63.6	Low	74.4	Confident	16 Å²	16	61 Å²	61	10%	0.098	31%	0.31	C	S	.	.			trans	-61.9	158.5	175.6	45.6	0	0	0	0	113.8	L2076 R2079	L2076-T2082 PolarHBondContact O-OG1 2.81Å; R2079-T2082 HydrophobicContact CB-CG2 3.78Å; R2079-T2082 HydrophobicContact CG-CG2 4.14Å; R2079-T2082 WeakPolarHBondContact O-CB 3.21Å; R2079-T2082 VanDerWaalsContact O-CG2 3.26Å; R2079-T2082 WeakPolarHBondContact O-CG2 3.43Å; R2079-T2082 PolarHBondContact O-N 2.8Å; R2079-T2082 PolarHBondContact O-OG1 3.2Å
2083	L	73.7	Confident	74.8	Confident	10 Å²	10	61.5 Å²	61.5	5%	0.052	31%	0.314	C	S	.	.	S	Bend	trans	-97.8	3.9	-176.7	-62.6	168.4	0	0	0	112.9	N1918 I1922 R1925 L1929 K2033	N1918-L2083 PolarHBondContact ND2-O 2.93Å; N1918-L2083 PolarHBondContact OD1-O 3.06Å; I1922-L2083 HydrophobicContact CD1-CB 3.71Å; I1922-L2083 HydrophobicContact CD1-CD2 3.74Å; I1922-L2083 HydrophobicContact CD1-CG 4.27Å; I1922-L2083 WeakPolarHBondContact CD1-O 2.82Å; R1925-L2083 HydrophobicContact CB-CD2 4.41Å; L1929-L2083 HydrophobicContact CD1-CD1 3.39Å; L1929-L2083 HydrophobicContact CD1-CD2 3.97Å; L1929-L2083 HydrophobicContact CD1-CG 4.32Å; L1929-L2083 HydrophobicContact CD2-CD1 3.86Å; L1929-L2083 HydrophobicContact CD2-CD2 4.27Å; L1929-L2083 HydrophobicContact CG-CD1 4.26Å; K2033-L2083 HydrophobicContact CB-CD1 4.36Å; K2033-L2083 HydrophobicContact CG-CD1 3.66Å
2084	F	81.1	Confident	75.3	Confident	5 Å²	5	60.8 Å²	60.8	2%	0.022	31%	0.309	C	S	.	.			trans	-127.8	14.3	-160.3	-44.4	-63.7	0	0	0	113	V2030 K2033 L2034 E2037 L2076 H2086 L2087	V2030-F2084 HydrophobicContact CG1-CD1 4.15Å; V2030-F2084 HydrophobicContact CG1-CE1 3.85Å; V2030-F2084 WeakPolarHBondContact O-CE1 3.44Å; K2033-F2084 HydrophobicContact CB-CZ 4.48Å; K2033-F2084 HydrophobicContact CG-CZ 4.28Å; L2034-F2084 VanDerWaalsContact CA-CZ 3.5Å; L2034-F2084 HydrophobicContact CB-CD1 4.19Å; L2034-F2084 HydrophobicContact CB-CE1 3.62Å; L2034-F2084 HydrophobicContact CB-CZ 3.88Å; L2034-F2084 HydrophobicContact CD1-CD1 4Å; L2034-F2084 HydrophobicContact CD1-CD2 4.13Å; L2034-F2084 HydrophobicContact CD1-CE1 4.14Å; L2034-F2084 HydrophobicContact CD1-CE2 4.26Å; L2034-F2084 HydrophobicContact CD1-CG 4Å; L2034-F2084 HydrophobicContact CD1-CZ 4.26Å; L2034-F2084 HydrophobicContact CG-CE1 4.43Å; E2037-F2084 HydrophobicContact CG-CE2 4.21Å; L2076-F2084 HydrophobicContact CD2-CD2 3.82Å; L2076-F2084 HydrophobicContact CD2-CE2 4.46Å; L2076-F2084 HydrophobicContact CD2-CG 4.47Å; F2084-H2086 PolarHBondContact O-N 2.69Å; F2084-L2087 HydrophobicContact CB-CB 4.24Å; F2084-L2087 WeakPolarHBondContact O-CB 3.36Å; F2084-L2087 PolarHBondContact O-N 2.95Å
2085	T	73.4	Confident	75.9	Confident	61 Å²	61	54.9 Å²	54.9	37%	0.374	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-14.3	-175	53.3	0	0	0	0	114.4
2086	H	75.5	Confident	76.4	Confident	83 Å²	83	53.6 Å²	53.6	38%	0.384	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	11.9	175.9	-49.5	-71.4	0	0	0	112.7	N1918 I1921 F2084	N1918-H2086 HydrophobicContact CB-CB 4.01Å; N1918-H2086 WeakPolarHBondContact OD1-CB 2.95Å; N1918-H2086 PolarHBondContact OD1-N 3.26Å; N1918-H2086 VanDerWaalsContact OD1-N 3.07Å; I1921-H2086 HydrophobicContact CD1-CB 4.04Å; F2084-H2086 PolarHBondContact O-N 2.69Å
2087	L	80	Confident	77	Confident	8 Å²	8	53.4 Å²	53.4	4%	0.042	27%	0.273	C	S	.	.			trans	-82.4	131.9	167.1	-167.1	88.4	0	0	0	108.2	F1912 L1915 L2034 F2084 L2089	F1912-L2087 HydrophobicContact CB-CD1 4.43Å; F1912-L2087 HydrophobicContact CB-CD2 4.47Å; F1912-L2087 HydrophobicContact CB-CG 4.36Å; L1915-L2087 HydrophobicContact CB-CD1 4.17Å; L1915-L2087 HydrophobicContact CD1-CD1 4.02Å; L2034-L2087 HydrophobicContact CD1-CD2 4.31Å; L2034-L2087 HydrophobicContact CD2-CD2 3.59Å; F2084-L2087 HydrophobicContact CB-CB 4.24Å; F2084-L2087 WeakPolarHBondContact O-CB 3.36Å; F2084-L2087 PolarHBondContact O-N 2.95Å; L2087-L2089 HydrophobicContact CD2-CD1 4.15Å; L2087-L2089 HydrophobicContact CD2-CG 4.13Å
2088	D	76.3	Confident	77.9	Confident	40 Å²	40	47.5 Å²	47.5	21%	0.214	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	149.1	169.3	-167.2	35.4	0	0	0	110.8	F1912 T1913 R2077 Q2090	F1912-D2088 WeakPolarHBondContact CA-O 3.1Å; F1912-D2088 WeakPolarHBondContact CB-O 3.32Å; T1913-D2088 PolarHBondContact N-O 2.93Å; R2077-D2088 IonicContact CZ-OD1 3.57Å; R2077-D2088 IonicContact NH2-OD1 3.82Å; R2077-D2088 PolarHBondContact NH2-OD1 3.44Å; D2088-Q2090 PolarHBondContact OD2-NE2 2.74Å
2089	L	80.4	Confident	78.9	Confident	18 Å²	18	43.3 Å²	43.3	9%	0.094	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	122.6	-175.4	-81.5	160.5	0	0	0	108.7	L1910 E1911 F1912 T2073 L2076 L2087	L1910-L2089 HydrophobicContact CB-CD2 4.23Å; L1910-L2089 HydrophobicContact CD1-CD2 4.11Å; E1911-L2089 WeakPolarHBondContact O-CA 3.33Å; F1912-L2089 HydrophobicContact CB-CD2 3.91Å; F1912-L2089 HydrophobicContact CB-CG 4.41Å; F1912-L2089 HydrophobicContact CD1-CD2 3.91Å; F1912-L2089 HydrophobicContact CG-CD2 4.32Å; T2073-L2089 HydrophobicContact CG2-CB 4.14Å; T2073-L2089 HydrophobicContact CG2-CD1 4.47Å; L2076-L2089 HydrophobicContact CD1-CD1 3.43Å; L2076-L2089 VanDerWaalsContact CD1-CD1 3.43Å; L2087-L2089 HydrophobicContact CD2-CD1 4.15Å; L2087-L2089 HydrophobicContact CD2-CG 4.13Å
2090	Q	81.5	Confident	80.1	Confident	92 Å²	92	38 Å²	38	43%	0.43	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137.5	-173.2	-57.8	-172.9	11	0	0	110.5	L1910 E1911 D2088	L1910-Q2090 CarbonylContact C-O 3.59Å; L1910-Q2090 VanDerWaalsContact CA-O 3.25Å; L1910-Q2090 WeakPolarHBondContact CA-O 3.19Å; E1911-Q2090 PolarHBondContact N-O 2.8Å; E1911-Q2090 PolarHBondContact O-N 3.41Å; D2088-Q2090 PolarHBondContact OD2-NE2 2.74Å
2091	Y	82.4	Confident	81.9	Confident	90 Å²	90	29.7 Å²	29.7	35%	0.353	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	132	177.9	171.4	-85.7	0	0	0	111.3	V1908 L2066 T2093 S2094 V2113	V1908-Y2091 HydrophobicContact CG1-CD2 3.67Å; V1908-Y2091 HydrophobicContact CG1-CE2 3.89Å; L2066-Y2091 HydrophobicContact CD2-CD2 3.99Å; L2066-Y2091 HydrophobicContact CD2-CE2 3.77Å; Y2091-T2093 VanDerWaalsContact OH-C 3.31Å; Y2091-S2094 PolarHBondContact OH-N 3.12Å; Y2091-S2094 PolarHBondContact OH-OG 3.18Å; Y2091-V2113 HydrophobicContact CE1-CG2 3.97Å
2092	V	84.1	Confident	83.2	Confident	68 Å²	68	27 Å²	27	41%	0.412	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	-56.3	177.4	-177.4	0	0	0	0	111.2	E1909 E1911	E1909-V2092 HydrophobicContact CB-CB 4.29Å; E1909-V2092 HydrophobicContact CG-CB 4.06Å; E1909-V2092 HydrophobicContact CG-CG2 4.34Å; E1909-V2092 PolarHBondContact O-N 3.27Å; E1911-V2092 HydrophobicContact CB-CG2 3.74Å
2093	T	88	Confident	84.1	Confident	25 Å²	25	28.2 Å²	28.2	15%	0.153	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	171.5	-177	-171.7	0	0	0	0	110.8	E1909 Y2091 W2095	E1909-T2093 HydrophobicContact CB-CG2 3.94Å; E1909-T2093 PolarHBondContact N-O 2.82Å; Y2091-T2093 VanDerWaalsContact OH-C 3.31Å; T2093-W2095 HydrophobicContact CG2-CH2 3.45Å; T2093-W2095 VanDerWaalsContact CG2-CH2 3.45Å; T2093-W2095 HydrophobicContact CG2-CZ2 3.57Å; T2093-W2095 HydrophobicContact CG2-CZ3 4.01Å
2094	S	89.3	Confident	84.5	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	158.4	171.6	56.2	0	0	0	0	112.8	N1907 Y2091 A2111	N1907-S2094 CarbonylContact O-C 3.45Å; N1907-S2094 WeakPolarHBondContact O-CA 3.36Å; N1907-S2094 WeakPolarHBondContact O-CB 3.39Å; Y2091-S2094 PolarHBondContact OH-N 3.12Å; Y2091-S2094 PolarHBondContact OH-OG 3.18Å; S2094-A2111 PolarHBondContact O-N 3.5Å; S2094-A2111 PolarHBondContact OG-O 3.08Å
2095	W	92.3	Very high	84.8	Confident	3 Å²	3	28 Å²	28	1%	0.011	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	129.6	179.4	-51.7	-96.6	0	0	0	110	V1906 N1907 E1909 I2054 T2093 Q2097 L2098 Y2106 V2109 D2158	V1906-W2095 WeakPolarHBondContact CA-O 3.42Å; N1907-W2095 HydrophobicContact CB-CE3 4.33Å; N1907-W2095 PolarHBondContact N-O 3Å; N1907-W2095 PolarHBondContact ND2-O 3.27Å; N1907-W2095 PolarHBondContact O-N 2.99Å; E1909-W2095 HydrophobicContact CB-CH2 3.94Å; E1909-W2095 HydrophobicContact CB-CZ3 3.9Å; I2054-W2095 HydrophobicContact CD1-CH2 4.3Å; I2054-W2095 HydrophobicContact CD1-CZ3 4.44Å; I2054-W2095 HydrophobicContact CG2-CZ3 4.03Å; T2093-W2095 HydrophobicContact CG2-CH2 3.45Å; T2093-W2095 VanDerWaalsContact CG2-CH2 3.45Å; T2093-W2095 HydrophobicContact CG2-CZ2 3.57Å; T2093-W2095 HydrophobicContact CG2-CZ3 4.01Å; W2095-Q2097 PolarHBondContact O-N 2.74Å; W2095-L2098 HydrophobicContact CB-CB 4.35Å; W2095-L2098 HydrophobicContact CD2-CD1 4.12Å; W2095-L2098 HydrophobicContact CE3-CD1 4.5Å; W2095-L2098 HydrophobicContact CE3-CD2 4.14Å; W2095-L2098 HydrophobicContact CG-CD1 4.15Å; W2095-L2098 HydrophobicContact CZ3-CD2 4.49Å; W2095-Y2106 HydrophobicContact CZ2-CE2 4.28Å; W2095-V2109 CarbonylContact C-O 3.57Å; W2095-V2109 WeakPolarHBondContact CA-O 3.37Å; W2095-D2158 PolarHBondContact NE1-OD2 2.86Å
2096	R	86.9	Confident	85.7	Confident	8 Å²	8	26.1 Å²	26.1	3%	0.03	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	-24.9	179.5	-61.4	-172.4	177.1	-81.5	8.8	113.8	Y1905 V2109 A2111 D2121 E2123 W2124 Y2189	Y1905-R2096 CarbonylContact C-O 3.58Å; Y1905-R2096 VanDerWaalsContact C-O 3.25Å; Y1905-R2096 CarbonylContact O-C 3.56Å; R2096-V2109 PolarHBondContact N-O 3.36Å; R2096-A2111 HydrophobicContact CG-CB 3.65Å; R2096-D2121 IonicContact CZ-OD1 2.68Å; R2096-D2121 IonicContact CZ-OD2 2.72Å; R2096-D2121 VanDerWaalsContact CZ-OD2 3.27Å; R2096-D2121 IonicContact NH1-OD1 3.91Å; R2096-D2121 IonicContact NH1-OD2 2.65Å; R2096-D2121 PolarHBondContact NH1-OD2 2.92Å; R2096-D2121 VanDerWaalsContact NH2-CG 3.27Å; R2096-D2121 IonicContact NH2-OD1 2.67Å; R2096-D2121 PolarHBondContact NH2-OD1 2.6Å; R2096-D2121 IonicContact NH2-OD2 3.86Å; R2096-D2121 PolarHBondContact NH2-OD2 3Å; R2096-E2123 IonicContact CZ-OE2 2.75Å; R2096-E2123 IonicContact NE-OE2 3.7Å; R2096-E2123 PolarHBondContact NE-OE2 3.18Å; R2096-E2123 IonicContact NH2-OE2 3.2Å; R2096-E2123 PolarHBondContact NH2-OE2 2.97Å; R2096-W2124 VanDerWaalsContact CZ-CD1 3.42Å; R2096-Y2189 HydrophobicContact CB-CE2 3.96Å; R2096-Y2189 VanDerWaalsContact CD-CE2 3.48Å; R2096-Y2189 WeakPolarHBondContact CD-OH 3.45Å; R2096-Y2189 HydrophobicContact CG-CE2 4.39Å; R2096-Y2189 PolarHBondContact NE-OH 2.9Å
2097	Q	87.9	Confident	86.4	Confident	5 Å²	5	22.1 Å²	22.1	2%	0.023	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	134.4	174.3	175.8	175.1	11.2	0	0	106.4	Y1903 W2095 G2108 V2109 L2185	Y1903-Q2097 WeakPolarHBondContact O-CA 3.21Å; W2095-Q2097 PolarHBondContact O-N 2.74Å; Q2097-G2108 CarbonylContact O-C 3.37Å; Q2097-G2108 WeakPolarHBondContact O-CA 3.49Å; Q2097-V2109 PolarHBondContact O-N 3.05Å; Q2097-L2185 HydrophobicContact CG-CD2 4.15Å
2098	L	91.6	Very high	86.9	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	123.8	-177.6	-176.7	65.9	0	0	0	110.2	Y1903 N1907 I2046 I2054 W2095 W2100 Y2106	Y1903-L2098 PolarHBondContact N-O 2.86Å; Y1903-L2098 PolarHBondContact O-N 3.42Å; N1907-L2098 HydrophobicContact CB-CB 4.34Å; N1907-L2098 HydrophobicContact CB-CD2 4.12Å; N1907-L2098 WeakPolarHBondContact ND2-CB 3.48Å; N1907-L2098 PolarHBondContact ND2-N 2.82Å; I2046-L2098 HydrophobicContact CD1-CD2 4.26Å; I2054-L2098 HydrophobicContact CG2-CD2 4.23Å; W2095-L2098 HydrophobicContact CB-CB 4.35Å; W2095-L2098 HydrophobicContact CD2-CD1 4.12Å; W2095-L2098 HydrophobicContact CE3-CD1 4.5Å; W2095-L2098 HydrophobicContact CE3-CD2 4.14Å; W2095-L2098 HydrophobicContact CG-CD1 4.15Å; W2095-L2098 HydrophobicContact CZ3-CD2 4.49Å; L2098-W2100 HydrophobicContact CD1-CE3 4.42Å; L2098-W2100 HydrophobicContact CD2-CB 4.38Å; L2098-W2100 HydrophobicContact CD2-CE3 4Å; L2098-W2100 HydrophobicContact CG-CB 4.27Å; L2098-W2100 HydrophobicContact CG-CE3 4.44Å; L2098-Y2106 HydrophobicContact CD1-CD2 4.17Å
2099	I	91.8	Very high	87.5	Confident	3 Å²	3	19.9 Å²	19.9	2%	0.015	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	118.1	162.7	-63.3	171	0	0	0	106.3	L1902 Y2106 A2107 W2161 Y2184 L2185 V2365 L2368	L1902-I2099 HydrophobicContact CB-CG1 4.43Å; L1902-I2099 HydrophobicContact CD1-CD1 4.13Å; L1902-I2099 HydrophobicContact CD1-CG1 3.77Å; L1902-I2099 HydrophobicContact CG-CG1 3.89Å; I2099-Y2106 CarbonylContact O-C 3.25Å; I2099-Y2106 VanDerWaalsContact O-CA 3.22Å; I2099-Y2106 WeakPolarHBondContact O-CA 3.35Å; I2099-Y2106 WeakPolarHBondContact O-CB 3.28Å; I2099-A2107 PolarHBondContact N-O 3.13Å; I2099-A2107 PolarHBondContact O-N 2.94Å; I2099-W2161 HydrophobicContact CG2-CH2 3.95Å; I2099-W2161 HydrophobicContact CG2-CZ2 4.07Å; I2099-Y2184 HydrophobicContact CD1-CD1 4.02Å; I2099-Y2184 HydrophobicContact CD1-CE1 3.79Å; I2099-L2185 HydrophobicContact CD1-CD1 4.15Å; I2099-L2185 HydrophobicContact CD1-CD2 3.6Å; I2099-L2185 HydrophobicContact CD1-CG 3.75Å; I2099-L2185 HydrophobicContact CG1-CD2 3.9Å; I2099-V2365 HydrophobicContact CG2-CG1 4.31Å; I2099-L2368 HydrophobicContact CG2-CB 4.44Å; I2099-L2368 HydrophobicContact CG2-CD1 3.54Å
2100	W	92.4	Very high	87.7	Confident	5 Å²	5	21.9 Å²	21.9	2%	0.019	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	129	-175.1	-175.1	-91.2	0	0	0	110.8	N1898 P1900 G1901 Y1903 I2046 Y2047 I2054 L2098 Y2106	N1898-W2100 PolarHBondContact OD1-NE1 3.23Å; P1900-W2100 CarbonylContact C-O 3.58Å; P1900-W2100 VanDerWaalsContact CA-O 3.25Å; P1900-W2100 WeakPolarHBondContact CA-O 3.48Å; G1901-W2100 PolarHBondContact N-O 3.09Å; G1901-W2100 PolarHBondContact O-N 3.3Å; Y1903-W2100 HydrophobicContact CD2-CB 4.39Å; Y1903-W2100 HydrophobicContact CE2-CB 4.35Å; I2046-W2100 HydrophobicContact CG2-CB 3.89Å; I2046-W2100 HydrophobicContact CG2-CD2 3.98Å; I2046-W2100 HydrophobicContact CG2-CG 3.51Å; Y2047-W2100 HydrophobicContact CD1-CZ2 4.49Å; Y2047-W2100 AromaticContact CD2-CZ2 3.61Å; Y2047-W2100 HydrophobicContact CD2-CZ2 3.61Å; Y2047-W2100 HydrophobicContact CE2-CZ2 4.42Å; Y2047-W2100 HydrophobicContact CG-CH2 4.35Å; Y2047-W2100 AromaticContact CG-CZ2 3.65Å; Y2047-W2100 HydrophobicContact CG-CZ2 3.65Å; I2054-W2100 HydrophobicContact CD1-CE3 4.32Å; I2054-W2100 HydrophobicContact CD1-CH2 3.44Å; I2054-W2100 VanDerWaalsContact CD1-CH2 3.44Å; I2054-W2100 HydrophobicContact CD1-CZ2 4.17Å; I2054-W2100 HydrophobicContact CD1-CZ3 3.53Å; L2098-W2100 HydrophobicContact CD1-CE3 4.42Å; L2098-W2100 HydrophobicContact CD2-CB 4.38Å; L2098-W2100 HydrophobicContact CD2-CE3 4Å; L2098-W2100 HydrophobicContact CG-CB 4.27Å; L2098-W2100 HydrophobicContact CG-CE3 4.44Å; W2100-Y2106 HydrophobicContact CE3-CD1 4.03Å; W2100-Y2106 HydrophobicContact CE3-CD2 4.47Å; W2100-Y2106 AromaticContact CE3-CG 3.74Å; W2100-Y2106 HydrophobicContact CE3-CG 3.74Å; W2100-Y2106 HydrophobicContact CH2-CD1 4.07Å; W2100-Y2106 AromaticContact CZ3-CD1 3.48Å; W2100-Y2106 HydrophobicContact CZ3-CD1 3.48Å; W2100-Y2106 VanDerWaalsContact CZ3-CD1 3.48Å; W2100-Y2106 HydrophobicContact CZ3-CD2 4.26Å; W2100-Y2106 HydrophobicContact CZ3-CE1 4.08Å; W2100-Y2106 AromaticContact CZ3-CG 3.59Å; W2100-Y2106 HydrophobicContact CZ3-CG 3.59Å
2101	M	88.6	Confident	87.7	Confident	17 Å²	17	17.5 Å²	17.5	8%	0.084	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-48.4	171.3	-176	176.8	-80.7	0	0	111.1	N1898 N2105 W2161 L2163 V2365 L2368 W2398	N1898-M2101 PolarHBondContact ND2-O 3.15Å; M2101-N2105 WeakPolarHBondContact CA-O 3.45Å; M2101-N2105 HydrophobicContact CB-CB 3.95Å; M2101-N2105 VanDerWaalsContact CB-O 3.32Å; M2101-N2105 WeakPolarHBondContact CB-O 3.23Å; M2101-N2105 HydrophobicContact CG-CB 4.45Å; M2101-N2105 PolarHBondContact N-O 2.85Å; M2101-N2105 HydrophobicContact SD-CB 4.49Å; M2101-W2161 HydrophobicContact CB-CZ3 4.24Å; M2101-L2163 HydrophobicContact CE-CD2 4.43Å; M2101-L2163 HydrophobicContact SD-CD2 3.76Å; M2101-V2365 HydrophobicContact CE-CG2 3.66Å; M2101-L2368 HydrophobicContact CB-CD1 4.13Å; M2101-L2368 HydrophobicContact CE-CD1 4.17Å; M2101-L2368 HydrophobicContact CE-CD2 4.4Å; M2101-L2368 HydrophobicContact CE-CG 4.47Å; M2101-W2398 HydrophobicContact CE-CH2 4.18Å; M2101-W2398 HydrophobicContact CE-CZ2 4.47Å; M2101-W2398 HydrophobicContact SD-CH2 3.94Å; M2101-W2398 HydrophobicContact SD-CZ2 4.28Å
2102	D	86.9	Confident	87.4	Confident	10 Å²	10	14.1 Å²	14.1	5%	0.053	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	179.6	169	62.8	43.3	0	0	0	110.8	A2104 N2105 H2402 R2448	D2102-A2104 PolarHBondContact O-N 3.41Å; D2102-A2104 WeakPolarHBondContact OD1-CA 3.24Å; D2102-A2104 PolarHBondContact OD1-N 2.81Å; D2102-N2105 PolarHBondContact N-O 3.04Å; D2102-N2105 CarbonylContact O-C 3.38Å; D2102-N2105 PolarHBondContact O-N 3.43Å; D2102-N2105 WeakPolarHBondContact OD1-CB 3.42Å; D2102-N2105 PolarHBondContact OD1-N 3.48Å; D2102-N2105 PolarHBondContact OD1-ND2 3.04Å; D2102-N2105 PolarHBondContact OD2-ND2 2.85Å; D2102-H2402 IonicContact OD2-CE1 3.24Å; D2102-R2448 IonicContact OD1-CZ 2.71Å; D2102-R2448 IonicContact OD1-NH1 3.54Å; D2102-R2448 PolarHBondContact OD1-NH1 3.48Å; D2102-R2448 VanDerWaalsContact OD1-NH1 3.17Å; D2102-R2448 IonicContact OD2-CZ 3.52Å; D2102-R2448 IonicContact OD2-NH1 3.28Å; D2102-R2448 PolarHBondContact OD2-NH1 3.27Å
2103	S	82.3	Confident	86.9	Confident	41 Å²	41	14 Å²	14	29%	0.287	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-7.8	-178.7	50.8	0	0	0	0	115.9
2104	A	82.3	Confident	86.1	Confident	6 Å²	6	20.9 Å²	20.9	5%	0.05	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.8	4	173.6	0	0	0	0	0	113.5	D2102 H2160 H2162 R2448	D2102-A2104 PolarHBondContact O-N 3.41Å; D2102-A2104 WeakPolarHBondContact OD1-CA 3.24Å; D2102-A2104 PolarHBondContact OD1-N 2.81Å; A2104-H2160 CarbonylContact C-O 3.31Å; A2104-H2160 VanDerWaalsContact O-O 3.07Å; A2104-H2162 HydrophobicContact CB-CB 4.01Å; A2104-H2162 VanDerWaalsContact O-CB 3.23Å; A2104-H2162 WeakPolarHBondContact O-CB 3.42Å; A2104-H2162 PolarHBondContact O-N 2.77Å; A2104-R2448 HydrophobicContact CB-CB 3.66Å; A2104-R2448 HydrophobicContact CB-CG 4.36Å
2105	N	87.4	Confident	85.1	Confident	4 Å²	4	23.3 Å²	23.3	2%	0.021	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	82.6	-173.9	-66.8	-75.8	0	0	0	110.1	M2101 D2102 H2160 W2161 H2162 L2163	M2101-N2105 WeakPolarHBondContact CA-O 3.45Å; M2101-N2105 HydrophobicContact CB-CB 3.95Å; M2101-N2105 VanDerWaalsContact CB-O 3.32Å; M2101-N2105 WeakPolarHBondContact CB-O 3.23Å; M2101-N2105 HydrophobicContact CG-CB 4.45Å; M2101-N2105 PolarHBondContact N-O 2.85Å; M2101-N2105 HydrophobicContact SD-CB 4.49Å; D2102-N2105 PolarHBondContact N-O 3.04Å; D2102-N2105 CarbonylContact O-C 3.38Å; D2102-N2105 PolarHBondContact O-N 3.43Å; D2102-N2105 WeakPolarHBondContact OD1-CB 3.42Å; D2102-N2105 PolarHBondContact OD1-N 3.48Å; D2102-N2105 PolarHBondContact OD1-ND2 3.04Å; D2102-N2105 PolarHBondContact OD2-ND2 2.85Å; N2105-H2160 CarbonylContact C-O 3.58Å; N2105-H2160 WeakPolarHBondContact CA-O 3.16Å; N2105-H2160 PolarHBondContact N-O 2.59Å; N2105-W2161 HydrophobicContact CB-CE3 3.8Å; N2105-W2161 HydrophobicContact CB-CZ3 3.81Å; N2105-H2162 PolarHBondContact OD1-N 3.07Å; N2105-H2162 VanDerWaalsContact OD1-N 3.15Å; N2105-L2163 HydrophobicContact CB-CD2 4.42Å; N2105-L2163 WeakPolarHBondContact OD1-CB 3.05Å; N2105-L2163 WeakPolarHBondContact OD1-CG 3Å; N2105-L2163 PolarHBondContact OD1-N 2.67Å
2106	Y	91.1	Very high	83.7	Confident	22 Å²	22	24.9 Å²	24.9	9%	0.086	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	162	176.8	65.7	-91.4	0	0	0	112.3	W2095 L2098 I2099 W2100 H2160	W2095-Y2106 HydrophobicContact CZ2-CE2 4.28Å; L2098-Y2106 HydrophobicContact CD1-CD2 4.17Å; I2099-Y2106 CarbonylContact O-C 3.25Å; I2099-Y2106 VanDerWaalsContact O-CA 3.22Å; I2099-Y2106 WeakPolarHBondContact O-CA 3.35Å; I2099-Y2106 WeakPolarHBondContact O-CB 3.28Å; W2100-Y2106 HydrophobicContact CE3-CD1 4.03Å; W2100-Y2106 HydrophobicContact CE3-CD2 4.47Å; W2100-Y2106 AromaticContact CE3-CG 3.74Å; W2100-Y2106 HydrophobicContact CE3-CG 3.74Å; W2100-Y2106 HydrophobicContact CH2-CD1 4.07Å; W2100-Y2106 AromaticContact CZ3-CD1 3.48Å; W2100-Y2106 HydrophobicContact CZ3-CD1 3.48Å; W2100-Y2106 VanDerWaalsContact CZ3-CD1 3.48Å; W2100-Y2106 HydrophobicContact CZ3-CD2 4.26Å; W2100-Y2106 HydrophobicContact CZ3-CE1 4.08Å; W2100-Y2106 AromaticContact CZ3-CG 3.59Å; W2100-Y2106 HydrophobicContact CZ3-CG 3.59Å; Y2106-H2160 HydrophobicContact CD1-CB 4.2Å; Y2106-H2160 HydrophobicContact CE1-CB 3.82Å; Y2106-H2160 HydrophobicContact CE2-CB 4.17Å; Y2106-H2160 AromaticContact CE2-CD2 3.9Å; Y2106-H2160 AromaticContact CZ-CD2 3.66Å; Y2106-H2160 AromaticContact CZ-CG 3.97Å; Y2106-H2160 PolarHBondContact N-O 3.27Å; Y2106-H2160 CarbonylContact O-C 3.49Å; Y2106-H2160 PolarHBondContact O-N 2.95Å; Y2106-H2160 PolarHBondContact OH-CD2 3Å; Y2106-H2160 VanDerWaalsContact OH-CD2 3.29Å
2107	A	90.4	Very high	82.3	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	139.3	169.7	0	0	0	0	0	111.6	I2099 D2158 M2159 W2161 L2185	I2099-A2107 PolarHBondContact N-O 3.13Å; I2099-A2107 PolarHBondContact O-N 2.94Å; A2107-D2158 CarbonylContact C-O 3.58Å; A2107-D2158 VanDerWaalsContact CA-O 3.22Å; A2107-D2158 WeakPolarHBondContact CA-O 3.43Å; A2107-M2159 HydrophobicContact CB-CB 4.47Å; A2107-M2159 HydrophobicContact CB-CG 3.57Å; A2107-W2161 HydrophobicContact CB-CZ2 3.96Å; A2107-L2185 HydrophobicContact CB-CD1 3.58Å
2108	G	90.1	Very high	80.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	157.2	-179.4	0	0	0	0	0	113.8	Q2097 K2110 D2158	Q2097-G2108 CarbonylContact O-C 3.37Å; Q2097-G2108 WeakPolarHBondContact O-CA 3.49Å; G2108-K2110 PolarHBondContact O-N 3.46Å; G2108-D2158 PolarHBondContact N-O 3.39Å; G2108-D2158 PolarHBondContact O-N 2.95Å
2109	V	89.2	Confident	79.2	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	110.8	172	177.8	0	0	0	0	107.7	W2095 R2096 Q2097 P2155 L2157 Y2189	W2095-V2109 CarbonylContact C-O 3.57Å; W2095-V2109 WeakPolarHBondContact CA-O 3.37Å; R2096-V2109 PolarHBondContact N-O 3.36Å; Q2097-V2109 PolarHBondContact O-N 3.05Å; V2109-P2155 HydrophobicContact CG1-CB 3.82Å; V2109-L2157 HydrophobicContact CG2-CD1 4.19Å; V2109-Y2189 HydrophobicContact CB-CD2 4.35Å; V2109-Y2189 HydrophobicContact CB-CG 4.49Å; V2109-Y2189 HydrophobicContact CG1-CD1 4.25Å; V2109-Y2189 HydrophobicContact CG1-CD2 4.26Å; V2109-Y2189 HydrophobicContact CG1-CE1 4.1Å; V2109-Y2189 HydrophobicContact CG1-CE2 4.12Å; V2109-Y2189 HydrophobicContact CG1-CG 4.34Å; V2109-Y2189 HydrophobicContact CG2-CD1 4.41Å; V2109-Y2189 HydrophobicContact CG2-CD2 4.31Å; V2109-Y2189 HydrophobicContact CG2-CG 4.03Å
2110	K	86	Confident	77.6	Confident	59 Å²	59	44.8 Å²	44.8	26%	0.257	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136.3	-173.6	180	167.9	160	-117.1	0	110.9	G2108 E2156	G2108-K2110 PolarHBondContact O-N 3.46Å; K2110-E2156 HydrophobicContact CB-CB 4.36Å; K2110-E2156 HydrophobicContact CD-CG 4.49Å; K2110-E2156 PolarHBondContact N-O 3.21Å; K2110-E2156 IonicContact NZ-OE1 3.68Å; K2110-E2156 PolarHBondContact NZ-OE1 2.94Å; K2110-E2156 IonicContact NZ-OE2 2.75Å; K2110-E2156 PolarHBondContact NZ-OE2 3.4Å
2111	A	80.7	Confident	76.5	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.008	25%	0.246	C	C	.	.			trans	-104.8	94.6	-179.6	0	0	0	0	0	109.1	L2062 S2094 R2096 V2113	L2062-A2111 HydrophobicContact CD1-CB 4.12Å; L2062-A2111 HydrophobicContact CD2-CB 4.12Å; S2094-A2111 PolarHBondContact O-N 3.5Å; S2094-A2111 PolarHBondContact OG-O 3.08Å; R2096-A2111 HydrophobicContact CG-CB 3.65Å; A2111-V2113 PolarHBondContact O-N 3.48Å
2112	S	76.4	Confident	75.5	Confident	18 Å²	18	47.7 Å²	47.7	13%	0.126	26%	0.263	C	S	.	.			trans	-73.6	130.3	176.2	-169.4	0	0	0	0	110.9	E2114 N2115	S2112-E2114 PolarHBondContact O-N 3.09Å; S2112-E2114 WeakPolarHBondContact OG-CB 3.14Å; S2112-E2114 WeakPolarHBondContact OG-CG 3.39Å; S2112-E2114 PolarHBondContact OG-N 2.7Å; S2112-E2114 PolarHBondContact OG-OE2 2.81Å; S2112-N2115 WeakPolarHBondContact O-CB 3.23Å; S2112-N2115 PolarHBondContact O-N 3.28Å
2113	V	74.1	Confident	74.4	Confident	66 Å²	66	47.6 Å²	47.6	40%	0.4	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-62.1	-25.5	171	-176	0	0	0	0	110.7	L2066 Y2091 A2111 N2115 L2116	L2066-V2113 HydrophobicContact CD1-CG2 4.33Å; Y2091-V2113 HydrophobicContact CE1-CG2 3.97Å; A2111-V2113 PolarHBondContact O-N 3.48Å; V2113-N2115 PolarHBondContact O-N 3Å; V2113-L2116 HydrophobicContact CG1-CD1 4.39Å; V2113-L2116 WeakPolarHBondContact O-CB 3.48Å; V2113-L2116 PolarHBondContact O-N 3Å; V2113-L2116 VanDerWaalsContact O-N 3.14Å
2114	E	70.5	Confident	73.7	Confident	170 Å²	170	46.3 Å²	46.3	79%	0.794	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-63.4	-20.3	176.9	-56.7	164.2	140.5	0	0	112.9	S2112 L2116	S2112-E2114 PolarHBondContact O-N 3.09Å; S2112-E2114 WeakPolarHBondContact OG-CB 3.14Å; S2112-E2114 WeakPolarHBondContact OG-CG 3.39Å; S2112-E2114 PolarHBondContact OG-N 2.7Å; S2112-E2114 PolarHBondContact OG-OE2 2.81Å; E2114-L2116 PolarHBondContact O-N 3.34Å
2115	N	67.8	Low	72.3	Confident	51 Å²	51	47.7 Å²	47.7	27%	0.273	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-79.8	0.3	177.4	-66.6	-12.5	0	0	0	113.4	S2112 V2113 V2117	S2112-N2115 WeakPolarHBondContact O-CB 3.23Å; S2112-N2115 PolarHBondContact O-N 3.28Å; V2113-N2115 PolarHBondContact O-N 3Å; N2115-V2117 PolarHBondContact O-N 2.75Å
2116	L	63.5	Low	70.4	Confident	36 Å²	36	53.8 Å²	53.8	19%	0.188	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	81.9	-179.2	-59.8	-175.2	0	0	0	112.3	L2062 P2063 L2066 V2113 E2114 D2121	L2062-L2116 HydrophobicContact CB-CD2 4.31Å; L2062-L2116 HydrophobicContact CD2-CD1 4.03Å; L2062-L2116 HydrophobicContact CD2-CD2 4.15Å; L2062-L2116 HydrophobicContact CD2-CG 4.09Å; L2062-L2116 HydrophobicContact CG-CD1 4.15Å; L2062-L2116 HydrophobicContact CG-CD2 4.46Å; P2063-L2116 HydrophobicContact CG-CD1 4.22Å; P2063-L2116 HydrophobicContact CG-CD2 3.77Å; L2066-L2116 HydrophobicContact CD1-CD1 4.08Å; V2113-L2116 HydrophobicContact CG1-CD1 4.39Å; V2113-L2116 WeakPolarHBondContact O-CB 3.48Å; V2113-L2116 PolarHBondContact O-N 3Å; V2113-L2116 VanDerWaalsContact O-N 3.14Å; E2114-L2116 PolarHBondContact O-N 3.34Å; L2116-D2121 HydrophobicContact CD2-CB 4.14Å
2117	V	58.4	Low	68	Low	85 Å²	85	58 Å²	58	52%	0.515	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	127.4	175	-176.1	0	0	0	0	109.8	N2115 G2119 K2120 V2122	N2115-V2117 PolarHBondContact O-N 2.75Å; V2117-G2119 PolarHBondContact O-N 3.16Å; V2117-G2119 VanDerWaalsContact O-N 3.16Å; V2117-K2120 PolarHBondContact N-O 2.85Å; V2117-K2120 PolarHBondContact O-N 2.84Å; V2117-V2122 HydrophobicContact CB-CG2 3.63Å; V2117-V2122 HydrophobicContact CG2-CG2 3.65Å
2118	D	56.4	Low	65.3	Low	151 Å²	151	64.5 Å²	64.5	81%	0.807	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	35	-174.2	-59.7	-28.4	0	0	0	113.8	K2120	D2118-K2120 PolarHBondContact O-N 2.75Å
2119	G	57.6	Low	62.5	Low	50 Å²	50	70 Å²	70	52%	0.515	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	70	8.8	-176.8	0	0	0	0	0	114.7	P2063 V2117	P2063-G2119 WeakPolarHBondContact CG-O 3.31Å; V2117-G2119 PolarHBondContact O-N 3.16Å; V2117-G2119 VanDerWaalsContact O-N 3.16Å
2120	K	58.7	Low	59.7	Low	148 Å²	148	76.1 Å²	76.1	64%	0.643	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	137.6	179.7	-67.9	170.1	-173.4	161.9	0	110.6	V2117 D2118 V2122	V2117-K2120 PolarHBondContact N-O 2.85Å; V2117-K2120 PolarHBondContact O-N 2.84Å; D2118-K2120 PolarHBondContact O-N 2.75Å; K2120-V2122 PolarHBondContact O-N 3.05Å
2121	D	68.1	Low	56.9	Low	11 Å²	11	81.1 Å²	81.1	6%	0.059	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	96.4	177.8	-165.4	-38.4	0	0	0	110.1	R2096 L2116 E2123 W2124 G2125	R2096-D2121 IonicContact CZ-OD1 2.68Å; R2096-D2121 IonicContact CZ-OD2 2.72Å; R2096-D2121 VanDerWaalsContact CZ-OD2 3.27Å; R2096-D2121 IonicContact NH1-OD1 3.91Å; R2096-D2121 IonicContact NH1-OD2 2.65Å; R2096-D2121 PolarHBondContact NH1-OD2 2.92Å; R2096-D2121 VanDerWaalsContact NH2-CG 3.27Å; R2096-D2121 IonicContact NH2-OD1 2.67Å; R2096-D2121 PolarHBondContact NH2-OD1 2.6Å; R2096-D2121 IonicContact NH2-OD2 3.86Å; R2096-D2121 PolarHBondContact NH2-OD2 3Å; L2116-D2121 HydrophobicContact CD2-CB 4.14Å; D2121-E2123 PolarHBondContact O-N 3.38Å; D2121-E2123 WeakPolarHBondContact OD1-CB 3.2Å; D2121-E2123 PolarHBondContact OD1-N 2.92Å; D2121-W2124 HydrophobicContact CB-CB 4.32Å; D2121-W2124 PolarHBondContact O-N 2.95Å; D2121-W2124 PolarHBondContact OD1-N 2.82Å; D2121-W2124 VanDerWaalsContact OD1-N 3.14Å; D2121-G2125 PolarHBondContact O-N 2.95Å
2122	V	67.4	Low	54.4	Low	71 Å²	71	88.9 Å²	88.9	43%	0.43	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-28.5	-178.1	-176.9	0	0	0	0	111.4	V2117 K2120	V2117-V2122 HydrophobicContact CB-CG2 3.63Å; V2117-V2122 HydrophobicContact CG2-CG2 3.65Å; K2120-V2122 PolarHBondContact O-N 3.05Å
2123	E	64.5	Low	52	Low	8 Å²	8	96.7 Å²	96.7	4%	0.037	51%	0.514	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-33.2	-178.1	-170.5	-172.6	175.2	0	0	111.7	R2096 D2121 Y2189 R2193	R2096-E2123 IonicContact CZ-OE2 2.75Å; R2096-E2123 IonicContact NE-OE2 3.7Å; R2096-E2123 PolarHBondContact NE-OE2 3.18Å; R2096-E2123 IonicContact NH2-OE2 3.2Å; R2096-E2123 PolarHBondContact NH2-OE2 2.97Å; D2121-E2123 PolarHBondContact O-N 3.38Å; D2121-E2123 WeakPolarHBondContact OD1-CB 3.2Å; D2121-E2123 PolarHBondContact OD1-N 2.92Å; E2123-Y2189 PolarHBondContact OE1-OH 3.26Å; E2123-R2193 VanDerWaalsContact CG-CZ 3.5Å; E2123-R2193 VanDerWaalsContact O-CZ 3.29Å; E2123-R2193 PolarHBondContact O-NE 3.46Å; E2123-R2193 PolarHBondContact O-NH2 3.49Å; E2123-R2193 IonicContact OE1-CZ 3.18Å; E2123-R2193 IonicContact OE1-NH1 3.62Å
2124	W	66.5	Low	49.6	Very low	14 Å²	14	97.9 Å²	97.9	5%	0.053	53%	0.525	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-28.4	-178.1	-76.8	61.6	0	0	0	114.1	I2060 R2096 D2121 Y2189 V2192 R2193 H2196	I2060-W2124 HydrophobicContact CG2-CE3 3.92Å; I2060-W2124 HydrophobicContact CG2-CH2 3.59Å; I2060-W2124 HydrophobicContact CG2-CZ3 3.22Å; R2096-W2124 VanDerWaalsContact CZ-CD1 3.42Å; D2121-W2124 HydrophobicContact CB-CB 4.32Å; D2121-W2124 PolarHBondContact O-N 2.95Å; D2121-W2124 PolarHBondContact OD1-N 2.82Å; D2121-W2124 VanDerWaalsContact OD1-N 3.14Å; W2124-Y2189 HydrophobicContact CZ2-CD2 4.47Å; W2124-Y2189 AromaticContact CZ2-CE2 3.7Å; W2124-Y2189 HydrophobicContact CZ2-CE2 3.7Å; W2124-Y2189 AromaticContact NE1-CZ 3.92Å; W2124-Y2189 PolarHBondContact NE1-OH 3.28Å; W2124-V2192 HydrophobicContact CH2-CG1 3.92Å; W2124-V2192 HydrophobicContact CZ3-CG1 4.48Å; W2124-R2193 HydrophobicContact CD2-CG 4.19Å; W2124-R2193 HydrophobicContact CH2-CB 4.07Å; W2124-R2193 HydrophobicContact CZ2-CB 3.9Å; W2124-R2193 HydrophobicContact CZ2-CG 4.2Å; W2124-R2193 HydrophobicContact CZ3-CB 4.49Å; W2124-H2196 HydrophobicContact CE3-CB 4Å; W2124-H2196 AromaticContact CE3-CG 3.78Å; W2124-H2196 AromaticContact CE3-ND1 3.48Å; W2124-H2196 HydrophobicContact CZ3-CB 3.54Å; W2124-H2196 AromaticContact CZ3-CG 3.6Å; W2124-H2196 AromaticContact CZ3-ND1 3.83Å
2125	G	54.3	Low	47.4	Very low	35 Å²	35	97.6 Å²	97.6	36%	0.361	52%	0.523	S	S	.	.	S	Bend	trans	-62.9	171.9	178.2	0	0	0	0	0	114.8	D2121 R2197	D2121-G2125 PolarHBondContact O-N 2.95Å; G2125-R2197 PolarHBondContact O-NH2 3.42Å
2126	K	47.1	Very low	45.2	Very low	132 Å²	132	101.7 Å²	101.7	57%	0.574	54%	0.544	S	S	*	.			trans	-99.3	133.3	156.9	-116.1	178.8	172.6	168.1	0	107	L2128 E2201	K2126-L2128 PolarHBondContact O-N 3.1Å; K2126-E2201 VanDerWaalsContact CD-OE1 3.32Å; K2126-E2201 WeakPolarHBondContact CD-OE1 3.29Å; K2126-E2201 WeakPolarHBondContact CE-OE1 3.45Å; K2126-E2201 IonicContact NZ-OE1 3.63Å; K2126-E2201 PolarHBondContact NZ-OE1 3.16Å; K2126-E2201 IonicContact NZ-OE2 2.73Å; K2126-E2201 PolarHBondContact NZ-OE2 3.28Å
2127	V	40	Very low	43.4	Very low	110 Å²	110	107.2 Å²	107.2	67%	0.667	57%	0.569	S	S	*	*			trans	-60.4	109	174.2	177.8	0	0	0	0	108.3	T2129	V2127-T2129 PolarHBondContact O-N 3.43Å
2128	L	34.6	Very low	41.8	Very low	137 Å²	137	107.8 Å²	107.8	72%	0.717	57%	0.573	S	S	*	*			trans	-75.3	92.5	170.2	-81	165.7	0	0	0	107.8	K2126 I2130	K2126-L2128 PolarHBondContact O-N 3.1Å; L2128-I2130 HydrophobicContact CB-CG1 4.36Å; L2128-I2130 PolarHBondContact O-N 2.94Å
2129	T	31.5	Very low	40.3	Very low	115 Å²	115	108.6 Å²	108.6	71%	0.706	57%	0.572	S	S	*	*			trans	-64.5	84.4	160.5	29.9	0	0	0	0	108.5	V2127 Q2131	V2127-T2129 PolarHBondContact O-N 3.43Å; T2129-Q2131 PolarHBondContact O-N 2.87Å
2130	I	29.6	Very low	38.9	Very low	130 Å²	130	113 Å²	113	67%	0.667	58%	0.583	S	S	*	*			trans	-63.9	99.3	173.8	-58.7	177.3	0	0	0	107.1	L2128 H2132	L2128-I2130 HydrophobicContact CB-CG1 4.36Å; L2128-I2130 PolarHBondContact O-N 2.94Å; I2130-H2132 PolarHBondContact O-N 2.81Å
2131	Q	28	Very low	37.4	Very low	165 Å²	165	115.8 Å²	115.8	77%	0.771	60%	0.596	S	S	*	*			trans	-70.7	74.6	173.9	-70.2	-173.6	-13.3	0	0	109.8	T2129 Q2133	T2129-Q2131 PolarHBondContact O-N 2.87Å; Q2131-Q2133 VanDerWaalsContact C-N 3.28Å; Q2131-Q2133 PolarHBondContact O-N 3.38Å
2132	H	28.5	Very low	35.3	Very low	164 Å²	164	124 Å²	124	76%	0.759	63%	0.633	S	S	*	*			trans	-68.6	90.8	168.3	-108.5	-65.9	0	0	0	109.2	I2130 S2134	I2130-H2132 PolarHBondContact O-N 2.81Å; H2132-S2134 PolarHBondContact O-N 2.92Å
2133	Q	24.6	Very low	33.5	Very low	181 Å²	181	127.1 Å²	127.1	85%	0.846	65%	0.648	S	S	*	*			trans	-66.1	101.3	170.1	-68.9	-175.6	-5.1	0	0	109.3	Q2131	Q2131-Q2133 VanDerWaalsContact C-N 3.28Å; Q2131-Q2133 PolarHBondContact O-N 3.38Å
2134	S	24	Very low	31.9	Very low	91 Å²	91	134 Å²	134	64%	0.636	69%	0.685	S	S	*	*			trans	-140.6	87.9	163.8	62.4	0	0	0	0	111.2	H2132	H2132-S2134 PolarHBondContact O-N 2.92Å
2135	H	23.8	Very low	30.2	Very low	165 Å²	165	141 Å²	141	76%	0.764	72%	0.722	S	S	*	*			trans	70.9	121.8	158.5	-67	-83.3	0	0	0	120.4
2136	L	22.8	Very low	29	Very low	137 Å²	137	147.8 Å²	147.8	72%	0.717	74%	0.744	S	S	*	*			trans	59.2	120.8	130.7	-57.3	169.1	0	0	0	117.3
2137	H	24.5	Very low	28.3	Very low	151 Å²	151	150.4 Å²	150.4	70%	0.699	76%	0.758	S	S	*	*			cis	-168.3	142.9	48.4	-127.9	-73.4	0	0	0	113.3
2138	T	24.5	Very low	27.8	Very low	98 Å²	98	154 Å²	154	60%	0.601	77%	0.768	S	S	*	*			trans	43.5	123.4	148.5	40.5	0	0	0	0	123.7
2139	E	26.2	Very low	27.8	Very low	167 Å²	167	155.4 Å²	155.4	78%	0.78	77%	0.771	S	S	*	*			trans	81.5	107.3	131	-67.7	169	-155.3	0	0	121.8
2140	D	27.7	Very low	28.3	Very low	143 Å²	143	154.9 Å²	154.9	77%	0.765	77%	0.77	S	S	*	*				54.4	96.3	129.6	-59.8	8.5	0	0	0	120.7
2141	K	26.4	Very low	29.1	Very low	207 Å²	207	156.6 Å²	156.6	90%	0.9	78%	0.78	S	S	*	*				-160.5	117.8	117.7	-101	135.5	-161.1	152	0	113.5
2142	E	25.9	Very low	30.4	Very low	182 Å²	182	152.4 Å²	152.4	85%	0.85	76%	0.763	S	S	*	*			trans	-67.9	132.9	156.1	-57.4	174.6	133.3	0	0	109.2
2143	N	27.7	Very low	31.8	Very low	138 Å²	138	148.1 Å²	148.1	74%	0.738	75%	0.749	S	S	*	*			trans	169.5	118.8	134.2	-96.5	-74.1	0	0	0	110.8
2144	N	31	Very low	33.9	Very low	153 Å²	153	146.8 Å²	146.8	82%	0.818	75%	0.748	S	S	*	*			trans	41.7	80.8	152.6	-55.8	-9.8	0	0	0	117.8
2145	I	30.7	Very low	36.2	Very low	159 Å²	159	144 Å²	144	82%	0.815	73%	0.727	S	S	*	*			trans	-106.9	120.6	148.8	-62.3	176.5	0	0	0	106.2
2146	E	29.6	Very low	38.8	Very low	178 Å²	178	141 Å²	141	83%	0.832	71%	0.714	S	S	*	*			trans	-66.8	133	174.5	-64	177.6	139.2	0	0	109.2	Q2148	E2146-Q2148 PolarHBondContact O-N 2.83Å
2147	E	32.9	Very low	41.7	Very low	188 Å²	188	136.9 Å²	136.9	88%	0.879	69%	0.692	S	S	*	*			trans	-66.2	94.4	-177.2	-68.1	-172.2	139.1	0	0	110.8	Q2149	E2147-Q2149 VanDerWaalsContact C-N 3.33Å; E2147-Q2149 PolarHBondContact O-N 2.99Å
2148	Q	29.3	Very low	44.5	Very low	184 Å²	184	131.2 Å²	131.2	86%	0.86	67%	0.667	S	S	*	*			trans	-64.3	94.5	168.8	-69.2	-175.3	-8.6	0	0	108.8	E2146	E2146-Q2148 PolarHBondContact O-N 2.83Å
2149	Q	34.5	Very low	47.3	Very low	167 Å²	167	128.6 Å²	128.6	78%	0.78	65%	0.649	S	S	*	*			trans	-54.9	125.9	166	-66.9	-174.8	-4.4	0	0	107.6	E2147 N2151	E2147-Q2149 VanDerWaalsContact C-N 3.33Å; E2147-Q2149 PolarHBondContact O-N 2.99Å; Q2149-N2151 PolarHBondContact O-N 3.13Å
2150	P	42.4	Very low	50	Low	105 Å²	105	123.4 Å²	123.4	68%	0.682	62%	0.624	S	S	*	*			trans	-62.5	127.8	-178.8	25	-33.1	0	0	0	108.9	L2152	P2150-L2152 PolarHBondContact O-N 3.05Å
2151	N	45.8	Very low	52.6	Low	166 Å²	166	117 Å²	117	89%	0.888	59%	0.589	S	S	*	*			trans	-58.2	102.6	176.3	-75.1	-4.9	0	0	0	109.2	Q2149	Q2149-N2151 PolarHBondContact O-N 3.13Å
2152	L	54.7	Low	55	Low	77 Å²	77	107.4 Å²	107.4	40%	0.403	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-61.8	141.3	166.3	-71	158.1	0	0	0	107.8	P2150 D2154	P2150-L2152 PolarHBondContact O-N 3.05Å; L2152-D2154 PolarHBondContact O-N 2.91Å
2153	P	59.4	Low	57.4	Low	73 Å²	73	99 Å²	99	47%	0.474	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-59.6	138.7	176.4	25.4	-33.6	0	0	0	110.2
2154	D	67.9	Low	59.6	Low	153 Å²	153	92.4 Å²	92.4	82%	0.818	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-63.2	138.2	174.7	-75.5	-53.1	0	0	0	110.2	L2152 E2156	L2152-D2154 PolarHBondContact O-N 2.91Å; D2154-E2156 PolarHBondContact O-N 2.68Å
2155	P	72.9	Confident	61.5	Low	32 Å²	32	89.1 Å²	89.1	21%	0.208	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-66.5	121.7	-178	26	-34.2	0	0	0	111.6	V2109 L2157 L2186 Y2189	V2109-P2155 HydrophobicContact CG1-CB 3.82Å; P2155-L2157 PolarHBondContact O-N 3.36Å; P2155-L2186 HydrophobicContact CB-CD2 4.31Å; P2155-L2186 HydrophobicContact CG-CD2 3.6Å; P2155-Y2189 HydrophobicContact CB-CD1 4.28Å; P2155-Y2189 HydrophobicContact CB-CE1 3.93Å; P2155-Y2189 HydrophobicContact CG-CD1 4.45Å; P2155-Y2189 HydrophobicContact CG-CE1 4.39Å
2156	E	78.4	Confident	63.2	Low	104 Å²	104	84 Å²	84	49%	0.486	42%	0.42	S	S	.	.			trans	-69.4	115.3	176.7	-169	-173.4	166.5	0	0	110.1	K2110 D2154	K2110-E2156 HydrophobicContact CB-CB 4.36Å; K2110-E2156 HydrophobicContact CD-CG 4.49Å; K2110-E2156 PolarHBondContact N-O 3.21Å; K2110-E2156 IonicContact NZ-OE1 3.68Å; K2110-E2156 PolarHBondContact NZ-OE1 2.94Å; K2110-E2156 IonicContact NZ-OE2 2.75Å; K2110-E2156 PolarHBondContact NZ-OE2 3.4Å; D2154-E2156 PolarHBondContact O-N 2.68Å
2157	L	84	Confident	65	Low	50 Å²	50	75.9 Å²	75.9	26%	0.262	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	111.7	-177.5	-176.3	67.9	0	0	0	110.6	V2109 P2155 M2159 A2182 L2185 L2186	V2109-L2157 HydrophobicContact CG2-CD1 4.19Å; P2155-L2157 PolarHBondContact O-N 3.36Å; L2157-M2159 HydrophobicContact CD1-CG 4.5Å; L2157-M2159 HydrophobicContact CD2-CG 4.17Å; L2157-M2159 HydrophobicContact CD2-SD 3.64Å; L2157-M2159 HydrophobicContact CG-CG 4Å; L2157-M2159 HydrophobicContact CG-SD 4.16Å; L2157-A2182 HydrophobicContact CD2-CB 3.48Å; L2157-A2182 VanDerWaalsContact CD2-CB 3.48Å; L2157-L2185 HydrophobicContact CD1-CB 4.27Å; L2157-L2185 HydrophobicContact CD1-CD1 4.01Å; L2157-L2186 HydrophobicContact CD2-CD1 4.49Å
2158	D	83	Confident	66.4	Low	31 Å²	31	67.1 Å²	67.1	17%	0.166	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	128	174.5	-174.7	12.5	0	0	0	109.8	W2095 A2107 G2108 H2160	W2095-D2158 PolarHBondContact NE1-OD2 2.86Å; A2107-D2158 CarbonylContact C-O 3.58Å; A2107-D2158 VanDerWaalsContact CA-O 3.22Å; A2107-D2158 WeakPolarHBondContact CA-O 3.43Å; G2108-D2158 PolarHBondContact N-O 3.39Å; G2108-D2158 PolarHBondContact O-N 2.95Å; D2158-H2160 IonicContact OD1-CD2 3.56Å; D2158-H2160 PolarHBondContact OD1-CD2 3.13Å; D2158-H2160 IonicContact OD1-NE2 3.79Å
2159	M	83.2	Confident	67.8	Low	44 Å²	44	63.3 Å²	63.3	22%	0.217	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	98.2	-168.4	-94.5	-167.9	77	0	0	113.5	A2107 L2157 Q2178 L2181 A2182	A2107-M2159 HydrophobicContact CB-CB 4.47Å; A2107-M2159 HydrophobicContact CB-CG 3.57Å; L2157-M2159 HydrophobicContact CD1-CG 4.5Å; L2157-M2159 HydrophobicContact CD2-CG 4.17Å; L2157-M2159 HydrophobicContact CD2-SD 3.64Å; L2157-M2159 HydrophobicContact CG-CG 4Å; L2157-M2159 HydrophobicContact CG-SD 4.16Å; M2159-Q2178 HydrophobicContact CE-CB 3.92Å; M2159-Q2178 HydrophobicContact CE-CG 4.17Å; M2159-L2181 HydrophobicContact CE-CB 4.24Å; M2159-A2182 HydrophobicContact SD-CB 3.84Å
2160	H	82.7	Confident	68.6	Low	58 Å²	58	55.9 Å²	55.9	27%	0.269	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	88.4	179.8	-76.2	-74.8	0	0	0	111.1	A2104 N2105 Y2106 D2158	A2104-H2160 CarbonylContact C-O 3.31Å; A2104-H2160 VanDerWaalsContact O-O 3.07Å; N2105-H2160 CarbonylContact C-O 3.58Å; N2105-H2160 WeakPolarHBondContact CA-O 3.16Å; N2105-H2160 PolarHBondContact N-O 2.59Å; Y2106-H2160 HydrophobicContact CD1-CB 4.2Å; Y2106-H2160 HydrophobicContact CE1-CB 3.82Å; Y2106-H2160 HydrophobicContact CE2-CB 4.17Å; Y2106-H2160 AromaticContact CE2-CD2 3.9Å; Y2106-H2160 AromaticContact CZ-CD2 3.66Å; Y2106-H2160 AromaticContact CZ-CG 3.97Å; Y2106-H2160 PolarHBondContact N-O 3.27Å; Y2106-H2160 CarbonylContact O-C 3.49Å; Y2106-H2160 PolarHBondContact O-N 2.95Å; Y2106-H2160 PolarHBondContact OH-CD2 3Å; Y2106-H2160 VanDerWaalsContact OH-CD2 3.29Å; D2158-H2160 IonicContact OD1-CD2 3.56Å; D2158-H2160 PolarHBondContact OD1-CD2 3.13Å; D2158-H2160 IonicContact OD1-NE2 3.79Å
2161	W	82.7	Confident	69.5	Low	8 Å²	8	56.8 Å²	56.8	3%	0.03	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	92.4	176.7	-68	102.9	0	0	0	112	I2099 M2101 N2105 A2107 L2163 A2164 F2177 L2181 V2365	I2099-W2161 HydrophobicContact CG2-CH2 3.95Å; I2099-W2161 HydrophobicContact CG2-CZ2 4.07Å; M2101-W2161 HydrophobicContact CB-CZ3 4.24Å; N2105-W2161 HydrophobicContact CB-CE3 3.8Å; N2105-W2161 HydrophobicContact CB-CZ3 3.81Å; A2107-W2161 HydrophobicContact CB-CZ2 3.96Å; W2161-L2163 VanDerWaalsContact C-N 3.29Å; W2161-L2163 HydrophobicContact CE3-CD2 3.8Å; W2161-L2163 HydrophobicContact CE3-CG 4.09Å; W2161-L2163 HydrophobicContact CZ3-CD2 4.04Å; W2161-L2163 PolarHBondContact O-N 2.72Å; W2161-A2164 HydrophobicContact CB-CB 3.89Å; W2161-A2164 WeakPolarHBondContact O-CB 3.29Å; W2161-A2164 PolarHBondContact O-N 2.81Å; W2161-F2177 HydrophobicContact CB-CE1 4.19Å; W2161-F2177 HydrophobicContact CD2-CE1 4.37Å; W2161-F2177 HydrophobicContact CG-CE1 4.06Å; W2161-L2181 HydrophobicContact CD2-CD1 4.25Å; W2161-L2181 HydrophobicContact CZ2-CD1 4.14Å; W2161-V2365 HydrophobicContact CE3-CG2 4.21Å; W2161-V2365 HydrophobicContact CH2-CB 4.37Å; W2161-V2365 HydrophobicContact CH2-CG1 3.41Å; W2161-V2365 VanDerWaalsContact CH2-CG1 3.41Å; W2161-V2365 HydrophobicContact CH2-CG2 3.99Å; W2161-V2365 HydrophobicContact CZ2-CG1 3.73Å; W2161-V2365 HydrophobicContact CZ3-CB 4.48Å; W2161-V2365 HydrophobicContact CZ3-CG1 3.94Å; W2161-V2365 HydrophobicContact CZ3-CG2 3.62Å
2162	H	76	Confident	70.5	Confident	6 Å²	6	49.9 Å²	49.9	3%	0.028	25%	0.249	C	C	.	.	S	Bend	trans	-61.6	-38.3	172.4	-170.4	-69.5	0	0	0	111.5	A2104 N2105 A2164 R2165 Y2166 C2447	A2104-H2162 HydrophobicContact CB-CB 4.01Å; A2104-H2162 VanDerWaalsContact O-CB 3.23Å; A2104-H2162 WeakPolarHBondContact O-CB 3.42Å; A2104-H2162 PolarHBondContact O-N 2.77Å; N2105-H2162 PolarHBondContact OD1-N 3.07Å; N2105-H2162 VanDerWaalsContact OD1-N 3.15Å; H2162-A2164 PolarHBondContact O-N 3.32Å; H2162-A2164 VanDerWaalsContact O-N 3.16Å; H2162-R2165 WeakPolarHBondContact O-CA 3.04Å; H2162-R2165 WeakPolarHBondContact O-CB 3.28Å; H2162-R2165 WeakPolarHBondContact O-CG 3.48Å; H2162-R2165 PolarHBondContact O-N 3.06Å; H2162-Y2166 AromaticContact CE1-CE2 3.71Å; H2162-Y2166 AromaticContact CE1-CZ 3.96Å; H2162-Y2166 AromaticContact ND1-CE2 3.54Å; H2162-C2447 PolarHBondContact NE2-O 3.32Å
2163	L	77.4	Confident	71.4	Confident	4 Å²	4	46.4 Å²	46.4	2%	0.021	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-59.9	-30.4	179.5	75.9	82.6	0	0	0	113.3	M2101 N2105 W2161 R2165 Y2166 F2177 V2365	M2101-L2163 HydrophobicContact CE-CD2 4.43Å; M2101-L2163 HydrophobicContact SD-CD2 3.76Å; N2105-L2163 HydrophobicContact CB-CD2 4.42Å; N2105-L2163 WeakPolarHBondContact OD1-CB 3.05Å; N2105-L2163 WeakPolarHBondContact OD1-CG 3Å; N2105-L2163 PolarHBondContact OD1-N 2.67Å; W2161-L2163 VanDerWaalsContact C-N 3.29Å; W2161-L2163 HydrophobicContact CE3-CD2 3.8Å; W2161-L2163 HydrophobicContact CE3-CG 4.09Å; W2161-L2163 HydrophobicContact CZ3-CD2 4.04Å; W2161-L2163 PolarHBondContact O-N 2.72Å; L2163-R2165 PolarHBondContact O-N 2.93Å; L2163-Y2166 PolarHBondContact O-N 2.84Å; L2163-F2177 HydrophobicContact CD1-CE1 4.11Å; L2163-F2177 HydrophobicContact CD1-CE2 3.94Å; L2163-F2177 HydrophobicContact CD1-CZ 3.45Å; L2163-F2177 VanDerWaalsContact CD1-CZ 3.45Å; L2163-F2177 HydrophobicContact CG-CZ 4.44Å; L2163-V2365 HydrophobicContact CD2-CG2 3.82Å
2164	A	74	Confident	72.2	Confident	1 Å²	1	45 Å²	45	1%	0.008	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-66.2	-18.7	175.8	0	0	0	0	0	112.7	W2161 H2162 Y2166 L2167 R2174 F2177	W2161-A2164 HydrophobicContact CB-CB 3.89Å; W2161-A2164 WeakPolarHBondContact O-CB 3.29Å; W2161-A2164 PolarHBondContact O-N 2.81Å; H2162-A2164 PolarHBondContact O-N 3.32Å; H2162-A2164 VanDerWaalsContact O-N 3.16Å; A2164-Y2166 VanDerWaalsContact C-N 3.33Å; A2164-L2167 WeakPolarHBondContact O-CB 3.19Å; A2164-L2167 PolarHBondContact O-N 3.39Å; A2164-R2174 HydrophobicContact CB-CG 4.48Å; A2164-R2174 WeakPolarHBondContact O-CG 3.47Å; A2164-R2174 PolarHBondContact O-NE 3.06Å; A2164-R2174 VanDerWaalsContact O-NE 3.14Å; A2164-F2177 HydrophobicContact CB-CD1 3.57Å; A2164-F2177 HydrophobicContact CB-CE1 3.7Å; A2164-F2177 HydrophobicContact CB-CG 4.47Å
2165	R	69.6	Low	72.6	Confident	83 Å²	83	40.8 Å²	40.8	31%	0.313	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-80.1	-14	178.7	-51.2	-178.7	176	160.6	-14.8	112.8	H2162 L2163 R2174 L2340	H2162-R2165 WeakPolarHBondContact O-CA 3.04Å; H2162-R2165 WeakPolarHBondContact O-CB 3.28Å; H2162-R2165 WeakPolarHBondContact O-CG 3.48Å; H2162-R2165 PolarHBondContact O-N 3.06Å; L2163-R2165 PolarHBondContact O-N 2.93Å; R2165-R2174 PolarHBondContact O-NH2 2.88Å; R2165-L2340 HydrophobicContact CB-CD1 4.14Å; R2165-L2340 HydrophobicContact CG-CD1 4.25Å; R2165-L2340 VanDerWaalsContact NH1-CD1 3.33Å
2166	Y	66.8	Low	73.1	Confident	52 Å²	52	41.9 Å²	41.9	20%	0.204	20%	0.2	C	C	.	.	S	Bend	trans	-82.8	-16.5	165.1	-63.4	-78.2	0	0	0	112.9	H2162 L2163 A2164 H2344 P2401	H2162-Y2166 AromaticContact CE1-CE2 3.71Å; H2162-Y2166 AromaticContact CE1-CZ 3.96Å; H2162-Y2166 AromaticContact ND1-CE2 3.54Å; L2163-Y2166 PolarHBondContact O-N 2.84Å; A2164-Y2166 VanDerWaalsContact C-N 3.33Å; Y2166-H2344 HydrophobicContact CD1-CB 3.94Å; Y2166-P2401 HydrophobicContact CD1-CB 4.44Å; Y2166-P2401 HydrophobicContact CD2-CB 3.57Å; Y2166-P2401 HydrophobicContact CD2-CG 3.74Å; Y2166-P2401 HydrophobicContact CE1-CB 4.42Å; Y2166-P2401 HydrophobicContact CE2-CB 3.54Å; Y2166-P2401 HydrophobicContact CE2-CG 4.12Å; Y2166-P2401 HydrophobicContact CG-CB 4.04Å; Y2166-P2401 HydrophobicContact CG-CG 4.29Å
2167	L	68.7	Low	73.4	Confident	7 Å²	7	37 Å²	37	4%	0.037	18%	0.177	C	C	.	.	S	Bend	trans	-76.9	147.3	171.8	-56.4	172.9	0	0	0	110.4	A2164 R2174 F2177 F2358	A2164-L2167 WeakPolarHBondContact O-CB 3.19Å; A2164-L2167 PolarHBondContact O-N 3.39Å; L2167-R2174 PolarHBondContact O-NE 2.98Å; L2167-R2174 PolarHBondContact O-NH2 2.92Å; L2167-F2177 HydrophobicContact CD1-CB 3.86Å; L2167-F2177 HydrophobicContact CD1-CD1 4.42Å; L2167-F2177 HydrophobicContact CD1-CD2 3.64Å; L2167-F2177 HydrophobicContact CD1-CE2 4.31Å; L2167-F2177 HydrophobicContact CD1-CG 3.72Å; L2167-F2358 HydrophobicContact CD1-CD2 4.29Å; L2167-F2358 HydrophobicContact CD2-CB 4.25Å
2168	P	61.8	Low	73.5	Confident	5 Å²	5	38 Å²	38	3%	0.032	18%	0.18	C	C	.	.			trans	-65	150.3	178.3	-10.9	23.1	0	0	0	112	T2170 L2173 R2174 Y2311 L2312 P2354	P2168-T2170 WeakPolarHBondContact CB-OG1 3.31Å; P2168-L2173 HydrophobicContact CB-CD1 4.34Å; P2168-L2173 HydrophobicContact CG-CD1 3.78Å; P2168-L2173 WeakPolarHBondContact O-CB 3.2Å; P2168-R2174 WeakPolarHBondContact O-CB 3.36Å; P2168-R2174 PolarHBondContact O-N 2.98Å; P2168-Y2311 HydrophobicContact CG-CE1 4.08Å; P2168-L2312 HydrophobicContact CB-CD2 3.8Å; P2168-L2312 HydrophobicContact CG-CD2 3.61Å; P2168-P2354 HydrophobicContact CG-CB 3.47Å; P2168-P2354 VanDerWaalsContact CG-CB 3.47Å; P2168-P2354 HydrophobicContact CG-CG 4.11Å
2169	E	57.3	Low	73.6	Confident	103 Å²	103	39.9 Å²	39.9	48%	0.481	20%	0.196	S	C	.	.	S	Bend	trans	-80.6	-24.5	161.6	-63.1	-171	150	0	0	111.2	R2171 G2172 R2174	E2169-R2171 PolarHBondContact O-N 3.14Å; E2169-G2172 WeakPolarHBondContact O-CA 3.32Å; E2169-G2172 PolarHBondContact O-N 2.8Å; E2169-R2174 HydrophobicContact CG-CB 4.23Å; E2169-R2174 VanDerWaalsContact CG-CZ 3.45Å; E2169-R2174 WeakPolarHBondContact OE1-CD 3.42Å; E2169-R2174 IonicContact OE1-CZ 2.82Å; E2169-R2174 IonicContact OE1-NE 3.18Å; E2169-R2174 IonicContact OE1-NH1 3.67Å; E2169-R2174 PolarHBondContact OE1-NH1 2.84Å; E2169-R2174 IonicContact OE2-NH1 3.37Å
2170	T	52.3	Low	73.7	Confident	12 Å²	12	38.3 Å²	38.3	7%	0.074	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-54.4	139	175.4	45.4	0	0	0	0	112.5	P2168 G2172 L2173 Y2311 E2314	P2168-T2170 WeakPolarHBondContact CB-OG1 3.31Å; T2170-G2172 PolarHBondContact O-N 2.63Å; T2170-L2173 PolarHBondContact O-N 2.89Å; T2170-Y2311 VanDerWaalsContact CB-O 3.3Å; T2170-Y2311 WeakPolarHBondContact CB-O 3.4Å; T2170-Y2311 WeakPolarHBondContact CG2-O 3.33Å; T2170-Y2311 PolarHBondContact OG1-O 2.87Å; T2170-E2314 VanDerWaalsContact CA-OE1 3.29Å; T2170-E2314 WeakPolarHBondContact CA-OE1 3.3Å; T2170-E2314 HydrophobicContact CG2-CB 4.13Å; T2170-E2314 HydrophobicContact CG2-CG 3.71Å; T2170-E2314 WeakPolarHBondContact CG2-OE1 3.45Å
2171	R	61	Low	73.9	Confident	123 Å²	123	35.6 Å²	35.6	46%	0.464	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	58.8	5.3	-172.2	-44.4	-64.7	-170.7	143.1	15.3	114.5	E2169 L2268 K2271	E2169-R2171 PolarHBondContact O-N 3.14Å; R2171-L2268 HydrophobicContact CB-CD2 3.73Å; R2171-L2268 HydrophobicContact CG-CD2 4.24Å; R2171-K2271 PolarHBondContact NH2-O 3.08Å
2172	G	65.9	Low	74.1	Confident	22 Å²	22	36.1 Å²	36.1	23%	0.227	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	79.5	25.9	-178.8	0	0	0	0	0	114.7	E2169 T2170 S2175 K2176	E2169-G2172 WeakPolarHBondContact O-CA 3.32Å; E2169-G2172 PolarHBondContact O-N 2.8Å; T2170-G2172 PolarHBondContact O-N 2.63Å; G2172-S2175 WeakPolarHBondContact CA-OG 3.47Å; G2172-S2175 PolarHBondContact O-OG 3.43Å; G2172-K2176 WeakPolarHBondContact O-CB 3.24Å; G2172-K2176 PolarHBondContact O-N 3.39Å
2173	L	73.7	Confident	74.6	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-50.8	-177.1	-82.5	166.2	0	0	0	112.5	P2168 T2170 K2176 F2177 L2268 P2354 F2358	P2168-L2173 HydrophobicContact CB-CD1 4.34Å; P2168-L2173 HydrophobicContact CG-CD1 3.78Å; P2168-L2173 WeakPolarHBondContact O-CB 3.2Å; T2170-L2173 PolarHBondContact O-N 2.89Å; L2173-K2176 PolarHBondContact O-N 2.71Å; L2173-F2177 WeakPolarHBondContact O-CB 3.45Å; L2173-F2177 PolarHBondContact O-N 3Å; L2173-L2268 HydrophobicContact CD2-CD1 3.75Å; L2173-P2354 HydrophobicContact CD1-CB 4.35Å; L2173-F2358 HydrophobicContact CB-CD2 4.47Å; L2173-F2358 HydrophobicContact CD2-CB 4.01Å; L2173-F2358 HydrophobicContact CD2-CD1 4.36Å; L2173-F2358 HydrophobicContact CD2-CD2 3.57Å; L2173-F2358 HydrophobicContact CD2-CE2 4.1Å; L2173-F2358 HydrophobicContact CD2-CG 3.72Å
2174	R	77.8	Confident	75.1	Confident	44 Å²	44	37.7 Å²	37.7	17%	0.166	20%	0.2	C	C	.	.	H	α-helix	trans	-56.8	-51.5	174.2	179.9	178.7	-56.3	172.1	2	112.8	A2164 R2165 L2167 P2168 E2169 K2176 F2177 Q2178	A2164-R2174 HydrophobicContact CB-CG 4.48Å; A2164-R2174 WeakPolarHBondContact O-CG 3.47Å; A2164-R2174 PolarHBondContact O-NE 3.06Å; A2164-R2174 VanDerWaalsContact O-NE 3.14Å; R2165-R2174 PolarHBondContact O-NH2 2.88Å; L2167-R2174 PolarHBondContact O-NE 2.98Å; L2167-R2174 PolarHBondContact O-NH2 2.92Å; P2168-R2174 WeakPolarHBondContact O-CB 3.36Å; P2168-R2174 PolarHBondContact O-N 2.98Å; E2169-R2174 HydrophobicContact CG-CB 4.23Å; E2169-R2174 VanDerWaalsContact CG-CZ 3.45Å; E2169-R2174 WeakPolarHBondContact OE1-CD 3.42Å; E2169-R2174 IonicContact OE1-CZ 2.82Å; E2169-R2174 IonicContact OE1-NE 3.18Å; E2169-R2174 IonicContact OE1-NH1 3.67Å; E2169-R2174 PolarHBondContact OE1-NH1 2.84Å; E2169-R2174 IonicContact OE2-NH1 3.37Å; R2174-K2176 VanDerWaalsContact C-N 3.32Å; R2174-K2176 PolarHBondContact O-N 2.78Å; R2174-F2177 WeakPolarHBondContact O-CB 3.39Å; R2174-F2177 PolarHBondContact O-N 2.87Å; R2174-Q2178 PolarHBondContact O-N 3.23Å
2175	S	75.6	Confident	75.7	Confident	65 Å²	65	37.7 Å²	37.7	46%	0.455	20%	0.199	S	C	.	.	H	α-helix	trans	-65.1	-35.1	-179.2	54.7	0	0	0	0	112.3	G2172 S2179	G2172-S2175 WeakPolarHBondContact CA-OG 3.47Å; G2172-S2175 PolarHBondContact O-OG 3.43Å; S2175-S2179 VanDerWaalsContact O-CB 3.31Å; S2175-S2179 WeakPolarHBondContact O-CB 3.46Å; S2175-S2179 PolarHBondContact O-N 3.45Å; S2175-S2179 PolarHBondContact O-OG 2.78Å
2176	K	82.5	Confident	76.6	Confident	55 Å²	55	36.3 Å²	36.3	24%	0.239	20%	0.198	C	C	.	.	H	α-helix	trans	-76.1	-33.4	177.4	-173.2	53.6	176.7	167.3	0	112.3	G2172 L2173 R2174 S2179 L2180 E2260 L2264	G2172-K2176 WeakPolarHBondContact O-CB 3.24Å; G2172-K2176 PolarHBondContact O-N 3.39Å; L2173-K2176 PolarHBondContact O-N 2.71Å; R2174-K2176 VanDerWaalsContact C-N 3.32Å; R2174-K2176 PolarHBondContact O-N 2.78Å; K2176-S2179 PolarHBondContact O-N 2.7Å; K2176-L2180 HydrophobicContact CD-CD1 4.14Å; K2176-L2180 HydrophobicContact CD-CG 3.96Å; K2176-L2180 HydrophobicContact CG-CD1 3.97Å; K2176-L2180 HydrophobicContact CG-CG 4.31Å; K2176-L2180 WeakPolarHBondContact O-CB 3.42Å; K2176-L2180 WeakPolarHBondContact O-CD1 3.34Å; K2176-L2180 WeakPolarHBondContact O-CG 3.37Å; K2176-L2180 PolarHBondContact O-N 3.38Å; K2176-E2260 VanDerWaalsContact CE-OE2 3.27Å; K2176-E2260 WeakPolarHBondContact CE-OE2 3.19Å; K2176-E2260 IonicContact NZ-OE2 3.42Å; K2176-E2260 PolarHBondContact NZ-OE2 2.98Å; K2176-L2264 HydrophobicContact CG-CD1 4.29Å; K2176-L2264 HydrophobicContact CG-CD2 3.6Å
2177	F	85.7	Confident	77.6	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-56.6	-52.5	167.9	174	-85.6	0	0	0	110.1	W2161 L2163 A2164 L2167 L2173 R2174 S2179 L2180 L2181 F2358 L2362 V2365	W2161-F2177 HydrophobicContact CB-CE1 4.19Å; W2161-F2177 HydrophobicContact CD2-CE1 4.37Å; W2161-F2177 HydrophobicContact CG-CE1 4.06Å; L2163-F2177 HydrophobicContact CD1-CE1 4.11Å; L2163-F2177 HydrophobicContact CD1-CE2 3.94Å; L2163-F2177 HydrophobicContact CD1-CZ 3.45Å; L2163-F2177 VanDerWaalsContact CD1-CZ 3.45Å; L2163-F2177 HydrophobicContact CG-CZ 4.44Å; A2164-F2177 HydrophobicContact CB-CD1 3.57Å; A2164-F2177 HydrophobicContact CB-CE1 3.7Å; A2164-F2177 HydrophobicContact CB-CG 4.47Å; L2167-F2177 HydrophobicContact CD1-CB 3.86Å; L2167-F2177 HydrophobicContact CD1-CD1 4.42Å; L2167-F2177 HydrophobicContact CD1-CD2 3.64Å; L2167-F2177 HydrophobicContact CD1-CE2 4.31Å; L2167-F2177 HydrophobicContact CD1-CG 3.72Å; L2173-F2177 WeakPolarHBondContact O-CB 3.45Å; L2173-F2177 PolarHBondContact O-N 3Å; R2174-F2177 WeakPolarHBondContact O-CB 3.39Å; R2174-F2177 PolarHBondContact O-N 2.87Å; F2177-S2179 PolarHBondContact O-N 2.72Å; F2177-L2180 PolarHBondContact O-N 2.97Å; F2177-L2181 HydrophobicContact CD1-CD1 4.07Å; F2177-L2181 HydrophobicContact CE1-CD1 3.4Å; F2177-L2181 HydrophobicContact CE1-CG 4.49Å; F2177-L2181 HydrophobicContact CE2-CD1 4.26Å; F2177-L2181 HydrophobicContact CZ-CD1 3.5Å; F2177-L2181 PolarHBondContact O-N 3.18Å; F2177-L2181 VanDerWaalsContact O-N 3.16Å; F2177-F2358 HydrophobicContact CB-CD2 4.28Å; F2177-F2358 HydrophobicContact CB-CE2 3.88Å; F2177-L2362 HydrophobicContact CD2-CB 4.07Å; F2177-L2362 HydrophobicContact CD2-CD1 3.87Å; F2177-L2362 HydrophobicContact CE2-CB 4.11Å; F2177-L2362 HydrophobicContact CE2-CD1 3.96Å; F2177-V2365 HydrophobicContact CZ-CG2 4.25Å
2178	Q	85.7	Confident	78.5	Confident	72 Å²	72	34.6 Å²	34.6	34%	0.336	20%	0.195	S	C	.	.	H	α-helix	trans	-62	-45.8	178	-68.8	173.4	-60.6	0	0	112	M2159 R2174 L2180 L2181 A2182	M2159-Q2178 HydrophobicContact CE-CB 3.92Å; M2159-Q2178 HydrophobicContact CE-CG 4.17Å; R2174-Q2178 PolarHBondContact O-N 3.23Å; Q2178-L2180 VanDerWaalsContact C-N 3.31Å; Q2178-L2180 PolarHBondContact O-N 2.96Å; Q2178-L2181 PolarHBondContact O-N 3.33Å; Q2178-A2182 WeakPolarHBondContact O-CB 3.45Å; Q2178-A2182 PolarHBondContact O-N 3.45Å
2179	S	84.6	Confident	79.7	Confident	71 Å²	71	34.5 Å²	34.5	50%	0.497	19%	0.194	S	C	.	.	H	α-helix	trans	-64.7	-31.9	-179.9	-56.8	0	0	0	0	113.4	S2175 K2176 F2177 G2183	S2175-S2179 VanDerWaalsContact O-CB 3.31Å; S2175-S2179 WeakPolarHBondContact O-CB 3.46Å; S2175-S2179 PolarHBondContact O-N 3.45Å; S2175-S2179 PolarHBondContact O-OG 2.78Å; K2176-S2179 PolarHBondContact O-N 2.7Å; F2177-S2179 PolarHBondContact O-N 2.72Å; S2179-G2183 PolarHBondContact O-N 3.49Å
2180	L	85.9	Confident	81.2	Confident	11 Å²	11	32.5 Å²	32.5	6%	0.058	19%	0.186	C	C	.	.	H	α-helix	trans	-72.4	-43.1	176.3	-76.3	165.6	0	0	0	111.4	K2176 F2177 Q2178 G2183 Y2184 L2257 L2261 L2264 F2358 L2362	K2176-L2180 HydrophobicContact CD-CD1 4.14Å; K2176-L2180 HydrophobicContact CD-CG 3.96Å; K2176-L2180 HydrophobicContact CG-CD1 3.97Å; K2176-L2180 HydrophobicContact CG-CG 4.31Å; K2176-L2180 WeakPolarHBondContact O-CB 3.42Å; K2176-L2180 WeakPolarHBondContact O-CD1 3.34Å; K2176-L2180 WeakPolarHBondContact O-CG 3.37Å; K2176-L2180 PolarHBondContact O-N 3.38Å; F2177-L2180 PolarHBondContact O-N 2.97Å; Q2178-L2180 VanDerWaalsContact C-N 3.31Å; Q2178-L2180 PolarHBondContact O-N 2.96Å; L2180-G2183 PolarHBondContact O-N 3.37Å; L2180-Y2184 WeakPolarHBondContact O-CB 3.32Å; L2180-Y2184 PolarHBondContact O-N 3.25Å; L2180-L2257 HydrophobicContact CD2-CD1 3.93Å; L2180-L2261 HydrophobicContact CD1-CD2 3.84Å; L2180-L2264 HydrophobicContact CD1-CD2 4.26Å; L2180-F2358 HydrophobicContact CD1-CZ 4.04Å; L2180-L2362 HydrophobicContact CD1-CD2 3.86Å
2181	L	87.8	Confident	82.8	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-66.4	-41.1	175.1	-67.8	179.2	0	0	0	112.1	M2159 W2161 F2177 Q2178 Y2184 L2185 L2362 V2365 L2366	M2159-L2181 HydrophobicContact CE-CB 4.24Å; W2161-L2181 HydrophobicContact CD2-CD1 4.25Å; W2161-L2181 HydrophobicContact CZ2-CD1 4.14Å; F2177-L2181 HydrophobicContact CD1-CD1 4.07Å; F2177-L2181 HydrophobicContact CE1-CD1 3.4Å; F2177-L2181 HydrophobicContact CE1-CG 4.49Å; F2177-L2181 HydrophobicContact CE2-CD1 4.26Å; F2177-L2181 HydrophobicContact CZ-CD1 3.5Å; F2177-L2181 PolarHBondContact O-N 3.18Å; F2177-L2181 VanDerWaalsContact O-N 3.16Å; Q2178-L2181 PolarHBondContact O-N 3.33Å; L2181-Y2184 PolarHBondContact O-N 2.8Å; L2181-L2185 WeakPolarHBondContact O-CB 3.21Å; L2181-L2185 PolarHBondContact O-N 3.47Å; L2181-L2362 HydrophobicContact CD2-CD1 3.81Å; L2181-L2362 HydrophobicContact CG-CD1 3.97Å; L2181-V2365 HydrophobicContact CD1-CG1 3.83Å; L2181-V2365 HydrophobicContact CD2-CG1 3.73Å; L2181-V2365 HydrophobicContact CG-CG1 4.47Å; L2181-L2366 HydrophobicContact CD2-CD2 3.95Å; L2181-L2366 HydrophobicContact CD2-CG 4.33Å
2182	A	86.2	Confident	84	Confident	19 Å²	19	27.2 Å²	27.2	16%	0.157	17%	0.169	C	C	.	.	H	α-helix	trans	-60.6	-46.3	173.5	0	0	0	0	0	111.9	L2157 M2159 Q2178 L2185 L2186	L2157-A2182 HydrophobicContact CD2-CB 3.48Å; L2157-A2182 VanDerWaalsContact CD2-CB 3.48Å; M2159-A2182 HydrophobicContact SD-CB 3.84Å; Q2178-A2182 WeakPolarHBondContact O-CB 3.45Å; Q2178-A2182 PolarHBondContact O-N 3.45Å; A2182-L2185 PolarHBondContact O-N 3.36Å; A2182-L2186 WeakPolarHBondContact O-CB 3.09Å; A2182-L2186 VanDerWaalsContact O-CG 3.27Å; A2182-L2186 WeakPolarHBondContact O-CG 3.33Å; A2182-L2186 PolarHBondContact O-N 3.47Å
2183	G	86.8	Confident	84.9	Confident	40 Å²	40	27.1 Å²	27.1	41%	0.412	16%	0.162	S	C	.	.	H	α-helix	trans	-62.8	-40.9	176.9	0	0	0	0	0	113	S2179 L2180 A2187	S2179-G2183 PolarHBondContact O-N 3.49Å; L2180-G2183 PolarHBondContact O-N 3.37Å; G2183-A2187 WeakPolarHBondContact O-CB 3.45Å; G2183-A2187 PolarHBondContact O-N 3.43Å
2184	Y	87.1	Confident	85.4	Confident	3 Å²	3	31.5 Å²	31.5	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-62.9	-53.8	174.5	169.6	-112.6	0	0	0	111.7	L1902 I2099 L2180 L2181 L2186 A2187 I2188 E2249 L2252 F2253 L2366	L1902-Y2184 HydrophobicContact CD1-CE1 4.14Å; L1902-Y2184 WeakPolarHBondContact CD1-OH 3.42Å; I2099-Y2184 HydrophobicContact CD1-CD1 4.02Å; I2099-Y2184 HydrophobicContact CD1-CE1 3.79Å; L2180-Y2184 WeakPolarHBondContact O-CB 3.32Å; L2180-Y2184 PolarHBondContact O-N 3.25Å; L2181-Y2184 PolarHBondContact O-N 2.8Å; Y2184-L2186 PolarHBondContact O-N 3.45Å; Y2184-A2187 PolarHBondContact O-N 3.32Å; Y2184-A2187 VanDerWaalsContact O-N 3.16Å; Y2184-I2188 HydrophobicContact CD2-CD1 4.48Å; Y2184-I2188 HydrophobicContact CD2-CG1 3.87Å; Y2184-I2188 HydrophobicContact CE2-CD1 3.97Å; Y2184-I2188 HydrophobicContact CE2-CG1 3.47Å; Y2184-I2188 VanDerWaalsContact CE2-CG1 3.47Å; Y2184-I2188 WeakPolarHBondContact O-CG1 3.47Å; Y2184-I2188 PolarHBondContact O-N 3.42Å; Y2184-E2249 WeakPolarHBondContact CE2-OE1 3.41Å; Y2184-E2249 PolarHBondContact OH-OE1 3.27Å; Y2184-L2252 HydrophobicContact CD2-CD2 3.91Å; Y2184-L2252 HydrophobicContact CE2-CD2 4.47Å; Y2184-F2253 HydrophobicContact CD2-CE2 4.48Å; Y2184-F2253 HydrophobicContact CD2-CZ 4.12Å; Y2184-F2253 HydrophobicContact CE2-CE1 4.49Å; Y2184-F2253 AromaticContact CE2-CE2 3.67Å; Y2184-F2253 HydrophobicContact CE2-CE2 3.67Å; Y2184-F2253 AromaticContact CE2-CZ 3.52Å; Y2184-F2253 HydrophobicContact CE2-CZ 3.52Å; Y2184-F2253 AromaticContact CZ-CZ 3.94Å; Y2184-L2366 HydrophobicContact CD1-CD2 3.87Å; Y2184-L2366 HydrophobicContact CE1-CD2 4.11Å; Y2184-L2366 HydrophobicContact CG-CD2 4.16Å
2185	L	87.7	Confident	85.6	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-54.8	-49	177.8	-85.4	166.2	0	0	0	112.1	Q2097 I2099 A2107 L2157 L2181 A2182 A2187 I2188 Y2189	Q2097-L2185 HydrophobicContact CG-CD2 4.15Å; I2099-L2185 HydrophobicContact CD1-CD1 4.15Å; I2099-L2185 HydrophobicContact CD1-CD2 3.6Å; I2099-L2185 HydrophobicContact CD1-CG 3.75Å; I2099-L2185 HydrophobicContact CG1-CD2 3.9Å; A2107-L2185 HydrophobicContact CB-CD1 3.58Å; L2157-L2185 HydrophobicContact CD1-CB 4.27Å; L2157-L2185 HydrophobicContact CD1-CD1 4.01Å; L2181-L2185 WeakPolarHBondContact O-CB 3.21Å; L2181-L2185 PolarHBondContact O-N 3.47Å; A2182-L2185 PolarHBondContact O-N 3.36Å; L2185-A2187 PolarHBondContact O-N 3.17Å; L2185-I2188 PolarHBondContact O-N 2.98Å; L2185-Y2189 WeakPolarHBondContact O-CB 3.39Å; L2185-Y2189 PolarHBondContact O-N 3.49Å
2186	L	88.1	Confident	85.8	Confident	54 Å²	54	28.8 Å²	28.8	28%	0.283	17%	0.167	S	C	.	.	H	α-helix	trans	-68.1	-32.9	179.9	-68.5	171.3	0	0	0	112.7	P2155 L2157 A2182 Y2184 N2190	P2155-L2186 HydrophobicContact CB-CD2 4.31Å; P2155-L2186 HydrophobicContact CG-CD2 3.6Å; L2157-L2186 HydrophobicContact CD2-CD1 4.49Å; A2182-L2186 WeakPolarHBondContact O-CB 3.09Å; A2182-L2186 VanDerWaalsContact O-CG 3.27Å; A2182-L2186 WeakPolarHBondContact O-CG 3.33Å; A2182-L2186 PolarHBondContact O-N 3.47Å; Y2184-L2186 PolarHBondContact O-N 3.45Å; L2186-N2190 WeakPolarHBondContact O-CB 3.41Å; L2186-N2190 PolarHBondContact O-N 2.88Å; L2186-N2190 VanDerWaalsContact O-N 3.16Å; L2186-N2190 PolarHBondContact O-ND2 3.39Å
2187	A	87.9	Confident	85.7	Confident	17 Å²	17	29 Å²	29	14%	0.14	17%	0.167	C	C	.	.	H	α-helix	trans	-69.4	-45.5	176	0	0	0	0	0	112	G2183 Y2184 L2185 A2191 Y2248 L2252	G2183-A2187 WeakPolarHBondContact O-CB 3.45Å; G2183-A2187 PolarHBondContact O-N 3.43Å; Y2184-A2187 PolarHBondContact O-N 3.32Å; Y2184-A2187 VanDerWaalsContact O-N 3.16Å; L2185-A2187 PolarHBondContact O-N 3.17Å; A2187-A2191 WeakPolarHBondContact O-CB 3.46Å; A2187-A2191 PolarHBondContact O-N 2.79Å; A2187-Y2248 HydrophobicContact CB-CE1 4.35Å; A2187-L2252 HydrophobicContact CB-CD1 4.09Å; A2187-L2252 HydrophobicContact CB-CD2 3.66Å
2188	I	87.6	Confident	85.3	Confident	6 Å²	6	36.3 Å²	36.3	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-67.4	-45.7	176.9	-60.6	-56.3	0	0	0	110.7	Y2184 L2185 N2190 A2191 V2192 E2249 L2252	Y2184-I2188 HydrophobicContact CD2-CD1 4.48Å; Y2184-I2188 HydrophobicContact CD2-CG1 3.87Å; Y2184-I2188 HydrophobicContact CE2-CD1 3.97Å; Y2184-I2188 HydrophobicContact CE2-CG1 3.47Å; Y2184-I2188 VanDerWaalsContact CE2-CG1 3.47Å; Y2184-I2188 WeakPolarHBondContact O-CG1 3.47Å; Y2184-I2188 PolarHBondContact O-N 3.42Å; L2185-I2188 PolarHBondContact O-N 2.98Å; I2188-N2190 VanDerWaalsContact C-N 3.32Å; I2188-N2190 PolarHBondContact O-N 2.92Å; I2188-A2191 WeakPolarHBondContact O-CB 3.36Å; I2188-A2191 PolarHBondContact O-N 2.82Å; I2188-V2192 HydrophobicContact CG2-CG2 4.22Å; I2188-V2192 WeakPolarHBondContact O-CG2 3.3Å; I2188-V2192 PolarHBondContact O-N 2.92Å; I2188-E2249 HydrophobicContact CD1-CB 3.74Å; I2188-E2249 HydrophobicContact CD1-CG 3.78Å; I2188-L2252 HydrophobicContact CD1-CD2 3.85Å; I2188-L2252 HydrophobicContact CG1-CD2 4.28Å
2189	Y	87.2	Confident	84.7	Confident	4 Å²	4	34.2 Å²	34.2	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-52.7	-48.5	176.6	178	-114.3	0	0	0	112.3	R2096 V2109 E2123 W2124 P2155 L2185 V2192 R2193	R2096-Y2189 HydrophobicContact CB-CE2 3.96Å; R2096-Y2189 VanDerWaalsContact CD-CE2 3.48Å; R2096-Y2189 WeakPolarHBondContact CD-OH 3.45Å; R2096-Y2189 HydrophobicContact CG-CE2 4.39Å; R2096-Y2189 PolarHBondContact NE-OH 2.9Å; V2109-Y2189 HydrophobicContact CB-CD2 4.35Å; V2109-Y2189 HydrophobicContact CB-CG 4.49Å; V2109-Y2189 HydrophobicContact CG1-CD1 4.25Å; V2109-Y2189 HydrophobicContact CG1-CD2 4.26Å; V2109-Y2189 HydrophobicContact CG1-CE1 4.1Å; V2109-Y2189 HydrophobicContact CG1-CE2 4.12Å; V2109-Y2189 HydrophobicContact CG1-CG 4.34Å; V2109-Y2189 HydrophobicContact CG2-CD1 4.41Å; V2109-Y2189 HydrophobicContact CG2-CD2 4.31Å; V2109-Y2189 HydrophobicContact CG2-CG 4.03Å; E2123-Y2189 PolarHBondContact OE1-OH 3.26Å; W2124-Y2189 HydrophobicContact CZ2-CD2 4.47Å; W2124-Y2189 AromaticContact CZ2-CE2 3.7Å; W2124-Y2189 HydrophobicContact CZ2-CE2 3.7Å; W2124-Y2189 AromaticContact NE1-CZ 3.92Å; W2124-Y2189 PolarHBondContact NE1-OH 3.28Å; P2155-Y2189 HydrophobicContact CB-CD1 4.28Å; P2155-Y2189 HydrophobicContact CB-CE1 3.93Å; P2155-Y2189 HydrophobicContact CG-CD1 4.45Å; P2155-Y2189 HydrophobicContact CG-CE1 4.39Å; L2185-Y2189 WeakPolarHBondContact O-CB 3.39Å; L2185-Y2189 PolarHBondContact O-N 3.49Å; Y2189-V2192 PolarHBondContact O-N 3.36Å; Y2189-R2193 VanDerWaalsContact O-CB 3.26Å; Y2189-R2193 WeakPolarHBondContact O-CB 3.21Å; Y2189-R2193 PolarHBondContact O-N 2.86Å
2190	N	87	Confident	84	Confident	61 Å²	61	33.4 Å²	33.4	33%	0.326	18%	0.175	S	C	.	.	H	α-helix	trans	-68.7	-32.5	177.8	-76.6	-58.6	0	0	0	112.9	L2186 I2188 N2194	L2186-N2190 WeakPolarHBondContact O-CB 3.41Å; L2186-N2190 PolarHBondContact O-N 2.88Å; L2186-N2190 VanDerWaalsContact O-N 3.16Å; L2186-N2190 PolarHBondContact O-ND2 3.39Å; I2188-N2190 VanDerWaalsContact C-N 3.32Å; I2188-N2190 PolarHBondContact O-N 2.92Å; N2190-N2194 VanDerWaalsContact O-CB 3.28Å; N2190-N2194 WeakPolarHBondContact O-CB 2.87Å; N2190-N2194 VanDerWaalsContact O-CG 3.22Å; N2190-N2194 PolarHBondContact O-N 3.32Å; N2190-N2194 PolarHBondContact O-ND2 2.91Å
2191	A	86.1	Confident	83.2	Confident	14 Å²	14	36 Å²	36	12%	0.116	19%	0.186	C	C	.	.	H	α-helix	trans	-64.9	-48.6	174	0	0	0	0	0	111.8	A2187 I2188 N2194 E2195 V2245 Y2248	A2187-A2191 WeakPolarHBondContact O-CB 3.46Å; A2187-A2191 PolarHBondContact O-N 2.79Å; I2188-A2191 WeakPolarHBondContact O-CB 3.36Å; I2188-A2191 PolarHBondContact O-N 2.82Å; A2191-N2194 PolarHBondContact O-N 3.16Å; A2191-E2195 PolarHBondContact O-N 2.85Å; A2191-V2245 HydrophobicContact CB-CG2 4.36Å; A2191-Y2248 HydrophobicContact CB-CD1 3.48Å; A2191-Y2248 VanDerWaalsContact CB-CD1 3.48Å; A2191-Y2248 HydrophobicContact CB-CE1 3.78Å; A2191-Y2248 HydrophobicContact CB-CG 4.01Å
2192	V	87.3	Confident	81.9	Confident	10 Å²	10	38.5 Å²	38.5	6%	0.061	20%	0.204	C	C	.	.	H	α-helix	trans	-61.2	-47.4	177.3	-178.1	0	0	0	0	111	W2124 I2188 Y2189 N2194 E2195 H2196 A2239 T2240 V2245	W2124-V2192 HydrophobicContact CH2-CG1 3.92Å; W2124-V2192 HydrophobicContact CZ3-CG1 4.48Å; I2188-V2192 HydrophobicContact CG2-CG2 4.22Å; I2188-V2192 WeakPolarHBondContact O-CG2 3.3Å; I2188-V2192 PolarHBondContact O-N 2.92Å; Y2189-V2192 PolarHBondContact O-N 3.36Å; V2192-N2194 VanDerWaalsContact C-N 3.32Å; V2192-N2194 PolarHBondContact O-N 2.87Å; V2192-E2195 PolarHBondContact O-N 3.35Å; V2192-H2196 VanDerWaalsContact O-CB 3.28Å; V2192-H2196 WeakPolarHBondContact O-CB 3.49Å; V2192-H2196 PolarHBondContact O-N 2.71Å; V2192-A2239 HydrophobicContact CG1-CB 4.01Å; V2192-T2240 HydrophobicContact CG1-CG2 3.84Å; V2192-V2245 HydrophobicContact CG2-CG1 3.87Å; V2192-V2245 HydrophobicContact CG2-CG2 4.19Å
2193	R	84.4	Confident	80.6	Confident	19 Å²	19	41.6 Å²	41.6	7%	0.072	22%	0.217	C	C	.	.	H	α-helix	trans	-59.6	-40.3	178.7	-175.1	177.5	175	-163.1	2.9	112.4	E2123 W2124 Y2189 R2197	E2123-R2193 VanDerWaalsContact CG-CZ 3.5Å; E2123-R2193 VanDerWaalsContact O-CZ 3.29Å; E2123-R2193 PolarHBondContact O-NE 3.46Å; E2123-R2193 PolarHBondContact O-NH2 3.49Å; E2123-R2193 IonicContact OE1-CZ 3.18Å; E2123-R2193 IonicContact OE1-NH1 3.62Å; W2124-R2193 HydrophobicContact CD2-CG 4.19Å; W2124-R2193 HydrophobicContact CH2-CB 4.07Å; W2124-R2193 HydrophobicContact CZ2-CB 3.9Å; W2124-R2193 HydrophobicContact CZ2-CG 4.2Å; W2124-R2193 HydrophobicContact CZ3-CB 4.49Å; Y2189-R2193 VanDerWaalsContact O-CB 3.26Å; Y2189-R2193 WeakPolarHBondContact O-CB 3.21Å; Y2189-R2193 PolarHBondContact O-N 2.86Å; R2193-R2197 WeakPolarHBondContact O-CB 3.45Å; R2193-R2197 PolarHBondContact O-N 3.04Å
2194	N	83.7	Confident	79.1	Confident	95 Å²	95	45.7 Å²	45.7	51%	0.508	22%	0.223	S	C	.	.	H	α-helix	trans	-71.3	-44.5	177.5	-76.9	-39	0	0	0	112.8	N2190 A2191 V2192 R2197 R2198	N2190-N2194 VanDerWaalsContact O-CB 3.28Å; N2190-N2194 WeakPolarHBondContact O-CB 2.87Å; N2190-N2194 VanDerWaalsContact O-CG 3.22Å; N2190-N2194 PolarHBondContact O-N 3.32Å; N2190-N2194 PolarHBondContact O-ND2 2.91Å; A2191-N2194 PolarHBondContact O-N 3.16Å; V2192-N2194 VanDerWaalsContact C-N 3.32Å; V2192-N2194 PolarHBondContact O-N 2.87Å; N2194-R2197 PolarHBondContact O-N 3.32Å; N2194-R2198 PolarHBondContact O-N 3.02Å
2195	E	82.2	Confident	77.2	Confident	29 Å²	29	50 Å²	50	14%	0.136	25%	0.253	C	S	.	.	H	α-helix	trans	-69.7	-36.4	178.2	-169.7	72.9	170.4	0	0	111.3	A2191 V2192 R2197 R2198 L2199 V2245	A2191-E2195 PolarHBondContact O-N 2.85Å; V2192-E2195 PolarHBondContact O-N 3.35Å; E2195-R2197 PolarHBondContact O-N 2.88Å; E2195-R2198 CarbonylContact O-C 3.58Å; E2195-R2198 WeakPolarHBondContact O-CB 3.43Å; E2195-R2198 PolarHBondContact O-N 2.71Å; E2195-R2198 VanDerWaalsContact O-N 3.13Å; E2195-R2198 IonicContact OE1-NH1 2.88Å; E2195-R2198 PolarHBondContact OE1-NH1 3.18Å; E2195-R2198 VanDerWaalsContact OE1-NH1 3.1Å; E2195-R2198 WeakPolarHBondContact OE2-CD 3.36Å; E2195-R2198 IonicContact OE2-CZ 3.52Å; E2195-R2198 IonicContact OE2-NE 3.91Å; E2195-R2198 IonicContact OE2-NH1 3.72Å; E2195-R2198 PolarHBondContact OE2-NH1 3.32Å; E2195-L2199 HydrophobicContact CG-CD1 4.09Å; E2195-L2199 HydrophobicContact CG-CG 4.29Å; E2195-L2199 WeakPolarHBondContact O-CB 3.41Å; E2195-L2199 VanDerWaalsContact O-CG 3.25Å; E2195-L2199 WeakPolarHBondContact O-CG 3.1Å; E2195-L2199 PolarHBondContact O-N 3.32Å; E2195-V2245 HydrophobicContact CB-CG2 3.92Å; E2195-V2245 HydrophobicContact CG-CG2 4.45Å
2196	H	81.1	Confident	75.1	Confident	23 Å²	23	54.8 Å²	54.8	11%	0.106	29%	0.287	C	S	.	.	H	α-helix	trans	-59.1	-45.6	173.1	-171.9	-97.3	0	0	0	112.1	E2061 W2124 V2192 R2198 L2199 I2200 A2239	E2061-H2196 IonicContact OE1-CE1 3.99Å; E2061-H2196 PolarHBondContact OE1-CE1 3.16Å; W2124-H2196 HydrophobicContact CE3-CB 4Å; W2124-H2196 AromaticContact CE3-CG 3.78Å; W2124-H2196 AromaticContact CE3-ND1 3.48Å; W2124-H2196 HydrophobicContact CZ3-CB 3.54Å; W2124-H2196 AromaticContact CZ3-CG 3.6Å; W2124-H2196 AromaticContact CZ3-ND1 3.83Å; V2192-H2196 VanDerWaalsContact O-CB 3.28Å; V2192-H2196 WeakPolarHBondContact O-CB 3.49Å; V2192-H2196 PolarHBondContact O-N 2.71Å; H2196-R2198 VanDerWaalsContact C-N 3.34Å; H2196-R2198 PolarHBondContact O-N 3.17Å; H2196-L2199 PolarHBondContact O-N 3.01Å; H2196-I2200 VanDerWaalsContact CE1-CD1 3.43Å; H2196-I2200 WeakPolarHBondContact CE1-CD1 3.36Å; H2196-I2200 PolarHBondContact O-N 2.84Å; H2196-A2239 HydrophobicContact CB-CB 3.65Å
2197	R	78.9	Confident	72.8	Confident	60 Å²	60	58.6 Å²	58.6	23%	0.226	31%	0.306	C	S	.	.	H	α-helix	trans	-59.2	-44.3	173.1	178.9	174.3	-73.1	155.9	-6.5	111.3	G2125 R2193 N2194 E2195 L2199 I2200 E2201	G2125-R2197 PolarHBondContact O-NH2 3.42Å; R2193-R2197 WeakPolarHBondContact O-CB 3.45Å; R2193-R2197 PolarHBondContact O-N 3.04Å; N2194-R2197 PolarHBondContact O-N 3.32Å; E2195-R2197 PolarHBondContact O-N 2.88Å; R2197-L2199 PolarHBondContact O-N 3.4Å; R2197-I2200 PolarHBondContact O-N 3.37Å; R2197-E2201 VanDerWaalsContact CG-OE1 3.24Å; R2197-E2201 WeakPolarHBondContact CG-OE1 3.35Å; R2197-E2201 WeakPolarHBondContact O-CB 3.36Å; R2197-E2201 VanDerWaalsContact O-CG 3.29Å; R2197-E2201 WeakPolarHBondContact O-CG 3.45Å; R2197-E2201 PolarHBondContact O-N 2.86Å
2198	R	78.2	Confident	70.3	Confident	154 Å²	154	64.3 Å²	64.3	58%	0.581	34%	0.335	S	S	*	.	H	α-helix	trans	-61.9	-39.5	176	-172.9	-161.7	-176.4	-175	-0.7	113	N2194 E2195 H2196 E2201 S2202	N2194-R2198 PolarHBondContact O-N 3.02Å; E2195-R2198 CarbonylContact O-C 3.58Å; E2195-R2198 WeakPolarHBondContact O-CB 3.43Å; E2195-R2198 PolarHBondContact O-N 2.71Å; E2195-R2198 VanDerWaalsContact O-N 3.13Å; E2195-R2198 IonicContact OE1-NH1 2.88Å; E2195-R2198 PolarHBondContact OE1-NH1 3.18Å; E2195-R2198 VanDerWaalsContact OE1-NH1 3.1Å; E2195-R2198 WeakPolarHBondContact OE2-CD 3.36Å; E2195-R2198 IonicContact OE2-CZ 3.52Å; E2195-R2198 IonicContact OE2-NE 3.91Å; E2195-R2198 IonicContact OE2-NH1 3.72Å; E2195-R2198 PolarHBondContact OE2-NH1 3.32Å; H2196-R2198 VanDerWaalsContact C-N 3.34Å; H2196-R2198 PolarHBondContact O-N 3.17Å; R2198-E2201 PolarHBondContact O-N 3.3Å; R2198-S2202 PolarHBondContact O-N 2.05Å
2199	L	72.7	Confident	67.5	Low	28 Å²	28	71.7 Å²	71.7	15%	0.147	37%	0.369	C	S	.	.	H	α-helix	trans	-71.6	-39.3	179.2	-68.1	170.2	0	0	0	111.7	E2195 H2196 R2197 E2201 S2202 I2203 S2237 A2239	E2195-L2199 HydrophobicContact CG-CD1 4.09Å; E2195-L2199 HydrophobicContact CG-CG 4.29Å; E2195-L2199 WeakPolarHBondContact O-CB 3.41Å; E2195-L2199 VanDerWaalsContact O-CG 3.25Å; E2195-L2199 WeakPolarHBondContact O-CG 3.1Å; E2195-L2199 PolarHBondContact O-N 3.32Å; H2196-L2199 PolarHBondContact O-N 3.01Å; R2197-L2199 PolarHBondContact O-N 3.4Å; L2199-E2201 VanDerWaalsContact C-N 3.27Å; L2199-E2201 PolarHBondContact O-N 3.08Å; L2199-S2202 PolarHBondContact O-N 3.21Å; L2199-S2202 PolarHBondContact O-OG 3.4Å; L2199-S2202 VanDerWaalsContact O-OG 3.06Å; L2199-I2203 WeakPolarHBondContact O-CD1 3.47Å; L2199-I2203 VanDerWaalsContact O-CG1 3.24Å; L2199-I2203 WeakPolarHBondContact O-CG1 3.42Å; L2199-I2203 PolarHBondContact O-N 2.94Å; L2199-S2237 WeakPolarHBondContact CD1-O 3.29Å; L2199-A2239 HydrophobicContact CD1-CB 4.23Å
2200	I	70.9	Confident	65.1	Low	54 Å²	54	77.5 Å²	77.5	28%	0.277	41%	0.407	S	S	.	.	H	α-helix	trans	-61.2	-38.1	168.9	-73.2	178.6	0	0	0	111.1	H2196 R2197 K2204	H2196-I2200 VanDerWaalsContact CE1-CD1 3.43Å; H2196-I2200 WeakPolarHBondContact CE1-CD1 3.36Å; H2196-I2200 PolarHBondContact O-N 2.84Å; R2197-I2200 PolarHBondContact O-N 3.37Å; I2200-K2204 HydrophobicContact CG2-CD 4.21Å; I2200-K2204 WeakPolarHBondContact O-CG 3.33Å; I2200-K2204 PolarHBondContact O-N 3.22Å; I2200-K2204 VanDerWaalsContact O-N 3.12Å
2201	E	67.9	Low	62.3	Low	64 Å²	64	82.9 Å²	82.9	30%	0.299	43%	0.43	S	S	.	.	H	α-helix	trans	-73	-37.4	178.5	-73.5	-179.9	-145.4	0	0	113.2	K2126 R2197 R2198 L2199 K2204 C2205	K2126-E2201 VanDerWaalsContact CD-OE1 3.32Å; K2126-E2201 WeakPolarHBondContact CD-OE1 3.29Å; K2126-E2201 WeakPolarHBondContact CE-OE1 3.45Å; K2126-E2201 IonicContact NZ-OE1 3.63Å; K2126-E2201 PolarHBondContact NZ-OE1 3.16Å; K2126-E2201 IonicContact NZ-OE2 2.73Å; K2126-E2201 PolarHBondContact NZ-OE2 3.28Å; R2197-E2201 VanDerWaalsContact CG-OE1 3.24Å; R2197-E2201 WeakPolarHBondContact CG-OE1 3.35Å; R2197-E2201 WeakPolarHBondContact O-CB 3.36Å; R2197-E2201 VanDerWaalsContact O-CG 3.29Å; R2197-E2201 WeakPolarHBondContact O-CG 3.45Å; R2197-E2201 PolarHBondContact O-N 2.86Å; R2198-E2201 PolarHBondContact O-N 3.3Å; L2199-E2201 VanDerWaalsContact C-N 3.27Å; L2199-E2201 PolarHBondContact O-N 3.08Å; E2201-K2204 PolarHBondContact O-N 2.84Å; E2201-C2205 PolarHBondContact O-N 3.34Å; E2201-C2205 PolarHBondContact O-SG 2.85Å
2202	S	61.7	Low	59.7	Low	54 Å²	54	85.6 Å²	85.6	38%	0.378	46%	0.459	S	S	.	.	H	α-helix	trans	-67.3	-40	174.8	69.5	0	0	0	0	111.8	R2198 L2199 K2204 C2205 S2206	R2198-S2202 PolarHBondContact O-N 2.05Å; L2199-S2202 PolarHBondContact O-N 3.21Å; L2199-S2202 PolarHBondContact O-OG 3.4Å; L2199-S2202 VanDerWaalsContact O-OG 3.06Å; S2202-K2204 VanDerWaalsContact C-N 3.32Å; S2202-K2204 PolarHBondContact O-N 2.95Å; S2202-C2205 PolarHBondContact O-N 3.46Å; S2202-S2206 WeakPolarHBondContact O-CB 3.21Å; S2202-S2206 PolarHBondContact O-N 3.25Å; S2202-S2206 PolarHBondContact O-OG 2.88Å; S2202-S2206 VanDerWaalsContact O-OG 3.1Å
2203	I	58.8	Low	57	Low	85 Å²	85	90.7 Å²	90.7	44%	0.436	50%	0.495	S	S	.	.	H	α-helix	trans	-59.8	-42.8	172.7	-67.7	166.7	0	0	0	110.7	L2199 L2207	L2199-I2203 WeakPolarHBondContact O-CD1 3.47Å; L2199-I2203 VanDerWaalsContact O-CG1 3.24Å; L2199-I2203 WeakPolarHBondContact O-CG1 3.42Å; L2199-I2203 PolarHBondContact O-N 2.94Å; I2203-L2207 HydrophobicContact CG2-CD1 4.23Å; I2203-L2207 WeakPolarHBondContact O-CG 3.36Å; I2203-L2207 PolarHBondContact O-N 3.32Å
2204	K	54.1	Low	54.2	Low	125 Å²	125	97.1 Å²	97.1	54%	0.543	53%	0.53	S	S	.	.	H	α-helix	trans	-67.4	-36.5	177	-75.5	174.6	-179.6	177.3	0	113.4	I2200 E2201 S2202	I2200-K2204 HydrophobicContact CG2-CD 4.21Å; I2200-K2204 WeakPolarHBondContact O-CG 3.33Å; I2200-K2204 PolarHBondContact O-N 3.22Å; I2200-K2204 VanDerWaalsContact O-N 3.12Å; E2201-K2204 PolarHBondContact O-N 2.84Å; S2202-K2204 VanDerWaalsContact C-N 3.32Å; S2202-K2204 PolarHBondContact O-N 2.95Å
2205	C	48	Very low	51.5	Low	95 Å²	95	101.1 Å²	101.1	64%	0.642	55%	0.546	S	S	*	.	H	α-helix	trans	-69.9	-40.4	175.5	-75.2	0	0	0	0	112.5	E2201 S2202 L2207 N2208	E2201-C2205 PolarHBondContact O-N 3.34Å; E2201-C2205 PolarHBondContact O-SG 2.85Å; S2202-C2205 PolarHBondContact O-N 3.46Å; C2205-L2207 PolarHBondContact O-N 2.63Å; C2205-N2208 PolarHBondContact O-N 3.23Å
2206	S	43	Very low	48.7	Very low	100 Å²	100	108.4 Å²	108.4	70%	0.699	58%	0.578	S	S	*	*	H	α-helix	trans	-67.7	-14.7	178.4	-62.8	0	0	0	0	114.3	S2202	S2202-S2206 WeakPolarHBondContact O-CB 3.21Å; S2202-S2206 PolarHBondContact O-N 3.25Å; S2202-S2206 PolarHBondContact O-OG 2.88Å; S2202-S2206 VanDerWaalsContact O-OG 3.1Å
2207	L	41.1	Very low	46.2	Very low	133 Å²	133	114.8 Å²	114.8	70%	0.696	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	1.2	176.3	-73.4	167.9	0	0	0	113.8	I2203 C2205	I2203-L2207 HydrophobicContact CG2-CD1 4.23Å; I2203-L2207 WeakPolarHBondContact O-CG 3.36Å; I2203-L2207 PolarHBondContact O-N 3.32Å; C2205-L2207 PolarHBondContact O-N 2.63Å
2208	N	34.9	Very low	43.6	Very low	137 Å²	137	117 Å²	117	73%	0.733	63%	0.632	S	S	*	*			trans	-102.2	20.8	-177.6	-81.3	-20.9	0	0	0	114.6	C2205 P2210	C2205-N2208 PolarHBondContact O-N 3.23Å; N2208-P2210 WeakPolarHBondContact O-CD 3.32Å
2209	E	29	Very low	41.3	Very low	161 Å²	161	116.2 Å²	116.2	75%	0.752	64%	0.64	S	S	*	*	S	Bend	trans	-83.2	115	160.3	-72.3	-160.3	150.4	0	0	109.9	H2211	E2209-H2211 PolarHBondContact O-N 3.32Å; E2209-H2211 VanDerWaalsContact O-N 3.12Å
2210	P	36.2	Very low	39.2	Very low	126 Å²	126	120.2 Å²	120.2	82%	0.818	67%	0.665	S	S	*	*			trans	-85.5	90.9	-167	33.2	-35.5	0	0	0	112.7	N2208	N2208-P2210 WeakPolarHBondContact O-CD 3.32Å
2211	H	28	Very low	37.3	Very low	175 Å²	175	124.6 Å²	124.6	81%	0.81	69%	0.689	S	S	*	*			trans	-124.6	111.9	175.3	-87	-62.2	0	0	0	114.5	E2209	E2209-H2211 PolarHBondContact O-N 3.32Å; E2209-H2211 VanDerWaalsContact O-N 3.12Å
2212	G	31.4	Very low	35.5	Very low	70 Å²	70	129.9 Å²	129.9	72%	0.722	71%	0.711	S	S	*	*			trans	63.5	85.4	146.1	0	0	0	0	0	117.8	L2214	G2212-L2214 PolarHBondContact O-N 3.45Å; G2212-L2214 VanDerWaalsContact O-N 3.07Å
2213	S	29.9	Very low	34	Very low	117 Å²	117	133.9 Å²	133.9	82%	0.818	73%	0.728	S	S	*	*			trans	-61.2	105.9	166.9	51.5	0	0	0	0	111.8
2214	L	25.8	Very low	33	Very low	155 Å²	155	135.8 Å²	135.8	81%	0.812	75%	0.746	S	S	*	*			trans	-98.3	97.6	167	-97.1	163.8	0	0	0	109.1	G2212 F2216	G2212-L2214 PolarHBondContact O-N 3.45Å; G2212-L2214 VanDerWaalsContact O-N 3.07Å; L2214-F2216 PolarHBondContact O-N 3.34Å
2215	E	27.3	Very low	31.8	Very low	179 Å²	179	137.6 Å²	137.6	84%	0.836	76%	0.762	S	S	*	*			trans	-72.7	120.8	175.5	-63.7	173.9	140.6	0	0	109.8
2216	F	23.8	Very low	30.8	Very low	182 Å²	182	138.5 Å²	138.5	80%	0.798	77%	0.768	S	S	*	*			trans	-107.6	92.8	166.7	-103.6	-83	0	0	0	109	L2214 V2218	L2214-F2216 PolarHBondContact O-N 3.34Å; F2216-V2218 PolarHBondContact O-N 2.92Å
2217	D	28.2	Very low	30.3	Very low	157 Å²	157	140.3 Å²	140.3	84%	0.84	77%	0.774	S	S	*	*			trans	-79.5	106.4	176.8	-170.7	18.4	0	0	0	109.9
2218	V	25.5	Very low	29.6	Very low	105 Å²	105	141.8 Å²	141.8	64%	0.636	78%	0.777	S	S	*	*			trans	-138.2	97.6	174.5	-170.1	0	0	0	0	109.3	F2216 V2220	F2216-V2218 PolarHBondContact O-N 2.92Å; V2218-V2220 HydrophobicContact CG1-CG2 3.81Å; V2218-V2220 PolarHBondContact O-N 2.96Å
2219	D	30.1	Very low	29.3	Very low	139 Å²	139	144.1 Å²	144.1	74%	0.743	78%	0.784	S	S	*	*			trans	-67.9	116.4	173.4	-177.9	11.1	0	0	0	110.9
2220	V	27.7	Very low	29.2	Very low	111 Å²	111	141 Å²	141	67%	0.673	79%	0.786	S	S	*	*			trans	-128.3	71	-179.8	-167.4	0	0	0	0	111.8	V2218 K2222	V2218-V2220 HydrophobicContact CG1-CG2 3.81Å; V2218-V2220 PolarHBondContact O-N 2.96Å; V2220-K2222 PolarHBondContact O-N 2.91Å
2221	N	31.2	Very low	28.9	Very low	147 Å²	147	144.3 Å²	144.3	79%	0.786	79%	0.79	S	S	*	*			trans	-85.1	81.4	154.1	-92.5	-74	0	0	0	110.9
2222	K	30.7	Very low	28.9	Very low	174 Å²	174	142.7 Å²	142.7	76%	0.757	79%	0.793	S	S	*	*	S	Bend	trans	-177	146.6	147.1	-104.7	154.5	-169.1	176.1	0	116.6	V2220	V2220-K2222 PolarHBondContact O-N 2.91Å
2223	D	28.9	Very low	29	Very low	139 Å²	139	145.4 Å²	145.4	74%	0.743	80%	0.795	S	S	*	*			trans	52.9	104	158.3	-60.3	-32.5	0	0	0	119.7	N2225	D2223-N2225 PolarHBondContact O-N 3.41Å
2224	P	37.9	Very low	29.1	Very low	124 Å²	124	145.5 Å²	145.5	81%	0.805	79%	0.794	S	S	*	*			trans	-84.6	94.3	176.2	33.6	-32.5	0	0	0	111.7
2225	N	30.2	Very low	29.6	Very low	164 Å²	164	149.2 Å²	149.2	88%	0.877	80%	0.798	S	S	*	*			trans	-160.1	59.2	172.2	-113.9	-29.7	0	0	0	115.9	D2223	D2223-N2225 PolarHBondContact O-N 3.41Å
2226	C	26.5	Very low	30.5	Very low	114 Å²	114	148.1 Å²	148.1	77%	0.77	79%	0.791	S	S	*	*			trans	-160.9	140.9	146.6	-154.6	0	0	0	0	111.1
2227	V	31.5	Very low	32	Very low	138 Å²	138	142.4 Å²	142.4	84%	0.836	77%	0.774	S	S	*	*			trans	-130.8	107.7	174.5	176.2	0	0	0	0	108.2
2228	H	27.3	Very low	34	Very low	163 Å²	163	137 Å²	137	76%	0.755	74%	0.744	S	S	*	*			trans	-153.2	142.3	168.3	-98.1	-80.4	0	0	0	111.2
2229	E	28.4	Very low	36.5	Very low	187 Å²	187	132 Å²	132	87%	0.874	71%	0.714	S	S	*	*			trans	59.6	93.7	162.7	-64.6	179.8	-164.7	0	0	118.4
2230	A	27.5	Very low	38.8	Very low	96 Å²	96	125.9 Å²	125.9	79%	0.793	68%	0.682	S	S	*	*			trans	-141.3	27.7	161.4	0	0	0	0	0	113	T2232	A2230-T2232 VanDerWaalsContact C-N 3.28Å; A2230-T2232 PolarHBondContact O-N 2.76Å
2231	E	28.5	Very low	41.1	Very low	194 Å²	194	123.6 Å²	123.6	91%	0.907	67%	0.668	S	S	*	*			trans	-76.9	74.2	169.8	-73.5	-162.4	144.4	0	0	110.9
2232	T	29.5	Very low	43.3	Very low	141 Å²	141	117 Å²	117	87%	0.865	63%	0.633	S	S	*	*			trans	-166.1	69.7	161.7	5	0	0	0	0	112.7	A2230	A2230-T2232 VanDerWaalsContact C-N 3.28Å; A2230-T2232 PolarHBondContact O-N 2.76Å
2233	T	31.6	Very low	45.5	Very low	127 Å²	127	113.9 Å²	113.9	78%	0.779	63%	0.631	S	S	*	*	S	Bend	trans	-121.5	144.7	162.1	44.7	0	0	0	0	109.8
2234	P	32.8	Very low	47.8	Very low	120 Å²	120	108.6 Å²	108.6	78%	0.779	61%	0.609	S	S	*	*			trans	-65.3	146.8	-164.5	26.9	-35.8	0	0	0	112.1	K2236	P2234-K2236 PolarHBondContact O-N 2.75Å
2235	Y	36.1	Very low	49.9	Very low	233 Å²	233	102.8 Å²	102.8	91%	0.914	57%	0.572	S	S	*	*			trans	-37.1	100.8	176.4	-72.6	-100.6	0	0	0	112.3	S2237	Y2235-S2237 PolarHBondContact O-N 3.35Å
2236	K	47.1	Very low	52.4	Low	156 Å²	156	100.6 Å²	100.6	68%	0.678	55%	0.551	S	S	*	*			trans	-55.8	109.3	157.4	-91.1	-166.3	178	-171.1	0	104.9	E2064 P2234 D2238	E2064-K2236 IonicContact OE1-NZ 2.7Å; E2064-K2236 PolarHBondContact OE1-NZ 3.36Å; E2064-K2236 IonicContact OE2-NZ 3.86Å; P2234-K2236 PolarHBondContact O-N 2.75Å; K2236-D2238 PolarHBondContact O-N 2.82Å; K2236-D2238 VanDerWaalsContact O-N 3.1Å
2237	S	55.5	Low	55	Low	62 Å²	62	100.3 Å²	100.3	43%	0.434	54%	0.538	S	S	.	.			trans	-68.5	111.4	178.2	10.6	0	0	0	0	107.3	L2199 Y2235 A2239	L2199-S2237 WeakPolarHBondContact CD1-O 3.29Å; Y2235-S2237 PolarHBondContact O-N 3.35Å; S2237-A2239 PolarHBondContact O-N 3.08Å
2238	D	69.8	Low	57.5	Low	42 Å²	42	97.6 Å²	97.6	23%	0.225	51%	0.514	C	S	.	.			trans	-63.6	117.5	176.6	-179.4	-13.1	0	0	0	108.9	Y1905 K2236 T2240 V2241 S2242	Y1905-D2238 WeakPolarHBondContact CE1-OD2 3.37Å; Y1905-D2238 PolarHBondContact OH-OD2 3.46Å; Y1905-D2238 VanDerWaalsContact OH-OD2 3.13Å; K2236-D2238 PolarHBondContact O-N 2.82Å; K2236-D2238 VanDerWaalsContact O-N 3.1Å; D2238-T2240 PolarHBondContact O-N 3.42Å; D2238-T2240 WeakPolarHBondContact OD1-CB 3.43Å; D2238-T2240 WeakPolarHBondContact OD1-CG2 3.35Å; D2238-T2240 PolarHBondContact OD1-N 3.22Å; D2238-T2240 PolarHBondContact OD1-OG1 3.41Å; D2238-T2240 PolarHBondContact OD2-OG1 2.8Å; D2238-V2241 HydrophobicContact CB-CG2 3.77Å; D2238-V2241 PolarHBondContact O-N 3.43Å; D2238-S2242 PolarHBondContact O-N 2.85Å; D2238-S2242 VanDerWaalsContact O-N 3.11Å
2239	A	78.3	Confident	60.3	Low	0 Å²	0	90.7 Å²	90.7	0%	0	48%	0.482	C	S	.	.	S	Bend	trans	-62.4	-31.9	-178	0	0	0	0	0	111.9	I2060 V2192 H2196 L2199 S2237 V2241 S2242 V2245	I2060-A2239 HydrophobicContact CD1-CB 4.44Å; V2192-A2239 HydrophobicContact CG1-CB 4.01Å; H2196-A2239 HydrophobicContact CB-CB 3.65Å; L2199-A2239 HydrophobicContact CD1-CB 4.23Å; S2237-A2239 PolarHBondContact O-N 3.08Å; A2239-V2241 PolarHBondContact O-N 3.36Å; A2239-S2242 VanDerWaalsContact O-CB 3.32Å; A2239-S2242 WeakPolarHBondContact O-CB 3.42Å; A2239-S2242 PolarHBondContact O-N 3.16Å; A2239-S2242 PolarHBondContact O-OG 2.99Å; A2239-V2245 WeakPolarHBondContact O-CG2 3.3Å
2240	T	78.1	Confident	62.8	Low	12 Å²	12	85.9 Å²	85.9	7%	0.074	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-39.8	-176.3	70.1	0	0	0	0	112.1	P1904 Y1905 I2060 V2192 D2238	P1904-T2240 HydrophobicContact CB-CG2 3.82Å; P1904-T2240 HydrophobicContact CG-CG2 4.17Å; P1904-T2240 WeakPolarHBondContact O-CG2 3.27Å; Y1905-T2240 HydrophobicContact CE1-CG2 4.42Å; I2060-T2240 HydrophobicContact CD1-CG2 4.46Å; V2192-T2240 HydrophobicContact CG1-CG2 3.84Å; D2238-T2240 PolarHBondContact O-N 3.42Å; D2238-T2240 WeakPolarHBondContact OD1-CB 3.43Å; D2238-T2240 WeakPolarHBondContact OD1-CG2 3.35Å; D2238-T2240 PolarHBondContact OD1-N 3.22Å; D2238-T2240 PolarHBondContact OD1-OG1 3.41Å; D2238-T2240 PolarHBondContact OD2-OG1 2.8Å
2241	V	75.6	Confident	65.4	Low	62 Å²	62	86.3 Å²	86.3	38%	0.376	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	12.4	179.1	-65	0	0	0	0	113.3	D2238 A2239	D2238-V2241 HydrophobicContact CB-CG2 3.77Å; D2238-V2241 PolarHBondContact O-N 3.43Å; A2239-V2241 PolarHBondContact O-N 3.36Å
2242	S	78.5	Confident	68.2	Low	8 Å²	8	77.7 Å²	77.7	6%	0.056	40%	0.4	C	S	.	.			trans	-58.2	149.3	175.1	67.3	0	0	0	0	111.7	D2238 A2239 G2244 V2245 R2246	D2238-S2242 PolarHBondContact O-N 2.85Å; D2238-S2242 VanDerWaalsContact O-N 3.11Å; A2239-S2242 VanDerWaalsContact O-CB 3.32Å; A2239-S2242 WeakPolarHBondContact O-CB 3.42Å; A2239-S2242 PolarHBondContact O-N 3.16Å; A2239-S2242 PolarHBondContact O-OG 2.99Å; S2242-G2244 PolarHBondContact O-N 2.73Å; S2242-V2245 PolarHBondContact O-N 3.33Å; S2242-V2245 WeakPolarHBondContact OG-CB 3.45Å; S2242-V2245 WeakPolarHBondContact OG-CG2 3.39Å; S2242-V2245 PolarHBondContact OG-N 3.25Å; S2242-V2245 VanDerWaalsContact OG-N 3.11Å; S2242-R2246 PolarHBondContact O-N 3.42Å
2243	P	75	Confident	70.8	Confident	110 Å²	110	71 Å²	71	71%	0.714	36%	0.359	S	S	*	.	H	α-helix	trans	-56.9	-35.8	172.6	-25.2	34.8	0	0	0	112.8	E2247	P2243-E2247 VanDerWaalsContact O-CB 3.23Å; P2243-E2247 WeakPolarHBondContact O-CB 3.17Å; P2243-E2247 PolarHBondContact O-N 3.47Å
2244	G	77.2	Confident	73	Confident	27 Å²	27	71.3 Å²	71.3	28%	0.278	35%	0.346	S	S	.	.	H	α-helix	trans	-66	-42.6	179.9	0	0	0	0	0	113.7	S2242 Y2248	S2242-G2244 PolarHBondContact O-N 2.73Å; G2244-Y2248 VanDerWaalsContact O-CB 3.31Å; G2244-Y2248 WeakPolarHBondContact O-CB 2.99Å; G2244-Y2248 PolarHBondContact O-N 3.38Å
2245	V	83.6	Confident	75.4	Confident	3 Å²	3	69.7 Å²	69.7	2%	0.018	33%	0.331	C	S	.	.	H	α-helix	trans	-71.3	-43.3	175.9	171.6	0	0	0	0	111.2	A2191 V2192 E2195 A2239 S2242 Y2248 E2249	A2191-V2245 HydrophobicContact CB-CG2 4.36Å; V2192-V2245 HydrophobicContact CG2-CG1 3.87Å; V2192-V2245 HydrophobicContact CG2-CG2 4.19Å; E2195-V2245 HydrophobicContact CB-CG2 3.92Å; E2195-V2245 HydrophobicContact CG-CG2 4.45Å; A2239-V2245 WeakPolarHBondContact O-CG2 3.3Å; S2242-V2245 PolarHBondContact O-N 3.33Å; S2242-V2245 WeakPolarHBondContact OG-CB 3.45Å; S2242-V2245 WeakPolarHBondContact OG-CG2 3.39Å; S2242-V2245 PolarHBondContact OG-N 3.25Å; S2242-V2245 VanDerWaalsContact OG-N 3.11Å; V2245-Y2248 CarbonylContact O-C 3.33Å; V2245-Y2248 WeakPolarHBondContact O-CB 3.23Å; V2245-Y2248 PolarHBondContact O-N 3.03Å; V2245-Y2248 VanDerWaalsContact O-N 3.16Å; V2245-E2249 WeakPolarHBondContact O-CB 3.24Å; V2245-E2249 PolarHBondContact O-N 3.44Å
2246	R	81.1	Confident	77.6	Confident	118 Å²	118	64 Å²	64	45%	0.445	31%	0.313	S	S	.	.	H	α-helix	trans	-62.2	-44.9	177.5	-73.4	-179.7	167.5	-176	-1.9	112.4	S2242 Y2248 E2249 E2250	S2242-R2246 PolarHBondContact O-N 3.42Å; R2246-Y2248 VanDerWaalsContact C-N 3.28Å; R2246-Y2248 PolarHBondContact O-N 3.28Å; R2246-E2249 PolarHBondContact O-N 3.35Å; R2246-E2250 WeakPolarHBondContact O-CG 3.41Å; R2246-E2250 PolarHBondContact O-N 3.26Å
2247	E	81.1	Confident	79.3	Confident	107 Å²	107	57.3 Å²	57.3	50%	0.5	28%	0.284	S	S	.	.	H	α-helix	trans	-65.8	-32	175.6	-157.6	-151.5	142.6	0	0	111.8	P2243 R2251	P2243-E2247 VanDerWaalsContact O-CB 3.23Å; P2243-E2247 WeakPolarHBondContact O-CB 3.17Å; P2243-E2247 PolarHBondContact O-N 3.47Å; E2247-R2251 VanDerWaalsContact CD-NH2 3.29Å; E2247-R2251 WeakPolarHBondContact O-CB 3.4Å; E2247-R2251 PolarHBondContact O-N 2.9Å; E2247-R2251 VanDerWaalsContact O-N 3.15Å; E2247-R2251 IonicContact OE1-CZ 3.6Å; E2247-R2251 IonicContact OE1-NH2 3.68Å; E2247-R2251 PolarHBondContact OE1-NH2 2.98Å; E2247-R2251 IonicContact OE2-NH2 3.67Å
2248	Y	85.1	Confident	80.6	Confident	82 Å²	82	54.6 Å²	54.6	32%	0.322	27%	0.265	S	S	.	.	H	α-helix	trans	-68.6	-39.8	171.7	-179.3	-89.5	0	0	0	112.2	A2187 A2191 G2244 V2245 R2246 R2251 L2252	A2187-Y2248 HydrophobicContact CB-CE1 4.35Å; A2191-Y2248 HydrophobicContact CB-CD1 3.48Å; A2191-Y2248 VanDerWaalsContact CB-CD1 3.48Å; A2191-Y2248 HydrophobicContact CB-CE1 3.78Å; A2191-Y2248 HydrophobicContact CB-CG 4.01Å; G2244-Y2248 VanDerWaalsContact O-CB 3.31Å; G2244-Y2248 WeakPolarHBondContact O-CB 2.99Å; G2244-Y2248 PolarHBondContact O-N 3.38Å; V2245-Y2248 CarbonylContact O-C 3.33Å; V2245-Y2248 WeakPolarHBondContact O-CB 3.23Å; V2245-Y2248 PolarHBondContact O-N 3.03Å; V2245-Y2248 VanDerWaalsContact O-N 3.16Å; R2246-Y2248 VanDerWaalsContact C-N 3.28Å; R2246-Y2248 PolarHBondContact O-N 3.28Å; Y2248-R2251 CarbonylContact O-C 3.43Å; Y2248-R2251 PolarHBondContact O-N 3.28Å; Y2248-L2252 HydrophobicContact CE1-CD2 4.46Å; Y2248-L2252 VanDerWaalsContact O-CB 3.29Å; Y2248-L2252 WeakPolarHBondContact O-CB 3.33Å; Y2248-L2252 PolarHBondContact O-N 2.94Å
2249	E	85	Confident	81.2	Confident	18 Å²	18	54.8 Å²	54.8	8%	0.084	27%	0.269	C	S	.	.	H	α-helix	trans	-68.2	-48.7	178.4	179.2	158	-140.2	0	0	112.2	Y2184 I2188 V2245 R2246 R2251 L2252 F2253	Y2184-E2249 WeakPolarHBondContact CE2-OE1 3.41Å; Y2184-E2249 PolarHBondContact OH-OE1 3.27Å; I2188-E2249 HydrophobicContact CD1-CB 3.74Å; I2188-E2249 HydrophobicContact CD1-CG 3.78Å; V2245-E2249 WeakPolarHBondContact O-CB 3.24Å; V2245-E2249 PolarHBondContact O-N 3.44Å; R2246-E2249 PolarHBondContact O-N 3.35Å; E2249-R2251 PolarHBondContact O-N 3.39Å; E2249-L2252 WeakPolarHBondContact O-CB 3.37Å; E2249-L2252 PolarHBondContact O-N 3.31Å; E2249-F2253 HydrophobicContact CG-CD2 3.73Å; E2249-F2253 HydrophobicContact CG-CE2 3.59Å; E2249-F2253 VanDerWaalsContact O-CD2 3.29Å; E2249-F2253 WeakPolarHBondContact O-CD2 3.17Å; E2249-F2253 PolarHBondContact O-N 3.2Å
2250	E	81.2	Confident	81.3	Confident	85 Å²	85	58.6 Å²	58.6	40%	0.397	29%	0.287	S	S	.	.	H	α-helix	trans	-56.1	-40.5	173	-69.6	-176.5	165.8	0	0	111.3	R2246 R2254 H2375	R2246-E2250 WeakPolarHBondContact O-CG 3.41Å; R2246-E2250 PolarHBondContact O-N 3.26Å; E2250-R2254 WeakPolarHBondContact O-CB 3.31Å; E2250-R2254 PolarHBondContact O-N 3Å; E2250-H2375 IonicContact OE1-CE1 3.52Å
2251	R	82.9	Confident	81.6	Confident	106 Å²	106	58.2 Å²	58.2	40%	0.4	28%	0.284	S	S	.	.	H	α-helix	trans	-69.1	-36.6	175.8	-168.4	-168.5	-57.1	-179.5	0.6	112.3	E2247 Y2248 E2249 D2255	E2247-R2251 VanDerWaalsContact CD-NH2 3.29Å; E2247-R2251 WeakPolarHBondContact O-CB 3.4Å; E2247-R2251 PolarHBondContact O-N 2.9Å; E2247-R2251 VanDerWaalsContact O-N 3.15Å; E2247-R2251 IonicContact OE1-CZ 3.6Å; E2247-R2251 IonicContact OE1-NH2 3.68Å; E2247-R2251 PolarHBondContact OE1-NH2 2.98Å; E2247-R2251 IonicContact OE2-NH2 3.67Å; Y2248-R2251 CarbonylContact O-C 3.43Å; Y2248-R2251 PolarHBondContact O-N 3.28Å; E2249-R2251 PolarHBondContact O-N 3.39Å; R2251-D2255 HydrophobicContact CG-CB 4.49Å; R2251-D2255 WeakPolarHBondContact CG-OD2 3.36Å; R2251-D2255 WeakPolarHBondContact O-CA 3.43Å; R2251-D2255 VanDerWaalsContact O-CB 3.26Å; R2251-D2255 WeakPolarHBondContact O-CB 3.25Å; R2251-D2255 PolarHBondContact O-N 2.89Å
2252	L	86.4	Confident	82.1	Confident	12 Å²	12	57.9 Å²	57.9	6%	0.063	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-47.3	174.7	-179.3	68.7	0	0	0	110.6	Y2184 A2187 I2188 Y2248 E2249 Q2256 L2257	Y2184-L2252 HydrophobicContact CD2-CD2 3.91Å; Y2184-L2252 HydrophobicContact CE2-CD2 4.47Å; A2187-L2252 HydrophobicContact CB-CD1 4.09Å; A2187-L2252 HydrophobicContact CB-CD2 3.66Å; I2188-L2252 HydrophobicContact CD1-CD2 3.85Å; I2188-L2252 HydrophobicContact CG1-CD2 4.28Å; Y2248-L2252 HydrophobicContact CE1-CD2 4.46Å; Y2248-L2252 VanDerWaalsContact O-CB 3.29Å; Y2248-L2252 WeakPolarHBondContact O-CB 3.33Å; Y2248-L2252 PolarHBondContact O-N 2.94Å; E2249-L2252 WeakPolarHBondContact O-CB 3.37Å; E2249-L2252 PolarHBondContact O-N 3.31Å; L2252-Q2256 HydrophobicContact CD1-CB 4.27Å; L2252-Q2256 WeakPolarHBondContact O-CB 3.45Å; L2252-Q2256 PolarHBondContact O-N 3.23Å; L2252-L2257 PolarHBondContact O-N 3.02Å
2253	F	84.7	Confident	82.2	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.009	30%	0.297	C	S	.	.	I	π-helix	trans	-62	-49.9	175.2	-81	-70.8	0	0	0	111.9	Y2184 E2249 L2257 A2258 L2366 A2372 I2376 I2379	Y2184-F2253 HydrophobicContact CD2-CE2 4.48Å; Y2184-F2253 HydrophobicContact CD2-CZ 4.12Å; Y2184-F2253 HydrophobicContact CE2-CE1 4.49Å; Y2184-F2253 AromaticContact CE2-CE2 3.67Å; Y2184-F2253 HydrophobicContact CE2-CE2 3.67Å; Y2184-F2253 AromaticContact CE2-CZ 3.52Å; Y2184-F2253 HydrophobicContact CE2-CZ 3.52Å; Y2184-F2253 AromaticContact CZ-CZ 3.94Å; E2249-F2253 HydrophobicContact CG-CD2 3.73Å; E2249-F2253 HydrophobicContact CG-CE2 3.59Å; E2249-F2253 VanDerWaalsContact O-CD2 3.29Å; E2249-F2253 WeakPolarHBondContact O-CD2 3.17Å; E2249-F2253 PolarHBondContact O-N 3.2Å; F2253-L2257 HydrophobicContact CD1-CB 4.46Å; F2253-L2257 HydrophobicContact CD1-CD2 3.58Å; F2253-L2257 HydrophobicContact CE1-CD2 3.59Å; F2253-A2258 WeakPolarHBondContact O-CB 3.21Å; F2253-A2258 PolarHBondContact O-N 2.93Å; F2253-L2366 HydrophobicContact CE1-CD1 4.31Å; F2253-L2366 HydrophobicContact CE1-CD2 4.21Å; F2253-L2366 HydrophobicContact CZ-CD2 4.35Å; F2253-A2372 HydrophobicContact CD2-CB 4.12Å; F2253-A2372 HydrophobicContact CE2-CB 3.43Å; F2253-A2372 VanDerWaalsContact CE2-CB 3.43Å; F2253-A2372 HydrophobicContact CZ-CB 3.78Å; F2253-I2376 HydrophobicContact CD1-CG1 4.28Å; F2253-I2376 HydrophobicContact CE1-CD1 4.06Å; F2253-I2376 HydrophobicContact CE1-CG1 3.87Å; F2253-I2376 HydrophobicContact CZ-CD1 4.04Å; F2253-I2376 HydrophobicContact CZ-CG1 4.3Å; F2253-I2379 HydrophobicContact CB-CD1 4.42Å; F2253-I2379 HydrophobicContact CD1-CD1 4.26Å
2254	R	79	Confident	82.4	Confident	132 Å²	132	57.5 Å²	57.5	50%	0.498	27%	0.268	S	S	.	.	I	π-helix	trans	-74.3	-45.3	-174	-173.9	-170.7	65.2	-125.3	-7	114.2	E2250 P2259	E2250-R2254 WeakPolarHBondContact O-CB 3.31Å; E2250-R2254 PolarHBondContact O-N 3Å; R2254-P2259 WeakPolarHBondContact O-CD 3.2Å
2255	D	81.8	Confident	82.5	Confident	86 Å²	86	56.2 Å²	56.2	46%	0.46	26%	0.255	S	S	.	.	I	π-helix	trans	-100.8	-14	-167.6	-55.7	-22.4	0	0	0	113.1	R2251	R2251-D2255 HydrophobicContact CG-CB 4.49Å; R2251-D2255 WeakPolarHBondContact CG-OD2 3.36Å; R2251-D2255 WeakPolarHBondContact O-CA 3.43Å; R2251-D2255 VanDerWaalsContact O-CB 3.26Å; R2251-D2255 WeakPolarHBondContact O-CB 3.25Å; R2251-D2255 PolarHBondContact O-N 2.89Å
2256	Q	82.5	Confident	82.2	Confident	115 Å²	115	58.3 Å²	58.3	54%	0.537	27%	0.265	S	S	.	.	I	π-helix	trans	-122.4	-61.1	176.6	-57.6	-171.8	15.7	0	0	112.8	L2252 P2259 E2260	L2252-Q2256 HydrophobicContact CD1-CB 4.27Å; L2252-Q2256 WeakPolarHBondContact O-CB 3.45Å; L2252-Q2256 PolarHBondContact O-N 3.23Å; Q2256-P2259 WeakPolarHBondContact O-CD 3.23Å; Q2256-E2260 VanDerWaalsContact O-CB 3.28Å; Q2256-E2260 WeakPolarHBondContact O-CB 3.44Å; Q2256-E2260 PolarHBondContact O-N 3.38Å
2257	L	83.4	Confident	81.7	Confident	15 Å²	15	58.5 Å²	58.5	8%	0.079	27%	0.266	C	S	.	.	I	π-helix	trans	-67.3	-47.2	-169.1	-158.8	82.5	0	0	0	112.4	L2180 L2252 F2253 E2260 L2261 L2366	L2180-L2257 HydrophobicContact CD2-CD1 3.93Å; L2252-L2257 PolarHBondContact O-N 3.02Å; F2253-L2257 HydrophobicContact CD1-CB 4.46Å; F2253-L2257 HydrophobicContact CD1-CD2 3.58Å; F2253-L2257 HydrophobicContact CE1-CD2 3.59Å; L2257-E2260 WeakPolarHBondContact O-CB 2.89Å; L2257-E2260 PolarHBondContact O-N 2.75Å; L2257-L2261 HydrophobicContact CD2-CD1 4.15Å; L2257-L2261 HydrophobicContact CG-CD1 4.02Å; L2257-L2261 WeakPolarHBondContact O-CB 3.41Å; L2257-L2261 VanDerWaalsContact O-CG 3.24Å; L2257-L2261 WeakPolarHBondContact O-CG 3.33Å; L2257-L2261 PolarHBondContact O-N 3.47Å; L2257-L2366 HydrophobicContact CD2-CD1 3.83Å
2258	A	82.4	Confident	81	Confident	4 Å²	4	54 Å²	54	3%	0.033	25%	0.245	C	C	.	.	H	α-helix	trans	-64	-47.8	177.8	0	0	0	0	0	111.6	F2253 E2260 L2261 Y2262 I2379	F2253-A2258 WeakPolarHBondContact O-CB 3.21Å; F2253-A2258 PolarHBondContact O-N 2.93Å; A2258-E2260 PolarHBondContact O-N 2.88Å; A2258-L2261 PolarHBondContact O-N 3.48Å; A2258-L2261 VanDerWaalsContact O-N 3.16Å; A2258-Y2262 HydrophobicContact CB-CD2 4.35Å; A2258-Y2262 HydrophobicContact CB-CE2 3.69Å; A2258-Y2262 WeakPolarHBondContact O-CD2 3.35Å; A2258-Y2262 PolarHBondContact O-N 2.94Å; A2258-I2379 HydrophobicContact CB-CD1 3.86Å; A2258-I2379 HydrophobicContact CB-CG1 3.86Å
2259	P	82.6	Confident	80	Confident	47 Å²	47	54.1 Å²	54.1	31%	0.305	25%	0.249	S	C	.	.	H	α-helix	trans	-56.7	-41.8	169.9	-29.4	36.7	0	0	0	114.5	R2254 Q2256 N2263	R2254-P2259 WeakPolarHBondContact O-CD 3.2Å; Q2256-P2259 WeakPolarHBondContact O-CD 3.23Å; P2259-N2263 VanDerWaalsContact O-CB 3.24Å; P2259-N2263 WeakPolarHBondContact O-CB 3.4Å; P2259-N2263 PolarHBondContact O-N 3.45Å; P2259-N2263 PolarHBondContact O-ND2 3.26Å
2260	E	80.6	Confident	78.9	Confident	80 Å²	80	62.5 Å²	62.5	37%	0.374	28%	0.28	S	S	.	.	H	α-helix	trans	-58	-47.5	172.9	-96.3	-89.6	144.8	0	0	111.2	K2176 Q2256 L2257 A2258 L2264	K2176-E2260 VanDerWaalsContact CE-OE2 3.27Å; K2176-E2260 WeakPolarHBondContact CE-OE2 3.19Å; K2176-E2260 IonicContact NZ-OE2 3.42Å; K2176-E2260 PolarHBondContact NZ-OE2 2.98Å; Q2256-E2260 VanDerWaalsContact O-CB 3.28Å; Q2256-E2260 WeakPolarHBondContact O-CB 3.44Å; Q2256-E2260 PolarHBondContact O-N 3.38Å; L2257-E2260 WeakPolarHBondContact O-CB 2.89Å; L2257-E2260 PolarHBondContact O-N 2.75Å; A2258-E2260 PolarHBondContact O-N 2.88Å; E2260-L2264 WeakPolarHBondContact O-CB 3.03Å; E2260-L2264 PolarHBondContact O-N 2.62Å
2261	L	83.7	Confident	77.6	Confident	3 Å²	3	64.8 Å²	64.8	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-68.6	-49.6	-178.9	-74.3	169.9	0	0	0	112.4	L2180 L2257 A2258 N2263 L2264 I2265 F2358 L2362 I2379 L2383	L2180-L2261 HydrophobicContact CD1-CD2 3.84Å; L2257-L2261 HydrophobicContact CD2-CD1 4.15Å; L2257-L2261 HydrophobicContact CG-CD1 4.02Å; L2257-L2261 WeakPolarHBondContact O-CB 3.41Å; L2257-L2261 VanDerWaalsContact O-CG 3.24Å; L2257-L2261 WeakPolarHBondContact O-CG 3.33Å; L2257-L2261 PolarHBondContact O-N 3.47Å; A2258-L2261 PolarHBondContact O-N 3.48Å; A2258-L2261 VanDerWaalsContact O-N 3.16Å; L2261-N2263 VanDerWaalsContact C-N 3.31Å; L2261-N2263 PolarHBondContact O-N 3.01Å; L2261-L2264 CarbonylContact O-C 3.58Å; L2261-L2264 WeakPolarHBondContact O-CA 3.35Å; L2261-L2264 WeakPolarHBondContact O-CB 3.19Å; L2261-L2264 PolarHBondContact O-N 3.49Å; L2261-I2265 WeakPolarHBondContact O-CG1 3.43Å; L2261-I2265 PolarHBondContact O-N 3.44Å; L2261-F2358 HydrophobicContact CD2-CE1 4.14Å; L2261-L2362 HydrophobicContact CD1-CD2 4.36Å; L2261-L2362 HydrophobicContact CD2-CD2 3.58Å; L2261-I2379 HydrophobicContact CD1-CG2 4.25Å; L2261-L2383 HydrophobicContact CB-CD1 4.37Å; L2261-L2383 HydrophobicContact CB-CD2 4.01Å; L2261-L2383 HydrophobicContact CD1-CD1 4.33Å
2262	Y	85.8	Confident	75.9	Confident	55 Å²	55	60.7 Å²	60.7	22%	0.216	28%	0.277	C	S	.	.	H	α-helix	trans	-57.6	-45.5	174.7	-56.9	-41	0	0	0	110.5	A2258 L2264 I2266 D2382 L2383 L2386	A2258-Y2262 HydrophobicContact CB-CD2 4.35Å; A2258-Y2262 HydrophobicContact CB-CE2 3.69Å; A2258-Y2262 WeakPolarHBondContact O-CD2 3.35Å; A2258-Y2262 PolarHBondContact O-N 2.94Å; Y2262-L2264 VanDerWaalsContact C-N 3.33Å; Y2262-L2264 PolarHBondContact O-N 3.17Å; Y2262-I2266 VanDerWaalsContact O-CB 3.26Å; Y2262-I2266 WeakPolarHBondContact O-CB 3.49Å; Y2262-I2266 WeakPolarHBondContact O-CD1 3.28Å; Y2262-I2266 WeakPolarHBondContact O-CG1 2.93Å; Y2262-I2266 PolarHBondContact O-N 3.24Å; Y2262-D2382 HydrophobicContact CD1-CB 4.48Å; Y2262-D2382 HydrophobicContact CE1-CB 3.44Å; Y2262-D2382 VanDerWaalsContact CE1-CB 3.44Å; Y2262-D2382 PolarHBondContact OH-OD2 2.89Å; Y2262-L2383 HydrophobicContact CD1-CD2 3.62Å; Y2262-L2383 HydrophobicContact CD1-CG 4.29Å; Y2262-L2383 HydrophobicContact CE1-CD2 3.99Å; Y2262-L2383 HydrophobicContact CE1-CG 4.16Å; Y2262-L2386 HydrophobicContact CD1-CD1 3.65Å; Y2262-L2386 HydrophobicContact CE1-CD1 4.46Å; Y2262-L2386 HydrophobicContact CG-CD1 4.31Å
2263	N	81.3	Confident	73.9	Confident	90 Å²	90	64 Å²	64	48%	0.481	31%	0.306	S	S	.	.	H	α-helix	trans	-66	-32.8	175.1	-79.8	-69.8	0	0	0	112.7	P2259 L2261 R2267	P2259-N2263 VanDerWaalsContact O-CB 3.24Å; P2259-N2263 WeakPolarHBondContact O-CB 3.4Å; P2259-N2263 PolarHBondContact O-N 3.45Å; P2259-N2263 PolarHBondContact O-ND2 3.26Å; L2261-N2263 VanDerWaalsContact C-N 3.31Å; L2261-N2263 PolarHBondContact O-N 3.01Å; N2263-R2267 WeakPolarHBondContact O-CB 3.49Å; N2263-R2267 WeakPolarHBondContact O-CG 3.2Å; N2263-R2267 PolarHBondContact O-N 3.07Å; N2263-R2267 PolarHBondContact O-NE 3.13Å
2264	L	79.1	Confident	71.7	Confident	21 Å²	21	69.8 Å²	69.8	11%	0.11	33%	0.328	C	S	.	.	H	α-helix	trans	-68.1	-52.4	175.2	178.9	62.8	0	0	0	111.1	K2176 L2180 E2260 L2261 Y2262 I2266 R2267 L2268 F2358	K2176-L2264 HydrophobicContact CG-CD1 4.29Å; K2176-L2264 HydrophobicContact CG-CD2 3.6Å; L2180-L2264 HydrophobicContact CD1-CD2 4.26Å; E2260-L2264 WeakPolarHBondContact O-CB 3.03Å; E2260-L2264 PolarHBondContact O-N 2.62Å; L2261-L2264 CarbonylContact O-C 3.58Å; L2261-L2264 WeakPolarHBondContact O-CA 3.35Å; L2261-L2264 WeakPolarHBondContact O-CB 3.19Å; L2261-L2264 PolarHBondContact O-N 3.49Å; Y2262-L2264 VanDerWaalsContact C-N 3.33Å; Y2262-L2264 PolarHBondContact O-N 3.17Å; L2264-I2266 PolarHBondContact O-N 3.48Å; L2264-R2267 PolarHBondContact O-N 3.34Å; L2264-L2268 HydrophobicContact CD1-CD1 3.84Å; L2264-L2268 HydrophobicContact CD1-CG 4.18Å; L2264-L2268 HydrophobicContact CG-CD1 3.83Å; L2264-L2268 WeakPolarHBondContact O-CB 3.26Å; L2264-L2268 VanDerWaalsContact O-CG 3.28Å; L2264-L2268 WeakPolarHBondContact O-CG 3.47Å; L2264-L2268 PolarHBondContact O-N 3.5Å; L2264-F2358 HydrophobicContact CD2-CE1 3.88Å; L2264-F2358 HydrophobicContact CD2-CZ 3.62Å
2265	I	79.4	Confident	70	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.2	-46.3	177.6	-61.8	-49.3	0	0	0	110.5	L2261 R2267 L2268 Q2269 L2355 F2358 I2359 L2383 L2386 I2387	L2261-I2265 WeakPolarHBondContact O-CG1 3.43Å; L2261-I2265 PolarHBondContact O-N 3.44Å; I2265-R2267 PolarHBondContact O-N 3.12Å; I2265-L2268 PolarHBondContact O-N 2.79Å; I2265-Q2269 WeakPolarHBondContact O-CB 3.44Å; I2265-Q2269 PolarHBondContact O-N 2.89Å; I2265-L2355 HydrophobicContact CD1-CD1 3.48Å; I2265-L2355 VanDerWaalsContact CD1-CD1 3.48Å; I2265-L2355 HydrophobicContact CD1-CG 4.05Å; I2265-L2355 HydrophobicContact CG2-CD2 4.25Å; I2265-F2358 HydrophobicContact CD1-CD1 4.19Å; I2265-F2358 HydrophobicContact CD1-CE1 4.33Å; I2265-I2359 HydrophobicContact CD1-CD1 3.88Å; I2265-I2359 HydrophobicContact CD1-CG1 3.74Å; I2265-I2359 HydrophobicContact CG1-CD1 4.2Å; I2265-I2359 HydrophobicContact CG1-CG1 4.26Å; I2265-L2383 HydrophobicContact CB-CD2 4.34Å; I2265-L2383 HydrophobicContact CG1-CD2 3.59Å; I2265-L2386 HydrophobicContact CG2-CB 4.38Å; I2265-I2387 HydrophobicContact CG2-CG2 3.84Å
2266	I	77.1	Confident	68	Low	46 Å²	46	67.4 Å²	67.4	24%	0.236	32%	0.324	C	S	.	.	H	α-helix	trans	-63.6	-39.6	176.6	-67.5	163.5	0	0	0	111.5	Y2262 L2264 R2270 L2386	Y2262-I2266 VanDerWaalsContact O-CB 3.26Å; Y2262-I2266 WeakPolarHBondContact O-CB 3.49Å; Y2262-I2266 WeakPolarHBondContact O-CD1 3.28Å; Y2262-I2266 WeakPolarHBondContact O-CG1 2.93Å; Y2262-I2266 PolarHBondContact O-N 3.24Å; L2264-I2266 PolarHBondContact O-N 3.48Å; I2266-R2270 HydrophobicContact CG2-CG 4.46Å; I2266-R2270 VanDerWaalsContact O-CB 3.32Å; I2266-R2270 WeakPolarHBondContact O-CB 3.33Å; I2266-R2270 WeakPolarHBondContact O-CG 3.4Å; I2266-R2270 PolarHBondContact O-N 3.2Å; I2266-L2386 HydrophobicContact CD1-CD2 4.21Å; I2266-L2386 HydrophobicContact CG1-CD2 4.18Å
2267	R	71.6	Confident	66.1	Low	122 Å²	122	65.6 Å²	65.6	46%	0.46	32%	0.323	S	S	.	.	H	α-helix	trans	-65	-39.3	174	-80.1	175.4	-67.1	180	-2.1	112.1	N2263 L2264 I2265 K2271	N2263-R2267 WeakPolarHBondContact O-CB 3.49Å; N2263-R2267 WeakPolarHBondContact O-CG 3.2Å; N2263-R2267 PolarHBondContact O-N 3.07Å; N2263-R2267 PolarHBondContact O-NE 3.13Å; L2264-R2267 PolarHBondContact O-N 3.34Å; I2265-R2267 PolarHBondContact O-N 3.12Å; R2267-K2271 VanDerWaalsContact O-CB 3.28Å; R2267-K2271 WeakPolarHBondContact O-CB 3.43Å; R2267-K2271 VanDerWaalsContact O-CG 3.27Å; R2267-K2271 WeakPolarHBondContact O-CG 3.32Å; R2267-K2271 PolarHBondContact O-N 3.05Å
2268	L	66.3	Low	64.1	Low	14 Å²	14	70 Å²	70	7%	0.073	34%	0.343	C	S	.	.	H	α-helix	trans	-72	-45	179.4	-72.9	169.2	0	0	0	111.5	R2171 L2173 L2264 I2265 K2271 A2272 L2355	R2171-L2268 HydrophobicContact CB-CD2 3.73Å; R2171-L2268 HydrophobicContact CG-CD2 4.24Å; L2173-L2268 HydrophobicContact CD2-CD1 3.75Å; L2264-L2268 HydrophobicContact CD1-CD1 3.84Å; L2264-L2268 HydrophobicContact CD1-CG 4.18Å; L2264-L2268 HydrophobicContact CG-CD1 3.83Å; L2264-L2268 WeakPolarHBondContact O-CB 3.26Å; L2264-L2268 VanDerWaalsContact O-CG 3.28Å; L2264-L2268 WeakPolarHBondContact O-CG 3.47Å; L2264-L2268 PolarHBondContact O-N 3.5Å; I2265-L2268 PolarHBondContact O-N 2.79Å; L2268-K2271 CarbonylContact O-C 3.57Å; L2268-K2271 WeakPolarHBondContact O-CA 3.34Å; L2268-K2271 PolarHBondContact O-N 2.92Å; L2268-K2271 VanDerWaalsContact O-N 3.12Å; L2268-A2272 WeakPolarHBondContact O-CB 3.13Å; L2268-A2272 PolarHBondContact O-N 2.66Å; L2268-L2355 HydrophobicContact CB-CD1 3.75Å; L2268-L2355 HydrophobicContact CD1-CD1 3.55Å; L2268-L2355 HydrophobicContact CG-CD1 4.31Å
2269	Q	63.8	Low	62.1	Low	83 Å²	83	74 Å²	74	39%	0.388	36%	0.363	S	S	.	.	H	α-helix	trans	-58.3	-49.1	174.4	-173.5	-178.2	43.1	0	0	111.2	I2265 K2271 A2272 A2273 L2386	I2265-Q2269 WeakPolarHBondContact O-CB 3.44Å; I2265-Q2269 PolarHBondContact O-N 2.89Å; Q2269-K2271 VanDerWaalsContact C-N 3.3Å; Q2269-K2271 PolarHBondContact O-N 3.25Å; Q2269-A2272 CarbonylContact O-C 2.99Å; Q2269-A2272 PolarHBondContact O-N 3.2Å; Q2269-A2273 PolarHBondContact O-N 3.02Å; Q2269-L2386 PolarHBondContact NE2-O 2.67Å
2270	R	62	Low	60.1	Low	195 Å²	195	77.2 Å²	77.2	74%	0.736	38%	0.375	S	S	*	.	H	α-helix	trans	-59.7	-37.7	172.9	-72.5	175.1	-176.1	-175.1	4.3	112.7	I2266 A2272 A2273	I2266-R2270 HydrophobicContact CG2-CG 4.46Å; I2266-R2270 VanDerWaalsContact O-CB 3.32Å; I2266-R2270 WeakPolarHBondContact O-CB 3.33Å; I2266-R2270 WeakPolarHBondContact O-CG 3.4Å; I2266-R2270 PolarHBondContact O-N 3.2Å; R2270-A2272 VanDerWaalsContact C-N 3.31Å; R2270-A2273 WeakPolarHBondContact O-CB 3.3Å
2271	K	53.5	Low	58	Low	133 Å²	133	81.5 Å²	81.5	58%	0.578	39%	0.388	S	S	*	.	H	α-helix	trans	-76	-15.6	175.2	-79.6	179.1	174.9	-176	0	113.8	R2171 R2267 L2268 Q2269	R2171-K2271 PolarHBondContact NH2-O 3.08Å; R2267-K2271 VanDerWaalsContact O-CB 3.28Å; R2267-K2271 WeakPolarHBondContact O-CB 3.43Å; R2267-K2271 VanDerWaalsContact O-CG 3.27Å; R2267-K2271 WeakPolarHBondContact O-CG 3.32Å; R2267-K2271 PolarHBondContact O-N 3.05Å; L2268-K2271 CarbonylContact O-C 3.57Å; L2268-K2271 WeakPolarHBondContact O-CA 3.34Å; L2268-K2271 PolarHBondContact O-N 2.92Å; L2268-K2271 VanDerWaalsContact O-N 3.12Å; Q2269-K2271 VanDerWaalsContact C-N 3.3Å; Q2269-K2271 PolarHBondContact O-N 3.25Å
2272	A	46.8	Very low	55.6	Low	19 Å²	19	89.6 Å²	89.6	16%	0.157	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	8.1	178.3	0	0	0	0	0	113	L2268 Q2269 R2270 W2274 I2275	L2268-A2272 WeakPolarHBondContact O-CB 3.13Å; L2268-A2272 PolarHBondContact O-N 2.66Å; Q2269-A2272 CarbonylContact O-C 2.99Å; Q2269-A2272 PolarHBondContact O-N 3.2Å; R2270-A2272 VanDerWaalsContact C-N 3.31Å; A2272-W2274 PolarHBondContact O-N 2.96Å; A2272-I2275 PolarHBondContact O-N 3.41Å
2273	A	44.6	Very low	53	Low	82 Å²	82	92.7 Å²	92.7	68%	0.678	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	12.1	174.2	0	0	0	0	0	115.1	Q2269 R2270	Q2269-A2273 PolarHBondContact O-N 3.02Å; R2270-A2273 WeakPolarHBondContact O-CB 3.3Å
2274	W	37.4	Very low	50.5	Low	123 Å²	123	95.6 Å²	95.6	47%	0.466	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-9.8	164.2	73.9	-14.1	0	0	0	113.5	A2272 Y2311 V2317	A2272-W2274 PolarHBondContact O-N 2.96Å; W2274-Y2311 HydrophobicContact CZ2-CD2 4.18Å; W2274-V2317 HydrophobicContact CH2-CB 4.47Å; W2274-V2317 HydrophobicContact CH2-CG2 3.99Å; W2274-V2317 HydrophobicContact CZ3-CB 3.96Å; W2274-V2317 HydrophobicContact CZ3-CG2 3.98Å
2275	I	43.8	Very low	48.6	Very low	80 Å²	80	100.6 Å²	100.6	41%	0.41	50%	0.497	S	S	.	.	S	Bend	trans	-82.2	116.3	169.3	-61.2	170.1	0	0	0	106.6	A2272 P2277	A2272-I2275 PolarHBondContact O-N 3.41Å; I2275-P2277 WeakPolarHBondContact O-CD 3.5Å
2276	D	40.9	Very low	46.2	Very low	88 Å²	88	105.6 Å²	105.6	47%	0.471	53%	0.532	S	S	.	.			trans	-59.9	120	-172.9	-176.9	-2.6	0	0	0	112.6	E2278 L2279	D2276-E2278 PolarHBondContact O-N 3.07Å; D2276-E2278 VanDerWaalsContact O-N 3.14Å; D2276-E2278 WeakPolarHBondContact OD1-CB 3.41Å; D2276-E2278 PolarHBondContact OD1-N 3.48Å; D2276-L2279 HydrophobicContact CB-CB 4.42Å; D2276-L2279 VanDerWaalsContact O-CB 3.29Å; D2276-L2279 WeakPolarHBondContact O-CB 3.21Å; D2276-L2279 PolarHBondContact O-N 3.12Å
2277	P	41.9	Very low	43.8	Very low	78 Å²	78	111.6 Å²	111.6	51%	0.506	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63	-10.7	174.6	-22.7	34.9	0	0	0	115.5	I2275 R2281	I2275-P2277 WeakPolarHBondContact O-CD 3.5Å; P2277-R2281 PolarHBondContact O-NE 3.11Å
2278	E	41.3	Very low	41.7	Very low	107 Å²	107	113.3 Å²	113.3	50%	0.5	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.9	-29.3	168.2	-63.1	-147	143.2	0	0	112.9	D2276 M2280 R2281	D2276-E2278 PolarHBondContact O-N 3.07Å; D2276-E2278 VanDerWaalsContact O-N 3.14Å; D2276-E2278 WeakPolarHBondContact OD1-CB 3.41Å; D2276-E2278 PolarHBondContact OD1-N 3.48Å; E2278-M2280 PolarHBondContact O-N 2.95Å; E2278-R2281 PolarHBondContact O-N 3.32Å
2279	L	41.6	Very low	40.1	Very low	89 Å²	89	119.8 Å²	119.8	47%	0.466	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.4	-24.3	175.9	-159.8	73.8	0	0	0	111.8	D2276	D2276-L2279 HydrophobicContact CB-CB 4.42Å; D2276-L2279 VanDerWaalsContact O-CB 3.29Å; D2276-L2279 WeakPolarHBondContact O-CB 3.21Å; D2276-L2279 PolarHBondContact O-N 3.12Å
2280	M	38.9	Very low	38.3	Very low	113 Å²	113	123.1 Å²	123.1	56%	0.557	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-10.5	179.3	-61.6	-81.1	84.8	0	0	114.5	E2278	E2278-M2280 PolarHBondContact O-N 2.95Å
2281	R	37.7	Very low	36.4	Very low	170 Å²	170	125.5 Å²	125.5	64%	0.642	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-0.8	-172.4	-89.7	-173.7	-65.8	166.1	5.5	116	P2277 E2278 T2283	P2277-R2281 PolarHBondContact O-NE 3.11Å; E2278-R2281 PolarHBondContact O-N 3.32Å; R2281-T2283 PolarHBondContact O-N 3.26Å; R2281-T2283 VanDerWaalsContact O-N 3.15Å
2282	K	32.7	Very low	35.2	Very low	174 Å²	174	126.2 Å²	126.2	76%	0.757	66%	0.661	S	S	*	*	S	Bend	trans	-86.3	32.6	-178.4	-70.8	-178	178.1	168.2	0	114.3
2283	T	30.7	Very low	34	Very low	120 Å²	120	130.6 Å²	130.6	74%	0.736	69%	0.689	S	S	*	*			trans	-142.4	75	177.5	49.4	0	0	0	0	110.3	R2281	R2281-T2283 PolarHBondContact O-N 3.26Å; R2281-T2283 VanDerWaalsContact O-N 3.15Å
2284	D	29.3	Very low	33.3	Very low	150 Å²	150	136 Å²	136	80%	0.802	70%	0.7	S	S	*	*			trans	-97	129.6	172.5	-130.5	-28	0	0	0	109.2	S2286	D2284-S2286 PolarHBondContact O-N 2.95Å
2285	P	40.1	Very low	32.7	Very low	127 Å²	127	136.7 Å²	136.7	83%	0.825	71%	0.713	S	S	*	*			trans	-90.2	12.5	-151.1	-12.2	31.7	0	0	0	117.1
2286	S	27.5	Very low	31.9	Very low	104 Å²	104	139.9 Å²	139.9	73%	0.727	73%	0.73	S	S	*	*			trans	-120.2	89.7	-168.5	64.4	0	0	0	0	114.7	D2284	D2284-S2286 PolarHBondContact O-N 2.95Å
2287	I	28	Very low	31.2	Very low	172 Å²	172	140.7 Å²	140.7	88%	0.882	74%	0.735	S	S	*	*	S	Bend	trans	-150	138.4	151.9	-99.8	150.3	0	0	0	107.2
2288	D	25.8	Very low	30.6	Very low	158 Å²	158	137.5 Å²	137.5	85%	0.845	72%	0.716	S	S	*	*			trans	-65.9	147.5	-162.9	-90.4	-62.1	0	0	0	116.4	N2290	D2288-N2290 PolarHBondContact O-N 2.83Å
2289	N	33.3	Very low	30.2	Very low	151 Å²	151	135.4 Å²	135.4	81%	0.807	71%	0.713	S	S	*	*	S	Bend	trans	-64	96.5	171.9	-70.4	-70.4	0	0	0	111.1
2290	N	25.4	Very low	29.7	Very low	153 Å²	153	134.7 Å²	134.7	82%	0.818	71%	0.71	S	S	*	*			trans	-179.7	83.5	139.9	-95.6	-46.8	0	0	0	113.7	D2288	D2288-N2290 PolarHBondContact O-N 2.83Å
2291	R	23.9	Very low	29.4	Very low	245 Å²	245	131 Å²	131	93%	0.925	69%	0.692	S	S	*	*			trans	-171.8	116.8	135.8	-103.2	153	-163.9	-145.5	0.7	112	C2293	R2291-C2293 PolarHBondContact O-N 3.34Å
2292	T	28.2	Very low	29.2	Very low	147 Å²	147	122.9 Å²	122.9	90%	0.902	66%	0.661	S	S	*	*			trans	-69.3	111.7	174.8	45.9	0	0	0	0	111.5
2293	C	22	Very low	29.3	Very low	112 Å²	112	118.8 Å²	118.8	76%	0.757	64%	0.641	S	S	*	*			trans	-132.6	114.1	164.5	-75.8	0	0	0	0	109.4	R2291 L2295	R2291-C2293 PolarHBondContact O-N 3.34Å; C2293-L2295 PolarHBondContact O-N 2.68Å
2294	Q	28.4	Very low	29.6	Very low	194 Å²	194	114.3 Å²	114.3	91%	0.907	61%	0.613	S	S	*	*			trans	-73.7	120	175.3	-59.7	139.5	-59.1	0	0	109.4
2295	L	25.2	Very low	29.9	Very low	138 Å²	138	107.3 Å²	107.3	72%	0.723	58%	0.575	S	S	*	*			trans	-150.7	106	173.4	-102.2	175.2	0	0	0	113.8	C2293 N2297	C2293-L2295 PolarHBondContact O-N 2.68Å; L2295-N2297 PolarHBondContact O-N 2.84Å
2296	N	26.7	Very low	30	Very low	147 Å²	147	101.3 Å²	101.3	79%	0.786	54%	0.536	S	S	*	.			trans	35.6	82.5	139.3	-60.3	-15.3	0	0	0	118.9
2297	N	26.9	Very low	30.5	Very low	106 Å²	106	98.9 Å²	98.9	57%	0.567	52%	0.515	S	S	*	.			trans	-120.3	1.4	165.6	-120.2	-28.3	0	0	0	114.9	L2295 S2299 N2300	L2295-N2297 PolarHBondContact O-N 2.84Å; N2297-S2299 VanDerWaalsContact C-N 3.27Å; N2297-S2299 PolarHBondContact O-N 2.98Å; N2297-N2300 PolarHBondContact O-N 2.72Å; N2297-N2300 PolarHBondContact OD1-ND2 2.65Å
2298	G	29.3	Very low	31.1	Very low	11 Å²	11	91.6 Å²	91.6	11%	0.113	48%	0.479	C	S	.	.	H	α-helix	trans	-60.9	-25.7	-175.9	0	0	0	0	0	115.6	K770 I2301 C2302	K770-G2298 VanDerWaalsContact CE-O 3.29Å; K770-G2298 WeakPolarHBondContact CE-O 3.34Å; G2298-I2301 PolarHBondContact O-N 3.46Å; G2298-C2302 PolarHBondContact O-N 2.76Å
2299	S	32.8	Very low	31.7	Very low	63 Å²	63	86 Å²	86	44%	0.441	45%	0.452	S	S	.	.	H	α-helix	trans	-65.2	-41.2	176.8	48.7	0	0	0	0	112.3	N2297 I2301 C2302 R2303	N2297-S2299 VanDerWaalsContact C-N 3.27Å; N2297-S2299 PolarHBondContact O-N 2.98Å; S2299-I2301 VanDerWaalsContact C-N 3.27Å; S2299-I2301 PolarHBondContact O-N 3.11Å; S2299-C2302 CarbonylContact O-C 3.57Å; S2299-C2302 PolarHBondContact O-N 3.41Å; S2299-R2303 WeakPolarHBondContact O-CB 3.31Å; S2299-R2303 PolarHBondContact O-N 3.27Å
2300	N	31.9	Very low	32.2	Very low	74 Å²	74	78.9 Å²	78.9	40%	0.396	41%	0.414	S	S	.	.	H	α-helix	trans	-63	-34.6	178	-79.7	-35.1	0	0	0	112.1	N2297 R2303 N2304	N2297-N2300 PolarHBondContact O-N 2.72Å; N2297-N2300 PolarHBondContact OD1-ND2 2.65Å; N2300-R2303 CarbonylContact O-C 3.51Å; N2300-R2303 VanDerWaalsContact O-CA 3.25Å; N2300-R2303 WeakPolarHBondContact O-CA 3.36Å; N2300-R2303 WeakPolarHBondContact O-CB 3.35Å; N2300-R2303 PolarHBondContact O-N 3.46Å; N2300-R2303 VanDerWaalsContact O-N 3.08Å; N2300-N2304 PolarHBondContact O-N 3.43Å; N2300-N2304 PolarHBondContact O-ND2 3.35Å
2301	I	31.6	Very low	32.9	Very low	34 Å²	34	72.9 Å²	72.9	17%	0.174	38%	0.38	C	S	.	.	H	α-helix	trans	-71.9	-44	-176.7	-20.5	175.3	0	0	0	109.6	V768 G2298 S2299 R2303 N2304 L2350	V768-I2301 HydrophobicContact CB-CB 4.43Å; V768-I2301 HydrophobicContact CB-CG2 4.35Å; V768-I2301 VanDerWaalsContact CB-O 3.26Å; V768-I2301 WeakPolarHBondContact CB-O 3.34Å; V768-I2301 VanDerWaalsContact CG1-C 3.43Å; V768-I2301 HydrophobicContact CG1-CB 3.65Å; V768-I2301 HydrophobicContact CG1-CG2 3.86Å; V768-I2301 HydrophobicContact CG2-CB 4.24Å; V768-I2301 HydrophobicContact CG2-CG2 3.66Å; V768-I2301 WeakPolarHBondContact CG2-O 3.25Å; G2298-I2301 PolarHBondContact O-N 3.46Å; S2299-I2301 VanDerWaalsContact C-N 3.27Å; S2299-I2301 PolarHBondContact O-N 3.11Å; I2301-R2303 PolarHBondContact O-N 2.74Å; I2301-N2304 WeakPolarHBondContact O-CB 3.42Å; I2301-N2304 PolarHBondContact O-N 3.39Å; I2301-L2350 HydrophobicContact CB-CD1 4.4Å; I2301-L2350 HydrophobicContact CG1-CD1 4.35Å; I2301-L2350 HydrophobicContact CG2-CB 4.02Å; I2301-L2350 HydrophobicContact CG2-CD1 4Å; I2301-L2350 HydrophobicContact CG2-CG 4.04Å
2302	C	34.4	Very low	33.6	Very low	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-80.9	2.7	169.1	-21.6	0	0	0	0	113.1	I755 L757 K766 V768 K770 G2298 S2299 N2304	I755-C2302 HydrophobicContact CB-CB 4.41Å; I755-C2302 HydrophobicContact CG2-CB 4.06Å; L757-C2302 HydrophobicContact CB-CB 4.15Å; L757-C2302 VanDerWaalsContact CB-O 3.28Å; L757-C2302 WeakPolarHBondContact CB-O 2.96Å; L757-C2302 HydrophobicContact CD1-CB 3.59Å; L757-C2302 HydrophobicContact CG-CB 4.45Å; L757-C2302 PolarHBondContact N-O 2.96Å; K766-C2302 CarbonylContact C-O 3.49Å; K766-C2302 WeakPolarHBondContact CA-O 3.4Å; K766-C2302 WeakPolarHBondContact CB-O 3.27Å; K766-C2302 WeakPolarHBondContact CG-O 3.23Å; K766-C2302 CarbonylContact O-C 3.43Å; K766-C2302 VanDerWaalsContact O-C 3.29Å; K766-C2302 WeakPolarHBondContact O-CA 3.3Å; V768-C2302 HydrophobicContact CB-CB 4.11Å; V768-C2302 HydrophobicContact CG1-CB 4.04Å; V768-C2302 WeakPolarHBondContact CG1-SG 3.3Å; K770-C2302 WeakPolarHBondContact CE-SG 3.43Å; G2298-C2302 PolarHBondContact O-N 2.76Å; S2299-C2302 CarbonylContact O-C 3.57Å; S2299-C2302 PolarHBondContact O-N 3.41Å; C2302-N2304 VanDerWaalsContact C-N 3.31Å
2303	R	34.4	Very low	34.4	Very low	89 Å²	89	59.2 Å²	59.2	34%	0.336	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	26.4	153.8	-155.6	-170	179.7	127.9	2.9	111.6	D759 K766 S2299 N2300 I2301	D759-R2303 HydrophobicContact CB-CG 4.19Å; D759-R2303 IonicContact OD1-CZ 3.48Å; D759-R2303 VanDerWaalsContact OD1-CZ 3.22Å; D759-R2303 IonicContact OD1-NH1 3.3Å; D759-R2303 PolarHBondContact OD1-NH1 2.91Å; D759-R2303 IonicContact OD1-NH2 2.69Å; D759-R2303 PolarHBondContact OD1-NH2 3.41Å; D759-R2303 WeakPolarHBondContact OD2-CD 3.32Å; D759-R2303 WeakPolarHBondContact OD2-CG 3.02Å; D759-R2303 IonicContact OD2-CZ 3.5Å; D759-R2303 IonicContact OD2-NE 3.17Å; D759-R2303 PolarHBondContact OD2-NE 2.99Å; D759-R2303 IonicContact OD2-NH1 2.66Å; D759-R2303 PolarHBondContact OD2-NH1 3.19Å; K766-R2303 VanDerWaalsContact CD-CA 3.42Å; K766-R2303 HydrophobicContact CD-CB 4.1Å; K766-R2303 HydrophobicContact CD-CG 3.59Å; K766-R2303 VanDerWaalsContact CD-O 3.28Å; K766-R2303 WeakPolarHBondContact CD-O 3.2Å; K766-R2303 VanDerWaalsContact CE-C 3.45Å; K766-R2303 WeakPolarHBondContact CE-O 3.34Å; K766-R2303 PolarHBondContact NZ-O 2.7Å; S2299-R2303 WeakPolarHBondContact O-CB 3.31Å; S2299-R2303 PolarHBondContact O-N 3.27Å; N2300-R2303 CarbonylContact O-C 3.51Å; N2300-R2303 VanDerWaalsContact O-CA 3.25Å; N2300-R2303 WeakPolarHBondContact O-CA 3.36Å; N2300-R2303 WeakPolarHBondContact O-CB 3.35Å; N2300-R2303 PolarHBondContact O-N 3.46Å; N2300-R2303 VanDerWaalsContact O-N 3.08Å; I2301-R2303 PolarHBondContact O-N 2.74Å
2304	N	36.4	Very low	35.4	Very low	26 Å²	26	60.6 Å²	60.6	14%	0.139	32%	0.322	C	S	.	.	S	Bend	trans	-121.1	-14.6	166.3	-85.1	-76.7	0	0	0	119.7	K766 N2300 I2301 C2302 V2308 L2350	K766-N2304 VanDerWaalsContact CG-N 3.32Å; N2300-N2304 PolarHBondContact O-N 3.43Å; N2300-N2304 PolarHBondContact O-ND2 3.35Å; I2301-N2304 WeakPolarHBondContact O-CB 3.42Å; I2301-N2304 PolarHBondContact O-N 3.39Å; C2302-N2304 VanDerWaalsContact C-N 3.31Å; N2304-V2308 WeakPolarHBondContact O-CG2 3.44Å; N2304-L2350 HydrophobicContact CB-CD2 4.29Å; N2304-L2350 HydrophobicContact CB-CG 4.24Å; N2304-L2350 WeakPolarHBondContact ND2-CD2 3.32Å
2305	N	35.5	Very low	35.8	Very low	3 Å²	3	56.5 Å²	56.5	2%	0.016	30%	0.301	C	S	.	.	H	α-helix	trans	-103.4	3.3	-176.7	-64.5	9.3	0	0	0	117.7	P765 K766 T767 S2309 I2347	P765-N2305 CarbonylContact O-C 3.52Å; K766-N2305 WeakPolarHBondContact O-CA 3.35Å; K766-N2305 WeakPolarHBondContact O-CB 3.41Å; K766-N2305 PolarHBondContact O-N 3.03Å; T767-N2305 WeakPolarHBondContact O-CB 3.49Å; T767-N2305 PolarHBondContact O-ND2 3.04Å; N2305-S2309 WeakPolarHBondContact O-CB 3.37Å; N2305-S2309 PolarHBondContact O-N 2.93Å; N2305-S2309 PolarHBondContact O-OG 3.02Å; N2305-I2347 VanDerWaalsContact CG-O 3.27Å; N2305-I2347 PolarHBondContact ND2-O 3.37Å; N2305-I2347 PolarHBondContact OD1-O 2.85Å
2306	D	42.2	Very low	36.3	Very low	1 Å²	1	54.2 Å²	54.2	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-58.2	-69	152.1	-110.7	58.6	0	0	0	106	F764 P765 K766 V2308 S2309 A2310	F764-D2306 VanDerWaalsContact C-OD1 3.24Å; F764-D2306 WeakPolarHBondContact CA-OD2 3.49Å; F764-D2306 PolarHBondContact N-OD2 2.83Å; F764-D2306 CarbonylContact O-C 3.03Å; F764-D2306 VanDerWaalsContact O-C 3.31Å; F764-D2306 WeakPolarHBondContact O-CA 3.35Å; F764-D2306 WeakPolarHBondContact O-CB 3.47Å; F764-D2306 VanDerWaalsContact O-OD2 3.08Å; P765-D2306 WeakPolarHBondContact CA-OD1 3.09Å; P765-D2306 WeakPolarHBondContact O-CA 3.1Å; P765-D2306 PolarHBondContact O-N 2.78Å; K766-D2306 VanDerWaalsContact C-N 3.29Å; K766-D2306 HydrophobicContact CB-CB 3.39Å; K766-D2306 VanDerWaalsContact CB-OD1 3.23Å; K766-D2306 WeakPolarHBondContact CB-OD1 3.38Å; K766-D2306 HydrophobicContact CD-CB 3.45Å; K766-D2306 VanDerWaalsContact CD-CB 3.45Å; K766-D2306 HydrophobicContact CG-CB 3.33Å; K766-D2306 VanDerWaalsContact N-CA 3.35Å; K766-D2306 PolarHBondContact N-OD1 2.98Å; D2306-V2308 CarbonylContact O-C 3.57Å; D2306-V2308 PolarHBondContact O-N 3.16Å; D2306-S2309 CarbonylContact O-C 3.59Å; D2306-S2309 WeakPolarHBondContact O-CA 3.13Å; D2306-S2309 PolarHBondContact O-N 3.3Å; D2306-A2310 WeakPolarHBondContact O-CB 3.19Å; D2306-A2310 PolarHBondContact O-N 3.07Å
2307	L	38.4	Very low	36.6	Very low	53 Å²	53	49.4 Å²	49.4	28%	0.277	27%	0.272	S	S	.	.	H	α-helix	trans	-61.1	-31.3	-166.4	-75.1	171.4	0	0	0	108.6	K766 Y2311 V2317	K766-L2307 VanDerWaalsContact NZ-CD1 3.33Å; L2307-Y2311 WeakPolarHBondContact O-CB 3.25Å; L2307-Y2311 PolarHBondContact O-N 2.68Å; L2307-V2317 HydrophobicContact CD2-CG1 4.36Å; L2307-V2317 HydrophobicContact CD2-CG2 3.79Å
2308	V	39.7	Very low	36.9	Very low	19 Å²	19	46.3 Å²	46.3	12%	0.115	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-55.7	164.8	-176.3	0	0	0	0	113.1	N2304 D2306 A2310 Y2311 L2312 I2347 F2352	N2304-V2308 WeakPolarHBondContact O-CG2 3.44Å; D2306-V2308 CarbonylContact O-C 3.57Å; D2306-V2308 PolarHBondContact O-N 3.16Å; V2308-A2310 VanDerWaalsContact C-N 3.25Å; V2308-A2310 PolarHBondContact O-N 3.47Å; V2308-Y2311 CarbonylContact O-C 3.51Å; V2308-Y2311 PolarHBondContact O-N 3.22Å; V2308-Y2311 VanDerWaalsContact O-N 3.15Å; V2308-L2312 HydrophobicContact CG1-CD1 3.8Å; V2308-L2312 HydrophobicContact CG1-CG 4.05Å; V2308-L2312 WeakPolarHBondContact O-CB 3.31Å; V2308-L2312 VanDerWaalsContact O-CG 3.22Å; V2308-L2312 WeakPolarHBondContact O-CG 3.43Å; V2308-L2312 PolarHBondContact O-N 2.96Å; V2308-I2347 HydrophobicContact CG1-CG2 4.46Å; V2308-F2352 HydrophobicContact CG1-CD1 4.21Å; V2308-F2352 HydrophobicContact CG1-CE1 3.98Å
2309	S	40.2	Very low	37.2	Very low	40 Å²	40	51.2 Å²	51.2	28%	0.28	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-28.7	178.5	-61.7	0	0	0	0	114.4	N2305 D2306 A2313	N2305-S2309 WeakPolarHBondContact O-CB 3.37Å; N2305-S2309 PolarHBondContact O-N 2.93Å; N2305-S2309 PolarHBondContact O-OG 3.02Å; D2306-S2309 CarbonylContact O-C 3.59Å; D2306-S2309 WeakPolarHBondContact O-CA 3.13Å; D2306-S2309 PolarHBondContact O-N 3.3Å; S2309-A2313 WeakPolarHBondContact O-CB 3.47Å; S2309-A2313 PolarHBondContact O-N 3.16Å
2310	A	42.8	Very low	37.1	Very low	1 Å²	1	56.7 Å²	56.7	1%	0.008	32%	0.316	C	S	.	.	H	α-helix	trans	-71.3	-49.9	173.3	0	0	0	0	0	110.8	F764 D2306 V2308 L2312 A2313 E2314 K2315	F764-A2310 HydrophobicContact CB-CB 3.52Å; F764-A2310 HydrophobicContact CD2-CB 3.67Å; F764-A2310 HydrophobicContact CG-CB 3.91Å; D2306-A2310 WeakPolarHBondContact O-CB 3.19Å; D2306-A2310 PolarHBondContact O-N 3.07Å; V2308-A2310 VanDerWaalsContact C-N 3.25Å; V2308-A2310 PolarHBondContact O-N 3.47Å; A2310-L2312 VanDerWaalsContact C-N 3.25Å; A2310-L2312 PolarHBondContact O-N 3.48Å; A2310-A2313 CarbonylContact O-C 3.45Å; A2310-A2313 PolarHBondContact O-N 2.97Å; A2310-E2314 PolarHBondContact O-N 2.87Å; A2310-K2315 PolarHBondContact O-N 2.58Å
2311	Y	40.2	Very low	36.8	Very low	28 Å²	28	59.9 Å²	59.9	11%	0.11	33%	0.332	C	S	.	.	H	α-helix	trans	-64.3	-28.3	174.5	-179.7	-72.8	0	0	0	111.9	P2168 T2170 W2274 L2307 V2308 P2354	P2168-Y2311 HydrophobicContact CG-CE1 4.08Å; T2170-Y2311 VanDerWaalsContact CB-O 3.3Å; T2170-Y2311 WeakPolarHBondContact CB-O 3.4Å; T2170-Y2311 WeakPolarHBondContact CG2-O 3.33Å; T2170-Y2311 PolarHBondContact OG1-O 2.87Å; W2274-Y2311 HydrophobicContact CZ2-CD2 4.18Å; L2307-Y2311 WeakPolarHBondContact O-CB 3.25Å; L2307-Y2311 PolarHBondContact O-N 2.68Å; V2308-Y2311 CarbonylContact O-C 3.51Å; V2308-Y2311 PolarHBondContact O-N 3.22Å; V2308-Y2311 VanDerWaalsContact O-N 3.15Å; Y2311-P2354 HydrophobicContact CD1-CG 4Å; Y2311-P2354 HydrophobicContact CE1-CB 3.93Å; Y2311-P2354 HydrophobicContact CE1-CG 3.7Å
2312	L	38.3	Very low	36.4	Very low	53 Å²	53	66.5 Å²	66.5	28%	0.277	36%	0.362	S	S	.	.	H	α-helix	trans	-81.1	-41.3	173.1	-68.5	179	0	0	0	111.3	P2168 V2308 A2310 E2314 I2347	P2168-L2312 HydrophobicContact CB-CD2 3.8Å; P2168-L2312 HydrophobicContact CG-CD2 3.61Å; V2308-L2312 HydrophobicContact CG1-CD1 3.8Å; V2308-L2312 HydrophobicContact CG1-CG 4.05Å; V2308-L2312 WeakPolarHBondContact O-CB 3.31Å; V2308-L2312 VanDerWaalsContact O-CG 3.22Å; V2308-L2312 WeakPolarHBondContact O-CG 3.43Å; V2308-L2312 PolarHBondContact O-N 2.96Å; A2310-L2312 VanDerWaalsContact C-N 3.25Å; A2310-L2312 PolarHBondContact O-N 3.48Å; L2312-E2314 VanDerWaalsContact C-N 3.33Å; L2312-E2314 PolarHBondContact O-N 2.92Å; L2312-I2347 HydrophobicContact CD1-CD1 4.22Å
2313	A	44.8	Very low	36	Very low	52 Å²	52	75.3 Å²	75.3	43%	0.43	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	35.3	-178.2	0	0	0	0	0	113.9	S2309 A2310 K2315	S2309-A2313 WeakPolarHBondContact O-CB 3.47Å; S2309-A2313 PolarHBondContact O-N 3.16Å; A2310-A2313 CarbonylContact O-C 3.45Å; A2310-A2313 PolarHBondContact O-N 2.97Å; A2313-K2315 WeakPolarHBondContact O-CG 3.28Å; A2313-K2315 PolarHBondContact O-N 3.47Å
2314	E	42.9	Very low	35.5	Very low	141 Å²	141	78.8 Å²	78.8	66%	0.659	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	8.3	171.6	-58.7	-108.7	114.1	0	0	116.9	T2170 A2310 L2312	T2170-E2314 VanDerWaalsContact CA-OE1 3.29Å; T2170-E2314 WeakPolarHBondContact CA-OE1 3.3Å; T2170-E2314 HydrophobicContact CG2-CB 4.13Å; T2170-E2314 HydrophobicContact CG2-CG 3.71Å; T2170-E2314 WeakPolarHBondContact CG2-OE1 3.45Å; A2310-E2314 PolarHBondContact O-N 2.87Å; L2312-E2314 VanDerWaalsContact C-N 3.33Å; L2312-E2314 PolarHBondContact O-N 2.92Å
2315	K	37.7	Very low	35	Very low	108 Å²	108	83.8 Å²	83.8	47%	0.47	46%	0.457	S	S	.	.			trans	-95.3	121.8	-162.4	-89.1	-178	-56.3	-173.7	0	113.7	F764 A2310 A2313 V2317	F764-K2315 HydrophobicContact CD1-CB 3.93Å; F764-K2315 HydrophobicContact CD1-CD 3.88Å; F764-K2315 HydrophobicContact CD1-CG 4.46Å; F764-K2315 HydrophobicContact CD2-CB 4.11Å; F764-K2315 HydrophobicContact CE1-CB 3.71Å; F764-K2315 HydrophobicContact CE1-CD 3.61Å; F764-K2315 HydrophobicContact CE1-CG 4.06Å; F764-K2315 HydrophobicContact CE2-CB 3.87Å; F764-K2315 HydrophobicContact CG-CB 4.15Å; F764-K2315 HydrophobicContact CZ-CB 3.67Å; F764-K2315 HydrophobicContact CZ-CD 4.34Å; F764-K2315 HydrophobicContact CZ-CG 4.32Å; A2310-K2315 PolarHBondContact O-N 2.58Å; A2313-K2315 WeakPolarHBondContact O-CG 3.28Å; A2313-K2315 PolarHBondContact O-N 3.47Å; K2315-V2317 PolarHBondContact O-N 2.66Å
2316	S	36.2	Very low	34.7	Very low	90 Å²	90	87.5 Å²	87.5	63%	0.629	49%	0.488	S	S	*	.			trans	-69.5	118.4	-174.2	55.1	0	0	0	0	112.8	F764 G2318	F764-S2316 WeakPolarHBondContact CE2-O 3.49Å; S2316-G2318 PolarHBondContact O-N 3.16Å
2317	V	32.5	Very low	33.8	Very low	46 Å²	46	95.2 Å²	95.2	28%	0.279	53%	0.529	S	S	.	.			trans	-72.9	71.7	172.2	-169.1	0	0	0	0	109.7	E762 F764 W2274 L2307 K2315	E762-V2317 HydrophobicContact CG-CG1 4.47Å; F764-V2317 HydrophobicContact CD2-CG2 4.4Å; W2274-V2317 HydrophobicContact CH2-CB 4.47Å; W2274-V2317 HydrophobicContact CH2-CG2 3.99Å; W2274-V2317 HydrophobicContact CZ3-CB 3.96Å; W2274-V2317 HydrophobicContact CZ3-CG2 3.98Å; L2307-V2317 HydrophobicContact CD2-CG1 4.36Å; L2307-V2317 HydrophobicContact CD2-CG2 3.79Å; K2315-V2317 PolarHBondContact O-N 2.66Å
2318	G	32.7	Very low	33.3	Very low	41 Å²	41	100.8 Å²	100.8	42%	0.423	56%	0.56	S	S	.	*			trans	-90.9	121.9	-178.6	0	0	0	0	0	112.2	S2316 H2320	S2316-G2318 PolarHBondContact O-N 3.16Å; G2318-H2320 PolarHBondContact O-N 3.46Å
2319	S	36.6	Very low	32.7	Very low	114 Å²	114	106.8 Å²	106.8	80%	0.797	59%	0.591	S	S	*	*	S	Bend	trans	-76.1	110.8	166.6	37.3	0	0	0	0	109.9
2320	H	29.8	Very low	32.2	Very low	178 Å²	178	114.6 Å²	114.6	82%	0.824	62%	0.62	S	S	*	*	S	Bend	trans	66.2	176.6	-174.5	-68.6	-100	0	0	0	116.4	G2318	G2318-H2320 PolarHBondContact O-N 3.46Å
2321	I	25.3	Very low	31.4	Very low	141 Å²	141	121.7 Å²	121.7	72%	0.723	66%	0.658	S	S	*	*			trans	86.7	133.8	179.8	-57.6	163.6	0	0	0	115.2
2322	E	22.6	Very low	30.7	Very low	173 Å²	173	125.9 Å²	125.9	81%	0.808	69%	0.691	S	S	*	*			trans	-80.8	171.7	-178.4	-62.1	102.3	145.2	0	0	114.7
2323	F	27.2	Very low	30.1	Very low	184 Å²	184	129.7 Å²	129.7	81%	0.807	71%	0.712	S	S	*	*			trans	-104.4	118.5	176.3	-87.4	-104.9	0	0	0	110.8
2324	D	23	Very low	29.5	Very low	163 Å²	163	132.6 Å²	132.6	87%	0.872	73%	0.727	S	S	*	*			trans	-95.7	128.1	171	-162	-5.3	0	0	0	109.7
2325	V	26.9	Very low	28.9	Very low	131 Å²	131	131.9 Å²	131.9	79%	0.794	73%	0.727	S	S	*	*			trans	-115.8	73.8	-159	-172.5	0	0	0	0	111.9
2326	A	27.7	Very low	28.8	Very low	81 Å²	81	131.4 Å²	131.4	67%	0.669	73%	0.729	S	S	*	*			trans	-153.3	89.4	175	0	0	0	0	0	114
2327	N	24.7	Very low	28.9	Very low	162 Å²	162	131.7 Å²	131.7	87%	0.866	73%	0.727	S	S	*	*			trans	179.6	57.6	146.7	-101.6	-60.8	0	0	0	114.4	N2329	N2327-N2329 PolarHBondContact O-N 3.4Å
2328	N	27.2	Very low	29.4	Very low	170 Å²	170	132.3 Å²	132.3	91%	0.909	73%	0.728	S	S	*	*			trans	-84.9	85.7	166.5	-85.9	-3.6	0	0	0	110.4
2329	N	27.4	Very low	29.8	Very low	145 Å²	145	132 Å²	132	78%	0.775	72%	0.719	S	S	*	*			trans	-157.8	64.9	169.9	-121.9	-30	0	0	0	114	N2327	N2327-N2329 PolarHBondContact O-N 3.4Å
2330	K	28.7	Very low	30.6	Very low	204 Å²	204	128.9 Å²	128.9	89%	0.887	69%	0.693	S	S	*	*			trans	-141.2	107.3	160.9	-75.2	-163.1	176.3	-174.7	0	110.7
2331	N	26.5	Very low	31.7	Very low	150 Å²	150	120.8 Å²	120.8	80%	0.802	66%	0.656	S	S	*	*			trans	-71.1	179.2	167.5	-75	-22.9	0	0	0	111.4
2332	S	26	Very low	32.9	Very low	117 Å²	117	115.5 Å²	115.5	82%	0.818	63%	0.631	S	S	*	*			trans	62.6	91.3	-173.7	72.8	0	0	0	0	114.7
2333	N	26.4	Very low	34.2	Very low	132 Å²	132	109.6 Å²	109.6	71%	0.706	61%	0.611	S	S	*	*			trans	-133.6	86.2	160.6	-165.4	7.6	0	0	0	108.5	N2335	N2333-N2335 PolarHBondContact O-N 3.07Å
2334	P	32.1	Very low	35.1	Very low	114 Å²	114	101.8 Å²	101.8	74%	0.74	58%	0.577	S	S	*	*			trans	-73.4	-3.7	-173.8	30.8	-35.9	0	0	0	113.7	L2336	P2334-L2336 PolarHBondContact O-N 3.01Å
2335	N	30.2	Very low	36	Very low	125 Å²	125	97 Å²	97	67%	0.668	55%	0.549	S	S	*	.			trans	-78	62.7	179.1	-65.1	-6.5	0	0	0	111.1	N2333 V2337	N2333-N2335 PolarHBondContact O-N 3.07Å; N2335-V2337 VanDerWaalsContact C-N 3.35Å; N2335-V2337 PolarHBondContact O-N 3.47Å
2336	L	35.3	Very low	36.9	Very low	99 Å²	99	91.7 Å²	91.7	52%	0.518	52%	0.52	S	S	.	.			trans	-74.3	87.2	174.6	-151.1	86.1	0	0	0	109.2	P2334 L2338 W2454 W2472	P2334-L2336 PolarHBondContact O-N 3.01Å; L2336-L2338 PolarHBondContact O-N 2.97Å; L2336-L2338 VanDerWaalsContact O-N 3.14Å; L2336-W2454 HydrophobicContact CD2-CB 4.08Å; L2336-W2454 HydrophobicContact CD2-CG 4.1Å; L2336-W2472 HydrophobicContact CD2-CH2 4.2Å
2337	V	38.5	Very low	37.7	Very low	95 Å²	95	88.6 Å²	88.6	58%	0.576	49%	0.492	S	S	*	.			trans	-63.6	115.1	-173.9	-177.4	0	0	0	0	110.9	N2335	N2335-V2337 VanDerWaalsContact C-N 3.35Å; N2335-V2337 PolarHBondContact O-N 3.47Å
2338	L	41.8	Very low	38.5	Very low	60 Å²	60	82.6 Å²	82.6	31%	0.314	46%	0.457	S	S	.	.			trans	-53.4	124	169.8	-72.1	132.8	0	0	0	110.2	L2336 V2452 W2472	L2336-L2338 PolarHBondContact O-N 2.97Å; L2336-L2338 VanDerWaalsContact O-N 3.14Å; L2338-V2452 HydrophobicContact CD2-CB 4.03Å; L2338-V2452 HydrophobicContact CD2-CG1 4.32Å; L2338-V2452 WeakPolarHBondContact CD2-O 3.21Å; L2338-W2472 HydrophobicContact CB-CH2 4.47Å; L2338-W2472 HydrophobicContact CB-CZ3 4.45Å; L2338-W2472 HydrophobicContact CD2-CE3 3.81Å; L2338-W2472 HydrophobicContact CD2-CH2 4.14Å; L2338-W2472 HydrophobicContact CD2-CZ3 3.36Å; L2338-W2472 HydrophobicContact CG-CH2 4.06Å; L2338-W2472 HydrophobicContact CG-CZ3 3.79Å
2339	P	42.6	Very low	39.2	Very low	35 Å²	35	77.8 Å²	77.8	23%	0.227	43%	0.434	C	S	.	.			trans	-73.4	151.2	177.4	33.6	-37.3	0	0	0	110.3	W2472	P2339-W2472 VanDerWaalsContact CD-NE1 3.28Å; P2339-W2472 VanDerWaalsContact CG-CD1 3.42Å; P2339-W2472 HydrophobicContact CG-CD2 4.09Å; P2339-W2472 HydrophobicContact CG-CG 3.96Å; P2339-W2472 HydrophobicContact CG-CZ2 4.35Å; P2339-W2472 VanDerWaalsContact CG-NE1 3.26Å
2340	L	52.8	Low	39.7	Very low	47 Å²	47	74 Å²	74	25%	0.246	41%	0.413	C	S	.	.			trans	-141.4	165.6	-176.7	-66.6	168.4	0	0	0	111.2	R2165	R2165-L2340 HydrophobicContact CB-CD1 4.14Å; R2165-L2340 HydrophobicContact CG-CD1 4.25Å; R2165-L2340 VanDerWaalsContact NH1-CD1 3.33Å
2341	L	53.6	Low	40.6	Very low	9 Å²	9	68.4 Å²	68.4	5%	0.047	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-90.9	169.4	-160.8	-72.1	161.1	0	0	0	111.7	V2446 H2559 I2560 H2563 F2564	L2341-V2446 WeakPolarHBondContact CD1-O 3.15Å; L2341-H2559 HydrophobicContact CD2-CB 3.87Å; L2341-H2559 WeakPolarHBondContact CD2-O 3.16Å; L2341-I2560 HydrophobicContact CD1-CD1 4.48Å; L2341-I2560 HydrophobicContact CD1-CG1 3.59Å; L2341-I2560 HydrophobicContact CD2-CB 4.32Å; L2341-I2560 HydrophobicContact CD2-CG1 3.79Å; L2341-I2560 VanDerWaalsContact CD2-N 3.31Å; L2341-I2560 HydrophobicContact CG-CG1 4.32Å; L2341-H2563 HydrophobicContact CD2-CB 4.33Å; L2341-F2564 HydrophobicContact CD1-CE2 3.98Å; L2341-F2564 HydrophobicContact CG-CE2 4.5Å
2342	P	50.2	Low	41.7	Very low	30 Å²	30	62.1 Å²	62.1	20%	0.195	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-67.7	161.3	-131.1	20.3	-31.7	0	0	0	116.5	V2556 H2559	P2342-V2556 HydrophobicContact CG-CB 4.44Å; P2342-V2556 HydrophobicContact CG-CG2 4.09Å; P2342-H2559 HydrophobicContact CB-CB 4.17Å; P2342-H2559 HydrophobicContact CG-CB 3.87Å
2343	A	49	Very low	43.4	Very low	48 Å²	48	59.1 Å²	59.1	40%	0.397	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-56.7	138.1	-170.1	0	0	0	0	0	114.3	I2347	A2343-I2347 HydrophobicContact CB-CD1 3.95Å
2344	H	46	Very low	45.4	Very low	20 Å²	20	53.4 Å²	53.4	9%	0.093	31%	0.306	C	S	.	.			trans	-44.6	138.3	-177.4	-175.9	-144.9	0	0	0	114.2	Y2166 A2346 I2347 F2352 D2357 P2401	Y2166-H2344 HydrophobicContact CD1-CB 3.94Å; H2344-A2346 WeakPolarHBondContact CE1-CB 3.46Å; H2344-A2346 PolarHBondContact O-N 3.49Å; H2344-I2347 HydrophobicContact CB-CD1 4.05Å; H2344-I2347 HydrophobicContact CB-CG1 4.26Å; H2344-I2347 WeakPolarHBondContact O-CB 3.49Å; H2344-I2347 PolarHBondContact O-N 3.44Å; H2344-I2347 VanDerWaalsContact O-N 3.09Å; H2344-F2352 AromaticContact ND1-CE2 3.95Å; H2344-D2357 IonicContact CE1-OD2 3.08Å; H2344-D2357 PolarHBondContact CE1-OD2 2.8Å; H2344-D2357 IonicContact ND1-OD2 3.85Å; H2344-D2357 PolarHBondContact ND1-OD2 2.71Å; H2344-P2401 VanDerWaalsContact CD2-CA 3.46Å; H2344-P2401 WeakPolarHBondContact CD2-CA 3.36Å
2345	Q	43	Very low	47.5	Very low	62 Å²	62	48.8 Å²	48.8	29%	0.29	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-56.2	-36.8	179.8	-179.8	171.4	-6.1	0	0	113	I2347 Y2348 I2404	Q2345-I2347 VanDerWaalsContact C-N 3.31Å; Q2345-I2347 PolarHBondContact O-N 3.41Å; Q2345-Y2348 WeakPolarHBondContact O-CD2 3.39Å; Q2345-Y2348 PolarHBondContact O-N 2.81Å; Q2345-I2404 VanDerWaalsContact OE1-CG1 3.25Å
2346	A	45.1	Very low	49.9	Very low	20 Å²	20	43 Å²	43	17%	0.165	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-71	-22	-178.5	0	0	0	0	0	113.6	H2344 Y2348 T2349 F2352	H2344-A2346 WeakPolarHBondContact CE1-CB 3.46Å; H2344-A2346 PolarHBondContact O-N 3.49Å; A2346-Y2348 PolarHBondContact O-N 3.29Å; A2346-T2349 PolarHBondContact O-N 2.92Å; A2346-T2349 PolarHBondContact O-OG1 3.16Å; A2346-F2352 VanDerWaalsContact C-CD2 3.43Å; A2346-F2352 HydrophobicContact CB-CD2 3.63Å; A2346-F2352 HydrophobicContact CB-CE2 4.13Å; A2346-F2352 WeakPolarHBondContact O-CB 3.38Å; A2346-F2352 WeakPolarHBondContact O-CD2 3.07Å; A2346-F2352 WeakPolarHBondContact O-CG 3.18Å
2347	I	44	Very low	51.8	Low	17 Å²	17	39 Å²	39	9%	0.087	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-50.9	-30.1	171.7	-75.2	166.1	0	0	0	110.4	N2305 V2308 L2312 A2343 H2344 Q2345 F2352	N2305-I2347 VanDerWaalsContact CG-O 3.27Å; N2305-I2347 PolarHBondContact ND2-O 3.37Å; N2305-I2347 PolarHBondContact OD1-O 2.85Å; V2308-I2347 HydrophobicContact CG1-CG2 4.46Å; L2312-I2347 HydrophobicContact CD1-CD1 4.22Å; A2343-I2347 HydrophobicContact CB-CD1 3.95Å; H2344-I2347 HydrophobicContact CB-CD1 4.05Å; H2344-I2347 HydrophobicContact CB-CG1 4.26Å; H2344-I2347 WeakPolarHBondContact O-CB 3.49Å; H2344-I2347 PolarHBondContact O-N 3.44Å; H2344-I2347 VanDerWaalsContact O-N 3.09Å; Q2345-I2347 VanDerWaalsContact C-N 3.31Å; Q2345-I2347 PolarHBondContact O-N 3.41Å; I2347-F2352 HydrophobicContact CB-CE1 4.34Å; I2347-F2352 HydrophobicContact CB-CZ 4.41Å; I2347-F2352 HydrophobicContact CD1-CZ 4.38Å; I2347-F2352 HydrophobicContact CG1-CD1 4.29Å; I2347-F2352 HydrophobicContact CG1-CE1 3.57Å; I2347-F2352 HydrophobicContact CG1-CE2 3.98Å; I2347-F2352 HydrophobicContact CG1-CZ 3.38Å
2348	Y	43.3	Very low	54	Low	35 Å²	35	34.5 Å²	34.5	14%	0.137	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-89	13.2	-179.8	-53.9	-82	0	0	0	116	T767 V768 M769 Q2345 A2346	T767-Y2348 HydrophobicContact CG2-CE1 4.3Å; T767-Y2348 WeakPolarHBondContact O-CD1 3.38Å; V768-Y2348 WeakPolarHBondContact CG2-O 3.4Å; M769-Y2348 HydrophobicContact CB-CG 4.44Å; M769-Y2348 HydrophobicContact CE-CD1 3.61Å; M769-Y2348 HydrophobicContact CE-CD2 4.09Å; M769-Y2348 HydrophobicContact CE-CE1 3.59Å; M769-Y2348 HydrophobicContact CE-CE2 4.08Å; M769-Y2348 HydrophobicContact CE-CG 3.87Å; M769-Y2348 HydrophobicContact CG-CD1 3.76Å; M769-Y2348 HydrophobicContact CG-CD2 4.19Å; M769-Y2348 HydrophobicContact CG-CG 3.49Å; M769-Y2348 VanDerWaalsContact CG-CG 3.49Å; Q2345-Y2348 WeakPolarHBondContact O-CD2 3.39Å; Q2345-Y2348 PolarHBondContact O-N 2.81Å; A2346-Y2348 PolarHBondContact O-N 3.29Å
2349	T	41.1	Very low	56.1	Low	69 Å²	69	31.7 Å²	31.7	42%	0.423	18%	0.181	S	C	.	.	S	Bend	trans	-114.2	138.7	174.8	57.2	0	0	0	0	110.8	A2346 N2351 F2352	A2346-T2349 PolarHBondContact O-N 2.92Å; A2346-T2349 PolarHBondContact O-OG1 3.16Å; T2349-N2351 PolarHBondContact O-N 3.17Å; T2349-F2352 WeakPolarHBondContact O-CB 3.44Å; T2349-F2352 PolarHBondContact O-N 2.93Å
2350	L	38.5	Very low	58.2	Low	65 Å²	65	31 Å²	31	34%	0.34	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-20.3	-176.5	-136	170.7	0	0	0	112.8	I2301 N2304 F2352	I2301-L2350 HydrophobicContact CB-CD1 4.4Å; I2301-L2350 HydrophobicContact CG1-CD1 4.35Å; I2301-L2350 HydrophobicContact CG2-CB 4.02Å; I2301-L2350 HydrophobicContact CG2-CD1 4Å; I2301-L2350 HydrophobicContact CG2-CG 4.04Å; N2304-L2350 HydrophobicContact CB-CD2 4.29Å; N2304-L2350 HydrophobicContact CB-CG 4.24Å; N2304-L2350 WeakPolarHBondContact ND2-CD2 3.32Å; L2350-F2352 VanDerWaalsContact C-N 3.28Å; L2350-F2352 PolarHBondContact O-N 3.2Å
2351	N	47.9	Very low	59.8	Low	87 Å²	87	29.2 Å²	29.2	47%	0.465	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	1.7	-178.4	-53.3	-11.3	0	0	0	112.4	T2349 T2353 E2395	T2349-N2351 PolarHBondContact O-N 3.17Å; N2351-T2353 PolarHBondContact O-N 2.98Å; N2351-E2395 HydrophobicContact CB-CG 3.56Å; N2351-E2395 WeakPolarHBondContact ND2-CG 3.5Å; N2351-E2395 PolarHBondContact ND2-OE1 3.43Å
2352	F	49.2	Very low	61.4	Low	19 Å²	19	28.9 Å²	28.9	8%	0.083	16%	0.164	C	C	.	.			trans	-79.8	105.3	179.1	-178.8	-95.6	0	0	0	111.7	V2308 H2344 A2346 I2347 T2349 L2350 P2354 D2357	V2308-F2352 HydrophobicContact CG1-CD1 4.21Å; V2308-F2352 HydrophobicContact CG1-CE1 3.98Å; H2344-F2352 AromaticContact ND1-CE2 3.95Å; A2346-F2352 VanDerWaalsContact C-CD2 3.43Å; A2346-F2352 HydrophobicContact CB-CD2 3.63Å; A2346-F2352 HydrophobicContact CB-CE2 4.13Å; A2346-F2352 WeakPolarHBondContact O-CB 3.38Å; A2346-F2352 WeakPolarHBondContact O-CD2 3.07Å; A2346-F2352 WeakPolarHBondContact O-CG 3.18Å; I2347-F2352 HydrophobicContact CB-CE1 4.34Å; I2347-F2352 HydrophobicContact CB-CZ 4.41Å; I2347-F2352 HydrophobicContact CD1-CZ 4.38Å; I2347-F2352 HydrophobicContact CG1-CD1 4.29Å; I2347-F2352 HydrophobicContact CG1-CE1 3.57Å; I2347-F2352 HydrophobicContact CG1-CE2 3.98Å; I2347-F2352 HydrophobicContact CG1-CZ 3.38Å; T2349-F2352 WeakPolarHBondContact O-CB 3.44Å; T2349-F2352 PolarHBondContact O-N 2.93Å; L2350-F2352 VanDerWaalsContact C-N 3.28Å; L2350-F2352 PolarHBondContact O-N 3.2Å; F2352-P2354 HydrophobicContact CE1-CG 3.9Å; F2352-P2354 HydrophobicContact CZ-CG 4.5Å; F2352-D2357 HydrophobicContact CE2-CB 4.1Å; F2352-D2357 VanDerWaalsContact CE2-OD2 3.23Å; F2352-D2357 WeakPolarHBondContact CE2-OD2 3.43Å
2353	T	61.2	Low	63.2	Low	54 Å²	54	27.6 Å²	27.6	33%	0.331	16%	0.156	S	C	.	.			trans	-103.4	136.3	156.6	69.4	0	0	0	0	108.8	N2351 L2355 L2356 D2357	N2351-T2353 PolarHBondContact O-N 2.98Å; T2353-L2355 PolarHBondContact O-N 3.01Å; T2353-L2356 WeakPolarHBondContact O-CB 3.32Å; T2353-L2356 PolarHBondContact O-N 3.38Å; T2353-L2356 VanDerWaalsContact OG1-CB 3.26Å; T2353-L2356 WeakPolarHBondContact OG1-CB 3.24Å; T2353-L2356 PolarHBondContact OG1-N 3.49Å; T2353-D2357 PolarHBondContact O-N 3.46Å; T2353-D2357 VanDerWaalsContact O-N 3.17Å
2354	P	68.3	Low	65.1	Low	12 Å²	12	28 Å²	28	8%	0.078	15%	0.149	C	C	.	.	H	α-helix	trans	-61	-13.1	171.7	-26.5	36.1	0	0	0	114	P2168 L2173 Y2311 F2352 F2358	P2168-P2354 HydrophobicContact CG-CB 3.47Å; P2168-P2354 VanDerWaalsContact CG-CB 3.47Å; P2168-P2354 HydrophobicContact CG-CG 4.11Å; L2173-P2354 HydrophobicContact CD1-CB 4.35Å; Y2311-P2354 HydrophobicContact CD1-CG 4Å; Y2311-P2354 HydrophobicContact CE1-CB 3.93Å; Y2311-P2354 HydrophobicContact CE1-CG 3.7Å; F2352-P2354 HydrophobicContact CE1-CG 3.9Å; F2352-P2354 HydrophobicContact CZ-CG 4.5Å; P2354-F2358 VanDerWaalsContact O-CB 3.27Å; P2354-F2358 WeakPolarHBondContact O-CB 3.26Å; P2354-F2358 PolarHBondContact O-N 3.02Å; P2354-F2358 VanDerWaalsContact O-N 3.13Å
2355	L	75.2	Confident	67.2	Low	17 Å²	17	27.1 Å²	27.1	9%	0.089	15%	0.145	C	C	.	.	H	α-helix	trans	-74.7	-45.4	171.6	-163.8	63.8	0	0	0	111.5	I2265 L2268 T2353 F2358 I2359 I2387	I2265-L2355 HydrophobicContact CD1-CD1 3.48Å; I2265-L2355 VanDerWaalsContact CD1-CD1 3.48Å; I2265-L2355 HydrophobicContact CD1-CG 4.05Å; I2265-L2355 HydrophobicContact CG2-CD2 4.25Å; L2268-L2355 HydrophobicContact CB-CD1 3.75Å; L2268-L2355 HydrophobicContact CD1-CD1 3.55Å; L2268-L2355 HydrophobicContact CG-CD1 4.31Å; T2353-L2355 PolarHBondContact O-N 3.01Å; L2355-F2358 PolarHBondContact O-N 3.02Å; L2355-I2359 WeakPolarHBondContact O-CD1 3.42Å; L2355-I2359 VanDerWaalsContact O-CG1 3.26Å; L2355-I2359 WeakPolarHBondContact O-CG1 3.35Å; L2355-I2359 PolarHBondContact O-N 3.45Å; L2355-I2387 HydrophobicContact CD2-CG2 3.81Å; L2355-I2387 HydrophobicContact CG-CG2 4.39Å
2356	L	80.6	Confident	69.3	Low	4 Å²	4	24.5 Å²	24.5	2%	0.021	13%	0.133	C	C	.	.	H	α-helix	trans	-60.8	-46.4	173.2	172.3	61.7	0	0	0	111.3	T2353 I2359 K2360 L2384 I2387 V2389 E2395	T2353-L2356 WeakPolarHBondContact O-CB 3.32Å; T2353-L2356 PolarHBondContact O-N 3.38Å; T2353-L2356 VanDerWaalsContact OG1-CB 3.26Å; T2353-L2356 WeakPolarHBondContact OG1-CB 3.24Å; T2353-L2356 PolarHBondContact OG1-N 3.49Å; L2356-I2359 WeakPolarHBondContact O-CB 3.28Å; L2356-I2359 PolarHBondContact O-N 3.17Å; L2356-K2360 HydrophobicContact CD1-CD 4.48Å; L2356-K2360 HydrophobicContact CD1-CG 4.24Å; L2356-K2360 HydrophobicContact CG-CD 4.38Å; L2356-K2360 WeakPolarHBondContact O-CG 3.48Å; L2356-K2360 PolarHBondContact O-N 3.04Å; L2356-L2384 HydrophobicContact CD1-CD2 3.36Å; L2356-I2387 HydrophobicContact CB-CD1 3.84Å; L2356-I2387 HydrophobicContact CD1-CD1 3.97Å; L2356-I2387 HydrophobicContact CG-CD1 4.47Å; L2356-V2389 HydrophobicContact CD1-CG1 4.38Å; L2356-V2389 HydrophobicContact CD1-CG2 4.41Å; L2356-E2395 HydrophobicContact CD2-CB 4.46Å
2357	D	76.7	Confident	71.3	Confident	13 Å²	13	24.7 Å²	24.7	7%	0.07	13%	0.133	C	C	.	.	H	α-helix	trans	-74.1	-26.2	-178.8	-90	30.3	0	0	0	113	H2344 F2352 T2353 K2360 S2361	H2344-D2357 IonicContact CE1-OD2 3.08Å; H2344-D2357 PolarHBondContact CE1-OD2 2.8Å; H2344-D2357 IonicContact ND1-OD2 3.85Å; H2344-D2357 PolarHBondContact ND1-OD2 2.71Å; F2352-D2357 HydrophobicContact CE2-CB 4.1Å; F2352-D2357 VanDerWaalsContact CE2-OD2 3.23Å; F2352-D2357 WeakPolarHBondContact CE2-OD2 3.43Å; T2353-D2357 PolarHBondContact O-N 3.46Å; T2353-D2357 VanDerWaalsContact O-N 3.17Å; D2357-K2360 WeakPolarHBondContact OD1-CD 3.33Å; D2357-K2360 IonicContact OD1-NZ 3.73Å; D2357-K2360 PolarHBondContact OD1-NZ 3.3Å; D2357-S2361 WeakPolarHBondContact O-CB 3.46Å; D2357-S2361 PolarHBondContact O-N 2.87Å; D2357-S2361 PolarHBondContact O-OG 3.31Å
2358	F	84.3	Confident	73.3	Confident	1 Å²	1	25 Å²	25	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-63.3	-47.7	164.2	172.3	-86.7	0	0	0	111.6	L2167 L2173 F2177 L2180 L2261 L2264 I2265 P2354 L2355 L2362	L2167-F2358 HydrophobicContact CD1-CD2 4.29Å; L2167-F2358 HydrophobicContact CD2-CB 4.25Å; L2173-F2358 HydrophobicContact CB-CD2 4.47Å; L2173-F2358 HydrophobicContact CD2-CB 4.01Å; L2173-F2358 HydrophobicContact CD2-CD1 4.36Å; L2173-F2358 HydrophobicContact CD2-CD2 3.57Å; L2173-F2358 HydrophobicContact CD2-CE2 4.1Å; L2173-F2358 HydrophobicContact CD2-CG 3.72Å; F2177-F2358 HydrophobicContact CB-CD2 4.28Å; F2177-F2358 HydrophobicContact CB-CE2 3.88Å; L2180-F2358 HydrophobicContact CD1-CZ 4.04Å; L2261-F2358 HydrophobicContact CD2-CE1 4.14Å; L2264-F2358 HydrophobicContact CD2-CE1 3.88Å; L2264-F2358 HydrophobicContact CD2-CZ 3.62Å; I2265-F2358 HydrophobicContact CD1-CD1 4.19Å; I2265-F2358 HydrophobicContact CD1-CE1 4.33Å; P2354-F2358 VanDerWaalsContact O-CB 3.27Å; P2354-F2358 WeakPolarHBondContact O-CB 3.26Å; P2354-F2358 PolarHBondContact O-N 3.02Å; P2354-F2358 VanDerWaalsContact O-N 3.13Å; L2355-F2358 PolarHBondContact O-N 3.02Å; F2358-L2362 HydrophobicContact CE1-CD2 4.12Å; F2358-L2362 HydrophobicContact CZ-CD2 4Å; F2358-L2362 VanDerWaalsContact O-CB 3.27Å; F2358-L2362 WeakPolarHBondContact O-CB 3.49Å; F2358-L2362 PolarHBondContact O-N 3.13Å
2359	I	85.4	Confident	75.3	Confident	2 Å²	2	24.6 Å²	24.6	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-58.9	-54.6	177.6	-70.3	160	0	0	0	110	I2265 L2355 L2356 S2361 L2362 C2363 L2383 L2384 I2387	I2265-I2359 HydrophobicContact CD1-CD1 3.88Å; I2265-I2359 HydrophobicContact CD1-CG1 3.74Å; I2265-I2359 HydrophobicContact CG1-CD1 4.2Å; I2265-I2359 HydrophobicContact CG1-CG1 4.26Å; L2355-I2359 WeakPolarHBondContact O-CD1 3.42Å; L2355-I2359 VanDerWaalsContact O-CG1 3.26Å; L2355-I2359 WeakPolarHBondContact O-CG1 3.35Å; L2355-I2359 PolarHBondContact O-N 3.45Å; L2356-I2359 WeakPolarHBondContact O-CB 3.28Å; L2356-I2359 PolarHBondContact O-N 3.17Å; I2359-S2361 PolarHBondContact O-N 3.47Å; I2359-L2362 PolarHBondContact O-N 2.96Å; I2359-C2363 VanDerWaalsContact O-CB 3.3Å; I2359-C2363 WeakPolarHBondContact O-CB 3.4Å; I2359-C2363 PolarHBondContact O-N 3.04Å; I2359-C2363 PolarHBondContact O-SG 3.02Å; I2359-L2383 HydrophobicContact CD1-CB 4.05Å; I2359-L2383 HydrophobicContact CG1-CB 4.12Å; I2359-L2383 HydrophobicContact CG1-CD1 4.46Å; I2359-L2383 HydrophobicContact CG2-CB 3.76Å; I2359-L2383 HydrophobicContact CG2-CD1 4.16Å; I2359-L2384 HydrophobicContact CG2-CD2 4.36Å; I2359-I2387 HydrophobicContact CD1-CD1 3.87Å; I2359-I2387 HydrophobicContact CD1-CG1 4.39Å; I2359-I2387 HydrophobicContact CD1-CG2 4.34Å
2360	K	86.3	Confident	76.9	Confident	20 Å²	20	26.1 Å²	26.1	9%	0.087	15%	0.145	C	C	.	.	H	α-helix	trans	-56.4	-53.5	179.6	-65.9	168.8	-177.8	162.1	0	111.6	L2356 D2357 L2362 C2363 E2364 E2395 I2397 W2398	L2356-K2360 HydrophobicContact CD1-CD 4.48Å; L2356-K2360 HydrophobicContact CD1-CG 4.24Å; L2356-K2360 HydrophobicContact CG-CD 4.38Å; L2356-K2360 WeakPolarHBondContact O-CG 3.48Å; L2356-K2360 PolarHBondContact O-N 3.04Å; D2357-K2360 WeakPolarHBondContact OD1-CD 3.33Å; D2357-K2360 IonicContact OD1-NZ 3.73Å; D2357-K2360 PolarHBondContact OD1-NZ 3.3Å; K2360-L2362 VanDerWaalsContact C-N 3.32Å; K2360-L2362 PolarHBondContact O-N 3.47Å; K2360-C2363 PolarHBondContact O-N 3.06Å; K2360-E2364 WeakPolarHBondContact O-CB 3.43Å; K2360-E2364 PolarHBondContact O-N 2.77Å; K2360-E2395 WeakPolarHBondContact CE-O 3.33Å; K2360-E2395 PolarHBondContact NZ-O 2.88Å; K2360-I2397 VanDerWaalsContact CE-O 3.31Å; K2360-I2397 WeakPolarHBondContact CE-O 3.18Å; K2360-W2398 HydrophobicContact CB-CB 4.3Å; K2360-W2398 HydrophobicContact CB-CG 4.39Å
2361	S	86.1	Confident	78.6	Confident	9 Å²	9	25.6 Å²	25.6	6%	0.063	15%	0.147	C	C	.	.	H	α-helix	trans	-66.5	-35.5	-171.8	-54.7	0	0	0	0	112.1	D2357 I2359 V2365	D2357-S2361 WeakPolarHBondContact O-CB 3.46Å; D2357-S2361 PolarHBondContact O-N 2.87Å; D2357-S2361 PolarHBondContact O-OG 3.31Å; I2359-S2361 PolarHBondContact O-N 3.47Å; S2361-V2365 WeakPolarHBondContact O-CG2 3.33Å; S2361-V2365 PolarHBondContact O-N 2.96Å; S2361-V2365 VanDerWaalsContact O-N 3.16Å
2362	L	88.3	Confident	79.9	Confident	3 Å²	3	21.6 Å²	21.6	2%	0.016	13%	0.126	C	C	.	.	H	α-helix	trans	-72.6	-44.6	175	-172.5	66.3	0	0	0	111.5	F2177 L2180 L2181 L2261 F2358 I2359 K2360 E2364 V2365 L2366	F2177-L2362 HydrophobicContact CD2-CB 4.07Å; F2177-L2362 HydrophobicContact CD2-CD1 3.87Å; F2177-L2362 HydrophobicContact CE2-CB 4.11Å; F2177-L2362 HydrophobicContact CE2-CD1 3.96Å; L2180-L2362 HydrophobicContact CD1-CD2 3.86Å; L2181-L2362 HydrophobicContact CD2-CD1 3.81Å; L2181-L2362 HydrophobicContact CG-CD1 3.97Å; L2261-L2362 HydrophobicContact CD1-CD2 4.36Å; L2261-L2362 HydrophobicContact CD2-CD2 3.58Å; F2358-L2362 HydrophobicContact CE1-CD2 4.12Å; F2358-L2362 HydrophobicContact CZ-CD2 4Å; F2358-L2362 VanDerWaalsContact O-CB 3.27Å; F2358-L2362 WeakPolarHBondContact O-CB 3.49Å; F2358-L2362 PolarHBondContact O-N 3.13Å; I2359-L2362 PolarHBondContact O-N 2.96Å; K2360-L2362 VanDerWaalsContact C-N 3.32Å; K2360-L2362 PolarHBondContact O-N 3.47Å; L2362-E2364 VanDerWaalsContact C-N 3.3Å; L2362-E2364 PolarHBondContact O-N 2.99Å; L2362-V2365 PolarHBondContact O-N 3.18Å; L2362-L2366 HydrophobicContact CD1-CD1 4.23Å; L2362-L2366 HydrophobicContact CD1-CG 4.48Å; L2362-L2366 HydrophobicContact CG-CD1 3.88Å; L2362-L2366 WeakPolarHBondContact O-CB 3.24Å; L2362-L2366 WeakPolarHBondContact O-CD1 3.32Å; L2362-L2366 VanDerWaalsContact O-CG 3.24Å; L2362-L2366 WeakPolarHBondContact O-CG 3.42Å; L2362-L2366 PolarHBondContact O-N 3.5Å
2363	C	88.8	Confident	81.3	Confident	3 Å²	3	25.2 Å²	25.2	2%	0.02	14%	0.142	C	C	.	.	H	α-helix	trans	-62.9	-34.7	175.6	-71.3	0	0	0	0	112.5	I2359 K2360 S2367 I2376 R2380	I2359-C2363 VanDerWaalsContact O-CB 3.3Å; I2359-C2363 WeakPolarHBondContact O-CB 3.4Å; I2359-C2363 PolarHBondContact O-N 3.04Å; I2359-C2363 PolarHBondContact O-SG 3.02Å; K2360-C2363 PolarHBondContact O-N 3.06Å; C2363-S2367 WeakPolarHBondContact O-CB 3.39Å; C2363-S2367 PolarHBondContact O-N 2.86Å; C2363-S2367 PolarHBondContact O-OG 2.85Å; C2363-I2376 HydrophobicContact CB-CG2 3.95Å; C2363-I2376 WeakPolarHBondContact O-CG2 3.21Å; C2363-R2380 HydrophobicContact CB-CB 4.37Å; C2363-R2380 HydrophobicContact CB-CG 4.39Å
2364	E	88.8	Confident	82.1	Confident	56 Å²	56	29.1 Å²	29.1	26%	0.262	16%	0.16	S	C	.	.	H	α-helix	trans	-71.5	-44.2	178.2	-150.7	81.7	-169.9	0	0	111.5	K2360 L2362 L2366 S2367 L2368 R2380 W2398	K2360-E2364 WeakPolarHBondContact O-CB 3.43Å; K2360-E2364 PolarHBondContact O-N 2.77Å; L2362-E2364 VanDerWaalsContact C-N 3.3Å; L2362-E2364 PolarHBondContact O-N 2.99Å; E2364-L2366 PolarHBondContact O-N 3.31Å; E2364-S2367 WeakPolarHBondContact O-CB 3.48Å; E2364-S2367 PolarHBondContact O-N 2.78Å; E2364-L2368 PolarHBondContact O-N 3Å; E2364-R2380 IonicContact OE2-CZ 3.34Å; E2364-R2380 IonicContact OE2-NH1 2.86Å; E2364-R2380 PolarHBondContact OE2-NH1 2.81Å; E2364-R2380 IonicContact OE2-NH2 3.81Å; E2364-W2398 HydrophobicContact CB-CD2 4.06Å; E2364-W2398 HydrophobicContact CB-CE3 4.44Å; E2364-W2398 HydrophobicContact CB-CG 4.21Å; E2364-W2398 HydrophobicContact CG-CB 4.48Å; E2364-W2398 HydrophobicContact CG-CD2 3.65Å; E2364-W2398 HydrophobicContact CG-CE3 3.54Å; E2364-W2398 HydrophobicContact CG-CG 4.1Å; E2364-W2398 HydrophobicContact CG-CH2 4.35Å; E2364-W2398 HydrophobicContact CG-CZ2 4.48Å; E2364-W2398 HydrophobicContact CG-CZ3 3.92Å; E2364-W2398 WeakPolarHBondContact OE2-CB 3.27Å
2365	V	88.9	Confident	82.7	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-64.3	-38.9	175.9	169.6	0	0	0	0	111.8	I2099 M2101 W2161 L2163 F2177 L2181 S2361 L2362 S2367 L2368	I2099-V2365 HydrophobicContact CG2-CG1 4.31Å; M2101-V2365 HydrophobicContact CE-CG2 3.66Å; W2161-V2365 HydrophobicContact CE3-CG2 4.21Å; W2161-V2365 HydrophobicContact CH2-CB 4.37Å; W2161-V2365 HydrophobicContact CH2-CG1 3.41Å; W2161-V2365 VanDerWaalsContact CH2-CG1 3.41Å; W2161-V2365 HydrophobicContact CH2-CG2 3.99Å; W2161-V2365 HydrophobicContact CZ2-CG1 3.73Å; W2161-V2365 HydrophobicContact CZ3-CB 4.48Å; W2161-V2365 HydrophobicContact CZ3-CG1 3.94Å; W2161-V2365 HydrophobicContact CZ3-CG2 3.62Å; L2163-V2365 HydrophobicContact CD2-CG2 3.82Å; F2177-V2365 HydrophobicContact CZ-CG2 4.25Å; L2181-V2365 HydrophobicContact CD1-CG1 3.83Å; L2181-V2365 HydrophobicContact CD2-CG1 3.73Å; L2181-V2365 HydrophobicContact CG-CG1 4.47Å; S2361-V2365 WeakPolarHBondContact O-CG2 3.33Å; S2361-V2365 PolarHBondContact O-N 2.96Å; S2361-V2365 VanDerWaalsContact O-N 3.16Å; L2362-V2365 PolarHBondContact O-N 3.18Å; V2365-S2367 VanDerWaalsContact C-N 3.34Å; V2365-L2368 HydrophobicContact CG1-CD1 4.47Å; V2365-L2368 VanDerWaalsContact O-CB 3.32Å; V2365-L2368 WeakPolarHBondContact O-CB 3.27Å; V2365-L2368 WeakPolarHBondContact O-CD1 3.27Å; V2365-L2368 VanDerWaalsContact O-CG 3.27Å; V2365-L2368 WeakPolarHBondContact O-CG 3.21Å; V2365-L2368 PolarHBondContact O-N 3.18Å
2366	L	86.7	Confident	83.2	Confident	8 Å²	8	31.1 Å²	31.1	4%	0.042	17%	0.168	C	C	.	.	H	α-helix	trans	-69.2	-34.2	174.3	-66.6	167	0	0	0	111.4	L2181 Y2184 F2253 L2257 L2362 E2364 L2368 E2369 I2376	L2181-L2366 HydrophobicContact CD2-CD2 3.95Å; L2181-L2366 HydrophobicContact CD2-CG 4.33Å; Y2184-L2366 HydrophobicContact CD1-CD2 3.87Å; Y2184-L2366 HydrophobicContact CE1-CD2 4.11Å; Y2184-L2366 HydrophobicContact CG-CD2 4.16Å; F2253-L2366 HydrophobicContact CE1-CD1 4.31Å; F2253-L2366 HydrophobicContact CE1-CD2 4.21Å; F2253-L2366 HydrophobicContact CZ-CD2 4.35Å; L2257-L2366 HydrophobicContact CD2-CD1 3.83Å; L2362-L2366 HydrophobicContact CD1-CD1 4.23Å; L2362-L2366 HydrophobicContact CD1-CG 4.48Å; L2362-L2366 HydrophobicContact CG-CD1 3.88Å; L2362-L2366 WeakPolarHBondContact O-CB 3.24Å; L2362-L2366 WeakPolarHBondContact O-CD1 3.32Å; L2362-L2366 VanDerWaalsContact O-CG 3.24Å; L2362-L2366 WeakPolarHBondContact O-CG 3.42Å; L2362-L2366 PolarHBondContact O-N 3.5Å; E2364-L2366 PolarHBondContact O-N 3.31Å; L2366-L2368 PolarHBondContact O-N 3.36Å; L2366-E2369 PolarHBondContact O-N 3.36Å; L2366-E2369 VanDerWaalsContact O-N 3.16Å; L2366-I2376 HydrophobicContact CB-CD1 3.6Å; L2366-I2376 HydrophobicContact CB-CG1 4.18Å; L2366-I2376 HydrophobicContact CB-CG2 4.33Å; L2366-I2376 VanDerWaalsContact O-CD1 3.24Å; L2366-I2376 WeakPolarHBondContact O-CD1 3.44Å
2367	S	87.9	Confident	83.3	Confident	23 Å²	23	35.1 Å²	35.1	16%	0.161	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-0.6	176.8	-64.3	0	0	0	0	114.5	C2363 E2364 V2365 E2369 I2376	C2363-S2367 WeakPolarHBondContact O-CB 3.39Å; C2363-S2367 PolarHBondContact O-N 2.86Å; C2363-S2367 PolarHBondContact O-OG 2.85Å; E2364-S2367 WeakPolarHBondContact O-CB 3.48Å; E2364-S2367 PolarHBondContact O-N 2.78Å; V2365-S2367 VanDerWaalsContact C-N 3.34Å; S2367-E2369 PolarHBondContact O-N 3.27Å; S2367-I2376 WeakPolarHBondContact OG-CG2 3.39Å
2368	L	86.8	Confident	83.6	Confident	24 Å²	24	37.8 Å²	37.8	13%	0.126	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-18.6	167.8	-64.2	174.9	0	0	0	112.5	P1900 G1901 L1902 I2099 M2101 E2364 V2365 L2366 P2370	P1900-L2368 HydrophobicContact CB-CD2 3.87Å; G1901-L2368 CarbonylContact C-O 3.4Å; G1901-L2368 WeakPolarHBondContact CA-O 3.46Å; L1902-L2368 PolarHBondContact N-O 2.94Å; I2099-L2368 HydrophobicContact CG2-CB 4.44Å; I2099-L2368 HydrophobicContact CG2-CD1 3.54Å; M2101-L2368 HydrophobicContact CB-CD1 4.13Å; M2101-L2368 HydrophobicContact CE-CD1 4.17Å; M2101-L2368 HydrophobicContact CE-CD2 4.4Å; M2101-L2368 HydrophobicContact CE-CG 4.47Å; E2364-L2368 PolarHBondContact O-N 3Å; V2365-L2368 HydrophobicContact CG1-CD1 4.47Å; V2365-L2368 VanDerWaalsContact O-CB 3.32Å; V2365-L2368 WeakPolarHBondContact O-CB 3.27Å; V2365-L2368 WeakPolarHBondContact O-CD1 3.27Å; V2365-L2368 VanDerWaalsContact O-CG 3.27Å; V2365-L2368 WeakPolarHBondContact O-CG 3.21Å; V2365-L2368 PolarHBondContact O-N 3.18Å; L2366-L2368 PolarHBondContact O-N 3.36Å; L2368-P2370 WeakPolarHBondContact O-CD 3.41Å
2369	E	83.7	Confident	83.7	Confident	26 Å²	26	38.3 Å²	38.3	12%	0.121	21%	0.209	C	C	.	.	S	Bend	trans	-90	110.4	169.5	175.9	36.3	-121.3	0	0	110.6	L1902 L2366 S2367 S2371 A2372 K2373	L1902-E2369 HydrophobicContact CB-CB 4.11Å; L1902-E2369 HydrophobicContact CD1-CB 3.94Å; L1902-E2369 HydrophobicContact CD1-CG 4.37Å; L2366-E2369 PolarHBondContact O-N 3.36Å; L2366-E2369 VanDerWaalsContact O-N 3.16Å; S2367-E2369 PolarHBondContact O-N 3.27Å; E2369-S2371 VanDerWaalsContact C-N 3.31Å; E2369-S2371 PolarHBondContact O-N 2.73Å; E2369-S2371 VanDerWaalsContact OE1-CB 3.25Å; E2369-S2371 WeakPolarHBondContact OE1-CB 3.48Å; E2369-S2371 PolarHBondContact OE1-N 2.91Å; E2369-S2371 PolarHBondContact OE1-OG 3.46Å; E2369-A2372 HydrophobicContact CB-CB 4.14Å; E2369-A2372 HydrophobicContact CG-CB 3.84Å; E2369-A2372 PolarHBondContact O-N 2.76Å; E2369-K2373 PolarHBondContact O-N 3.39Å
2370	P	76.1	Confident	83.8	Confident	101 Å²	101	40.4 Å²	40.4	66%	0.656	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-29.8	-173.1	-24.1	35.6	0	0	0	114.9	L2368 K2373	L2368-P2370 WeakPolarHBondContact O-CD 3.41Å; P2370-K2373 WeakPolarHBondContact O-CB 3.27Å
2371	S	72.6	Confident	83.8	Confident	54 Å²	54	42 Å²	42	38%	0.378	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-35.9	-179.9	67.3	0	0	0	0	112.8	E2369 K2373	E2369-S2371 VanDerWaalsContact C-N 3.31Å; E2369-S2371 PolarHBondContact O-N 2.73Å; E2369-S2371 VanDerWaalsContact OE1-CB 3.25Å; E2369-S2371 WeakPolarHBondContact OE1-CB 3.48Å; E2369-S2371 PolarHBondContact OE1-N 2.91Å; E2369-S2371 PolarHBondContact OE1-OG 3.46Å; S2371-K2373 VanDerWaalsContact C-N 3.3Å; S2371-K2373 PolarHBondContact O-N 3.19Å
2372	A	76.4	Confident	83.8	Confident	3 Å²	3	44.1 Å²	44.1	3%	0.025	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-21.6	175.3	0	0	0	0	0	112.9	F2253 E2369 L2374 H2375 I2376	F2253-A2372 HydrophobicContact CD2-CB 4.12Å; F2253-A2372 HydrophobicContact CE2-CB 3.43Å; F2253-A2372 VanDerWaalsContact CE2-CB 3.43Å; F2253-A2372 HydrophobicContact CZ-CB 3.78Å; E2369-A2372 HydrophobicContact CB-CB 4.14Å; E2369-A2372 HydrophobicContact CG-CB 3.84Å; E2369-A2372 PolarHBondContact O-N 2.76Å; A2372-L2374 PolarHBondContact O-N 3.33Å; A2372-L2374 VanDerWaalsContact O-N 3.16Å; A2372-H2375 WeakPolarHBondContact O-CA 3.39Å; A2372-H2375 WeakPolarHBondContact O-CB 3.27Å; A2372-H2375 PolarHBondContact O-N 3.16Å; A2372-I2376 HydrophobicContact CB-CD1 3.52Å; A2372-I2376 HydrophobicContact CB-CG1 4.29Å; A2372-I2376 WeakPolarHBondContact O-CG1 3.44Å; A2372-I2376 PolarHBondContact O-N 3.23Å
2373	K	79	Confident	83.7	Confident	96 Å²	96	44.1 Å²	44.1	42%	0.417	24%	0.235	S	C	.	.	H	α-helix	trans	-48.7	-45.8	-171.4	-176.1	169.3	174.9	171.2	0	114.9	E2369 P2370 S2371 H2375 I2376 E2377	E2369-K2373 PolarHBondContact O-N 3.39Å; P2370-K2373 WeakPolarHBondContact O-CB 3.27Å; S2371-K2373 VanDerWaalsContact C-N 3.3Å; S2371-K2373 PolarHBondContact O-N 3.19Å; K2373-H2375 PolarHBondContact O-N 3.35Å; K2373-I2376 CarbonylContact O-C 3.39Å; K2373-I2376 PolarHBondContact O-N 3.37Å; K2373-E2377 WeakPolarHBondContact CE-OE1 3.28Å; K2373-E2377 HydrophobicContact CG-CG 4.43Å; K2373-E2377 IonicContact NZ-OE1 2.99Å; K2373-E2377 WeakPolarHBondContact O-CB 3.26Å; K2373-E2377 WeakPolarHBondContact O-CG 2.83Å; K2373-E2377 PolarHBondContact O-N 3.13Å
2374	L	78.1	Confident	83.6	Confident	135 Å²	135	44 Å²	44	71%	0.707	23%	0.234	S	C	*	.	H	α-helix	trans	-64.4	-38.2	178.4	-71	171.8	0	0	0	112.7	A2372 E2377 S2378	A2372-L2374 PolarHBondContact O-N 3.33Å; A2372-L2374 VanDerWaalsContact O-N 3.16Å; L2374-E2377 PolarHBondContact O-N 3.26Å; L2374-S2378 PolarHBondContact O-N 3.21Å; L2374-S2378 VanDerWaalsContact O-N 3.12Å
2375	H	80	Confident	83.3	Confident	70 Å²	70	49.3 Å²	49.3	32%	0.324	25%	0.252	S	S	.	.	H	α-helix	trans	-67.2	-39.3	174.2	-67.8	104.9	0	0	0	111	E2250 A2372 K2373 S2378 I2379	E2250-H2375 IonicContact OE1-CE1 3.52Å; A2372-H2375 WeakPolarHBondContact O-CA 3.39Å; A2372-H2375 WeakPolarHBondContact O-CB 3.27Å; A2372-H2375 PolarHBondContact O-N 3.16Å; K2373-H2375 PolarHBondContact O-N 3.35Å; H2375-S2378 WeakPolarHBondContact O-CB 3.37Å; H2375-S2378 PolarHBondContact O-N 3.47Å; H2375-I2379 VanDerWaalsContact O-CG1 3.28Å; H2375-I2379 WeakPolarHBondContact O-CG1 3.5Å; H2375-I2379 PolarHBondContact O-N 2.83Å
2376	I	84.9	Confident	82.8	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-71.4	-33	178.4	-61.7	156.6	0	0	0	111.4	F2253 C2363 L2366 S2367 A2372 K2373 I2379 R2380	F2253-I2376 HydrophobicContact CD1-CG1 4.28Å; F2253-I2376 HydrophobicContact CE1-CD1 4.06Å; F2253-I2376 HydrophobicContact CE1-CG1 3.87Å; F2253-I2376 HydrophobicContact CZ-CD1 4.04Å; F2253-I2376 HydrophobicContact CZ-CG1 4.3Å; C2363-I2376 HydrophobicContact CB-CG2 3.95Å; C2363-I2376 WeakPolarHBondContact O-CG2 3.21Å; L2366-I2376 HydrophobicContact CB-CD1 3.6Å; L2366-I2376 HydrophobicContact CB-CG1 4.18Å; L2366-I2376 HydrophobicContact CB-CG2 4.33Å; L2366-I2376 VanDerWaalsContact O-CD1 3.24Å; L2366-I2376 WeakPolarHBondContact O-CD1 3.44Å; S2367-I2376 WeakPolarHBondContact OG-CG2 3.39Å; A2372-I2376 HydrophobicContact CB-CD1 3.52Å; A2372-I2376 HydrophobicContact CB-CG1 4.29Å; A2372-I2376 WeakPolarHBondContact O-CG1 3.44Å; A2372-I2376 PolarHBondContact O-N 3.23Å; K2373-I2376 CarbonylContact O-C 3.39Å; K2373-I2376 PolarHBondContact O-N 3.37Å; I2376-I2379 PolarHBondContact O-N 3.25Å; I2376-R2380 WeakPolarHBondContact O-CB 3.3Å; I2376-R2380 PolarHBondContact O-N 3.31Å
2377	E	84.2	Confident	82.5	Confident	88 Å²	88	53 Å²	53	41%	0.411	27%	0.271	S	S	.	.	H	α-helix	trans	-64.5	-41.2	170.8	-76.9	171.5	177.6	0	0	111.2	K2373 L2374 R2380 H2381	K2373-E2377 WeakPolarHBondContact CE-OE1 3.28Å; K2373-E2377 HydrophobicContact CG-CG 4.43Å; K2373-E2377 IonicContact NZ-OE1 2.99Å; K2373-E2377 WeakPolarHBondContact O-CB 3.26Å; K2373-E2377 WeakPolarHBondContact O-CG 2.83Å; K2373-E2377 PolarHBondContact O-N 3.13Å; L2374-E2377 PolarHBondContact O-N 3.26Å; E2377-R2380 WeakPolarHBondContact O-CB 3.2Å; E2377-R2380 PolarHBondContact O-N 3.45Å; E2377-H2381 PolarHBondContact O-N 3.44Å
2378	S	82.7	Confident	82.1	Confident	68 Å²	68	59.3 Å²	59.3	48%	0.476	30%	0.303	S	S	.	.	H	α-helix	trans	-63.6	-43.3	171.2	-168.3	0	0	0	0	112.5	L2374 H2375 R2380 H2381 D2382	L2374-S2378 PolarHBondContact O-N 3.21Å; L2374-S2378 VanDerWaalsContact O-N 3.12Å; H2375-S2378 WeakPolarHBondContact O-CB 3.37Å; H2375-S2378 PolarHBondContact O-N 3.47Å; S2378-R2380 VanDerWaalsContact C-N 3.33Å; S2378-R2380 PolarHBondContact O-N 2.99Å; S2378-H2381 WeakPolarHBondContact O-CB 3.31Å; S2378-H2381 PolarHBondContact O-N 3.22Å; S2378-D2382 PolarHBondContact O-N 3.35Å
2379	I	86.6	Confident	81.7	Confident	13 Å²	13	59.6 Å²	59.6	7%	0.067	31%	0.305	C	S	.	.	H	α-helix	trans	-64.2	-39.7	175.9	-68.4	163.6	0	0	0	110.3	F2253 A2258 L2261 H2375 I2376 D2382 L2383	F2253-I2379 HydrophobicContact CB-CD1 4.42Å; F2253-I2379 HydrophobicContact CD1-CD1 4.26Å; A2258-I2379 HydrophobicContact CB-CD1 3.86Å; A2258-I2379 HydrophobicContact CB-CG1 3.86Å; L2261-I2379 HydrophobicContact CD1-CG2 4.25Å; H2375-I2379 VanDerWaalsContact O-CG1 3.28Å; H2375-I2379 WeakPolarHBondContact O-CG1 3.5Å; H2375-I2379 PolarHBondContact O-N 2.83Å; I2376-I2379 PolarHBondContact O-N 3.25Å; I2379-D2382 PolarHBondContact O-N 2.75Å; I2379-L2383 HydrophobicContact CG2-CD1 3.5Å; I2379-L2383 HydrophobicContact CG2-CG 4.02Å; I2379-L2383 WeakPolarHBondContact O-CB 3.38Å; I2379-L2383 WeakPolarHBondContact O-CG 3.41Å; I2379-L2383 PolarHBondContact O-N 2.93Å
2380	R	87.9	Confident	81.4	Confident	45 Å²	45	60.4 Å²	60.4	17%	0.17	32%	0.321	C	S	.	.	H	α-helix	trans	-62.3	-45.3	175	-173.5	179.4	-173.8	141.6	1.1	110.9	C2363 E2364 I2376 E2377 S2378 D2382 L2383 L2384 A2396	C2363-R2380 HydrophobicContact CB-CB 4.37Å; C2363-R2380 HydrophobicContact CB-CG 4.39Å; E2364-R2380 IonicContact OE2-CZ 3.34Å; E2364-R2380 IonicContact OE2-NH1 2.86Å; E2364-R2380 PolarHBondContact OE2-NH1 2.81Å; E2364-R2380 IonicContact OE2-NH2 3.81Å; I2376-R2380 WeakPolarHBondContact O-CB 3.3Å; I2376-R2380 PolarHBondContact O-N 3.31Å; E2377-R2380 WeakPolarHBondContact O-CB 3.2Å; E2377-R2380 PolarHBondContact O-N 3.45Å; S2378-R2380 VanDerWaalsContact C-N 3.33Å; S2378-R2380 PolarHBondContact O-N 2.99Å; R2380-D2382 PolarHBondContact O-N 2.78Å; R2380-L2383 PolarHBondContact O-N 2.88Å; R2380-L2384 HydrophobicContact CG-CD1 3.86Å; R2380-L2384 HydrophobicContact CG-CG 4.34Å; R2380-L2384 VanDerWaalsContact O-CB 3.28Å; R2380-L2384 WeakPolarHBondContact O-CB 3.11Å; R2380-L2384 WeakPolarHBondContact O-CG 3.34Å; R2380-L2384 PolarHBondContact O-N 2.88Å; R2380-A2396 PolarHBondContact NH2-O 3.39Å
2381	H	85.4	Confident	81.3	Confident	53 Å²	53	60 Å²	60	25%	0.245	31%	0.31	C	S	.	.	H	α-helix	trans	-53.9	-53.8	173.1	178.8	101.8	0	0	0	111	E2377 S2378 L2384 R2385 E2391	E2377-H2381 PolarHBondContact O-N 3.44Å; S2378-H2381 WeakPolarHBondContact O-CB 3.31Å; S2378-H2381 PolarHBondContact O-N 3.22Å; H2381-L2384 PolarHBondContact O-N 2.82Å; H2381-R2385 PolarHBondContact NE2-NH1 3.47Å; H2381-R2385 WeakPolarHBondContact O-CB 3.4Å; H2381-R2385 PolarHBondContact O-N 2.95Å; H2381-E2391 IonicContact CE1-OE1 3.64Å; H2381-E2391 IonicContact CE1-OE2 2.64Å; H2381-E2391 IonicContact CG-OE2 2.65Å; H2381-E2391 IonicContact ND1-OE1 2.67Å; H2381-E2391 PolarHBondContact ND1-OE1 2.92Å; H2381-E2391 IonicContact ND1-OE2 3.85Å; H2381-E2391 PolarHBondContact ND1-OE2 2.89Å
2382	D	85.1	Confident	81.5	Confident	55 Å²	55	66.3 Å²	66.3	29%	0.294	33%	0.331	S	S	.	.	H	α-helix	trans	-65	-42	-178.4	-74.2	-25.8	0	0	0	113.3	Y2262 S2378 I2379 R2380 R2385 L2386	Y2262-D2382 HydrophobicContact CD1-CB 4.48Å; Y2262-D2382 HydrophobicContact CE1-CB 3.44Å; Y2262-D2382 VanDerWaalsContact CE1-CB 3.44Å; Y2262-D2382 PolarHBondContact OH-OD2 2.89Å; S2378-D2382 PolarHBondContact O-N 3.35Å; I2379-D2382 PolarHBondContact O-N 2.75Å; R2380-D2382 PolarHBondContact O-N 2.78Å; D2382-R2385 PolarHBondContact O-N 3.36Å; D2382-L2386 WeakPolarHBondContact O-CB 3.29Å; D2382-L2386 VanDerWaalsContact O-CG 3.31Å; D2382-L2386 WeakPolarHBondContact O-CG 3.29Å; D2382-L2386 PolarHBondContact O-N 3.08Å
2383	L	87.3	Confident	81.3	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-68.1	-39.8	179.7	-67.6	171.2	0	0	0	111.8	L2261 Y2262 I2265 I2359 I2379 R2380 I2387	L2261-L2383 HydrophobicContact CB-CD1 4.37Å; L2261-L2383 HydrophobicContact CB-CD2 4.01Å; L2261-L2383 HydrophobicContact CD1-CD1 4.33Å; Y2262-L2383 HydrophobicContact CD1-CD2 3.62Å; Y2262-L2383 HydrophobicContact CD1-CG 4.29Å; Y2262-L2383 HydrophobicContact CE1-CD2 3.99Å; Y2262-L2383 HydrophobicContact CE1-CG 4.16Å; I2265-L2383 HydrophobicContact CB-CD2 4.34Å; I2265-L2383 HydrophobicContact CG1-CD2 3.59Å; I2359-L2383 HydrophobicContact CD1-CB 4.05Å; I2359-L2383 HydrophobicContact CG1-CB 4.12Å; I2359-L2383 HydrophobicContact CG1-CD1 4.46Å; I2359-L2383 HydrophobicContact CG2-CB 3.76Å; I2359-L2383 HydrophobicContact CG2-CD1 4.16Å; I2379-L2383 HydrophobicContact CG2-CD1 3.5Å; I2379-L2383 HydrophobicContact CG2-CG 4.02Å; I2379-L2383 WeakPolarHBondContact O-CB 3.38Å; I2379-L2383 WeakPolarHBondContact O-CG 3.41Å; I2379-L2383 PolarHBondContact O-N 2.93Å; R2380-L2383 PolarHBondContact O-N 2.88Å; L2383-I2387 PolarHBondContact O-N 3.02Å
2384	L	87.1	Confident	80.6	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-65.6	-43.7	173	-69.4	174	0	0	0	110.9	L2356 I2359 R2380 H2381 L2386 I2387 N2388 V2389 A2396	L2356-L2384 HydrophobicContact CD1-CD2 3.36Å; I2359-L2384 HydrophobicContact CG2-CD2 4.36Å; R2380-L2384 HydrophobicContact CG-CD1 3.86Å; R2380-L2384 HydrophobicContact CG-CG 4.34Å; R2380-L2384 VanDerWaalsContact O-CB 3.28Å; R2380-L2384 WeakPolarHBondContact O-CB 3.11Å; R2380-L2384 WeakPolarHBondContact O-CG 3.34Å; R2380-L2384 PolarHBondContact O-N 2.88Å; H2381-L2384 PolarHBondContact O-N 2.82Å; L2384-L2386 PolarHBondContact O-N 2.82Å; L2384-I2387 CarbonylContact O-C 3.58Å; L2384-I2387 WeakPolarHBondContact O-CG1 3.33Å; L2384-I2387 PolarHBondContact O-N 3.34Å; L2384-N2388 PolarHBondContact O-N 2.71Å; L2384-N2388 VanDerWaalsContact O-N 3.14Å; L2384-V2389 CarbonylContact C-O 3.4Å; L2384-V2389 HydrophobicContact CB-CB 4.27Å; L2384-V2389 WeakPolarHBondContact CB-O 3.48Å; L2384-V2389 HydrophobicContact CD2-CB 4.11Å; L2384-V2389 HydrophobicContact CD2-CG1 3.96Å; L2384-V2389 PolarHBondContact O-N 2.68Å; L2384-A2396 HydrophobicContact CD1-CB 3.75Å; L2384-A2396 HydrophobicContact CD2-CB 4.47Å
2385	R	81.8	Confident	80.1	Confident	166 Å²	166	63.1 Å²	63.1	63%	0.626	32%	0.323	S	S	*	.	H	α-helix	trans	-62.6	-37.8	176.6	-174.3	175	-176.4	166	-1.5	112.8	H2381 D2382 I2387 N2388	H2381-R2385 PolarHBondContact NE2-NH1 3.47Å; H2381-R2385 WeakPolarHBondContact O-CB 3.4Å; H2381-R2385 PolarHBondContact O-N 2.95Å; D2382-R2385 PolarHBondContact O-N 3.36Å; R2385-I2387 PolarHBondContact O-N 2.93Å; R2385-N2388 PolarHBondContact O-N 2.82Å; R2385-N2388 VanDerWaalsContact O-N 3.12Å
2386	L	79.1	Confident	79.9	Confident	55 Å²	55	59.9 Å²	59.9	29%	0.288	31%	0.309	S	S	.	.	H	α-helix	trans	-60.9	-25.8	172.8	-81.8	169.1	0	0	0	113	Y2262 I2265 I2266 Q2269 D2382 L2384	Y2262-L2386 HydrophobicContact CD1-CD1 3.65Å; Y2262-L2386 HydrophobicContact CE1-CD1 4.46Å; Y2262-L2386 HydrophobicContact CG-CD1 4.31Å; I2265-L2386 HydrophobicContact CG2-CB 4.38Å; I2266-L2386 HydrophobicContact CD1-CD2 4.21Å; I2266-L2386 HydrophobicContact CG1-CD2 4.18Å; Q2269-L2386 PolarHBondContact NE2-O 2.67Å; D2382-L2386 WeakPolarHBondContact O-CB 3.29Å; D2382-L2386 VanDerWaalsContact O-CG 3.31Å; D2382-L2386 WeakPolarHBondContact O-CG 3.29Å; D2382-L2386 PolarHBondContact O-N 3.08Å; L2384-L2386 PolarHBondContact O-N 2.82Å
2387	I	80.8	Confident	79.3	Confident	31 Å²	31	61.9 Å²	61.9	16%	0.159	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	15.4	175.9	66.8	165.2	0	0	0	113.4	I2265 L2355 L2356 I2359 L2383 L2384 R2385 V2389	I2265-I2387 HydrophobicContact CG2-CG2 3.84Å; L2355-I2387 HydrophobicContact CD2-CG2 3.81Å; L2355-I2387 HydrophobicContact CG-CG2 4.39Å; L2356-I2387 HydrophobicContact CB-CD1 3.84Å; L2356-I2387 HydrophobicContact CD1-CD1 3.97Å; L2356-I2387 HydrophobicContact CG-CD1 4.47Å; I2359-I2387 HydrophobicContact CD1-CD1 3.87Å; I2359-I2387 HydrophobicContact CD1-CG1 4.39Å; I2359-I2387 HydrophobicContact CD1-CG2 4.34Å; L2383-I2387 PolarHBondContact O-N 3.02Å; L2384-I2387 CarbonylContact O-C 3.58Å; L2384-I2387 WeakPolarHBondContact O-CG1 3.33Å; L2384-I2387 PolarHBondContact O-N 3.34Å; R2385-I2387 PolarHBondContact O-N 2.93Å; I2387-V2389 VanDerWaalsContact C-N 3.27Å; I2387-V2389 HydrophobicContact CD1-CB 4.48Å; I2387-V2389 HydrophobicContact CD1-CG2 3.9Å; I2387-V2389 HydrophobicContact CG1-CB 4.26Å; I2387-V2389 HydrophobicContact CG1-CG2 3.93Å; I2387-V2389 PolarHBondContact O-N 2.87Å
2388	N	77.9	Confident	79	Confident	157 Å²	157	60.2 Å²	60.2	84%	0.84	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	29.1	-177.8	-76.5	-3.8	0	0	0	115.5	L2384 R2385	L2384-N2388 PolarHBondContact O-N 2.71Å; L2384-N2388 VanDerWaalsContact O-N 3.14Å; R2385-N2388 PolarHBondContact O-N 2.82Å; R2385-N2388 VanDerWaalsContact O-N 3.12Å
2389	V	79.6	Confident	78.4	Confident	29 Å²	29	59.6 Å²	59.6	18%	0.176	30%	0.3	C	S	.	.			trans	-97.9	131	170.9	177.5	0	0	0	0	109.3	L2356 L2384 I2387 S2393 E2395 A2396	L2356-V2389 HydrophobicContact CD1-CG1 4.38Å; L2356-V2389 HydrophobicContact CD1-CG2 4.41Å; L2384-V2389 CarbonylContact C-O 3.4Å; L2384-V2389 HydrophobicContact CB-CB 4.27Å; L2384-V2389 WeakPolarHBondContact CB-O 3.48Å; L2384-V2389 HydrophobicContact CD2-CB 4.11Å; L2384-V2389 HydrophobicContact CD2-CG1 3.96Å; L2384-V2389 PolarHBondContact O-N 2.68Å; I2387-V2389 VanDerWaalsContact C-N 3.27Å; I2387-V2389 HydrophobicContact CD1-CB 4.48Å; I2387-V2389 HydrophobicContact CD1-CG2 3.9Å; I2387-V2389 HydrophobicContact CG1-CB 4.26Å; I2387-V2389 HydrophobicContact CG1-CG2 3.93Å; I2387-V2389 PolarHBondContact O-N 2.87Å; V2389-S2393 WeakPolarHBondContact CG1-OG 3.39Å; V2389-E2395 HydrophobicContact CG1-CB 4.2Å; V2389-A2396 HydrophobicContact CG1-CB 4.12Å
2390	G	77.5	Confident	77.8	Confident	44 Å²	44	59.7 Å²	59.7	45%	0.454	30%	0.302	S	S	.	.			trans	-76.1	141.7	176.3	0	0	0	0	0	111.9	F2392 S2393 A2396	G2390-F2392 VanDerWaalsContact C-N 3.33Å; G2390-F2392 PolarHBondContact O-N 3.48Å; G2390-S2393 WeakPolarHBondContact O-CB 3.17Å; G2390-S2393 PolarHBondContact O-N 3.34Å; G2390-S2393 PolarHBondContact O-OG 3.04Å; G2390-A2396 WeakPolarHBondContact O-CB 3.12Å
2391	E	74.1	Confident	76.9	Confident	91 Å²	91	58.4 Å²	58.4	43%	0.425	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-35.7	-173.4	72.9	-159.1	127.1	0	0	114.2	H2381 A2396	H2381-E2391 IonicContact CE1-OE1 3.64Å; H2381-E2391 IonicContact CE1-OE2 2.64Å; H2381-E2391 IonicContact CG-OE2 2.65Å; H2381-E2391 IonicContact ND1-OE1 2.67Å; H2381-E2391 PolarHBondContact ND1-OE1 2.92Å; H2381-E2391 IonicContact ND1-OE2 3.85Å; H2381-E2391 PolarHBondContact ND1-OE2 2.89Å; E2391-A2396 WeakPolarHBondContact O-CB 3.49Å
2392	F	76.9	Confident	76	Confident	188 Å²	188	57.1 Å²	57.1	83%	0.825	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	10.6	176.5	-53.2	-63.3	0	0	0	113.4	G2390	G2390-F2392 VanDerWaalsContact C-N 3.33Å; G2390-F2392 PolarHBondContact O-N 3.48Å
2393	S	71.4	Confident	75.3	Confident	23 Å²	23	57.4 Å²	57.4	16%	0.161	29%	0.293	C	S	.	.	S	Bend	trans	-67.7	148	176.6	67.9	0	0	0	0	110.8	V2389 G2390 E2395 A2396	V2389-S2393 WeakPolarHBondContact CG1-OG 3.39Å; G2390-S2393 WeakPolarHBondContact O-CB 3.17Å; G2390-S2393 PolarHBondContact O-N 3.34Å; G2390-S2393 PolarHBondContact O-OG 3.04Å; S2393-E2395 WeakPolarHBondContact CB-OE2 3.43Å; S2393-E2395 PolarHBondContact O-N 3.23Å; S2393-E2395 VanDerWaalsContact O-N 3.13Å; S2393-A2396 WeakPolarHBondContact O-CB 3.4Å; S2393-A2396 PolarHBondContact O-N 2.92Å; S2393-A2396 WeakPolarHBondContact OG-CB 3.48Å; S2393-A2396 PolarHBondContact OG-N 2.88Å
2394	P	64.4	Low	74.2	Confident	82 Å²	82	57.5 Å²	57.5	53%	0.532	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-23	174.3	23.1	-30.6	0	0	0	112.4	I2397	P2394-I2397 HydrophobicContact CB-CD1 4.33Å; P2394-I2397 WeakPolarHBondContact O-CG1 3.21Å
2395	E	68.1	Low	73	Confident	61 Å²	61	60.7 Å²	60.7	29%	0.285	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-30.1	173.2	-66	65.7	-142.7	0	0	113.7	N2351 L2356 K2360 V2389 S2393	N2351-E2395 HydrophobicContact CB-CG 3.56Å; N2351-E2395 WeakPolarHBondContact ND2-CG 3.5Å; N2351-E2395 PolarHBondContact ND2-OE1 3.43Å; L2356-E2395 HydrophobicContact CD2-CB 4.46Å; K2360-E2395 WeakPolarHBondContact CE-O 3.33Å; K2360-E2395 PolarHBondContact NZ-O 2.88Å; V2389-E2395 HydrophobicContact CG1-CB 4.2Å; S2393-E2395 WeakPolarHBondContact CB-OE2 3.43Å; S2393-E2395 PolarHBondContact O-N 3.23Å; S2393-E2395 VanDerWaalsContact O-N 3.13Å
2396	A	74.4	Confident	71.7	Confident	2 Å²	2	54.3 Å²	54.3	2%	0.017	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-15	-176.6	0	0	0	0	0	114.1	R2380 L2384 V2389 G2390 E2391 S2393 W2398	R2380-A2396 PolarHBondContact NH2-O 3.39Å; L2384-A2396 HydrophobicContact CD1-CB 3.75Å; L2384-A2396 HydrophobicContact CD2-CB 4.47Å; V2389-A2396 HydrophobicContact CG1-CB 4.12Å; G2390-A2396 WeakPolarHBondContact O-CB 3.12Å; E2391-A2396 WeakPolarHBondContact O-CB 3.49Å; S2393-A2396 WeakPolarHBondContact O-CB 3.4Å; S2393-A2396 PolarHBondContact O-N 2.92Å; S2393-A2396 WeakPolarHBondContact OG-CB 3.48Å; S2393-A2396 PolarHBondContact OG-N 2.88Å; A2396-W2398 PolarHBondContact O-N 2.93Å
2397	I	74.1	Confident	70.4	Confident	44 Å²	44	55 Å²	55	23%	0.226	29%	0.293	C	S	.	.			trans	-60.3	133.3	175.3	-52	168.7	0	0	0	109	K2360 P2394 I2399 F2418	K2360-I2397 VanDerWaalsContact CE-O 3.31Å; K2360-I2397 WeakPolarHBondContact CE-O 3.18Å; P2394-I2397 HydrophobicContact CB-CD1 4.33Å; P2394-I2397 WeakPolarHBondContact O-CG1 3.21Å; I2397-I2399 HydrophobicContact CG2-CG1 4.15Å; I2397-F2418 HydrophobicContact CD1-CE2 3.85Å; I2397-F2418 HydrophobicContact CD1-CZ 3.44Å; I2397-F2418 VanDerWaalsContact CD1-CZ 3.44Å; I2397-F2418 HydrophobicContact CG1-CZ 4.1Å
2398	W	77.4	Confident	68.7	Low	53 Å²	53	56.3 Å²	56.3	20%	0.201	30%	0.303	C	S	.	.			trans	-91.3	138.2	165.7	-176.3	80.9	0	0	0	110	M2101 K2360 E2364 A2396	M2101-W2398 HydrophobicContact CE-CH2 4.18Å; M2101-W2398 HydrophobicContact CE-CZ2 4.47Å; M2101-W2398 HydrophobicContact SD-CH2 3.94Å; M2101-W2398 HydrophobicContact SD-CZ2 4.28Å; K2360-W2398 HydrophobicContact CB-CB 4.3Å; K2360-W2398 HydrophobicContact CB-CG 4.39Å; E2364-W2398 HydrophobicContact CB-CD2 4.06Å; E2364-W2398 HydrophobicContact CB-CE3 4.44Å; E2364-W2398 HydrophobicContact CB-CG 4.21Å; E2364-W2398 HydrophobicContact CG-CB 4.48Å; E2364-W2398 HydrophobicContact CG-CD2 3.65Å; E2364-W2398 HydrophobicContact CG-CE3 3.54Å; E2364-W2398 HydrophobicContact CG-CG 4.1Å; E2364-W2398 HydrophobicContact CG-CH2 4.35Å; E2364-W2398 HydrophobicContact CG-CZ2 4.48Å; E2364-W2398 HydrophobicContact CG-CZ3 3.92Å; E2364-W2398 WeakPolarHBondContact OE2-CB 3.27Å; A2396-W2398 PolarHBondContact O-N 2.93Å
2399	I	70.4	Confident	66.9	Low	56 Å²	56	50.3 Å²	50.3	29%	0.287	27%	0.271	S	S	.	.			trans	-135.1	130.3	172.1	-59.2	179.1	0	0	0	104.8	I2397 M2403 R2405	I2397-I2399 HydrophobicContact CG2-CG1 4.15Å; I2399-M2403 HydrophobicContact CG2-CB 3.89Å; I2399-M2403 WeakPolarHBondContact CG2-O 3.31Å; I2399-R2405 HydrophobicContact CD1-CG 4.3Å
2400	S	72.6	Confident	65	Low	15 Å²	15	52.7 Å²	52.7	11%	0.105	28%	0.283	C	S	.	.			trans	-60.6	141.9	-178.1	-172.1	0	0	0	0	111.1	H2402 M2403	S2400-H2402 PolarHBondContact O-N 3.41Å; S2400-H2402 PolarHBondContact OG-CE1 2.98Å; S2400-H2402 VanDerWaalsContact OG-CE1 3.25Å; S2400-H2402 PolarHBondContact OG-ND1 3.43Å; S2400-M2403 WeakPolarHBondContact O-CB 3.38Å; S2400-M2403 PolarHBondContact O-N 2.8Å
2401	P	68.6	Low	63	Low	17 Å²	17	56.4 Å²	56.4	11%	0.11	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.1	-169.6	-30.7	36.6	0	0	0	117.3	Y2166 H2344	Y2166-P2401 HydrophobicContact CD1-CB 4.44Å; Y2166-P2401 HydrophobicContact CD2-CB 3.57Å; Y2166-P2401 HydrophobicContact CD2-CG 3.74Å; Y2166-P2401 HydrophobicContact CE1-CB 4.42Å; Y2166-P2401 HydrophobicContact CE2-CB 3.54Å; Y2166-P2401 HydrophobicContact CE2-CG 4.12Å; Y2166-P2401 HydrophobicContact CG-CB 4.04Å; Y2166-P2401 HydrophobicContact CG-CG 4.29Å; H2344-P2401 VanDerWaalsContact CD2-CA 3.46Å; H2344-P2401 WeakPolarHBondContact CD2-CA 3.36Å
2402	H	68.5	Low	61.6	Low	26 Å²	26	56.6 Å²	56.6	12%	0.12	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	0.9	178.2	65.1	-102.6	0	0	0	113.9	D2102 S2400 L2426 L2427	D2102-H2402 IonicContact OD2-CE1 3.24Å; S2400-H2402 PolarHBondContact O-N 3.41Å; S2400-H2402 PolarHBondContact OG-CE1 2.98Å; S2400-H2402 VanDerWaalsContact OG-CE1 3.25Å; S2400-H2402 PolarHBondContact OG-ND1 3.43Å; H2402-L2426 WeakPolarHBondContact O-CB 3.38Å; H2402-L2426 PolarHBondContact O-N 2.91Å; H2402-L2427 HydrophobicContact CB-CD1 4.46Å; H2402-L2427 HydrophobicContact CB-CD2 3.65Å; H2402-L2427 HydrophobicContact CB-CG 3.84Å
2403	M	68.7	Low	60	Low	62 Å²	62	51.3 Å²	51.3	31%	0.305	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	138.9	-176.9	-70.8	-66.4	-168.7	0	0	111.8	I2399 S2400 I2423 R2424	I2399-M2403 HydrophobicContact CG2-CB 3.89Å; I2399-M2403 WeakPolarHBondContact CG2-O 3.31Å; S2400-M2403 WeakPolarHBondContact O-CB 3.38Å; S2400-M2403 PolarHBondContact O-N 2.8Å; M2403-I2423 HydrophobicContact CB-CG2 3.72Å; M2403-I2423 HydrophobicContact CG-CG2 4.07Å; M2403-I2423 HydrophobicContact SD-CG2 3.86Å; M2403-R2424 CarbonylContact C-O 3.59Å; M2403-R2424 WeakPolarHBondContact CA-O 3.35Å
2404	I	65.7	Low	58.8	Low	3 Å²	3	56.7 Å²	56.7	2%	0.015	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	138.2	174	-178	158.9	0	0	0	110.4	Q2345 I2423 R2424 L2426 A2549 R2552	Q2345-I2404 VanDerWaalsContact OE1-CG1 3.25Å; I2404-I2423 CarbonylContact O-C 3.41Å; I2404-I2423 WeakPolarHBondContact O-CA 3.32Å; I2404-R2424 HydrophobicContact CG2-CB 4.24Å; I2404-R2424 WeakPolarHBondContact CG2-O 3.5Å; I2404-R2424 PolarHBondContact N-O 3.3Å; I2404-R2424 PolarHBondContact O-N 2.92Å; I2404-L2426 HydrophobicContact CB-CD1 4.46Å; I2404-L2426 HydrophobicContact CG2-CD1 4.46Å; I2404-L2426 HydrophobicContact CG2-CD2 3.79Å; I2404-L2426 HydrophobicContact CG2-CG 4.05Å; I2404-A2549 HydrophobicContact CG2-CB 4Å; I2404-R2552 HydrophobicContact CD1-CG 3.94Å
2405	R	60.6	Low	57.9	Low	69 Å²	69	61.3 Å²	61.3	26%	0.26	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	128.9	166.7	-84.8	179.5	174	-168.5	-4.7	109.8	I2399 C2407 I2423	I2399-R2405 HydrophobicContact CD1-CG 4.3Å; R2405-C2407 VanDerWaalsContact C-N 3.33Å; R2405-C2407 PolarHBondContact O-N 3.49Å; R2405-I2423 HydrophobicContact CG-CD1 4.32Å; R2405-I2423 HydrophobicContact CG-CG1 3.81Å
2406	D	55.8	Low	56.5	Low	33 Å²	33	63.1 Å²	63.1	18%	0.176	32%	0.32	C	S	.	.			trans	-71.7	85	172.5	-78.5	-17.7	0	0	0	109.7	P2408 A2422 R2424 A2549	D2406-P2408 WeakPolarHBondContact O-CD 3.43Å; D2406-A2422 HydrophobicContact CB-CB 4.43Å; D2406-A2422 PolarHBondContact N-O 3.29Å; D2406-R2424 IonicContact OD1-NE 3.78Å; D2406-R2424 WeakPolarHBondContact OD2-CD 3.29Å; D2406-R2424 WeakPolarHBondContact OD2-CG 3.5Å; D2406-R2424 IonicContact OD2-CZ 2.75Å; D2406-R2424 IonicContact OD2-NE 2.87Å; D2406-R2424 PolarHBondContact OD2-NE 3.12Å; D2406-A2549 WeakPolarHBondContact OD1-CB 3.11Å
2407	C	50.7	Low	54.8	Low	70 Å²	70	68.1 Å²	68.1	47%	0.473	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-78.8	124.5	166.4	-73.1	0	0	0	0	110	R2405 L2409	R2405-C2407 VanDerWaalsContact C-N 3.33Å; R2405-C2407 PolarHBondContact O-N 3.49Å; C2407-L2409 PolarHBondContact O-N 2.85Å
2408	P	45.4	Very low	53.4	Low	57 Å²	57	72.5 Å²	72.5	37%	0.37	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-55.5	130.4	167.6	-25	35.6	0	0	0	110.1	D2406 Q2411	D2406-P2408 WeakPolarHBondContact O-CD 3.43Å; P2408-Q2411 PolarHBondContact O-N 2.8Å
2409	L	40.1	Very low	51.7	Low	31 Å²	31	78.7 Å²	78.7	16%	0.162	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	144.4	-169.6	-52.5	114.6	0	0	0	110.5	Q750 E751 C2407 Q2411 T2546 H2548	Q750-L2409 VanDerWaalsContact C-CD2 3.47Å; Q750-L2409 HydrophobicContact CB-CB 3.22Å; Q750-L2409 HydrophobicContact CB-CD1 4.14Å; Q750-L2409 HydrophobicContact CB-CD2 3.87Å; Q750-L2409 HydrophobicContact CB-CG 3.9Å; Q750-L2409 HydrophobicContact CG-CB 3.51Å; Q750-L2409 WeakPolarHBondContact O-CB 3.44Å; Q750-L2409 WeakPolarHBondContact O-CD2 3.49Å; E751-L2409 HydrophobicContact CG-CD2 4.16Å; C2407-L2409 PolarHBondContact O-N 2.85Å; L2409-Q2411 VanDerWaalsContact C-N 3.34Å; L2409-Q2411 PolarHBondContact O-N 2.91Å; L2409-T2546 WeakPolarHBondContact CD1-O 3.2Å; L2409-H2548 HydrophobicContact CD2-CB 4.21Å
2410	N	39.2	Very low	50.3	Low	80 Å²	80	81 Å²	81	43%	0.428	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	28.6	-171.4	-69.7	-25.4	0	0	0	116.7	S749 Q750 H773	S749-N2410 PolarHBondContact O-ND2 2.93Å; S749-N2410 PolarHBondContact O-OD1 2.68Å; S749-N2410 PolarHBondContact OG-ND2 3.32Å; Q750-N2410 PolarHBondContact N-ND2 3.09Å; H773-N2410 PolarHBondContact CE1-OD1 2.75Å
2411	Q	36.9	Very low	49.1	Very low	122 Å²	122	82 Å²	82	57%	0.57	42%	0.422	S	S	*	.	S	Bend	trans	-123.5	152.9	164	-62.4	-162	14.8	0	0	113.4	P2408 L2409 Y2416	P2408-Q2411 PolarHBondContact O-N 2.8Å; L2409-Q2411 VanDerWaalsContact C-N 3.34Å; L2409-Q2411 PolarHBondContact O-N 2.91Å; Q2411-Y2416 HydrophobicContact CB-CE2 4.47Å
2412	D	44	Very low	48.4	Very low	95 Å²	95	83.7 Å²	83.7	51%	0.508	44%	0.437	S	S	.	.			trans	-74.8	116.7	-170.9	-173.9	-9.9	0	0	0	110.8	N2414 K2415	D2412-N2414 PolarHBondContact O-N 2.61Å; D2412-N2414 VanDerWaalsContact O-N 3.13Å; D2412-N2414 PolarHBondContact OD1-N 3.49Å; D2412-K2415 WeakPolarHBondContact O-CB 3.27Å; D2412-K2415 PolarHBondContact O-N 3.02Å; D2412-K2415 VanDerWaalsContact O-N 3.11Å
2413	P	43.7	Very low	47.8	Very low	76 Å²	76	86.8 Å²	86.8	49%	0.494	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-62.7	-23.7	-171.7	25.5	-35.4	0	0	0	113.6	K2415	P2413-K2415 PolarHBondContact O-N 3.28Å
2414	N	46.2	Very low	47.5	Very low	137 Å²	137	87.7 Å²	87.7	73%	0.733	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-75.1	-5.7	179.9	-69	-13.6	0	0	0	113.6	D2412	D2412-N2414 PolarHBondContact O-N 2.61Å; D2412-N2414 VanDerWaalsContact O-N 3.13Å; D2412-N2414 PolarHBondContact OD1-N 3.49Å
2415	K	44.6	Very low	47.7	Very low	179 Å²	179	89.3 Å²	89.3	78%	0.778	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-100.4	-4.6	-170.8	-143.3	173.9	-170.8	174	0	115.1	D2412 P2413	D2412-K2415 WeakPolarHBondContact O-CB 3.27Å; D2412-K2415 PolarHBondContact O-N 3.02Å; D2412-K2415 VanDerWaalsContact O-N 3.11Å; P2413-K2415 PolarHBondContact O-N 3.28Å
2416	Y	39.8	Very low	48.4	Very low	99 Å²	99	87 Å²	87	39%	0.388	46%	0.458	S	S	.	.	S	Bend	trans	-94.9	132.7	178.7	-85.1	-90	0	0	0	111.9	Q2411	Q2411-Y2416 HydrophobicContact CB-CE2 4.47Å
2417	T	38.3	Very low	49.4	Very low	106 Å²	106	85.8 Å²	85.8	65%	0.65	45%	0.452	S	S	*	.			trans	-65.9	142.5	162.9	44.5	0	0	0	0	109.9	E2419	T2417-E2419 PolarHBondContact O-N 3.07Å
2418	F	44.1	Very low	50.8	Low	137 Å²	137	82.5 Å²	82.5	60%	0.601	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-13.2	-159.8	-139	-100.5	0	0	0	115.6	I2397	I2397-F2418 HydrophobicContact CD1-CE2 3.85Å; I2397-F2418 HydrophobicContact CD1-CZ 3.44Å; I2397-F2418 VanDerWaalsContact CD1-CZ 3.44Å; I2397-F2418 HydrophobicContact CG1-CZ 4.1Å
2419	E	42.4	Very low	52.4	Low	182 Å²	182	82 Å²	82	85%	0.85	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-2.2	-158.5	-58.3	179	142.4	0	0	115.2	T2417	T2417-E2419 PolarHBondContact O-N 3.07Å
2420	T	40.3	Very low	54.3	Low	105 Å²	105	81 Å²	81	64%	0.644	42%	0.415	S	S	*	.	S	Bend	trans	-132.9	9.6	-166.5	51.3	0	0	0	0	116.9
2421	T	46.8	Very low	55.9	Low	37 Å²	37	78.2 Å²	78.2	23%	0.227	40%	0.401	C	S	.	.			trans	-97.7	125.4	171.9	41.8	0	0	0	0	111.5
2422	A	54.5	Low	57.7	Low	52 Å²	52	72.8 Å²	72.8	43%	0.43	38%	0.376	S	S	.	.			trans	-70.5	154.5	178.1	0	0	0	0	0	111.8	D2406	D2406-A2422 HydrophobicContact CB-CB 4.43Å; D2406-A2422 PolarHBondContact N-O 3.29Å
2423	I	55.9	Low	59.3	Low	91 Å²	91	69.5 Å²	69.5	47%	0.467	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	132.6	172.5	-60.9	177.4	0	0	0	107.8	M2403 I2404 R2405	M2403-I2423 HydrophobicContact CB-CG2 3.72Å; M2403-I2423 HydrophobicContact CG-CG2 4.07Å; M2403-I2423 HydrophobicContact SD-CG2 3.86Å; I2404-I2423 CarbonylContact O-C 3.41Å; I2404-I2423 WeakPolarHBondContact O-CA 3.32Å; R2405-I2423 HydrophobicContact CG-CD1 4.32Å; R2405-I2423 HydrophobicContact CG-CG1 3.81Å
2424	R	61.9	Low	60.9	Low	80 Å²	80	66.9 Å²	66.9	30%	0.302	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	147.8	-179.2	-69.9	-171.3	175.9	-103.8	-16.2	112	M2403 I2404 D2406 P2545	M2403-R2424 CarbonylContact C-O 3.59Å; M2403-R2424 WeakPolarHBondContact CA-O 3.35Å; I2404-R2424 HydrophobicContact CG2-CB 4.24Å; I2404-R2424 WeakPolarHBondContact CG2-O 3.5Å; I2404-R2424 PolarHBondContact N-O 3.3Å; I2404-R2424 PolarHBondContact O-N 2.92Å; D2406-R2424 IonicContact OD1-NE 3.78Å; D2406-R2424 WeakPolarHBondContact OD2-CD 3.29Å; D2406-R2424 WeakPolarHBondContact OD2-CG 3.5Å; D2406-R2424 IonicContact OD2-CZ 2.75Å; D2406-R2424 IonicContact OD2-NE 2.87Å; D2406-R2424 PolarHBondContact OD2-NE 3.12Å; R2424-P2545 VanDerWaalsContact CZ-CG 3.43Å
2425	S	70.9	Confident	62.2	Low	38 Å²	38	60.4 Å²	60.4	27%	0.266	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	142.4	173.9	-173.2	0	0	0	0	111.9	L2427	S2425-L2427 WeakPolarHBondContact OG-CB 3.44Å; S2425-L2427 VanDerWaalsContact OG-CG 3.28Å; S2425-L2427 WeakPolarHBondContact OG-CG 3.46Å; S2425-L2427 PolarHBondContact OG-N 3.44Å
2426	L	75.3	Confident	63.2	Low	21 Å²	21	53.4 Å²	53.4	11%	0.11	28%	0.283	C	S	.	.			trans	-99.1	2.2	171.5	-60.2	179.1	0	0	0	112.6	H2402 I2404 R2552 R2553 V2556	H2402-L2426 WeakPolarHBondContact O-CB 3.38Å; H2402-L2426 PolarHBondContact O-N 2.91Å; I2404-L2426 HydrophobicContact CB-CD1 4.46Å; I2404-L2426 HydrophobicContact CG2-CD1 4.46Å; I2404-L2426 HydrophobicContact CG2-CD2 3.79Å; I2404-L2426 HydrophobicContact CG2-CG 4.05Å; L2426-R2552 HydrophobicContact CD1-CB 3.89Å; L2426-R2552 HydrophobicContact CD1-CG 4.38Å; L2426-R2552 HydrophobicContact CD2-CB 3.49Å; L2426-R2552 VanDerWaalsContact CD2-CB 3.49Å; L2426-R2552 HydrophobicContact CG-CB 4.35Å; L2426-R2553 HydrophobicContact CD2-CB 4.48Å; L2426-V2556 HydrophobicContact CB-CG2 4.26Å
2427	L	76.6	Confident	64.3	Low	7 Å²	7	51.8 Å²	51.8	4%	0.037	28%	0.283	C	S	.	.			trans	-65.8	147.2	177.3	-60.8	172.5	0	0	0	111	H2402 S2425 Y2429 C2447 R2448	H2402-L2427 HydrophobicContact CB-CD1 4.46Å; H2402-L2427 HydrophobicContact CB-CD2 3.65Å; H2402-L2427 HydrophobicContact CB-CG 3.84Å; S2425-L2427 WeakPolarHBondContact OG-CB 3.44Å; S2425-L2427 VanDerWaalsContact OG-CG 3.28Å; S2425-L2427 WeakPolarHBondContact OG-CG 3.46Å; S2425-L2427 PolarHBondContact OG-N 3.44Å; L2427-Y2429 HydrophobicContact CB-CD2 4.11Å; L2427-Y2429 HydrophobicContact CB-CE2 3.59Å; L2427-Y2429 HydrophobicContact CD1-CE2 3.93Å; L2427-Y2429 HydrophobicContact CG-CE2 4.43Å; L2427-C2447 HydrophobicContact CD2-CB 3.75Å; L2427-R2448 VanDerWaalsContact CD1-CZ 3.45Å; L2427-R2448 VanDerWaalsContact CD1-NH2 3.32Å; L2427-R2448 HydrophobicContact CD2-CG 3.88Å
2428	I	80.6	Confident	65.7	Low	1 Å²	1	48.9 Å²	48.9	1%	0.005	27%	0.266	C	S	.	.			trans	-119.9	117.5	175	-68.6	163.4	0	0	0	106.6	V2446 L2492 R2553 V2556 Y2557 I2560	I2428-V2446 HydrophobicContact CG2-CB 4.48Å; I2428-V2446 HydrophobicContact CG2-CG2 4.43Å; I2428-V2446 WeakPolarHBondContact O-CB 3.48Å; I2428-V2446 PolarHBondContact O-N 2.79Å; I2428-L2492 HydrophobicContact CG2-CD2 3.81Å; I2428-R2553 HydrophobicContact CG1-CG 4.43Å; I2428-V2556 HydrophobicContact CD1-CB 3.83Å; I2428-V2556 HydrophobicContact CD1-CG1 3.7Å; I2428-V2556 HydrophobicContact CG1-CG1 4.48Å; I2428-Y2557 HydrophobicContact CD1-CD1 3.72Å; I2428-Y2557 HydrophobicContact CD1-CD2 3.38Å; I2428-Y2557 HydrophobicContact CD1-CE1 3.88Å; I2428-Y2557 HydrophobicContact CD1-CE2 3.58Å; I2428-Y2557 HydrophobicContact CD1-CG 3.47Å; I2428-Y2557 VanDerWaalsContact CD1-CG 3.47Å; I2428-Y2557 HydrophobicContact CG1-CD2 4.26Å; I2428-Y2557 HydrophobicContact CG1-CE1 4.35Å; I2428-Y2557 HydrophobicContact CG1-CE2 3.97Å; I2428-Y2557 HydrophobicContact CG2-CD1 4.42Å; I2428-Y2557 HydrophobicContact CG2-CE1 3.75Å; I2428-I2560 HydrophobicContact CB-CD1 4.08Å; I2428-I2560 HydrophobicContact CD1-CD1 3.59Å; I2428-I2560 HydrophobicContact CG1-CD1 4.44Å; I2428-I2560 HydrophobicContact CG2-CD1 4.14Å
2429	Y	78.3	Confident	67.1	Low	46 Å²	46	43.5 Å²	43.5	18%	0.18	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.1	177	-66.1	-100.6	0	0	0	108.4	L2427 P2431 I2444 D2445 R2448 Q2495	L2427-Y2429 HydrophobicContact CB-CD2 4.11Å; L2427-Y2429 HydrophobicContact CB-CE2 3.59Å; L2427-Y2429 HydrophobicContact CD1-CE2 3.93Å; L2427-Y2429 HydrophobicContact CG-CE2 4.43Å; Y2429-P2431 VanDerWaalsContact O-CD 3.26Å; Y2429-P2431 WeakPolarHBondContact O-CD 3.35Å; Y2429-I2444 WeakPolarHBondContact CA-O 3.37Å; Y2429-D2445 HydrophobicContact CD1-CB 3.96Å; Y2429-D2445 HydrophobicContact CE1-CB 3.85Å; Y2429-R2448 PolarHBondContact OH-NH2 2.82Å; Y2429-Q2495 PolarHBondContact O-NE2 3.22Å; Y2429-Q2495 PolarHBondContact O-OE1 2.9Å
2430	L	81.1	Confident	68.6	Low	9 Å²	9	35.6 Å²	35.6	5%	0.047	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	106.8	158.1	-77.5	166.9	0	0	0	107	V2433 I2444 V2446 L2488 A2491 L2492 Q2495	L2430-V2433 HydrophobicContact CB-CG2 3.61Å; L2430-I2444 HydrophobicContact CB-CB 4.34Å; L2430-I2444 PolarHBondContact N-O 3.48Å; L2430-I2444 PolarHBondContact O-N 3.32Å; L2430-V2446 HydrophobicContact CB-CG2 4.34Å; L2430-V2446 HydrophobicContact CD1-CG2 3.91Å; L2430-V2446 HydrophobicContact CG-CG2 3.91Å; L2430-L2488 HydrophobicContact CD1-CB 4.49Å; L2430-L2488 HydrophobicContact CD1-CD2 3.85Å; L2430-A2491 HydrophobicContact CD2-CB 3.58Å; L2430-L2492 HydrophobicContact CD1-CD1 4.37Å; L2430-L2492 HydrophobicContact CD1-CD2 4.4Å; L2430-L2492 HydrophobicContact CD1-CG 4.05Å; L2430-L2492 HydrophobicContact CD2-CD2 4.3Å; L2430-L2492 HydrophobicContact CD2-CG 4.14Å; L2430-L2492 HydrophobicContact CG-CD2 4.16Å; L2430-L2492 HydrophobicContact CG-CG 4.22Å; L2430-Q2495 HydrophobicContact CD2-CG 4.14Å; L2430-Q2495 VanDerWaalsContact CD2-OE1 3.3Å
2431	P	72.8	Confident	70.3	Confident	22 Å²	22	32.3 Å²	32.3	14%	0.143	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	139.8	-177.1	27.9	-34.3	0	0	0	111.3	V1894 Y2429 V2433 D2443	V1894-P2431 HydrophobicContact CG2-CB 4.17Å; Y2429-P2431 VanDerWaalsContact O-CD 3.26Å; Y2429-P2431 WeakPolarHBondContact O-CD 3.35Å; P2431-V2433 PolarHBondContact O-N 2.97Å; P2431-D2443 VanDerWaalsContact CA-OD1 3.3Å; P2431-D2443 WeakPolarHBondContact CA-OD1 3.33Å
2432	E	73.1	Confident	71.7	Confident	9 Å²	9	31.2 Å²	31.2	4%	0.042	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	53.8	42.2	165.5	-41.4	167.4	179.9	0	0	116.3	Y2004 R2008 Q2024 A2434 T2441 R2442 D2443	Y2004-E2432 WeakPolarHBondContact CE1-OE2 3.48Å; Y2004-E2432 PolarHBondContact OH-OE1 3.43Å; Y2004-E2432 PolarHBondContact OH-OE2 3.42Å; R2008-E2432 WeakPolarHBondContact CD-OE2 3.41Å; R2008-E2432 IonicContact CZ-OE2 3.21Å; R2008-E2432 IonicContact NE-OE2 3.8Å; R2008-E2432 PolarHBondContact NH1-O 3.06Å; R2008-E2432 IonicContact NH1-OE2 2.87Å; R2008-E2432 PolarHBondContact NH1-OE2 3.29Å; Q2024-E2432 PolarHBondContact NE2-OE1 2.83Å; E2432-A2434 PolarHBondContact O-N 3.44Å; E2432-T2441 HydrophobicContact CB-CG2 3.89Å; E2432-T2441 WeakPolarHBondContact O-CG2 3.29Å; E2432-R2442 CarbonylContact C-O 3.57Å; E2432-D2443 PolarHBondContact N-OD1 3.11Å
2433	V	78.4	Confident	72.9	Confident	26 Å²	26	29.8 Å²	29.8	16%	0.158	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	112.4	-179.6	-168.2	0	0	0	0	111.8	L2430 P2431 R2442 I2444 Y2483 L2488	L2430-V2433 HydrophobicContact CB-CG2 3.61Å; P2431-V2433 PolarHBondContact O-N 2.97Å; V2433-R2442 PolarHBondContact N-O 2.98Å; V2433-R2442 PolarHBondContact O-N 3.13Å; V2433-I2444 HydrophobicContact CB-CD1 3.76Å; V2433-I2444 HydrophobicContact CB-CG1 3.98Å; V2433-I2444 HydrophobicContact CG1-CD1 3.96Å; V2433-I2444 HydrophobicContact CG2-CB 4.31Å; V2433-I2444 HydrophobicContact CG2-CD1 3.81Å; V2433-I2444 HydrophobicContact CG2-CG1 3.8Å; V2433-Y2483 HydrophobicContact CB-CE1 4.32Å; V2433-Y2483 HydrophobicContact CG1-CD1 3.72Å; V2433-Y2483 HydrophobicContact CG1-CE1 3.62Å; V2433-L2488 HydrophobicContact CG1-CD2 4.07Å
2434	A	76	Confident	74.2	Confident	21 Å²	21	25.5 Å²	25.5	17%	0.174	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	133.1	177	0	0	0	0	0	112.6	Q2005 E2432 T2441	Q2005-A2434 HydrophobicContact CG-CB 4.13Å; E2432-A2434 PolarHBondContact O-N 3.44Å; A2434-T2441 WeakPolarHBondContact CB-OG1 3.45Å
2435	C	75.5	Confident	75.1	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.131	C	C	.	.			trans	-73.9	130	173.3	176.3	0	0	0	0	111.4	T2437 C2438 N2439 F2440 C2476 C2479 Y2483	C2435-T2437 PolarHBondContact O-N 3.06Å; C2435-C2438 VanDerWaalsContact SG-SG 3.67Å; C2435-N2439 VanDerWaalsContact O-CA 3.24Å; C2435-N2439 WeakPolarHBondContact O-CA 3.24Å; C2435-N2439 PolarHBondContact O-N 3.48Å; C2435-F2440 PolarHBondContact N-O 3.18Å; C2435-C2476 HydrophobicContact CB-CB 3.95Å; C2435-C2476 VanDerWaalsContact SG-CB 3.51Å; C2435-C2479 PolarHBondContact SG-SG 2.98Å; C2435-Y2483 HydrophobicContact CB-CE1 4.16Å
2436	P	65	Low	75.6	Confident	33 Å²	33	20.7 Å²	20.7	21%	0.214	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	6	-177.4	32.8	-39.2	0	0	0	115.4	I1843 P2484	I1843-P2436 HydrophobicContact CD1-CB 3.83Å; P2436-P2484 HydrophobicContact CG-CG 4.25Å
2437	T	63.5	Low	75.6	Confident	65 Å²	65	20.1 Å²	20.1	40%	0.399	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118	-44.1	178.4	-53.8	0	0	0	0	112.8	C2435 T2481	C2435-T2437 PolarHBondContact O-N 3.06Å; T2437-T2481 WeakPolarHBondContact CB-OG1 3.33Å; T2437-T2481 WeakPolarHBondContact OG1-CG2 3.39Å; T2437-T2481 PolarHBondContact OG1-OG1 2.81Å
2438	C	66.9	Low	75.5	Confident	44 Å²	44	20.1 Å²	20.1	30%	0.297	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	5.6	-177.5	63.5	0	0	0	0	113.8	C2435 F2440 C2479	C2435-C2438 VanDerWaalsContact SG-SG 3.67Å; C2438-F2440 PolarHBondContact O-N 2.97Å; C2438-C2479 HydrophobicContact CB-CB 4.15Å; C2438-C2479 PolarHBondContact SG-SG 2.88Å
2439	N	73.7	Confident	75.4	Confident	24 Å²	24	21.1 Å²	21.1	13%	0.128	12%	0.122	C	C	.	.			trans	59.3	-1.6	-175.8	-168.8	57.5	0	0	0	115.8	I2001 Y2002 Q2005 C2435 T2441	I2001-N2439 HydrophobicContact CG2-CB 3.82Å; I2001-N2439 VanDerWaalsContact CG2-ND2 3.32Å; I2001-N2439 WeakPolarHBondContact CG2-ND2 3.35Å; I2001-N2439 PolarHBondContact O-ND2 2.97Å; Y2002-N2439 HydrophobicContact CD1-CB 4.07Å; Y2002-N2439 WeakPolarHBondContact CD1-OD1 3.35Å; Y2002-N2439 HydrophobicContact CE1-CB 3.67Å; Y2002-N2439 HydrophobicContact CE2-CB 4.46Å; Q2005-N2439 PolarHBondContact OE1-OD1 3.1Å; C2435-N2439 VanDerWaalsContact O-CA 3.24Å; C2435-N2439 WeakPolarHBondContact O-CA 3.24Å; C2435-N2439 PolarHBondContact O-N 3.48Å; N2439-T2441 PolarHBondContact O-N 2.73Å; N2439-T2441 PolarHBondContact O-OG1 3.11Å
2440	F	73.9	Confident	75.1	Confident	17 Å²	17	21.6 Å²	21.6	8%	0.075	13%	0.127	C	C	.	.			trans	-51.8	119.4	178.4	-179.9	-117	0	0	0	110.8	E1911 C2435 C2438 R2442 P2477 H2478	E1911-F2440 HydrophobicContact CG-CE2 3.89Å; E1911-F2440 WeakPolarHBondContact OE1-CD2 3.43Å; E1911-F2440 WeakPolarHBondContact OE1-CE2 3.28Å; E1911-F2440 WeakPolarHBondContact OE2-CE2 3.34Å; C2435-F2440 PolarHBondContact N-O 3.18Å; C2438-F2440 PolarHBondContact O-N 2.97Å; F2440-R2442 HydrophobicContact CD1-CB 4.43Å; F2440-R2442 HydrophobicContact CE1-CB 3.74Å; F2440-R2442 HydrophobicContact CE1-CG 4.16Å; F2440-R2442 HydrophobicContact CZ-CB 3.99Å; F2440-P2477 HydrophobicContact CD1-CG 3.84Å; F2440-P2477 HydrophobicContact CE1-CG 3.48Å; F2440-P2477 VanDerWaalsContact CE1-CG 3.48Å; F2440-H2478 HydrophobicContact CB-CB 4.45Å
2441	T	75.4	Confident	75	Confident	36 Å²	36	22.7 Å²	22.7	22%	0.221	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	115.4	-166.4	-75	0	0	0	0	108.3	E2432 A2434 N2439	E2432-T2441 HydrophobicContact CB-CG2 3.89Å; E2432-T2441 WeakPolarHBondContact O-CG2 3.29Å; A2434-T2441 WeakPolarHBondContact CB-OG1 3.45Å; N2439-T2441 PolarHBondContact O-N 2.73Å; N2439-T2441 PolarHBondContact O-OG1 3.11Å
2442	R	77.1	Confident	75.2	Confident	13 Å²	13	22.5 Å²	22.5	5%	0.049	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	147.6	-173.8	73.3	-169.5	-173.2	92.8	-13.9	112	E2432 V2433 F2440 I2444 D2449 V2475 Y2483	E2432-R2442 CarbonylContact C-O 3.57Å; V2433-R2442 PolarHBondContact N-O 2.98Å; V2433-R2442 PolarHBondContact O-N 3.13Å; F2440-R2442 HydrophobicContact CD1-CB 4.43Å; F2440-R2442 HydrophobicContact CE1-CB 3.74Å; F2440-R2442 HydrophobicContact CE1-CG 4.16Å; F2440-R2442 HydrophobicContact CZ-CB 3.99Å; R2442-I2444 HydrophobicContact CG-CG1 4.2Å; R2442-I2444 PolarHBondContact O-N 3.35Å; R2442-D2449 IonicContact CZ-OD2 3.73Å; R2442-D2449 IonicContact NH1-OD1 2.65Å; R2442-D2449 IonicContact NH1-OD2 2.7Å; R2442-D2449 PolarHBondContact NH1-OD2 3.04Å; R2442-D2449 IonicContact NH2-OD2 2.65Å; R2442-D2449 PolarHBondContact NH2-OD2 2.99Å; R2442-V2475 PolarHBondContact NH2-O 3.36Å; R2442-V2475 VanDerWaalsContact NH2-O 3.15Å; R2442-Y2483 PolarHBondContact NE-OH 3.14Å
2443	D	79.5	Confident	75	Confident	23 Å²	23	24.2 Å²	24.2	12%	0.123	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	133.9	164.4	-54.5	-45.4	0	0	0	109.2	P2431 E2432	P2431-D2443 VanDerWaalsContact CA-OD1 3.3Å; P2431-D2443 WeakPolarHBondContact CA-OD1 3.33Å; E2432-D2443 PolarHBondContact N-OD1 3.11Å
2444	I	82.2	Confident	74.4	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	106.5	172.8	-58.9	-173.4	0	0	0	107.7	Y2429 L2430 V2433 R2442 V2446 D2449 W2474 Y2483	Y2429-I2444 WeakPolarHBondContact CA-O 3.37Å; L2430-I2444 HydrophobicContact CB-CB 4.34Å; L2430-I2444 PolarHBondContact N-O 3.48Å; L2430-I2444 PolarHBondContact O-N 3.32Å; V2433-I2444 HydrophobicContact CB-CD1 3.76Å; V2433-I2444 HydrophobicContact CB-CG1 3.98Å; V2433-I2444 HydrophobicContact CG1-CD1 3.96Å; V2433-I2444 HydrophobicContact CG2-CB 4.31Å; V2433-I2444 HydrophobicContact CG2-CD1 3.81Å; V2433-I2444 HydrophobicContact CG2-CG1 3.8Å; R2442-I2444 HydrophobicContact CG-CG1 4.2Å; R2442-I2444 PolarHBondContact O-N 3.35Å; I2444-V2446 HydrophobicContact CG2-CG2 4.26Å; I2444-V2446 WeakPolarHBondContact O-CG2 3.46Å; I2444-V2446 PolarHBondContact O-N 3.47Å; I2444-D2449 HydrophobicContact CG2-CB 4.47Å; I2444-W2474 HydrophobicContact CG2-CG 4.29Å; I2444-Y2483 HydrophobicContact CD1-CD2 4.34Å; I2444-Y2483 HydrophobicContact CD1-CE2 4.16Å
2445	D	80.9	Confident	73.7	Confident	14 Å²	14	27.9 Å²	27.9	8%	0.075	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	95.1	164.6	-173.5	-38.9	0	0	0	108.3	Y2429 C2447 R2448 D2449	Y2429-D2445 HydrophobicContact CD1-CB 3.96Å; Y2429-D2445 HydrophobicContact CE1-CB 3.85Å; D2445-C2447 PolarHBondContact O-N 3.13Å; D2445-C2447 VanDerWaalsContact O-N 3.1Å; D2445-C2447 WeakPolarHBondContact OD1-CA 3.24Å; D2445-C2447 WeakPolarHBondContact OD1-CB 3.48Å; D2445-C2447 PolarHBondContact OD1-N 2.58Å; D2445-R2448 HydrophobicContact CB-CB 4.49Å; D2445-R2448 PolarHBondContact O-N 2.85Å; D2445-R2448 VanDerWaalsContact O-N 3.09Å; D2445-R2448 WeakPolarHBondContact OD1-CB 3.28Å; D2445-R2448 PolarHBondContact OD1-N 3.21Å; D2445-R2448 IonicContact OD1-NE 3.1Å; D2445-R2448 IonicContact OD2-CZ 2.72Å; D2445-R2448 IonicContact OD2-NE 3.59Å; D2445-R2448 PolarHBondContact OD2-NE 3.34Å; D2445-R2448 IonicContact OD2-NH2 2.63Å; D2445-R2448 PolarHBondContact OD2-NH2 2.79Å; D2445-D2449 WeakPolarHBondContact O-CB 3.25Å; D2445-D2449 PolarHBondContact O-N 3.43Å
2446	V	81.3	Confident	72.5	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.018	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-22	-174	-171.5	0	0	0	0	110.9	L2341 I2428 L2430 I2444 W2474 L2492 I2560	L2341-V2446 WeakPolarHBondContact CD1-O 3.15Å; I2428-V2446 HydrophobicContact CG2-CB 4.48Å; I2428-V2446 HydrophobicContact CG2-CG2 4.43Å; I2428-V2446 WeakPolarHBondContact O-CB 3.48Å; I2428-V2446 PolarHBondContact O-N 2.79Å; L2430-V2446 HydrophobicContact CB-CG2 4.34Å; L2430-V2446 HydrophobicContact CD1-CG2 3.91Å; L2430-V2446 HydrophobicContact CG-CG2 3.91Å; I2444-V2446 HydrophobicContact CG2-CG2 4.26Å; I2444-V2446 WeakPolarHBondContact O-CG2 3.46Å; I2444-V2446 PolarHBondContact O-N 3.47Å; V2446-W2474 HydrophobicContact CB-CZ2 4.39Å; V2446-W2474 HydrophobicContact CG1-CH2 3.83Å; V2446-W2474 HydrophobicContact CG1-CZ2 3.58Å; V2446-L2492 HydrophobicContact CG1-CD1 4.32Å; V2446-L2492 HydrophobicContact CG1-CD2 4.48Å; V2446-L2492 HydrophobicContact CG2-CD2 4.29Å; V2446-I2560 HydrophobicContact CB-CD1 4.23Å; V2446-I2560 HydrophobicContact CG1-CD1 3.71Å; V2446-I2560 HydrophobicContact CG1-CG1 4.01Å; V2446-I2560 HydrophobicContact CG1-CG2 3.76Å
2447	C	74.9	Confident	71.6	Confident	10 Å²	10	34.9 Å²	34.9	7%	0.068	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-25.1	178.6	-65	0	0	0	0	114.3	H2162 L2427 D2445 V2556	H2162-C2447 PolarHBondContact NE2-O 3.32Å; L2427-C2447 HydrophobicContact CD2-CB 3.75Å; D2445-C2447 PolarHBondContact O-N 3.13Å; D2445-C2447 VanDerWaalsContact O-N 3.1Å; D2445-C2447 WeakPolarHBondContact OD1-CA 3.24Å; D2445-C2447 WeakPolarHBondContact OD1-CB 3.48Å; D2445-C2447 PolarHBondContact OD1-N 2.58Å; C2447-V2556 VanDerWaalsContact SG-CG1 3.54Å
2448	R	76.2	Confident	70.5	Confident	7 Å²	7	36.1 Å²	36.1	3%	0.026	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-135.8	-9.8	-165.6	-53.1	-171.4	-67	170.4	4	117.2	D2102 A2104 L2427 Y2429 D2445	D2102-R2448 IonicContact OD1-CZ 2.71Å; D2102-R2448 IonicContact OD1-NH1 3.54Å; D2102-R2448 PolarHBondContact OD1-NH1 3.48Å; D2102-R2448 VanDerWaalsContact OD1-NH1 3.17Å; D2102-R2448 IonicContact OD2-CZ 3.52Å; D2102-R2448 IonicContact OD2-NH1 3.28Å; D2102-R2448 PolarHBondContact OD2-NH1 3.27Å; A2104-R2448 HydrophobicContact CB-CB 3.66Å; A2104-R2448 HydrophobicContact CB-CG 4.36Å; L2427-R2448 VanDerWaalsContact CD1-CZ 3.45Å; L2427-R2448 VanDerWaalsContact CD1-NH2 3.32Å; L2427-R2448 HydrophobicContact CD2-CG 3.88Å; Y2429-R2448 PolarHBondContact OH-NH2 2.82Å; D2445-R2448 HydrophobicContact CB-CB 4.49Å; D2445-R2448 PolarHBondContact O-N 2.85Å; D2445-R2448 VanDerWaalsContact O-N 3.09Å; D2445-R2448 WeakPolarHBondContact OD1-CB 3.28Å; D2445-R2448 PolarHBondContact OD1-N 3.21Å; D2445-R2448 IonicContact OD1-NE 3.1Å; D2445-R2448 IonicContact OD2-CZ 2.72Å; D2445-R2448 IonicContact OD2-NE 3.59Å; D2445-R2448 PolarHBondContact OD2-NE 3.34Å; D2445-R2448 IonicContact OD2-NH2 2.63Å; D2445-R2448 PolarHBondContact OD2-NH2 2.79Å
2449	D	78.1	Confident	68.7	Low	22 Å²	22	40.8 Å²	40.8	12%	0.118	22%	0.222	C	C	.	.			trans	-52.8	138	-177.2	-166.8	-2	0	0	0	113.2	R2442 I2444 D2445 H2451 V2452 W2474	R2442-D2449 IonicContact CZ-OD2 3.73Å; R2442-D2449 IonicContact NH1-OD1 2.65Å; R2442-D2449 IonicContact NH1-OD2 2.7Å; R2442-D2449 PolarHBondContact NH1-OD2 3.04Å; R2442-D2449 IonicContact NH2-OD2 2.65Å; R2442-D2449 PolarHBondContact NH2-OD2 2.99Å; I2444-D2449 HydrophobicContact CG2-CB 4.47Å; D2445-D2449 WeakPolarHBondContact O-CB 3.25Å; D2445-D2449 PolarHBondContact O-N 3.43Å; D2449-H2451 WeakPolarHBondContact OD1-CB 3.34Å; D2449-H2451 IonicContact OD1-CD2 2.73Å; D2449-H2451 PolarHBondContact OD1-CD2 2.79Å; D2449-H2451 VanDerWaalsContact OD1-CD2 3.31Å; D2449-H2451 IonicContact OD1-CG 2.96Å; D2449-H2451 PolarHBondContact OD1-N 3.38Å; D2449-V2452 HydrophobicContact CB-CG2 4.5Å; D2449-W2474 VanDerWaalsContact OD2-CD1 3.31Å
2450	I	72	Confident	66.5	Low	56 Å²	56	45.4 Å²	45.4	29%	0.287	25%	0.247	S	C	.	.	S	Bend	trans	-89.6	-18.4	177.1	61.8	173.2	0	0	0	112.5	V2452	I2450-V2452 PolarHBondContact O-N 3.16Å
2451	H	79.1	Confident	64.3	Low	31 Å²	31	49.7 Å²	49.7	14%	0.144	28%	0.279	C	S	.	.			trans	-86.6	55.4	-176.4	-56.4	-57.5	0	0	0	112.1	D2449 W2474 V2475	D2449-H2451 WeakPolarHBondContact OD1-CB 3.34Å; D2449-H2451 IonicContact OD1-CD2 2.73Å; D2449-H2451 PolarHBondContact OD1-CD2 2.79Å; D2449-H2451 VanDerWaalsContact OD1-CD2 3.31Å; D2449-H2451 IonicContact OD1-CG 2.96Å; D2449-H2451 PolarHBondContact OD1-N 3.38Å; H2451-W2474 WeakPolarHBondContact O-CA 3.33Å; H2451-V2475 HydrophobicContact CB-CG2 4.3Å; H2451-V2475 WeakPolarHBondContact O-CG2 3.25Å; H2451-V2475 PolarHBondContact O-N 2.78Å
2452	V	76.7	Confident	61.9	Low	18 Å²	18	54.8 Å²	54.8	11%	0.109	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	139.5	-179.2	-176.1	0	0	0	0	109.3	L2338 D2449 I2450 W2472 A2473 W2474 F2564	L2338-V2452 HydrophobicContact CD2-CB 4.03Å; L2338-V2452 HydrophobicContact CD2-CG1 4.32Å; L2338-V2452 WeakPolarHBondContact CD2-O 3.21Å; D2449-V2452 HydrophobicContact CB-CG2 4.5Å; I2450-V2452 PolarHBondContact O-N 3.16Å; V2452-W2472 HydrophobicContact CG1-CB 3.98Å; V2452-W2472 HydrophobicContact CG1-CE3 4.02Å; V2452-A2473 WeakPolarHBondContact CA-O 3.29Å; V2452-W2474 HydrophobicContact CG2-CG 4.16Å; V2452-F2564 HydrophobicContact CG1-CE1 3.94Å
2453	V	69.2	Low	59.5	Low	45 Å²	45	57.9 Å²	57.9	27%	0.273	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	151.6	179.1	-60.7	0	0	0	0	111.6	I2455 W2472 A2473 V2475	V2453-I2455 HydrophobicContact CG2-CG1 4.24Å; V2453-W2472 VanDerWaalsContact C-CE3 3.42Å; V2453-W2472 WeakPolarHBondContact O-CA 3.44Å; V2453-A2473 PolarHBondContact N-O 3.04Å; V2453-A2473 PolarHBondContact O-N 2.65Å; V2453-V2475 HydrophobicContact CG1-CG1 4.24Å; V2453-V2475 HydrophobicContact CG1-CG2 4.09Å; V2453-V2475 HydrophobicContact CG2-CG1 3.69Å
2454	W	65.3	Low	57.1	Low	69 Å²	69	59.3 Å²	59.3	26%	0.261	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	112.8	171.7	-178.7	-114.2	0	0	0	109.5	L2336 Q2468 G2470 W2472	L2336-W2454 HydrophobicContact CD2-CB 4.08Å; L2336-W2454 HydrophobicContact CD2-CG 4.1Å; W2454-Q2468 HydrophobicContact CZ2-CB 4.06Å; W2454-G2470 WeakPolarHBondContact CH2-O 3.48Å; W2454-G2470 VanDerWaalsContact CZ2-CA 3.41Å; W2454-G2470 VanDerWaalsContact CZ3-C 3.41Å; W2454-G2470 WeakPolarHBondContact CZ3-O 3.4Å; W2454-W2472 HydrophobicContact CB-CD2 4.15Å; W2454-W2472 HydrophobicContact CB-CE3 3.82Å; W2454-W2472 HydrophobicContact CB-CH2 3.72Å; W2454-W2472 HydrophobicContact CB-CZ2 3.99Å; W2454-W2472 HydrophobicContact CB-CZ3 3.61Å; W2454-W2472 HydrophobicContact CD2-CD2 4.45Å; W2454-W2472 HydrophobicContact CD2-CZ2 4.23Å; W2454-W2472 AromaticContact CE3-CD1 3.41Å; W2454-W2472 VanDerWaalsContact CE3-CD1 3.41Å; W2454-W2472 AromaticContact CE3-CD2 3.66Å; W2454-W2472 HydrophobicContact CE3-CD2 3.66Å; W2454-W2472 AromaticContact CE3-CE2 3.33Å; W2454-W2472 HydrophobicContact CE3-CE3 4.49Å; W2454-W2472 AromaticContact CE3-CG 3.7Å; W2454-W2472 HydrophobicContact CE3-CG 3.7Å; W2454-W2472 AromaticContact CE3-CZ2 3.98Å; W2454-W2472 HydrophobicContact CE3-CZ2 3.98Å; W2454-W2472 AromaticContact CE3-NE1 3.11Å; W2454-W2472 HydrophobicContact CG-CH2 4.49Å; W2454-W2472 HydrophobicContact CG-CZ2 4.32Å; W2454-W2472 AromaticContact CZ3-CD1 3.41Å; W2454-W2472 VanDerWaalsContact CZ3-CD1 3.41Å; W2454-W2472 HydrophobicContact CZ3-CD2 4.43Å; W2454-W2472 AromaticContact CZ3-CE2 3.92Å; W2454-W2472 HydrophobicContact CZ3-CG 4.13Å; W2454-W2472 AromaticContact CZ3-NE1 3.2Å
2455	I	61.3	Low	54.6	Low	56 Å²	56	66.5 Å²	66.5	29%	0.287	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	108.7	171.9	-56.5	179.8	0	0	0	106.9	V2453 G2470 C2471 A2473 V2482	V2453-I2455 HydrophobicContact CG2-CG1 4.24Å; I2455-G2470 CarbonylContact O-C 3.48Å; I2455-G2470 WeakPolarHBondContact O-CA 3.32Å; I2455-C2471 PolarHBondContact N-O 2.77Å; I2455-C2471 PolarHBondContact O-N 2.87Å; I2455-A2473 HydrophobicContact CD1-CB 3.68Å; I2455-A2473 HydrophobicContact CG1-CB 4.3Å; I2455-V2482 HydrophobicContact CD1-CB 4.43Å; I2455-V2482 HydrophobicContact CD1-CG1 3.76Å; I2455-V2482 HydrophobicContact CD1-CG2 3.82Å
2456	M	51.3	Low	52.1	Low	126 Å²	126	69.9 Å²	69.9	62%	0.621	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	130.1	168.5	-64	179.6	66.4	0	0	108.7	M2459	M2456-M2459 HydrophobicContact CE-CE 4.24Å
2457	A	46	Very low	49.8	Very low	54 Å²	54	79.6 Å²	79.6	45%	0.446	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-64.5	152	165.4	0	0	0	0	0	109.3	S2469	A2457-S2469 WeakPolarHBondContact CB-O 3.5Å; A2457-S2469 PolarHBondContact N-O 3.04Å
2458	S	39.6	Very low	48	Very low	91 Å²	91	86.9 Å²	86.9	64%	0.636	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-58.2	143.6	176	54.9	0	0	0	0	110.6	D2460	S2458-D2460 VanDerWaalsContact CB-OD2 3.3Å; S2458-D2460 WeakPolarHBondContact CB-OD2 3.37Å; S2458-D2460 PolarHBondContact O-N 2.83Å; S2458-D2460 PolarHBondContact OG-OD2 3.43Å
2459	M	28	Very low	46.4	Very low	141 Å²	141	91.4 Å²	91.4	70%	0.695	49%	0.489	S	S	*	.			trans	-75.8	49.5	-174.3	-78.8	-164.7	159.8	0	0	113.6	M2456 S2461 M2462	M2456-M2459 HydrophobicContact CE-CE 4.24Å; M2459-S2461 PolarHBondContact O-N 3.19Å; M2459-S2461 VanDerWaalsContact O-N 3.16Å; M2459-M2462 HydrophobicContact SD-CE 3.98Å
2460	D	28.7	Very low	45.4	Very low	122 Å²	122	91.4 Å²	91.4	65%	0.652	49%	0.494	S	S	*	.			trans	-84.3	32.2	178.6	-69	-66.5	0	0	0	113.5	S2458	S2458-D2460 VanDerWaalsContact CB-OD2 3.3Å; S2458-D2460 WeakPolarHBondContact CB-OD2 3.37Å; S2458-D2460 PolarHBondContact O-N 2.83Å; S2458-D2460 PolarHBondContact OG-OD2 3.43Å
2461	S	27.8	Very low	45.2	Very low	106 Å²	106	90.4 Å²	90.4	74%	0.741	49%	0.491	S	S	*	.			trans	-163.4	73.8	167.4	59.6	0	0	0	0	113.6	M2459	M2459-S2461 PolarHBondContact O-N 3.19Å; M2459-S2461 VanDerWaalsContact O-N 3.16Å
2462	M	25.7	Very low	44.9	Very low	144 Å²	144	90.1 Å²	90.1	71%	0.709	49%	0.489	S	S	*	.			trans	-61.6	137.7	153.1	-75.6	-70.5	155.1	0	0	109	M2459	M2459-M2462 HydrophobicContact SD-CE 3.98Å
2463	H	26.7	Very low	44.7	Very low	77 Å²	77	89.3 Å²	89.3	36%	0.356	48%	0.484	S	S	.	.	S	Bend	trans	97.1	53.3	-173.1	-53	-63	0	0	0	118.2	E1132	E1132-H2463 HydrophobicContact CG-CB 4.09Å; E1132-H2463 IonicContact OE1-CD2 3.26Å; E1132-H2463 IonicContact OE2-CD2 3.71Å
2464	A	27.7	Very low	45.4	Very low	53 Å²	53	87.3 Å²	87.3	44%	0.438	47%	0.471	S	S	.	.			trans	-160.9	113.3	139.8	0	0	0	0	0	110.4	T2466	A2464-T2466 VanDerWaalsContact C-N 3.26Å; A2464-T2466 PolarHBondContact O-N 3.21Å
2465	E	29.7	Very low	46.2	Very low	152 Å²	152	84.2 Å²	84.2	71%	0.71	46%	0.46	S	S	*	.			trans	-74.1	70.2	172.3	-70.7	-161.3	136.3	0	0	112
2466	T	29.4	Very low	47	Very low	84 Å²	84	81.6 Å²	81.6	52%	0.515	45%	0.447	S	S	.	.	S	Bend	trans	-164.6	135.3	160.7	-0.9	0	0	0	0	113.9	A2464	A2464-T2466 VanDerWaalsContact C-N 3.26Å; A2464-T2466 PolarHBondContact O-N 3.21Å
2467	R	31.5	Very low	48.1	Very low	208 Å²	208	76.7 Å²	76.7	79%	0.785	43%	0.425	S	S	*	.			trans	70.1	123.9	173.1	-52.4	-176.5	-170.9	-174	5.6	115.4	S2469	R2467-S2469 PolarHBondContact O-N 2.99Å; R2467-S2469 VanDerWaalsContact O-N 3.14Å
2468	Q	37.8	Very low	49.2	Very low	162 Å²	162	80 Å²	80	76%	0.757	43%	0.43	S	S	*	.			trans	-69.2	105	178	-64.4	151.7	-34.2	0	0	109.5	W2454 G2470	W2454-Q2468 HydrophobicContact CZ2-CB 4.06Å; Q2468-G2470 PolarHBondContact O-N 3.49Å
2469	S	43.9	Very low	50.5	Low	103 Å²	103	77.7 Å²	77.7	72%	0.72	41%	0.414	S	S	*	.			trans	-82.2	84.2	179.4	-158.2	0	0	0	0	111	A2457 R2467	A2457-S2469 WeakPolarHBondContact CB-O 3.5Å; A2457-S2469 PolarHBondContact N-O 3.04Å; R2467-S2469 PolarHBondContact O-N 2.99Å; R2467-S2469 VanDerWaalsContact O-N 3.14Å
2470	G	56.3	Low	52.7	Low	22 Å²	22	78.1 Å²	78.1	23%	0.227	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	-179.3	165.3	0	0	0	0	0	109.7	W2454 I2455 Q2468	W2454-G2470 WeakPolarHBondContact CH2-O 3.48Å; W2454-G2470 VanDerWaalsContact CZ2-CA 3.41Å; W2454-G2470 VanDerWaalsContact CZ3-C 3.41Å; W2454-G2470 WeakPolarHBondContact CZ3-O 3.4Å; I2455-G2470 CarbonylContact O-C 3.48Å; I2455-G2470 WeakPolarHBondContact O-CA 3.32Å; Q2468-G2470 PolarHBondContact O-N 3.49Å
2471	C	66.6	Low	54.8	Low	34 Å²	34	73 Å²	73	23%	0.23	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.1	173.8	61.6	0	0	0	0	111.3	I2455	I2455-C2471 PolarHBondContact N-O 2.77Å; I2455-C2471 PolarHBondContact O-N 2.87Å
2472	W	72.8	Confident	56.9	Low	26 Å²	26	69.2 Å²	69.2	10%	0.098	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	138.2	172.5	-63.8	95.3	0	0	0	109.6	L2336 L2338 P2339 V2452 V2453 W2454 F2564	L2336-W2472 HydrophobicContact CD2-CH2 4.2Å; L2338-W2472 HydrophobicContact CB-CH2 4.47Å; L2338-W2472 HydrophobicContact CB-CZ3 4.45Å; L2338-W2472 HydrophobicContact CD2-CE3 3.81Å; L2338-W2472 HydrophobicContact CD2-CH2 4.14Å; L2338-W2472 HydrophobicContact CD2-CZ3 3.36Å; L2338-W2472 HydrophobicContact CG-CH2 4.06Å; L2338-W2472 HydrophobicContact CG-CZ3 3.79Å; P2339-W2472 VanDerWaalsContact CD-NE1 3.28Å; P2339-W2472 VanDerWaalsContact CG-CD1 3.42Å; P2339-W2472 HydrophobicContact CG-CD2 4.09Å; P2339-W2472 HydrophobicContact CG-CG 3.96Å; P2339-W2472 HydrophobicContact CG-CZ2 4.35Å; P2339-W2472 VanDerWaalsContact CG-NE1 3.26Å; V2452-W2472 HydrophobicContact CG1-CB 3.98Å; V2452-W2472 HydrophobicContact CG1-CE3 4.02Å; V2453-W2472 VanDerWaalsContact C-CE3 3.42Å; V2453-W2472 WeakPolarHBondContact O-CA 3.44Å; W2454-W2472 HydrophobicContact CB-CD2 4.15Å; W2454-W2472 HydrophobicContact CB-CE3 3.82Å; W2454-W2472 HydrophobicContact CB-CH2 3.72Å; W2454-W2472 HydrophobicContact CB-CZ2 3.99Å; W2454-W2472 HydrophobicContact CB-CZ3 3.61Å; W2454-W2472 HydrophobicContact CD2-CD2 4.45Å; W2454-W2472 HydrophobicContact CD2-CZ2 4.23Å; W2454-W2472 AromaticContact CE3-CD1 3.41Å; W2454-W2472 VanDerWaalsContact CE3-CD1 3.41Å; W2454-W2472 AromaticContact CE3-CD2 3.66Å; W2454-W2472 HydrophobicContact CE3-CD2 3.66Å; W2454-W2472 AromaticContact CE3-CE2 3.33Å; W2454-W2472 HydrophobicContact CE3-CE3 4.49Å; W2454-W2472 AromaticContact CE3-CG 3.7Å; W2454-W2472 HydrophobicContact CE3-CG 3.7Å; W2454-W2472 AromaticContact CE3-CZ2 3.98Å; W2454-W2472 HydrophobicContact CE3-CZ2 3.98Å; W2454-W2472 AromaticContact CE3-NE1 3.11Å; W2454-W2472 HydrophobicContact CG-CH2 4.49Å; W2454-W2472 HydrophobicContact CG-CZ2 4.32Å; W2454-W2472 AromaticContact CZ3-CD1 3.41Å; W2454-W2472 VanDerWaalsContact CZ3-CD1 3.41Å; W2454-W2472 HydrophobicContact CZ3-CD2 4.43Å; W2454-W2472 AromaticContact CZ3-CE2 3.92Å; W2454-W2472 HydrophobicContact CZ3-CG 4.13Å; W2454-W2472 AromaticContact CZ3-NE1 3.2Å; W2472-F2564 HydrophobicContact CB-CD1 3.8Å; W2472-F2564 HydrophobicContact CB-CE1 3.81Å
2473	A	73.1	Confident	59.4	Low	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	143	178.3	0	0	0	0	0	110.8	V2452 V2453 I2455 V2482 R2485	V2452-A2473 WeakPolarHBondContact CA-O 3.29Å; V2453-A2473 PolarHBondContact N-O 3.04Å; V2453-A2473 PolarHBondContact O-N 2.65Å; I2455-A2473 HydrophobicContact CD1-CB 3.68Å; I2455-A2473 HydrophobicContact CG1-CB 4.3Å; A2473-V2482 HydrophobicContact CB-CG1 3.7Å; A2473-R2485 HydrophobicContact CB-CG 4.18Å
2474	W	84.3	Confident	61.5	Low	3 Å²	3	61.2 Å²	61.2	1%	0.011	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	143.5	173.8	-68.5	-95	0	0	0	110.8	I2444 V2446 D2449 H2451 V2452 V2482 Y2483 L2488 F2564 F2566	I2444-W2474 HydrophobicContact CG2-CG 4.29Å; V2446-W2474 HydrophobicContact CB-CZ2 4.39Å; V2446-W2474 HydrophobicContact CG1-CH2 3.83Å; V2446-W2474 HydrophobicContact CG1-CZ2 3.58Å; D2449-W2474 VanDerWaalsContact OD2-CD1 3.31Å; H2451-W2474 WeakPolarHBondContact O-CA 3.33Å; V2452-W2474 HydrophobicContact CG2-CG 4.16Å; W2474-V2482 WeakPolarHBondContact O-CA 3.24Å; W2474-Y2483 HydrophobicContact CB-CD2 3.89Å; W2474-Y2483 PolarHBondContact O-N 2.96Å; W2474-L2488 HydrophobicContact CB-CD1 4.38Å; W2474-L2488 HydrophobicContact CD2-CD1 4.16Å; W2474-L2488 HydrophobicContact CE3-CD1 3.47Å; W2474-L2488 VanDerWaalsContact CE3-CD1 3.47Å; W2474-L2488 HydrophobicContact CZ3-CD1 4.13Å; W2474-F2564 HydrophobicContact CD2-CE1 4.41Å; W2474-F2564 HydrophobicContact CE3-CD1 4.16Å; W2474-F2564 HydrophobicContact CE3-CE1 4.23Å; W2474-F2564 HydrophobicContact CH2-CB 4.3Å; W2474-F2564 AromaticContact CH2-CD1 3.22Å; W2474-F2564 HydrophobicContact CH2-CD1 3.22Å; W2474-F2564 AromaticContact CH2-CD2 3.75Å; W2474-F2564 HydrophobicContact CH2-CD2 3.75Å; W2474-F2564 AromaticContact CH2-CE1 3.27Å; W2474-F2564 HydrophobicContact CH2-CE1 3.27Å; W2474-F2564 AromaticContact CH2-CE2 3.81Å; W2474-F2564 HydrophobicContact CH2-CE2 3.81Å; W2474-F2564 AromaticContact CH2-CG 3.46Å; W2474-F2564 HydrophobicContact CH2-CG 3.46Å; W2474-F2564 VanDerWaalsContact CH2-CG 3.46Å; W2474-F2564 AromaticContact CH2-CZ 3.58Å; W2474-F2564 HydrophobicContact CH2-CZ 3.58Å; W2474-F2564 AromaticContact CZ2-CD1 3.92Å; W2474-F2564 HydrophobicContact CZ2-CD1 3.92Å; W2474-F2564 HydrophobicContact CZ2-CD2 4.36Å; W2474-F2564 AromaticContact CZ2-CE1 3.43Å; W2474-F2564 HydrophobicContact CZ2-CE1 3.43Å; W2474-F2564 VanDerWaalsContact CZ2-CE1 3.43Å; W2474-F2564 AromaticContact CZ2-CE2 3.95Å; W2474-F2564 HydrophobicContact CZ2-CE2 3.95Å; W2474-F2564 HydrophobicContact CZ2-CG 4.35Å; W2474-F2564 AromaticContact CZ2-CZ 3.45Å; W2474-F2564 HydrophobicContact CZ2-CZ 3.45Å; W2474-F2564 VanDerWaalsContact CZ2-CZ 3.45Å; W2474-F2564 HydrophobicContact CZ3-CB 4.37Å; W2474-F2564 AromaticContact CZ3-CD1 3.36Å; W2474-F2564 HydrophobicContact CZ3-CD1 3.36Å; W2474-F2564 AromaticContact CZ3-CE1 3.7Å; W2474-F2564 HydrophobicContact CZ3-CE1 3.7Å; W2474-F2564 AromaticContact CZ3-CG 3.85Å; W2474-F2564 HydrophobicContact CZ3-CG 3.85Å; W2474-F2564 HydrophobicContact CZ3-CZ 4.44Å; W2474-F2566 HydrophobicContact CH2-CE2 4.17Å; W2474-F2566 AromaticContact CZ3-CE2 3.77Å; W2474-F2566 HydrophobicContact CZ3-CE2 3.77Å; W2474-F2566 AromaticContact CZ3-CZ 3.85Å; W2474-F2566 HydrophobicContact CZ3-CZ 3.85Å
2475	V	81.2	Confident	64	Low	5 Å²	5	61.6 Å²	61.6	3%	0.03	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-116.4	152.2	170.7	-72.3	0	0	0	0	110.7	R2442 H2451 V2453 R2480 T2481 V2482 Y2483	R2442-V2475 PolarHBondContact NH2-O 3.36Å; R2442-V2475 VanDerWaalsContact NH2-O 3.15Å; H2451-V2475 HydrophobicContact CB-CG2 4.3Å; H2451-V2475 WeakPolarHBondContact O-CG2 3.25Å; H2451-V2475 PolarHBondContact O-N 2.78Å; V2453-V2475 HydrophobicContact CG1-CG1 4.24Å; V2453-V2475 HydrophobicContact CG1-CG2 4.09Å; V2453-V2475 HydrophobicContact CG2-CG1 3.69Å; V2475-R2480 WeakPolarHBondContact CG1-O 3.28Å; V2475-T2481 WeakPolarHBondContact CA-O 3.24Å; V2475-V2482 HydrophobicContact CG1-CG2 3.92Å; V2475-Y2483 VanDerWaalsContact C-CE2 3.45Å; V2475-Y2483 WeakPolarHBondContact O-CE2 3.41Å
2476	C	79.7	Confident	66	Low	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.306	C	S	.	.			trans	-66.8	130.6	167.8	179.4	0	0	0	0	109.6	C2435 H2478 R2480 T2481 Y2483	C2435-C2476 HydrophobicContact CB-CB 3.95Å; C2435-C2476 VanDerWaalsContact SG-CB 3.51Å; C2476-H2478 VanDerWaalsContact C-N 3.3Å; C2476-H2478 PolarHBondContact O-N 3.12Å; C2476-R2480 WeakPolarHBondContact O-CA 3.42Å; C2476-R2480 PolarHBondContact O-N 2.84Å; C2476-T2481 PolarHBondContact N-O 2.99Å; C2476-Y2483 HydrophobicContact CB-CE2 4.16Å
2477	P	73.8	Confident	68	Low	24 Å²	24	61.6 Å²	61.6	16%	0.156	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-39.7	176.7	22.7	-32.4	0	0	0	112.4	F2440 R2480	F2440-P2477 HydrophobicContact CD1-CG 3.84Å; F2440-P2477 HydrophobicContact CE1-CG 3.48Å; F2440-P2477 VanDerWaalsContact CE1-CG 3.48Å; P2477-R2480 PolarHBondContact O-NE 3.26Å
2478	H	69.3	Low	70.4	Confident	122 Å²	122	52 Å²	52	57%	0.565	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-57.2	-175	-170.2	-60.5	0	0	0	113	F2440 C2476	F2440-H2478 HydrophobicContact CB-CB 4.45Å; C2476-H2478 VanDerWaalsContact C-N 3.3Å; C2476-H2478 PolarHBondContact O-N 3.12Å
2479	C	67.4	Low	72.7	Confident	43 Å²	43	45.8 Å²	45.8	29%	0.291	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-1.2	-174.9	69.3	0	0	0	0	115.1	C2435 C2438 T2481	C2435-C2479 PolarHBondContact SG-SG 2.98Å; C2438-C2479 HydrophobicContact CB-CB 4.15Å; C2438-C2479 PolarHBondContact SG-SG 2.88Å; C2479-T2481 PolarHBondContact O-N 3.22Å; C2479-T2481 PolarHBondContact SG-OG1 3.13Å; C2479-T2481 VanDerWaalsContact SG-OG1 3.39Å
2480	R	73.5	Confident	74.4	Confident	151 Å²	151	45.3 Å²	45.3	57%	0.57	23%	0.227	S	C	*	.			trans	57.7	4.8	-177.1	-57.5	-64.3	176.3	129.8	2.6	116.8	V2475 C2476 P2477 V2482	V2475-R2480 WeakPolarHBondContact CG1-O 3.28Å; C2476-R2480 WeakPolarHBondContact O-CA 3.42Å; C2476-R2480 PolarHBondContact O-N 2.84Å; P2477-R2480 PolarHBondContact O-NE 3.26Å; R2480-V2482 PolarHBondContact O-N 2.97Å
2481	T	72.3	Confident	75.5	Confident	14 Å²	14	45.8 Å²	45.8	9%	0.086	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-56	134.5	167.9	-55.4	0	0	0	0	110.8	P1824 T2437 V2475 C2476 C2479	P1824-T2481 HydrophobicContact CG-CG2 4.09Å; T2437-T2481 WeakPolarHBondContact CB-OG1 3.33Å; T2437-T2481 WeakPolarHBondContact OG1-CG2 3.39Å; T2437-T2481 PolarHBondContact OG1-OG1 2.81Å; V2475-T2481 WeakPolarHBondContact CA-O 3.24Å; C2476-T2481 PolarHBondContact N-O 2.99Å; C2479-T2481 PolarHBondContact O-N 3.22Å; C2479-T2481 PolarHBondContact SG-OG1 3.13Å; C2479-T2481 VanDerWaalsContact SG-OG1 3.39Å
2482	V	73.1	Confident	76.4	Confident	26 Å²	26	44.1 Å²	44.1	16%	0.158	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-67.7	128.3	173.3	179.5	0	0	0	0	109.9	V1827 I2455 A2473 W2474 V2475 R2480	V1827-V2482 HydrophobicContact CG2-CG2 3.8Å; I2455-V2482 HydrophobicContact CD1-CB 4.43Å; I2455-V2482 HydrophobicContact CD1-CG1 3.76Å; I2455-V2482 HydrophobicContact CD1-CG2 3.82Å; A2473-V2482 HydrophobicContact CB-CG1 3.7Å; W2474-V2482 WeakPolarHBondContact O-CA 3.24Å; V2475-V2482 HydrophobicContact CG1-CG2 3.92Å; R2480-V2482 PolarHBondContact O-N 2.97Å
2483	Y	78.3	Confident	76.9	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.008	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-67.9	136.7	172.5	-74.1	-88.2	0	0	0	110	V2433 C2435 R2442 I2444 W2474 V2475 C2476 R2485	V2433-Y2483 HydrophobicContact CB-CE1 4.32Å; V2433-Y2483 HydrophobicContact CG1-CD1 3.72Å; V2433-Y2483 HydrophobicContact CG1-CE1 3.62Å; C2435-Y2483 HydrophobicContact CB-CE1 4.16Å; R2442-Y2483 PolarHBondContact NE-OH 3.14Å; I2444-Y2483 HydrophobicContact CD1-CD2 4.34Å; I2444-Y2483 HydrophobicContact CD1-CE2 4.16Å; W2474-Y2483 HydrophobicContact CB-CD2 3.89Å; W2474-Y2483 PolarHBondContact O-N 2.96Å; V2475-Y2483 VanDerWaalsContact C-CE2 3.45Å; V2475-Y2483 WeakPolarHBondContact O-CE2 3.41Å; C2476-Y2483 HydrophobicContact CB-CE2 4.16Å; Y2483-R2485 PolarHBondContact O-N 3.28Å
2484	P	70.5	Confident	77	Confident	52 Å²	52	47.1 Å²	47.1	34%	0.338	23%	0.233	S	C	.	.			trans	-61.2	112.7	-177.5	-23.7	34.4	0	0	0	111.6	P2436 D2486 K2487 L2488	P2436-P2484 HydrophobicContact CG-CG 4.25Å; P2484-D2486 VanDerWaalsContact C-N 3.28Å; P2484-D2486 PolarHBondContact O-N 2.99Å; P2484-K2487 HydrophobicContact CB-CB 4.31Å; P2484-K2487 HydrophobicContact CB-CD 4.34Å; P2484-K2487 HydrophobicContact CB-CG 4.17Å; P2484-K2487 HydrophobicContact CG-CD 4.44Å; P2484-K2487 PolarHBondContact O-N 2.72Å; P2484-K2487 VanDerWaalsContact O-N 3.08Å; P2484-L2488 PolarHBondContact O-N 2.84Å
2485	R	79.1	Confident	76.7	Confident	60 Å²	60	47.4 Å²	47.4	23%	0.226	23%	0.234	C	C	.	.	H	α-helix	trans	-50.8	-47.3	-175.6	-78	-177.4	71.7	-105	-0.4	112	A2473 Y2483 K2487 L2488 E2489 F2564 G2565 F2566	A2473-R2485 HydrophobicContact CB-CG 4.18Å; Y2483-R2485 PolarHBondContact O-N 3.28Å; R2485-K2487 VanDerWaalsContact C-N 3.3Å; R2485-K2487 PolarHBondContact O-N 3.27Å; R2485-L2488 WeakPolarHBondContact O-CB 3.49Å; R2485-L2488 PolarHBondContact O-N 3.11Å; R2485-E2489 PolarHBondContact O-N 3.47Å; R2485-F2564 PolarHBondContact NH2-O 3.13Å; R2485-G2565 PolarHBondContact NH2-O 3.38Å; R2485-F2566 HydrophobicContact CB-CE1 4.03Å; R2485-F2566 HydrophobicContact CG-CE1 4.48Å; R2485-F2566 WeakPolarHBondContact O-CE1 3.48Å
2486	D	72.9	Confident	76.8	Confident	124 Å²	124	47.1 Å²	47.1	66%	0.663	23%	0.233	S	C	*	.	H	α-helix	trans	-60.8	-37.3	-176.9	-36.7	-20.2	0	0	0	112.1	P2484 E2489 E2490	P2484-D2486 VanDerWaalsContact C-N 3.28Å; P2484-D2486 PolarHBondContact O-N 2.99Å; D2486-E2489 PolarHBondContact O-N 3.16Å; D2486-E2490 WeakPolarHBondContact O-CB 3.46Å; D2486-E2490 PolarHBondContact O-N 3.03Å
2487	K	71.3	Confident	76.7	Confident	113 Å²	113	51.7 Å²	51.7	49%	0.491	25%	0.254	S	S	.	.	H	α-helix	trans	-71.9	-30.6	175.9	-68.2	-168.3	175.8	-169.1	0	112.8	P2484 R2485 A2491	P2484-K2487 HydrophobicContact CB-CB 4.31Å; P2484-K2487 HydrophobicContact CB-CD 4.34Å; P2484-K2487 HydrophobicContact CB-CG 4.17Å; P2484-K2487 HydrophobicContact CG-CD 4.44Å; P2484-K2487 PolarHBondContact O-N 2.72Å; P2484-K2487 VanDerWaalsContact O-N 3.08Å; R2485-K2487 VanDerWaalsContact C-N 3.3Å; R2485-K2487 PolarHBondContact O-N 3.27Å; K2487-A2491 VanDerWaalsContact O-CB 3.31Å; K2487-A2491 WeakPolarHBondContact O-CB 3.13Å; K2487-A2491 PolarHBondContact O-N 3.08Å
2488	L	81.7	Confident	76.6	Confident	7 Å²	7	52.1 Å²	52.1	4%	0.037	25%	0.254	C	S	.	.	H	α-helix	trans	-73.6	-38.3	175.1	-61.7	176.8	0	0	0	111	L2430 V2433 W2474 P2484 R2485 L2492 F2566	L2430-L2488 HydrophobicContact CD1-CB 4.49Å; L2430-L2488 HydrophobicContact CD1-CD2 3.85Å; V2433-L2488 HydrophobicContact CG1-CD2 4.07Å; W2474-L2488 HydrophobicContact CB-CD1 4.38Å; W2474-L2488 HydrophobicContact CD2-CD1 4.16Å; W2474-L2488 HydrophobicContact CE3-CD1 3.47Å; W2474-L2488 VanDerWaalsContact CE3-CD1 3.47Å; W2474-L2488 HydrophobicContact CZ3-CD1 4.13Å; P2484-L2488 PolarHBondContact O-N 2.84Å; R2485-L2488 WeakPolarHBondContact O-CB 3.49Å; R2485-L2488 PolarHBondContact O-N 3.11Å; L2488-L2492 WeakPolarHBondContact O-CB 3.2Å; L2488-L2492 WeakPolarHBondContact O-CD1 3.22Å; L2488-L2492 VanDerWaalsContact O-CG 3.29Å; L2488-L2492 WeakPolarHBondContact O-CG 3.28Å; L2488-L2492 PolarHBondContact O-N 3.38Å; L2488-F2566 HydrophobicContact CB-CZ 4.06Å
2489	E	86.5	Confident	76.8	Confident	31 Å²	31	47.1 Å²	47.1	15%	0.145	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-46.6	171.9	-177.4	159.9	-156.8	0	0	111.7	R2485 D2486 A2491 L2492 V2493 F2566 E2567 Y2568 L2569	R2485-E2489 PolarHBondContact O-N 3.47Å; D2486-E2489 PolarHBondContact O-N 3.16Å; E2489-A2491 PolarHBondContact O-N 2.78Å; E2489-L2492 PolarHBondContact O-N 2.77Å; E2489-V2493 WeakPolarHBondContact O-CB 3.32Å; E2489-V2493 WeakPolarHBondContact O-CG2 3.26Å; E2489-V2493 PolarHBondContact O-N 2.72Å; E2489-F2566 HydrophobicContact CB-CB 4.34Å; E2489-F2566 HydrophobicContact CB-CD1 3.7Å; E2489-F2566 HydrophobicContact CB-CD2 4.46Å; E2489-F2566 HydrophobicContact CB-CE1 4Å; E2489-F2566 HydrophobicContact CB-CG 3.95Å; E2489-F2566 VanDerWaalsContact CD-CB 3.42Å; E2489-F2566 HydrophobicContact CG-CB 3.95Å; E2489-F2566 HydrophobicContact CG-CD1 4.19Å; E2489-F2566 HydrophobicContact CG-CG 4.13Å; E2489-F2566 WeakPolarHBondContact OE1-CA 3.44Å; E2489-F2566 WeakPolarHBondContact OE1-CB 3.49Å; E2489-F2566 WeakPolarHBondContact OE2-CA 3.38Å; E2489-F2566 WeakPolarHBondContact OE2-CD1 3.47Å; E2489-E2567 PolarHBondContact OE1-N 2.81Å; E2489-Y2568 WeakPolarHBondContact OE1-CA 3.18Å; E2489-Y2568 VanDerWaalsContact OE1-CB 3.29Å; E2489-Y2568 WeakPolarHBondContact OE1-CB 3.38Å; E2489-Y2568 PolarHBondContact OE1-N 3.28Å; E2489-L2569 HydrophobicContact CG-CB 4.26Å; E2489-L2569 PolarHBondContact OE1-N 2.84Å
2490	E	78.5	Confident	77.2	Confident	92 Å²	92	45.7 Å²	45.7	43%	0.43	22%	0.221	S	C	.	.	H	α-helix	trans	-55.5	-49.2	174.8	-175.3	-175.1	177.9	0	0	111.3	D2486 V2493 Q2494	D2486-E2490 WeakPolarHBondContact O-CB 3.46Å; D2486-E2490 PolarHBondContact O-N 3.03Å; E2490-V2493 PolarHBondContact O-N 3.38Å; E2490-Q2494 WeakPolarHBondContact O-CG 3.21Å; E2490-Q2494 PolarHBondContact O-N 3.42Å; E2490-Q2494 PolarHBondContact OE1-NE2 2.7Å
2491	A	78.7	Confident	77.1	Confident	32 Å²	32	41.1 Å²	41.1	26%	0.264	21%	0.208	S	C	.	.	H	α-helix	trans	-62.4	-48.7	177.9	0	0	0	0	0	111.9	L2430 K2487 E2489 V2493 Q2494 Q2495	L2430-A2491 HydrophobicContact CD2-CB 3.58Å; K2487-A2491 VanDerWaalsContact O-CB 3.31Å; K2487-A2491 WeakPolarHBondContact O-CB 3.13Å; K2487-A2491 PolarHBondContact O-N 3.08Å; E2489-A2491 PolarHBondContact O-N 2.78Å; A2491-V2493 VanDerWaalsContact C-N 3.28Å; A2491-V2493 PolarHBondContact O-N 2.75Å; A2491-Q2494 WeakPolarHBondContact O-CB 3.49Å; A2491-Q2494 PolarHBondContact O-N 3.39Å; A2491-Q2495 WeakPolarHBondContact O-CG 3.39Å; A2491-Q2495 PolarHBondContact O-N 3.09Å
2492	L	85.7	Confident	76.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.8	-36	178.4	-79.7	163.9	0	0	0	112.9	I2428 L2430 V2446 L2488 E2489 L2496 Y2557 I2560 F2566 L2569	I2428-L2492 HydrophobicContact CG2-CD2 3.81Å; L2430-L2492 HydrophobicContact CD1-CD1 4.37Å; L2430-L2492 HydrophobicContact CD1-CD2 4.4Å; L2430-L2492 HydrophobicContact CD1-CG 4.05Å; L2430-L2492 HydrophobicContact CD2-CD2 4.3Å; L2430-L2492 HydrophobicContact CD2-CG 4.14Å; L2430-L2492 HydrophobicContact CG-CD2 4.16Å; L2430-L2492 HydrophobicContact CG-CG 4.22Å; V2446-L2492 HydrophobicContact CG1-CD1 4.32Å; V2446-L2492 HydrophobicContact CG1-CD2 4.48Å; V2446-L2492 HydrophobicContact CG2-CD2 4.29Å; L2488-L2492 WeakPolarHBondContact O-CB 3.2Å; L2488-L2492 WeakPolarHBondContact O-CD1 3.22Å; L2488-L2492 VanDerWaalsContact O-CG 3.29Å; L2488-L2492 WeakPolarHBondContact O-CG 3.28Å; L2488-L2492 PolarHBondContact O-N 3.38Å; E2489-L2492 PolarHBondContact O-N 2.77Å; L2492-L2496 WeakPolarHBondContact O-CB 2.92Å; L2492-L2496 PolarHBondContact O-N 2.71Å; L2492-Y2557 HydrophobicContact CD2-CD1 4.34Å; L2492-Y2557 HydrophobicContact CD2-CE1 3.97Å; L2492-I2560 HydrophobicContact CD1-CG2 3.9Å; L2492-F2566 HydrophobicContact CD1-CD2 4.18Å; L2492-F2566 HydrophobicContact CD1-CE2 3.92Å; L2492-L2569 HydrophobicContact CB-CD1 3.82Å; L2492-L2569 HydrophobicContact CB-CD2 3.71Å; L2492-L2569 HydrophobicContact CB-CG 4.39Å; L2492-L2569 HydrophobicContact CD1-CD2 3.75Å; L2492-L2569 HydrophobicContact CG-CD2 4.23Å
2493	V	84.2	Confident	76.7	Confident	9 Å²	9	41.5 Å²	41.5	6%	0.055	21%	0.207	C	C	.	.	H	α-helix	trans	-67.8	-42.8	173.4	167.8	0	0	0	0	110.9	E2489 E2490 A2491 Q2495 L2496 E2497 Y2568 L2569 I2572	E2489-V2493 WeakPolarHBondContact O-CB 3.32Å; E2489-V2493 WeakPolarHBondContact O-CG2 3.26Å; E2489-V2493 PolarHBondContact O-N 2.72Å; E2490-V2493 PolarHBondContact O-N 3.38Å; A2491-V2493 VanDerWaalsContact C-N 3.28Å; A2491-V2493 PolarHBondContact O-N 2.75Å; V2493-Q2495 PolarHBondContact O-N 3.07Å; V2493-L2496 WeakPolarHBondContact O-CB 3.2Å; V2493-L2496 PolarHBondContact O-N 2.93Å; V2493-E2497 HydrophobicContact CG1-CG 4.44Å; V2493-E2497 WeakPolarHBondContact O-CG 3.43Å; V2493-E2497 PolarHBondContact O-N 2.76Å; V2493-Y2568 HydrophobicContact CG1-CD1 4.43Å; V2493-Y2568 HydrophobicContact CG1-CE1 4.09Å; V2493-Y2568 HydrophobicContact CG2-CD1 3.96Å; V2493-Y2568 HydrophobicContact CG2-CE1 4.44Å; V2493-L2569 HydrophobicContact CG2-CB 4.2Å; V2493-L2569 HydrophobicContact CG2-CD1 3.83Å; V2493-I2572 HydrophobicContact CG1-CD1 3.53Å; V2493-I2572 HydrophobicContact CG2-CD1 4.21Å
2494	Q	75.1	Confident	76.3	Confident	79 Å²	79	45.4 Å²	45.4	37%	0.369	23%	0.233	S	C	.	.	H	α-helix	trans	-62.4	-39.4	174.8	-69.9	174.9	20.7	0	0	112.2	E2490 A2491 L2496 Q2498	E2490-Q2494 WeakPolarHBondContact O-CG 3.21Å; E2490-Q2494 PolarHBondContact O-N 3.42Å; E2490-Q2494 PolarHBondContact OE1-NE2 2.7Å; A2491-Q2494 WeakPolarHBondContact O-CB 3.49Å; A2491-Q2494 PolarHBondContact O-N 3.39Å; Q2494-L2496 VanDerWaalsContact C-N 3.3Å; Q2494-L2496 PolarHBondContact O-N 2.96Å; Q2494-Q2498 WeakPolarHBondContact O-CB 3.47Å; Q2494-Q2498 VanDerWaalsContact O-CG 3.28Å; Q2494-Q2498 WeakPolarHBondContact O-CG 3.47Å; Q2494-Q2498 PolarHBondContact O-N 2.89Å; Q2494-Q2498 PolarHBondContact O-NE2 2.87Å
2495	Q	78.4	Confident	75.9	Confident	9 Å²	9	47.9 Å²	47.9	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-60.7	-42.3	173.4	-53.9	-151.1	-90.8	0	0	111.7	E1890 Y2429 L2430 A2491 V2493 Q2498 F2499 Y2557	E1890-Q2495 WeakPolarHBondContact OE2-CA 3.22Å; E1890-Q2495 WeakPolarHBondContact OE2-CB 3.32Å; E1890-Q2495 WeakPolarHBondContact OE2-CG 3.45Å; E1890-Q2495 PolarHBondContact OE2-NE2 3.35Å; Y2429-Q2495 PolarHBondContact O-NE2 3.22Å; Y2429-Q2495 PolarHBondContact O-OE1 2.9Å; L2430-Q2495 HydrophobicContact CD2-CG 4.14Å; L2430-Q2495 VanDerWaalsContact CD2-OE1 3.3Å; A2491-Q2495 WeakPolarHBondContact O-CG 3.39Å; A2491-Q2495 PolarHBondContact O-N 3.09Å; V2493-Q2495 PolarHBondContact O-N 3.07Å; Q2495-Q2498 PolarHBondContact O-N 2.86Å; Q2495-F2499 WeakPolarHBondContact O-CB 3.15Å; Q2495-F2499 PolarHBondContact O-N 3.26Å; Q2495-Y2557 HydrophobicContact CB-CE1 4.32Å; Q2495-Y2557 VanDerWaalsContact CB-OH 3.3Å; Q2495-Y2557 WeakPolarHBondContact CB-OH 3.23Å
2496	L	82.6	Confident	75.2	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-71.5	-38.9	-175.6	-179.7	59.2	0	0	0	112.4	L2492 V2493 Q2494 S2500 L2554 Y2557 L2569 I2572 A2573 L2576	L2492-L2496 WeakPolarHBondContact O-CB 2.92Å; L2492-L2496 PolarHBondContact O-N 2.71Å; V2493-L2496 WeakPolarHBondContact O-CB 3.2Å; V2493-L2496 PolarHBondContact O-N 2.93Å; Q2494-L2496 VanDerWaalsContact C-N 3.3Å; Q2494-L2496 PolarHBondContact O-N 2.96Å; L2496-S2500 PolarHBondContact O-N 3.49Å; L2496-L2554 HydrophobicContact CD1-CD2 3.63Å; L2496-Y2557 HydrophobicContact CB-CD1 4.23Å; L2496-Y2557 HydrophobicContact CB-CE1 4.11Å; L2496-Y2557 HydrophobicContact CD1-CD1 4.2Å; L2496-Y2557 HydrophobicContact CD1-CD2 3.54Å; L2496-Y2557 HydrophobicContact CD1-CE2 3.88Å; L2496-Y2557 HydrophobicContact CD1-CG 3.7Å; L2496-Y2557 HydrophobicContact CD2-CD1 4.41Å; L2496-Y2557 HydrophobicContact CD2-CG 4.36Å; L2496-Y2557 HydrophobicContact CG-CG 4.44Å; L2496-L2569 HydrophobicContact CD2-CD1 3.72Å; L2496-I2572 HydrophobicContact CD2-CB 4.21Å; L2496-I2572 HydrophobicContact CD2-CG2 3.69Å; L2496-I2572 HydrophobicContact CG-CG2 4.2Å; L2496-A2573 HydrophobicContact CD2-CB 3.71Å; L2496-L2576 HydrophobicContact CD1-CD1 3.37Å; L2496-L2576 HydrophobicContact CD2-CD1 4.35Å; L2496-L2576 HydrophobicContact CG-CD1 3.55Å
2497	E	78.3	Confident	74.7	Confident	96 Å²	96	43.7 Å²	43.7	45%	0.449	22%	0.224	S	C	.	.	H	α-helix	trans	-67.9	-42.4	171.8	-70	-169.3	153.7	0	0	111.6	V2493 S2500 L2501	V2493-E2497 HydrophobicContact CG1-CG 4.44Å; V2493-E2497 WeakPolarHBondContact O-CG 3.43Å; V2493-E2497 PolarHBondContact O-N 2.76Å; E2497-S2500 WeakPolarHBondContact O-CB 3.32Å; E2497-S2500 PolarHBondContact O-N 2.95Å; E2497-L2501 WeakPolarHBondContact O-CB 3.5Å; E2497-L2501 PolarHBondContact O-N 3.08Å
2498	Q	70.8	Confident	74.3	Confident	32 Å²	32	41.6 Å²	41.6	15%	0.15	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-44.7	173.2	-76.6	171.9	80.7	0	0	112.1	L1886 L1887 E1890 Q2494 Q2495 S2500 L2501 Q2502	L1886-Q2498 PolarHBondContact O-OE1 2.86Å; L1886-Q2498 VanDerWaalsContact O-OE1 3.05Å; L1887-Q2498 HydrophobicContact CD2-CB 4.43Å; L1887-Q2498 WeakPolarHBondContact CD2-O 3.5Å; E1890-Q2498 PolarHBondContact OE1-NE2 3.19Å; Q2494-Q2498 WeakPolarHBondContact O-CB 3.47Å; Q2494-Q2498 VanDerWaalsContact O-CG 3.28Å; Q2494-Q2498 WeakPolarHBondContact O-CG 3.47Å; Q2494-Q2498 PolarHBondContact O-N 2.89Å; Q2494-Q2498 PolarHBondContact O-NE2 2.87Å; Q2495-Q2498 PolarHBondContact O-N 2.86Å; Q2498-S2500 VanDerWaalsContact C-N 3.33Å; Q2498-S2500 PolarHBondContact O-N 3.28Å; Q2498-L2501 CarbonylContact O-C 3.55Å; Q2498-L2501 PolarHBondContact O-N 2.84Å; Q2498-L2501 VanDerWaalsContact O-N 3.1Å; Q2498-Q2502 PolarHBondContact O-N 3.34Å
2499	F	74.9	Confident	73.5	Confident	17 Å²	17	44.4 Å²	44.4	8%	0.075	23%	0.231	C	C	.	.	H	α-helix	trans	-62.5	-38.2	176.5	178.9	-111.8	0	0	0	112.4	Q2495 L2501 H2503 V2550 R2553 L2554	Q2495-F2499 WeakPolarHBondContact O-CB 3.15Å; Q2495-F2499 PolarHBondContact O-N 3.26Å; F2499-L2501 VanDerWaalsContact C-N 3.34Å; F2499-H2503 PolarHBondContact O-N 2.83Å; F2499-V2550 HydrophobicContact CE1-CG1 3.82Å; F2499-V2550 HydrophobicContact CZ-CG1 3.86Å; F2499-R2553 HydrophobicContact CE1-CB 4.37Å; F2499-R2553 HydrophobicContact CZ-CB 4.34Å; F2499-L2554 HydrophobicContact CD1-CD2 3.81Å; F2499-L2554 HydrophobicContact CE1-CD2 3.86Å; F2499-L2554 HydrophobicContact CE1-CG 4.11Å
2500	S	75.2	Confident	72.2	Confident	13 Å²	13	43.6 Å²	43.6	9%	0.091	23%	0.229	C	C	.	.	H	α-helix	trans	-63	-40.6	171.5	-176.8	0	0	0	0	112.2	L2496 E2497 Q2498 C2504 L2576	L2496-S2500 PolarHBondContact O-N 3.49Å; E2497-S2500 WeakPolarHBondContact O-CB 3.32Å; E2497-S2500 PolarHBondContact O-N 2.95Å; Q2498-S2500 VanDerWaalsContact C-N 3.33Å; Q2498-S2500 PolarHBondContact O-N 3.28Å; S2500-C2504 PolarHBondContact O-N 3.48Å; S2500-C2504 PolarHBondContact O-SG 3.47Å; S2500-C2504 VanDerWaalsContact O-SG 3.34Å; S2500-L2576 WeakPolarHBondContact OG-CD2 3.26Å
2501	L	70.1	Confident	71.3	Confident	55 Å²	55	42.6 Å²	42.6	29%	0.288	23%	0.23	S	C	.	.	H	α-helix	trans	-77.8	-32.6	-176.5	-175.6	69.5	0	0	0	111.8	Q1883 L1887 E2497 Q2498 F2499 C2504 L2505	Q1883-L2501 HydrophobicContact CB-CD2 4.27Å; Q1883-L2501 HydrophobicContact CG-CD2 4.39Å; L1887-L2501 HydrophobicContact CD1-CG 4.3Å; L1887-L2501 HydrophobicContact CD2-CB 3.72Å; L1887-L2501 HydrophobicContact CD2-CD2 3.92Å; L1887-L2501 HydrophobicContact CD2-CG 3.81Å; L1887-L2501 HydrophobicContact CG-CD2 4.49Å; L1887-L2501 HydrophobicContact CG-CG 4.48Å; E2497-L2501 WeakPolarHBondContact O-CB 3.5Å; E2497-L2501 PolarHBondContact O-N 3.08Å; Q2498-L2501 CarbonylContact O-C 3.55Å; Q2498-L2501 PolarHBondContact O-N 2.84Å; Q2498-L2501 VanDerWaalsContact O-N 3.1Å; F2499-L2501 VanDerWaalsContact C-N 3.34Å; L2501-C2504 PolarHBondContact O-N 3.48Å; L2501-L2505 HydrophobicContact CD1-CD1 3.76Å; L2501-L2505 HydrophobicContact CD1-CG 4.02Å; L2501-L2505 HydrophobicContact CG-CD1 3.99Å; L2501-L2505 HydrophobicContact CG-CG 4.4Å; L2501-L2505 WeakPolarHBondContact O-CB 3.35Å; L2501-L2505 PolarHBondContact O-N 3.49Å
2502	Q	66.8	Low	70.3	Confident	29 Å²	29	48.4 Å²	48.4	14%	0.136	25%	0.249	C	C	.	.	H	α-helix	trans	-53.2	-55.8	165.8	-84.7	-173.1	-14.9	0	0	109.7	L1887 Q2498 C2504 L2505 Q2506	L1887-Q2502 HydrophobicContact CB-CG 3.99Å; L1887-Q2502 HydrophobicContact CD2-CB 4.34Å; L1887-Q2502 HydrophobicContact CD2-CG 3.92Å; L1887-Q2502 VanDerWaalsContact CD2-N 3.29Å; L1887-Q2502 HydrophobicContact CG-CG 4.42Å; L1887-Q2502 WeakPolarHBondContact O-CG 3.4Å; L1887-Q2502 PolarHBondContact O-NE2 2.9Å; Q2498-Q2502 PolarHBondContact O-N 3.34Å; Q2502-C2504 PolarHBondContact O-N 3.13Å; Q2502-L2505 PolarHBondContact O-N 2.94Å; Q2502-Q2506 WeakPolarHBondContact O-CB 3.29Å; Q2502-Q2506 PolarHBondContact O-N 3.36Å; Q2502-Q2506 VanDerWaalsContact O-N 3.17Å
2503	H	71.8	Confident	69.1	Low	20 Å²	20	50.4 Å²	50.4	9%	0.093	26%	0.263	C	S	.	.	H	α-helix	trans	-59.6	-28.8	-178.9	176.2	-82.5	0	0	0	112.6	Q747 F2499 Q2506	Q747-H2503 PolarHBondContact NE2-CE1 2.99Å; Q747-H2503 PolarHBondContact NE2-NE2 3.12Å; F2499-H2503 PolarHBondContact O-N 2.83Å; H2503-Q2506 PolarHBondContact O-NE2 2.98Å
2504	C	68.7	Low	67.3	Low	83 Å²	83	55.1 Å²	55.1	56%	0.561	29%	0.292	S	S	*	.	H	α-helix	trans	-85.5	-30.1	177.7	-72.4	0	0	0	0	115.1	S2500 L2501 Q2502	S2500-C2504 PolarHBondContact O-N 3.48Å; S2500-C2504 PolarHBondContact O-SG 3.47Å; S2500-C2504 VanDerWaalsContact O-SG 3.34Å; L2501-C2504 PolarHBondContact O-N 3.48Å; Q2502-C2504 PolarHBondContact O-N 3.13Å
2505	L	63.6	Low	65.6	Low	104 Å²	104	57.8 Å²	57.8	55%	0.545	31%	0.313	S	S	.	.	S	Bend	trans	-110.2	21.8	-175.1	-60.1	-174.7	0	0	0	113.3	L1887 L2501 Q2502	L1887-L2505 HydrophobicContact CD1-CB 4.06Å; L1887-L2505 HydrophobicContact CD1-CD1 4.16Å; L2501-L2505 HydrophobicContact CD1-CD1 3.76Å; L2501-L2505 HydrophobicContact CD1-CG 4.02Å; L2501-L2505 HydrophobicContact CG-CD1 3.99Å; L2501-L2505 HydrophobicContact CG-CG 4.4Å; L2501-L2505 WeakPolarHBondContact O-CB 3.35Å; L2501-L2505 PolarHBondContact O-N 3.49Å; Q2502-L2505 PolarHBondContact O-N 2.94Å
2506	Q	62.9	Low	63.7	Low	42 Å²	42	61.2 Å²	61.2	20%	0.196	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-75.2	148.4	-172.7	59.3	171.6	-56.6	0	0	115.2	Q2502 H2503 L2542 T2543 V2544	Q2502-Q2506 WeakPolarHBondContact O-CB 3.29Å; Q2502-Q2506 PolarHBondContact O-N 3.36Å; Q2502-Q2506 VanDerWaalsContact O-N 3.17Å; H2503-Q2506 PolarHBondContact O-NE2 2.98Å; Q2506-L2542 HydrophobicContact CG-CD2 4.43Å; Q2506-T2543 WeakPolarHBondContact CB-OG1 3.36Å; Q2506-V2544 HydrophobicContact CB-CG2 4.48Å; Q2506-V2544 PolarHBondContact NE2-O 2.79Å; Q2506-V2544 VanDerWaalsContact OE1-C 3.3Å; Q2506-V2544 PolarHBondContact OE1-O 3.37Å
2507	D	62.5	Low	61.6	Low	54 Å²	54	63.6 Å²	63.6	29%	0.289	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-96.2	165.7	-179	-109.9	-43.9	0	0	0	113	R1884 T2543	R1884-D2507 IonicContact CZ-OD2 2.94Å; R1884-D2507 IonicContact NH1-OD2 2.68Å; R1884-D2507 PolarHBondContact NH1-OD2 2.95Å; R1884-D2507 IonicContact NH2-OD2 3.25Å; R1884-D2507 PolarHBondContact NH2-OD2 3.21Å; D2507-T2543 HydrophobicContact CB-CG2 4.3Å; D2507-T2543 PolarHBondContact N-OG1 2.79Å; D2507-T2543 WeakPolarHBondContact O-CB 3.41Å; D2507-T2543 WeakPolarHBondContact O-CG2 3.46Å; D2507-T2543 PolarHBondContact O-N 2.94Å; D2507-T2543 PolarHBondContact O-OG1 2.99Å
2508	L	63.5	Low	59.8	Low	69 Å²	69	59.8 Å²	59.8	36%	0.361	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	148.7	162.7	-72.2	172.3	0	0	0	111	I2519 L2542	L2508-I2519 HydrophobicContact CB-CD1 3.61Å; L2508-I2519 HydrophobicContact CB-CG1 4.47Å; L2508-I2519 WeakPolarHBondContact O-CG1 3.44Å; L2508-I2519 PolarHBondContact O-N 3.23Å; L2508-I2519 VanDerWaalsContact O-N 3.11Å; L2508-L2542 HydrophobicContact CD2-CD2 4.11Å
2509	Q	64.3	Low	58.4	Low	67 Å²	67	59.8 Å²	59.8	31%	0.313	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	159.6	178.9	57	167.5	-8.4	0	0	111.9	L2540 T2541 L2542 T2543	Q2509-L2540 WeakPolarHBondContact O-CA 3.49Å; Q2509-T2541 VanDerWaalsContact CG-O 3.24Å; Q2509-T2541 WeakPolarHBondContact CG-O 3.45Å; Q2509-T2541 PolarHBondContact N-O 3.38Å; Q2509-T2541 PolarHBondContact O-N 3.1Å; Q2509-T2541 PolarHBondContact O-OG1 2.84Å; Q2509-L2542 PolarHBondContact NE2-O 3.48Å; Q2509-T2543 HydrophobicContact CB-CG2 3.86Å; Q2509-T2543 HydrophobicContact CG-CG2 3.8Å
2510	C	60	Low	56.9	Low	14 Å²	14	65.3 Å²	65.3	10%	0.095	39%	0.388	C	S	.	.			trans	-101.7	117.3	174.4	-178.1	0	0	0	0	111.8	K2512 C2513 T2514 C2533 C2536 L2540	C2510-K2512 PolarHBondContact O-N 3.34Å; C2510-K2512 VanDerWaalsContact O-N 3.08Å; C2510-C2513 HydrophobicContact CB-CB 4.09Å; C2510-T2514 PolarHBondContact O-N 3.27Å; C2510-C2533 HydrophobicContact CB-CB 3.81Å; C2510-C2533 WeakPolarHBondContact SG-CB 3.38Å; C2510-C2533 VanDerWaalsContact SG-SG 3.64Å; C2510-C2536 PolarHBondContact SG-SG 3.1Å; C2510-L2540 HydrophobicContact CB-CD2 3.82Å
2511	P	58.6	Low	55.4	Low	71 Å²	71	72.1 Å²	72.1	46%	0.461	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-1.6	-174.9	31	-36.7	0	0	0	114.6	T2538 K2539 T2541	P2511-T2538 HydrophobicContact CG-CG2 3.98Å; P2511-K2539 WeakPolarHBondContact CD-O 3.49Å; P2511-T2541 HydrophobicContact CG-CG2 4.28Å
2512	K	59.4	Low	53.9	Low	154 Å²	154	75.1 Å²	75.1	67%	0.67	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.8	-23.4	-177.8	-149.2	-176.7	-171	-173.7	0	114.5	C2510 T2538	C2510-K2512 PolarHBondContact O-N 3.34Å; C2510-K2512 VanDerWaalsContact O-N 3.08Å; K2512-T2538 HydrophobicContact CB-CG2 3.97Å; K2512-T2538 WeakPolarHBondContact CD-OG1 3.47Å
2513	C	59.9	Low	52.7	Low	42 Å²	42	76.2 Å²	76.2	28%	0.284	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-28.1	177.7	-80.3	0	0	0	0	112.3	C2510 V2515 C2533 C2536	C2510-C2513 HydrophobicContact CB-CB 4.09Å; C2513-V2515 VanDerWaalsContact C-N 3.27Å; C2513-V2515 PolarHBondContact O-N 2.88Å; C2513-C2533 VanDerWaalsContact SG-SG 3.63Å; C2513-C2536 WeakPolarHBondContact CB-SG 3.35Å; C2513-C2536 WeakPolarHBondContact SG-CB 3.35Å; C2513-C2536 CovalentContact SG-SG 2.05Å; C2513-C2536 PolarHBondContact SG-SG 3.05Å
2514	T	46.6	Very low	51.2	Low	108 Å²	108	80.3 Å²	80.3	66%	0.663	46%	0.462	S	S	*	.			trans	36.1	43.8	164	54.4	0	0	0	0	117.8	C2510	C2510-T2514 PolarHBondContact O-N 3.27Å
2515	V	39	Very low	50.2	Low	135 Å²	135	80.3 Å²	80.3	82%	0.818	47%	0.468	S	S	*	.			trans	-87.4	124.7	155.7	-179.4	0	0	0	0	106.2	C2513	C2513-V2515 VanDerWaalsContact C-N 3.27Å; C2513-V2515 PolarHBondContact O-N 2.88Å
2516	G	37.9	Very low	49.1	Very low	81 Å²	81	81.7 Å²	81.7	84%	0.835	48%	0.476	S	S	*	.	S	Bend	trans	-68.3	141	-165.6	0	0	0	0	0	114.4
2517	G	38.9	Very low	48.1	Very low	50 Å²	50	82.8 Å²	82.8	52%	0.515	50%	0.499	S	S	.	.	S	Bend	trans	118.1	158.2	-174.3	0	0	0	0	0	111.6
2518	G	39.8	Very low	46.8	Very low	15 Å²	15	81.2 Å²	81.2	16%	0.155	50%	0.496	C	S	.	.	S	Bend	trans	-63.8	161.4	172.1	0	0	0	0	0	111.9	Q2520	G2518-Q2520 PolarHBondContact O-N 2.77Å
2519	I	42.1	Very low	46	Very low	32 Å²	32	81.4 Å²	81.4	16%	0.164	50%	0.503	C	S	.	.			trans	-58.5	108.5	178.1	-60.6	162	0	0	0	109.5	L2508 E2521 L2523 I2524 L2540	L2508-I2519 HydrophobicContact CB-CD1 3.61Å; L2508-I2519 HydrophobicContact CB-CG1 4.47Å; L2508-I2519 WeakPolarHBondContact O-CG1 3.44Å; L2508-I2519 PolarHBondContact O-N 3.23Å; L2508-I2519 VanDerWaalsContact O-N 3.11Å; I2519-E2521 PolarHBondContact O-N 3.05Å; I2519-L2523 HydrophobicContact CG2-CB 3.61Å; I2519-L2523 HydrophobicContact CG2-CD1 4.32Å; I2519-I2524 HydrophobicContact CG2-CD1 4.31Å; I2519-I2524 HydrophobicContact CG2-CG1 3.93Å; I2519-L2540 HydrophobicContact CD1-CB 4.38Å; I2519-L2540 HydrophobicContact CD1-CD1 3.39Å; I2519-L2540 HydrophobicContact CD1-CD2 3.6Å; I2519-L2540 HydrophobicContact CD1-CG 3.93Å; I2519-L2540 HydrophobicContact CG1-CD2 4.33Å
2520	Q	44.4	Very low	45.5	Very low	134 Å²	134	84.9 Å²	84.9	63%	0.626	53%	0.528	S	S	*	.			trans	-53.8	136.3	171.7	-62	175.4	-5.5	0	0	109.3	G2518 L2522 L2523	G2518-Q2520 PolarHBondContact O-N 2.77Å; Q2520-L2522 PolarHBondContact O-N 3.16Å; Q2520-L2523 WeakPolarHBondContact O-CB 3.39Å; Q2520-L2523 PolarHBondContact O-N 3.42Å
2521	E	42.1	Very low	45.4	Very low	155 Å²	155	86.5 Å²	86.5	72%	0.724	54%	0.542	S	S	*	.	H	α-helix	trans	-54	-28	-177.5	-66.4	-173.7	116.1	0	0	113	I2519 L2523 I2524 A2525	I2519-E2521 PolarHBondContact O-N 3.05Å; E2521-L2523 VanDerWaalsContact C-N 3.25Å; E2521-L2523 PolarHBondContact O-N 3.19Å; E2521-I2524 PolarHBondContact O-N 2.81Å; E2521-A2525 WeakPolarHBondContact O-CB 3.49Å; E2521-A2525 PolarHBondContact O-N 3.4Å
2522	L	39.8	Very low	45.7	Very low	118 Å²	118	87.7 Å²	87.7	62%	0.618	54%	0.542	S	S	*	.	H	α-helix	trans	-51.9	-35.9	171.1	-78.2	156.5	0	0	0	114.2	Q2520 N2526	Q2520-L2522 PolarHBondContact O-N 3.16Å; L2522-N2526 WeakPolarHBondContact O-CB 3.24Å; L2522-N2526 VanDerWaalsContact O-CG 3.29Å; L2522-N2526 PolarHBondContact O-N 3.15Å; L2522-N2526 VanDerWaalsContact O-N 3.12Å; L2522-N2526 PolarHBondContact O-ND2 2.82Å
2523	L	41.1	Very low	45.5	Very low	52 Å²	52	80.8 Å²	80.8	27%	0.272	51%	0.513	S	S	.	.	H	α-helix	trans	-73.3	-28.6	177.3	-96.6	161.6	0	0	0	112.8	I2519 Q2520 E2521 A2534 D2535	I2519-L2523 HydrophobicContact CG2-CB 3.61Å; I2519-L2523 HydrophobicContact CG2-CD1 4.32Å; Q2520-L2523 WeakPolarHBondContact O-CB 3.39Å; Q2520-L2523 PolarHBondContact O-N 3.42Å; E2521-L2523 VanDerWaalsContact C-N 3.25Å; E2521-L2523 PolarHBondContact O-N 3.19Å; L2523-A2534 HydrophobicContact CD2-CB 3.75Å; L2523-D2535 WeakPolarHBondContact CD2-OD2 3.21Å
2524	I	40.4	Very low	45.4	Very low	106 Å²	106	81 Å²	81	54%	0.544	52%	0.517	S	S	.	.	H	α-helix	trans	-80.5	-42.4	174	-57.9	175.2	0	0	0	109.6	I2519 E2521 N2526 G2527	I2519-I2524 HydrophobicContact CG2-CD1 4.31Å; I2519-I2524 HydrophobicContact CG2-CG1 3.93Å; E2521-I2524 PolarHBondContact O-N 2.81Å; I2524-N2526 PolarHBondContact O-N 3.23Å; I2524-G2527 PolarHBondContact O-N 2.91Å; I2524-G2527 VanDerWaalsContact O-N 3.09Å
2525	A	46.9	Very low	45.9	Very low	83 Å²	83	81.7 Å²	81.7	69%	0.686	52%	0.517	S	S	*	.	H	α-helix	trans	-59.1	-32.6	177	0	0	0	0	0	113.1	E2521 G2527	E2521-A2525 WeakPolarHBondContact O-CB 3.49Å; E2521-A2525 PolarHBondContact O-N 3.4Å; A2525-G2527 PolarHBondContact O-N 2.92Å
2526	N	41.2	Very low	47.4	Very low	133 Å²	133	77.1 Å²	77.1	71%	0.711	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	16.6	176.8	-72.6	-26.2	0	0	0	114.5	L2522 I2524	L2522-N2526 WeakPolarHBondContact O-CB 3.24Å; L2522-N2526 VanDerWaalsContact O-CG 3.29Å; L2522-N2526 PolarHBondContact O-N 3.15Å; L2522-N2526 VanDerWaalsContact O-N 3.12Å; L2522-N2526 PolarHBondContact O-ND2 2.82Å; I2524-N2526 PolarHBondContact O-N 3.23Å
2527	G	41.1	Very low	48.8	Very low	66 Å²	66	77.1 Å²	77.1	68%	0.68	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	87	13.9	165.7	0	0	0	0	0	116	I2524 A2525 S2529	I2524-G2527 PolarHBondContact O-N 2.91Å; I2524-G2527 VanDerWaalsContact O-N 3.09Å; A2525-G2527 PolarHBondContact O-N 2.92Å; G2527-S2529 PolarHBondContact O-N 2.89Å
2528	G	36.2	Very low	49.9	Very low	21 Å²	21	76.4 Å²	76.4	22%	0.216	46%	0.464	C	S	.	.			trans	-61.5	126	167.8	0	0	0	0	0	110.9
2529	S	45.5	Very low	51.2	Low	73 Å²	73	82.9 Å²	82.9	51%	0.51	49%	0.488	S	S	.	.			trans	-63	145.6	176.4	78.8	0	0	0	0	110.6	G2527 A2531 Q2532	G2527-S2529 PolarHBondContact O-N 2.89Å; S2529-A2531 PolarHBondContact O-N 2.84Å; S2529-Q2532 PolarHBondContact O-N 3.06Å
2530	V	55.6	Low	52.1	Low	139 Å²	139	82.4 Å²	82.4	84%	0.842	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-12.4	-166	-169.5	0	0	0	0	115.8
2531	A	58.1	Low	52.9	Low	48 Å²	48	78.8 Å²	78.8	40%	0.397	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-0.2	179.6	0	0	0	0	0	115.6	S2529 K2539 L2540	S2529-A2531 PolarHBondContact O-N 2.84Å; A2531-K2539 VanDerWaalsContact O-CA 3.32Å; A2531-K2539 WeakPolarHBondContact O-CA 3.47Å; A2531-K2539 WeakPolarHBondContact O-CG 3.46Å; A2531-L2540 PolarHBondContact O-N 3.46Å
2532	Q	63.5	Low	54	Low	96 Å²	96	74.6 Å²	74.6	45%	0.449	46%	0.455	S	S	.	.	B	Isolated β-bridge	trans	-135.4	138.6	-173.6	-68.3	-180	-0.3	0	0	113.2	S2529	S2529-Q2532 PolarHBondContact O-N 3.06Å
2533	C	56.2	Low	54.9	Low	10 Å²	10	71 Å²	71	7%	0.068	44%	0.438	C	S	.	.			trans	-63.8	133.9	172.5	-170.6	0	0	0	0	110.8	C2510 C2513 D2535 S2537 T2538 L2540	C2510-C2533 HydrophobicContact CB-CB 3.81Å; C2510-C2533 WeakPolarHBondContact SG-CB 3.38Å; C2510-C2533 VanDerWaalsContact SG-SG 3.64Å; C2513-C2533 VanDerWaalsContact SG-SG 3.63Å; C2533-D2535 PolarHBondContact O-N 3.28Å; C2533-S2537 WeakPolarHBondContact O-CA 3.18Å; C2533-S2537 PolarHBondContact O-N 2.87Å; C2533-T2538 PolarHBondContact N-O 2.85Å; C2533-L2540 HydrophobicContact CB-CD2 3.77Å
2534	A	57.2	Low	55.7	Low	45 Å²	45	69.6 Å²	69.6	37%	0.372	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-45	-179.1	0	0	0	0	0	112.5	L2523	L2523-A2534 HydrophobicContact CD2-CB 3.75Å
2535	D	57	Low	56.5	Low	124 Å²	124	66.4 Å²	66.4	66%	0.663	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-42.1	-169.5	-42.8	-75.8	0	0	0	114.2	L2523 C2533	L2523-D2535 WeakPolarHBondContact CD2-OD2 3.21Å; C2533-D2535 PolarHBondContact O-N 3.28Å
2536	C	69.7	Low	57.1	Low	39 Å²	39	65 Å²	65	26%	0.264	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	12.9	-176.3	54.6	0	0	0	0	114.2	C2510 C2513 T2538	C2510-C2536 PolarHBondContact SG-SG 3.1Å; C2513-C2536 WeakPolarHBondContact CB-SG 3.35Å; C2513-C2536 WeakPolarHBondContact SG-CB 3.35Å; C2513-C2536 CovalentContact SG-SG 2.05Å; C2513-C2536 PolarHBondContact SG-SG 3.05Å; C2536-T2538 PolarHBondContact O-N 3.4Å; C2536-T2538 PolarHBondContact O-OG1 2.94Å
2537	S	68.3	Low	58.1	Low	81 Å²	81	58.7 Å²	58.7	57%	0.566	37%	0.367	S	S	*	.			trans	49.5	11	179.4	-46.9	0	0	0	0	116	C2533	C2533-S2537 WeakPolarHBondContact O-CA 3.18Å; C2533-S2537 PolarHBondContact O-N 2.87Å
2538	T	62.6	Low	59.1	Low	34 Å²	34	57 Å²	57	21%	0.209	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-83.6	140.7	-169.6	-60.5	0	0	0	0	109.3	P2511 K2512 C2533 C2536 L2540	P2511-T2538 HydrophobicContact CG-CG2 3.98Å; K2512-T2538 HydrophobicContact CB-CG2 3.97Å; K2512-T2538 WeakPolarHBondContact CD-OG1 3.47Å; C2533-T2538 PolarHBondContact N-O 2.85Å; C2536-T2538 PolarHBondContact O-N 3.4Å; C2536-T2538 PolarHBondContact O-OG1 2.94Å; T2538-L2540 PolarHBondContact O-N 3.16Å
2539	K	66.3	Low	60.4	Low	151 Å²	151	56.6 Å²	56.6	66%	0.657	34%	0.336	S	S	*	.	B	Isolated β-bridge	trans	-59.6	131.1	-177.8	-165	-174.6	178.7	-176.3	0	110.3	P2511 A2531	P2511-K2539 WeakPolarHBondContact CD-O 3.49Å; A2531-K2539 VanDerWaalsContact O-CA 3.32Å; A2531-K2539 WeakPolarHBondContact O-CA 3.47Å; A2531-K2539 WeakPolarHBondContact O-CG 3.46Å
2540	L	61.7	Low	61.7	Low	22 Å²	22	53.4 Å²	53.4	12%	0.115	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-74.1	143.4	179.2	-59.4	167.9	0	0	0	110.2	Q2509 C2510 I2519 A2531 C2533 T2538	Q2509-L2540 WeakPolarHBondContact O-CA 3.49Å; C2510-L2540 HydrophobicContact CB-CD2 3.82Å; I2519-L2540 HydrophobicContact CD1-CB 4.38Å; I2519-L2540 HydrophobicContact CD1-CD1 3.39Å; I2519-L2540 HydrophobicContact CD1-CD2 3.6Å; I2519-L2540 HydrophobicContact CD1-CG 3.93Å; I2519-L2540 HydrophobicContact CG1-CD2 4.33Å; A2531-L2540 PolarHBondContact O-N 3.46Å; C2533-L2540 HydrophobicContact CB-CD2 3.77Å; T2538-L2540 PolarHBondContact O-N 3.16Å
2541	T	60.6	Low	62.8	Low	59 Å²	59	47.3 Å²	47.3	36%	0.362	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	156.4	-176.5	49.9	0	0	0	0	110	Q2509 P2511	Q2509-T2541 VanDerWaalsContact CG-O 3.24Å; Q2509-T2541 WeakPolarHBondContact CG-O 3.45Å; Q2509-T2541 PolarHBondContact N-O 3.38Å; Q2509-T2541 PolarHBondContact O-N 3.1Å; Q2509-T2541 PolarHBondContact O-OG1 2.84Å; P2511-T2541 HydrophobicContact CG-CG2 4.28Å
2542	L	64.2	Low	63.5	Low	67 Å²	67	45.7 Å²	45.7	35%	0.351	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	150.2	173.7	-75.5	175.8	0	0	0	111.9	Q2506 L2508 Q2509 T2546	Q2506-L2542 HydrophobicContact CG-CD2 4.43Å; L2508-L2542 HydrophobicContact CD2-CD2 4.11Å; Q2509-L2542 PolarHBondContact NE2-O 3.48Å; L2542-T2546 HydrophobicContact CD1-CG2 4.06Å
2543	T	59	Low	64.2	Low	43 Å²	43	42.7 Å²	42.7	26%	0.264	24%	0.243	S	C	.	.	S	Bend	trans	-70.8	-40.7	172.5	37.8	0	0	0	0	112.1	Q2506 D2507 Q2509 P2545	Q2506-T2543 WeakPolarHBondContact CB-OG1 3.36Å; D2507-T2543 HydrophobicContact CB-CG2 4.3Å; D2507-T2543 PolarHBondContact N-OG1 2.79Å; D2507-T2543 WeakPolarHBondContact O-CB 3.41Å; D2507-T2543 WeakPolarHBondContact O-CG2 3.46Å; D2507-T2543 PolarHBondContact O-N 2.94Å; D2507-T2543 PolarHBondContact O-OG1 2.99Å; Q2509-T2543 HydrophobicContact CB-CG2 3.86Å; Q2509-T2543 HydrophobicContact CG-CG2 3.8Å; T2543-P2545 WeakPolarHBondContact O-CD 3.4Å
2544	V	59.2	Low	65.5	Low	22 Å²	22	42.3 Å²	42.3	13%	0.133	24%	0.241	C	C	.	.	S	Bend	trans	-116.1	83.8	174.1	-173.5	0	0	0	0	109.2	Q2506 T2546	Q2506-V2544 HydrophobicContact CB-CG2 4.48Å; Q2506-V2544 PolarHBondContact NE2-O 2.79Å; Q2506-V2544 VanDerWaalsContact OE1-C 3.3Å; Q2506-V2544 PolarHBondContact OE1-O 3.37Å; V2544-T2546 PolarHBondContact O-N 2.92Å
2545	P	55.7	Low	66.6	Low	38 Å²	38	40.9 Å²	40.9	25%	0.247	23%	0.226	C	C	.	.			trans	-54.4	130.6	-177.7	23.2	-34.1	0	0	0	111.3	R2424 T2543	R2424-P2545 VanDerWaalsContact CZ-CG 3.43Å; T2543-P2545 WeakPolarHBondContact O-CD 3.4Å
2546	T	59.8	Low	67.7	Low	55 Å²	55	35.5 Å²	35.5	34%	0.337	20%	0.198	S	C	.	.			trans	-75.2	158.9	-171.2	53.5	0	0	0	0	112.6	L2409 L2542 V2544	L2409-T2546 WeakPolarHBondContact CD1-O 3.2Å; L2542-T2546 HydrophobicContact CD1-CG2 4.06Å; V2544-T2546 PolarHBondContact O-N 2.92Å
2547	G	61.9	Low	68.4	Low	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	105	-129.9	165.1	0	0	0	0	0	115.4	A2549 V2550 Y2551	G2547-A2549 VanDerWaalsContact C-N 3.33Å; G2547-A2549 PolarHBondContact O-N 3.32Å; G2547-V2550 WeakPolarHBondContact O-CA 3.43Å; G2547-V2550 WeakPolarHBondContact O-CB 3.35Å; G2547-V2550 PolarHBondContact O-N 3.12Å; G2547-Y2551 PolarHBondContact O-N 3.49Å
2548	H	63.6	Low	69.2	Low	30 Å²	30	33.4 Å²	33.4	14%	0.139	17%	0.172	C	C	.	.	H	α-helix	trans	-67.1	-29.8	-155	-157.1	-20.6	0	0	0	113.8	R752 L2409 Y2551 R2552	R752-H2548 WeakPolarHBondContact CB-NE2 3.4Å; L2409-H2548 HydrophobicContact CD2-CB 4.21Å; H2548-Y2551 AromaticContact CE1-CD1 3.97Å; H2548-Y2551 AromaticContact ND1-CD1 3.97Å; H2548-Y2551 WeakPolarHBondContact O-CB 3.46Å; H2548-R2552 WeakPolarHBondContact O-CB 3.21Å; H2548-R2552 WeakPolarHBondContact O-CG 3.44Å; H2548-R2552 PolarHBondContact O-N 2.8Å
2549	A	62.6	Low	69.8	Low	13 Å²	13	34.2 Å²	34.2	11%	0.107	17%	0.173	C	C	.	.	H	α-helix	trans	-65.5	-42.6	170.7	0	0	0	0	0	111.8	I2404 D2406 G2547 R2552 R2553	I2404-A2549 HydrophobicContact CG2-CB 4Å; D2406-A2549 WeakPolarHBondContact OD1-CB 3.11Å; G2547-A2549 VanDerWaalsContact C-N 3.33Å; G2547-A2549 PolarHBondContact O-N 3.32Å; A2549-R2552 PolarHBondContact O-N 2.75Å; A2549-R2553 PolarHBondContact O-N 3.45Å
2550	V	73.9	Confident	70.5	Confident	6 Å²	6	27 Å²	27	4%	0.036	14%	0.142	C	C	.	.	H	α-helix	trans	-64.5	-46.7	176.2	-167	0	0	0	0	110.3	F2499 G2547 R2552 R2553 L2554 L2580	F2499-V2550 HydrophobicContact CE1-CG1 3.82Å; F2499-V2550 HydrophobicContact CZ-CG1 3.86Å; G2547-V2550 WeakPolarHBondContact O-CA 3.43Å; G2547-V2550 WeakPolarHBondContact O-CB 3.35Å; G2547-V2550 PolarHBondContact O-N 3.12Å; V2550-R2552 VanDerWaalsContact C-N 3.28Å; V2550-R2552 PolarHBondContact O-N 3.2Å; V2550-R2553 PolarHBondContact O-N 3.39Å; V2550-L2554 HydrophobicContact CG1-CD1 4.11Å; V2550-L2554 VanDerWaalsContact O-CG 3.24Å; V2550-L2554 WeakPolarHBondContact O-CG 3.22Å; V2550-L2554 PolarHBondContact O-N 3.49Å; V2550-L2580 HydrophobicContact CB-CD2 4.18Å; V2550-L2580 HydrophobicContact CG1-CD2 3.49Å; V2550-L2580 VanDerWaalsContact CG1-CD2 3.49Å
2551	Y	76.9	Confident	71.4	Confident	10 Å²	10	26 Å²	26	4%	0.039	14%	0.137	C	C	.	.	H	α-helix	trans	-48.1	-52.2	171.7	176.9	-105.4	0	0	0	112.1	E751 R787 G2547 H2548 D2555 I2577 Q2581	E751-Y2551 WeakPolarHBondContact OE1-CB 3.19Å; R787-Y2551 VanDerWaalsContact NH2-CE2 3.29Å; G2547-Y2551 PolarHBondContact O-N 3.49Å; H2548-Y2551 AromaticContact CE1-CD1 3.97Å; H2548-Y2551 AromaticContact ND1-CD1 3.97Å; H2548-Y2551 WeakPolarHBondContact O-CB 3.46Å; Y2551-D2555 PolarHBondContact O-N 3.48Å; Y2551-D2555 VanDerWaalsContact O-N 3.13Å; Y2551-I2577 HydrophobicContact CD2-CG2 4.32Å; Y2551-I2577 HydrophobicContact CE2-CG2 3.52Å; Y2551-Q2581 HydrophobicContact CD2-CG 4.02Å; Y2551-Q2581 VanDerWaalsContact CD2-NE2 3.27Å; Y2551-Q2581 HydrophobicContact CE2-CG 4.27Å
2552	R	73.9	Confident	72	Confident	15 Å²	15	26.7 Å²	26.7	6%	0.057	14%	0.141	C	C	.	.	H	α-helix	trans	-67	-45.7	-174.9	-75.8	-69.2	-169.8	-178.1	4.5	112.1	M769 I2404 L2426 H2548 A2549 V2550 L2554 D2555 V2556	M769-R2552 PolarHBondContact SD-NH2 2.86Å; M769-R2552 VanDerWaalsContact SD-NH2 3.44Å; I2404-R2552 HydrophobicContact CD1-CG 3.94Å; L2426-R2552 HydrophobicContact CD1-CB 3.89Å; L2426-R2552 HydrophobicContact CD1-CG 4.38Å; L2426-R2552 HydrophobicContact CD2-CB 3.49Å; L2426-R2552 VanDerWaalsContact CD2-CB 3.49Å; L2426-R2552 HydrophobicContact CG-CB 4.35Å; H2548-R2552 WeakPolarHBondContact O-CB 3.21Å; H2548-R2552 WeakPolarHBondContact O-CG 3.44Å; H2548-R2552 PolarHBondContact O-N 2.8Å; A2549-R2552 PolarHBondContact O-N 2.75Å; V2550-R2552 VanDerWaalsContact C-N 3.28Å; V2550-R2552 PolarHBondContact O-N 3.2Å; R2552-L2554 VanDerWaalsContact C-N 3.3Å; R2552-L2554 PolarHBondContact O-N 2.89Å; R2552-D2555 CarbonylContact O-C 3.39Å; R2552-D2555 WeakPolarHBondContact O-CA 3.42Å; R2552-D2555 WeakPolarHBondContact O-CB 3.43Å; R2552-D2555 PolarHBondContact O-N 2.87Å; R2552-V2556 WeakPolarHBondContact O-CG2 2.97Å; R2552-V2556 PolarHBondContact O-N 3.33Å
2553	R	77.2	Confident	72.4	Confident	33 Å²	33	26.9 Å²	26.9	13%	0.125	14%	0.14	C	C	.	.	H	α-helix	trans	-62.2	-39.9	-178.7	-165.6	179.3	-170.6	139.4	-22.9	111.8	E1891 L2426 I2428 F2499 A2549 V2550 D2555 V2556 Y2557	E1891-R2553 IonicContact OE1-CZ 2.67Å; E1891-R2553 IonicContact OE1-NH1 3.64Å; E1891-R2553 PolarHBondContact OE1-NH1 2.84Å; E1891-R2553 IonicContact OE1-NH2 2.97Å; E1891-R2553 PolarHBondContact OE1-NH2 3.36Å; L2426-R2553 HydrophobicContact CD2-CB 4.48Å; I2428-R2553 HydrophobicContact CG1-CG 4.43Å; F2499-R2553 HydrophobicContact CE1-CB 4.37Å; F2499-R2553 HydrophobicContact CZ-CB 4.34Å; A2549-R2553 PolarHBondContact O-N 3.45Å; V2550-R2553 PolarHBondContact O-N 3.39Å; R2553-D2555 VanDerWaalsContact C-N 3.31Å; R2553-D2555 PolarHBondContact O-N 2.93Å; R2553-V2556 WeakPolarHBondContact O-CB 3.49Å; R2553-V2556 PolarHBondContact O-N 2.79Å; R2553-Y2557 HydrophobicContact CG-CE2 4.31Å; R2553-Y2557 WeakPolarHBondContact O-CD2 3.31Å; R2553-Y2557 PolarHBondContact O-N 3.47Å; R2553-Y2557 VanDerWaalsContact O-N 3.15Å
2554	L	84.7	Confident	73.2	Confident	2 Å²	2	25.4 Å²	25.4	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-61.9	-40	173	-62.5	171.3	0	0	0	111.3	L2496 F2499 V2550 R2552 V2556 Y2557 R2558 L2576 I2577 L2580	L2496-L2554 HydrophobicContact CD1-CD2 3.63Å; F2499-L2554 HydrophobicContact CD1-CD2 3.81Å; F2499-L2554 HydrophobicContact CE1-CD2 3.86Å; F2499-L2554 HydrophobicContact CE1-CG 4.11Å; V2550-L2554 HydrophobicContact CG1-CD1 4.11Å; V2550-L2554 VanDerWaalsContact O-CG 3.24Å; V2550-L2554 WeakPolarHBondContact O-CG 3.22Å; V2550-L2554 PolarHBondContact O-N 3.49Å; R2552-L2554 VanDerWaalsContact C-N 3.3Å; R2552-L2554 PolarHBondContact O-N 2.89Å; L2554-V2556 VanDerWaalsContact C-N 3.32Å; L2554-V2556 PolarHBondContact O-N 3.27Å; L2554-Y2557 PolarHBondContact O-N 3.44Å; L2554-R2558 PolarHBondContact O-N 2.9Å; L2554-L2576 HydrophobicContact CD1-CB 4.02Å; L2554-L2576 HydrophobicContact CD2-CB 3.7Å; L2554-L2576 HydrophobicContact CD2-CD1 3.73Å; L2554-L2576 HydrophobicContact CD2-CG 4.26Å; L2554-L2576 HydrophobicContact CG-CB 4.29Å; L2554-I2577 HydrophobicContact CB-CG1 3.63Å; L2554-I2577 WeakPolarHBondContact O-CD1 3.31Å; L2554-I2577 WeakPolarHBondContact O-CG1 3.5Å; L2554-L2580 HydrophobicContact CD1-CD2 4.49Å
2555	D	79	Confident	73.9	Confident	14 Å²	14	26.2 Å²	26.2	8%	0.075	14%	0.143	C	C	.	.	H	α-helix	trans	-62.9	-34.7	174.6	-156.8	43.6	0	0	0	112.5	Y2551 R2552 R2553 R2558 H2559 I2577	Y2551-D2555 PolarHBondContact O-N 3.48Å; Y2551-D2555 VanDerWaalsContact O-N 3.13Å; R2552-D2555 CarbonylContact O-C 3.39Å; R2552-D2555 WeakPolarHBondContact O-CA 3.42Å; R2552-D2555 WeakPolarHBondContact O-CB 3.43Å; R2552-D2555 PolarHBondContact O-N 2.87Å; R2553-D2555 VanDerWaalsContact C-N 3.31Å; R2553-D2555 PolarHBondContact O-N 2.93Å; D2555-R2558 PolarHBondContact O-N 3.14Å; D2555-H2559 PolarHBondContact O-N 3.29Å; D2555-H2559 VanDerWaalsContact O-N 3.14Å; D2555-H2559 PolarHBondContact O-ND1 3.04Å; D2555-H2559 IonicContact OD1-CE1 2.7Å; D2555-H2559 IonicContact OD1-ND1 3.76Å; D2555-H2559 IonicContact OD2-CE1 3.63Å; D2555-H2559 PolarHBondContact OD2-CE1 3.31Å; D2555-H2559 IonicContact OD2-ND1 3.66Å; D2555-I2577 VanDerWaalsContact CA-CD1 3.48Å; D2555-I2577 HydrophobicContact CB-CD1 4.26Å; D2555-I2577 HydrophobicContact CB-CG1 4.45Å
2556	V	80	Confident	75.3	Confident	11 Å²	11	24.4 Å²	24.4	7%	0.067	13%	0.132	C	C	.	.	H	α-helix	trans	-62.7	-49.2	171.1	-172.7	0	0	0	0	111.4	P2342 L2426 I2428 C2447 R2552 R2553 L2554 R2558 H2559 I2560	P2342-V2556 HydrophobicContact CG-CB 4.44Å; P2342-V2556 HydrophobicContact CG-CG2 4.09Å; L2426-V2556 HydrophobicContact CB-CG2 4.26Å; I2428-V2556 HydrophobicContact CD1-CB 3.83Å; I2428-V2556 HydrophobicContact CD1-CG1 3.7Å; I2428-V2556 HydrophobicContact CG1-CG1 4.48Å; C2447-V2556 VanDerWaalsContact SG-CG1 3.54Å; R2552-V2556 WeakPolarHBondContact O-CG2 2.97Å; R2552-V2556 PolarHBondContact O-N 3.33Å; R2553-V2556 WeakPolarHBondContact O-CB 3.49Å; R2553-V2556 PolarHBondContact O-N 2.79Å; L2554-V2556 VanDerWaalsContact C-N 3.32Å; L2554-V2556 PolarHBondContact O-N 3.27Å; V2556-R2558 PolarHBondContact O-N 3.03Å; V2556-H2559 PolarHBondContact O-N 3.33Å; V2556-I2560 HydrophobicContact CG1-CD1 4.24Å; V2556-I2560 WeakPolarHBondContact O-CG1 3.05Å; V2556-I2560 PolarHBondContact O-N 3.05Å
2557	Y	85.7	Confident	76.2	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-54	-38.9	177.1	-83.6	-76.5	0	0	0	113	I2428 L2492 Q2495 L2496 R2553 L2554 I2560 G2561 L2569	I2428-Y2557 HydrophobicContact CD1-CD1 3.72Å; I2428-Y2557 HydrophobicContact CD1-CD2 3.38Å; I2428-Y2557 HydrophobicContact CD1-CE1 3.88Å; I2428-Y2557 HydrophobicContact CD1-CE2 3.58Å; I2428-Y2557 HydrophobicContact CD1-CG 3.47Å; I2428-Y2557 VanDerWaalsContact CD1-CG 3.47Å; I2428-Y2557 HydrophobicContact CG1-CD2 4.26Å; I2428-Y2557 HydrophobicContact CG1-CE1 4.35Å; I2428-Y2557 HydrophobicContact CG1-CE2 3.97Å; I2428-Y2557 HydrophobicContact CG2-CD1 4.42Å; I2428-Y2557 HydrophobicContact CG2-CE1 3.75Å; L2492-Y2557 HydrophobicContact CD2-CD1 4.34Å; L2492-Y2557 HydrophobicContact CD2-CE1 3.97Å; Q2495-Y2557 HydrophobicContact CB-CE1 4.32Å; Q2495-Y2557 VanDerWaalsContact CB-OH 3.3Å; Q2495-Y2557 WeakPolarHBondContact CB-OH 3.23Å; L2496-Y2557 HydrophobicContact CB-CD1 4.23Å; L2496-Y2557 HydrophobicContact CB-CE1 4.11Å; L2496-Y2557 HydrophobicContact CD1-CD1 4.2Å; L2496-Y2557 HydrophobicContact CD1-CD2 3.54Å; L2496-Y2557 HydrophobicContact CD1-CE2 3.88Å; L2496-Y2557 HydrophobicContact CD1-CG 3.7Å; L2496-Y2557 HydrophobicContact CD2-CD1 4.41Å; L2496-Y2557 HydrophobicContact CD2-CG 4.36Å; L2496-Y2557 HydrophobicContact CG-CG 4.44Å; R2553-Y2557 HydrophobicContact CG-CE2 4.31Å; R2553-Y2557 WeakPolarHBondContact O-CD2 3.31Å; R2553-Y2557 PolarHBondContact O-N 3.47Å; R2553-Y2557 VanDerWaalsContact O-N 3.15Å; L2554-Y2557 PolarHBondContact O-N 3.44Å; Y2557-I2560 WeakPolarHBondContact O-CB 3.17Å; Y2557-I2560 PolarHBondContact O-N 3.15Å; Y2557-G2561 PolarHBondContact O-N 2.91Å; Y2557-L2569 HydrophobicContact CD1-CD1 4.21Å
2558	R	83.9	Confident	77.4	Confident	73 Å²	73	35.3 Å²	35.3	28%	0.275	17%	0.174	S	C	.	.	H	α-helix	trans	-69	-42.1	176.6	-178.4	-167.2	173.4	-146	-4.8	112.4	L2554 D2555 V2556 I2560 G2561 V2562 E2570 A2573 I2577	L2554-R2558 PolarHBondContact O-N 2.9Å; D2555-R2558 PolarHBondContact O-N 3.14Å; V2556-R2558 PolarHBondContact O-N 3.03Å; R2558-I2560 PolarHBondContact O-N 3.33Å; R2558-G2561 WeakPolarHBondContact O-CA 3.29Å; R2558-G2561 PolarHBondContact O-N 3.13Å; R2558-V2562 PolarHBondContact O-N 3.14Å; R2558-E2570 HydrophobicContact CG-CG 3.54Å; R2558-E2570 IonicContact CZ-OE1 3.26Å; R2558-E2570 IonicContact NE-OE1 3.84Å; R2558-E2570 PolarHBondContact NE-OE1 3.31Å; R2558-E2570 IonicContact NH2-OE1 3.59Å; R2558-E2570 PolarHBondContact NH2-OE1 3.48Å; R2558-E2570 VanDerWaalsContact NH2-OE1 3.07Å; R2558-A2573 HydrophobicContact CB-CB 3.75Å; R2558-A2573 VanDerWaalsContact N-CB 3.27Å; R2558-I2577 HydrophobicContact CB-CD1 3.27Å; R2558-I2577 HydrophobicContact CG-CD1 3.96Å
2559	H	76.5	Confident	78.6	Confident	50 Å²	50	33.9 Å²	33.9	23%	0.231	17%	0.167	C	C	.	.	H	α-helix	trans	-65.2	-31.1	176.2	-71.9	89	0	0	0	111.4	L2341 P2342 D2555 V2556 V2562 H2563	L2341-H2559 HydrophobicContact CD2-CB 3.87Å; L2341-H2559 WeakPolarHBondContact CD2-O 3.16Å; P2342-H2559 HydrophobicContact CB-CB 4.17Å; P2342-H2559 HydrophobicContact CG-CB 3.87Å; D2555-H2559 PolarHBondContact O-N 3.29Å; D2555-H2559 VanDerWaalsContact O-N 3.14Å; D2555-H2559 PolarHBondContact O-ND1 3.04Å; D2555-H2559 IonicContact OD1-CE1 2.7Å; D2555-H2559 IonicContact OD1-ND1 3.76Å; D2555-H2559 IonicContact OD2-CE1 3.63Å; D2555-H2559 PolarHBondContact OD2-CE1 3.31Å; D2555-H2559 IonicContact OD2-ND1 3.66Å; V2556-H2559 PolarHBondContact O-N 3.33Å; H2559-V2562 PolarHBondContact O-N 3.06Å; H2559-H2563 WeakPolarHBondContact O-CB 3.43Å; H2559-H2563 PolarHBondContact O-CD2 2.62Å; H2559-H2563 VanDerWaalsContact O-CD2 3.27Å; H2559-H2563 PolarHBondContact O-N 3.23Å
2560	I	81.2	Confident	79.7	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.3	-48.9	168	-63.3	164.8	0	0	0	109.8	L2341 I2428 V2446 L2492 V2556 Y2557 R2558 V2562 H2563 F2564 F2566 L2569	L2341-I2560 HydrophobicContact CD1-CD1 4.48Å; L2341-I2560 HydrophobicContact CD1-CG1 3.59Å; L2341-I2560 HydrophobicContact CD2-CB 4.32Å; L2341-I2560 HydrophobicContact CD2-CG1 3.79Å; L2341-I2560 VanDerWaalsContact CD2-N 3.31Å; L2341-I2560 HydrophobicContact CG-CG1 4.32Å; I2428-I2560 HydrophobicContact CB-CD1 4.08Å; I2428-I2560 HydrophobicContact CD1-CD1 3.59Å; I2428-I2560 HydrophobicContact CG1-CD1 4.44Å; I2428-I2560 HydrophobicContact CG2-CD1 4.14Å; V2446-I2560 HydrophobicContact CB-CD1 4.23Å; V2446-I2560 HydrophobicContact CG1-CD1 3.71Å; V2446-I2560 HydrophobicContact CG1-CG1 4.01Å; V2446-I2560 HydrophobicContact CG1-CG2 3.76Å; L2492-I2560 HydrophobicContact CD1-CG2 3.9Å; V2556-I2560 HydrophobicContact CG1-CD1 4.24Å; V2556-I2560 WeakPolarHBondContact O-CG1 3.05Å; V2556-I2560 PolarHBondContact O-N 3.05Å; Y2557-I2560 WeakPolarHBondContact O-CB 3.17Å; Y2557-I2560 PolarHBondContact O-N 3.15Å; R2558-I2560 PolarHBondContact O-N 3.33Å; I2560-V2562 PolarHBondContact O-N 3.2Å; I2560-H2563 PolarHBondContact O-N 2.98Å; I2560-F2564 HydrophobicContact CG2-CD2 4.2Å; I2560-F2564 PolarHBondContact O-N 3.22Å; I2560-F2564 VanDerWaalsContact O-N 3.09Å; I2560-F2566 HydrophobicContact CG2-CD2 4.29Å; I2560-L2569 HydrophobicContact CB-CD2 4.13Å; I2560-L2569 HydrophobicContact CG2-CD2 3.75Å
2561	G	80.2	Confident	80.3	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-46.3	-58.1	171.8	0	0	0	0	0	113.7	Y2557 R2558 G2565 F2566	Y2557-G2561 PolarHBondContact O-N 2.91Å; R2558-G2561 WeakPolarHBondContact O-CA 3.29Å; R2558-G2561 PolarHBondContact O-N 3.13Å; G2561-G2565 PolarHBondContact O-N 3.03Å; G2561-F2566 WeakPolarHBondContact CA-O 3.42Å; G2561-F2566 PolarHBondContact O-N 3.47Å
2562	V	73.8	Confident	80.8	Confident	73 Å²	73	41 Å²	41	44%	0.442	20%	0.198	S	C	.	.	H	α-helix	trans	-61.4	-49.1	-179.1	178.3	0	0	0	0	112.5	R2558 H2559 I2560 E2570	R2558-V2562 PolarHBondContact O-N 3.14Å; H2559-V2562 PolarHBondContact O-N 3.06Å; I2560-V2562 PolarHBondContact O-N 3.2Å; V2562-E2570 HydrophobicContact CG2-CG 3.75Å
2563	H	71.1	Confident	81.3	Confident	72 Å²	72	40.2 Å²	40.2	33%	0.333	20%	0.195	S	C	.	.	H	α-helix	trans	-77.2	-29.2	-169	-82.4	-78.1	0	0	0	114	L2341 H2559 I2560	L2341-H2563 HydrophobicContact CD2-CB 4.33Å; H2559-H2563 WeakPolarHBondContact O-CB 3.43Å; H2559-H2563 PolarHBondContact O-CD2 2.62Å; H2559-H2563 VanDerWaalsContact O-CD2 3.27Å; H2559-H2563 PolarHBondContact O-N 3.23Å; I2560-H2563 PolarHBondContact O-N 2.98Å
2564	F	76.1	Confident	81.6	Confident	11 Å²	11	42.7 Å²	42.7	5%	0.048	21%	0.205	C	C	.	.	H	α-helix	trans	-99.6	-4.9	-179.9	-70.6	-89.5	0	0	0	113.6	L2341 V2452 W2472 W2474 R2485 I2560 F2566	L2341-F2564 HydrophobicContact CD1-CE2 3.98Å; L2341-F2564 HydrophobicContact CG-CE2 4.5Å; V2452-F2564 HydrophobicContact CG1-CE1 3.94Å; W2472-F2564 HydrophobicContact CB-CD1 3.8Å; W2472-F2564 HydrophobicContact CB-CE1 3.81Å; W2474-F2564 HydrophobicContact CD2-CE1 4.41Å; W2474-F2564 HydrophobicContact CE3-CD1 4.16Å; W2474-F2564 HydrophobicContact CE3-CE1 4.23Å; W2474-F2564 HydrophobicContact CH2-CB 4.3Å; W2474-F2564 AromaticContact CH2-CD1 3.22Å; W2474-F2564 HydrophobicContact CH2-CD1 3.22Å; W2474-F2564 AromaticContact CH2-CD2 3.75Å; W2474-F2564 HydrophobicContact CH2-CD2 3.75Å; W2474-F2564 AromaticContact CH2-CE1 3.27Å; W2474-F2564 HydrophobicContact CH2-CE1 3.27Å; W2474-F2564 AromaticContact CH2-CE2 3.81Å; W2474-F2564 HydrophobicContact CH2-CE2 3.81Å; W2474-F2564 AromaticContact CH2-CG 3.46Å; W2474-F2564 HydrophobicContact CH2-CG 3.46Å; W2474-F2564 VanDerWaalsContact CH2-CG 3.46Å; W2474-F2564 AromaticContact CH2-CZ 3.58Å; W2474-F2564 HydrophobicContact CH2-CZ 3.58Å; W2474-F2564 AromaticContact CZ2-CD1 3.92Å; W2474-F2564 HydrophobicContact CZ2-CD1 3.92Å; W2474-F2564 HydrophobicContact CZ2-CD2 4.36Å; W2474-F2564 AromaticContact CZ2-CE1 3.43Å; W2474-F2564 HydrophobicContact CZ2-CE1 3.43Å; W2474-F2564 VanDerWaalsContact CZ2-CE1 3.43Å; W2474-F2564 AromaticContact CZ2-CE2 3.95Å; W2474-F2564 HydrophobicContact CZ2-CE2 3.95Å; W2474-F2564 HydrophobicContact CZ2-CG 4.35Å; W2474-F2564 AromaticContact CZ2-CZ 3.45Å; W2474-F2564 HydrophobicContact CZ2-CZ 3.45Å; W2474-F2564 VanDerWaalsContact CZ2-CZ 3.45Å; W2474-F2564 HydrophobicContact CZ3-CB 4.37Å; W2474-F2564 AromaticContact CZ3-CD1 3.36Å; W2474-F2564 HydrophobicContact CZ3-CD1 3.36Å; W2474-F2564 AromaticContact CZ3-CE1 3.7Å; W2474-F2564 HydrophobicContact CZ3-CE1 3.7Å; W2474-F2564 AromaticContact CZ3-CG 3.85Å; W2474-F2564 HydrophobicContact CZ3-CG 3.85Å; W2474-F2564 HydrophobicContact CZ3-CZ 4.44Å; R2485-F2564 PolarHBondContact NH2-O 3.13Å; I2560-F2564 HydrophobicContact CG2-CD2 4.2Å; I2560-F2564 PolarHBondContact O-N 3.22Å; I2560-F2564 VanDerWaalsContact O-N 3.09Å; F2564-F2566 HydrophobicContact CB-CD2 3.86Å; F2564-F2566 HydrophobicContact CB-CE2 3.85Å; F2564-F2566 HydrophobicContact CB-CG 4.35Å; F2564-F2566 HydrophobicContact CB-CZ 4.33Å
2565	G	73.1	Confident	81.6	Confident	40 Å²	40	43.7 Å²	43.7	41%	0.412	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	43.9	-178.9	0	0	0	0	0	112.2	R2485 G2561	R2485-G2565 PolarHBondContact NH2-O 3.38Å; G2561-G2565 PolarHBondContact O-N 3.03Å
2566	F	85	Confident	81.7	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.205	C	C	.	.			trans	-103.2	86.1	173.7	-66.6	-32.7	0	0	0	107.6	W2474 R2485 L2488 E2489 L2492 I2560 G2561 F2564 Y2568 L2569 E2570	W2474-F2566 HydrophobicContact CH2-CE2 4.17Å; W2474-F2566 AromaticContact CZ3-CE2 3.77Å; W2474-F2566 HydrophobicContact CZ3-CE2 3.77Å; W2474-F2566 AromaticContact CZ3-CZ 3.85Å; W2474-F2566 HydrophobicContact CZ3-CZ 3.85Å; R2485-F2566 HydrophobicContact CB-CE1 4.03Å; R2485-F2566 HydrophobicContact CG-CE1 4.48Å; R2485-F2566 WeakPolarHBondContact O-CE1 3.48Å; L2488-F2566 HydrophobicContact CB-CZ 4.06Å; E2489-F2566 HydrophobicContact CB-CB 4.34Å; E2489-F2566 HydrophobicContact CB-CD1 3.7Å; E2489-F2566 HydrophobicContact CB-CD2 4.46Å; E2489-F2566 HydrophobicContact CB-CE1 4Å; E2489-F2566 HydrophobicContact CB-CG 3.95Å; E2489-F2566 VanDerWaalsContact CD-CB 3.42Å; E2489-F2566 HydrophobicContact CG-CB 3.95Å; E2489-F2566 HydrophobicContact CG-CD1 4.19Å; E2489-F2566 HydrophobicContact CG-CG 4.13Å; E2489-F2566 WeakPolarHBondContact OE1-CA 3.44Å; E2489-F2566 WeakPolarHBondContact OE1-CB 3.49Å; E2489-F2566 WeakPolarHBondContact OE2-CA 3.38Å; E2489-F2566 WeakPolarHBondContact OE2-CD1 3.47Å; L2492-F2566 HydrophobicContact CD1-CD2 4.18Å; L2492-F2566 HydrophobicContact CD1-CE2 3.92Å; I2560-F2566 HydrophobicContact CG2-CD2 4.29Å; G2561-F2566 WeakPolarHBondContact CA-O 3.42Å; G2561-F2566 PolarHBondContact O-N 3.47Å; F2564-F2566 HydrophobicContact CB-CD2 3.86Å; F2564-F2566 HydrophobicContact CB-CE2 3.85Å; F2564-F2566 HydrophobicContact CB-CG 4.35Å; F2564-F2566 HydrophobicContact CB-CZ 4.33Å; F2566-Y2568 VanDerWaalsContact C-N 3.32Å; F2566-Y2568 PolarHBondContact O-N 3.22Å; F2566-L2569 HydrophobicContact CB-CB 3.84Å; F2566-L2569 HydrophobicContact CB-CD2 4.44Å; F2566-L2569 HydrophobicContact CD2-CD2 4.17Å; F2566-L2569 PolarHBondContact O-N 2.95Å; F2566-E2570 PolarHBondContact O-N 3.42Å
2567	E	80.3	Confident	81.7	Confident	146 Å²	146	42.7 Å²	42.7	68%	0.682	20%	0.203	S	C	*	.	H	α-helix	trans	-66.8	-30.9	-171.9	-67.4	-169.7	178.1	0	0	113.1	E2489 Q2571	E2489-E2567 PolarHBondContact OE1-N 2.81Å; E2567-Q2571 VanDerWaalsContact O-CB 3.29Å; E2567-Q2571 WeakPolarHBondContact O-CB 3.46Å; E2567-Q2571 WeakPolarHBondContact O-CG 3.26Å; E2567-Q2571 PolarHBondContact O-N 3.4Å; E2567-Q2571 PolarHBondContact O-NE2 3.18Å
2568	Y	86.2	Confident	81.2	Confident	138 Å²	138	43.8 Å²	43.8	54%	0.541	21%	0.208	S	C	.	.	H	α-helix	trans	-78.5	-37.3	179	-169.3	-128.6	0	0	0	110.4	E2489 V2493 F2566 Q2571 I2572	E2489-Y2568 WeakPolarHBondContact OE1-CA 3.18Å; E2489-Y2568 VanDerWaalsContact OE1-CB 3.29Å; E2489-Y2568 WeakPolarHBondContact OE1-CB 3.38Å; E2489-Y2568 PolarHBondContact OE1-N 3.28Å; V2493-Y2568 HydrophobicContact CG1-CD1 4.43Å; V2493-Y2568 HydrophobicContact CG1-CE1 4.09Å; V2493-Y2568 HydrophobicContact CG2-CD1 3.96Å; V2493-Y2568 HydrophobicContact CG2-CE1 4.44Å; F2566-Y2568 VanDerWaalsContact C-N 3.32Å; F2566-Y2568 PolarHBondContact O-N 3.22Å; Y2568-Q2571 PolarHBondContact O-N 3.06Å; Y2568-I2572 HydrophobicContact CD1-CD1 4.02Å; Y2568-I2572 HydrophobicContact CD2-CD1 4.21Å; Y2568-I2572 HydrophobicContact CD2-CG1 4.45Å; Y2568-I2572 HydrophobicContact CE1-CD1 3.58Å; Y2568-I2572 HydrophobicContact CE2-CD1 3.79Å; Y2568-I2572 HydrophobicContact CE2-CG1 4.26Å; Y2568-I2572 HydrophobicContact CG-CD1 4.31Å; Y2568-I2572 VanDerWaalsContact CZ-CD1 3.47Å; Y2568-I2572 WeakPolarHBondContact O-CG1 3.15Å; Y2568-I2572 PolarHBondContact O-N 3.02Å
2569	L	89.3	Confident	80.4	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.3	-44	170.1	-173.1	68.3	0	0	0	112.2	E2489 L2492 V2493 L2496 Y2557 I2560 F2566 Q2571 I2572 A2573	E2489-L2569 HydrophobicContact CG-CB 4.26Å; E2489-L2569 PolarHBondContact OE1-N 2.84Å; L2492-L2569 HydrophobicContact CB-CD1 3.82Å; L2492-L2569 HydrophobicContact CB-CD2 3.71Å; L2492-L2569 HydrophobicContact CB-CG 4.39Å; L2492-L2569 HydrophobicContact CD1-CD2 3.75Å; L2492-L2569 HydrophobicContact CG-CD2 4.23Å; V2493-L2569 HydrophobicContact CG2-CB 4.2Å; V2493-L2569 HydrophobicContact CG2-CD1 3.83Å; L2496-L2569 HydrophobicContact CD2-CD1 3.72Å; Y2557-L2569 HydrophobicContact CD1-CD1 4.21Å; I2560-L2569 HydrophobicContact CB-CD2 4.13Å; I2560-L2569 HydrophobicContact CG2-CD2 3.75Å; F2566-L2569 HydrophobicContact CB-CB 3.84Å; F2566-L2569 HydrophobicContact CB-CD2 4.44Å; F2566-L2569 HydrophobicContact CD2-CD2 4.17Å; F2566-L2569 PolarHBondContact O-N 2.95Å; L2569-Q2571 VanDerWaalsContact C-N 3.27Å; L2569-Q2571 PolarHBondContact O-N 3Å; L2569-I2572 PolarHBondContact O-N 3.38Å; L2569-A2573 WeakPolarHBondContact O-CB 3.47Å; L2569-A2573 PolarHBondContact O-N 3.39Å
2570	E	85.1	Confident	79.9	Confident	57 Å²	57	39 Å²	39	27%	0.266	19%	0.191	S	C	.	.	H	α-helix	trans	-59	-46.2	173.1	-164	-160.2	166.2	0	0	109.1	R2558 V2562 F2566 A2573 Y2574	R2558-E2570 HydrophobicContact CG-CG 3.54Å; R2558-E2570 IonicContact CZ-OE1 3.26Å; R2558-E2570 IonicContact NE-OE1 3.84Å; R2558-E2570 PolarHBondContact NE-OE1 3.31Å; R2558-E2570 IonicContact NH2-OE1 3.59Å; R2558-E2570 PolarHBondContact NH2-OE1 3.48Å; R2558-E2570 VanDerWaalsContact NH2-OE1 3.07Å; V2562-E2570 HydrophobicContact CG2-CG 3.75Å; F2566-E2570 PolarHBondContact O-N 3.42Å; E2570-A2573 PolarHBondContact O-N 3.15Å; E2570-Y2574 WeakPolarHBondContact O-CA 3.18Å; E2570-Y2574 WeakPolarHBondContact O-CB 3.21Å; E2570-Y2574 PolarHBondContact O-N 2.85Å
2571	Q	87.5	Confident	79	Confident	114 Å²	114	39.1 Å²	39.1	53%	0.533	19%	0.192	S	C	.	.	H	α-helix	trans	-60.1	-52.2	179.7	-78.7	171.6	70.7	0	0	111.5	E2567 Y2568 L2569 A2573 Y2574 W2575	E2567-Q2571 VanDerWaalsContact O-CB 3.29Å; E2567-Q2571 WeakPolarHBondContact O-CB 3.46Å; E2567-Q2571 WeakPolarHBondContact O-CG 3.26Å; E2567-Q2571 PolarHBondContact O-N 3.4Å; E2567-Q2571 PolarHBondContact O-NE2 3.18Å; Y2568-Q2571 PolarHBondContact O-N 3.06Å; L2569-Q2571 VanDerWaalsContact C-N 3.27Å; L2569-Q2571 PolarHBondContact O-N 3Å; Q2571-A2573 PolarHBondContact O-N 2.89Å; Q2571-Y2574 CarbonylContact O-C 3.55Å; Q2571-W2575 WeakPolarHBondContact O-CA 3.38Å; Q2571-W2575 WeakPolarHBondContact O-CB 3.47Å; Q2571-W2575 PolarHBondContact O-N 3.23Å
2572	I	86.4	Confident	77.4	Confident	6 Å²	6	39.2 Å²	39.2	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-66.9	-35.5	-179	-67.2	176.7	0	0	0	112.3	V2493 L2496 Y2568 L2569 W2575 L2576	V2493-I2572 HydrophobicContact CG1-CD1 3.53Å; V2493-I2572 HydrophobicContact CG2-CD1 4.21Å; L2496-I2572 HydrophobicContact CD2-CB 4.21Å; L2496-I2572 HydrophobicContact CD2-CG2 3.69Å; L2496-I2572 HydrophobicContact CG-CG2 4.2Å; Y2568-I2572 HydrophobicContact CD1-CD1 4.02Å; Y2568-I2572 HydrophobicContact CD2-CD1 4.21Å; Y2568-I2572 HydrophobicContact CD2-CG1 4.45Å; Y2568-I2572 HydrophobicContact CE1-CD1 3.58Å; Y2568-I2572 HydrophobicContact CE2-CD1 3.79Å; Y2568-I2572 HydrophobicContact CE2-CG1 4.26Å; Y2568-I2572 HydrophobicContact CG-CD1 4.31Å; Y2568-I2572 VanDerWaalsContact CZ-CD1 3.47Å; Y2568-I2572 WeakPolarHBondContact O-CG1 3.15Å; Y2568-I2572 PolarHBondContact O-N 3.02Å; L2569-I2572 PolarHBondContact O-N 3.38Å; I2572-W2575 HydrophobicContact CG1-CE3 4.38Å; I2572-W2575 HydrophobicContact CG2-CE3 4.43Å; I2572-W2575 CarbonylContact O-C 3.38Å; I2572-W2575 VanDerWaalsContact O-CA 3.26Å; I2572-W2575 WeakPolarHBondContact O-CA 3.36Å; I2572-W2575 PolarHBondContact O-N 2.71Å; I2572-W2575 VanDerWaalsContact O-N 3.14Å; I2572-L2576 PolarHBondContact O-N 3.49Å
2573	A	84.3	Confident	77.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-76.7	-46	178.1	0	0	0	0	0	111.7	L2496 R2558 L2569 E2570 Q2571 W2575 L2576 I2577	L2496-A2573 HydrophobicContact CD2-CB 3.71Å; R2558-A2573 HydrophobicContact CB-CB 3.75Å; R2558-A2573 VanDerWaalsContact N-CB 3.27Å; L2569-A2573 WeakPolarHBondContact O-CB 3.47Å; L2569-A2573 PolarHBondContact O-N 3.39Å; E2570-A2573 PolarHBondContact O-N 3.15Å; Q2571-A2573 PolarHBondContact O-N 2.89Å; A2573-W2575 PolarHBondContact O-N 2.99Å; A2573-W2575 VanDerWaalsContact O-N 3.09Å; A2573-L2576 PolarHBondContact O-N 3.46Å; A2573-I2577 WeakPolarHBondContact O-CB 3.46Å; A2573-I2577 WeakPolarHBondContact O-CD1 3.15Å; A2573-I2577 WeakPolarHBondContact O-CG1 3.24Å; A2573-I2577 PolarHBondContact O-N 2.96Å
2574	Y	84.9	Confident	77.9	Confident	85 Å²	85	35.7 Å²	35.7	33%	0.333	17%	0.171	S	C	.	.	H	α-helix	trans	-55.5	-24	163.6	-177.1	-105.5	0	0	0	111	K786 E2570 Q2571 I2577 Q2578	K786-Y2574 VanDerWaalsContact CE-CE2 3.49Å; E2570-Y2574 WeakPolarHBondContact O-CA 3.18Å; E2570-Y2574 WeakPolarHBondContact O-CB 3.21Å; E2570-Y2574 PolarHBondContact O-N 2.85Å; Q2571-Y2574 CarbonylContact O-C 3.55Å; Y2574-I2577 CarbonylContact O-C 3.56Å; Y2574-Q2578 HydrophobicContact CD1-CG 3.67Å; Y2574-Q2578 HydrophobicContact CE1-CG 3.48Å; Y2574-Q2578 VanDerWaalsContact CE1-CG 3.48Å; Y2574-Q2578 HydrophobicContact CG-CG 4.28Å; Y2574-Q2578 VanDerWaalsContact O-CA 3.25Å; Y2574-Q2578 WeakPolarHBondContact O-CA 3.07Å; Y2574-Q2578 VanDerWaalsContact O-CB 3.3Å; Y2574-Q2578 WeakPolarHBondContact O-CB 3.28Å; Y2574-Q2578 WeakPolarHBondContact O-CG 3.2Å; Y2574-Q2578 PolarHBondContact O-N 3.12Å; Y2574-Q2578 PolarHBondContact OH-NE2 3.24Å; Y2574-Q2578 VanDerWaalsContact OH-NE2 3.12Å
2575	W	83.8	Confident	78	Confident	23 Å²	23	37.1 Å²	37.1	9%	0.087	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	24	176.3	-172.7	72.6	0	0	0	113.9	D790 R793 R794 Q2571 I2572 A2573	D790-W2575 HydrophobicContact CB-CZ2 4.4Å; D790-W2575 WeakPolarHBondContact O-CZ2 3.38Å; D790-W2575 PolarHBondContact OD1-NE1 2.69Å; D790-W2575 WeakPolarHBondContact OD2-CA 3.49Å; R793-W2575 HydrophobicContact CB-CH2 4.23Å; R793-W2575 HydrophobicContact CB-CZ2 3.33Å; R793-W2575 VanDerWaalsContact CD-CE2 3.43Å; R793-W2575 HydrophobicContact CG-CH2 4.1Å; R793-W2575 HydrophobicContact CG-CZ2 3.57Å; R793-W2575 VanDerWaalsContact NE-NE1 3.17Å; R794-W2575 HydrophobicContact CB-CH2 3.57Å; R794-W2575 HydrophobicContact CB-CZ2 3.81Å; R794-W2575 HydrophobicContact CG-CH2 4.23Å; R794-W2575 VanDerWaalsContact CZ-CH2 3.43Å; R794-W2575 VanDerWaalsContact CZ-CZ3 3.48Å; R794-W2575 VanDerWaalsContact CZ-O 3.29Å; R794-W2575 VanDerWaalsContact N-CZ2 3.33Å; R794-W2575 PolarHBondContact NH1-O 2.65Å; R794-W2575 PolarHBondContact NH2-O 2.75Å; Q2571-W2575 WeakPolarHBondContact O-CA 3.38Å; Q2571-W2575 WeakPolarHBondContact O-CB 3.47Å; Q2571-W2575 PolarHBondContact O-N 3.23Å; I2572-W2575 HydrophobicContact CG1-CE3 4.38Å; I2572-W2575 HydrophobicContact CG2-CE3 4.43Å; I2572-W2575 CarbonylContact O-C 3.38Å; I2572-W2575 VanDerWaalsContact O-CA 3.26Å; I2572-W2575 WeakPolarHBondContact O-CA 3.36Å; I2572-W2575 PolarHBondContact O-N 2.71Å; I2572-W2575 VanDerWaalsContact O-N 3.14Å; A2573-W2575 PolarHBondContact O-N 2.99Å; A2573-W2575 VanDerWaalsContact O-N 3.09Å
2576	L	81	Confident	78.3	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.9	-34.3	159.3	-88	171.1	0	0	0	110.9	D790 R794 L2496 S2500 L2554 I2572 A2573 G2579	D790-L2576 PolarHBondContact OD2-N 3.34Å; R794-L2576 VanDerWaalsContact NH2-CG 3.27Å; L2496-L2576 HydrophobicContact CD1-CD1 3.37Å; L2496-L2576 HydrophobicContact CD2-CD1 4.35Å; L2496-L2576 HydrophobicContact CG-CD1 3.55Å; S2500-L2576 WeakPolarHBondContact OG-CD2 3.26Å; L2554-L2576 HydrophobicContact CD1-CB 4.02Å; L2554-L2576 HydrophobicContact CD2-CB 3.7Å; L2554-L2576 HydrophobicContact CD2-CD1 3.73Å; L2554-L2576 HydrophobicContact CD2-CG 4.26Å; L2554-L2576 HydrophobicContact CG-CB 4.29Å; I2572-L2576 PolarHBondContact O-N 3.49Å; A2573-L2576 PolarHBondContact O-N 3.46Å; L2576-G2579 WeakPolarHBondContact O-CA 3.18Å; L2576-G2579 PolarHBondContact O-N 3.06Å
2577	I	79.9	Confident	77.8	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-24.1	156.1	-40.5	148.6	0	0	0	108.8	K786 R787 Y2551 L2554 D2555 R2558 A2573 Y2574	K786-I2577 PolarHBondContact NZ-O 3.28Å; R787-I2577 VanDerWaalsContact CZ-O 3.26Å; R787-I2577 PolarHBondContact NE-O 3.41Å; R787-I2577 VanDerWaalsContact NH2-CG2 3.31Å; R787-I2577 PolarHBondContact NH2-O 2.9Å; Y2551-I2577 HydrophobicContact CD2-CG2 4.32Å; Y2551-I2577 HydrophobicContact CE2-CG2 3.52Å; L2554-I2577 HydrophobicContact CB-CG1 3.63Å; L2554-I2577 WeakPolarHBondContact O-CD1 3.31Å; L2554-I2577 WeakPolarHBondContact O-CG1 3.5Å; D2555-I2577 VanDerWaalsContact CA-CD1 3.48Å; D2555-I2577 HydrophobicContact CB-CD1 4.26Å; D2555-I2577 HydrophobicContact CB-CG1 4.45Å; R2558-I2577 HydrophobicContact CB-CD1 3.27Å; R2558-I2577 HydrophobicContact CG-CD1 3.96Å; A2573-I2577 WeakPolarHBondContact O-CB 3.46Å; A2573-I2577 WeakPolarHBondContact O-CD1 3.15Å; A2573-I2577 WeakPolarHBondContact O-CG1 3.24Å; A2573-I2577 PolarHBondContact O-N 2.96Å; Y2574-I2577 CarbonylContact O-C 3.56Å
2578	Q	76.3	Confident	77.7	Confident	28 Å²	28	32.1 Å²	32.1	13%	0.131	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-58.9	161.4	-20.7	-160.8	-68.7	0	0	108.2	K786 R787 D790 Y2574	K786-Q2578 CarbonylContact C-O 3.54Å; K786-Q2578 HydrophobicContact CB-CB 4.13Å; K786-Q2578 HydrophobicContact CG-CB 3.35Å; K786-Q2578 HydrophobicContact CG-CG 3.67Å; K786-Q2578 WeakPolarHBondContact O-CB 3.41Å; K786-Q2578 PolarHBondContact O-OE1 2.98Å; R787-Q2578 WeakPolarHBondContact CA-O 3.28Å; R787-Q2578 WeakPolarHBondContact CB-O 3.5Å; R787-Q2578 WeakPolarHBondContact CD-O 3.33Å; R787-Q2578 WeakPolarHBondContact CG-O 3.45Å; R787-Q2578 PolarHBondContact N-O 3.25Å; R787-Q2578 VanDerWaalsContact N-O 3.14Å; R787-Q2578 PolarHBondContact NE-O 2.97Å; R787-Q2578 VanDerWaalsContact NE-O 3.1Å; D790-Q2578 WeakPolarHBondContact OD1-CB 3.13Å; D790-Q2578 PolarHBondContact OD1-OE1 2.77Å; D790-Q2578 WeakPolarHBondContact OD2-CA 3.34Å; D790-Q2578 WeakPolarHBondContact OD2-CB 3.15Å; D790-Q2578 PolarHBondContact OD2-N 2.75Å; Y2574-Q2578 HydrophobicContact CD1-CG 3.67Å; Y2574-Q2578 HydrophobicContact CE1-CG 3.48Å; Y2574-Q2578 VanDerWaalsContact CE1-CG 3.48Å; Y2574-Q2578 HydrophobicContact CG-CG 4.28Å; Y2574-Q2578 VanDerWaalsContact O-CA 3.25Å; Y2574-Q2578 WeakPolarHBondContact O-CA 3.07Å; Y2574-Q2578 VanDerWaalsContact O-CB 3.3Å; Y2574-Q2578 WeakPolarHBondContact O-CB 3.28Å; Y2574-Q2578 WeakPolarHBondContact O-CG 3.2Å; Y2574-Q2578 PolarHBondContact O-N 3.12Å; Y2574-Q2578 PolarHBondContact OH-NE2 3.24Å; Y2574-Q2578 VanDerWaalsContact OH-NE2 3.12Å
2579	G	67.3	Low	77.1	Confident	6 Å²	6	24.6 Å²	24.6	6%	0.062	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	22.1	-96.8	153.6	0	0	0	0	0	134.8	R787 D790 L2576	R787-G2579 VanDerWaalsContact CG-CA 3.44Å; R787-G2579 WeakPolarHBondContact CG-O 3.18Å; D790-G2579 VanDerWaalsContact CB-CA 3.49Å; D790-G2579 PolarHBondContact OD2-N 2.92Å; L2576-G2579 WeakPolarHBondContact O-CA 3.18Å; L2576-G2579 PolarHBondContact O-N 3.06Å
2580	L	65.9	Low	76.1	Confident	17 Å²	17	26.5 Å²	26.5	9%	0.089	12%	0.121	C	C	.	.	S	Bend	trans	-73.7	-43.5	163.6	-69.6	54.5	0	0	0	127.3	Q747 V2550 L2554 Q2582	Q747-L2580 HydrophobicContact CG-CB 4.35Å; V2550-L2580 HydrophobicContact CB-CD2 4.18Å; V2550-L2580 HydrophobicContact CG1-CD2 3.49Å; V2550-L2580 VanDerWaalsContact CG1-CD2 3.49Å; L2554-L2580 HydrophobicContact CD1-CD2 4.49Å; L2580-Q2582 PolarHBondContact O-N 2.82Å; L2580-Q2582 VanDerWaalsContact O-N 3.07Å
2581	Q	61.6	Low	75.4	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.009	11%	0.109	C	C	.	.			trans	-63.2	49.5	163.9	-56.7	153.2	-33.2	0	0	112.5	L748 E751 F753 V783 R787 Y2551	L748-Q2581 HydrophobicContact CD2-CB 3.73Å; L748-Q2581 HydrophobicContact CD2-CG 4.43Å; L748-Q2581 VanDerWaalsContact CG-C 3.42Å; L748-Q2581 HydrophobicContact CG-CB 4.25Å; E751-Q2581 HydrophobicContact CB-CG 3.99Å; E751-Q2581 VanDerWaalsContact CD-CG 3.49Å; E751-Q2581 HydrophobicContact CG-CG 4.34Å; E751-Q2581 WeakPolarHBondContact OE2-CA 3.33Å; E751-Q2581 WeakPolarHBondContact OE2-CB 3.4Å; E751-Q2581 WeakPolarHBondContact OE2-CG 3.47Å; E751-Q2581 PolarHBondContact OE2-N 3.35Å; F753-Q2581 HydrophobicContact CD1-CG 4.45Å; F753-Q2581 HydrophobicContact CE1-CB 3.97Å; F753-Q2581 HydrophobicContact CE1-CG 3.44Å; F753-Q2581 VanDerWaalsContact CE1-CG 3.44Å; F753-Q2581 HydrophobicContact CZ-CB 4.05Å; F753-Q2581 HydrophobicContact CZ-CG 3.54Å; V783-Q2581 HydrophobicContact CG1-CB 3.77Å; V783-Q2581 WeakPolarHBondContact CG1-O 3.46Å; R787-Q2581 WeakPolarHBondContact CB-O 3.35Å; R787-Q2581 HydrophobicContact CG-CB 4.16Å; R787-Q2581 VanDerWaalsContact NE-CA 3.29Å; Y2551-Q2581 HydrophobicContact CD2-CG 4.02Å; Y2551-Q2581 VanDerWaalsContact CD2-NE2 3.27Å; Y2551-Q2581 HydrophobicContact CE2-CG 4.27Å
2582	Q	45.8	Very low	74.3	Confident	3 Å²	3	15.7 Å²	15.7	1%	0.014	7%	0.07	C	C	.	.			trans	-127.5	0	141.3	-93.9	177.2	43.5	0	0	103.3	I744 H745 L748 V783 E784 K785 R787 I788 L2580	I744-Q2582 CarbonylContact C-O 3.38Å; I744-Q2582 WeakPolarHBondContact CA-OXT 3.49Å; I744-Q2582 WeakPolarHBondContact CB-OXT 3.31Å; I744-Q2582 HydrophobicContact CG2-CB 3.45Å; I744-Q2582 VanDerWaalsContact CG2-CB 3.45Å; I744-Q2582 WeakPolarHBondContact CG2-O 3.4Å; I744-Q2582 WeakPolarHBondContact CG2-OXT 3.44Å; I744-Q2582 CarbonylContact O-C 3.48Å; H745-Q2582 WeakPolarHBondContact CA-O 3.31Å; H745-Q2582 PolarHBondContact N-O 3.43Å; L748-Q2582 WeakPolarHBondContact CB-O 3.5Å; L748-Q2582 WeakPolarHBondContact CD1-O 3.44Å; L748-Q2582 VanDerWaalsContact CG-CA 3.49Å; L748-Q2582 WeakPolarHBondContact CG-O 3.3Å; V783-Q2582 VanDerWaalsContact O-CG 3.28Å; V783-Q2582 WeakPolarHBondContact O-CG 3.41Å; V783-Q2582 PolarHBondContact O-NE2 3.49Å; E784-Q2582 HydrophobicContact CB-CG 3.74Å; E784-Q2582 HydrophobicContact CG-CG 3.96Å; E784-Q2582 PolarHBondContact O-NE2 3.36Å; E784-Q2582 PolarHBondContact O-OE1 3.38Å; K785-Q2582 PolarHBondContact O-NE2 3.24Å; R787-Q2582 HydrophobicContact CB-CB 3.61Å; R787-Q2582 HydrophobicContact CB-CG 3.54Å; R787-Q2582 HydrophobicContact CG-CB 4.45Å; I788-Q2582 HydrophobicContact CG1-CB 4.08Å; I788-Q2582 VanDerWaalsContact N-OE1 3.08Å; L2580-Q2582 PolarHBondContact O-N 2.82Å; L2580-Q2582 VanDerWaalsContact O-N 3.07Å

Retrieved 2,582 of 2,582 residues in 1309.7 ms (Link to these results)

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