A0A087YHZ3_POEFO Loading...

Synaptic vesicle glycoprotein 2Ba

AlphaFold DB , UniProt , Accession A0A087YHZ3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 689 aa.

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(Predicted Aligned Error values between residue pairs)

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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	35.5	Very low	31.2	Very low	238 Å²	238	156.9 Å²	156.9	100%	1.172	80%	0.802	S	S	*	*				0	84.2	0	-106.5	175.8	174	0	0	104
2	D	32.3	Very low	30.6	Very low	144 Å²	144	156.1 Å²	156.1	77%	0.77	79%	0.793	S	S	*	*			trans	-132.6	133.9	-154.8	-61.8	-76.7	0	0	0	105.9
3	D	34.9	Very low	30.1	Very low	166 Å²	166	156.5 Å²	156.5	89%	0.888	79%	0.793	S	S	*	*			trans	-165.1	111.5	140.1	-116.9	-12.8	0	0	0	111.7
4	P	48.2	Very low	29.7	Very low	91 Å²	91	153.5 Å²	153.5	59%	0.591	79%	0.787	S	S	*	*			trans	-119.9	-176.4	151.8	24.6	-4.2	0	0	0	111.2
5	Y	29.8	Very low	29.4	Very low	205 Å²	205	155.7 Å²	155.7	80%	0.804	79%	0.792	S	S	*	*			trans	90.2	144.6	169.1	-69.8	-94.9	0	0	0	116.7
6	H	31.5	Very low	29.1	Very low	139 Å²	139	151.4 Å²	151.4	64%	0.644	80%	0.799	S	S	*	*			cis	178.8	160.2	-23.8	-136.4	-76.5	0	0	0	106.8
7	N	28.8	Very low	28.9	Very low	138 Å²	138	146.6 Å²	146.6	74%	0.738	79%	0.794	S	S	*	*			trans	89.3	126.5	142.9	-79.4	-20.4	0	0	0	124.4
8	N	26.6	Very low	28.6	Very low	148 Å²	148	149.2 Å²	149.2	79%	0.791	80%	0.8	S	S	*	*			trans	-57.9	158.2	154.1	-69.9	-38.2	0	0	0	113.6
9	V	27.6	Very low	28.6	Very low	139 Å²	139	152.8 Å²	152.8	84%	0.842	80%	0.803	S	S	*	*				168.1	141.2	111.2	165.4	0	0	0	0	111.7
10	N	24.3	Very low	28.5	Very low	147 Å²	147	152 Å²	152	79%	0.786	80%	0.804	S	S	*	*			trans	-39.2	149.3	175	-61.2	-38.3	0	0	0	120.2
11	Q	24.3	Very low	28.5	Very low	171 Å²	171	155.3 Å²	155.3	80%	0.799	81%	0.808	S	S	*	*				178	127.1	111.8	-102.3	178.1	-10.9	0	0	115.5
12	Q	23.7	Very low	28.1	Very low	147 Å²	147	150.5 Å²	150.5	69%	0.687	79%	0.792	S	S	*	*			trans	62.5	128.7	136.6	-75.3	177.7	-24.9	0	0	126.3
13	M	23.9	Very low	27.9	Very low	161 Å²	161	152.4 Å²	152.4	79%	0.793	80%	0.796	S	S	*	*			trans	63.9	141.1	141.4	-68.2	-174	-172	0	0	118.6
14	T	24.9	Very low	27.5	Very low	115 Å²	115	152.8 Å²	152.8	71%	0.706	80%	0.798	S	S	*	*			cis	-166.7	158.9	27.9	3.6	0	0	0	0	110.4
15	E	24.8	Very low	26.6	Very low	186 Å²	186	152.1 Å²	152.1	87%	0.869	81%	0.808	S	S	*	*			trans	58	126.3	143.1	-69.5	178.7	165.3	0	0	124.5
16	G	24.8	Very low	26.4	Very low	87 Å²	87	146.5 Å²	146.5	90%	0.897	81%	0.813	S	S	*	*				86.8	109	123.5	0	0	0	0	0	118.8
17	G	25.6	Very low	26.1	Very low	70 Å²	70	143.9 Å²	143.9	72%	0.722	82%	0.823	S	S	*	*			trans	-148.9	96.1	168.7	0	0	0	0	0	112.6
18	E	24.3	Very low	26.1	Very low	193 Å²	193	145.9 Å²	145.9	90%	0.902	83%	0.828	S	S	*	*			trans	-87.4	137.8	161.5	-101	179.3	161.5	0	0	109.3
19	Y	28.5	Very low	26.2	Very low	218 Å²	218	148.2 Å²	148.2	86%	0.855	83%	0.834	S	S	*	*			trans	-120.9	114.8	170.9	-77.7	-79.3	0	0	0	110.8
20	T	24.8	Very low	26.1	Very low	136 Å²	136	145.3 Å²	145.3	83%	0.834	83%	0.832	S	S	*	*			trans	-73	139.9	167.9	-19.7	0	0	0	0	110.2
21	Y	28.9	Very low	26.2	Very low	222 Å²	222	149.4 Å²	149.4	87%	0.871	84%	0.838	S	S	*	*			trans	-111	131.7	165.5	-100.6	-85.8	0	0	0	110.9
22	T	27.2	Very low	27.3	Very low	137 Å²	137	146.3 Å²	146.3	84%	0.84	83%	0.832	S	S	*	*			trans	-78.5	155.1	179.2	31.5	0	0	0	0	113.1
23	Q	29.5	Very low	27.5	Very low	185 Å²	185	150.4 Å²	150.4	86%	0.864	84%	0.843	S	S	*	*			trans	-87.2	137.7	177.9	-163.9	177.7	20.9	0	0	110.1
24	D	26.6	Very low	27.7	Very low	173 Å²	173	150.7 Å²	150.7	93%	0.925	84%	0.843	S	S	*	*			trans	-176	146.9	137.9	-113.3	-19.7	0	0	0	113.4
25	G	27.5	Very low	27.9	Very low	77 Å²	77	151 Å²	151	79%	0.794	85%	0.845	S	S	*	*			trans	141.3	91.1	162.5	0	0	0	0	0	115.6
26	G	26.2	Very low	28	Very low	88 Å²	88	147.4 Å²	147.4	91%	0.907	83%	0.831	S	S	*	*			trans	-85.8	173.2	176.4	0	0	0	0	0	116.1
27	G	26	Very low	28.2	Very low	84 Å²	84	152.8 Å²	152.8	87%	0.866	83%	0.826	S	S	*	*			trans	176.6	115.5	168.1	0	0	0	0	0	113.2
28	Q	27.9	Very low	28.8	Very low	180 Å²	180	155 Å²	155	84%	0.841	83%	0.827	S	S	*	*			trans	-72.7	155	-178.7	-72.6	168.8	-38.2	0	0	114.4
29	H	28.4	Very low	29.3	Very low	197 Å²	197	154.7 Å²	154.7	91%	0.912	83%	0.826	S	S	*	*				173.6	134.1	124.1	-93.6	-66.2	0	0	0	113.5
30	G	26	Very low	29.3	Very low	77 Å²	77	152.8 Å²	152.8	79%	0.794	83%	0.825	S	S	*	*			trans	114.7	99.9	143.9	0	0	0	0	0	120.2
31	Y	27.1	Very low	29.5	Very low	233 Å²	233	154.9 Å²	154.9	91%	0.914	83%	0.825	S	S	*	*			trans	-82.5	-177.9	159.3	-78.9	-78.6	0	0	0	111.5
32	P	46	Very low	29.8	Very low	106 Å²	106	151.7 Å²	151.7	69%	0.688	82%	0.823	S	S	*	*			cis	-134.6	177.5	-18.1	24.8	-1.4	0	0	0	113.7
33	Y	28.1	Very low	30	Very low	233 Å²	233	154.7 Å²	154.7	91%	0.914	83%	0.827	S	S	*	*			trans	-164.7	138.8	134.9	-110.5	-77.6	0	0	0	111.1
34	Q	27.6	Very low	30.3	Very low	167 Å²	167	153.9 Å²	153.9	78%	0.78	83%	0.829	S	S	*	*			trans	-130.1	145.8	-178.8	176	175.1	3.1	0	0	108.2
35	T	29.2	Very low	30.6	Very low	123 Å²	123	150.9 Å²	150.9	76%	0.755	83%	0.828	S	S	*	*			trans	160.5	144.3	153.8	35.1	0	0	0	0	108.4
36	D	28.4	Very low	31	Very low	109 Å²	109	151.9 Å²	151.9	58%	0.583	83%	0.829	S	S	*	*			cis	-176.7	143.3	-8.3	-118.8	-7.6	0	0	0	109.9
37	Y	28.1	Very low	31.4	Very low	200 Å²	200	153 Å²	153	78%	0.784	82%	0.823	S	S	*	*			trans	60.1	162.9	149.2	-68.8	-62.1	0	0	0	125.2
38	P	38.8	Very low	31.7	Very low	116 Å²	116	156.6 Å²	156.6	75%	0.753	82%	0.822	S	S	*	*			cis	-138.5	179.1	-32.7	36	-16.9	0	0	0	116
39	H	35.2	Very low	32.3	Very low	187 Å²	187	152 Å²	152	87%	0.866	82%	0.815	S	S	*	*			trans	-75.3	154.7	175.5	-88	-88.8	0	0	0	116.8
40	Q	27.5	Very low	32.6	Very low	179 Å²	179	149.5 Å²	149.5	84%	0.836	81%	0.814	S	S	*	*			trans	-157.4	110.5	148.5	-105.4	169.4	-11.3	0	0	108.2
41	Q	29.5	Very low	33.5	Very low	180 Å²	180	155.8 Å²	155.8	84%	0.841	82%	0.823	S	S	*	*				83.6	124.9	82.9	-120.8	174.1	6.7	0	0	114.5
42	D	34.5	Very low	33.9	Very low	154 Å²	154	147.9 Å²	147.9	82%	0.824	81%	0.812	S	S	*	*			trans	-62.6	148.8	-178.3	-55.8	-67.2	0	0	0	114.4
43	E	32.6	Very low	33.9	Very low	200 Å²	200	147.8 Å²	147.8	94%	0.935	82%	0.82	S	S	*	*			trans	-139.6	123.8	150.5	-82.9	-166	161.6	0	0	110.8
44	D	34.8	Very low	34.4	Very low	169 Å²	169	143.3 Å²	143.3	90%	0.904	81%	0.812	S	S	*	*			trans	-70.8	142.1	169.7	-68.1	-52.8	0	0	0	111.8
45	A	33.8	Very low	35.4	Very low	109 Å²	109	144.3 Å²	144.3	90%	0.901	82%	0.816	S	S	*	*			trans	-150.4	126.7	154.2	0	0	0	0	0	111.3
46	A	34.8	Very low	36.2	Very low	99 Å²	99	145.7 Å²	145.7	82%	0.818	82%	0.819	S	S	*	*			trans	-92	163.1	-172.6	0	0	0	0	0	114.3
47	S	34.4	Very low	36.8	Very low	111 Å²	111	147.1 Å²	147.1	78%	0.776	83%	0.827	S	S	*	*			trans	73.1	116.1	149.5	-166.4	0	0	0	0	118.7
48	D	32.7	Very low	37.9	Very low	159 Å²	159	146.3 Å²	146.3	85%	0.85	83%	0.831	S	S	*	*				-165.7	147.7	99.1	-138.9	-10.5	0	0	0	111.8
49	A	41	Very low	38	Very low	83 Å²	83	148.8 Å²	148.8	69%	0.686	83%	0.834	S	S	*	*			trans	-93.3	138.4	-179.2	0	0	0	0	0	111.2
50	T	35.3	Very low	38.7	Very low	146 Å²	146	150.6 Å²	150.6	90%	0.896	84%	0.835	S	S	*	*			trans	-145.2	108.1	148.6	41.6	0	0	0	0	109.5
51	E	44.2	Very low	39.7	Very low	209 Å²	209	150.4 Å²	150.4	98%	0.977	83%	0.834	S	S	*	*			trans	-62.7	133.9	163.5	-114.8	175.7	165.5	0	0	110
52	G	34.6	Very low	40.4	Very low	66 Å²	66	144.5 Å²	144.5	68%	0.68	82%	0.821	S	S	*	*			trans	-170.7	70.9	177.6	0	0	0	0	0	113.8
53	A	46.7	Very low	41.2	Very low	104 Å²	104	145.6 Å²	145.6	86%	0.86	82%	0.822	S	S	*	*			trans	38.9	99	150.3	0	0	0	0	0	118.8
54	D	39.2	Very low	41.8	Very low	139 Å²	139	146.4 Å²	146.4	74%	0.743	82%	0.817	S	S	*	*			trans	-104	106.6	163.2	-64	-43.1	0	0	0	110
55	E	47.7	Very low	42.7	Very low	188 Å²	188	146.6 Å²	146.6	88%	0.879	81%	0.813	S	S	*	*			trans	-85	129.4	150.4	-77	-176.3	156.9	0	0	107.2
56	D	47.4	Very low	43.8	Very low	152 Å²	152	143.8 Å²	143.8	81%	0.813	79%	0.794	S	S	*	*			trans	70.6	64.7	167.7	-60.2	-24	0	0	0	119.5	Q58	D56-Q58 PolarHBondContact O-N 3.11Å
57	D	40.5	Very low	45.1	Very low	140 Å²	140	146.6 Å²	146.6	75%	0.749	79%	0.794	S	S	*	*			trans	-82.4	98.1	155.2	-95.4	-15.4	0	0	0	110.7	M59	D57-M59 PolarHBondContact O-N 3.37Å; D57-M59 VanDerWaalsContact O-N 3.11Å
58	Q	50.8	Low	46.4	Very low	183 Å²	183	144.5 Å²	144.5	86%	0.855	78%	0.778	S	S	*	*			trans	-67.6	103.7	161.9	-71.1	179.6	8.9	0	0	108.3	D56 Y60	D56-Q58 PolarHBondContact O-N 3.11Å; Q58-Y60 PolarHBondContact O-N 2.95Å
59	M	41.3	Very low	48.2	Very low	168 Å²	168	142.3 Å²	142.3	83%	0.828	76%	0.762	S	S	*	*			trans	-54.8	106.5	169.9	-79	-157.9	-62.4	0	0	110	D57 E61	D57-M59 PolarHBondContact O-N 3.37Å; D57-M59 VanDerWaalsContact O-N 3.11Å; M59-E61 PolarHBondContact O-N 2.83Å; M59-E61 VanDerWaalsContact O-N 3.15Å
60	Y	48.7	Very low	49.7	Very low	224 Å²	224	142.2 Å²	142.2	88%	0.878	75%	0.754	S	S	*	*			trans	-76.2	95.5	165.8	-141.9	-88.4	0	0	0	107.2	Q58 G62	Q58-Y60 PolarHBondContact O-N 2.95Å; Y60-G62 PolarHBondContact O-N 3.15Å
61	E	49	Very low	51.7	Low	176 Å²	176	139 Å²	139	82%	0.822	73%	0.732	S	S	*	*			trans	-66.9	80	167.3	-76.3	-172.2	165.1	0	0	109	M59 E63	M59-E61 PolarHBondContact O-N 2.83Å; M59-E61 VanDerWaalsContact O-N 3.15Å; E61-E63 PolarHBondContact O-N 3.06Å
62	G	44.8	Very low	53.3	Low	56 Å²	56	134.5 Å²	134.5	58%	0.577	71%	0.711	S	S	*	*			trans	-74.6	105.8	162.8	0	0	0	0	0	108.4	Y60 Y64	Y60-G62 PolarHBondContact O-N 3.15Å; G62-Y64 PolarHBondContact O-N 3.32Å
63	E	50.3	Low	55.4	Low	177 Å²	177	134.7 Å²	134.7	83%	0.827	70%	0.695	S	S	*	*			trans	-51.4	117.5	166.5	-77.2	-176.5	157	0	0	108.9	E61 Q65	E61-E63 PolarHBondContact O-N 3.06Å; E63-Q65 VanDerWaalsContact C-N 3.28Å; E63-Q65 PolarHBondContact O-N 3.02Å
64	Y	46.1	Very low	57	Low	216 Å²	216	135.5 Å²	135.5	85%	0.847	68%	0.68	S	S	*	*			trans	-70.2	87.5	176.1	-153.6	-88.9	0	0	0	108.3	G62 G66	G62-Y64 PolarHBondContact O-N 3.32Å; Y64-G66 PolarHBondContact O-N 2.85Å
65	Q	54.4	Low	59.1	Low	174 Å²	174	135.3 Å²	135.3	81%	0.813	67%	0.674	S	S	*	*			trans	-62.7	106.8	166.8	-78.1	179.7	-12.5	0	0	107.1	E63	E63-Q65 VanDerWaalsContact C-N 3.28Å; E63-Q65 PolarHBondContact O-N 3.02Å
66	G	56.3	Low	60.7	Low	49 Å²	49	129.4 Å²	129.4	51%	0.505	66%	0.657	S	S	.	*	P	Polyproline II helix	trans	-50.8	153.5	179.3	0	0	0	0	0	112.1	Y64 P68	Y64-G66 PolarHBondContact O-N 2.85Å; G66-P68 VanDerWaalsContact O-CD 3.29Å; G66-P68 WeakPolarHBondContact O-CD 3.29Å
67	I	60.9	Low	62.3	Low	159 Å²	159	131.2 Å²	131.2	82%	0.815	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-53.1	116.5	178.5	-60.6	167	0	0	0	108	H69	I67-H69 PolarHBondContact O-N 3.45Å
68	P	62.3	Low	64.3	Low	67 Å²	67	133.5 Å²	133.5	44%	0.435	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-59.5	138.9	-174	-22.6	31.4	0	0	0	110.6	G66 I73	G66-P68 VanDerWaalsContact O-CD 3.29Å; G66-P68 WeakPolarHBondContact O-CD 3.29Å; P68-I73 HydrophobicContact CB-CD1 4.22Å; P68-I73 HydrophobicContact CB-CG1 3.78Å
69	H	71.3	Confident	65.8	Low	112 Å²	112	127.5 Å²	127.5	52%	0.519	63%	0.633	S	S	.	*	P	Polyproline II helix	trans	-60.5	141.1	177.8	-168.3	-93.1	0	0	0	108.8	I67 D71 E72 I73	I67-H69 PolarHBondContact O-N 3.45Å; H69-D71 IonicContact CE1-OD2 3.64Å; H69-D71 PolarHBondContact CE1-OD2 3.09Å; H69-D71 IonicContact ND1-OD2 3.51Å; H69-D71 PolarHBondContact O-N 3.21Å; H69-E72 HydrophobicContact CB-CG 4.18Å; H69-E72 PolarHBondContact N-OE2 3.31Å; H69-E72 VanDerWaalsContact N-OE2 3.09Å; H69-E72 WeakPolarHBondContact O-CB 3.41Å; H69-E72 PolarHBondContact O-N 2.87Å; H69-I73 PolarHBondContact O-N 2.91Å
70	P	72.2	Confident	67.7	Low	81 Å²	81	122.2 Å²	122.2	53%	0.526	62%	0.616	S	S	.	*	H	α-helix	trans	-52.7	-26.2	-175.7	-28.9	34.2	0	0	0	114.9	K74	P70-K74 WeakPolarHBondContact O-CG 3.36Å; P70-K74 PolarHBondContact O-N 3.19Å
71	D	76.1	Confident	69.1	Low	78 Å²	78	118.3 Å²	118.3	42%	0.417	60%	0.599	S	S	.	*	H	α-helix	trans	-78.6	-34.4	176.7	-62.7	-38.2	0	0	0	113	H69 I73 K74 E75	H69-D71 IonicContact CE1-OD2 3.64Å; H69-D71 PolarHBondContact CE1-OD2 3.09Å; H69-D71 IonicContact ND1-OD2 3.51Å; H69-D71 PolarHBondContact O-N 3.21Å; D71-I73 VanDerWaalsContact C-N 3.3Å; D71-I73 PolarHBondContact O-N 3.35Å; D71-K74 WeakPolarHBondContact O-CB 3.38Å; D71-K74 PolarHBondContact O-N 2.95Å; D71-K74 IonicContact OD1-NZ 3.31Å; D71-K74 PolarHBondContact OD1-NZ 3.16Å; D71-E75 WeakPolarHBondContact O-CG 2.87Å; D71-E75 PolarHBondContact O-N 3.48Å
72	E	78.6	Confident	70.6	Confident	116 Å²	116	116 Å²	116	54%	0.542	59%	0.592	S	S	.	*	H	α-helix	trans	-64.7	-36.7	171.4	-64.5	174.3	160.8	0	0	111	H69 K74 E75 A76	H69-E72 HydrophobicContact CB-CG 4.18Å; H69-E72 PolarHBondContact N-OE2 3.31Å; H69-E72 VanDerWaalsContact N-OE2 3.09Å; H69-E72 WeakPolarHBondContact O-CB 3.41Å; H69-E72 PolarHBondContact O-N 2.87Å; E72-K74 VanDerWaalsContact C-N 3.35Å; E72-E75 PolarHBondContact O-N 3.25Å; E72-A76 VanDerWaalsContact O-CB 3.23Å; E72-A76 WeakPolarHBondContact O-CB 3.29Å; E72-A76 PolarHBondContact O-N 2.84Å
73	I	78.5	Confident	72.2	Confident	69 Å²	69	118.3 Å²	118.3	35%	0.354	59%	0.588	S	S	.	*	H	α-helix	trans	-64.8	-40.1	174	-58.5	176.9	0	0	0	110.8	P68 H69 D71 R77	P68-I73 HydrophobicContact CB-CD1 4.22Å; P68-I73 HydrophobicContact CB-CG1 3.78Å; H69-I73 PolarHBondContact O-N 2.91Å; D71-I73 VanDerWaalsContact C-N 3.3Å; D71-I73 PolarHBondContact O-N 3.35Å; I73-R77 WeakPolarHBondContact O-CB 3.35Å; I73-R77 VanDerWaalsContact O-CG 3.29Å; I73-R77 WeakPolarHBondContact O-CG 3.23Å; I73-R77 PolarHBondContact O-N 3.39Å
74	K	80.2	Confident	73.4	Confident	121 Å²	121	112.5 Å²	112.5	53%	0.526	57%	0.57	S	S	.	*	H	α-helix	trans	-67.4	-41.3	176.4	-75.7	173	-169.4	158.6	0	111.6	P70 D71 E72 R77 R78	P70-K74 WeakPolarHBondContact O-CG 3.36Å; P70-K74 PolarHBondContact O-N 3.19Å; D71-K74 WeakPolarHBondContact O-CB 3.38Å; D71-K74 PolarHBondContact O-N 2.95Å; D71-K74 IonicContact OD1-NZ 3.31Å; D71-K74 PolarHBondContact OD1-NZ 3.16Å; E72-K74 VanDerWaalsContact C-N 3.35Å; K74-R77 PolarHBondContact O-N 2.97Å; K74-R78 WeakPolarHBondContact O-CG 3.27Å; K74-R78 PolarHBondContact O-N 3.05Å
75	E	82.8	Confident	74.8	Confident	136 Å²	136	108.8 Å²	108.8	64%	0.636	56%	0.559	S	S	*	*	H	α-helix	trans	-67.3	-45.1	177.3	-74.1	-175	175.3	0	0	111.7	D71 E72 R77 R78 A79	D71-E75 WeakPolarHBondContact O-CG 2.87Å; D71-E75 PolarHBondContact O-N 3.48Å; E72-E75 PolarHBondContact O-N 3.25Å; E75-R77 VanDerWaalsContact C-N 3.32Å; E75-R77 PolarHBondContact O-N 3.45Å; E75-R78 WeakPolarHBondContact O-CB 3.43Å; E75-R78 PolarHBondContact O-N 2.93Å; E75-R78 VanDerWaalsContact O-N 3.09Å; E75-A79 WeakPolarHBondContact O-CB 3.48Å; E75-A79 PolarHBondContact O-N 2.82Å
76	A	81.3	Confident	75.8	Confident	63 Å²	63	109.2 Å²	109.2	52%	0.521	55%	0.553	S	S	.	*	H	α-helix	trans	-59.3	-42	173.6	0	0	0	0	0	111.7	E72 A79 A80	E72-A76 VanDerWaalsContact O-CB 3.23Å; E72-A76 WeakPolarHBondContact O-CB 3.29Å; E72-A76 PolarHBondContact O-N 2.84Å; A76-A79 PolarHBondContact O-N 3.38Å; A76-A80 VanDerWaalsContact O-CB 3.22Å; A76-A80 WeakPolarHBondContact O-CB 3.45Å; A76-A80 PolarHBondContact O-N 2.89Å
77	R	82.3	Confident	76.7	Confident	190 Å²	190	113 Å²	113	72%	0.717	56%	0.556	S	S	*	*	H	α-helix	trans	-63.8	-39.4	173.3	-79.3	178.6	179.4	-176.4	1.3	112.6	I73 K74 E75 R81	I73-R77 WeakPolarHBondContact O-CB 3.35Å; I73-R77 VanDerWaalsContact O-CG 3.29Å; I73-R77 WeakPolarHBondContact O-CG 3.23Å; I73-R77 PolarHBondContact O-N 3.39Å; K74-R77 PolarHBondContact O-N 2.97Å; E75-R77 VanDerWaalsContact C-N 3.32Å; E75-R77 PolarHBondContact O-N 3.45Å; R77-R81 WeakPolarHBondContact O-CB 3.28Å; R77-R81 PolarHBondContact O-N 3.45Å
78	R	81.3	Confident	77	Confident	188 Å²	188	106.6 Å²	106.6	71%	0.709	53%	0.526	S	S	*	.	H	α-helix	trans	-66.3	-46.2	175.9	-79.3	178.2	178.5	-173.2	0.7	111.2	K74 E75 R81 L82	K74-R78 WeakPolarHBondContact O-CG 3.27Å; K74-R78 PolarHBondContact O-N 3.05Å; E75-R78 WeakPolarHBondContact O-CB 3.43Å; E75-R78 PolarHBondContact O-N 2.93Å; E75-R78 VanDerWaalsContact O-N 3.09Å; R78-R81 PolarHBondContact O-N 3.17Å; R78-L82 WeakPolarHBondContact O-CB 3.39Å; R78-L82 PolarHBondContact O-N 2.91Å
79	A	83.4	Confident	77.3	Confident	58 Å²	58	112 Å²	112	48%	0.479	54%	0.538	S	S	.	.	H	α-helix	trans	-61.3	-47.9	177.3	0	0	0	0	0	111.2	E75 A76 R81 L82 E83	E75-A79 WeakPolarHBondContact O-CB 3.48Å; E75-A79 PolarHBondContact O-N 2.82Å; A76-A79 PolarHBondContact O-N 3.38Å; A79-R81 VanDerWaalsContact C-N 3.3Å; A79-R81 PolarHBondContact O-N 2.99Å; A79-L82 WeakPolarHBondContact O-CB 3.32Å; A79-L82 PolarHBondContact O-N 3.29Å; A79-L82 VanDerWaalsContact O-N 3.1Å; A79-E83 WeakPolarHBondContact O-CB 3.4Å; A79-E83 PolarHBondContact O-N 3.45Å
80	A	80	Confident	77.3	Confident	56 Å²	56	110.4 Å²	110.4	46%	0.463	53%	0.532	S	S	.	.	H	α-helix	trans	-59.5	-39.6	175.2	0	0	0	0	0	112.1	A76 E83 A84	A76-A80 VanDerWaalsContact O-CB 3.22Å; A76-A80 WeakPolarHBondContact O-CB 3.45Å; A76-A80 PolarHBondContact O-N 2.89Å; A80-E83 PolarHBondContact O-N 3.17Å; A80-A84 WeakPolarHBondContact O-CB 3.47Å; A80-A84 PolarHBondContact O-N 3.24Å
81	R	79.9	Confident	77.1	Confident	142 Å²	142	108.2 Å²	108.2	54%	0.536	52%	0.522	S	S	.	.	H	α-helix	trans	-67.4	-37.1	175.5	-164.6	174.8	-169.5	-174.1	3.4	112.2	R77 R78 A79 K85	R77-R81 WeakPolarHBondContact O-CB 3.28Å; R77-R81 PolarHBondContact O-N 3.45Å; R78-R81 PolarHBondContact O-N 3.17Å; A79-R81 VanDerWaalsContact C-N 3.3Å; A79-R81 PolarHBondContact O-N 2.99Å; R81-K85 WeakPolarHBondContact O-CB 3.23Å; R81-K85 WeakPolarHBondContact O-CG 3.5Å; R81-K85 PolarHBondContact O-N 3.16Å
82	L	79.6	Confident	76.6	Confident	129 Å²	129	108.5 Å²	108.5	68%	0.675	53%	0.526	S	S	*	.	H	α-helix	trans	-69.9	-41.3	177.5	-131.9	128.1	0	0	0	111.1	R78 A79 K85 R86	R78-L82 WeakPolarHBondContact O-CB 3.39Å; R78-L82 PolarHBondContact O-N 2.91Å; A79-L82 WeakPolarHBondContact O-CB 3.32Å; A79-L82 PolarHBondContact O-N 3.29Å; A79-L82 VanDerWaalsContact O-N 3.1Å; L82-K85 PolarHBondContact O-N 3.21Å; L82-R86 WeakPolarHBondContact O-CB 3.21Å; L82-R86 PolarHBondContact O-N 3.24Å
83	E	78.4	Confident	76.1	Confident	103 Å²	103	108.5 Å²	108.5	48%	0.481	53%	0.526	S	S	.	.	H	α-helix	trans	-67.4	-41.8	175.4	-163.1	-171.7	151.2	0	0	111.5	A79 A80 K85 R86 K87	A79-E83 WeakPolarHBondContact O-CB 3.4Å; A79-E83 PolarHBondContact O-N 3.45Å; A80-E83 PolarHBondContact O-N 3.17Å; E83-K85 PolarHBondContact O-N 3.44Å; E83-R86 WeakPolarHBondContact O-CB 3.23Å; E83-R86 PolarHBondContact O-N 3.06Å; E83-R86 VanDerWaalsContact O-N 3.16Å; E83-K87 WeakPolarHBondContact O-CB 3.32Å; E83-K87 PolarHBondContact O-N 3.48Å; E83-K87 WeakPolarHBondContact OE1-CE 3.22Å; E83-K87 IonicContact OE1-NZ 2.6Å; E83-K87 PolarHBondContact OE1-NZ 3.39Å
84	A	75.4	Confident	75.8	Confident	56 Å²	56	109.7 Å²	109.7	46%	0.463	53%	0.53	S	S	.	.	H	α-helix	trans	-60.2	-44.5	172.6	0	0	0	0	0	111.3	A80 R86 K87 A88	A80-A84 WeakPolarHBondContact O-CB 3.47Å; A80-A84 PolarHBondContact O-N 3.24Å; A84-R86 VanDerWaalsContact C-N 3.33Å; A84-R86 PolarHBondContact O-N 3.01Å; A84-K87 PolarHBondContact O-N 2.95Å; A84-A88 VanDerWaalsContact O-CB 3.22Å; A84-A88 WeakPolarHBondContact O-CB 3.4Å; A84-A88 PolarHBondContact O-N 3.5Å
85	K	74.8	Confident	75.4	Confident	138 Å²	138	105.6 Å²	105.6	60%	0.6	51%	0.513	S	S	*	.	H	α-helix	trans	-61.4	-39.5	173	-79.5	-176.3	177	-169.5	0	112.4	R81 L82 E83 R89	R81-K85 WeakPolarHBondContact O-CB 3.23Å; R81-K85 WeakPolarHBondContact O-CG 3.5Å; R81-K85 PolarHBondContact O-N 3.16Å; L82-K85 PolarHBondContact O-N 3.21Å; E83-K85 PolarHBondContact O-N 3.44Å; K85-R89 WeakPolarHBondContact O-CB 3.38Å; K85-R89 PolarHBondContact O-N 3.35Å
86	R	76.3	Confident	75	Confident	182 Å²	182	99.8 Å²	99.8	69%	0.687	49%	0.488	S	S	*	.	H	α-helix	trans	-66.7	-48.1	177.9	-173.7	-178.3	179.2	-173	0.5	111.4	L82 E83 A84 A88 R89 L90	L82-R86 WeakPolarHBondContact O-CB 3.21Å; L82-R86 PolarHBondContact O-N 3.24Å; E83-R86 WeakPolarHBondContact O-CB 3.23Å; E83-R86 PolarHBondContact O-N 3.06Å; E83-R86 VanDerWaalsContact O-N 3.16Å; A84-R86 VanDerWaalsContact C-N 3.33Å; A84-R86 PolarHBondContact O-N 3.01Å; R86-A88 VanDerWaalsContact C-N 3.32Å; R86-A88 PolarHBondContact O-N 2.86Å; R86-R89 PolarHBondContact O-N 2.85Å; R86-L90 HydrophobicContact CG-CD1 4.21Å; R86-L90 WeakPolarHBondContact O-CG 3.41Å; R86-L90 PolarHBondContact O-N 3.44Å
87	K	75.2	Confident	74.7	Confident	130 Å²	130	101.3 Å²	101.3	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-60.7	-42	174.9	-80.7	174.8	170.3	157.5	0	111.1	E83 A84 L90 A91	E83-K87 WeakPolarHBondContact O-CB 3.32Å; E83-K87 PolarHBondContact O-N 3.48Å; E83-K87 WeakPolarHBondContact OE1-CE 3.22Å; E83-K87 IonicContact OE1-NZ 2.6Å; E83-K87 PolarHBondContact OE1-NZ 3.39Å; A84-K87 PolarHBondContact O-N 2.95Å; K87-L90 PolarHBondContact O-N 3.23Å; K87-A91 WeakPolarHBondContact O-CB 3.46Å; K87-A91 PolarHBondContact O-N 3.28Å
88	A	67.6	Low	74.4	Confident	24 Å²	24	96.8 Å²	96.8	20%	0.198	47%	0.471	C	S	.	.	H	α-helix	trans	-60.4	-47.9	175.2	0	0	0	0	0	111.3	A84 R86 L90 A91 T92 P348	A84-A88 VanDerWaalsContact O-CB 3.22Å; A84-A88 WeakPolarHBondContact O-CB 3.4Å; A84-A88 PolarHBondContact O-N 3.5Å; R86-A88 VanDerWaalsContact C-N 3.32Å; R86-A88 PolarHBondContact O-N 2.86Å; A88-L90 PolarHBondContact O-N 2.84Å; A88-A91 PolarHBondContact O-N 3.49Å; A88-T92 PolarHBondContact O-N 2.99Å; A88-T92 PolarHBondContact O-OG1 3.26Å; A88-P348 HydrophobicContact CB-CB 3.62Å; A88-P348 HydrophobicContact CB-CG 3.72Å
89	R	68.8	Low	74.3	Confident	181 Å²	181	88.2 Å²	88.2	68%	0.683	44%	0.439	S	S	*	.	H	α-helix	trans	-61.3	-41.6	178.6	-167.7	176.7	-177.9	-176.3	0.6	112.9	K85 R86 T92 Q93	K85-R89 WeakPolarHBondContact O-CB 3.38Å; K85-R89 PolarHBondContact O-N 3.35Å; R86-R89 PolarHBondContact O-N 2.85Å; R89-T92 PolarHBondContact O-N 3.09Å; R89-Q93 WeakPolarHBondContact O-CG 3.48Å; R89-Q93 PolarHBondContact O-N 2.59Å; R89-Q93 VanDerWaalsContact O-N 3.11Å
90	L	71.5	Confident	74.1	Confident	77 Å²	77	85.8 Å²	85.8	40%	0.403	42%	0.418	S	S	.	.	H	α-helix	trans	-66.3	-41.4	175.9	-74	165.4	0	0	0	111.7	R86 K87 A88 Q93 H94	R86-L90 HydrophobicContact CG-CD1 4.21Å; R86-L90 WeakPolarHBondContact O-CG 3.41Å; R86-L90 PolarHBondContact O-N 3.44Å; K87-L90 PolarHBondContact O-N 3.23Å; A88-L90 PolarHBondContact O-N 2.84Å; L90-Q93 PolarHBondContact O-N 2.6Å; L90-H94 PolarHBondContact O-CD2 3.31Å; L90-H94 VanDerWaalsContact O-CD2 3.29Å; L90-H94 PolarHBondContact O-N 3.01Å
91	A	67.7	Low	74.1	Confident	36 Å²	36	86.9 Å²	86.9	30%	0.298	42%	0.418	S	S	.	.	H	α-helix	trans	-63	-42	175.6	0	0	0	0	0	111.7	K87 A88 Q93 H94 L95 P348	K87-A91 WeakPolarHBondContact O-CB 3.46Å; K87-A91 PolarHBondContact O-N 3.28Å; A88-A91 PolarHBondContact O-N 3.49Å; A91-Q93 VanDerWaalsContact C-N 3.27Å; A91-Q93 PolarHBondContact O-N 2.79Å; A91-H94 PolarHBondContact O-N 3.41Å; A91-L95 PolarHBondContact O-N 2.81Å; A91-L95 VanDerWaalsContact O-N 3.09Å; A91-P348 HydrophobicContact CB-CG 4.26Å
92	T	65.9	Low	74.1	Confident	83 Å²	83	80.5 Å²	80.5	51%	0.509	40%	0.395	S	S	.	.	H	α-helix	trans	-61.8	-33.9	174.4	-51.1	0	0	0	0	112.3	A88 R89 P96	A88-T92 PolarHBondContact O-N 2.99Å; A88-T92 PolarHBondContact O-OG1 3.26Å; R89-T92 PolarHBondContact O-N 3.09Å; T92-P96 WeakPolarHBondContact O-CD 3.34Å
93	Q	67.4	Low	74.3	Confident	117 Å²	117	74.4 Å²	74.4	55%	0.547	36%	0.363	S	S	.	.	H	α-helix	trans	-72	-34.2	178.1	-78.6	179.5	-30.9	0	0	113.8	R89 L90 A91 P96	R89-Q93 WeakPolarHBondContact O-CG 3.48Å; R89-Q93 PolarHBondContact O-N 2.59Å; R89-Q93 VanDerWaalsContact O-N 3.11Å; L90-Q93 PolarHBondContact O-N 2.6Å; A91-Q93 VanDerWaalsContact C-N 3.27Å; A91-Q93 PolarHBondContact O-N 2.79Å; Q93-P96 WeakPolarHBondContact O-CD 3.48Å
94	H	71.6	Confident	74.4	Confident	94 Å²	94	74.9 Å²	74.9	44%	0.435	37%	0.365	S	S	.	.	H	α-helix	trans	-88.8	-13.1	179.5	-70.6	-60.5	0	0	0	114.1	L90 A91 P96 E97 Q98	L90-H94 PolarHBondContact O-CD2 3.31Å; L90-H94 VanDerWaalsContact O-CD2 3.29Å; L90-H94 PolarHBondContact O-N 3.01Å; A91-H94 PolarHBondContact O-N 3.41Å; H94-P96 VanDerWaalsContact C-CD 3.48Å; H94-E97 IonicContact ND1-OE2 2.75Å; H94-E97 PolarHBondContact ND1-OE2 2.96Å; H94-E97 VanDerWaalsContact ND1-OE2 3.14Å; H94-E97 PolarHBondContact O-N 3.49Å; H94-Q98 WeakPolarHBondContact O-CG 3.45Å; H94-Q98 PolarHBondContact O-N 3.29Å; H94-Q98 VanDerWaalsContact O-N 3.15Å
95	L	71.9	Confident	74.6	Confident	34 Å²	34	75.1 Å²	75.1	18%	0.178	36%	0.359	C	S	.	.	H	α-helix	trans	-57.1	-41.3	-179.9	-173.5	67.1	0	0	0	113.7	A91 Q98 Y99 I345 T347	A91-L95 PolarHBondContact O-N 2.81Å; A91-L95 VanDerWaalsContact O-N 3.09Å; L95-Q98 PolarHBondContact O-N 3.37Å; L95-Y99 WeakPolarHBondContact O-CB 3.49Å; L95-Y99 PolarHBondContact O-N 3.33Å; L95-I345 HydrophobicContact CD1-CG2 3.82Å; L95-T347 HydrophobicContact CD1-CG2 3.98Å; L95-T347 HydrophobicContact CD2-CG2 4.02Å
96	P	73.9	Confident	75	Confident	15 Å²	15	68.5 Å²	68.5	10%	0.097	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-41.1	177.4	-25.1	36.9	0	0	0	114.1	T92 Q93 H94 Y99 E100 I687 L688	T92-P96 WeakPolarHBondContact O-CD 3.34Å; Q93-P96 WeakPolarHBondContact O-CD 3.48Å; H94-P96 VanDerWaalsContact C-CD 3.48Å; P96-Y99 PolarHBondContact O-N 3.38Å; P96-E100 WeakPolarHBondContact O-CG 3.44Å; P96-E100 PolarHBondContact O-N 3.09Å; P96-I687 HydrophobicContact CB-CG2 3.59Å; P96-L688 WeakPolarHBondContact CB-O 3.37Å
97	E	75.8	Confident	75.2	Confident	95 Å²	95	60.1 Å²	60.1	44%	0.444	30%	0.3	S	S	.	.	H	α-helix	trans	-64.5	-43.8	178.5	-70.7	172.5	166.5	0	0	111.2	H94 Y99 E100 T101 I687	H94-E97 IonicContact ND1-OE2 2.75Å; H94-E97 PolarHBondContact ND1-OE2 2.96Å; H94-E97 VanDerWaalsContact ND1-OE2 3.14Å; H94-E97 PolarHBondContact O-N 3.49Å; E97-Y99 VanDerWaalsContact C-N 3.33Å; E97-Y99 PolarHBondContact O-N 3.49Å; E97-E100 PolarHBondContact O-N 2.68Å; E97-T101 PolarHBondContact O-N 2.98Å; E97-T101 VanDerWaalsContact O-N 3.11Å; E97-T101 PolarHBondContact O-OG1 2.72Å; E97-I687 HydrophobicContact CG-CD1 3.62Å
98	Q	76.8	Confident	75.7	Confident	94 Å²	94	55.1 Å²	55.1	44%	0.439	28%	0.279	S	S	.	.	H	α-helix	trans	-61.6	-43.1	175	-69.9	179.8	-4.1	0	0	111.5	H94 L95 T101 I102	H94-Q98 WeakPolarHBondContact O-CG 3.45Å; H94-Q98 PolarHBondContact O-N 3.29Å; H94-Q98 VanDerWaalsContact O-N 3.15Å; L95-Q98 PolarHBondContact O-N 3.37Å; Q98-T101 PolarHBondContact O-N 3.24Å; Q98-I102 WeakPolarHBondContact O-CD1 3.42Å; Q98-I102 VanDerWaalsContact O-CG1 3.28Å; Q98-I102 WeakPolarHBondContact O-CG1 3.33Å; Q98-I102 PolarHBondContact O-N 2.88Å; Q98-I102 VanDerWaalsContact O-N 3.08Å
99	Y	78.7	Confident	76.6	Confident	9 Å²	9	54.6 Å²	54.6	4%	0.035	28%	0.276	C	S	.	.	H	α-helix	trans	-63.1	-42.9	179.3	-176.8	-93.4	0	0	0	112.4	L95 P96 E97 I102 M103 E229 P306 R307 L310 L322	L95-Y99 WeakPolarHBondContact O-CB 3.49Å; L95-Y99 PolarHBondContact O-N 3.33Å; P96-Y99 PolarHBondContact O-N 3.38Å; E97-Y99 VanDerWaalsContact C-N 3.33Å; E97-Y99 PolarHBondContact O-N 3.49Å; Y99-I102 WeakPolarHBondContact O-CB 3.45Å; Y99-I102 PolarHBondContact O-N 3.42Å; Y99-M103 HydrophobicContact CD1-CG 3.94Å; Y99-M103 HydrophobicContact CE1-CG 3.48Å; Y99-M103 VanDerWaalsContact CE1-CG 3.48Å; Y99-M103 HydrophobicContact CE1-SD 4.2Å; Y99-M103 WeakPolarHBondContact O-CG 3.47Å; Y99-M103 PolarHBondContact O-N 3.29Å; Y99-E229 PolarHBondContact OH-O 3.11Å; Y99-P306 HydrophobicContact CE2-CB 4.47Å; Y99-P306 HydrophobicContact CE2-CG 4.45Å; Y99-P306 WeakPolarHBondContact OH-CG 3.34Å; Y99-R307 HydrophobicContact CE1-CB 4.49Å; Y99-R307 HydrophobicContact CE2-CB 4.19Å; Y99-L310 HydrophobicContact CD2-CD1 3.72Å; Y99-L310 HydrophobicContact CE2-CD1 4.09Å; Y99-L322 HydrophobicContact CE2-CD2 4.34Å
100	E	78.6	Confident	77.6	Confident	7 Å²	7	54.6 Å²	54.6	3%	0.033	28%	0.276	C	S	.	.	H	α-helix	trans	-67	-38.6	179	-67.4	-70.5	173.1	0	0	111.8	P96 E97 I102 M103 E104 M233 R236 I687	P96-E100 WeakPolarHBondContact O-CG 3.44Å; P96-E100 PolarHBondContact O-N 3.09Å; E97-E100 PolarHBondContact O-N 2.68Å; E100-I102 VanDerWaalsContact C-N 3.29Å; E100-I102 PolarHBondContact O-N 2.97Å; E100-M103 CarbonylContact O-C 3.56Å; E100-M103 PolarHBondContact O-N 3.38Å; E100-E104 WeakPolarHBondContact O-CG 3.39Å; E100-E104 PolarHBondContact O-N 3.49Å; E100-M233 HydrophobicContact CB-CE 4.41Å; E100-M233 HydrophobicContact CG-CE 3.48Å; E100-M233 VanDerWaalsContact CG-CE 3.48Å; E100-M233 WeakPolarHBondContact OE1-CE 3.27Å; E100-R236 IonicContact OE1-CZ 3.89Å; E100-R236 IonicContact OE1-NH2 3.11Å; E100-R236 PolarHBondContact OE1-NH2 2.89Å; E100-R236 IonicContact OE2-NH2 3.67Å; E100-I687 HydrophobicContact CG-CG2 4.22Å
101	T	79.8	Confident	78.5	Confident	78 Å²	78	51.1 Å²	51.1	48%	0.479	26%	0.257	S	S	.	.	H	α-helix	trans	-58.7	-42	172.7	-50.7	0	0	0	0	111.2	E97 Q98 M103 E104 D105	E97-T101 PolarHBondContact O-N 2.98Å; E97-T101 VanDerWaalsContact O-N 3.11Å; E97-T101 PolarHBondContact O-OG1 2.72Å; Q98-T101 PolarHBondContact O-N 3.24Å; T101-M103 VanDerWaalsContact C-N 3.34Å; T101-M103 PolarHBondContact O-N 2.96Å; T101-E104 WeakPolarHBondContact O-CB 3.49Å; T101-E104 PolarHBondContact O-N 3.45Å; T101-D105 PolarHBondContact O-N 3.45Å; T101-D105 VanDerWaalsContact O-N 3.08Å
102	I	81	Confident	79.6	Confident	9 Å²	9	49.4 Å²	49.4	5%	0.046	24%	0.243	C	C	.	.	H	α-helix	trans	-63.8	-40.8	175.1	-66.6	160.5	0	0	0	111.4	Q98 Y99 E100 E104 D105 C106 L322 F340 V342 I345	Q98-I102 WeakPolarHBondContact O-CD1 3.42Å; Q98-I102 VanDerWaalsContact O-CG1 3.28Å; Q98-I102 WeakPolarHBondContact O-CG1 3.33Å; Q98-I102 PolarHBondContact O-N 2.88Å; Q98-I102 VanDerWaalsContact O-N 3.08Å; Y99-I102 WeakPolarHBondContact O-CB 3.45Å; Y99-I102 PolarHBondContact O-N 3.42Å; E100-I102 VanDerWaalsContact C-N 3.29Å; E100-I102 PolarHBondContact O-N 2.97Å; I102-E104 VanDerWaalsContact C-N 3.34Å; I102-D105 PolarHBondContact O-N 2.85Å; I102-C106 PolarHBondContact O-N 3.16Å; I102-C106 PolarHBondContact O-SG 3.41Å; I102-L322 HydrophobicContact CG2-CD1 4.08Å; I102-L322 HydrophobicContact CG2-CD2 4.14Å; I102-F340 HydrophobicContact CG2-CE2 3.95Å; I102-F340 HydrophobicContact CG2-CZ 3.62Å; I102-V342 HydrophobicContact CD1-CB 4.44Å; I102-V342 HydrophobicContact CD1-CG1 3.92Å; I102-V342 HydrophobicContact CD1-CG2 4.34Å; I102-V342 HydrophobicContact CG1-CB 4.17Å; I102-V342 HydrophobicContact CG1-CG1 4.17Å; I102-V342 HydrophobicContact CG1-CG2 3.65Å; I102-I345 HydrophobicContact CD1-CD1 4.23Å; I102-I345 HydrophobicContact CD1-CG1 4.26Å
103	M	82.4	Confident	80.9	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-68.5	-33.7	179	-73.6	-60.7	-63.2	0	0	112.2	Y99 E100 T101 C106 G107 F230 Q232 L322	Y99-M103 HydrophobicContact CD1-CG 3.94Å; Y99-M103 HydrophobicContact CE1-CG 3.48Å; Y99-M103 VanDerWaalsContact CE1-CG 3.48Å; Y99-M103 HydrophobicContact CE1-SD 4.2Å; Y99-M103 WeakPolarHBondContact O-CG 3.47Å; Y99-M103 PolarHBondContact O-N 3.29Å; E100-M103 CarbonylContact O-C 3.56Å; E100-M103 PolarHBondContact O-N 3.38Å; T101-M103 VanDerWaalsContact C-N 3.34Å; T101-M103 PolarHBondContact O-N 2.96Å; M103-C106 PolarHBondContact O-N 2.91Å; M103-G107 PolarHBondContact O-N 3.36Å; M103-F230 WeakPolarHBondContact CE-O 3.24Å; M103-Q232 PolarHBondContact O-NE2 2.87Å; M103-L322 HydrophobicContact SD-CD2 3.92Å
104	E	81.5	Confident	82.1	Confident	113 Å²	113	49.7 Å²	49.7	53%	0.528	24%	0.235	S	C	.	.	H	α-helix	trans	-60.7	-47.9	169.4	-74.6	177.3	-171.4	0	0	111.1	E100 T101 I102 C106 G107 Q232	E100-E104 WeakPolarHBondContact O-CG 3.39Å; E100-E104 PolarHBondContact O-N 3.49Å; T101-E104 WeakPolarHBondContact O-CB 3.49Å; T101-E104 PolarHBondContact O-N 3.45Å; I102-E104 VanDerWaalsContact C-N 3.34Å; E104-C106 PolarHBondContact O-N 3.1Å; E104-G107 PolarHBondContact O-N 3.08Å; E104-Q232 PolarHBondContact O-NE2 3.26Å
105	D	80.1	Confident	83.2	Confident	60 Å²	60	45.2 Å²	45.2	32%	0.321	21%	0.214	S	C	.	.	H	α-helix	trans	-62.2	-38.5	176.9	-81	-8.8	0	0	0	112.9	T101 I102 G107 W330 T341	T101-D105 PolarHBondContact O-N 3.45Å; T101-D105 VanDerWaalsContact O-N 3.08Å; I102-D105 PolarHBondContact O-N 2.85Å; D105-G107 PolarHBondContact O-N 2.8Å; D105-W330 PolarHBondContact O-NE1 3.1Å; D105-T341 PolarHBondContact OD2-OG1 3.45Å
106	C	81.8	Confident	84.3	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.6	-25.7	174.7	-69.4	0	0	0	0	112.9	I102 M103 E104 V325 H326 N329	I102-C106 PolarHBondContact O-N 3.16Å; I102-C106 PolarHBondContact O-SG 3.41Å; M103-C106 PolarHBondContact O-N 2.91Å; E104-C106 PolarHBondContact O-N 3.1Å; C106-V325 HydrophobicContact CB-CG1 4.34Å; C106-H326 HydrophobicContact CB-CB 4.4Å; C106-N329 WeakPolarHBondContact O-CB 3.2Å; C106-N329 PolarHBondContact O-ND2 2.82Å
107	G	81.3	Confident	85.3	Confident	5 Å²	5	48.7 Å²	48.7	5%	0.052	23%	0.227	C	C	.	.			trans	65.8	166	-176.3	0	0	0	0	0	114.1	M103 E104 D105 Q112 Q232 N329	M103-G107 PolarHBondContact O-N 3.36Å; E104-G107 PolarHBondContact O-N 3.08Å; D105-G107 PolarHBondContact O-N 2.8Å; G107-Q112 PolarHBondContact O-NE2 3.36Å; G107-Q232 VanDerWaalsContact CA-NE2 3.28Å; G107-N329 PolarHBondContact O-ND2 3.38Å
108	H	84.8	Confident	86.3	Confident	26 Å²	26	45 Å²	45	12%	0.12	21%	0.211	C	C	.	.	S	Bend	trans	-92.6	134.6	166.1	-170.8	94.8	0	0	0	110.7	Q112 W113 H239 K333	H108-Q112 VanDerWaalsContact CE1-CB 3.46Å; H108-Q112 WeakPolarHBondContact CE1-CB 3.49Å; H108-W113 AromaticContact NE2-CD1 3.77Å; H108-W113 AromaticContact NE2-NE1 3.41Å; H108-W113 PolarHBondContact NE2-NE1 3.08Å; H108-H239 AromaticContact CE1-CD2 3.74Å; H108-H239 AromaticContact CE1-CE1 3.44Å; H108-H239 PolarHBondContact CE1-CE1 2.94Å; H108-H239 VanDerWaalsContact CE1-CE1 3.44Å; H108-H239 AromaticContact CE1-NE2 3.18Å; H108-H239 PolarHBondContact CE1-NE2 3.37Å; H108-H239 AromaticContact ND1-NE2 3.86Å; H108-H239 AromaticContact NE2-CE1 3.43Å; H108-H239 PolarHBondContact NE2-CE1 3.38Å; H108-H239 AromaticContact NE2-NE2 3.42Å; H108-H239 PolarHBondContact NE2-NE2 3.4Å; H108-K333 WeakPolarHBondContact O-CE 3.29Å; H108-K333 PolarHBondContact O-NZ 3.45Å
109	G	87.1	Confident	87.2	Confident	13 Å²	13	40.5 Å²	40.5	13%	0.134	19%	0.19	C	C	.	.	S	Bend	trans	-168.1	-148.7	-176	0	0	0	0	0	114.6	F111 Q112 W113 N329	G109-F111 VanDerWaalsContact C-N 3.28Å; G109-F111 PolarHBondContact O-N 2.9Å; G109-Q112 PolarHBondContact O-N 3.48Å; G109-Q112 PolarHBondContact O-OE1 3.45Å; G109-W113 PolarHBondContact O-N 2.91Å; G109-N329 VanDerWaalsContact C-OD1 3.24Å; G109-N329 VanDerWaalsContact CA-OD1 3.3Å; G109-N329 WeakPolarHBondContact CA-OD1 3.32Å
110	R	89	Confident	88	Confident	181 Å²	181	40.1 Å²	40.1	68%	0.683	19%	0.188	S	C	*	.	H	α-helix	trans	-58.3	-37.1	-173.7	-107.9	-173.9	172.4	161.7	-4.6	113.1	W113 M114 T328 N329 A332	R110-W113 PolarHBondContact O-N 3.3Å; R110-M114 WeakPolarHBondContact O-CB 3.34Å; R110-M114 PolarHBondContact O-N 3.33Å; R110-T328 HydrophobicContact CB-CG2 4.38Å; R110-N329 PolarHBondContact N-OD1 2.91Å; R110-A332 HydrophobicContact CB-CB 3.97Å; R110-A332 HydrophobicContact CG-CB 3.94Å
111	F	91.1	Very high	88.8	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.013	20%	0.2	C	C	.	.	H	α-helix	trans	-64.6	-46.8	-177	-178.6	-88.7	0	0	0	111.2	G109 W113 M114 L115 F230 P303 V325 T328 N329	G109-F111 VanDerWaalsContact C-N 3.28Å; G109-F111 PolarHBondContact O-N 2.9Å; F111-W113 VanDerWaalsContact C-N 3.35Å; F111-W113 PolarHBondContact O-N 3.18Å; F111-M114 HydrophobicContact CD2-CE 4.21Å; F111-M114 HydrophobicContact CE2-CE 4.36Å; F111-M114 PolarHBondContact O-N 3Å; F111-L115 HydrophobicContact CE1-CD2 4.35Å; F111-L115 WeakPolarHBondContact O-CB 3.41Å; F111-L115 PolarHBondContact O-N 3.36Å; F111-F230 HydrophobicContact CD1-CD1 4.49Å; F111-F230 AromaticContact CE1-CD1 3.63Å; F111-F230 HydrophobicContact CE1-CD1 3.63Å; F111-F230 AromaticContact CE1-CE1 3.76Å; F111-F230 HydrophobicContact CE1-CE1 3.76Å; F111-F230 HydrophobicContact CE1-CG 4.29Å; F111-F230 HydrophobicContact CZ-CD1 4.4Å; F111-F230 HydrophobicContact CZ-CE1 4.08Å; F111-P303 HydrophobicContact CE2-CG 4.01Å; F111-P303 HydrophobicContact CZ-CG 3.62Å; F111-V325 HydrophobicContact CB-CG1 4.45Å; F111-V325 HydrophobicContact CD1-CB 4.36Å; F111-V325 HydrophobicContact CD1-CG1 3.98Å; F111-V325 HydrophobicContact CD1-CG2 3.67Å; F111-V325 HydrophobicContact CD2-CG2 4.29Å; F111-V325 HydrophobicContact CE1-CG2 3.59Å; F111-V325 HydrophobicContact CE2-CG2 4.21Å; F111-V325 HydrophobicContact CG-CG1 4.3Å; F111-V325 HydrophobicContact CG-CG2 4.03Å; F111-V325 HydrophobicContact CZ-CG2 3.88Å; F111-T328 HydrophobicContact CB-CG2 4.04Å; F111-N329 WeakPolarHBondContact CB-OD1 3.33Å; F111-N329 PolarHBondContact N-OD1 3.32Å; F111-N329 VanDerWaalsContact N-OD1 3.11Å
112	Q	91.8	Very high	89.6	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-64.6	-38.2	179.7	-68	87.8	-10.8	0	0	112.1	G107 H108 G109 L115 F116 N329	G107-Q112 PolarHBondContact O-NE2 3.36Å; H108-Q112 VanDerWaalsContact CE1-CB 3.46Å; H108-Q112 WeakPolarHBondContact CE1-CB 3.49Å; G109-Q112 PolarHBondContact O-N 3.48Å; G109-Q112 PolarHBondContact O-OE1 3.45Å; Q112-L115 PolarHBondContact O-N 3.35Å; Q112-F116 VanDerWaalsContact O-CB 3.23Å; Q112-F116 WeakPolarHBondContact O-CB 3.48Å; Q112-F116 PolarHBondContact O-N 2.85Å; Q112-N329 PolarHBondContact NE2-ND2 3.22Å; Q112-N329 VanDerWaalsContact NE2-ND2 3.17Å; Q112-N329 PolarHBondContact OE1-ND2 3.43Å; Q112-N329 PolarHBondContact OE1-OD1 2.94Å
113	W	92.3	Very high	90.3	Very high	109 Å²	109	38.2 Å²	38.2	41%	0.413	18%	0.175	S	C	.	.	H	α-helix	trans	-66.6	-40	173.9	-80.1	103.3	0	0	0	112.7	H108 G109 R110 F111 F116 F117 H239	H108-W113 AromaticContact NE2-CD1 3.77Å; H108-W113 AromaticContact NE2-NE1 3.41Å; H108-W113 PolarHBondContact NE2-NE1 3.08Å; G109-W113 PolarHBondContact O-N 2.91Å; R110-W113 PolarHBondContact O-N 3.3Å; F111-W113 VanDerWaalsContact C-N 3.35Å; F111-W113 PolarHBondContact O-N 3.18Å; W113-F116 AromaticContact CE3-CD1 3.74Å; W113-F116 HydrophobicContact CE3-CD1 3.74Å; W113-F116 HydrophobicContact CE3-CE1 4.21Å; W113-F116 HydrophobicContact CE3-CG 4.36Å; W113-F116 AromaticContact CZ3-CD1 3.8Å; W113-F116 HydrophobicContact CZ3-CD1 3.8Å; W113-F116 AromaticContact CZ3-CE1 3.79Å; W113-F116 HydrophobicContact CZ3-CE1 3.79Å; W113-F116 WeakPolarHBondContact O-CB 3.43Å; W113-F116 PolarHBondContact O-N 2.88Å; W113-F117 HydrophobicContact CE3-CE2 4.07Å; W113-F117 HydrophobicContact CE3-CZ 4.43Å; W113-F117 WeakPolarHBondContact O-CD2 2.98Å; W113-F117 PolarHBondContact O-N 3.32Å; W113-H239 AromaticContact CZ2-CE1 3.94Å
114	M	93.6	Very high	90.9	Very high	97 Å²	97	39.5 Å²	39.5	48%	0.478	18%	0.182	S	C	.	.	H	α-helix	trans	-62.4	-44.9	175.2	-167.6	-176.8	66.4	0	0	111	R110 F111 F117 V118 M302	R110-M114 WeakPolarHBondContact O-CB 3.34Å; R110-M114 PolarHBondContact O-N 3.33Å; F111-M114 HydrophobicContact CD2-CE 4.21Å; F111-M114 HydrophobicContact CE2-CE 4.36Å; F111-M114 PolarHBondContact O-N 3Å; M114-F117 PolarHBondContact O-N 3.42Å; M114-V118 WeakPolarHBondContact O-CG2 3.33Å; M114-V118 PolarHBondContact O-N 2.91Å; M114-V118 VanDerWaalsContact O-N 3.13Å; M114-M302 HydrophobicContact CB-CE 4.22Å; M114-M302 HydrophobicContact CE-CE 3.52Å; M114-M302 HydrophobicContact CE-SD 3.76Å; M114-M302 HydrophobicContact CG-CE 3.63Å; M114-M302 HydrophobicContact SD-CE 4.18Å
115	L	93.9	Very high	91.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.4	-43.5	175.3	-175.5	63.3	0	0	0	111.3	F111 Q112 F117 V118 L119 Y226 F227 F230 M302	F111-L115 HydrophobicContact CE1-CD2 4.35Å; F111-L115 WeakPolarHBondContact O-CB 3.41Å; F111-L115 PolarHBondContact O-N 3.36Å; Q112-L115 PolarHBondContact O-N 3.35Å; L115-F117 PolarHBondContact O-N 3.43Å; L115-V118 PolarHBondContact O-N 3.23Å; L115-L119 HydrophobicContact CD1-CD1 3.81Å; L115-L119 HydrophobicContact CD1-CD2 4.43Å; L115-L119 HydrophobicContact CD1-CG 3.91Å; L115-L119 HydrophobicContact CD2-CD1 4.36Å; L115-L119 HydrophobicContact CG-CD1 3.76Å; L115-L119 HydrophobicContact CG-CG 4.18Å; L115-L119 WeakPolarHBondContact O-CB 3.41Å; L115-L119 VanDerWaalsContact O-CG 3.27Å; L115-L119 WeakPolarHBondContact O-CG 3.22Å; L115-L119 PolarHBondContact O-N 2.83Å; L115-Y226 HydrophobicContact CD1-CD1 4.33Å; L115-Y226 HydrophobicContact CD1-CE1 3.63Å; L115-F227 HydrophobicContact CD2-CD2 4Å; L115-F227 HydrophobicContact CG-CD2 4.12Å; L115-F230 HydrophobicContact CD2-CB 3.78Å; L115-F230 HydrophobicContact CD2-CD1 4.5Å; L115-F230 HydrophobicContact CD2-CD2 3.47Å; L115-F230 VanDerWaalsContact CD2-CD2 3.47Å; L115-F230 HydrophobicContact CD2-CE2 4.13Å; L115-F230 HydrophobicContact CD2-CG 3.68Å; L115-M302 HydrophobicContact CB-CE 4.49Å; L115-M302 HydrophobicContact CD1-CB 4.44Å; L115-M302 HydrophobicContact CD1-CE 4.46Å; L115-M302 HydrophobicContact CD1-CG 4.02Å; L115-M302 HydrophobicContact CD1-SD 3.93Å
116	F	95	Very high	92.1	Very high	9 Å²	9	31.5 Å²	31.5	4%	0.039	14%	0.143	C	C	.	.	H	α-helix	trans	-55.5	-46.5	176	172.5	-99.6	0	0	0	112.4	Q112 W113 G120 F227 W242 L243 F246	Q112-F116 VanDerWaalsContact O-CB 3.23Å; Q112-F116 WeakPolarHBondContact O-CB 3.48Å; Q112-F116 PolarHBondContact O-N 2.85Å; W113-F116 AromaticContact CE3-CD1 3.74Å; W113-F116 HydrophobicContact CE3-CD1 3.74Å; W113-F116 HydrophobicContact CE3-CE1 4.21Å; W113-F116 HydrophobicContact CE3-CG 4.36Å; W113-F116 AromaticContact CZ3-CD1 3.8Å; W113-F116 HydrophobicContact CZ3-CD1 3.8Å; W113-F116 AromaticContact CZ3-CE1 3.79Å; W113-F116 HydrophobicContact CZ3-CE1 3.79Å; W113-F116 WeakPolarHBondContact O-CB 3.43Å; W113-F116 PolarHBondContact O-N 2.88Å; F116-G120 WeakPolarHBondContact O-CA 3.45Å; F116-G120 PolarHBondContact O-N 2.91Å; F116-F227 HydrophobicContact CB-CE2 3.93Å; F116-F227 HydrophobicContact CB-CZ 3.76Å; F116-F227 AromaticContact CD2-CE1 3.84Å; F116-F227 HydrophobicContact CD2-CE1 3.84Å; F116-F227 AromaticContact CD2-CZ 3.67Å; F116-F227 HydrophobicContact CD2-CZ 3.67Å; F116-F227 HydrophobicContact CG-CZ 4.2Å; F116-W242 HydrophobicContact CE2-CB 3.72Å; F116-W242 HydrophobicContact CZ-CB 3.7Å; F116-L243 HydrophobicContact CD2-CB 4.31Å; F116-L243 HydrophobicContact CD2-CD1 4.08Å; F116-L243 HydrophobicContact CE2-CB 3.93Å; F116-L243 HydrophobicContact CE2-CD1 4.22Å; F116-F246 HydrophobicContact CD1-CE2 4.29Å; F116-F246 AromaticContact CE1-CE2 3.52Å; F116-F246 HydrophobicContact CE1-CE2 3.52Å; F116-F246 HydrophobicContact CE1-CZ 4.01Å; F116-F246 HydrophobicContact CE2-CE2 4.31Å; F116-F246 HydrophobicContact CZ-CD2 4.32Å; F116-F246 AromaticContact CZ-CE2 3.54Å; F116-F246 HydrophobicContact CZ-CE2 3.54Å; F116-F246 HydrophobicContact CZ-CZ 4.46Å
117	F	95.6	Very high	92.6	Very high	112 Å²	112	31.5 Å²	31.5	49%	0.491	14%	0.143	S	C	.	.	H	α-helix	trans	-68.3	-40.6	178	-75.1	-66.5	0	0	0	112.7	W113 M114 L115 G120 L121 F246	W113-F117 HydrophobicContact CE3-CE2 4.07Å; W113-F117 HydrophobicContact CE3-CZ 4.43Å; W113-F117 WeakPolarHBondContact O-CD2 2.98Å; W113-F117 PolarHBondContact O-N 3.32Å; M114-F117 PolarHBondContact O-N 3.42Å; L115-F117 PolarHBondContact O-N 3.43Å; F117-G120 PolarHBondContact O-N 3.08Å; F117-L121 WeakPolarHBondContact O-CG 3.43Å; F117-L121 PolarHBondContact O-N 3.11Å; F117-F246 HydrophobicContact CD1-CE1 4.42Å; F117-F246 AromaticContact CD1-CZ 3.83Å; F117-F246 HydrophobicContact CD1-CZ 3.83Å; F117-F246 HydrophobicContact CE1-CZ 4.15Å
118	V	95.9	Very high	93.1	Very high	18 Å²	18	31.3 Å²	31.3	11%	0.109	14%	0.14	C	C	.	.	H	α-helix	trans	-64.5	-44.5	178.3	167.8	0	0	0	0	111.4	M114 L115 L121 A122 G298 V299 M302	M114-V118 WeakPolarHBondContact O-CG2 3.33Å; M114-V118 PolarHBondContact O-N 2.91Å; M114-V118 VanDerWaalsContact O-N 3.13Å; L115-V118 PolarHBondContact O-N 3.23Å; V118-L121 PolarHBondContact O-N 3.42Å; V118-A122 PolarHBondContact O-N 2.93Å; V118-G298 VanDerWaalsContact CG1-C 3.46Å; V118-V299 HydrophobicContact CG1-CB 4.46Å; V118-V299 HydrophobicContact CG1-CG2 3.66Å; V118-M302 HydrophobicContact CB-CE 3.91Å; V118-M302 HydrophobicContact CG1-CE 4.44Å; V118-M302 HydrophobicContact CG1-CG 4.23Å; V118-M302 HydrophobicContact CG2-CE 3.46Å; V118-M302 VanDerWaalsContact CG2-CE 3.46Å
119	L	96.1	Very high	93.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-72.3	-32.8	177.1	-64.1	-174.7	0	0	0	112.5	L115 A122 L123 L182 V223 Y226 F227 L243	L115-L119 HydrophobicContact CD1-CD1 3.81Å; L115-L119 HydrophobicContact CD1-CD2 4.43Å; L115-L119 HydrophobicContact CD1-CG 3.91Å; L115-L119 HydrophobicContact CD2-CD1 4.36Å; L115-L119 HydrophobicContact CG-CD1 3.76Å; L115-L119 HydrophobicContact CG-CG 4.18Å; L115-L119 WeakPolarHBondContact O-CB 3.41Å; L115-L119 VanDerWaalsContact O-CG 3.27Å; L115-L119 WeakPolarHBondContact O-CG 3.22Å; L115-L119 PolarHBondContact O-N 2.83Å; L119-A122 WeakPolarHBondContact O-CB 3.36Å; L119-A122 PolarHBondContact O-N 2.99Å; L119-L123 PolarHBondContact O-N 3.49Å; L119-L182 HydrophobicContact CD2-CD2 3.65Å; L119-V223 HydrophobicContact CB-CG1 3.86Å; L119-V223 HydrophobicContact CD2-CG2 4.42Å; L119-Y226 HydrophobicContact CD1-CD1 3.64Å; L119-Y226 HydrophobicContact CD1-CE1 4.21Å; L119-Y226 HydrophobicContact CD1-CG 4.46Å; L119-Y226 HydrophobicContact CD2-CD1 3.53Å; L119-Y226 HydrophobicContact CD2-CE1 3.83Å; L119-Y226 HydrophobicContact CG-CD1 4.16Å; L119-Y226 HydrophobicContact CG-CE1 4.46Å; L119-F227 HydrophobicContact CD1-CB 3.64Å; L119-F227 HydrophobicContact CD1-CD2 4.01Å; L119-F227 HydrophobicContact CD1-CG 4.13Å; L119-L243 HydrophobicContact CB-CD1 4.25Å
120	G	96	Very high	93.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-59.2	-45	169.4	0	0	0	0	0	111.6	F116 F117 A122 L123 M124 F246	F116-G120 WeakPolarHBondContact O-CA 3.45Å; F116-G120 PolarHBondContact O-N 2.91Å; F117-G120 PolarHBondContact O-N 3.08Å; G120-A122 VanDerWaalsContact C-N 3.27Å; G120-A122 PolarHBondContact O-N 3.3Å; G120-L123 PolarHBondContact O-N 3.4Å; G120-L123 VanDerWaalsContact O-N 3.17Å; G120-M124 WeakPolarHBondContact O-CB 3.35Å; G120-M124 PolarHBondContact O-N 2.88Å; G120-F246 VanDerWaalsContact C-CD1 3.41Å; G120-F246 WeakPolarHBondContact O-CB 3.43Å; G120-F246 WeakPolarHBondContact O-CD1 3.24Å; G120-F246 WeakPolarHBondContact O-CG 3.46Å
121	L	95.8	Very high	93.2	Very high	53 Å²	53	25.1 Å²	25.1	28%	0.277	12%	0.124	S	C	.	.	H	α-helix	trans	-61.4	-34.6	174.8	-70.5	172.3	0	0	0	112.7	F117 V118 M124 A125 A294 A295	F117-L121 WeakPolarHBondContact O-CG 3.43Å; F117-L121 PolarHBondContact O-N 3.11Å; V118-L121 PolarHBondContact O-N 3.42Å; L121-M124 HydrophobicContact CD2-SD 4.19Å; L121-M124 WeakPolarHBondContact O-CB 3.4Å; L121-M124 PolarHBondContact O-N 3.49Å; L121-A125 PolarHBondContact O-N 2.88Å; L121-A294 HydrophobicContact CD1-CB 4.11Å; L121-A295 HydrophobicContact CB-CB 3.91Å
122	A	96	Very high	93	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.1	-41.2	174.8	0	0	0	0	0	112	V118 L119 G120 A125 D126 L186 V223 A295	V118-A122 PolarHBondContact O-N 2.93Å; L119-A122 WeakPolarHBondContact O-CB 3.36Å; L119-A122 PolarHBondContact O-N 2.99Å; G120-A122 VanDerWaalsContact C-N 3.27Å; G120-A122 PolarHBondContact O-N 3.3Å; A122-A125 WeakPolarHBondContact O-CB 3.36Å; A122-A125 PolarHBondContact O-N 2.92Å; A122-D126 PolarHBondContact O-N 3.16Å; A122-D126 VanDerWaalsContact O-N 3.09Å; A122-L186 HydrophobicContact CB-CD1 4.39Å; A122-L186 HydrophobicContact CB-CD2 4.36Å; A122-V223 HydrophobicContact CB-CG2 3.93Å; A122-A295 HydrophobicContact CB-CB 3.98Å
123	L	94.9	Very high	92.6	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-71.2	-31.6	173.6	-72.9	170.4	0	0	0	112.9	L119 G120 A125 D126 G127 I220 V223 Y224 L243 F246	L119-L123 PolarHBondContact O-N 3.49Å; G120-L123 PolarHBondContact O-N 3.4Å; G120-L123 VanDerWaalsContact O-N 3.17Å; L123-A125 VanDerWaalsContact C-N 3.32Å; L123-D126 PolarHBondContact O-N 3.17Å; L123-G127 PolarHBondContact O-N 2.89Å; L123-I220 HydrophobicContact CD2-CG1 4.01Å; L123-V223 HydrophobicContact CD1-CG1 3.73Å; L123-V223 HydrophobicContact CD2-CB 4.38Å; L123-V223 HydrophobicContact CD2-CG1 4.24Å; L123-V223 HydrophobicContact CG-CB 4.34Å; L123-V223 HydrophobicContact CG-CG1 3.77Å; L123-Y224 HydrophobicContact CD1-CE2 4.09Å; L123-Y224 HydrophobicContact CD2-CE2 4.17Å; L123-L243 HydrophobicContact CD1-CD1 3.91Å; L123-L243 HydrophobicContact CD1-CD2 3.92Å; L123-L243 HydrophobicContact CD1-CG 3.46Å; L123-L243 VanDerWaalsContact CD1-CG 3.46Å; L123-F246 HydrophobicContact CB-CB 4.23Å
124	M	95.3	Very high	91.9	Very high	28 Å²	28	22.8 Å²	22.8	14%	0.138	13%	0.131	C	C	.	.	H	α-helix	trans	-62.9	-42.5	172.1	-175.2	-175	170.5	0	0	110.5	G120 L121 G127 V128 F246 G250 Y253 P291	G120-M124 WeakPolarHBondContact O-CB 3.35Å; G120-M124 PolarHBondContact O-N 2.88Å; L121-M124 HydrophobicContact CD2-SD 4.19Å; L121-M124 WeakPolarHBondContact O-CB 3.4Å; L121-M124 PolarHBondContact O-N 3.49Å; M124-G127 PolarHBondContact O-N 3.45Å; M124-V128 VanDerWaalsContact O-CG2 3.28Å; M124-V128 WeakPolarHBondContact O-CG2 3.38Å; M124-V128 PolarHBondContact O-N 3.27Å; M124-F246 VanDerWaalsContact CA-O 3.31Å; M124-F246 WeakPolarHBondContact CA-O 3.31Å; M124-F246 HydrophobicContact CB-CB 4.44Å; M124-G250 WeakPolarHBondContact O-CA 3.46Å; M124-Y253 VanDerWaalsContact CE-CB 3.49Å; M124-Y253 HydrophobicContact CE-CD1 4.08Å; M124-Y253 HydrophobicContact CE-CD2 3.8Å; M124-Y253 HydrophobicContact CE-CG 3.51Å; M124-P291 HydrophobicContact CE-CB 4.46Å; M124-P291 HydrophobicContact CE-CG 3.94Å; M124-P291 HydrophobicContact CG-CB 4.27Å; M124-P291 HydrophobicContact SD-CB 4.24Å; M124-P291 HydrophobicContact SD-CG 4.36Å
125	A	94.4	Very high	91.3	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.008	11%	0.109	C	C	.	.	H	α-helix	trans	-60.2	-48.5	173.6	0	0	0	0	0	112	L121 A122 L123 G127 V128 D129 P291 A292	L121-A125 PolarHBondContact O-N 2.88Å; A122-A125 WeakPolarHBondContact O-CB 3.36Å; A122-A125 PolarHBondContact O-N 2.92Å; L123-A125 VanDerWaalsContact C-N 3.32Å; A125-G127 VanDerWaalsContact C-N 3.31Å; A125-G127 PolarHBondContact O-N 3.27Å; A125-V128 WeakPolarHBondContact O-CB 3.08Å; A125-V128 PolarHBondContact O-N 2.86Å; A125-V128 VanDerWaalsContact O-N 3.12Å; A125-D129 PolarHBondContact O-N 3.21Å; A125-P291 HydrophobicContact CB-CB 4.29Å; A125-A292 HydrophobicContact CB-CB 3.77Å
126	D	92.9	Very high	90.7	Very high	4 Å²	4	18.4 Å²	18.4	2%	0.021	11%	0.109	C	C	.	.	H	α-helix	trans	-55.3	-45.2	174.6	-179.1	90.7	0	0	0	112.3	A122 L123 D129 G130 I216 S219 W247	A122-D126 PolarHBondContact O-N 3.16Å; A122-D126 VanDerWaalsContact O-N 3.09Å; L123-D126 PolarHBondContact O-N 3.17Å; D126-D129 PolarHBondContact O-N 3.1Å; D126-G130 PolarHBondContact O-N 3.14Å; D126-I216 HydrophobicContact CB-CG2 4.2Å; D126-I216 WeakPolarHBondContact OD1-CG2 3.39Å; D126-S219 WeakPolarHBondContact CB-OG 3.07Å; D126-S219 VanDerWaalsContact CG-OG 3.29Å; D126-S219 PolarHBondContact OD1-OG 3.17Å; D126-W247 PolarHBondContact OD2-NE1 3.33Å
127	G	91.4	Very high	89.8	Confident	0 Å²	0	20 Å²	20	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.6	-49.5	174.8	0	0	0	0	0	111.8	L123 M124 A125 D129 G130 F131	L123-G127 PolarHBondContact O-N 2.89Å; M124-G127 PolarHBondContact O-N 3.45Å; A125-G127 VanDerWaalsContact C-N 3.31Å; A125-G127 PolarHBondContact O-N 3.27Å; G127-D129 PolarHBondContact O-N 2.9Å; G127-G130 PolarHBondContact O-N 3.27Å; G127-F131 WeakPolarHBondContact O-CD2 3.3Å; G127-F131 PolarHBondContact O-N 3.49Å; G127-F131 VanDerWaalsContact O-N 3.11Å
128	V	93	Very high	88.8	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-54.5	-52.3	178.4	169.4	0	0	0	0	110.9	M124 A125 G130 F131 V132 G250 Y253 A254 C288 P291	M124-V128 VanDerWaalsContact O-CG2 3.28Å; M124-V128 WeakPolarHBondContact O-CG2 3.38Å; M124-V128 PolarHBondContact O-N 3.27Å; A125-V128 WeakPolarHBondContact O-CB 3.08Å; A125-V128 PolarHBondContact O-N 2.86Å; A125-V128 VanDerWaalsContact O-N 3.12Å; V128-G130 VanDerWaalsContact C-N 3.29Å; V128-G130 PolarHBondContact O-N 3.44Å; V128-F131 PolarHBondContact O-N 2.84Å; V128-F131 VanDerWaalsContact O-N 3.16Å; V128-V132 HydrophobicContact CG1-CG2 3.73Å; V128-V132 VanDerWaalsContact O-CB 3.27Å; V128-V132 WeakPolarHBondContact O-CB 3.4Å; V128-V132 WeakPolarHBondContact O-CG2 3.38Å; V128-V132 PolarHBondContact O-N 3.08Å; V128-G250 VanDerWaalsContact CG2-O 3.31Å; V128-G250 WeakPolarHBondContact CG2-O 3.22Å; V128-Y253 HydrophobicContact CG2-CD1 3.65Å; V128-Y253 HydrophobicContact CG2-CE1 4.41Å; V128-A254 HydrophobicContact CG1-CB 4.39Å; V128-A254 HydrophobicContact CG2-CB 4.48Å; V128-C288 HydrophobicContact CG1-CB 3.48Å; V128-C288 VanDerWaalsContact CG1-CB 3.48Å; V128-P291 HydrophobicContact CG2-CG 4.42Å
129	D	89.6	Confident	87.7	Confident	10 Å²	10	15.1 Å²	15.1	5%	0.053	10%	0.098	C	C	.	.	H	α-helix	trans	-65.2	-32.8	-178.2	-78.8	-52.2	0	0	0	113.6	A125 D126 G127 I216	A125-D129 PolarHBondContact O-N 3.21Å; D126-D129 PolarHBondContact O-N 3.1Å; G127-D129 PolarHBondContact O-N 2.9Å; D129-I216 HydrophobicContact CB-CD1 3.33Å; D129-I216 HydrophobicContact CB-CG1 4.32Å
130	G	85.6	Confident	86.7	Confident	32 Å²	32	15.1 Å²	15.1	33%	0.33	10%	0.098	S	C	.	.	H	α-helix	trans	-60.6	-42.9	172.5	0	0	0	0	0	113.1	D126 G127 V128	D126-G130 PolarHBondContact O-N 3.14Å; G127-G130 PolarHBondContact O-N 3.27Å; V128-G130 VanDerWaalsContact C-N 3.29Å; V128-G130 PolarHBondContact O-N 3.44Å
131	F	86.4	Confident	85.5	Confident	49 Å²	49	18 Å²	18	22%	0.215	11%	0.112	C	C	.	.	H	α-helix	trans	-84.7	-29.3	-178.7	-74.3	-76	0	0	0	113.7	G127 V128 V133 G134 F135 W247 A254	G127-F131 WeakPolarHBondContact O-CD2 3.3Å; G127-F131 PolarHBondContact O-N 3.49Å; G127-F131 VanDerWaalsContact O-N 3.11Å; V128-F131 PolarHBondContact O-N 2.84Å; V128-F131 VanDerWaalsContact O-N 3.16Å; F131-V133 VanDerWaalsContact C-N 3.25Å; F131-V133 PolarHBondContact O-N 3.5Å; F131-G134 PolarHBondContact O-N 3.4Å; F131-G134 VanDerWaalsContact O-N 3.09Å; F131-F135 HydrophobicContact CB-CD2 4.47Å; F131-F135 HydrophobicContact CB-CE2 3.93Å; F131-F135 WeakPolarHBondContact O-CD2 3.33Å; F131-F135 PolarHBondContact O-N 2.81Å; F131-W247 HydrophobicContact CE2-CE3 4.05Å; F131-W247 AromaticContact CE2-CH2 3.56Å; F131-W247 HydrophobicContact CE2-CH2 3.56Å; F131-W247 HydrophobicContact CE2-CZ2 4.2Å; F131-W247 AromaticContact CE2-CZ3 3.46Å; F131-W247 HydrophobicContact CE2-CZ3 3.46Å; F131-W247 VanDerWaalsContact CE2-CZ3 3.46Å; F131-W247 AromaticContact CZ-CH2 3.71Å; F131-W247 HydrophobicContact CZ-CH2 3.71Å; F131-W247 AromaticContact CZ-CZ3 3.62Å; F131-W247 HydrophobicContact CZ-CZ3 3.62Å; F131-A254 HydrophobicContact CB-CB 4.12Å
132	V	86.9	Confident	84.2	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-52.6	-41	-178.5	151.6	0	0	0	0	112.6	V128 G134 F135 V136 R209 F284 M285 C288	V128-V132 HydrophobicContact CG1-CG2 3.73Å; V128-V132 VanDerWaalsContact O-CB 3.27Å; V128-V132 WeakPolarHBondContact O-CB 3.4Å; V128-V132 WeakPolarHBondContact O-CG2 3.38Å; V128-V132 PolarHBondContact O-N 3.08Å; V132-G134 VanDerWaalsContact C-N 3.28Å; V132-G134 PolarHBondContact O-N 2.74Å; V132-F135 PolarHBondContact O-N 3.17Å; V132-F135 VanDerWaalsContact O-N 3.13Å; V132-V136 HydrophobicContact CG1-CG2 4.05Å; V132-V136 WeakPolarHBondContact O-CB 3.09Å; V132-V136 WeakPolarHBondContact O-CG2 3.45Å; V132-V136 PolarHBondContact O-N 2.52Å; V132-R209 VanDerWaalsContact CG1-NH1 3.34Å; V132-F284 HydrophobicContact CB-CE1 4.36Å; V132-F284 HydrophobicContact CG1-CE1 4.3Å; V132-F284 HydrophobicContact CG2-CE1 3.89Å; V132-F284 HydrophobicContact CG2-CZ 3.84Å; V132-M285 HydrophobicContact CB-SD 4.45Å; V132-M285 HydrophobicContact CG1-CE 4.05Å; V132-M285 HydrophobicContact CG1-SD 3.09Å; V132-M285 WeakPolarHBondContact CG1-SD 3.43Å; V132-C288 HydrophobicContact CG2-CB 3.89Å; V132-C288 WeakPolarHBondContact CG2-SG 3.45Å
133	V	83.1	Confident	83	Confident	18 Å²	18	19.6 Å²	19.6	11%	0.109	12%	0.119	C	C	.	.	H	α-helix	trans	-60.2	-41	-178.2	178.3	0	0	0	0	111.1	F131 F135 L137 L154 V158	F131-V133 VanDerWaalsContact C-N 3.25Å; F131-V133 PolarHBondContact O-N 3.5Å; V133-F135 VanDerWaalsContact C-N 3.3Å; V133-F135 PolarHBondContact O-N 2.98Å; V133-L137 WeakPolarHBondContact O-CB 3.33Å; V133-L137 PolarHBondContact O-N 3.4Å; V133-L137 VanDerWaalsContact O-N 3.14Å; V133-L154 HydrophobicContact CG1-CD2 3.99Å; V133-L154 HydrophobicContact CG1-CG 3.97Å; V133-V158 HydrophobicContact CG2-CG1 4.3Å; V133-V158 HydrophobicContact CG2-CG2 4.01Å
134	G	78.6	Confident	81.9	Confident	46 Å²	46	21 Å²	21	47%	0.474	13%	0.126	S	C	.	.	H	α-helix	trans	-64.9	-32.3	177.9	0	0	0	0	0	113.2	F131 V132 P138	F131-G134 PolarHBondContact O-N 3.4Å; F131-G134 VanDerWaalsContact O-N 3.09Å; V132-G134 VanDerWaalsContact C-N 3.28Å; V132-G134 PolarHBondContact O-N 2.74Å; G134-P138 WeakPolarHBondContact O-CD 3.34Å
135	F	80.4	Confident	80.7	Confident	4 Å²	4	23.1 Å²	23.1	2%	0.018	14%	0.142	C	C	.	.	H	α-helix	trans	-87	-31.1	-179.3	-60.4	-43.9	0	0	0	114	F131 V132 V133 A254 S255 A258 I262 F284 Y545	F131-F135 HydrophobicContact CB-CD2 4.47Å; F131-F135 HydrophobicContact CB-CE2 3.93Å; F131-F135 WeakPolarHBondContact O-CD2 3.33Å; F131-F135 PolarHBondContact O-N 2.81Å; V132-F135 PolarHBondContact O-N 3.17Å; V132-F135 VanDerWaalsContact O-N 3.13Å; V133-F135 VanDerWaalsContact C-N 3.3Å; V133-F135 PolarHBondContact O-N 2.98Å; F135-A254 HydrophobicContact CD2-CB 4.31Å; F135-A254 HydrophobicContact CE2-CB 4.04Å; F135-S255 VanDerWaalsContact CZ-OG 3.28Å; F135-S255 WeakPolarHBondContact CZ-OG 3.21Å; F135-A258 HydrophobicContact CB-CB 4.08Å; F135-A258 HydrophobicContact CD2-CB 4.1Å; F135-A258 HydrophobicContact CG-CB 4Å; F135-I262 HydrophobicContact CB-CD1 4.41Å; F135-F284 HydrophobicContact CB-CE1 4.09Å; F135-F284 HydrophobicContact CB-CZ 4.2Å; F135-F284 HydrophobicContact CD2-CZ 4.16Å; F135-Y545 HydrophobicContact CB-CE1 3.95Å; F135-Y545 AromaticContact CD1-CD1 3.33Å; F135-Y545 HydrophobicContact CD1-CD1 3.33Å; F135-Y545 AromaticContact CD1-CE1 3.44Å; F135-Y545 HydrophobicContact CD1-CE1 3.44Å; F135-Y545 VanDerWaalsContact CD1-CE1 3.44Å; F135-Y545 AromaticContact CE1-CD1 3.68Å; F135-Y545 HydrophobicContact CE1-CD1 3.68Å; F135-Y545 HydrophobicContact CE1-CE1 4.26Å; F135-Y545 HydrophobicContact CG-CD1 4.12Å; F135-Y545 AromaticContact CG-CE1 3.98Å; F135-Y545 HydrophobicContact CG-CE1 3.98Å
136	V	81.2	Confident	79.5	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-77.1	-35.4	178.8	170.6	0	0	0	0	111.6	V132 S139 A140 F205 W281 F284 M285	V132-V136 HydrophobicContact CG1-CG2 4.05Å; V132-V136 WeakPolarHBondContact O-CB 3.09Å; V132-V136 WeakPolarHBondContact O-CG2 3.45Å; V132-V136 PolarHBondContact O-N 2.52Å; V136-S139 PolarHBondContact O-N 2.99Å; V136-S139 VanDerWaalsContact O-N 3.08Å; V136-A140 HydrophobicContact CG1-CB 3.98Å; V136-A140 WeakPolarHBondContact O-CB 3.49Å; V136-A140 PolarHBondContact O-N 3.02Å; V136-F205 HydrophobicContact CG1-CZ 4.17Å; V136-W281 HydrophobicContact CG1-CD2 4.17Å; V136-W281 HydrophobicContact CG1-CE3 3.46Å; V136-W281 VanDerWaalsContact CG1-CE3 3.46Å; V136-W281 HydrophobicContact CG1-CZ3 3.92Å; V136-F284 HydrophobicContact CG2-CD1 3.71Å; V136-F284 HydrophobicContact CG2-CE1 3.77Å; V136-M285 HydrophobicContact CG2-CG 3.92Å; V136-M285 HydrophobicContact CG2-SD 3.83Å
137	L	77.1	Confident	78.3	Confident	42 Å²	42	26.8 Å²	26.8	22%	0.22	17%	0.167	C	C	.	.	H	α-helix	trans	-52.8	-48.3	-171.8	-178.8	70.8	0	0	0	114.1	V133 S139 A140 E141 K151 L154	V133-L137 WeakPolarHBondContact O-CB 3.33Å; V133-L137 PolarHBondContact O-N 3.4Å; V133-L137 VanDerWaalsContact O-N 3.14Å; L137-S139 VanDerWaalsContact C-N 3.3Å; L137-S139 PolarHBondContact O-N 2.68Å; L137-A140 PolarHBondContact O-N 3.29Å; L137-E141 WeakPolarHBondContact O-CB 3.27Å; L137-E141 PolarHBondContact O-N 3.44Å; L137-K151 HydrophobicContact CD1-CB 4.38Å; L137-L154 HydrophobicContact CD1-CB 4.47Å; L137-L154 HydrophobicContact CD1-CD2 3.83Å
138	P	73.7	Confident	77.1	Confident	27 Å²	27	32.6 Å²	32.6	18%	0.175	20%	0.198	C	C	.	.	H	α-helix	trans	-64.3	-32.8	179.9	-21.3	33.7	0	0	0	113.6	G134 K142	G134-P138 WeakPolarHBondContact O-CD 3.34Å; P138-K142 WeakPolarHBondContact O-CG 3.4Å
139	S	74.1	Confident	75.7	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.007	23%	0.23	C	C	.	.	H	α-helix	trans	-80.4	-39.2	179	-64.3	0	0	0	0	112	V136 L137 E141 K142 D143 I262	V136-S139 PolarHBondContact O-N 2.99Å; V136-S139 VanDerWaalsContact O-N 3.08Å; L137-S139 VanDerWaalsContact C-N 3.3Å; L137-S139 PolarHBondContact O-N 2.68Å; S139-E141 VanDerWaalsContact C-N 3.31Å; S139-E141 PolarHBondContact O-N 3.22Å; S139-K142 PolarHBondContact O-N 3.13Å; S139-D143 PolarHBondContact O-N 3.15Å; S139-I262 WeakPolarHBondContact OG-CG2 3.49Å
140	A	75.1	Confident	74.9	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-67.1	-32.8	177.2	0	0	0	0	0	112.1	V136 L137 D143 M144	V136-A140 HydrophobicContact CG1-CB 3.98Å; V136-A140 WeakPolarHBondContact O-CB 3.49Å; V136-A140 PolarHBondContact O-N 3.02Å; L137-A140 PolarHBondContact O-N 3.29Å; A140-D143 PolarHBondContact O-N 3.31Å; A140-M144 WeakPolarHBondContact O-CB 3.44Å; A140-M144 PolarHBondContact O-N 3.12Å
141	E	69.8	Low	74.1	Confident	60 Å²	60	39.8 Å²	39.8	28%	0.28	24%	0.238	S	C	.	.	H	α-helix	trans	-57	-49.7	172	177.4	-172	168.5	0	0	111.9	L137 S139 D143 C145 I146 K151	L137-E141 WeakPolarHBondContact O-CB 3.27Å; L137-E141 PolarHBondContact O-N 3.44Å; S139-E141 VanDerWaalsContact C-N 3.31Å; S139-E141 PolarHBondContact O-N 3.22Å; E141-D143 VanDerWaalsContact C-N 3.32Å; E141-D143 PolarHBondContact O-N 3.36Å; E141-C145 WeakPolarHBondContact O-CA 3.28Å; E141-C145 PolarHBondContact O-N 3.44Å; E141-I146 PolarHBondContact O-N 3.46Å; E141-K151 WeakPolarHBondContact OE1-CE 3.37Å; E141-K151 IonicContact OE1-NZ 2.65Å; E141-K151 PolarHBondContact OE1-NZ 2.88Å; E141-K151 WeakPolarHBondContact OE2-CE 3.45Å; E141-K151 IonicContact OE2-NZ 3.97Å; E141-K151 PolarHBondContact OE2-NZ 2.85Å
142	K	68.6	Low	73.5	Confident	39 Å²	39	39.9 Å²	39.9	17%	0.17	25%	0.253	C	S	.	.	H	α-helix	trans	-64.7	-39.3	-177.4	-63.8	173.9	-167.6	173.5	0	111	P138 S139 C532 F536 D541	P138-K142 WeakPolarHBondContact O-CG 3.4Å; S139-K142 PolarHBondContact O-N 3.13Å; K142-C532 WeakPolarHBondContact O-CB 3.31Å; K142-F536 HydrophobicContact CD-CB 4.14Å; K142-F536 HydrophobicContact CD-CD2 4.19Å; K142-F536 HydrophobicContact CG-CD2 4.15Å; K142-F536 PolarHBondContact NZ-O 3.41Å; K142-D541 IonicContact NZ-OD2 3.85Å; K142-D541 PolarHBondContact NZ-OD2 3.45Å
143	D	71.3	Confident	73.2	Confident	47 Å²	47	43.5 Å²	43.5	25%	0.251	27%	0.272	S	S	.	.	H	α-helix	trans	-72.7	-45.8	-179.4	-173	19.9	0	0	0	112.7	S139 A140 E141 H279 W281 R282	S139-D143 PolarHBondContact O-N 3.15Å; A140-D143 PolarHBondContact O-N 3.31Å; E141-D143 VanDerWaalsContact C-N 3.32Å; E141-D143 PolarHBondContact O-N 3.36Å; D143-H279 IonicContact OD1-CD2 3.84Å; D143-H279 PolarHBondContact OD1-CD2 2.72Å; D143-H279 IonicContact OD1-NE2 3.48Å; D143-H279 PolarHBondContact OD1-NE2 2.95Å; D143-H279 VanDerWaalsContact OD1-NE2 3.12Å; D143-H279 IonicContact OD2-CD2 3.68Å; D143-H279 PolarHBondContact OD2-CD2 3.49Å; D143-H279 IonicContact OD2-CG 2.98Å; D143-W281 PolarHBondContact OD2-NE1 3.44Å; D143-R282 IonicContact OD2-CZ 3.01Å; D143-R282 IonicContact OD2-NH1 3.02Å; D143-R282 IonicContact OD2-NH2 2.72Å; D143-R282 PolarHBondContact OD2-NH2 3.23Å
144	M	71.8	Confident	73.2	Confident	33 Å²	33	42.8 Å²	42.8	16%	0.163	27%	0.267	C	S	.	.	H	α-helix	trans	-101.3	4.3	-171.3	-62.4	-171.8	-178	0	0	115	A140 I146 A199 Y202 W281	A140-M144 WeakPolarHBondContact O-CB 3.44Å; A140-M144 PolarHBondContact O-N 3.12Å; M144-I146 HydrophobicContact CB-CD1 4.21Å; M144-I146 HydrophobicContact CB-CG1 3.89Å; M144-I146 PolarHBondContact O-N 3.23Å; M144-A199 VanDerWaalsContact CE-O 3.26Å; M144-A199 WeakPolarHBondContact CE-O 3.34Å; M144-Y202 HydrophobicContact SD-CD2 4.44Å; M144-W281 HydrophobicContact CE-CH2 3.88Å; M144-W281 HydrophobicContact CE-CZ2 3.81Å
145	C	69.3	Low	73.3	Confident	71 Å²	71	41.8 Å²	41.8	48%	0.48	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	51.4	-177	-73.7	0	0	0	0	114.1	E141 C532	E141-C145 WeakPolarHBondContact O-CA 3.28Å; E141-C145 PolarHBondContact O-N 3.44Å; C145-C532 WeakPolarHBondContact CA-SG 3.28Å; C145-C532 HydrophobicContact CB-CB 4.25Å; C145-C532 WeakPolarHBondContact CB-SG 3.01Å; C145-C532 WeakPolarHBondContact SG-CB 3.43Å; C145-C532 PolarHBondContact SG-N 3.31Å; C145-C532 CovalentContact SG-SG 2.04Å; C145-C532 PolarHBondContact SG-SG 2.71Å
146	I	69.4	Low	73.6	Confident	16 Å²	16	45.3 Å²	45.3	8%	0.082	28%	0.276	C	S	.	.			trans	-78.1	131.9	-175	-55.2	172.5	0	0	0	110.4	E141 M144 D150 K151 Y202	E141-I146 PolarHBondContact O-N 3.46Å; M144-I146 HydrophobicContact CB-CD1 4.21Å; M144-I146 HydrophobicContact CB-CG1 3.89Å; M144-I146 PolarHBondContact O-N 3.23Å; I146-D150 HydrophobicContact CG2-CB 3.61Å; I146-K151 HydrophobicContact CG2-CG 4.36Å; I146-Y202 HydrophobicContact CD1-CD2 3.5Å; I146-Y202 HydrophobicContact CD1-CE2 3.58Å; I146-Y202 HydrophobicContact CD1-CG 4.26Å; I146-Y202 HydrophobicContact CG1-CD2 4.03Å; I146-Y202 HydrophobicContact CG1-CE2 4.32Å; I146-Y202 HydrophobicContact CG1-CG 4.3Å; I146-Y202 HydrophobicContact CG2-CE1 4.29Å; I146-Y202 HydrophobicContact CG2-CE2 4.4Å
147	S	68.2	Low	74	Confident	66 Å²	66	47.3 Å²	47.3	46%	0.462	29%	0.286	S	S	.	.			trans	-65.1	150.2	173.7	178.7	0	0	0	0	111.8	A149 D150 K151	S147-A149 PolarHBondContact O-N 3.24Å; S147-D150 PolarHBondContact O-N 3.47Å; S147-K151 PolarHBondContact O-N 3.3Å
148	N	65.4	Low	74.5	Confident	123 Å²	123	46.1 Å²	46.1	66%	0.658	28%	0.28	S	S	*	.	H	α-helix	trans	-54.4	-36.2	176.3	-73.4	-39.5	0	0	0	113.6	D150 K151	N148-D150 VanDerWaalsContact C-N 3.34Å; N148-K151 WeakPolarHBondContact OD1-CE 2.9Å; N148-K151 PolarHBondContact OD1-NZ 3.43Å
149	A	65	Low	75.3	Confident	81 Å²	81	47.8 Å²	47.8	67%	0.669	28%	0.284	S	S	*	.	H	α-helix	trans	-68.8	-34.8	177.6	0	0	0	0	0	112.2	S147 K151	S147-A149 PolarHBondContact O-N 3.24Å; A149-K151 VanDerWaalsContact C-N 3.32Å; A149-K151 PolarHBondContact O-N 3.41Å
150	D	71.5	Confident	76.2	Confident	70 Å²	70	49.9 Å²	49.9	37%	0.374	30%	0.296	S	S	.	.	H	α-helix	trans	-76.4	-19.9	-178.3	-66.9	-31	0	0	0	112.3	I146 S147 N148 G152 L153 Y202	I146-D150 HydrophobicContact CG2-CB 3.61Å; S147-D150 PolarHBondContact O-N 3.47Å; N148-D150 VanDerWaalsContact C-N 3.34Å; D150-G152 PolarHBondContact O-N 3.18Å; D150-L153 VanDerWaalsContact O-CB 3.3Å; D150-L153 WeakPolarHBondContact O-CB 3.39Å; D150-L153 PolarHBondContact O-N 3.12Å; D150-Y202 HydrophobicContact CB-CE1 3.95Å; D150-Y202 PolarHBondContact O-OH 3.46Å
151	K	68.6	Low	77.2	Confident	42 Å²	42	49.9 Å²	49.9	18%	0.183	30%	0.296	C	S	.	.	H	α-helix	trans	-59	-44.7	176.5	-64.1	177.3	-171.8	-174.1	0	112.7	L137 E141 I146 S147 N148 A149 L153 L154	L137-K151 HydrophobicContact CD1-CB 4.38Å; E141-K151 WeakPolarHBondContact OE1-CE 3.37Å; E141-K151 IonicContact OE1-NZ 2.65Å; E141-K151 PolarHBondContact OE1-NZ 2.88Å; E141-K151 WeakPolarHBondContact OE2-CE 3.45Å; E141-K151 IonicContact OE2-NZ 3.97Å; E141-K151 PolarHBondContact OE2-NZ 2.85Å; I146-K151 HydrophobicContact CG2-CG 4.36Å; S147-K151 PolarHBondContact O-N 3.3Å; N148-K151 WeakPolarHBondContact OD1-CE 2.9Å; N148-K151 PolarHBondContact OD1-NZ 3.43Å; A149-K151 VanDerWaalsContact C-N 3.32Å; A149-K151 PolarHBondContact O-N 3.41Å; K151-L153 PolarHBondContact O-N 2.87Å; K151-L154 PolarHBondContact O-N 3.09Å
152	G	73.8	Confident	78.3	Confident	51 Å²	51	47.4 Å²	47.4	53%	0.526	29%	0.285	S	S	.	.	H	α-helix	trans	-66.1	-26.4	-180	0	0	0	0	0	112.7	D150 L154 L156	D150-G152 PolarHBondContact O-N 3.18Å; G152-L154 PolarHBondContact O-N 3.34Å; G152-L156 WeakPolarHBondContact O-CB 3.34Å; G152-L156 PolarHBondContact O-N 3.29Å; G152-L156 VanDerWaalsContact O-N 3.09Å
153	L	81.6	Confident	79.6	Confident	76 Å²	76	47.5 Å²	47.5	40%	0.398	29%	0.286	S	S	.	.	H	α-helix	trans	-65.2	-38.3	-179	-172.7	63.7	0	0	0	112.2	D150 K151 L156 L157 L206	D150-L153 VanDerWaalsContact O-CB 3.3Å; D150-L153 WeakPolarHBondContact O-CB 3.39Å; D150-L153 PolarHBondContact O-N 3.12Å; K151-L153 PolarHBondContact O-N 2.87Å; L153-L156 PolarHBondContact O-N 3.21Å; L153-L157 WeakPolarHBondContact O-CB 3.46Å; L153-L157 PolarHBondContact O-N 3.33Å; L153-L206 HydrophobicContact CD2-CD1 4.08Å
154	L	82.3	Confident	80.7	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-61.8	-50.7	179	179.3	65.7	0	0	0	111.6	V133 L137 K151 G152 L157 V158 F205 L206 R209	V133-L154 HydrophobicContact CG1-CD2 3.99Å; V133-L154 HydrophobicContact CG1-CG 3.97Å; L137-L154 HydrophobicContact CD1-CB 4.47Å; L137-L154 HydrophobicContact CD1-CD2 3.83Å; K151-L154 PolarHBondContact O-N 3.09Å; G152-L154 PolarHBondContact O-N 3.34Å; L154-L157 PolarHBondContact O-N 3.18Å; L154-V158 WeakPolarHBondContact O-CG2 3.47Å; L154-V158 PolarHBondContact O-N 3.46Å; L154-F205 HydrophobicContact CD1-CD1 4.26Å; L154-F205 HydrophobicContact CD1-CE1 3.79Å; L154-F205 HydrophobicContact CD2-CE1 3.9Å; L154-L206 HydrophobicContact CB-CD2 3.91Å; L154-L206 HydrophobicContact CD1-CD2 3.46Å; L154-L206 VanDerWaalsContact CD1-CD2 3.46Å; L154-L206 HydrophobicContact CG-CD2 4.29Å; L154-R209 HydrophobicContact CD1-CB 4.47Å; L154-R209 HydrophobicContact CD1-CG 4.36Å
155	G	80.9	Confident	81.8	Confident	25 Å²	25	46.2 Å²	46.2	26%	0.258	28%	0.282	S	S	.	.	H	α-helix	trans	-61.4	-45.3	178.6	0	0	0	0	0	112	V158 Y159	G155-V158 PolarHBondContact O-N 2.96Å; G155-Y159 VanDerWaalsContact O-CD2 3.25Å; G155-Y159 WeakPolarHBondContact O-CD2 3.17Å; G155-Y159 PolarHBondContact O-N 3.37Å
156	L	86.1	Confident	83	Confident	79 Å²	79	42.8 Å²	42.8	41%	0.414	26%	0.259	S	S	.	.	H	α-helix	trans	-59.6	-48.5	177.2	178.2	64.7	0	0	0	112	G152 L153 V158 Y159 V160 I645	G152-L156 WeakPolarHBondContact O-CB 3.34Å; G152-L156 PolarHBondContact O-N 3.29Å; G152-L156 VanDerWaalsContact O-N 3.09Å; L153-L156 PolarHBondContact O-N 3.21Å; L156-V158 VanDerWaalsContact C-N 3.29Å; L156-V158 PolarHBondContact O-N 2.93Å; L156-Y159 PolarHBondContact O-N 3.43Å; L156-V160 HydrophobicContact CD1-CG2 4.25Å; L156-V160 HydrophobicContact CG-CG2 4.41Å; L156-V160 WeakPolarHBondContact O-CG2 3.35Å; L156-V160 PolarHBondContact O-N 2.92Å; L156-I645 HydrophobicContact CD1-CB 4.35Å; L156-I645 HydrophobicContact CD1-CD1 4.47Å; L156-I645 HydrophobicContact CD1-CG1 4.12Å; L156-I645 HydrophobicContact CD1-CG2 3.4Å
157	L	89.7	Confident	84.2	Confident	42 Å²	42	45.9 Å²	45.9	22%	0.22	28%	0.275	C	S	.	.	H	α-helix	trans	-61.7	-38.8	-176.5	-173.2	69.5	0	0	0	111.6	L153 L154 V160 S161 L206 F210	L153-L157 WeakPolarHBondContact O-CB 3.46Å; L153-L157 PolarHBondContact O-N 3.33Å; L154-L157 PolarHBondContact O-N 3.18Å; L157-V160 PolarHBondContact O-N 3.2Å; L157-S161 WeakPolarHBondContact O-CB 3.44Å; L157-S161 PolarHBondContact O-N 3.11Å; L157-S161 PolarHBondContact O-OG 3.41Å; L157-L206 HydrophobicContact CD2-CB 3.78Å; L157-L206 HydrophobicContact CD2-CD2 3.77Å; L157-L206 HydrophobicContact CD2-CG 4.33Å; L157-L206 WeakPolarHBondContact CD2-O 3.48Å; L157-F210 HydrophobicContact CD1-CB 4.45Å; L157-F210 HydrophobicContact CD1-CD2 3.59Å; L157-F210 HydrophobicContact CD1-CE2 4.3Å; L157-F210 HydrophobicContact CD1-CG 4.37Å; L157-F210 HydrophobicContact CD2-CB 4.06Å; L157-F210 HydrophobicContact CG-CB 4.09Å; L157-F210 HydrophobicContact CG-CD2 3.9Å; L157-F210 HydrophobicContact CG-CG 4.46Å
158	V	88.6	Confident	85.4	Confident	17 Å²	17	45.9 Å²	45.9	10%	0.103	27%	0.272	C	S	.	.	H	α-helix	trans	-64.8	-48.4	176.8	172.9	0	0	0	0	110.7	V133 L154 G155 L156 V160 S161 M162 R209	V133-V158 HydrophobicContact CG2-CG1 4.3Å; V133-V158 HydrophobicContact CG2-CG2 4.01Å; L154-V158 WeakPolarHBondContact O-CG2 3.47Å; L154-V158 PolarHBondContact O-N 3.46Å; G155-V158 PolarHBondContact O-N 2.96Å; L156-V158 VanDerWaalsContact C-N 3.29Å; L156-V158 PolarHBondContact O-N 2.93Å; V158-V160 VanDerWaalsContact C-N 3.33Å; V158-V160 PolarHBondContact O-N 3.4Å; V158-S161 WeakPolarHBondContact CA-OG 3.27Å; V158-S161 PolarHBondContact O-N 3.29Å; V158-S161 VanDerWaalsContact O-N 3.15Å; V158-S161 PolarHBondContact O-OG 2.95Å; V158-M162 HydrophobicContact CG1-SD 4.35Å; V158-M162 WeakPolarHBondContact O-CG 3.49Å; V158-M162 PolarHBondContact O-N 3.26Å; V158-R209 HydrophobicContact CG2-CB 4.3Å
159	Y	90.1	Very high	86.8	Confident	62 Å²	62	41 Å²	41	24%	0.243	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-38.3	176.7	-78.4	-66.5	0	0	0	113.1	G155 L156 S161 M162 M163 K641 A644 I645	G155-Y159 VanDerWaalsContact O-CD2 3.25Å; G155-Y159 WeakPolarHBondContact O-CD2 3.17Å; G155-Y159 PolarHBondContact O-N 3.37Å; L156-Y159 PolarHBondContact O-N 3.43Å; Y159-S161 VanDerWaalsContact C-N 3.35Å; Y159-M162 PolarHBondContact O-N 3.41Å; Y159-M163 WeakPolarHBondContact O-CB 3.35Å; Y159-M163 PolarHBondContact O-N 3.33Å; Y159-K641 HydrophobicContact CD1-CD 4.12Å; Y159-K641 HydrophobicContact CE1-CD 4.5Å; Y159-A644 HydrophobicContact CD1-CB 4.37Å; Y159-A644 HydrophobicContact CE1-CB 4.27Å; Y159-I645 HydrophobicContact CG-CG1 4.39Å
160	V	93.8	Very high	88	Confident	45 Å²	45	37.2 Å²	37.2	27%	0.273	21%	0.213	S	C	.	.	H	α-helix	trans	-63	-43.4	174.5	171.1	0	0	0	0	110.5	L156 L157 V158 M163 V164 I645	L156-V160 HydrophobicContact CD1-CG2 4.25Å; L156-V160 HydrophobicContact CG-CG2 4.41Å; L156-V160 WeakPolarHBondContact O-CG2 3.35Å; L156-V160 PolarHBondContact O-N 2.92Å; L157-V160 PolarHBondContact O-N 3.2Å; V158-V160 VanDerWaalsContact C-N 3.33Å; V158-V160 PolarHBondContact O-N 3.4Å; V160-M163 WeakPolarHBondContact O-CB 3.44Å; V160-M163 PolarHBondContact O-N 3.47Å; V160-V164 WeakPolarHBondContact O-CG2 3.42Å; V160-V164 PolarHBondContact O-N 3.03Å; V160-I645 HydrophobicContact CG2-CD1 3.67Å
161	S	94.8	Very high	88.9	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.2	-41.5	177.8	70.9	0	0	0	0	112.5	L157 V158 Y159 M163 V164 G165 F210 G213 F214	L157-S161 WeakPolarHBondContact O-CB 3.44Å; L157-S161 PolarHBondContact O-N 3.11Å; L157-S161 PolarHBondContact O-OG 3.41Å; V158-S161 WeakPolarHBondContact CA-OG 3.27Å; V158-S161 PolarHBondContact O-N 3.29Å; V158-S161 VanDerWaalsContact O-N 3.15Å; V158-S161 PolarHBondContact O-OG 2.95Å; Y159-S161 VanDerWaalsContact C-N 3.35Å; S161-M163 VanDerWaalsContact C-N 3.34Å; S161-M163 PolarHBondContact O-N 3.27Å; S161-V164 PolarHBondContact O-N 3.32Å; S161-G165 PolarHBondContact O-N 2.84Å; S161-F210 WeakPolarHBondContact CB-O 3.36Å; S161-G213 VanDerWaalsContact OG-CA 3.24Å; S161-G213 WeakPolarHBondContact OG-CA 3.38Å; S161-F214 WeakPolarHBondContact O-CA 3.28Å
162	M	93.9	Very high	90	Very high	8 Å²	8	33.6 Å²	33.6	4%	0.039	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-39.2	174.9	-68	178.6	110	0	0	111.8	V158 Y159 G165 A166 G213 I216 G217 K641	V158-M162 HydrophobicContact CG1-SD 4.35Å; V158-M162 WeakPolarHBondContact O-CG 3.49Å; V158-M162 PolarHBondContact O-N 3.26Å; Y159-M162 PolarHBondContact O-N 3.41Å; M162-G165 PolarHBondContact O-N 3.35Å; M162-A166 VanDerWaalsContact O-CB 3.31Å; M162-A166 WeakPolarHBondContact O-CB 3.36Å; M162-A166 PolarHBondContact O-N 2.68Å; M162-G213 WeakPolarHBondContact CA-O 3.4Å; M162-I216 HydrophobicContact CE-CG2 3.62Å; M162-G217 WeakPolarHBondContact O-CA 3.33Å; M162-K641 HydrophobicContact CB-CD 4.35Å; M162-K641 HydrophobicContact CB-CG 4.09Å; M162-K641 HydrophobicContact SD-CD 4.46Å
163	M	94.8	Very high	90.8	Very high	41 Å²	41	31.2 Å²	31.2	20%	0.202	17%	0.171	C	C	.	.	H	α-helix	trans	-60.3	-50.3	175.5	179.6	-178	68.7	0	0	111.1	Y159 V160 S161 G165 A166 L167 G638 K641 F642	Y159-M163 WeakPolarHBondContact O-CB 3.35Å; Y159-M163 PolarHBondContact O-N 3.33Å; V160-M163 WeakPolarHBondContact O-CB 3.44Å; V160-M163 PolarHBondContact O-N 3.47Å; S161-M163 VanDerWaalsContact C-N 3.34Å; S161-M163 PolarHBondContact O-N 3.27Å; M163-G165 VanDerWaalsContact C-N 3.34Å; M163-A166 PolarHBondContact O-N 3.34Å; M163-L167 WeakPolarHBondContact O-CG 3.09Å; M163-L167 PolarHBondContact O-N 2.99Å; M163-G638 WeakPolarHBondContact CG-O 3.21Å; M163-K641 HydrophobicContact CB-CB 3.86Å; M163-F642 HydrophobicContact SD-CB 3.88Å; M163-F642 HydrophobicContact SD-CD2 4.3Å
164	V	95.5	Very high	91.2	Very high	53 Å²	53	27.8 Å²	27.8	32%	0.321	15%	0.153	S	C	.	.	H	α-helix	trans	-65.1	-41.1	179	177.6	0	0	0	0	110.5	V160 S161 L167 V168 F214	V160-V164 WeakPolarHBondContact O-CG2 3.42Å; V160-V164 PolarHBondContact O-N 3.03Å; S161-V164 PolarHBondContact O-N 3.32Å; V164-L167 PolarHBondContact O-N 3.38Å; V164-V168 HydrophobicContact CG1-CG2 4.43Å; V164-V168 WeakPolarHBondContact O-CG2 3.3Å; V164-V168 PolarHBondContact O-N 2.95Å; V164-V168 VanDerWaalsContact O-N 3.08Å; V164-F214 HydrophobicContact CB-CD2 4.49Å; V164-F214 HydrophobicContact CG1-CD2 4.07Å; V164-F214 HydrophobicContact CG1-CE2 4.02Å
165	G	95.1	Very high	91.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59.1	-48.2	175.3	0	0	0	0	0	112.8	S161 M162 M163 L167 V168 W169 F214	S161-G165 PolarHBondContact O-N 2.84Å; M162-G165 PolarHBondContact O-N 3.35Å; M163-G165 VanDerWaalsContact C-N 3.34Å; G165-L167 VanDerWaalsContact C-N 3.32Å; G165-L167 PolarHBondContact O-N 3Å; G165-V168 PolarHBondContact O-N 3.21Å; G165-W169 WeakPolarHBondContact O-CB 3.34Å; G165-W169 PolarHBondContact O-N 2.93Å; G165-F214 WeakPolarHBondContact CA-O 3.03Å
166	A	94.4	Very high	91.6	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.6	-43.1	179.6	0	0	0	0	0	112.4	M162 M163 G170 G217 G634 N637	M162-A166 VanDerWaalsContact O-CB 3.31Å; M162-A166 WeakPolarHBondContact O-CB 3.36Å; M162-A166 PolarHBondContact O-N 2.68Å; M163-A166 PolarHBondContact O-N 3.34Å; A166-G170 WeakPolarHBondContact O-CA 3.28Å; A166-G170 PolarHBondContact O-N 3.5Å; A166-G217 WeakPolarHBondContact CA-O 3.34Å; A166-G217 VanDerWaalsContact CB-O 3.24Å; A166-G217 WeakPolarHBondContact CB-O 3.48Å; A166-G634 VanDerWaalsContact O-CA 3.25Å; A166-G634 WeakPolarHBondContact O-CA 3.44Å; A166-N637 HydrophobicContact CB-CB 4.14Å
167	L	93.8	Very high	91.7	Very high	81 Å²	81	27.2 Å²	27.2	42%	0.424	14%	0.141	S	C	.	.	H	α-helix	trans	-66.8	-44.8	178.7	-66.3	172.4	0	0	0	112	M163 V164 G165 G171 I635	M163-L167 WeakPolarHBondContact O-CG 3.09Å; M163-L167 PolarHBondContact O-N 2.99Å; V164-L167 PolarHBondContact O-N 3.38Å; G165-L167 VanDerWaalsContact C-N 3.32Å; G165-L167 PolarHBondContact O-N 3Å; L167-G171 PolarHBondContact O-N 3.36Å; L167-I635 HydrophobicContact CD2-CB 4.34Å; L167-I635 HydrophobicContact CD2-CG1 3.95Å
168	V	94.1	Very high	91.9	Very high	66 Å²	66	25.2 Å²	25.2	40%	0.4	13%	0.13	S	C	.	.	H	α-helix	trans	-72.2	-54	-177.2	174.4	0	0	0	0	111.1	V164 G165 G171 L172 F214	V164-V168 HydrophobicContact CG1-CG2 4.43Å; V164-V168 WeakPolarHBondContact O-CG2 3.3Å; V164-V168 PolarHBondContact O-N 2.95Å; V164-V168 VanDerWaalsContact O-N 3.08Å; G165-V168 PolarHBondContact O-N 3.21Å; V168-G171 PolarHBondContact O-N 3.45Å; V168-L172 VanDerWaalsContact O-CB 3.27Å; V168-L172 WeakPolarHBondContact O-CB 3.31Å; V168-L172 PolarHBondContact O-N 3.15Å; V168-F214 HydrophobicContact CB-CE2 4.01Å; V168-F214 HydrophobicContact CB-CZ 4.09Å; V168-F214 HydrophobicContact CG1-CE2 4.34Å; V168-F214 HydrophobicContact CG1-CZ 3.92Å; V168-F214 HydrophobicContact CG2-CE2 4.05Å; V168-F214 HydrophobicContact CG2-CZ 4.42Å
169	W	94.5	Very high	92.1	Very high	21 Å²	21	27.9 Å²	27.9	8%	0.08	14%	0.139	C	C	.	.	H	α-helix	trans	-72.1	-32.6	-176	-65.4	118.9	0	0	0	112.9	G165 L172 C173 C181 V185 I188 F214 I222	G165-W169 WeakPolarHBondContact O-CB 3.34Å; G165-W169 PolarHBondContact O-N 2.93Å; W169-L172 HydrophobicContact CE3-CD2 3.87Å; W169-L172 HydrophobicContact CZ3-CD2 3.77Å; W169-L172 PolarHBondContact O-N 3.01Å; W169-C173 WeakPolarHBondContact O-CB 3.41Å; W169-C173 PolarHBondContact O-N 3.42Å; W169-C181 VanDerWaalsContact CE3-SG 3.54Å; W169-V185 HydrophobicContact CB-CG2 4.03Å; W169-V185 HydrophobicContact CD2-CG2 3.39Å; W169-V185 HydrophobicContact CE3-CG2 3.82Å; W169-V185 HydrophobicContact CG-CG2 3.47Å; W169-V185 VanDerWaalsContact CG-CG2 3.47Å; W169-V185 HydrophobicContact CZ2-CG2 4.35Å; W169-V185 HydrophobicContact CZ3-CG2 4.43Å; W169-I188 HydrophobicContact CH2-CD1 3.68Å; W169-I188 HydrophobicContact CZ2-CD1 3.36Å; W169-F214 AromaticContact CE2-CE1 3.64Å; W169-F214 HydrophobicContact CZ2-CD1 4.33Å; W169-F214 AromaticContact CZ2-CE1 3.59Å; W169-F214 HydrophobicContact CZ2-CE1 3.59Å; W169-F214 HydrophobicContact CZ2-CZ 4.28Å; W169-F214 AromaticContact NE1-CD1 3.67Å; W169-F214 AromaticContact NE1-CE1 3.33Å; W169-F214 VanDerWaalsContact NE1-CE1 3.33Å; W169-F214 AromaticContact NE1-CZ 3.64Å; W169-F214 PolarHBondContact NE1-O 3.45Å; W169-I222 HydrophobicContact CB-CD1 4.21Å
170	G	91.1	Very high	92.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61	-46.7	172.7	0	0	0	0	0	111.8	A166 C173 G630 T631	A166-G170 WeakPolarHBondContact O-CA 3.28Å; A166-G170 PolarHBondContact O-N 3.5Å; G170-C173 PolarHBondContact O-SG 3.33Å; G170-G630 CarbonylContact C-O 3.01Å; G170-G630 WeakPolarHBondContact CA-O 3.46Å; G170-G630 CarbonylContact O-C 3.46Å; G170-T631 PolarHBondContact O-N 3.33Å; G170-T631 VanDerWaalsContact O-N 3.13Å
171	G	89.9	Confident	92.3	Very high	2 Å²	2	27.4 Å²	27.4	2%	0.021	13%	0.134	C	C	.	.	H	α-helix	trans	-65.5	-40.4	174.2	0	0	0	0	0	113.3	L167 V168 C173	L167-G171 PolarHBondContact O-N 3.36Å; V168-G171 PolarHBondContact O-N 3.45Å; G171-C173 PolarHBondContact O-N 2.9Å
172	L	91.4	Very high	92.3	Very high	35 Å²	35	27.4 Å²	27.4	18%	0.183	13%	0.134	C	C	.	.	H	α-helix	trans	-72.1	-29	-174.8	-161.4	63.4	0	0	0	113.2	V168 W169 D174 K175 M176	V168-L172 VanDerWaalsContact O-CB 3.27Å; V168-L172 WeakPolarHBondContact O-CB 3.31Å; V168-L172 PolarHBondContact O-N 3.15Å; W169-L172 HydrophobicContact CE3-CD2 3.87Å; W169-L172 HydrophobicContact CZ3-CD2 3.77Å; W169-L172 PolarHBondContact O-N 3.01Å; L172-D174 VanDerWaalsContact C-N 3.31Å; L172-D174 PolarHBondContact O-N 3Å; L172-K175 PolarHBondContact O-N 3.44Å; L172-M176 HydrophobicContact CD1-CG 3.96Å; L172-M176 HydrophobicContact CD1-SD 3.51Å; L172-M176 VanDerWaalsContact CD1-SD 3.51Å; L172-M176 HydrophobicContact CD2-CE 4.39Å; L172-M176 HydrophobicContact CD2-SD 3.47Å; L172-M176 WeakPolarHBondContact CD2-SD 3.47Å; L172-M176 HydrophobicContact CG-CB 4.46Å; L172-M176 HydrophobicContact CG-CG 3.93Å; L172-M176 HydrophobicContact CG-SD 3.35Å; L172-M176 WeakPolarHBondContact CG-SD 3.41Å; L172-M176 WeakPolarHBondContact O-CB 3.15Å; L172-M176 PolarHBondContact O-N 3.4Å
173	C	91.3	Very high	92.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67.9	-28.8	-178.6	77.7	0	0	0	0	113.7	W169 G170 G171 K175 G177 C181 I222 G630	W169-C173 WeakPolarHBondContact O-CB 3.41Å; W169-C173 PolarHBondContact O-N 3.42Å; G170-C173 PolarHBondContact O-SG 3.33Å; G171-C173 PolarHBondContact O-N 2.9Å; C173-K175 PolarHBondContact O-N 3.26Å; C173-G177 CarbonylContact O-C 3.53Å; C173-G177 PolarHBondContact O-N 3.17Å; C173-C181 HydrophobicContact CB-CB 3.8Å; C173-I222 HydrophobicContact CB-CD1 4.22Å; C173-I222 HydrophobicContact CB-CG1 3.72Å; C173-G630 VanDerWaalsContact SG-CA 3.57Å
174	D	89.3	Confident	92.5	Very high	5 Å²	5	32.3 Å²	32.3	3%	0.027	15%	0.153	C	C	.	.	H	α-helix	trans	-67.7	-24	176.6	-72.7	-26	0	0	0	112	L172 F308 K628 G630 T631	L172-D174 VanDerWaalsContact C-N 3.31Å; L172-D174 PolarHBondContact O-N 3Å; D174-F308 WeakPolarHBondContact O-CE2 3.33Å; D174-K628 VanDerWaalsContact OD2-C 3.27Å; D174-K628 WeakPolarHBondContact OD2-CA 3.5Å; D174-G630 WeakPolarHBondContact OD1-CA 3.49Å; D174-G630 PolarHBondContact OD1-N 3.45Å; D174-G630 PolarHBondContact OD2-N 3.01Å; D174-T631 WeakPolarHBondContact OD2-CB 3.44Å; D174-T631 PolarHBondContact OD2-N 3Å; D174-T631 PolarHBondContact OD2-OG1 2.83Å
175	K	85.4	Confident	92.5	Very high	60 Å²	60	29.9 Å²	29.9	26%	0.261	14%	0.138	S	C	.	.	H	α-helix	trans	-108	-40.2	-176.9	-59.3	-62	171.7	179.9	0	114	L172 C173 Q379 V380	L172-K175 PolarHBondContact O-N 3.44Å; C173-K175 PolarHBondContact O-N 3.26Å; K175-Q379 HydrophobicContact CD-CB 4.32Å; K175-V380 HydrophobicContact CG-CG2 4.32Å
176	M	86.6	Confident	92.5	Very high	33 Å²	33	30 Å²	30	16%	0.163	14%	0.139	C	C	.	.	H	α-helix	trans	-83.5	-17.5	-178.8	-74.2	-174.8	42.3	0	0	113.7	L172 Y184 M376	L172-M176 HydrophobicContact CD1-CG 3.96Å; L172-M176 HydrophobicContact CD1-SD 3.51Å; L172-M176 VanDerWaalsContact CD1-SD 3.51Å; L172-M176 HydrophobicContact CD2-CE 4.39Å; L172-M176 HydrophobicContact CD2-SD 3.47Å; L172-M176 WeakPolarHBondContact CD2-SD 3.47Å; L172-M176 HydrophobicContact CG-CB 4.46Å; L172-M176 HydrophobicContact CG-CG 3.93Å; L172-M176 HydrophobicContact CG-SD 3.35Å; L172-M176 WeakPolarHBondContact CG-SD 3.41Å; L172-M176 WeakPolarHBondContact O-CB 3.15Å; L172-M176 PolarHBondContact O-N 3.4Å; M176-Y184 HydrophobicContact CE-CD2 3.68Å; M176-Y184 HydrophobicContact CE-CE2 3.29Å; M176-M376 HydrophobicContact CG-CE 4.22Å; M176-M376 HydrophobicContact CG-SD 3.93Å; M176-M376 HydrophobicContact SD-SD 4.41Å
177	G	88.4	Confident	92.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.154	C	C	.	.			trans	100.6	149.8	-173.4	0	0	0	0	0	111.7	C173 C181	C173-G177 CarbonylContact O-C 3.53Å; C173-G177 PolarHBondContact O-N 3.17Å; G177-C181 WeakPolarHBondContact O-CB 3.29Å; G177-C181 PolarHBondContact O-N 3.15Å; G177-C181 VanDerWaalsContact O-N 3.12Å
178	R	92.8	Very high	92.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-72.4	-47.6	-170.9	-69.8	68.9	165.2	137.8	-0.8	110.1	C181 L182 I222 Y226 E229 E304 S626	R178-C181 PolarHBondContact O-N 2.91Å; R178-L182 WeakPolarHBondContact O-CB 3.35Å; R178-L182 PolarHBondContact O-N 3.49Å; R178-I222 WeakPolarHBondContact O-CG2 3.17Å; R178-Y226 HydrophobicContact CB-CD2 3.54Å; R178-Y226 HydrophobicContact CB-CE2 4.37Å; R178-Y226 HydrophobicContact CB-CG 3.92Å; R178-Y226 HydrophobicContact CG-CD2 4.29Å; R178-E229 IonicContact CZ-OE1 2.63Å; R178-E229 IonicContact CZ-OE2 2.7Å; R178-E229 IonicContact NE-OE1 2.89Å; R178-E229 PolarHBondContact NE-OE1 3.3Å; R178-E229 VanDerWaalsContact NE-OE1 3.1Å; R178-E229 IonicContact NE-OE2 3.47Å; R178-E229 PolarHBondContact NE-OE2 2.86Å; R178-E229 IonicContact NH2-OE1 2.74Å; R178-E229 PolarHBondContact NH2-OE1 3.14Å; R178-E229 IonicContact NH2-OE2 3.93Å; R178-E304 PolarHBondContact N-OE1 3.13Å; R178-S626 PolarHBondContact NH2-O 3.21Å
179	R	94.1	Very high	92.7	Very high	74 Å²	74	27.6 Å²	27.6	28%	0.279	13%	0.126	S	C	.	.	H	α-helix	trans	-62	-49.9	178.9	178	-163	173.1	-155	4.7	111.5	C181 L182 I183 Y226 V299 V300 M302 E304	R179-C181 VanDerWaalsContact C-N 3.33Å; R179-C181 PolarHBondContact O-N 3.38Å; R179-L182 PolarHBondContact O-N 2.9Å; R179-I183 HydrophobicContact CG-CD1 4.12Å; R179-I183 WeakPolarHBondContact O-CG1 3.25Å; R179-I183 PolarHBondContact O-N 2.86Å; R179-Y226 HydrophobicContact CB-CE2 4.49Å; R179-V299 HydrophobicContact CG-CG1 4.15Å; R179-V300 PolarHBondContact NH2-O 3.43Å; R179-M302 WeakPolarHBondContact CD-O 3.48Å; R179-M302 VanDerWaalsContact CZ-O 3.27Å; R179-M302 PolarHBondContact NE-O 3.23Å; R179-E304 WeakPolarHBondContact CB-OE2 3.38Å; R179-E304 PolarHBondContact N-OE1 3.2Å; R179-E304 PolarHBondContact N-OE2 3.43Å
180	K	93	Very high	92.7	Very high	96 Å²	96	28.1 Å²	28.1	42%	0.417	13%	0.13	S	C	.	.	H	α-helix	trans	-61.2	-43.8	-179.4	-67	-177.1	-172.8	171.7	0	111.4	I183 Y184	K180-I183 PolarHBondContact O-N 3.3Å; K180-Y184 HydrophobicContact CB-CE2 4.27Å; K180-Y184 WeakPolarHBondContact O-CD2 3.41Å; K180-Y184 PolarHBondContact O-N 3.3Å; K180-Y184 VanDerWaalsContact O-N 3.13Å
181	C	94.3	Very high	93	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.2	-43.9	178.3	-156.2	0	0	0	0	111.5	W169 C173 G177 R178 R179 I183 Y184 V185 I222	W169-C181 VanDerWaalsContact CE3-SG 3.54Å; C173-C181 HydrophobicContact CB-CB 3.8Å; G177-C181 WeakPolarHBondContact O-CB 3.29Å; G177-C181 PolarHBondContact O-N 3.15Å; G177-C181 VanDerWaalsContact O-N 3.12Å; R178-C181 PolarHBondContact O-N 2.91Å; R179-C181 VanDerWaalsContact C-N 3.33Å; R179-C181 PolarHBondContact O-N 3.38Å; C181-I183 PolarHBondContact O-N 3.08Å; C181-Y184 PolarHBondContact O-N 3.01Å; C181-V185 PolarHBondContact O-N 3.43Å; C181-I222 HydrophobicContact CB-CD1 3.84Å; C181-I222 WeakPolarHBondContact SG-CD1 3.32Å
182	L	95.4	Very high	93.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.4	-40.8	177.2	-169.5	56.5	0	0	0	112.5	L119 R178 R179 V185 L186 I222 V223 V299	L119-L182 HydrophobicContact CD2-CD2 3.65Å; R178-L182 WeakPolarHBondContact O-CB 3.35Å; R178-L182 PolarHBondContact O-N 3.49Å; R179-L182 PolarHBondContact O-N 2.9Å; L182-V185 PolarHBondContact O-N 3.43Å; L182-L186 HydrophobicContact CD1-CD1 4.16Å; L182-L186 HydrophobicContact CD1-CG 4.24Å; L182-L186 HydrophobicContact CG-CD1 3.97Å; L182-L186 HydrophobicContact CG-CG 4.46Å; L182-L186 WeakPolarHBondContact O-CB 3.24Å; L182-L186 VanDerWaalsContact O-CG 3.32Å; L182-L186 WeakPolarHBondContact O-CG 3.26Å; L182-L186 PolarHBondContact O-N 2.96Å; L182-I222 HydrophobicContact CB-CG2 3.8Å; L182-I222 HydrophobicContact CD1-CG2 4.23Å; L182-I222 HydrophobicContact CG-CG2 4.45Å; L182-V223 HydrophobicContact CD1-CG2 3.85Å; L182-V223 HydrophobicContact CD2-CG2 4.2Å; L182-V299 HydrophobicContact CB-CG1 4.28Å; L182-V299 HydrophobicContact CD2-CB 4.5Å; L182-V299 HydrophobicContact CD2-CG1 4Å; L182-V299 HydrophobicContact CD2-CG2 3.6Å; L182-V299 HydrophobicContact CG-CG1 4.22Å; L182-V299 HydrophobicContact CG-CG2 4.16Å
183	I	96.3	Very high	93.3	Very high	38 Å²	38	32.5 Å²	32.5	20%	0.195	15%	0.153	C	C	.	.	H	α-helix	trans	-61	-46	175.3	-69	169.6	0	0	0	110.9	R179 K180 C181 T187 L296 V299 V300	R179-I183 HydrophobicContact CG-CD1 4.12Å; R179-I183 WeakPolarHBondContact O-CG1 3.25Å; R179-I183 PolarHBondContact O-N 2.86Å; K180-I183 PolarHBondContact O-N 3.3Å; C181-I183 PolarHBondContact O-N 3.08Å; I183-T187 VanDerWaalsContact O-CB 3.27Å; I183-T187 WeakPolarHBondContact O-CB 3.41Å; I183-T187 PolarHBondContact O-N 3.41Å; I183-T187 PolarHBondContact O-OG1 2.94Å; I183-L296 HydrophobicContact CG2-CD1 4.1Å; I183-V299 HydrophobicContact CD1-CG1 4.3Å; I183-V299 HydrophobicContact CG1-CB 4.48Å; I183-V299 HydrophobicContact CG1-CG1 3.67Å; I183-V300 HydrophobicContact CD1-CG2 4.32Å
184	Y	95.2	Very high	93.4	Very high	115 Å²	115	36.6 Å²	36.6	45%	0.451	17%	0.171	S	C	.	.	H	α-helix	trans	-63.5	-46	179.3	-67.1	-52.2	0	0	0	112.1	M176 K180 C181 T187 I188	M176-Y184 HydrophobicContact CE-CD2 3.68Å; M176-Y184 HydrophobicContact CE-CE2 3.29Å; K180-Y184 HydrophobicContact CB-CE2 4.27Å; K180-Y184 WeakPolarHBondContact O-CD2 3.41Å; K180-Y184 PolarHBondContact O-N 3.3Å; K180-Y184 VanDerWaalsContact O-N 3.13Å; C181-Y184 PolarHBondContact O-N 3.01Å; Y184-T187 PolarHBondContact O-N 2.97Å; Y184-I188 WeakPolarHBondContact O-CB 3.32Å; Y184-I188 VanDerWaalsContact O-CG1 3.27Å; Y184-I188 WeakPolarHBondContact O-CG1 3.4Å; Y184-I188 PolarHBondContact O-N 3.43Å
185	V	95.7	Very high	93.6	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	19%	0.188	C	C	.	.	H	α-helix	trans	-58.5	-51.6	178	157.9	0	0	0	0	111.4	W169 C181 L182 T187 I188 D189 G215 I222	W169-V185 HydrophobicContact CB-CG2 4.03Å; W169-V185 HydrophobicContact CD2-CG2 3.39Å; W169-V185 HydrophobicContact CE3-CG2 3.82Å; W169-V185 HydrophobicContact CG-CG2 3.47Å; W169-V185 VanDerWaalsContact CG-CG2 3.47Å; W169-V185 HydrophobicContact CZ2-CG2 4.35Å; W169-V185 HydrophobicContact CZ3-CG2 4.43Å; C181-V185 PolarHBondContact O-N 3.43Å; L182-V185 PolarHBondContact O-N 3.43Å; V185-T187 VanDerWaalsContact C-N 3.32Å; V185-T187 PolarHBondContact O-N 2.98Å; V185-I188 PolarHBondContact O-N 3.43Å; V185-D189 PolarHBondContact O-N 3.34Å; V185-G215 WeakPolarHBondContact CG1-O 3.38Å; V185-I222 HydrophobicContact CG2-CD1 4.03Å
186	L	95.4	Very high	93.8	Very high	4 Å²	4	37 Å²	37	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-65.6	-34.5	179.8	-70.2	173	0	0	0	112.4	A122 L182 L190 A295 L296 V299	A122-L186 HydrophobicContact CB-CD1 4.39Å; A122-L186 HydrophobicContact CB-CD2 4.36Å; L182-L186 HydrophobicContact CD1-CD1 4.16Å; L182-L186 HydrophobicContact CD1-CG 4.24Å; L182-L186 HydrophobicContact CG-CD1 3.97Å; L182-L186 HydrophobicContact CG-CG 4.46Å; L182-L186 WeakPolarHBondContact O-CB 3.24Å; L182-L186 VanDerWaalsContact O-CG 3.32Å; L182-L186 WeakPolarHBondContact O-CG 3.26Å; L182-L186 PolarHBondContact O-N 2.96Å; L186-L190 VanDerWaalsContact O-CB 3.24Å; L186-L190 WeakPolarHBondContact O-CB 3.43Å; L186-L190 PolarHBondContact O-N 3.27Å; L186-A295 HydrophobicContact CD1-CB 4.15Å; L186-L296 HydrophobicContact CB-CB 4.42Å; L186-L296 HydrophobicContact CB-CD1 4.13Å; L186-V299 HydrophobicContact CD1-CG2 4.19Å
187	T	96.3	Very high	94	Very high	51 Å²	51	35.9 Å²	35.9	31%	0.313	17%	0.171	S	C	.	.	H	α-helix	trans	-70	-43.7	178.1	-57.6	0	0	0	0	111.5	I183 Y184 V185 D189 L190 V191	I183-T187 VanDerWaalsContact O-CB 3.27Å; I183-T187 WeakPolarHBondContact O-CB 3.41Å; I183-T187 PolarHBondContact O-N 3.41Å; I183-T187 PolarHBondContact O-OG1 2.94Å; Y184-T187 PolarHBondContact O-N 2.97Å; V185-T187 VanDerWaalsContact C-N 3.32Å; V185-T187 PolarHBondContact O-N 2.98Å; T187-D189 VanDerWaalsContact C-N 3.33Å; T187-L190 PolarHBondContact O-N 3.4Å; T187-V191 HydrophobicContact CG2-CG2 4.28Å; T187-V191 WeakPolarHBondContact O-CB 3.11Å; T187-V191 VanDerWaalsContact O-CG2 3.25Å; T187-V191 WeakPolarHBondContact O-CG2 3.46Å; T187-V191 PolarHBondContact O-N 3.46Å
188	I	95.6	Very high	93.9	Very high	41 Å²	41	41.3 Å²	41.3	21%	0.21	20%	0.195	C	C	.	.	H	α-helix	trans	-58.8	-50.6	176.7	-75.5	168.2	0	0	0	109.2	W169 Y184 V185 V191 F192 C211	W169-I188 HydrophobicContact CH2-CD1 3.68Å; W169-I188 HydrophobicContact CZ2-CD1 3.36Å; Y184-I188 WeakPolarHBondContact O-CB 3.32Å; Y184-I188 VanDerWaalsContact O-CG1 3.27Å; Y184-I188 WeakPolarHBondContact O-CG1 3.4Å; Y184-I188 PolarHBondContact O-N 3.43Å; V185-I188 PolarHBondContact O-N 3.43Å; I188-V191 PolarHBondContact O-N 3.35Å; I188-F192 HydrophobicContact CG2-CD2 3.71Å; I188-F192 HydrophobicContact CG2-CE2 3.93Å; I188-F192 WeakPolarHBondContact O-CD2 3.27Å; I188-F192 PolarHBondContact O-N 3.07Å; I188-C211 WeakPolarHBondContact CG2-O 2.95Å
189	D	94.9	Very high	93.6	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-58.3	-52.2	177.8	175.9	48.2	0	0	0	112.4	V185 T187 V191 F192 S193 S212 I216	V185-D189 PolarHBondContact O-N 3.34Å; T187-D189 VanDerWaalsContact C-N 3.33Å; D189-V191 VanDerWaalsContact C-N 3.33Å; D189-V191 PolarHBondContact O-N 3.43Å; D189-F192 PolarHBondContact O-N 3.49Å; D189-S193 VanDerWaalsContact O-CB 3.24Å; D189-S193 WeakPolarHBondContact O-CB 3.43Å; D189-S193 PolarHBondContact O-N 3.08Å; D189-S193 PolarHBondContact O-OG 3.4Å; D189-S193 PolarHBondContact OD1-OG 3.11Å; D189-S212 PolarHBondContact O-OG 2.94Å; D189-S212 PolarHBondContact OD1-OG 2.93Å; D189-I216 HydrophobicContact CB-CG1 3.89Å; D189-I216 WeakPolarHBondContact OD1-CD1 3.39Å; D189-I216 VanDerWaalsContact OD1-CG1 3.27Å; D189-I216 WeakPolarHBondContact OD1-CG1 3.35Å
190	L	95.3	Very high	93	Very high	32 Å²	32	42.2 Å²	42.2	17%	0.168	20%	0.202	C	C	.	.	H	α-helix	trans	-57.4	-43.6	-179.7	-172.4	75.6	0	0	0	112.7	L186 T187 F194 L289 A292 L293 L296	L186-L190 VanDerWaalsContact O-CB 3.24Å; L186-L190 WeakPolarHBondContact O-CB 3.43Å; L186-L190 PolarHBondContact O-N 3.27Å; T187-L190 PolarHBondContact O-N 3.4Å; L190-F194 WeakPolarHBondContact O-CB 3.43Å; L190-F194 PolarHBondContact O-N 2.98Å; L190-L289 HydrophobicContact CD1-CB 4.03Å; L190-L289 HydrophobicContact CD1-CD2 4.08Å; L190-A292 HydrophobicContact CD1-CB 4.19Å; L190-L293 HydrophobicContact CD1-CB 4.06Å; L190-L293 HydrophobicContact CD2-CD1 3.93Å; L190-L296 HydrophobicContact CD2-CD2 3.98Å
191	V	96.1	Very high	92.5	Very high	71 Å²	71	39.4 Å²	39.4	43%	0.43	20%	0.2	S	C	.	.	H	α-helix	trans	-67.3	-48.2	-179.3	170.4	0	0	0	0	111	T187 I188 D189 F194 L195	T187-V191 HydrophobicContact CG2-CG2 4.28Å; T187-V191 WeakPolarHBondContact O-CB 3.11Å; T187-V191 VanDerWaalsContact O-CG2 3.25Å; T187-V191 WeakPolarHBondContact O-CG2 3.46Å; T187-V191 PolarHBondContact O-N 3.46Å; I188-V191 PolarHBondContact O-N 3.35Å; D189-V191 VanDerWaalsContact C-N 3.33Å; D189-V191 PolarHBondContact O-N 3.43Å; V191-F194 PolarHBondContact O-N 2.74Å; V191-L195 HydrophobicContact CG1-CD1 4.08Å; V191-L195 VanDerWaalsContact O-CG 3.26Å; V191-L195 WeakPolarHBondContact O-CG 3.18Å; V191-L195 PolarHBondContact O-N 2.94Å
192	F	95.4	Very high	92	Very high	57 Å²	57	41.3 Å²	41.3	25%	0.25	21%	0.208	C	C	.	.	H	α-helix	trans	-75.4	-33.9	-176.3	-71.7	-66.7	0	0	0	112.8	I188 D189 L195 S196 L208 C211	I188-F192 HydrophobicContact CG2-CD2 3.71Å; I188-F192 HydrophobicContact CG2-CE2 3.93Å; I188-F192 WeakPolarHBondContact O-CD2 3.27Å; I188-F192 PolarHBondContact O-N 3.07Å; D189-F192 PolarHBondContact O-N 3.49Å; F192-L195 HydrophobicContact CD1-CD1 4.29Å; F192-L195 PolarHBondContact O-N 3.06Å; F192-S196 WeakPolarHBondContact O-CB 3.34Å; F192-S196 PolarHBondContact O-N 2.97Å; F192-S196 PolarHBondContact O-OG 3.23Å; F192-L208 HydrophobicContact CD1-CD2 3.8Å; F192-L208 HydrophobicContact CE1-CD2 4.4Å; F192-C211 HydrophobicContact CB-CB 4.09Å; F192-C211 HydrophobicContact CD1-CB 3.6Å; F192-C211 HydrophobicContact CD2-CB 3.55Å; F192-C211 HydrophobicContact CE1-CB 3.84Å; F192-C211 HydrophobicContact CE2-CB 3.82Å; F192-C211 HydrophobicContact CG-CB 3.47Å; F192-C211 VanDerWaalsContact CG-CB 3.47Å; F192-C211 HydrophobicContact CZ-CB 3.95Å
193	S	92.9	Very high	91.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.5	-38.7	170.3	-78.8	0	0	0	0	111.7	D189 S196 C197 S212	D189-S193 VanDerWaalsContact O-CB 3.24Å; D189-S193 WeakPolarHBondContact O-CB 3.43Å; D189-S193 PolarHBondContact O-N 3.08Å; D189-S193 PolarHBondContact O-OG 3.4Å; D189-S193 PolarHBondContact OD1-OG 3.11Å; S193-S196 WeakPolarHBondContact O-CB 3.37Å; S193-S196 PolarHBondContact O-N 2.47Å; S193-C197 PolarHBondContact O-N 3.1Å; S193-C197 PolarHBondContact O-SG 3.29Å; S193-C197 VanDerWaalsContact O-SG 3.35Å; S193-S212 PolarHBondContact N-OG 3.36Å; S193-S212 PolarHBondContact OG-OG 2.9Å
194	F	93.3	Very high	91.3	Very high	86 Å²	86	47.7 Å²	47.7	38%	0.377	25%	0.249	S	C	.	.	H	α-helix	trans	-63.2	-46.8	172.9	176.9	-104.8	0	0	0	111.9	L190 V191 S196 C197 F198 F286 L289	L190-F194 WeakPolarHBondContact O-CB 3.43Å; L190-F194 PolarHBondContact O-N 2.98Å; V191-F194 PolarHBondContact O-N 2.74Å; F194-S196 PolarHBondContact O-N 2.98Å; F194-C197 VanDerWaalsContact O-CB 3.29Å; F194-C197 WeakPolarHBondContact O-CB 3.4Å; F194-C197 PolarHBondContact O-N 2.74Å; F194-C197 VanDerWaalsContact O-N 3.15Å; F194-F198 HydrophobicContact CD1-CE2 4.37Å; F194-F198 HydrophobicContact CD2-CE2 4.28Å; F194-F198 AromaticContact CE1-CE2 3.88Å; F194-F198 HydrophobicContact CE1-CE2 3.88Å; F194-F198 AromaticContact CE2-CE2 3.77Å; F194-F198 HydrophobicContact CE2-CE2 3.77Å; F194-F198 HydrophobicContact CE2-CZ 4.21Å; F194-F198 AromaticContact CZ-CE2 3.55Å; F194-F198 HydrophobicContact CZ-CE2 3.55Å; F194-F198 HydrophobicContact CZ-CZ 4.01Å; F194-F198 WeakPolarHBondContact O-CD2 3.38Å; F194-F286 HydrophobicContact CD2-CD2 4.08Å; F194-F286 AromaticContact CD2-CE2 3.98Å; F194-F286 HydrophobicContact CD2-CE2 3.98Å; F194-F286 HydrophobicContact CE2-CD2 4.14Å; F194-F286 AromaticContact CE2-CE2 3.78Å; F194-F286 HydrophobicContact CE2-CE2 3.78Å; F194-L289 HydrophobicContact CB-CD1 3.99Å; F194-L289 HydrophobicContact CD2-CD1 4.01Å
195	L	93.3	Very high	91	Very high	75 Å²	75	42.3 Å²	42.3	39%	0.393	23%	0.228	S	C	.	.	H	α-helix	trans	-61.6	-34.3	175.6	-70.2	173.5	0	0	0	112	V191 F192 C197 F198 L208	V191-L195 HydrophobicContact CG1-CD1 4.08Å; V191-L195 VanDerWaalsContact O-CG 3.26Å; V191-L195 WeakPolarHBondContact O-CG 3.18Å; V191-L195 PolarHBondContact O-N 2.94Å; F192-L195 HydrophobicContact CD1-CD1 4.29Å; F192-L195 PolarHBondContact O-N 3.06Å; L195-C197 PolarHBondContact O-N 2.99Å; L195-F198 PolarHBondContact O-N 2.82Å; L195-F198 VanDerWaalsContact O-N 3.07Å; L195-L208 HydrophobicContact CB-CD1 3.99Å; L195-L208 HydrophobicContact CB-CD2 3.96Å; L195-L208 HydrophobicContact CD1-CD2 4.25Å
196	S	90.6	Very high	90.7	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.4	-26.8	178	-64.5	0	0	0	0	112.8	F192 S193 F194 F198 A199 L208	F192-S196 WeakPolarHBondContact O-CB 3.34Å; F192-S196 PolarHBondContact O-N 2.97Å; F192-S196 PolarHBondContact O-OG 3.23Å; S193-S196 WeakPolarHBondContact O-CB 3.37Å; S193-S196 PolarHBondContact O-N 2.47Å; F194-S196 PolarHBondContact O-N 2.98Å; S196-F198 PolarHBondContact O-N 3.42Å; S196-A199 WeakPolarHBondContact O-CB 3.36Å; S196-A199 PolarHBondContact O-N 3.02Å; S196-L208 WeakPolarHBondContact OG-CB 3.35Å
197	C	88.9	Confident	90.6	Very high	8 Å²	8	48.4 Å²	48.4	5%	0.054	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.4	176.8	-60.4	0	0	0	0	112.6	S193 F194 L195 R282	S193-C197 PolarHBondContact O-N 3.1Å; S193-C197 PolarHBondContact O-SG 3.29Å; S193-C197 VanDerWaalsContact O-SG 3.35Å; F194-C197 VanDerWaalsContact O-CB 3.29Å; F194-C197 WeakPolarHBondContact O-CB 3.4Å; F194-C197 PolarHBondContact O-N 2.74Å; F194-C197 VanDerWaalsContact O-N 3.15Å; L195-C197 PolarHBondContact O-N 2.99Å; C197-R282 WeakPolarHBondContact O-CD 3.33Å; C197-R282 WeakPolarHBondContact O-CG 3.36Å
198	F	87.6	Confident	90.5	Very high	115 Å²	115	46.1 Å²	46.1	50%	0.504	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	1.2	-179	-58.2	-83	0	0	0	113.1	F194 L195 S196 Q200	F194-F198 HydrophobicContact CD1-CE2 4.37Å; F194-F198 HydrophobicContact CD2-CE2 4.28Å; F194-F198 AromaticContact CE1-CE2 3.88Å; F194-F198 HydrophobicContact CE1-CE2 3.88Å; F194-F198 AromaticContact CE2-CE2 3.77Å; F194-F198 HydrophobicContact CE2-CE2 3.77Å; F194-F198 HydrophobicContact CE2-CZ 4.21Å; F194-F198 AromaticContact CZ-CE2 3.55Å; F194-F198 HydrophobicContact CZ-CE2 3.55Å; F194-F198 HydrophobicContact CZ-CZ 4.01Å; F194-F198 WeakPolarHBondContact O-CD2 3.38Å; L195-F198 PolarHBondContact O-N 2.82Å; L195-F198 VanDerWaalsContact O-N 3.07Å; S196-F198 PolarHBondContact O-N 3.42Å; F198-Q200 PolarHBondContact O-N 3.48Å
199	A	86.7	Confident	90.3	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.008	23%	0.233	C	C	.	.			trans	-70.6	119.7	-177.3	0	0	0	0	0	111.3	M144 S196 F204 F205 L208 R282	M144-A199 VanDerWaalsContact CE-O 3.26Å; M144-A199 WeakPolarHBondContact CE-O 3.34Å; S196-A199 WeakPolarHBondContact O-CB 3.36Å; S196-A199 PolarHBondContact O-N 3.02Å; A199-F204 HydrophobicContact CB-CD1 4.04Å; A199-F205 HydrophobicContact CB-CB 3.78Å; A199-F205 HydrophobicContact CB-CD2 4.06Å; A199-F205 HydrophobicContact CB-CG 4.43Å; A199-L208 HydrophobicContact CB-CD1 4.18Å; A199-R282 PolarHBondContact O-NE 3.03Å; A199-R282 PolarHBondContact O-NH2 2.89Å
200	Q	81.3	Confident	90.3	Very high	91 Å²	91	47.5 Å²	47.5	43%	0.425	25%	0.245	S	C	.	.			trans	-96.4	-28.2	177.7	-64.2	-171.6	-32.5	0	0	113.2	F198 Q275 F276	F198-Q200 PolarHBondContact O-N 3.48Å; Q200-Q275 PolarHBondContact NE2-O 3.49Å; Q200-F276 HydrophobicContact CG-CE1 4.48Å; Q200-F276 VanDerWaalsContact NE2-CE1 3.26Å
201	G	82.4	Confident	90.3	Very high	37 Å²	37	47 Å²	47	38%	0.381	24%	0.244	S	C	.	.	S	Bend	trans	-99.7	138.7	177.9	0	0	0	0	0	112.2	G203 F204 F205	G201-G203 PolarHBondContact O-N 3.31Å; G201-F204 PolarHBondContact O-N 2.97Å; G201-F205 WeakPolarHBondContact O-CB 3.38Å; G201-F205 PolarHBondContact O-N 2.95Å
202	Y	84	Confident	90.2	Very high	41 Å²	41	43.7 Å²	43.7	16%	0.161	22%	0.224	C	C	.	.	H	α-helix	trans	-59	-44.7	-179.2	-178.3	-121.3	0	0	0	113.2	M144 I146 D150 F204 F205 L206	M144-Y202 HydrophobicContact SD-CD2 4.44Å; I146-Y202 HydrophobicContact CD1-CD2 3.5Å; I146-Y202 HydrophobicContact CD1-CE2 3.58Å; I146-Y202 HydrophobicContact CD1-CG 4.26Å; I146-Y202 HydrophobicContact CG1-CD2 4.03Å; I146-Y202 HydrophobicContact CG1-CE2 4.32Å; I146-Y202 HydrophobicContact CG1-CG 4.3Å; I146-Y202 HydrophobicContact CG2-CE1 4.29Å; I146-Y202 HydrophobicContact CG2-CE2 4.4Å; D150-Y202 HydrophobicContact CB-CE1 3.95Å; D150-Y202 PolarHBondContact O-OH 3.46Å; Y202-F204 PolarHBondContact O-N 3.45Å; Y202-F205 HydrophobicContact CD2-CD1 4.45Å; Y202-F205 WeakPolarHBondContact O-CB 3.26Å; Y202-F205 PolarHBondContact O-N 3.48Å; Y202-L206 HydrophobicContact CD1-CD1 3.87Å; Y202-L206 HydrophobicContact CD2-CG 4.37Å; Y202-L206 HydrophobicContact CE1-CD1 3.42Å; Y202-L206 VanDerWaalsContact CE1-CD1 3.42Å; Y202-L206 HydrophobicContact CE1-CG 4.13Å; Y202-L206 HydrophobicContact CE2-CD1 4.16Å; Y202-L206 HydrophobicContact CE2-CD2 4.17Å; Y202-L206 HydrophobicContact CE2-CG 3.94Å; Y202-L206 HydrophobicContact CG-CD1 4.44Å; Y202-L206 WeakPolarHBondContact O-CG 3.4Å; Y202-L206 PolarHBondContact O-N 3.07Å
203	G	86.2	Confident	90.1	Very high	51 Å²	51	41.1 Å²	41.1	53%	0.526	21%	0.213	S	C	.	.	H	α-helix	trans	-64	-38.3	178.2	0	0	0	0	0	113.6	G201 L206 F207	G201-G203 PolarHBondContact O-N 3.31Å; G203-L206 PolarHBondContact O-N 3.15Å; G203-F207 PolarHBondContact O-N 3.29Å
204	F	89.3	Confident	90.2	Very high	120 Å²	120	43.5 Å²	43.5	53%	0.526	22%	0.224	S	C	.	.	H	α-helix	trans	-70.1	-39.5	175.7	-173.9	-119.3	0	0	0	111.4	A199 G201 Y202 F207 L208	A199-F204 HydrophobicContact CB-CD1 4.04Å; G201-F204 PolarHBondContact O-N 2.97Å; Y202-F204 PolarHBondContact O-N 3.45Å; F204-F207 PolarHBondContact O-N 2.93Å; F204-L208 HydrophobicContact CD1-CD1 3.9Å; F204-L208 HydrophobicContact CE1-CD1 3.55Å; F204-L208 HydrophobicContact CE1-CG 4.34Å; F204-L208 HydrophobicContact CE2-CD1 4.4Å; F204-L208 HydrophobicContact CE2-CD2 4.4Å; F204-L208 HydrophobicContact CE2-CG 4.34Å; F204-L208 HydrophobicContact CG-CD1 4.48Å; F204-L208 HydrophobicContact CZ-CD1 3.83Å; F204-L208 HydrophobicContact CZ-CD2 4.21Å; F204-L208 HydrophobicContact CZ-CG 4.2Å; F204-L208 WeakPolarHBondContact O-CG 3.14Å; F204-L208 PolarHBondContact O-N 2.86Å
205	F	89.7	Confident	90.2	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.009	21%	0.206	C	C	.	.	H	α-helix	trans	-59.3	-46.1	172.1	175.9	-106.4	0	0	0	111.9	V136 L154 A199 G201 Y202 F207 L208 R209 W281	V136-F205 HydrophobicContact CG1-CZ 4.17Å; L154-F205 HydrophobicContact CD1-CD1 4.26Å; L154-F205 HydrophobicContact CD1-CE1 3.79Å; L154-F205 HydrophobicContact CD2-CE1 3.9Å; A199-F205 HydrophobicContact CB-CB 3.78Å; A199-F205 HydrophobicContact CB-CD2 4.06Å; A199-F205 HydrophobicContact CB-CG 4.43Å; G201-F205 WeakPolarHBondContact O-CB 3.38Å; G201-F205 PolarHBondContact O-N 2.95Å; Y202-F205 HydrophobicContact CD2-CD1 4.45Å; Y202-F205 WeakPolarHBondContact O-CB 3.26Å; Y202-F205 PolarHBondContact O-N 3.48Å; F205-F207 PolarHBondContact O-N 3.34Å; F205-L208 PolarHBondContact O-N 2.94Å; F205-R209 HydrophobicContact CE1-CG 4.27Å; F205-R209 HydrophobicContact CE2-CG 4.2Å; F205-R209 HydrophobicContact CZ-CG 4.08Å; F205-R209 VanDerWaalsContact CZ-NH2 3.32Å; F205-R209 WeakPolarHBondContact O-CG 3.34Å; F205-R209 PolarHBondContact O-N 3.25Å; F205-W281 HydrophobicContact CD2-CH2 4.38Å; F205-W281 HydrophobicContact CD2-CZ3 4.45Å; F205-W281 HydrophobicContact CE2-CH2 4.16Å; F205-W281 AromaticContact CE2-CZ3 3.81Å; F205-W281 HydrophobicContact CE2-CZ3 3.81Å; F205-W281 HydrophobicContact CZ-CZ3 4.25Å
206	L	90.1	Very high	90.2	Very high	16 Å²	16	36.4 Å²	36.4	8%	0.084	19%	0.19	C	C	.	.	H	α-helix	trans	-58.4	-45.9	175.2	-78.7	173.1	0	0	0	112.2	L153 L154 L157 Y202 G203 R209 F210	L153-L206 HydrophobicContact CD2-CD1 4.08Å; L154-L206 HydrophobicContact CB-CD2 3.91Å; L154-L206 HydrophobicContact CD1-CD2 3.46Å; L154-L206 VanDerWaalsContact CD1-CD2 3.46Å; L154-L206 HydrophobicContact CG-CD2 4.29Å; L157-L206 HydrophobicContact CD2-CB 3.78Å; L157-L206 HydrophobicContact CD2-CD2 3.77Å; L157-L206 HydrophobicContact CD2-CG 4.33Å; L157-L206 WeakPolarHBondContact CD2-O 3.48Å; Y202-L206 HydrophobicContact CD1-CD1 3.87Å; Y202-L206 HydrophobicContact CD2-CG 4.37Å; Y202-L206 HydrophobicContact CE1-CD1 3.42Å; Y202-L206 VanDerWaalsContact CE1-CD1 3.42Å; Y202-L206 HydrophobicContact CE1-CG 4.13Å; Y202-L206 HydrophobicContact CE2-CD1 4.16Å; Y202-L206 HydrophobicContact CE2-CD2 4.17Å; Y202-L206 HydrophobicContact CE2-CG 3.94Å; Y202-L206 HydrophobicContact CG-CD1 4.44Å; Y202-L206 WeakPolarHBondContact O-CG 3.4Å; Y202-L206 PolarHBondContact O-N 3.07Å; G203-L206 PolarHBondContact O-N 3.15Å; L206-R209 PolarHBondContact O-N 3.19Å; L206-F210 PolarHBondContact O-N 3.13Å
207	F	93	Very high	90.2	Very high	117 Å²	117	36.4 Å²	36.4	51%	0.513	19%	0.191	S	C	.	.	H	α-helix	trans	-60.8	-46.6	178.8	173.9	-102.4	0	0	0	112.1	G203 F204 F205 R209 F210 C211	G203-F207 PolarHBondContact O-N 3.29Å; F204-F207 PolarHBondContact O-N 2.93Å; F205-F207 PolarHBondContact O-N 3.34Å; F207-R209 VanDerWaalsContact C-N 3.31Å; F207-R209 PolarHBondContact O-N 2.86Å; F207-F210 WeakPolarHBondContact O-CB 3.34Å; F207-F210 PolarHBondContact O-N 3.14Å; F207-C211 PolarHBondContact O-N 3.13Å; F207-C211 PolarHBondContact O-SG 2.69Å
208	L	94	Very high	90.2	Very high	4 Å²	4	36 Å²	36	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-64	-37.9	178.1	-65.9	171.9	0	0	0	111.7	F192 L195 S196 A199 F204 F205 C211 S212	F192-L208 HydrophobicContact CD1-CD2 3.8Å; F192-L208 HydrophobicContact CE1-CD2 4.4Å; L195-L208 HydrophobicContact CB-CD1 3.99Å; L195-L208 HydrophobicContact CB-CD2 3.96Å; L195-L208 HydrophobicContact CD1-CD2 4.25Å; S196-L208 WeakPolarHBondContact OG-CB 3.35Å; A199-L208 HydrophobicContact CB-CD1 4.18Å; F204-L208 HydrophobicContact CD1-CD1 3.9Å; F204-L208 HydrophobicContact CE1-CD1 3.55Å; F204-L208 HydrophobicContact CE1-CG 4.34Å; F204-L208 HydrophobicContact CE2-CD1 4.4Å; F204-L208 HydrophobicContact CE2-CD2 4.4Å; F204-L208 HydrophobicContact CE2-CG 4.34Å; F204-L208 HydrophobicContact CG-CD1 4.48Å; F204-L208 HydrophobicContact CZ-CD1 3.83Å; F204-L208 HydrophobicContact CZ-CD2 4.21Å; F204-L208 HydrophobicContact CZ-CG 4.2Å; F204-L208 WeakPolarHBondContact O-CG 3.14Å; F204-L208 PolarHBondContact O-N 2.86Å; F205-L208 PolarHBondContact O-N 2.94Å; L208-C211 PolarHBondContact O-N 2.91Å; L208-S212 PolarHBondContact O-N 3.14Å
209	R	91.8	Very high	90.5	Very high	9 Å²	9	30.7 Å²	30.7	3%	0.034	17%	0.165	C	C	.	.	H	α-helix	trans	-66.2	-37.8	174.3	-71.5	-60.4	-177.2	127.7	16.6	113.5	V132 L154 V158 F205 L206 F207 C211 S212 G213 M285	V132-R209 VanDerWaalsContact CG1-NH1 3.34Å; L154-R209 HydrophobicContact CD1-CB 4.47Å; L154-R209 HydrophobicContact CD1-CG 4.36Å; V158-R209 HydrophobicContact CG2-CB 4.3Å; F205-R209 HydrophobicContact CE1-CG 4.27Å; F205-R209 HydrophobicContact CE2-CG 4.2Å; F205-R209 HydrophobicContact CZ-CG 4.08Å; F205-R209 VanDerWaalsContact CZ-NH2 3.32Å; F205-R209 WeakPolarHBondContact O-CG 3.34Å; F205-R209 PolarHBondContact O-N 3.25Å; L206-R209 PolarHBondContact O-N 3.19Å; F207-R209 VanDerWaalsContact C-N 3.31Å; F207-R209 PolarHBondContact O-N 2.86Å; R209-C211 VanDerWaalsContact C-N 3.33Å; R209-S212 PolarHBondContact O-N 2.98Å; R209-G213 PolarHBondContact O-N 2.61Å; R209-M285 VanDerWaalsContact CZ-SD 3.56Å; R209-M285 PolarHBondContact NH2-SD 3.43Å
210	F	93.8	Very high	90.8	Very high	65 Å²	65	31.1 Å²	31.1	29%	0.285	17%	0.167	S	C	.	.	H	α-helix	trans	-60.4	-44.7	172	178.9	-89.8	0	0	0	111.1	L157 S161 L206 F207 G213 F214	L157-F210 HydrophobicContact CD1-CB 4.45Å; L157-F210 HydrophobicContact CD1-CD2 3.59Å; L157-F210 HydrophobicContact CD1-CE2 4.3Å; L157-F210 HydrophobicContact CD1-CG 4.37Å; L157-F210 HydrophobicContact CD2-CB 4.06Å; L157-F210 HydrophobicContact CG-CB 4.09Å; L157-F210 HydrophobicContact CG-CD2 3.9Å; L157-F210 HydrophobicContact CG-CG 4.46Å; S161-F210 WeakPolarHBondContact CB-O 3.36Å; L206-F210 PolarHBondContact O-N 3.13Å; F207-F210 WeakPolarHBondContact O-CB 3.34Å; F207-F210 PolarHBondContact O-N 3.14Å; F210-G213 PolarHBondContact O-N 2.99Å; F210-F214 WeakPolarHBondContact O-CB 3.49Å; F210-F214 PolarHBondContact O-N 2.51Å
211	C	95.3	Very high	91.4	Very high	20 Å²	20	26.8 Å²	26.8	14%	0.135	15%	0.147	C	C	.	.	H	α-helix	trans	-65.1	-38.7	177.2	-67	0	0	0	0	112.9	I188 F192 F207 L208 R209 G215	I188-C211 WeakPolarHBondContact CG2-O 2.95Å; F192-C211 HydrophobicContact CB-CB 4.09Å; F192-C211 HydrophobicContact CD1-CB 3.6Å; F192-C211 HydrophobicContact CD2-CB 3.55Å; F192-C211 HydrophobicContact CE1-CB 3.84Å; F192-C211 HydrophobicContact CE2-CB 3.82Å; F192-C211 HydrophobicContact CG-CB 3.47Å; F192-C211 VanDerWaalsContact CG-CB 3.47Å; F192-C211 HydrophobicContact CZ-CB 3.95Å; F207-C211 PolarHBondContact O-N 3.13Å; F207-C211 PolarHBondContact O-SG 2.69Å; L208-C211 PolarHBondContact O-N 2.91Å; R209-C211 VanDerWaalsContact C-N 3.33Å; C211-G215 PolarHBondContact O-N 3.27Å
212	S	94.6	Very high	92	Very high	2 Å²	2	25 Å²	25	1%	0.014	13%	0.128	C	C	.	.	H	α-helix	trans	-65.3	-49.8	174.6	-126.7	0	0	0	0	112.3	D189 S193 L208 R209 F214 G215 I216	D189-S212 PolarHBondContact O-OG 2.94Å; D189-S212 PolarHBondContact OD1-OG 2.93Å; S193-S212 PolarHBondContact N-OG 3.36Å; S193-S212 PolarHBondContact OG-OG 2.9Å; L208-S212 PolarHBondContact O-N 3.14Å; R209-S212 PolarHBondContact O-N 2.98Å; S212-F214 PolarHBondContact O-N 3.42Å; S212-G215 WeakPolarHBondContact O-CA 3.22Å; S212-G215 PolarHBondContact O-N 3.35Å; S212-I216 WeakPolarHBondContact O-CG1 3.39Å; S212-I216 PolarHBondContact O-N 3.31Å
213	G	93.4	Very high	92.5	Very high	3 Å²	3	23 Å²	23	3%	0.031	12%	0.121	C	C	.	.	H	α-helix	trans	-63.7	-28.3	180	0	0	0	0	0	112.9	S161 M162 R209 F210 G217	S161-G213 VanDerWaalsContact OG-CA 3.24Å; S161-G213 WeakPolarHBondContact OG-CA 3.38Å; M162-G213 WeakPolarHBondContact CA-O 3.4Å; R209-G213 PolarHBondContact O-N 2.61Å; F210-G213 PolarHBondContact O-N 2.99Å; G213-G217 PolarHBondContact O-N 2.8Å
214	F	95.4	Very high	92.9	Very high	51 Å²	51	20.7 Å²	20.7	22%	0.224	10%	0.096	C	C	.	.	H	α-helix	trans	-62.5	-38.3	168.6	175.8	-99.9	0	0	0	112.9	S161 V164 G165 V168 W169 F210 S212	S161-F214 WeakPolarHBondContact O-CA 3.28Å; V164-F214 HydrophobicContact CB-CD2 4.49Å; V164-F214 HydrophobicContact CG1-CD2 4.07Å; V164-F214 HydrophobicContact CG1-CE2 4.02Å; G165-F214 WeakPolarHBondContact CA-O 3.03Å; V168-F214 HydrophobicContact CB-CE2 4.01Å; V168-F214 HydrophobicContact CB-CZ 4.09Å; V168-F214 HydrophobicContact CG1-CE2 4.34Å; V168-F214 HydrophobicContact CG1-CZ 3.92Å; V168-F214 HydrophobicContact CG2-CE2 4.05Å; V168-F214 HydrophobicContact CG2-CZ 4.42Å; W169-F214 AromaticContact CE2-CE1 3.64Å; W169-F214 HydrophobicContact CZ2-CD1 4.33Å; W169-F214 AromaticContact CZ2-CE1 3.59Å; W169-F214 HydrophobicContact CZ2-CE1 3.59Å; W169-F214 HydrophobicContact CZ2-CZ 4.28Å; W169-F214 AromaticContact NE1-CD1 3.67Å; W169-F214 AromaticContact NE1-CE1 3.33Å; W169-F214 VanDerWaalsContact NE1-CE1 3.33Å; W169-F214 AromaticContact NE1-CZ 3.64Å; W169-F214 PolarHBondContact NE1-O 3.45Å; F210-F214 WeakPolarHBondContact O-CB 3.49Å; F210-F214 PolarHBondContact O-N 2.51Å; S212-F214 PolarHBondContact O-N 3.42Å
215	G	93.8	Very high	93	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-63.7	-62.6	170.5	0	0	0	0	0	110.3	V185 C211 S212 G217 G218	V185-G215 WeakPolarHBondContact CG1-O 3.38Å; C211-G215 PolarHBondContact O-N 3.27Å; S212-G215 WeakPolarHBondContact O-CA 3.22Å; S212-G215 PolarHBondContact O-N 3.35Å; G215-G217 PolarHBondContact O-N 3.01Å; G215-G217 VanDerWaalsContact O-N 3.09Å; G215-G218 PolarHBondContact O-N 3Å
216	I	91.6	Very high	93.3	Very high	11 Å²	11	14.9 Å²	14.9	6%	0.056	7%	0.071	C	C	.	.	H	α-helix	trans	-51.6	-39.3	-173.8	-63	157.5	0	0	0	112.7	D126 D129 M162 D189 S212 G218 S219	D126-I216 HydrophobicContact CB-CG2 4.2Å; D126-I216 WeakPolarHBondContact OD1-CG2 3.39Å; D129-I216 HydrophobicContact CB-CD1 3.33Å; D129-I216 HydrophobicContact CB-CG1 4.32Å; M162-I216 HydrophobicContact CE-CG2 3.62Å; D189-I216 HydrophobicContact CB-CG1 3.89Å; D189-I216 WeakPolarHBondContact OD1-CD1 3.39Å; D189-I216 VanDerWaalsContact OD1-CG1 3.27Å; D189-I216 WeakPolarHBondContact OD1-CG1 3.35Å; S212-I216 WeakPolarHBondContact O-CG1 3.39Å; S212-I216 PolarHBondContact O-N 3.31Å; I216-G218 PolarHBondContact O-N 3.46Å; I216-S219 VanDerWaalsContact O-CB 3.23Å; I216-S219 WeakPolarHBondContact O-CB 3.41Å; I216-S219 PolarHBondContact O-N 3.17Å; I216-S219 PolarHBondContact O-OG 3.37Å
217	G	90.5	Very high	93.4	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.01	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-27.4	-179.7	0	0	0	0	0	115.1	M162 A166 G213 G215 N637	M162-G217 WeakPolarHBondContact O-CA 3.33Å; A166-G217 WeakPolarHBondContact CA-O 3.34Å; A166-G217 VanDerWaalsContact CB-O 3.24Å; A166-G217 WeakPolarHBondContact CB-O 3.48Å; G213-G217 PolarHBondContact O-N 2.8Å; G215-G217 PolarHBondContact O-N 3.01Å; G215-G217 VanDerWaalsContact O-N 3.09Å; G217-N637 PolarHBondContact O-ND2 3.28Å
218	G	89.9	Confident	93.3	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-12.8	176.5	0	0	0	0	0	115.5	G215 I216 P221 I222	G215-G218 PolarHBondContact O-N 3Å; I216-G218 PolarHBondContact O-N 3.46Å; G218-P221 WeakPolarHBondContact O-CD 3.48Å; G218-P221 WeakPolarHBondContact O-CG 3.4Å; G218-I222 WeakPolarHBondContact O-CD1 3.29Å; G218-I222 WeakPolarHBondContact O-CG1 3.37Å; G218-I222 PolarHBondContact O-N 2.88Å
219	S	93.3	Very high	93.1	Very high	3 Å²	3	8.5 Å²	8.5	2%	0.021	4%	0.042	C	C	.	.	H	α-helix	trans	-65	-51.6	-168.7	77.2	0	0	0	0	112.1	D126 I216 I222 V223	D126-S219 WeakPolarHBondContact CB-OG 3.07Å; D126-S219 VanDerWaalsContact CG-OG 3.29Å; D126-S219 PolarHBondContact OD1-OG 3.17Å; I216-S219 VanDerWaalsContact O-CB 3.23Å; I216-S219 WeakPolarHBondContact O-CB 3.41Å; I216-S219 PolarHBondContact O-N 3.17Å; I216-S219 PolarHBondContact O-OG 3.37Å; S219-I222 PolarHBondContact O-N 2.92Å; S219-V223 WeakPolarHBondContact O-CB 3.35Å; S219-V223 VanDerWaalsContact O-CG2 3.28Å; S219-V223 WeakPolarHBondContact O-CG2 3.37Å; S219-V223 PolarHBondContact O-N 2.69Å
220	I	92.7	Very high	93	Very high	9 Å²	9	8.1 Å²	8.1	5%	0.046	4%	0.04	C	C	.	.	H	α-helix	trans	-54.7	-60.3	-178.5	-64.2	168.6	0	0	0	111.4	L123 I222 V223 Y224 F633	L123-I220 HydrophobicContact CD2-CG1 4.01Å; I220-I222 VanDerWaalsContact C-N 3.26Å; I220-I222 PolarHBondContact O-N 3.33Å; I220-V223 PolarHBondContact O-N 3.12Å; I220-Y224 HydrophobicContact CG2-CD2 3.87Å; I220-Y224 HydrophobicContact CG2-CE2 4.02Å; I220-Y224 WeakPolarHBondContact O-CD2 3.48Å; I220-Y224 PolarHBondContact O-N 2.89Å; I220-Y224 VanDerWaalsContact O-N 3.09Å; I220-F633 HydrophobicContact CG2-CE2 4.13Å; I220-F633 HydrophobicContact CG2-CZ 3.93Å
221	P	93.8	Very high	92.7	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-61	-36.6	-176.3	23.7	-34	0	0	0	112.1	G218 T225 F633	G218-P221 WeakPolarHBondContact O-CD 3.48Å; G218-P221 WeakPolarHBondContact O-CG 3.4Å; P221-T225 WeakPolarHBondContact O-CB 3.14Å; P221-T225 VanDerWaalsContact O-CG2 3.22Å; P221-T225 WeakPolarHBondContact O-CG2 3.3Å; P221-T225 PolarHBondContact O-N 3.12Å; P221-T225 VanDerWaalsContact O-N 3.11Å; P221-T225 PolarHBondContact O-OG1 2.93Å; P221-F633 HydrophobicContact CB-CB 3.84Å; P221-F633 HydrophobicContact CB-CD1 4.26Å; P221-F633 HydrophobicContact CB-CD2 4.25Å; P221-F633 HydrophobicContact CB-CG 3.85Å
222	I	94.9	Very high	92	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-69.1	-45.7	179.2	-62.5	168.1	0	0	0	111.2	W169 C173 R178 C181 L182 V185 G218 S219 I220 T225 Y226	W169-I222 HydrophobicContact CB-CD1 4.21Å; C173-I222 HydrophobicContact CB-CD1 4.22Å; C173-I222 HydrophobicContact CB-CG1 3.72Å; R178-I222 WeakPolarHBondContact O-CG2 3.17Å; C181-I222 HydrophobicContact CB-CD1 3.84Å; C181-I222 WeakPolarHBondContact SG-CD1 3.32Å; L182-I222 HydrophobicContact CB-CG2 3.8Å; L182-I222 HydrophobicContact CD1-CG2 4.23Å; L182-I222 HydrophobicContact CG-CG2 4.45Å; V185-I222 HydrophobicContact CG2-CD1 4.03Å; G218-I222 WeakPolarHBondContact O-CD1 3.29Å; G218-I222 WeakPolarHBondContact O-CG1 3.37Å; G218-I222 PolarHBondContact O-N 2.88Å; S219-I222 PolarHBondContact O-N 2.92Å; I220-I222 VanDerWaalsContact C-N 3.26Å; I220-I222 PolarHBondContact O-N 3.33Å; I222-T225 WeakPolarHBondContact CA-OG1 3.46Å; I222-T225 PolarHBondContact O-N 3.18Å; I222-T225 PolarHBondContact O-OG1 3.38Å; I222-Y226 WeakPolarHBondContact O-CB 3.5Å; I222-Y226 PolarHBondContact O-N 3.45Å
223	V	95.6	Very high	90.9	Very high	0 Å²	0	7 Å²	7	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-62.2	-48.6	-178	163.6	0	0	0	0	111.1	L119 A122 L123 L182 S219 I220 Y226 F227 L243	L119-V223 HydrophobicContact CB-CG1 3.86Å; L119-V223 HydrophobicContact CD2-CG2 4.42Å; A122-V223 HydrophobicContact CB-CG2 3.93Å; L123-V223 HydrophobicContact CD1-CG1 3.73Å; L123-V223 HydrophobicContact CD2-CB 4.38Å; L123-V223 HydrophobicContact CD2-CG1 4.24Å; L123-V223 HydrophobicContact CG-CB 4.34Å; L123-V223 HydrophobicContact CG-CG1 3.77Å; L182-V223 HydrophobicContact CD1-CG2 3.85Å; L182-V223 HydrophobicContact CD2-CG2 4.2Å; S219-V223 WeakPolarHBondContact O-CB 3.35Å; S219-V223 VanDerWaalsContact O-CG2 3.28Å; S219-V223 WeakPolarHBondContact O-CG2 3.37Å; S219-V223 PolarHBondContact O-N 2.69Å; I220-V223 PolarHBondContact O-N 3.12Å; V223-Y226 PolarHBondContact O-N 3.12Å; V223-F227 WeakPolarHBondContact O-CB 3.27Å; V223-F227 PolarHBondContact O-N 3.23Å; V223-L243 HydrophobicContact CG1-CD2 3.85Å
224	Y	93.9	Very high	89.9	Confident	2 Å²	2	13.3 Å²	13.3	1%	0.008	7%	0.067	C	C	.	.	H	α-helix	trans	-65	-46.3	-179.9	-83.5	-87.3	0	0	0	111.5	L123 I220 Y226 F227 T228 L240 L243 C244 E617 F633	L123-Y224 HydrophobicContact CD1-CE2 4.09Å; L123-Y224 HydrophobicContact CD2-CE2 4.17Å; I220-Y224 HydrophobicContact CG2-CD2 3.87Å; I220-Y224 HydrophobicContact CG2-CE2 4.02Å; I220-Y224 WeakPolarHBondContact O-CD2 3.48Å; I220-Y224 PolarHBondContact O-N 2.89Å; I220-Y224 VanDerWaalsContact O-N 3.09Å; Y224-Y226 VanDerWaalsContact C-N 3.35Å; Y224-Y226 PolarHBondContact O-N 2.94Å; Y224-F227 PolarHBondContact O-N 3.36Å; Y224-T228 WeakPolarHBondContact O-CG2 3.23Å; Y224-T228 PolarHBondContact O-N 2.91Å; Y224-T228 PolarHBondContact O-OG1 3.23Å; Y224-L240 HydrophobicContact CD1-CD2 3.81Å; Y224-L240 HydrophobicContact CE1-CB 4.47Å; Y224-L240 HydrophobicContact CE1-CD2 4.37Å; Y224-L243 HydrophobicContact CE1-CD2 4.41Å; Y224-C244 VanDerWaalsContact OH-CA 3.28Å; Y224-C244 WeakPolarHBondContact OH-CA 3.23Å; Y224-C244 WeakPolarHBondContact OH-CB 2.98Å; Y224-E617 HydrophobicContact CD1-CB 4.28Å; Y224-E617 HydrophobicContact CE1-CB 3.87Å; Y224-E617 HydrophobicContact CE2-CB 4.46Å; Y224-E617 HydrophobicContact CE2-CG 4.49Å; Y224-E617 PolarHBondContact OH-OE2 2.76Å; Y224-F633 VanDerWaalsContact CB-CE1 3.47Å; Y224-F633 HydrophobicContact CD2-CE1 4.11Å; Y224-F633 HydrophobicContact CD2-CZ 4.17Å; Y224-F633 AromaticContact CG-CE1 3.82Å; Y224-F633 HydrophobicContact CG-CE1 3.82Å; Y224-F633 HydrophobicContact CG-CZ 4.27Å
225	T	92.9	Very high	89.1	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-60.8	-44.9	177.6	51.2	0	0	0	0	111.9	P221 I222 F227 T228 E229 V621 R629	P221-T225 WeakPolarHBondContact O-CB 3.14Å; P221-T225 VanDerWaalsContact O-CG2 3.22Å; P221-T225 WeakPolarHBondContact O-CG2 3.3Å; P221-T225 PolarHBondContact O-N 3.12Å; P221-T225 VanDerWaalsContact O-N 3.11Å; P221-T225 PolarHBondContact O-OG1 2.93Å; I222-T225 WeakPolarHBondContact CA-OG1 3.46Å; I222-T225 PolarHBondContact O-N 3.18Å; I222-T225 PolarHBondContact O-OG1 3.38Å; T225-F227 PolarHBondContact O-N 3.13Å; T225-T228 PolarHBondContact O-N 3.41Å; T225-T228 PolarHBondContact O-OG1 2.96Å; T225-E229 WeakPolarHBondContact O-CG 3.4Å; T225-E229 PolarHBondContact O-N 3.46Å; T225-V621 HydrophobicContact CG2-CG1 4.01Å; T225-R629 HydrophobicContact CG2-CB 4.12Å; T225-R629 HydrophobicContact CG2-CG 3.61Å
226	Y	94.4	Very high	88.6	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62	-45	178.3	-173.5	-135.8	0	0	0	112.3	L115 L119 R178 R179 I222 V223 Y224 E229 F230 M302 P303	L115-Y226 HydrophobicContact CD1-CD1 4.33Å; L115-Y226 HydrophobicContact CD1-CE1 3.63Å; L119-Y226 HydrophobicContact CD1-CD1 3.64Å; L119-Y226 HydrophobicContact CD1-CE1 4.21Å; L119-Y226 HydrophobicContact CD1-CG 4.46Å; L119-Y226 HydrophobicContact CD2-CD1 3.53Å; L119-Y226 HydrophobicContact CD2-CE1 3.83Å; L119-Y226 HydrophobicContact CG-CD1 4.16Å; L119-Y226 HydrophobicContact CG-CE1 4.46Å; R178-Y226 HydrophobicContact CB-CD2 3.54Å; R178-Y226 HydrophobicContact CB-CE2 4.37Å; R178-Y226 HydrophobicContact CB-CG 3.92Å; R178-Y226 HydrophobicContact CG-CD2 4.29Å; R179-Y226 HydrophobicContact CB-CE2 4.49Å; I222-Y226 WeakPolarHBondContact O-CB 3.5Å; I222-Y226 PolarHBondContact O-N 3.45Å; V223-Y226 PolarHBondContact O-N 3.12Å; Y224-Y226 VanDerWaalsContact C-N 3.35Å; Y224-Y226 PolarHBondContact O-N 2.94Å; Y226-E229 PolarHBondContact O-N 3.37Å; Y226-F230 AromaticContact CD2-CE2 3.92Å; Y226-F230 HydrophobicContact CD2-CE2 3.92Å; Y226-F230 HydrophobicContact CE2-CD2 4.41Å; Y226-F230 AromaticContact CE2-CE2 3.5Å; Y226-F230 HydrophobicContact CE2-CE2 3.5Å; Y226-F230 VanDerWaalsContact CE2-CE2 3.5Å; Y226-F230 HydrophobicContact CE2-CZ 4.27Å; Y226-F230 WeakPolarHBondContact O-CD2 3.12Å; Y226-M302 WeakPolarHBondContact OH-CB 3.23Å; Y226-P303 PolarHBondContact OH-O 3.22Å
227	F	93.8	Very high	88.1	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-67.2	-39.5	179.4	-166.1	-136.7	0	0	0	112.4	L115 F116 L119 V223 Y224 T225 E229 F230 L231 H239 L240 L243	L115-F227 HydrophobicContact CD2-CD2 4Å; L115-F227 HydrophobicContact CG-CD2 4.12Å; F116-F227 HydrophobicContact CB-CE2 3.93Å; F116-F227 HydrophobicContact CB-CZ 3.76Å; F116-F227 AromaticContact CD2-CE1 3.84Å; F116-F227 HydrophobicContact CD2-CE1 3.84Å; F116-F227 AromaticContact CD2-CZ 3.67Å; F116-F227 HydrophobicContact CD2-CZ 3.67Å; F116-F227 HydrophobicContact CG-CZ 4.2Å; L119-F227 HydrophobicContact CD1-CB 3.64Å; L119-F227 HydrophobicContact CD1-CD2 4.01Å; L119-F227 HydrophobicContact CD1-CG 4.13Å; V223-F227 WeakPolarHBondContact O-CB 3.27Å; V223-F227 PolarHBondContact O-N 3.23Å; Y224-F227 PolarHBondContact O-N 3.36Å; T225-F227 PolarHBondContact O-N 3.13Å; F227-E229 PolarHBondContact O-N 3.38Å; F227-F230 PolarHBondContact O-N 3.27Å; F227-F230 VanDerWaalsContact O-N 3.16Å; F227-L231 HydrophobicContact CD1-CD1 3.57Å; F227-L231 HydrophobicContact CD1-CG 4.34Å; F227-L231 HydrophobicContact CD2-CG 4.47Å; F227-L231 HydrophobicContact CE1-CD1 3.56Å; F227-L231 HydrophobicContact CE1-CD2 4.25Å; F227-L231 HydrophobicContact CE1-CG 4.21Å; F227-L231 HydrophobicContact CE2-CD1 4.48Å; F227-L231 HydrophobicContact CE2-CD2 4.2Å; F227-L231 HydrophobicContact CE2-CG 4.3Å; F227-L231 HydrophobicContact CG-CD1 4.08Å; F227-L231 HydrophobicContact CG-CG 4.47Å; F227-L231 HydrophobicContact CZ-CD1 4.01Å; F227-L231 HydrophobicContact CZ-CD2 3.87Å; F227-L231 HydrophobicContact CZ-CG 4.16Å; F227-L231 WeakPolarHBondContact O-CG 3.38Å; F227-L231 PolarHBondContact O-N 3.45Å; F227-H239 HydrophobicContact CE1-CB 3.87Å; F227-H239 HydrophobicContact CZ-CB 4.13Å; F227-L240 HydrophobicContact CB-CD2 4.32Å; F227-L240 HydrophobicContact CD1-CD2 3.66Å; F227-L240 HydrophobicContact CD1-CG 4.43Å; F227-L240 HydrophobicContact CG-CD2 4.44Å; F227-L243 HydrophobicContact CB-CD2 4.2Å; F227-L243 HydrophobicContact CD1-CD2 3.67Å; F227-L243 HydrophobicContact CE1-CB 4.49Å; F227-L243 HydrophobicContact CE1-CD2 4.37Å; F227-L243 HydrophobicContact CG-CD2 4.19Å
228	T	90.9	Very high	88	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.006	9%	0.089	C	C	.	.	H	α-helix	trans	-59.3	-31.6	-179.7	63.8	0	0	0	0	113.7	Y224 T225 F230 L231 L240 V621 R629	Y224-T228 WeakPolarHBondContact O-CG2 3.23Å; Y224-T228 PolarHBondContact O-N 2.91Å; Y224-T228 PolarHBondContact O-OG1 3.23Å; T225-T228 PolarHBondContact O-N 3.41Å; T225-T228 PolarHBondContact O-OG1 2.96Å; T228-F230 VanDerWaalsContact C-N 3.27Å; T228-F230 PolarHBondContact O-N 3.17Å; T228-L231 PolarHBondContact O-N 2.87Å; T228-L240 HydrophobicContact CG2-CD1 3.58Å; T228-L240 HydrophobicContact CG2-CD2 3.69Å; T228-L240 HydrophobicContact CG2-CG 4.23Å; T228-V621 HydrophobicContact CG2-CB 3.57Å; T228-V621 HydrophobicContact CG2-CG1 4.09Å; T228-V621 HydrophobicContact CG2-CG2 3.3Å; T228-R629 PolarHBondContact OG1-NH1 3.44Å
229	E	89.4	Confident	88	Confident	2 Å²	2	18.9 Å²	18.9	1%	0.009	9%	0.092	C	C	.	.	H	α-helix	trans	-75.8	-17.3	-175.6	-67.8	173.3	176.4	0	0	112.5	Y99 R178 T225 Y226 F227 S305 R307 R629	Y99-E229 PolarHBondContact OH-O 3.11Å; R178-E229 IonicContact CZ-OE1 2.63Å; R178-E229 IonicContact CZ-OE2 2.7Å; R178-E229 IonicContact NE-OE1 2.89Å; R178-E229 PolarHBondContact NE-OE1 3.3Å; R178-E229 VanDerWaalsContact NE-OE1 3.1Å; R178-E229 IonicContact NE-OE2 3.47Å; R178-E229 PolarHBondContact NE-OE2 2.86Å; R178-E229 IonicContact NH2-OE1 2.74Å; R178-E229 PolarHBondContact NH2-OE1 3.14Å; R178-E229 IonicContact NH2-OE2 3.93Å; T225-E229 WeakPolarHBondContact O-CG 3.4Å; T225-E229 PolarHBondContact O-N 3.46Å; Y226-E229 PolarHBondContact O-N 3.37Å; F227-E229 PolarHBondContact O-N 3.38Å; E229-S305 WeakPolarHBondContact CB-OG 3.44Å; E229-S305 WeakPolarHBondContact OE2-CB 3.43Å; E229-S305 PolarHBondContact OE2-OG 3.03Å; E229-R307 HydrophobicContact CB-CB 4.31Å; E229-R307 HydrophobicContact CG-CB 4.31Å; E229-R629 IonicContact OE1-NH1 2.74Å
230	F	89.3	Confident	87.8	Confident	1 Å²	1	18.8 Å²	18.8	0%	0.004	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	0.1	173.5	-70.3	-84.7	0	0	0	113.8	M103 F111 L115 Y226 F227 T228 P303 P306 I321 V325	M103-F230 WeakPolarHBondContact CE-O 3.24Å; F111-F230 HydrophobicContact CD1-CD1 4.49Å; F111-F230 AromaticContact CE1-CD1 3.63Å; F111-F230 HydrophobicContact CE1-CD1 3.63Å; F111-F230 AromaticContact CE1-CE1 3.76Å; F111-F230 HydrophobicContact CE1-CE1 3.76Å; F111-F230 HydrophobicContact CE1-CG 4.29Å; F111-F230 HydrophobicContact CZ-CD1 4.4Å; F111-F230 HydrophobicContact CZ-CE1 4.08Å; L115-F230 HydrophobicContact CD2-CB 3.78Å; L115-F230 HydrophobicContact CD2-CD1 4.5Å; L115-F230 HydrophobicContact CD2-CD2 3.47Å; L115-F230 VanDerWaalsContact CD2-CD2 3.47Å; L115-F230 HydrophobicContact CD2-CE2 4.13Å; L115-F230 HydrophobicContact CD2-CG 3.68Å; Y226-F230 AromaticContact CD2-CE2 3.92Å; Y226-F230 HydrophobicContact CD2-CE2 3.92Å; Y226-F230 HydrophobicContact CE2-CD2 4.41Å; Y226-F230 AromaticContact CE2-CE2 3.5Å; Y226-F230 HydrophobicContact CE2-CE2 3.5Å; Y226-F230 VanDerWaalsContact CE2-CE2 3.5Å; Y226-F230 HydrophobicContact CE2-CZ 4.27Å; Y226-F230 WeakPolarHBondContact O-CD2 3.12Å; F227-F230 PolarHBondContact O-N 3.27Å; F227-F230 VanDerWaalsContact O-N 3.16Å; T228-F230 VanDerWaalsContact C-N 3.27Å; T228-F230 PolarHBondContact O-N 3.17Å; F230-P303 HydrophobicContact CZ-CG 4.41Å; F230-P306 HydrophobicContact CD1-CG 4.45Å; F230-P306 HydrophobicContact CE1-CG 3.97Å; F230-P306 HydrophobicContact CZ-CG 4.35Å; F230-I321 HydrophobicContact CE1-CG2 4.15Å; F230-V325 HydrophobicContact CD1-CG2 4.27Å; F230-V325 HydrophobicContact CE1-CG2 4.19Å
231	L	87.6	Confident	87.7	Confident	2 Å²	2	18.3 Å²	18.3	1%	0.01	9%	0.089	C	C	.	.	S	Bend	trans	-100	135.3	-179.1	-74.1	173.1	0	0	0	112.1	F227 T228 R236 H239 L240	F227-L231 HydrophobicContact CD1-CD1 3.57Å; F227-L231 HydrophobicContact CD1-CG 4.34Å; F227-L231 HydrophobicContact CD2-CG 4.47Å; F227-L231 HydrophobicContact CE1-CD1 3.56Å; F227-L231 HydrophobicContact CE1-CD2 4.25Å; F227-L231 HydrophobicContact CE1-CG 4.21Å; F227-L231 HydrophobicContact CE2-CD1 4.48Å; F227-L231 HydrophobicContact CE2-CD2 4.2Å; F227-L231 HydrophobicContact CE2-CG 4.3Å; F227-L231 HydrophobicContact CG-CD1 4.08Å; F227-L231 HydrophobicContact CG-CG 4.47Å; F227-L231 HydrophobicContact CZ-CD1 4.01Å; F227-L231 HydrophobicContact CZ-CD2 3.87Å; F227-L231 HydrophobicContact CZ-CG 4.16Å; F227-L231 WeakPolarHBondContact O-CG 3.38Å; F227-L231 PolarHBondContact O-N 3.45Å; T228-L231 PolarHBondContact O-N 2.87Å; L231-R236 HydrophobicContact CB-CB 4.32Å; L231-R236 HydrophobicContact CB-CG 4.08Å; L231-R236 HydrophobicContact CD1-CG 4.14Å; L231-R236 PolarHBondContact O-NE 3.39Å; L231-R236 PolarHBondContact O-NH2 3.05Å; L231-H239 HydrophobicContact CD1-CB 3.99Å; L231-H239 HydrophobicContact CD2-CB 3.85Å; L231-L240 HydrophobicContact CD1-CD2 4.15Å; L231-L240 HydrophobicContact CD1-CG 3.91Å
232	Q	81.2	Confident	87.6	Confident	31 Å²	31	21.2 Å²	21.2	15%	0.145	10%	0.1	C	C	.	.			trans	-68.5	151.1	168.6	-60.5	178.2	-42.3	0	0	110.6	M103 E104 G107 D234 R236	M103-Q232 PolarHBondContact O-NE2 2.87Å; E104-Q232 PolarHBondContact O-NE2 3.26Å; G107-Q232 VanDerWaalsContact CA-NE2 3.28Å; Q232-D234 PolarHBondContact O-N 2.96Å; Q232-R236 WeakPolarHBondContact O-CB 3.28Å; Q232-R236 PolarHBondContact O-N 3.26Å
233	M	71.4	Confident	87.4	Confident	30 Å²	30	21.2 Å²	21.2	15%	0.148	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-53.6	-50.7	-177.3	-70.5	-162.1	166.9	0	0	114.7	E100 K235 R236 I687	E100-M233 HydrophobicContact CB-CE 4.41Å; E100-M233 HydrophobicContact CG-CE 3.48Å; E100-M233 VanDerWaalsContact CG-CE 3.48Å; E100-M233 WeakPolarHBondContact OE1-CE 3.27Å; M233-K235 PolarHBondContact O-N 3.35Å; M233-K235 VanDerWaalsContact O-N 3.11Å; M233-R236 WeakPolarHBondContact O-CB 3.38Å; M233-R236 PolarHBondContact O-N 3.4Å; M233-I687 HydrophobicContact CE-CB 3.87Å; M233-I687 HydrophobicContact CE-CG1 3.81Å; M233-I687 HydrophobicContact CE-CG2 3.94Å; M233-I687 HydrophobicContact SD-CG1 4.23Å
234	D	71.8	Confident	87.1	Confident	136 Å²	136	21.5 Å²	21.5	73%	0.727	10%	0.101	S	C	*	.	G	3₁₀ helix	trans	-63.5	-26.3	-166.6	-68.8	-18.7	0	0	0	114.1	Q232	Q232-D234 PolarHBondContact O-N 2.96Å
235	K	77.9	Confident	87	Confident	101 Å²	101	22.5 Å²	22.5	44%	0.439	11%	0.106	S	C	.	.	G	3₁₀ helix	trans	-117.4	6.3	-177	-56.5	-171.1	177.4	-173.3	0	113.2	M233 G237 H239	M233-K235 PolarHBondContact O-N 3.35Å; M233-K235 VanDerWaalsContact O-N 3.11Å; K235-G237 PolarHBondContact O-N 3.26Å; K235-H239 PolarHBondContact O-CD2 2.83Å; K235-H239 PolarHBondContact O-N 2.9Å; K235-H239 VanDerWaalsContact O-N 3.08Å
236	R	84.1	Confident	87.1	Confident	7 Å²	7	23.6 Å²	23.6	3%	0.026	11%	0.111	C	C	.	.	H	α-helix	trans	-61.2	-50.2	-171.9	-174.9	175.3	-68.2	144.5	-2.8	111.3	E100 L231 Q232 M233 H239 L240 L688	E100-R236 IonicContact OE1-CZ 3.89Å; E100-R236 IonicContact OE1-NH2 3.11Å; E100-R236 PolarHBondContact OE1-NH2 2.89Å; E100-R236 IonicContact OE2-NH2 3.67Å; L231-R236 HydrophobicContact CB-CB 4.32Å; L231-R236 HydrophobicContact CB-CG 4.08Å; L231-R236 HydrophobicContact CD1-CG 4.14Å; L231-R236 PolarHBondContact O-NE 3.39Å; L231-R236 PolarHBondContact O-NH2 3.05Å; Q232-R236 WeakPolarHBondContact O-CB 3.28Å; Q232-R236 PolarHBondContact O-N 3.26Å; M233-R236 WeakPolarHBondContact O-CB 3.38Å; M233-R236 PolarHBondContact O-N 3.4Å; R236-H239 PolarHBondContact O-N 2.83Å; R236-L240 HydrophobicContact CG-CD1 3.66Å; R236-L240 HydrophobicContact CG-CG 4.43Å; R236-L240 WeakPolarHBondContact O-CB 3.47Å; R236-L240 WeakPolarHBondContact O-CD1 3.09Å; R236-L240 VanDerWaalsContact O-CG 3.23Å; R236-L240 WeakPolarHBondContact O-CG 3.36Å; R236-L240 PolarHBondContact O-N 3.32Å; R236-L688 VanDerWaalsContact NH1-CD1 3.28Å
237	G	81.6	Confident	87	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.8	-42.4	-177.9	0	0	0	0	0	113	K235 S241 R571	K235-G237 PolarHBondContact O-N 3.26Å; G237-S241 WeakPolarHBondContact O-CB 3.44Å; G237-S241 PolarHBondContact O-N 2.85Å; G237-S241 PolarHBondContact O-OG 3.37Å; G237-R571 VanDerWaalsContact CA-NH2 3.33Å
238	E	86.7	Confident	86.8	Confident	61 Å²	61	26.1 Å²	26.1	29%	0.285	12%	0.121	S	C	.	.	H	α-helix	trans	-57.2	-54.7	173.6	172.9	174.1	-173	0	0	111.2	L240 S241 W242 D567	E238-L240 PolarHBondContact O-N 3.04Å; E238-S241 WeakPolarHBondContact O-CB 3.41Å; E238-S241 PolarHBondContact O-N 3.37Å; E238-S241 VanDerWaalsContact O-N 3.09Å; E238-W242 VanDerWaalsContact CG-CD1 3.45Å; E238-W242 VanDerWaalsContact CG-NE1 3.3Å; E238-W242 PolarHBondContact O-N 3.27Å; E238-W242 PolarHBondContact OE1-NE1 3.22Å; E238-W242 VanDerWaalsContact OE1-NE1 3.11Å; E238-D567 WeakPolarHBondContact CB-OD2 3.46Å; E238-D567 PolarHBondContact N-OD1 3.41Å; E238-D567 PolarHBondContact N-OD2 2.89Å
239	H	89.8	Confident	86.9	Confident	10 Å²	10	29.2 Å²	29.2	5%	0.046	14%	0.137	C	C	.	.	H	α-helix	trans	-64.6	-37.6	-176.4	-76.4	-68.7	0	0	0	113.4	H108 W113 F227 L231 K235 R236 S241 W242 L243	H108-H239 AromaticContact CE1-CD2 3.74Å; H108-H239 AromaticContact CE1-CE1 3.44Å; H108-H239 PolarHBondContact CE1-CE1 2.94Å; H108-H239 VanDerWaalsContact CE1-CE1 3.44Å; H108-H239 AromaticContact CE1-NE2 3.18Å; H108-H239 PolarHBondContact CE1-NE2 3.37Å; H108-H239 AromaticContact ND1-NE2 3.86Å; H108-H239 AromaticContact NE2-CE1 3.43Å; H108-H239 PolarHBondContact NE2-CE1 3.38Å; H108-H239 AromaticContact NE2-NE2 3.42Å; H108-H239 PolarHBondContact NE2-NE2 3.4Å; W113-H239 AromaticContact CZ2-CE1 3.94Å; F227-H239 HydrophobicContact CE1-CB 3.87Å; F227-H239 HydrophobicContact CZ-CB 4.13Å; L231-H239 HydrophobicContact CD1-CB 3.99Å; L231-H239 HydrophobicContact CD2-CB 3.85Å; K235-H239 PolarHBondContact O-CD2 2.83Å; K235-H239 PolarHBondContact O-N 2.9Å; K235-H239 VanDerWaalsContact O-N 3.08Å; R236-H239 PolarHBondContact O-N 2.83Å; H239-S241 VanDerWaalsContact C-N 3.29Å; H239-S241 PolarHBondContact O-N 3.28Å; H239-W242 PolarHBondContact O-N 3.07Å; H239-L243 PolarHBondContact O-N 3.15Å; H239-L243 VanDerWaalsContact O-N 3.07Å
240	L	90.6	Very high	87	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-66.3	-32.9	174.3	-70.8	167.7	0	0	0	112.1	Y224 F227 T228 L231 R236 E238 L243 C244 V618 V621	Y224-L240 HydrophobicContact CD1-CD2 3.81Å; Y224-L240 HydrophobicContact CE1-CB 4.47Å; Y224-L240 HydrophobicContact CE1-CD2 4.37Å; F227-L240 HydrophobicContact CB-CD2 4.32Å; F227-L240 HydrophobicContact CD1-CD2 3.66Å; F227-L240 HydrophobicContact CD1-CG 4.43Å; F227-L240 HydrophobicContact CG-CD2 4.44Å; T228-L240 HydrophobicContact CG2-CD1 3.58Å; T228-L240 HydrophobicContact CG2-CD2 3.69Å; T228-L240 HydrophobicContact CG2-CG 4.23Å; L231-L240 HydrophobicContact CD1-CD2 4.15Å; L231-L240 HydrophobicContact CD1-CG 3.91Å; R236-L240 HydrophobicContact CG-CD1 3.66Å; R236-L240 HydrophobicContact CG-CG 4.43Å; R236-L240 WeakPolarHBondContact O-CB 3.47Å; R236-L240 WeakPolarHBondContact O-CD1 3.09Å; R236-L240 VanDerWaalsContact O-CG 3.23Å; R236-L240 WeakPolarHBondContact O-CG 3.36Å; R236-L240 PolarHBondContact O-N 3.32Å; E238-L240 PolarHBondContact O-N 3.04Å; L240-L243 WeakPolarHBondContact O-CB 3.44Å; L240-L243 PolarHBondContact O-N 3.42Å; L240-C244 PolarHBondContact O-N 3.27Å; L240-V618 HydrophobicContact CB-CG2 3.61Å; L240-V618 HydrophobicContact CD1-CG1 4.3Å; L240-V618 HydrophobicContact CD1-CG2 4.19Å; L240-V621 HydrophobicContact CD1-CG2 3.94Å
241	S	89.5	Confident	87	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-69.8	-41.2	173.9	-53.8	0	0	0	0	111.9	G237 E238 H239 L243 C244 A563 M566	G237-S241 WeakPolarHBondContact O-CB 3.44Å; G237-S241 PolarHBondContact O-N 2.85Å; G237-S241 PolarHBondContact O-OG 3.37Å; E238-S241 WeakPolarHBondContact O-CB 3.41Å; E238-S241 PolarHBondContact O-N 3.37Å; E238-S241 VanDerWaalsContact O-N 3.09Å; H239-S241 VanDerWaalsContact C-N 3.29Å; H239-S241 PolarHBondContact O-N 3.28Å; S241-L243 PolarHBondContact O-N 3.33Å; S241-C244 PolarHBondContact O-N 2.9Å; S241-A563 VanDerWaalsContact CB-CA 3.47Å; S241-M566 WeakPolarHBondContact OG-CE 3.21Å
242	W	91.6	Very high	87.2	Confident	61 Å²	61	30.9 Å²	30.9	23%	0.231	15%	0.146	C	C	.	.	H	α-helix	trans	-59.1	-31.4	172.9	-74.9	107.1	0	0	0	111.5	F116 E238 H239 M245 I560 A563 L564	F116-W242 HydrophobicContact CE2-CB 3.72Å; F116-W242 HydrophobicContact CZ-CB 3.7Å; E238-W242 VanDerWaalsContact CG-CD1 3.45Å; E238-W242 VanDerWaalsContact CG-NE1 3.3Å; E238-W242 PolarHBondContact O-N 3.27Å; E238-W242 PolarHBondContact OE1-NE1 3.22Å; E238-W242 VanDerWaalsContact OE1-NE1 3.11Å; H239-W242 PolarHBondContact O-N 3.07Å; W242-M245 HydrophobicContact CB-CE 4.35Å; W242-M245 HydrophobicContact CD2-CE 3.86Å; W242-M245 HydrophobicContact CE3-CE 2.9Å; W242-M245 HydrophobicContact CE3-SD 4.33Å; W242-M245 HydrophobicContact CG-CE 4.49Å; W242-M245 HydrophobicContact CH2-CE 4.47Å; W242-M245 HydrophobicContact CZ3-CE 3.26Å; W242-M245 HydrophobicContact CZ3-SD 4.25Å; W242-M245 WeakPolarHBondContact O-CB 3.39Å; W242-M245 PolarHBondContact O-N 3.28Å; W242-I560 HydrophobicContact CH2-CG1 4.38Å; W242-I560 HydrophobicContact CH2-CG2 4.16Å; W242-I560 HydrophobicContact CZ3-CG1 4.38Å; W242-A563 HydrophobicContact CD2-CB 4.14Å; W242-A563 HydrophobicContact CG-CB 4.19Å; W242-A563 HydrophobicContact CZ2-CB 4.18Å; W242-L564 HydrophobicContact CZ2-CD2 4.08Å; W242-L564 HydrophobicContact CZ2-CG 4.36Å
243	L	92.3	Very high	87.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-69.5	-37.9	-178.6	-175.8	66.5	0	0	0	111.7	F116 L119 L123 V223 Y224 F227 H239 L240 S241 M245 F246	F116-L243 HydrophobicContact CD2-CB 4.31Å; F116-L243 HydrophobicContact CD2-CD1 4.08Å; F116-L243 HydrophobicContact CE2-CB 3.93Å; F116-L243 HydrophobicContact CE2-CD1 4.22Å; L119-L243 HydrophobicContact CB-CD1 4.25Å; L123-L243 HydrophobicContact CD1-CD1 3.91Å; L123-L243 HydrophobicContact CD1-CD2 3.92Å; L123-L243 HydrophobicContact CD1-CG 3.46Å; L123-L243 VanDerWaalsContact CD1-CG 3.46Å; V223-L243 HydrophobicContact CG1-CD2 3.85Å; Y224-L243 HydrophobicContact CE1-CD2 4.41Å; F227-L243 HydrophobicContact CB-CD2 4.2Å; F227-L243 HydrophobicContact CD1-CD2 3.67Å; F227-L243 HydrophobicContact CE1-CB 4.49Å; F227-L243 HydrophobicContact CE1-CD2 4.37Å; F227-L243 HydrophobicContact CG-CD2 4.19Å; H239-L243 PolarHBondContact O-N 3.15Å; H239-L243 VanDerWaalsContact O-N 3.07Å; L240-L243 WeakPolarHBondContact O-CB 3.44Å; L240-L243 PolarHBondContact O-N 3.42Å; S241-L243 PolarHBondContact O-N 3.33Å; L243-M245 PolarHBondContact O-N 3.48Å; L243-M245 VanDerWaalsContact O-N 3.16Å; L243-F246 PolarHBondContact O-N 2.83Å; L243-F246 VanDerWaalsContact O-N 3.13Å
244	C	89.3	Confident	88.6	Confident	5 Å²	5	30.8 Å²	30.8	3%	0.034	14%	0.143	C	C	.	.	H	α-helix	trans	-59.8	-27.5	178.5	-167	0	0	0	0	113.3	Y224 L240 S241 F246 W247 N614 E617	Y224-C244 VanDerWaalsContact OH-CA 3.28Å; Y224-C244 WeakPolarHBondContact OH-CA 3.23Å; Y224-C244 WeakPolarHBondContact OH-CB 2.98Å; L240-C244 PolarHBondContact O-N 3.27Å; S241-C244 PolarHBondContact O-N 2.9Å; C244-F246 PolarHBondContact O-N 3.27Å; C244-F246 VanDerWaalsContact O-N 3.15Å; C244-W247 WeakPolarHBondContact O-CB 3.37Å; C244-W247 PolarHBondContact O-N 3.44Å; C244-W247 VanDerWaalsContact O-N 3.12Å; C244-N614 VanDerWaalsContact CB-OD1 3.27Å; C244-N614 WeakPolarHBondContact CB-OD1 3.13Å; C244-N614 PolarHBondContact SG-OD1 3.45Å; C244-E617 PolarHBondContact SG-OE2 2.75Å
245	M	91.4	Very high	89.3	Confident	23 Å²	23	24.4 Å²	24.4	11%	0.113	11%	0.109	C	C	.	.	H	α-helix	trans	-59.3	-29.5	177.3	-71.9	-163.9	-66.7	0	0	114	W242 L243 W247 M248 L249 N559 I560	W242-M245 HydrophobicContact CB-CE 4.35Å; W242-M245 HydrophobicContact CD2-CE 3.86Å; W242-M245 HydrophobicContact CE3-CE 2.9Å; W242-M245 HydrophobicContact CE3-SD 4.33Å; W242-M245 HydrophobicContact CG-CE 4.49Å; W242-M245 HydrophobicContact CH2-CE 4.47Å; W242-M245 HydrophobicContact CZ3-CE 3.26Å; W242-M245 HydrophobicContact CZ3-SD 4.25Å; W242-M245 WeakPolarHBondContact O-CB 3.39Å; W242-M245 PolarHBondContact O-N 3.28Å; L243-M245 PolarHBondContact O-N 3.48Å; L243-M245 VanDerWaalsContact O-N 3.16Å; M245-W247 PolarHBondContact O-N 2.79Å; M245-M248 PolarHBondContact O-N 3.32Å; M245-M248 VanDerWaalsContact O-N 3.1Å; M245-L249 WeakPolarHBondContact O-CG 3.37Å; M245-L249 PolarHBondContact O-N 2.92Å; M245-N559 HydrophobicContact CG-CB 3.39Å; M245-N559 HydrophobicContact SD-CB 3.92Å; M245-I560 HydrophobicContact SD-CG1 3.83Å
246	F	93.9	Very high	89.7	Confident	24 Å²	24	25.5 Å²	25.5	11%	0.105	11%	0.114	C	C	.	.	H	α-helix	trans	-62.9	-31.3	179.6	-80	-92	0	0	0	112.6	F116 F117 G120 L123 M124 L243 C244 M248 L249 G250	F116-F246 HydrophobicContact CD1-CE2 4.29Å; F116-F246 AromaticContact CE1-CE2 3.52Å; F116-F246 HydrophobicContact CE1-CE2 3.52Å; F116-F246 HydrophobicContact CE1-CZ 4.01Å; F116-F246 HydrophobicContact CE2-CE2 4.31Å; F116-F246 HydrophobicContact CZ-CD2 4.32Å; F116-F246 AromaticContact CZ-CE2 3.54Å; F116-F246 HydrophobicContact CZ-CE2 3.54Å; F116-F246 HydrophobicContact CZ-CZ 4.46Å; F117-F246 HydrophobicContact CD1-CE1 4.42Å; F117-F246 AromaticContact CD1-CZ 3.83Å; F117-F246 HydrophobicContact CD1-CZ 3.83Å; F117-F246 HydrophobicContact CE1-CZ 4.15Å; G120-F246 VanDerWaalsContact C-CD1 3.41Å; G120-F246 WeakPolarHBondContact O-CB 3.43Å; G120-F246 WeakPolarHBondContact O-CD1 3.24Å; G120-F246 WeakPolarHBondContact O-CG 3.46Å; L123-F246 HydrophobicContact CB-CB 4.23Å; M124-F246 VanDerWaalsContact CA-O 3.31Å; M124-F246 WeakPolarHBondContact CA-O 3.31Å; M124-F246 HydrophobicContact CB-CB 4.44Å; L243-F246 PolarHBondContact O-N 2.83Å; L243-F246 VanDerWaalsContact O-N 3.13Å; C244-F246 PolarHBondContact O-N 3.27Å; C244-F246 VanDerWaalsContact O-N 3.15Å; F246-M248 VanDerWaalsContact C-N 3.32Å; F246-M248 PolarHBondContact O-N 3.02Å; F246-L249 HydrophobicContact CD1-CD1 4.31Å; F246-L249 PolarHBondContact O-N 2.66Å; F246-G250 PolarHBondContact O-N 3.19Å
247	W	92.4	Very high	89.8	Confident	44 Å²	44	26 Å²	26	17%	0.167	12%	0.118	C	C	.	.	H	α-helix	trans	-61.7	-43.1	174.3	-167.7	89.8	0	0	0	111.4	D126 F131 C244 M245 G250 G251	D126-W247 PolarHBondContact OD2-NE1 3.33Å; F131-W247 HydrophobicContact CE2-CE3 4.05Å; F131-W247 AromaticContact CE2-CH2 3.56Å; F131-W247 HydrophobicContact CE2-CH2 3.56Å; F131-W247 HydrophobicContact CE2-CZ2 4.2Å; F131-W247 AromaticContact CE2-CZ3 3.46Å; F131-W247 HydrophobicContact CE2-CZ3 3.46Å; F131-W247 VanDerWaalsContact CE2-CZ3 3.46Å; F131-W247 AromaticContact CZ-CH2 3.71Å; F131-W247 HydrophobicContact CZ-CH2 3.71Å; F131-W247 AromaticContact CZ-CZ3 3.62Å; F131-W247 HydrophobicContact CZ-CZ3 3.62Å; C244-W247 WeakPolarHBondContact O-CB 3.37Å; C244-W247 PolarHBondContact O-N 3.44Å; C244-W247 VanDerWaalsContact O-N 3.12Å; M245-W247 PolarHBondContact O-N 2.79Å; W247-G250 WeakPolarHBondContact O-CA 3.37Å; W247-G250 PolarHBondContact O-N 3.46Å; W247-G250 VanDerWaalsContact O-N 3.16Å; W247-G251 PolarHBondContact O-N 3.16Å
248	M	90.2	Very high	89.9	Confident	9 Å²	9	26 Å²	26	4%	0.044	12%	0.118	C	C	.	.	H	α-helix	trans	-71.9	-34.7	177.3	-60.2	-64.3	159.1	0	0	112.5	M245 F246 G250 G251 L252 V555 L556 V610	M245-M248 PolarHBondContact O-N 3.32Å; M245-M248 VanDerWaalsContact O-N 3.1Å; F246-M248 VanDerWaalsContact C-N 3.32Å; F246-M248 PolarHBondContact O-N 3.02Å; M248-G250 PolarHBondContact O-N 3.43Å; M248-G251 PolarHBondContact O-N 3.48Å; M248-L252 PolarHBondContact O-N 3.42Å; M248-V555 HydrophobicContact CE-CG1 3.86Å; M248-V555 HydrophobicContact CG-CB 4.16Å; M248-V555 HydrophobicContact CG-CG1 3.55Å; M248-V555 HydrophobicContact SD-CB 3.94Å; M248-V555 HydrophobicContact SD-CG1 3.58Å; M248-V555 VanDerWaalsContact SD-CG1 3.58Å; M248-V555 HydrophobicContact SD-CG2 4.11Å; M248-L556 HydrophobicContact CB-CD2 4.02Å; M248-V610 HydrophobicContact CE-CG2 4.39Å
249	L	92.4	Very high	89.6	Confident	66 Å²	66	29.9 Å²	29.9	35%	0.346	13%	0.13	S	C	.	.	H	α-helix	trans	-61.7	-33	169.7	-68.3	175.4	0	0	0	111.4	M245 F246 L252 Y253 L556	M245-L249 WeakPolarHBondContact O-CG 3.37Å; M245-L249 PolarHBondContact O-N 2.92Å; F246-L249 HydrophobicContact CD1-CD1 4.31Å; F246-L249 PolarHBondContact O-N 2.66Å; L249-L252 PolarHBondContact O-N 2.89Å; L249-Y253 VanDerWaalsContact O-CB 3.31Å; L249-Y253 WeakPolarHBondContact O-CB 3.42Å; L249-Y253 PolarHBondContact O-N 3.31Å; L249-L556 HydrophobicContact CD2-CD2 4.36Å
250	G	92.6	Very high	89	Confident	0 Å²	0	31 Å²	31	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.3	-48	170.6	0	0	0	0	0	112.3	M124 V128 F246 W247 M248 L252 Y253 A254	M124-G250 WeakPolarHBondContact O-CA 3.46Å; V128-G250 VanDerWaalsContact CG2-O 3.31Å; V128-G250 WeakPolarHBondContact CG2-O 3.22Å; F246-G250 PolarHBondContact O-N 3.19Å; W247-G250 WeakPolarHBondContact O-CA 3.37Å; W247-G250 PolarHBondContact O-N 3.46Å; W247-G250 VanDerWaalsContact O-N 3.16Å; M248-G250 PolarHBondContact O-N 3.43Å; G250-L252 VanDerWaalsContact C-N 3.34Å; G250-L252 PolarHBondContact O-N 3.39Å; G250-Y253 WeakPolarHBondContact O-CB 3.37Å; G250-Y253 PolarHBondContact O-N 2.99Å; G250-A254 WeakPolarHBondContact O-CB 2.98Å; G250-A254 PolarHBondContact O-N 3.41Å
251	G	89.7	Confident	88.5	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.2	-39.1	174.2	0	0	0	0	0	113.8	W247 M248 A254 S255	W247-G251 PolarHBondContact O-N 3.16Å; M248-G251 PolarHBondContact O-N 3.48Å; G251-A254 PolarHBondContact O-N 2.91Å; G251-S255 WeakPolarHBondContact O-CB 3.34Å; G251-S255 PolarHBondContact O-N 3.28Å; G251-S255 PolarHBondContact O-OG 3.36Å
252	L	90.9	Very high	87.6	Confident	40 Å²	40	32.3 Å²	32.3	21%	0.209	15%	0.151	C	C	.	.	H	α-helix	trans	-64.2	-44.6	174.8	-167.5	72.1	0	0	0	111.5	M248 L249 G250 S255 F256 F549	M248-L252 PolarHBondContact O-N 3.42Å; L249-L252 PolarHBondContact O-N 2.89Å; G250-L252 VanDerWaalsContact C-N 3.34Å; G250-L252 PolarHBondContact O-N 3.39Å; L252-S255 PolarHBondContact O-N 3.04Å; L252-F256 WeakPolarHBondContact O-CB 3.44Å; L252-F256 PolarHBondContact O-N 3.33Å; L252-F549 HydrophobicContact CD1-CD2 3.52Å; L252-F549 HydrophobicContact CD1-CE2 3.22Å; L252-F549 HydrophobicContact CD1-CG 4.36Å; L252-F549 HydrophobicContact CD1-CZ 3.85Å; L252-F549 HydrophobicContact CG-CE2 4.14Å
253	Y	92.1	Very high	86.4	Confident	59 Å²	59	31.9 Å²	31.9	23%	0.231	16%	0.156	C	C	.	.	H	α-helix	trans	-61.7	-46.6	175.8	176.1	-94.6	0	0	0	111.8	M124 V128 L249 G250 S255 F256 T257 V287 P291	M124-Y253 VanDerWaalsContact CE-CB 3.49Å; M124-Y253 HydrophobicContact CE-CD1 4.08Å; M124-Y253 HydrophobicContact CE-CD2 3.8Å; M124-Y253 HydrophobicContact CE-CG 3.51Å; V128-Y253 HydrophobicContact CG2-CD1 3.65Å; V128-Y253 HydrophobicContact CG2-CE1 4.41Å; L249-Y253 VanDerWaalsContact O-CB 3.31Å; L249-Y253 WeakPolarHBondContact O-CB 3.42Å; L249-Y253 PolarHBondContact O-N 3.31Å; G250-Y253 WeakPolarHBondContact O-CB 3.37Å; G250-Y253 PolarHBondContact O-N 2.99Å; Y253-S255 PolarHBondContact O-N 3.42Å; Y253-F256 PolarHBondContact O-N 3Å; Y253-T257 HydrophobicContact CD1-CG2 4.41Å; Y253-T257 HydrophobicContact CD2-CG2 4.28Å; Y253-T257 HydrophobicContact CE1-CG2 4.08Å; Y253-T257 HydrophobicContact CE2-CG2 3.93Å; Y253-T257 WeakPolarHBondContact O-CB 3.19Å; Y253-T257 WeakPolarHBondContact O-CG2 3.5Å; Y253-T257 PolarHBondContact O-N 3.42Å; Y253-T257 PolarHBondContact O-OG1 3.3Å; Y253-V287 WeakPolarHBondContact OH-CG1 3.49Å; Y253-V287 PolarHBondContact OH-O 3.42Å; Y253-P291 HydrophobicContact CD1-CG 4.21Å; Y253-P291 HydrophobicContact CE1-CG 3.88Å
254	A	90.1	Very high	85.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-43.7	176.6	0	0	0	0	0	111.6	V128 F131 F135 G250 G251 T257 A258 F284	V128-A254 HydrophobicContact CG1-CB 4.39Å; V128-A254 HydrophobicContact CG2-CB 4.48Å; F131-A254 HydrophobicContact CB-CB 4.12Å; F135-A254 HydrophobicContact CD2-CB 4.31Å; F135-A254 HydrophobicContact CE2-CB 4.04Å; G250-A254 WeakPolarHBondContact O-CB 2.98Å; G250-A254 PolarHBondContact O-N 3.41Å; G251-A254 PolarHBondContact O-N 2.91Å; A254-T257 WeakPolarHBondContact CA-OG1 3.37Å; A254-T257 PolarHBondContact O-OG1 2.87Å; A254-A258 WeakPolarHBondContact O-CB 3.38Å; A254-A258 PolarHBondContact O-N 3.49Å; A254-F284 WeakPolarHBondContact O-CE2 3.4Å
255	S	86.5	Confident	83.5	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-64.6	-43.9	178.1	-55.9	0	0	0	0	112	F135 G251 L252 Y253 A258 W259	F135-S255 VanDerWaalsContact CZ-OG 3.28Å; F135-S255 WeakPolarHBondContact CZ-OG 3.21Å; G251-S255 WeakPolarHBondContact O-CB 3.34Å; G251-S255 PolarHBondContact O-N 3.28Å; G251-S255 PolarHBondContact O-OG 3.36Å; L252-S255 PolarHBondContact O-N 3.04Å; Y253-S255 PolarHBondContact O-N 3.42Å; S255-A258 PolarHBondContact O-N 2.93Å; S255-W259 WeakPolarHBondContact O-CB 3.39Å; S255-W259 PolarHBondContact O-N 3.37Å
256	F	85.8	Confident	81.3	Confident	124 Å²	124	44.7 Å²	44.7	54%	0.544	23%	0.231	S	C	.	.	H	α-helix	trans	-66.2	-44.2	179.4	-178.4	-100.2	0	0	0	112.1	L252 Y253 W259 G260	L252-F256 WeakPolarHBondContact O-CB 3.44Å; L252-F256 PolarHBondContact O-N 3.33Å; Y253-F256 PolarHBondContact O-N 3Å; F256-W259 HydrophobicContact CD2-CE3 4.46Å; F256-W259 HydrophobicContact CE2-CE3 4.41Å; F256-W259 HydrophobicContact CE2-CZ3 4.29Å; F256-W259 PolarHBondContact O-N 3.39Å; F256-G260 PolarHBondContact O-N 3.26Å
257	T	86.8	Confident	79.2	Confident	16 Å²	16	46 Å²	46	10%	0.098	25%	0.251	C	S	.	.	H	α-helix	trans	-70	-35.5	177.4	50.7	0	0	0	0	112.1	Y253 A254 G260 I261 F284 V287	Y253-T257 HydrophobicContact CD1-CG2 4.41Å; Y253-T257 HydrophobicContact CD2-CG2 4.28Å; Y253-T257 HydrophobicContact CE1-CG2 4.08Å; Y253-T257 HydrophobicContact CE2-CG2 3.93Å; Y253-T257 WeakPolarHBondContact O-CB 3.19Å; Y253-T257 WeakPolarHBondContact O-CG2 3.5Å; Y253-T257 PolarHBondContact O-N 3.42Å; Y253-T257 PolarHBondContact O-OG1 3.3Å; A254-T257 WeakPolarHBondContact CA-OG1 3.37Å; A254-T257 PolarHBondContact O-OG1 2.87Å; T257-G260 PolarHBondContact O-N 3Å; T257-I261 WeakPolarHBondContact O-CB 3.47Å; T257-I261 VanDerWaalsContact O-CG1 3.29Å; T257-I261 WeakPolarHBondContact O-CG1 3.16Å; T257-I261 PolarHBondContact O-N 3.25Å; T257-I261 VanDerWaalsContact O-N 3.08Å; T257-F284 WeakPolarHBondContact OG1-CE2 3.2Å; T257-V287 HydrophobicContact CG2-CG1 3.99Å
258	A	82.8	Confident	77.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.6	-49	172.6	0	0	0	0	0	111.1	F135 A254 S255 G260 I261 I262 P263 F284 Y545	F135-A258 HydrophobicContact CB-CB 4.08Å; F135-A258 HydrophobicContact CD2-CB 4.1Å; F135-A258 HydrophobicContact CG-CB 4Å; A254-A258 WeakPolarHBondContact O-CB 3.38Å; A254-A258 PolarHBondContact O-N 3.49Å; S255-A258 PolarHBondContact O-N 2.93Å; A258-G260 VanDerWaalsContact C-N 3.33Å; A258-G260 PolarHBondContact O-N 2.9Å; A258-I261 PolarHBondContact O-N 2.88Å; A258-I262 HydrophobicContact CB-CD1 3.86Å; A258-I262 WeakPolarHBondContact O-CB 3.38Å; A258-I262 WeakPolarHBondContact O-CG1 3.25Å; A258-I262 PolarHBondContact O-N 3.04Å; A258-P263 WeakPolarHBondContact O-CD 3.37Å; A258-F284 HydrophobicContact CB-CD2 4.14Å; A258-F284 HydrophobicContact CB-CE2 3.63Å; A258-F284 HydrophobicContact CB-CZ 3.93Å; A258-F284 VanDerWaalsContact N-CE2 3.33Å; A258-Y545 HydrophobicContact CB-CD1 4.02Å; A258-Y545 HydrophobicContact CB-CE1 4.03Å
259	W	80.6	Confident	75.8	Confident	144 Å²	144	51.9 Å²	51.9	55%	0.545	29%	0.286	S	S	.	.	H	α-helix	trans	-61.7	-37.7	176.7	175.2	72	0	0	0	112.9	S255 F256 P263	S255-W259 WeakPolarHBondContact O-CB 3.39Å; S255-W259 PolarHBondContact O-N 3.37Å; F256-W259 HydrophobicContact CD2-CE3 4.46Å; F256-W259 HydrophobicContact CE2-CE3 4.41Å; F256-W259 HydrophobicContact CE2-CZ3 4.29Å; F256-W259 PolarHBondContact O-N 3.39Å; W259-P263 WeakPolarHBondContact O-CD 3.34Å; W259-P263 VanDerWaalsContact O-CG 3.26Å; W259-P263 WeakPolarHBondContact O-CG 3.14Å
260	G	77.8	Confident	74.2	Confident	32 Å²	32	55.1 Å²	55.1	33%	0.33	30%	0.297	S	S	.	.	H	α-helix	trans	-76.1	-21.6	179.7	0	0	0	0	0	115.1	F256 T257 A258 H264	F256-G260 PolarHBondContact O-N 3.26Å; T257-G260 PolarHBondContact O-N 3Å; A258-G260 VanDerWaalsContact C-N 3.33Å; A258-G260 PolarHBondContact O-N 2.9Å; G260-H264 PolarHBondContact O-CD2 3.4Å
261	I	79.4	Confident	72.3	Confident	23 Å²	23	58.1 Å²	58.1	12%	0.118	32%	0.322	C	S	.	.	H	α-helix	trans	-112.3	-47.3	-172	-61.9	170.3	0	0	0	112.1	T257 A258 H264 S280 L283 F284 V287	T257-I261 WeakPolarHBondContact O-CB 3.47Å; T257-I261 VanDerWaalsContact O-CG1 3.29Å; T257-I261 WeakPolarHBondContact O-CG1 3.16Å; T257-I261 PolarHBondContact O-N 3.25Å; T257-I261 VanDerWaalsContact O-N 3.08Å; A258-I261 PolarHBondContact O-N 2.88Å; I261-H264 PolarHBondContact O-N 3.09Å; I261-S280 WeakPolarHBondContact CG2-O 3.38Å; I261-L283 HydrophobicContact CG2-CB 4.36Å; I261-L283 HydrophobicContact CG2-CD2 4.2Å; I261-L283 HydrophobicContact CG2-CG 4.33Å; I261-F284 HydrophobicContact CB-CB 4.45Å; I261-F284 HydrophobicContact CD1-CB 4.47Å; I261-F284 HydrophobicContact CG2-CB 4.19Å; I261-V287 HydrophobicContact CD1-CB 4.21Å; I261-V287 HydrophobicContact CD1-CG1 4.48Å; I261-V287 HydrophobicContact CD1-CG2 3.88Å
262	I	71.8	Confident	70.5	Confident	6 Å²	6	63.8 Å²	63.8	3%	0.031	35%	0.351	C	S	.	.	S	Bend	trans	-66	-47	-170.2	-59.8	174.4	0	0	0	112.4	F135 S139 A258 H264 Y265 F284 Y545	F135-I262 HydrophobicContact CB-CD1 4.41Å; S139-I262 WeakPolarHBondContact OG-CG2 3.49Å; A258-I262 HydrophobicContact CB-CD1 3.86Å; A258-I262 WeakPolarHBondContact O-CB 3.38Å; A258-I262 WeakPolarHBondContact O-CG1 3.25Å; A258-I262 PolarHBondContact O-N 3.04Å; I262-H264 PolarHBondContact O-N 3.31Å; I262-Y265 VanDerWaalsContact O-CD2 3.25Å; I262-Y265 WeakPolarHBondContact O-CD2 3.36Å; I262-F284 HydrophobicContact CD1-CD1 4.41Å; I262-F284 HydrophobicContact CD1-CG 4.46Å; I262-F284 HydrophobicContact CG1-CB 4.42Å; I262-Y545 HydrophobicContact CD1-CE1 4.08Å; I262-Y545 WeakPolarHBondContact CD1-OH 3.39Å; I262-Y545 WeakPolarHBondContact CG2-OH 3.38Å
263	P	65.8	Low	68.7	Low	53 Å²	53	64.9 Å²	64.9	34%	0.344	37%	0.372	S	S	.	.	S	Bend	trans	-64.2	-23.2	-177.3	-23.7	35.8	0	0	0	114.4	A258 W259 Y265	A258-P263 WeakPolarHBondContact O-CD 3.37Å; W259-P263 WeakPolarHBondContact O-CD 3.34Å; W259-P263 VanDerWaalsContact O-CG 3.26Å; W259-P263 WeakPolarHBondContact O-CG 3.14Å; P263-Y265 PolarHBondContact O-N 3.23Å
264	H	65.8	Low	66.7	Low	111 Å²	111	68.8 Å²	68.8	51%	0.514	40%	0.402	S	S	.	.			trans	-87.1	50.3	-179.1	-63.7	-68.4	0	0	0	112.4	G260 I261 I262 A266 G267	G260-H264 PolarHBondContact O-CD2 3.4Å; I261-H264 PolarHBondContact O-N 3.09Å; I262-H264 PolarHBondContact O-N 3.31Å; H264-A266 PolarHBondContact O-N 2.87Å; H264-A266 VanDerWaalsContact O-N 3.08Å; H264-G267 PolarHBondContact O-N 2.88Å; H264-G267 VanDerWaalsContact O-N 3.15Å
265	Y	54.7	Low	65	Low	75 Å²	75	76.4 Å²	76.4	29%	0.294	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-26.1	-175.9	-120.9	-93.1	0	0	0	114.3	I262 P263	I262-Y265 VanDerWaalsContact O-CD2 3.25Å; I262-Y265 WeakPolarHBondContact O-CD2 3.36Å; P263-Y265 PolarHBondContact O-N 3.23Å
266	A	46.6	Very low	63.7	Low	111 Å²	111	81.4 Å²	81.4	92%	0.917	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-14.9	-177.7	0	0	0	0	0	114.9	H264	H264-A266 PolarHBondContact O-N 2.87Å; H264-A266 VanDerWaalsContact O-N 3.08Å
267	G	49.6	Very low	62.6	Low	51 Å²	51	80.6 Å²	80.6	53%	0.526	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-25.3	-170.9	0	0	0	0	0	115.8	H264	H264-G267 PolarHBondContact O-N 2.88Å; H264-G267 VanDerWaalsContact O-N 3.15Å
268	W	54	Low	61.7	Low	135 Å²	135	82.3 Å²	82.3	51%	0.511	47%	0.465	S	S	.	.	S	Bend	trans	-118	-1.4	-168.9	-64.9	95.6	0	0	0	114.8	F270 L283	W268-F270 WeakPolarHBondContact O-CD2 3.34Å; W268-F270 PolarHBondContact O-N 3.44Å; W268-L283 HydrophobicContact CB-CD2 3.99Å; W268-L283 HydrophobicContact CD2-CD2 4.31Å; W268-L283 HydrophobicContact CE3-CD2 3.89Å; W268-L283 HydrophobicContact CG-CD2 4.39Å
269	G	55.6	Low	61.2	Low	41 Å²	41	84.2 Å²	84.2	42%	0.423	47%	0.474	S	S	.	.			trans	-82	114	174.3	0	0	0	0	0	110.8	I278	G269-I278 VanDerWaalsContact CA-O 3.25Å; G269-I278 WeakPolarHBondContact CA-O 3.49Å
270	F	58.8	Low	61	Low	134 Å²	134	77.4 Å²	77.4	59%	0.588	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	131	175.1	-60.1	-82.2	0	0	0	109.5	W268 I278	W268-F270 WeakPolarHBondContact O-CD2 3.34Å; W268-F270 PolarHBondContact O-N 3.44Å; F270-I278 PolarHBondContact N-O 3.24Å; F270-I278 WeakPolarHBondContact O-CB 3.45Å; F270-I278 PolarHBondContact O-N 2.99Å; F270-I278 VanDerWaalsContact O-N 3.12Å
271	A	53.5	Low	61.1	Low	63 Å²	63	75.9 Å²	75.9	52%	0.521	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	124.1	173.3	0	0	0	0	0	109.4	F276 Q277	A271-F276 CarbonylContact C-O 3.56Å; A271-F276 WeakPolarHBondContact CA-O 3.25Å; A271-Q277 HydrophobicContact CB-CG 4.37Å
272	I	51.7	Low	61.4	Low	120 Å²	120	75.5 Å²	75.5	62%	0.615	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	93.6	172.3	-58.8	173.1	0	0	0	106.8	F276 I278	I272-F276 HydrophobicContact CB-CB 4.49Å; I272-F276 PolarHBondContact N-O 2.72Å; I272-F276 WeakPolarHBondContact O-CB 3.4Å; I272-I278 HydrophobicContact CD1-CD1 4.04Å
273	G	53.7	Low	62	Low	62 Å²	62	77.6 Å²	77.6	64%	0.639	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-162.9	-176.1	0	0	0	0	0	114
274	T	50.2	Low	63	Low	142 Å²	142	75.1 Å²	75.1	87%	0.871	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-10.3	-172.6	51.2	0	0	0	0	114.7
275	Q	53.5	Low	64.1	Low	160 Å²	160	69.9 Å²	69.9	75%	0.748	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	-16.6	-174.4	-67.2	-167.6	-17	0	0	115.2	Q200	Q200-Q275 PolarHBondContact NE2-O 3.49Å
276	F	58.7	Low	65.8	Low	107 Å²	107	70.2 Å²	70.2	47%	0.469	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	97.1	177.3	-72.7	-90.7	0	0	0	110.8	Q200 A271 I272	Q200-F276 HydrophobicContact CG-CE1 4.48Å; Q200-F276 VanDerWaalsContact NE2-CE1 3.26Å; A271-F276 CarbonylContact C-O 3.56Å; A271-F276 WeakPolarHBondContact CA-O 3.25Å; I272-F276 HydrophobicContact CB-CB 4.49Å; I272-F276 PolarHBondContact N-O 2.72Å; I272-F276 WeakPolarHBondContact O-CB 3.4Å
277	Q	63.3	Low	68	Low	106 Å²	106	66.2 Å²	66.2	50%	0.495	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	115.1	169.1	-61.3	-159.6	-5.5	0	0	109.5	A271 R282	A271-Q277 HydrophobicContact CB-CG 4.37Å; Q277-R282 PolarHBondContact O-NH1 3.11Å
278	I	68.8	Low	70	Confident	52 Å²	52	63.9 Å²	63.9	27%	0.267	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	109.4	174.2	-60	174.9	0	0	0	107.4	G269 F270 I272 R282	G269-I278 VanDerWaalsContact CA-O 3.25Å; G269-I278 WeakPolarHBondContact CA-O 3.49Å; F270-I278 PolarHBondContact N-O 3.24Å; F270-I278 WeakPolarHBondContact O-CB 3.45Å; F270-I278 PolarHBondContact O-N 2.99Å; F270-I278 VanDerWaalsContact O-N 3.12Å; I272-I278 HydrophobicContact CD1-CD1 4.04Å; I278-R282 HydrophobicContact CG2-CB 4.02Å
279	H	71.8	Confident	71.9	Confident	40 Å²	40	58 Å²	58	19%	0.185	32%	0.322	C	S	.	.			trans	-84	157.9	175.1	-66.3	-73.3	0	0	0	111.5	D143 W281 R282	D143-H279 IonicContact OD1-CD2 3.84Å; D143-H279 PolarHBondContact OD1-CD2 2.72Å; D143-H279 IonicContact OD1-NE2 3.48Å; D143-H279 PolarHBondContact OD1-NE2 2.95Å; D143-H279 VanDerWaalsContact OD1-NE2 3.12Å; D143-H279 IonicContact OD2-CD2 3.68Å; D143-H279 PolarHBondContact OD2-CD2 3.49Å; D143-H279 IonicContact OD2-CG 2.98Å; H279-W281 PolarHBondContact O-N 3.44Å; H279-R282 WeakPolarHBondContact O-CB 3.35Å; H279-R282 PolarHBondContact O-N 3.46Å
280	S	75.8	Confident	73.7	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.007	32%	0.322	C	S	.	.	H	α-helix	trans	-55	-30.2	-174.5	-53.4	0	0	0	0	114.4	I261 R282 L283 F284	I261-S280 WeakPolarHBondContact CG2-O 3.38Å; S280-R282 VanDerWaalsContact C-N 3.33Å; S280-R282 PolarHBondContact O-N 3.05Å; S280-L283 PolarHBondContact O-N 2.98Å; S280-F284 PolarHBondContact O-N 2.91Å
281	W	80.1	Confident	75.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.4	-28.3	178.3	71.5	-97.3	0	0	0	113.4	V136 D143 M144 F205 H279 M285	V136-W281 HydrophobicContact CG1-CD2 4.17Å; V136-W281 HydrophobicContact CG1-CE3 3.46Å; V136-W281 VanDerWaalsContact CG1-CE3 3.46Å; V136-W281 HydrophobicContact CG1-CZ3 3.92Å; D143-W281 PolarHBondContact OD2-NE1 3.44Å; M144-W281 HydrophobicContact CE-CH2 3.88Å; M144-W281 HydrophobicContact CE-CZ2 3.81Å; F205-W281 HydrophobicContact CD2-CH2 4.38Å; F205-W281 HydrophobicContact CD2-CZ3 4.45Å; F205-W281 HydrophobicContact CE2-CH2 4.16Å; F205-W281 AromaticContact CE2-CZ3 3.81Å; F205-W281 HydrophobicContact CE2-CZ3 3.81Å; F205-W281 HydrophobicContact CZ-CZ3 4.25Å; H279-W281 PolarHBondContact O-N 3.44Å; W281-M285 HydrophobicContact CE3-CG 4.38Å; W281-M285 WeakPolarHBondContact O-CG 3.31Å; W281-M285 PolarHBondContact O-N 2.82Å; W281-M285 VanDerWaalsContact O-N 3.11Å
282	R	85.7	Confident	77.4	Confident	16 Å²	16	51.8 Å²	51.8	6%	0.06	27%	0.272	C	S	.	.	H	α-helix	trans	-72.5	-34.3	173.9	-69.3	175.8	170.2	128.2	13.8	111.5	D143 C197 A199 Q277 I278 H279 S280 M285 F286	D143-R282 IonicContact OD2-CZ 3.01Å; D143-R282 IonicContact OD2-NH1 3.02Å; D143-R282 IonicContact OD2-NH2 2.72Å; D143-R282 PolarHBondContact OD2-NH2 3.23Å; C197-R282 WeakPolarHBondContact O-CD 3.33Å; C197-R282 WeakPolarHBondContact O-CG 3.36Å; A199-R282 PolarHBondContact O-NE 3.03Å; A199-R282 PolarHBondContact O-NH2 2.89Å; Q277-R282 PolarHBondContact O-NH1 3.11Å; I278-R282 HydrophobicContact CG2-CB 4.02Å; H279-R282 WeakPolarHBondContact O-CB 3.35Å; H279-R282 PolarHBondContact O-N 3.46Å; S280-R282 VanDerWaalsContact C-N 3.33Å; S280-R282 PolarHBondContact O-N 3.05Å; R282-M285 WeakPolarHBondContact O-CB 3.46Å; R282-M285 PolarHBondContact O-N 2.84Å; R282-F286 PolarHBondContact O-N 3.29Å; R282-F286 VanDerWaalsContact O-N 3.15Å
283	L	84.3	Confident	79.5	Confident	50 Å²	50	49.6 Å²	49.6	26%	0.262	26%	0.261	S	S	.	.	H	α-helix	trans	-68.9	-42.3	173.3	180	63.1	0	0	0	111.3	I261 W268 S280 M285 F286 V287	I261-L283 HydrophobicContact CG2-CB 4.36Å; I261-L283 HydrophobicContact CG2-CD2 4.2Å; I261-L283 HydrophobicContact CG2-CG 4.33Å; W268-L283 HydrophobicContact CB-CD2 3.99Å; W268-L283 HydrophobicContact CD2-CD2 4.31Å; W268-L283 HydrophobicContact CE3-CD2 3.89Å; W268-L283 HydrophobicContact CG-CD2 4.39Å; S280-L283 PolarHBondContact O-N 2.98Å; L283-M285 VanDerWaalsContact C-N 3.31Å; L283-M285 PolarHBondContact O-N 2.97Å; L283-F286 WeakPolarHBondContact O-CB 3.43Å; L283-F286 PolarHBondContact O-N 3.47Å; L283-F286 VanDerWaalsContact O-N 3.12Å; L283-V287 WeakPolarHBondContact O-CG2 3.07Å; L283-V287 PolarHBondContact O-N 3.35Å
284	F	87.4	Confident	81.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-54.4	-48.7	172.5	165.2	-108.5	0	0	0	111.3	V132 F135 V136 A254 T257 A258 I261 I262 S280 F286 V287 C288	V132-F284 HydrophobicContact CB-CE1 4.36Å; V132-F284 HydrophobicContact CG1-CE1 4.3Å; V132-F284 HydrophobicContact CG2-CE1 3.89Å; V132-F284 HydrophobicContact CG2-CZ 3.84Å; F135-F284 HydrophobicContact CB-CE1 4.09Å; F135-F284 HydrophobicContact CB-CZ 4.2Å; F135-F284 HydrophobicContact CD2-CZ 4.16Å; V136-F284 HydrophobicContact CG2-CD1 3.71Å; V136-F284 HydrophobicContact CG2-CE1 3.77Å; A254-F284 WeakPolarHBondContact O-CE2 3.4Å; T257-F284 WeakPolarHBondContact OG1-CE2 3.2Å; A258-F284 HydrophobicContact CB-CD2 4.14Å; A258-F284 HydrophobicContact CB-CE2 3.63Å; A258-F284 HydrophobicContact CB-CZ 3.93Å; A258-F284 VanDerWaalsContact N-CE2 3.33Å; I261-F284 HydrophobicContact CB-CB 4.45Å; I261-F284 HydrophobicContact CD1-CB 4.47Å; I261-F284 HydrophobicContact CG2-CB 4.19Å; I262-F284 HydrophobicContact CD1-CD1 4.41Å; I262-F284 HydrophobicContact CD1-CG 4.46Å; I262-F284 HydrophobicContact CG1-CB 4.42Å; S280-F284 PolarHBondContact O-N 2.91Å; F284-F286 VanDerWaalsContact C-N 3.28Å; F284-F286 PolarHBondContact O-N 3.37Å; F284-V287 PolarHBondContact O-N 3.5Å; F284-V287 VanDerWaalsContact O-N 3.13Å; F284-C288 VanDerWaalsContact CE2-SG 3.5Å; F284-C288 VanDerWaalsContact CZ-SG 3.56Å; F284-C288 PolarHBondContact O-N 2.86Å; F284-C288 PolarHBondContact O-SG 3.02Å
285	M	88.5	Confident	83.7	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-55.2	-41.1	174.7	-80.3	-59.4	-57.2	0	0	113.9	V132 V136 R209 W281 R282 L283 C288	V132-M285 HydrophobicContact CB-SD 4.45Å; V132-M285 HydrophobicContact CG1-CE 4.05Å; V132-M285 HydrophobicContact CG1-SD 3.09Å; V132-M285 WeakPolarHBondContact CG1-SD 3.43Å; V136-M285 HydrophobicContact CG2-CG 3.92Å; V136-M285 HydrophobicContact CG2-SD 3.83Å; R209-M285 VanDerWaalsContact CZ-SD 3.56Å; R209-M285 PolarHBondContact NH2-SD 3.43Å; W281-M285 HydrophobicContact CE3-CG 4.38Å; W281-M285 WeakPolarHBondContact O-CG 3.31Å; W281-M285 PolarHBondContact O-N 2.82Å; W281-M285 VanDerWaalsContact O-N 3.11Å; R282-M285 WeakPolarHBondContact O-CB 3.46Å; R282-M285 PolarHBondContact O-N 2.84Å; L283-M285 VanDerWaalsContact C-N 3.31Å; L283-M285 PolarHBondContact O-N 2.97Å; M285-C288 WeakPolarHBondContact O-CB 3.41Å; M285-C288 PolarHBondContact O-N 3.25Å
286	F	91	Very high	85.7	Confident	82 Å²	82	35.3 Å²	35.3	36%	0.36	18%	0.176	S	C	.	.	H	α-helix	trans	-66.1	-40.9	178.3	-179.5	-99.4	0	0	0	112	F194 R282 L283 F284 C288 L289 F290	F194-F286 HydrophobicContact CD2-CD2 4.08Å; F194-F286 AromaticContact CD2-CE2 3.98Å; F194-F286 HydrophobicContact CD2-CE2 3.98Å; F194-F286 HydrophobicContact CE2-CD2 4.14Å; F194-F286 AromaticContact CE2-CE2 3.78Å; F194-F286 HydrophobicContact CE2-CE2 3.78Å; R282-F286 PolarHBondContact O-N 3.29Å; R282-F286 VanDerWaalsContact O-N 3.15Å; L283-F286 WeakPolarHBondContact O-CB 3.43Å; L283-F286 PolarHBondContact O-N 3.47Å; L283-F286 VanDerWaalsContact O-N 3.12Å; F284-F286 VanDerWaalsContact C-N 3.28Å; F284-F286 PolarHBondContact O-N 3.37Å; F286-C288 VanDerWaalsContact C-N 3.28Å; F286-C288 PolarHBondContact O-N 2.98Å; F286-L289 HydrophobicContact CD2-CD1 3.83Å; F286-L289 HydrophobicContact CE2-CD1 4.36Å; F286-L289 HydrophobicContact CG-CD1 4.49Å; F286-L289 VanDerWaalsContact O-CB 3.31Å; F286-L289 WeakPolarHBondContact O-CB 3.41Å; F286-L289 PolarHBondContact O-N 2.83Å; F286-F290 HydrophobicContact CE1-CE1 4.19Å; F286-F290 HydrophobicContact CE1-CZ 4.11Å
287	V	91.7	Very high	87.5	Confident	27 Å²	27	34.6 Å²	34.6	16%	0.164	18%	0.176	C	C	.	.	H	α-helix	trans	-64.9	-34.7	176.7	174.2	0	0	0	0	111.4	Y253 T257 I261 L283 F284 L289 F290	Y253-V287 WeakPolarHBondContact OH-CG1 3.49Å; Y253-V287 PolarHBondContact OH-O 3.42Å; T257-V287 HydrophobicContact CG2-CG1 3.99Å; I261-V287 HydrophobicContact CD1-CB 4.21Å; I261-V287 HydrophobicContact CD1-CG1 4.48Å; I261-V287 HydrophobicContact CD1-CG2 3.88Å; L283-V287 WeakPolarHBondContact O-CG2 3.07Å; L283-V287 PolarHBondContact O-N 3.35Å; F284-V287 PolarHBondContact O-N 3.5Å; F284-V287 VanDerWaalsContact O-N 3.13Å; V287-L289 PolarHBondContact O-N 2.99Å; V287-L289 VanDerWaalsContact O-N 3.14Å; V287-F290 HydrophobicContact CG1-CD2 4.32Å; V287-F290 HydrophobicContact CG1-CE2 4.41Å; V287-F290 PolarHBondContact O-N 3.4Å
288	C	91.7	Very high	89	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.02	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-17.1	175.7	-69.5	0	0	0	0	114.4	V128 V132 F284 M285 F286 F290 P291	V128-C288 HydrophobicContact CG1-CB 3.48Å; V128-C288 VanDerWaalsContact CG1-CB 3.48Å; V132-C288 HydrophobicContact CG2-CB 3.89Å; V132-C288 WeakPolarHBondContact CG2-SG 3.45Å; F284-C288 VanDerWaalsContact CE2-SG 3.5Å; F284-C288 VanDerWaalsContact CZ-SG 3.56Å; F284-C288 PolarHBondContact O-N 2.86Å; F284-C288 PolarHBondContact O-SG 3.02Å; M285-C288 WeakPolarHBondContact O-CB 3.41Å; M285-C288 PolarHBondContact O-N 3.25Å; F286-C288 VanDerWaalsContact C-N 3.28Å; F286-C288 PolarHBondContact O-N 2.98Å; C288-F290 VanDerWaalsContact C-N 3.32Å; C288-F290 PolarHBondContact O-N 3.3Å; C288-P291 WeakPolarHBondContact O-CD 3.15Å
289	L	93.8	Very high	90.2	Very high	11 Å²	11	27.7 Å²	27.7	6%	0.058	15%	0.146	C	C	.	.	H	α-helix	trans	-74.1	-18.6	177.7	-61.8	165	0	0	0	113.5	L190 F194 F286 V287 A292 L293	L190-L289 HydrophobicContact CD1-CB 4.03Å; L190-L289 HydrophobicContact CD1-CD2 4.08Å; F194-L289 HydrophobicContact CB-CD1 3.99Å; F194-L289 HydrophobicContact CD2-CD1 4.01Å; F286-L289 HydrophobicContact CD2-CD1 3.83Å; F286-L289 HydrophobicContact CE2-CD1 4.36Å; F286-L289 HydrophobicContact CG-CD1 4.49Å; F286-L289 VanDerWaalsContact O-CB 3.31Å; F286-L289 WeakPolarHBondContact O-CB 3.41Å; F286-L289 PolarHBondContact O-N 2.83Å; V287-L289 PolarHBondContact O-N 2.99Å; V287-L289 VanDerWaalsContact O-N 3.14Å; L289-A292 PolarHBondContact O-N 3.26Å; L289-L293 PolarHBondContact O-N 3.3Å
290	F	94.5	Very high	91.3	Very high	100 Å²	100	29 Å²	29	44%	0.439	16%	0.156	S	C	.	.	H	α-helix	trans	-64.1	-43.2	-171.3	-66.1	-27.1	0	0	0	114.5	F286 V287 C288 A292 L293 A294	F286-F290 HydrophobicContact CE1-CE1 4.19Å; F286-F290 HydrophobicContact CE1-CZ 4.11Å; V287-F290 HydrophobicContact CG1-CD2 4.32Å; V287-F290 HydrophobicContact CG1-CE2 4.41Å; V287-F290 PolarHBondContact O-N 3.4Å; C288-F290 VanDerWaalsContact C-N 3.32Å; C288-F290 PolarHBondContact O-N 3.3Å; F290-A292 VanDerWaalsContact C-N 3.33Å; F290-A292 PolarHBondContact O-N 3.02Å; F290-L293 PolarHBondContact O-N 3.08Å; F290-A294 WeakPolarHBondContact O-CB 3.47Å; F290-A294 PolarHBondContact O-N 3.43Å
291	P	94.6	Very high	92.1	Very high	8 Å²	8	36.8 Å²	36.8	5%	0.052	19%	0.191	C	C	.	.	H	α-helix	trans	-59.6	-41.6	173.3	-25.4	36.6	0	0	0	112.7	M124 A125 V128 Y253 C288 A294 A295	M124-P291 HydrophobicContact CE-CB 4.46Å; M124-P291 HydrophobicContact CE-CG 3.94Å; M124-P291 HydrophobicContact CG-CB 4.27Å; M124-P291 HydrophobicContact SD-CB 4.24Å; M124-P291 HydrophobicContact SD-CG 4.36Å; A125-P291 HydrophobicContact CB-CB 4.29Å; V128-P291 HydrophobicContact CG2-CG 4.42Å; Y253-P291 HydrophobicContact CD1-CG 4.21Å; Y253-P291 HydrophobicContact CE1-CG 3.88Å; C288-P291 WeakPolarHBondContact O-CD 3.15Å; P291-A294 PolarHBondContact O-N 3.37Å; P291-A295 WeakPolarHBondContact O-CB 3.44Å; P291-A295 PolarHBondContact O-N 2.96Å
292	A	93.9	Very high	92.7	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.5	-43.8	178.3	0	0	0	0	0	111.8	A125 L190 L289 F290 A295 L296	A125-A292 HydrophobicContact CB-CB 3.77Å; L190-A292 HydrophobicContact CD1-CB 4.19Å; L289-A292 PolarHBondContact O-N 3.26Å; F290-A292 VanDerWaalsContact C-N 3.33Å; F290-A292 PolarHBondContact O-N 3.02Å; A292-A295 PolarHBondContact O-N 3.33Å; A292-L296 WeakPolarHBondContact O-CB 3.42Å; A292-L296 PolarHBondContact O-N 2.92Å
293	L	96.1	Very high	93.1	Very high	73 Å²	73	37 Å²	37	38%	0.382	19%	0.193	S	C	.	.	H	α-helix	trans	-63.7	-44.5	176.1	179	61.9	0	0	0	111.8	L190 L289 F290 A295 L296 I297	L190-L293 HydrophobicContact CD1-CB 4.06Å; L190-L293 HydrophobicContact CD2-CD1 3.93Å; L289-L293 PolarHBondContact O-N 3.3Å; F290-L293 PolarHBondContact O-N 3.08Å; L293-A295 VanDerWaalsContact C-N 3.34Å; L293-A295 PolarHBondContact O-N 3.28Å; L293-L296 PolarHBondContact O-N 3.05Å; L293-I297 HydrophobicContact CD1-CD1 4.12Å; L293-I297 HydrophobicContact CD1-CG1 4.4Å; L293-I297 HydrophobicContact CG-CD1 4.07Å; L293-I297 VanDerWaalsContact O-CG1 3.31Å; L293-I297 WeakPolarHBondContact O-CG1 3.26Å; L293-I297 PolarHBondContact O-N 3.33Å
294	A	96.1	Very high	93.5	Very high	41 Å²	41	35.3 Å²	35.3	34%	0.339	18%	0.184	S	C	.	.	H	α-helix	trans	-62.9	-41.6	177.4	0	0	0	0	0	111.7	L121 F290 P291 G298	L121-A294 HydrophobicContact CD1-CB 4.11Å; F290-A294 WeakPolarHBondContact O-CB 3.47Å; F290-A294 PolarHBondContact O-N 3.43Å; P291-A294 PolarHBondContact O-N 3.37Å; A294-G298 PolarHBondContact O-N 3.05Å
295	A	95.5	Very high	93.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62	-46.8	174.3	0	0	0	0	0	111.7	L121 A122 L186 P291 A292 L293 I297 G298 V299	L121-A295 HydrophobicContact CB-CB 3.91Å; A122-A295 HydrophobicContact CB-CB 3.98Å; L186-A295 HydrophobicContact CD1-CB 4.15Å; P291-A295 WeakPolarHBondContact O-CB 3.44Å; P291-A295 PolarHBondContact O-N 2.96Å; A292-A295 PolarHBondContact O-N 3.33Å; L293-A295 VanDerWaalsContact C-N 3.34Å; L293-A295 PolarHBondContact O-N 3.28Å; A295-I297 PolarHBondContact O-N 3.21Å; A295-G298 PolarHBondContact O-N 2.87Å; A295-G298 VanDerWaalsContact O-N 3.15Å; A295-V299 VanDerWaalsContact O-CG2 3.29Å; A295-V299 WeakPolarHBondContact O-CG2 3.09Å; A295-V299 PolarHBondContact O-N 3.5Å
296	L	96.1	Very high	93.5	Very high	24 Å²	24	35.2 Å²	35.2	13%	0.126	18%	0.184	C	C	.	.	H	α-helix	trans	-59	-47.4	179	179.5	61.9	0	0	0	111.5	I183 L186 L190 A292 L293 G298 V299 V300	I183-L296 HydrophobicContact CG2-CD1 4.1Å; L186-L296 HydrophobicContact CB-CB 4.42Å; L186-L296 HydrophobicContact CB-CD1 4.13Å; L190-L296 HydrophobicContact CD2-CD2 3.98Å; A292-L296 WeakPolarHBondContact O-CB 3.42Å; A292-L296 PolarHBondContact O-N 2.92Å; L293-L296 PolarHBondContact O-N 3.05Å; L296-G298 VanDerWaalsContact C-N 3.31Å; L296-G298 PolarHBondContact O-N 3.02Å; L296-V299 PolarHBondContact O-N 3.3Å; L296-V300 WeakPolarHBondContact O-CG2 3.41Å; L296-V300 PolarHBondContact O-N 3.17Å; L296-V300 VanDerWaalsContact O-N 3.17Å
297	I	96.4	Very high	93.2	Very high	92 Å²	92	31.9 Å²	31.9	47%	0.472	17%	0.169	S	C	.	.	H	α-helix	trans	-59.3	-45.6	176.1	-66.7	167.4	0	0	0	110	L293 A295 V300 F301	L293-I297 HydrophobicContact CD1-CD1 4.12Å; L293-I297 HydrophobicContact CD1-CG1 4.4Å; L293-I297 HydrophobicContact CG-CD1 4.07Å; L293-I297 VanDerWaalsContact O-CG1 3.31Å; L293-I297 WeakPolarHBondContact O-CG1 3.26Å; L293-I297 PolarHBondContact O-N 3.33Å; A295-I297 PolarHBondContact O-N 3.21Å; I297-V300 PolarHBondContact O-N 3.45Å; I297-F301 HydrophobicContact CG2-CD2 4.42Å; I297-F301 HydrophobicContact CG2-CE2 3.85Å; I297-F301 WeakPolarHBondContact O-CD2 3.45Å
298	G	94.8	Very high	92.9	Very high	13 Å²	13	31 Å²	31	13%	0.134	16%	0.162	C	C	.	.	H	α-helix	trans	-60.5	-46.5	178.3	0	0	0	0	0	113.5	V118 A294 A295 L296 V300 F301 M302	V118-G298 VanDerWaalsContact CG1-C 3.46Å; A294-G298 PolarHBondContact O-N 3.05Å; A295-G298 PolarHBondContact O-N 2.87Å; A295-G298 VanDerWaalsContact O-N 3.15Å; L296-G298 VanDerWaalsContact C-N 3.31Å; L296-G298 PolarHBondContact O-N 3.02Å; G298-V300 VanDerWaalsContact C-N 3.28Å; G298-V300 PolarHBondContact O-N 3.46Å; G298-F301 PolarHBondContact O-N 3.05Å; G298-F301 VanDerWaalsContact O-N 3.14Å; G298-M302 WeakPolarHBondContact O-CG 3.46Å; G298-M302 PolarHBondContact O-N 3.12Å
299	V	94.9	Very high	92.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.5	-30.1	-177.6	174.9	0	0	0	0	111.8	V118 R179 L182 I183 L186 A295 L296 F301 M302	V118-V299 HydrophobicContact CG1-CB 4.46Å; V118-V299 HydrophobicContact CG1-CG2 3.66Å; R179-V299 HydrophobicContact CG-CG1 4.15Å; L182-V299 HydrophobicContact CB-CG1 4.28Å; L182-V299 HydrophobicContact CD2-CB 4.5Å; L182-V299 HydrophobicContact CD2-CG1 4Å; L182-V299 HydrophobicContact CD2-CG2 3.6Å; L182-V299 HydrophobicContact CG-CG1 4.22Å; L182-V299 HydrophobicContact CG-CG2 4.16Å; I183-V299 HydrophobicContact CD1-CG1 4.3Å; I183-V299 HydrophobicContact CG1-CB 4.48Å; I183-V299 HydrophobicContact CG1-CG1 3.67Å; L186-V299 HydrophobicContact CD1-CG2 4.19Å; A295-V299 VanDerWaalsContact O-CG2 3.29Å; A295-V299 WeakPolarHBondContact O-CG2 3.09Å; A295-V299 PolarHBondContact O-N 3.5Å; L296-V299 PolarHBondContact O-N 3.3Å; V299-F301 PolarHBondContact O-N 3.14Å; V299-M302 PolarHBondContact O-N 3.12Å
300	V	94.3	Very high	91.8	Very high	67 Å²	67	30.6 Å²	30.6	41%	0.406	16%	0.16	S	C	.	.	H	α-helix	trans	-60.8	-34.2	174.8	169.8	0	0	0	0	111.6	R179 I183 L296 I297 G298	R179-V300 PolarHBondContact NH2-O 3.43Å; I183-V300 HydrophobicContact CD1-CG2 4.32Å; L296-V300 WeakPolarHBondContact O-CG2 3.41Å; L296-V300 PolarHBondContact O-N 3.17Å; L296-V300 VanDerWaalsContact O-N 3.17Å; I297-V300 PolarHBondContact O-N 3.45Å; G298-V300 VanDerWaalsContact C-N 3.28Å; G298-V300 PolarHBondContact O-N 3.46Å
301	F	92.4	Very high	90.8	Very high	165 Å²	165	28.9 Å²	28.9	72%	0.724	15%	0.154	S	C	*	.	H	α-helix	trans	-84.1	-11.6	178.2	-65.1	-71.5	0	0	0	114.3	I297 G298 V299	I297-F301 HydrophobicContact CG2-CD2 4.42Å; I297-F301 HydrophobicContact CG2-CE2 3.85Å; I297-F301 WeakPolarHBondContact O-CD2 3.45Å; G298-F301 PolarHBondContact O-N 3.05Å; G298-F301 VanDerWaalsContact O-N 3.14Å; V299-F301 PolarHBondContact O-N 3.14Å
302	M	92.9	Very high	89.9	Confident	5 Å²	5	32 Å²	32	3%	0.025	17%	0.17	C	C	.	.	S	Bend	trans	-83	146.6	-179.4	-66.6	-64.4	176.7	0	0	111.9	M114 L115 V118 R179 Y226 G298 V299	M114-M302 HydrophobicContact CB-CE 4.22Å; M114-M302 HydrophobicContact CE-CE 3.52Å; M114-M302 HydrophobicContact CE-SD 3.76Å; M114-M302 HydrophobicContact CG-CE 3.63Å; M114-M302 HydrophobicContact SD-CE 4.18Å; L115-M302 HydrophobicContact CB-CE 4.49Å; L115-M302 HydrophobicContact CD1-CB 4.44Å; L115-M302 HydrophobicContact CD1-CE 4.46Å; L115-M302 HydrophobicContact CD1-CG 4.02Å; L115-M302 HydrophobicContact CD1-SD 3.93Å; V118-M302 HydrophobicContact CB-CE 3.91Å; V118-M302 HydrophobicContact CG1-CE 4.44Å; V118-M302 HydrophobicContact CG1-CG 4.23Å; V118-M302 HydrophobicContact CG2-CE 3.46Å; V118-M302 VanDerWaalsContact CG2-CE 3.46Å; R179-M302 WeakPolarHBondContact CD-O 3.48Å; R179-M302 VanDerWaalsContact CZ-O 3.27Å; R179-M302 PolarHBondContact NE-O 3.23Å; Y226-M302 WeakPolarHBondContact OH-CB 3.23Å; G298-M302 WeakPolarHBondContact O-CG 3.46Å; G298-M302 PolarHBondContact O-N 3.12Å; V299-M302 PolarHBondContact O-N 3.12Å
303	P	93.4	Very high	89	Confident	14 Å²	14	33.9 Å²	33.9	9%	0.091	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-78.6	161.2	177.3	31.5	-34.4	0	0	0	112.4	F111 Y226 F230 I321	F111-P303 HydrophobicContact CE2-CG 4.01Å; F111-P303 HydrophobicContact CZ-CG 3.62Å; Y226-P303 PolarHBondContact OH-O 3.22Å; F230-P303 HydrophobicContact CZ-CG 4.41Å; P303-I321 HydrophobicContact CB-CD1 3.96Å; P303-I321 HydrophobicContact CB-CG1 3.84Å; P303-I321 HydrophobicContact CB-CG2 3.92Å; P303-I321 HydrophobicContact CG-CG2 3.95Å
304	E	92.6	Very high	88.1	Confident	15 Å²	15	34.8 Å²	34.8	7%	0.07	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-66.4	159	172	-169.7	60.3	-97.2	0	0	110.8	R178 R179 F308 L309 I321	R178-E304 PolarHBondContact N-OE1 3.13Å; R179-E304 WeakPolarHBondContact CB-OE2 3.38Å; R179-E304 PolarHBondContact N-OE1 3.2Å; R179-E304 PolarHBondContact N-OE2 3.43Å; E304-F308 HydrophobicContact CG-CD1 3.68Å; E304-F308 HydrophobicContact CG-CE1 4.14Å; E304-L309 HydrophobicContact CB-CD1 4.23Å; E304-L309 HydrophobicContact CG-CD2 4.41Å; E304-L309 HydrophobicContact CG-CG 4.32Å; E304-I321 WeakPolarHBondContact O-CD1 3.37Å
305	S	90.4	Very high	87.2	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-62.6	127.9	177.1	169.5	0	0	0	0	112	E229 R307 F308 L309	E229-S305 WeakPolarHBondContact CB-OG 3.44Å; E229-S305 WeakPolarHBondContact OE2-CB 3.43Å; E229-S305 PolarHBondContact OE2-OG 3.03Å; S305-R307 VanDerWaalsContact C-N 3.26Å; S305-R307 PolarHBondContact O-N 3.46Å; S305-R307 PolarHBondContact OG-N 3.41Å; S305-F308 PolarHBondContact O-N 2.91Å; S305-L309 WeakPolarHBondContact O-CG 3.41Å; S305-L309 PolarHBondContact O-N 3.39Å; S305-L309 VanDerWaalsContact O-N 3.15Å
306	P	86.8	Confident	86.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.2	-32.6	177.7	23	-30.2	0	0	0	111.7	Y99 F230 L309 L310 A318 I321 L322	Y99-P306 HydrophobicContact CE2-CB 4.47Å; Y99-P306 HydrophobicContact CE2-CG 4.45Å; Y99-P306 WeakPolarHBondContact OH-CG 3.34Å; F230-P306 HydrophobicContact CD1-CG 4.45Å; F230-P306 HydrophobicContact CE1-CG 3.97Å; F230-P306 HydrophobicContact CZ-CG 4.35Å; P306-L309 PolarHBondContact O-N 3.3Å; P306-L310 WeakPolarHBondContact O-CG 3.41Å; P306-L310 PolarHBondContact O-N 3.03Å; P306-A318 HydrophobicContact CB-CB 4.49Å; P306-I321 HydrophobicContact CB-CG2 4.31Å; P306-I321 HydrophobicContact CG-CG2 4.28Å; P306-L322 HydrophobicContact CB-CD1 4.32Å; P306-L322 HydrophobicContact CB-CD2 3.98Å; P306-L322 HydrophobicContact CB-CG 3.83Å; P306-L322 HydrophobicContact CG-CD2 3.93Å; P306-L322 HydrophobicContact CG-CG 4.3Å
307	R	84.1	Confident	85.9	Confident	12 Å²	12	43.7 Å²	43.7	5%	0.045	22%	0.222	C	C	.	.	H	α-helix	trans	-65.6	-42.6	177.3	-168.9	167.6	175.3	141.3	0.7	112.4	Y99 E229 S305 L309 L310 E311 S626 L688 S689	Y99-R307 HydrophobicContact CE1-CB 4.49Å; Y99-R307 HydrophobicContact CE2-CB 4.19Å; E229-R307 HydrophobicContact CB-CB 4.31Å; E229-R307 HydrophobicContact CG-CB 4.31Å; S305-R307 VanDerWaalsContact C-N 3.26Å; S305-R307 PolarHBondContact O-N 3.46Å; S305-R307 PolarHBondContact OG-N 3.41Å; R307-L309 VanDerWaalsContact C-N 3.3Å; R307-L309 PolarHBondContact O-N 3.5Å; R307-L310 PolarHBondContact O-N 2.94Å; R307-E311 PolarHBondContact O-N 3.32Å; R307-E311 VanDerWaalsContact O-N 3.12Å; R307-S626 VanDerWaalsContact NE-CB 3.25Å; R307-S626 PolarHBondContact NE-OG 3.41Å; R307-S626 PolarHBondContact NH2-OG 2.8Å; R307-L688 PolarHBondContact NH1-O 3.43Å; R307-L688 PolarHBondContact NH2-O 3.42Å; R307-S689 PolarHBondContact NH2-O 2.98Å
308	F	85.2	Confident	85.3	Confident	7 Å²	7	39.3 Å²	39.3	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-38.3	173.1	169.9	-107.6	0	0	0	112.5	D174 E304 S305 E311 N312	D174-F308 WeakPolarHBondContact O-CE2 3.33Å; E304-F308 HydrophobicContact CG-CD1 3.68Å; E304-F308 HydrophobicContact CG-CE1 4.14Å; S305-F308 PolarHBondContact O-N 2.91Å; F308-E311 PolarHBondContact O-N 2.71Å; F308-N312 WeakPolarHBondContact CE1-ND2 2.87Å; F308-N312 WeakPolarHBondContact CE2-ND2 3.24Å; F308-N312 WeakPolarHBondContact CZ-ND2 3.05Å; F308-N312 PolarHBondContact O-N 3.26Å; F308-N312 PolarHBondContact O-ND2 3.15Å
309	L	83.7	Confident	84.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-68.8	-36	178.7	-70.1	169.6	0	0	0	112.2	E304 S305 P306 R307 N312 A313 R314 E317 A318 I321	E304-L309 HydrophobicContact CB-CD1 4.23Å; E304-L309 HydrophobicContact CG-CD2 4.41Å; E304-L309 HydrophobicContact CG-CG 4.32Å; S305-L309 WeakPolarHBondContact O-CG 3.41Å; S305-L309 PolarHBondContact O-N 3.39Å; S305-L309 VanDerWaalsContact O-N 3.15Å; P306-L309 PolarHBondContact O-N 3.3Å; R307-L309 VanDerWaalsContact C-N 3.3Å; R307-L309 PolarHBondContact O-N 3.5Å; L309-N312 CarbonylContact O-C 3.6Å; L309-N312 PolarHBondContact O-N 3.11Å; L309-A313 PolarHBondContact O-N 3.36Å; L309-R314 HydrophobicContact CB-CB 4.32Å; L309-R314 HydrophobicContact CD2-CB 4.05Å; L309-R314 PolarHBondContact O-N 2.79Å; L309-E317 HydrophobicContact CD1-CB 3.99Å; L309-A318 HydrophobicContact CB-CB 3.82Å; L309-I321 HydrophobicContact CD1-CD1 3.35Å
310	L	78.9	Confident	84.3	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-65.9	-39.8	173.7	-68.9	174.9	0	0	0	112.7	Y99 P306 R307 N312 A313 A318 I345	Y99-L310 HydrophobicContact CD2-CD1 3.72Å; Y99-L310 HydrophobicContact CE2-CD1 4.09Å; P306-L310 WeakPolarHBondContact O-CG 3.41Å; P306-L310 PolarHBondContact O-N 3.03Å; R307-L310 PolarHBondContact O-N 2.94Å; L310-N312 VanDerWaalsContact C-N 3.27Å; L310-N312 PolarHBondContact O-N 3.38Å; L310-A313 PolarHBondContact O-N 3.37Å; L310-A318 HydrophobicContact CD2-CB 3.58Å; L310-A318 HydrophobicContact CG-CB 3.72Å; L310-I345 HydrophobicContact CD1-CD1 4.03Å; L310-I345 HydrophobicContact CD1-CG2 4.25Å; L310-I345 HydrophobicContact CD2-CB 4.06Å; L310-I345 HydrophobicContact CD2-CD1 3.69Å; L310-I345 HydrophobicContact CD2-CG1 4.47Å; L310-I345 HydrophobicContact CD2-CG2 3.67Å; L310-I345 HydrophobicContact CG-CD1 4.45Å
311	E	74.8	Confident	84.1	Confident	64 Å²	64	45.1 Å²	45.1	30%	0.299	22%	0.218	S	C	.	.	H	α-helix	trans	-64.8	-31.2	175.5	-72.5	-177.2	162.4	0	0	112.7	R307 F308 A313 S626 S627	R307-E311 PolarHBondContact O-N 3.32Å; R307-E311 VanDerWaalsContact O-N 3.12Å; F308-E311 PolarHBondContact O-N 2.71Å; E311-A313 VanDerWaalsContact C-N 3.34Å; E311-S626 VanDerWaalsContact OE1-CB 3.26Å; E311-S626 WeakPolarHBondContact OE1-CB 3.39Å; E311-S626 PolarHBondContact OE1-OG 2.79Å; E311-S627 PolarHBondContact OE1-N 3.41Å; E311-S627 VanDerWaalsContact OE1-N 3.13Å; E311-S627 WeakPolarHBondContact OE2-CA 3.48Å
312	N	75.4	Confident	83.8	Confident	73 Å²	73	37.3 Å²	37.3	39%	0.39	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	21	178.2	-71.6	-29	0	0	0	113.8	F308 L309 L310 R314	F308-N312 WeakPolarHBondContact CE1-ND2 2.87Å; F308-N312 WeakPolarHBondContact CE2-ND2 3.24Å; F308-N312 WeakPolarHBondContact CZ-ND2 3.05Å; F308-N312 PolarHBondContact O-N 3.26Å; F308-N312 PolarHBondContact O-ND2 3.15Å; L309-N312 CarbonylContact O-C 3.6Å; L309-N312 PolarHBondContact O-N 3.11Å; L310-N312 VanDerWaalsContact C-N 3.27Å; L310-N312 PolarHBondContact O-N 3.38Å; N312-R314 PolarHBondContact O-N 3.32Å; N312-R314 VanDerWaalsContact O-N 3.08Å
313	A	73.6	Confident	83.5	Confident	41 Å²	41	42.7 Å²	42.7	34%	0.339	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	21.4	179.5	0	0	0	0	0	115.7	L309 L310 E311 H315	L309-A313 PolarHBondContact O-N 3.36Å; L310-A313 PolarHBondContact O-N 3.37Å; E311-A313 VanDerWaalsContact C-N 3.34Å; A313-H315 PolarHBondContact O-N 2.78Å
314	R	78.3	Confident	83.3	Confident	92 Å²	92	46.4 Å²	46.4	35%	0.347	22%	0.22	S	C	.	.			trans	-95.2	68.9	176.8	-69.2	173.5	73.6	-164	14.1	110.9	L309 N312 E317 A318	L309-R314 HydrophobicContact CB-CB 4.32Å; L309-R314 HydrophobicContact CD2-CB 4.05Å; L309-R314 PolarHBondContact O-N 2.79Å; N312-R314 PolarHBondContact O-N 3.32Å; N312-R314 VanDerWaalsContact O-N 3.08Å; R314-E317 IonicContact CZ-OE1 3.44Å; R314-E317 IonicContact CZ-OE2 3.12Å; R314-E317 IonicContact NE-OE1 3.6Å; R314-E317 PolarHBondContact NE-OE1 3.44Å; R314-E317 IonicContact NE-OE2 3.17Å; R314-E317 PolarHBondContact NE-OE2 2.88Å; R314-E317 IonicContact NH1-OE2 3.05Å; R314-E317 IonicContact NH2-OE1 2.59Å; R314-E317 PolarHBondContact NH2-OE1 3.19Å; R314-E317 IonicContact NH2-OE2 3.35Å; R314-E317 PolarHBondContact NH2-OE2 3.17Å; R314-A318 PolarHBondContact O-N 3.49Å
315	H	77.4	Confident	83	Confident	48 Å²	48	45.8 Å²	45.8	22%	0.222	22%	0.217	C	C	.	.	H	α-helix	trans	-65.6	-43	-171.7	-61	-40.5	0	0	0	114.2	A313 E317 A318 W319 T347	A313-H315 PolarHBondContact O-N 2.78Å; H315-E317 VanDerWaalsContact C-N 3.34Å; H315-E317 PolarHBondContact O-N 3.44Å; H315-A318 PolarHBondContact O-N 2.9Å; H315-W319 WeakPolarHBondContact O-CB 3.4Å; H315-W319 PolarHBondContact O-N 3Å; H315-T347 WeakPolarHBondContact CE1-CG2 3.42Å; H315-T347 PolarHBondContact CE1-OG1 3.06Å; H315-T347 PolarHBondContact NE2-OG1 3.18Å
316	D	79.8	Confident	82.9	Confident	133 Å²	133	46 Å²	46	71%	0.711	22%	0.218	S	C	*	.	H	α-helix	trans	-63.5	-42.2	-176.7	-60.3	-26.4	0	0	0	111.5	W319 M320	D316-W319 PolarHBondContact O-N 3.12Å; D316-M320 WeakPolarHBondContact O-CG 3.24Å; D316-M320 PolarHBondContact O-N 3.2Å
317	E	83.6	Confident	82.8	Confident	71 Å²	71	48 Å²	48	33%	0.332	23%	0.228	S	C	.	.	H	α-helix	trans	-68.4	-41.7	177.6	-68.4	-175.3	-138.9	0	0	112.5	L309 R314 H315 W319 M320 I321	L309-E317 HydrophobicContact CD1-CB 3.99Å; R314-E317 IonicContact CZ-OE1 3.44Å; R314-E317 IonicContact CZ-OE2 3.12Å; R314-E317 IonicContact NE-OE1 3.6Å; R314-E317 PolarHBondContact NE-OE1 3.44Å; R314-E317 IonicContact NE-OE2 3.17Å; R314-E317 PolarHBondContact NE-OE2 2.88Å; R314-E317 IonicContact NH1-OE2 3.05Å; R314-E317 IonicContact NH2-OE1 2.59Å; R314-E317 PolarHBondContact NH2-OE1 3.19Å; R314-E317 IonicContact NH2-OE2 3.35Å; R314-E317 PolarHBondContact NH2-OE2 3.17Å; H315-E317 VanDerWaalsContact C-N 3.34Å; H315-E317 PolarHBondContact O-N 3.44Å; E317-W319 VanDerWaalsContact C-N 3.29Å; E317-W319 PolarHBondContact O-N 3.12Å; E317-M320 HydrophobicContact CB-CE 4.38Å; E317-M320 HydrophobicContact CG-CE 3.98Å; E317-M320 PolarHBondContact O-N 3.24Å; E317-I321 WeakPolarHBondContact O-CD1 3.36Å; E317-I321 WeakPolarHBondContact O-CG1 3.31Å; E317-I321 PolarHBondContact O-N 3.39Å; E317-I321 VanDerWaalsContact O-N 3.08Å
318	A	83.9	Confident	82.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.6	-44.1	175.1	0	0	0	0	0	110.9	P306 L309 L310 R314 H315 I321 L322	P306-A318 HydrophobicContact CB-CB 4.49Å; L309-A318 HydrophobicContact CB-CB 3.82Å; L310-A318 HydrophobicContact CD2-CB 3.58Å; L310-A318 HydrophobicContact CG-CB 3.72Å; R314-A318 PolarHBondContact O-N 3.49Å; H315-A318 PolarHBondContact O-N 2.9Å; A318-I321 PolarHBondContact O-N 3.11Å; A318-L322 VanDerWaalsContact O-CG 3.31Å; A318-L322 WeakPolarHBondContact O-CG 3.36Å; A318-L322 PolarHBondContact O-N 3.38Å
319	W	83.4	Confident	83	Confident	75 Å²	75	49.3 Å²	49.3	28%	0.284	24%	0.239	S	C	.	.	H	α-helix	trans	-64.8	-44.1	178.6	-173.5	90.7	0	0	0	112.3	H315 D316 E317 I321 L322 R323 F340 V342	H315-W319 WeakPolarHBondContact O-CB 3.4Å; H315-W319 PolarHBondContact O-N 3Å; D316-W319 PolarHBondContact O-N 3.12Å; E317-W319 VanDerWaalsContact C-N 3.29Å; E317-W319 PolarHBondContact O-N 3.12Å; W319-I321 VanDerWaalsContact C-N 3.29Å; W319-I321 PolarHBondContact O-N 3.43Å; W319-L322 PolarHBondContact O-N 3.35Å; W319-R323 WeakPolarHBondContact O-CB 3.25Å; W319-R323 PolarHBondContact O-N 3.09Å; W319-F340 AromaticContact CD1-CE1 3.94Å; W319-F340 HydrophobicContact CZ2-CD1 4.34Å; W319-F340 AromaticContact NE1-CD1 3.71Å; W319-F340 AromaticContact NE1-CE1 3.57Å; W319-V342 PolarHBondContact NE1-O 3.41Å
320	M	86.4	Confident	83	Confident	110 Å²	110	50.8 Å²	50.8	54%	0.542	24%	0.244	S	C	.	.	H	α-helix	trans	-58.5	-41.2	175.9	-75.8	-169.7	-62.6	0	0	112.1	D316 E317 Q324	D316-M320 WeakPolarHBondContact O-CG 3.24Å; D316-M320 PolarHBondContact O-N 3.2Å; E317-M320 HydrophobicContact CB-CE 4.38Å; E317-M320 HydrophobicContact CG-CE 3.98Å; E317-M320 PolarHBondContact O-N 3.24Å; M320-Q324 WeakPolarHBondContact O-CB 3.18Å; M320-Q324 PolarHBondContact O-N 2.96Å
321	I	89.1	Confident	83.1	Confident	17 Å²	17	56.8 Å²	56.8	9%	0.087	27%	0.27	C	S	.	.	H	α-helix	trans	-70.1	-44.6	179.7	-68	163.4	0	0	0	110.6	F230 P303 E304 P306 L309 E317 A318 W319 R323 Q324 V325	F230-I321 HydrophobicContact CE1-CG2 4.15Å; P303-I321 HydrophobicContact CB-CD1 3.96Å; P303-I321 HydrophobicContact CB-CG1 3.84Å; P303-I321 HydrophobicContact CB-CG2 3.92Å; P303-I321 HydrophobicContact CG-CG2 3.95Å; E304-I321 WeakPolarHBondContact O-CD1 3.37Å; P306-I321 HydrophobicContact CB-CG2 4.31Å; P306-I321 HydrophobicContact CG-CG2 4.28Å; L309-I321 HydrophobicContact CD1-CD1 3.35Å; E317-I321 WeakPolarHBondContact O-CD1 3.36Å; E317-I321 WeakPolarHBondContact O-CG1 3.31Å; E317-I321 PolarHBondContact O-N 3.39Å; E317-I321 VanDerWaalsContact O-N 3.08Å; A318-I321 PolarHBondContact O-N 3.11Å; W319-I321 VanDerWaalsContact C-N 3.29Å; W319-I321 PolarHBondContact O-N 3.43Å; I321-R323 VanDerWaalsContact C-N 3.3Å; I321-R323 PolarHBondContact O-N 3.27Å; I321-Q324 WeakPolarHBondContact O-CB 3.18Å; I321-Q324 PolarHBondContact O-N 2.76Å; I321-Q324 VanDerWaalsContact O-N 3.1Å; I321-V325 HydrophobicContact CG2-CG2 4.49Å; I321-V325 WeakPolarHBondContact O-CG2 3.4Å; I321-V325 PolarHBondContact O-N 2.8Å
322	L	87.4	Confident	83.1	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-59.6	-43	176.2	-71.8	165.9	0	0	0	111.4	Y99 I102 M103 P306 A318 W319 Q324 V325 H326 F340 I345	Y99-L322 HydrophobicContact CE2-CD2 4.34Å; I102-L322 HydrophobicContact CG2-CD1 4.08Å; I102-L322 HydrophobicContact CG2-CD2 4.14Å; M103-L322 HydrophobicContact SD-CD2 3.92Å; P306-L322 HydrophobicContact CB-CD1 4.32Å; P306-L322 HydrophobicContact CB-CD2 3.98Å; P306-L322 HydrophobicContact CB-CG 3.83Å; P306-L322 HydrophobicContact CG-CD2 3.93Å; P306-L322 HydrophobicContact CG-CG 4.3Å; A318-L322 VanDerWaalsContact O-CG 3.31Å; A318-L322 WeakPolarHBondContact O-CG 3.36Å; A318-L322 PolarHBondContact O-N 3.38Å; W319-L322 PolarHBondContact O-N 3.35Å; L322-Q324 PolarHBondContact O-N 3Å; L322-V325 PolarHBondContact O-N 3.09Å; L322-H326 WeakPolarHBondContact O-CB 3.42Å; L322-H326 PolarHBondContact O-N 2.66Å; L322-F340 HydrophobicContact CB-CZ 3.95Å; L322-I345 HydrophobicContact CD1-CD1 4Å
323	R	85.6	Confident	83.3	Confident	117 Å²	117	57.6 Å²	57.6	44%	0.442	28%	0.277	S	S	.	.	H	α-helix	trans	-61.3	-43.1	172.7	-176.4	175.8	179.1	178.5	5.4	112.1	W319 I321 V325 H326 D327	W319-R323 WeakPolarHBondContact O-CB 3.25Å; W319-R323 PolarHBondContact O-N 3.09Å; I321-R323 VanDerWaalsContact C-N 3.3Å; I321-R323 PolarHBondContact O-N 3.27Å; R323-V325 VanDerWaalsContact C-N 3.32Å; R323-V325 PolarHBondContact O-N 2.86Å; R323-H326 PolarHBondContact O-N 3.47Å; R323-D327 IonicContact NE-OD2 3.91Å; R323-D327 VanDerWaalsContact O-CB 3.3Å; R323-D327 WeakPolarHBondContact O-CB 3.44Å; R323-D327 PolarHBondContact O-N 3.44Å
324	Q	88.2	Confident	83.3	Confident	93 Å²	93	58.5 Å²	58.5	44%	0.435	29%	0.291	S	S	.	.	H	α-helix	trans	-59.9	-42.6	175.9	-177.9	-175.3	-2.1	0	0	111.7	M320 I321 L322 T328	M320-Q324 WeakPolarHBondContact O-CB 3.18Å; M320-Q324 PolarHBondContact O-N 2.96Å; I321-Q324 WeakPolarHBondContact O-CB 3.18Å; I321-Q324 PolarHBondContact O-N 2.76Å; I321-Q324 VanDerWaalsContact O-N 3.1Å; L322-Q324 PolarHBondContact O-N 3Å; Q324-T328 VanDerWaalsContact O-CB 3.28Å; Q324-T328 WeakPolarHBondContact O-CB 3.49Å; Q324-T328 PolarHBondContact O-N 2.93Å; Q324-T328 PolarHBondContact O-OG1 3.37Å
325	V	88.1	Confident	83.1	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	30%	0.297	C	S	.	.	H	α-helix	trans	-64.2	-50.7	177.4	175.4	0	0	0	0	110.5	C106 F111 F230 I321 L322 R323 D327 T328 N329	C106-V325 HydrophobicContact CB-CG1 4.34Å; F111-V325 HydrophobicContact CB-CG1 4.45Å; F111-V325 HydrophobicContact CD1-CB 4.36Å; F111-V325 HydrophobicContact CD1-CG1 3.98Å; F111-V325 HydrophobicContact CD1-CG2 3.67Å; F111-V325 HydrophobicContact CD2-CG2 4.29Å; F111-V325 HydrophobicContact CE1-CG2 3.59Å; F111-V325 HydrophobicContact CE2-CG2 4.21Å; F111-V325 HydrophobicContact CG-CG1 4.3Å; F111-V325 HydrophobicContact CG-CG2 4.03Å; F111-V325 HydrophobicContact CZ-CG2 3.88Å; F230-V325 HydrophobicContact CD1-CG2 4.27Å; F230-V325 HydrophobicContact CE1-CG2 4.19Å; I321-V325 HydrophobicContact CG2-CG2 4.49Å; I321-V325 WeakPolarHBondContact O-CG2 3.4Å; I321-V325 PolarHBondContact O-N 2.8Å; L322-V325 PolarHBondContact O-N 3.09Å; R323-V325 VanDerWaalsContact C-N 3.32Å; R323-V325 PolarHBondContact O-N 2.86Å; V325-D327 PolarHBondContact O-N 3.17Å; V325-T328 PolarHBondContact O-N 3.42Å; V325-N329 WeakPolarHBondContact O-CB 3.33Å; V325-N329 VanDerWaalsContact O-CG 3.27Å; V325-N329 PolarHBondContact O-N 3.25Å; V325-N329 PolarHBondContact O-ND2 3.4Å
326	H	86.8	Confident	82.4	Confident	5 Å²	5	60.8 Å²	60.8	2%	0.023	31%	0.312	C	S	.	.	H	α-helix	trans	-54.9	-53.3	176.7	172.7	-80.7	0	0	0	111.6	C106 L322 R323 T328 N329 W330 R338 F340	C106-H326 HydrophobicContact CB-CB 4.4Å; L322-H326 WeakPolarHBondContact O-CB 3.42Å; L322-H326 PolarHBondContact O-N 2.66Å; R323-H326 PolarHBondContact O-N 3.47Å; H326-T328 VanDerWaalsContact C-N 3.33Å; H326-T328 PolarHBondContact O-N 3.15Å; H326-N329 PolarHBondContact O-N 3.42Å; H326-W330 AromaticContact CD2-CD1 3.36Å; H326-W330 AromaticContact CD2-NE1 3.55Å; H326-W330 AromaticContact CE1-CD1 3.47Å; H326-W330 VanDerWaalsContact CE1-CD1 3.47Å; H326-W330 AromaticContact CG-CD1 3.78Å; H326-W330 AromaticContact ND1-CD1 3.86Å; H326-W330 AromaticContact NE2-CD1 3.14Å; H326-W330 AromaticContact NE2-NE1 3.45Å; H326-W330 PolarHBondContact NE2-NE1 3.12Å; H326-W330 PolarHBondContact O-N 3.33Å; H326-R338 PolarHBondContact CE1-O 2.91Å; H326-F340 HydrophobicContact CB-CD2 3.96Å; H326-F340 HydrophobicContact CB-CE2 4.32Å; H326-F340 AromaticContact CD2-CD2 3.78Å; H326-F340 AromaticContact CG-CD2 3.79Å
327	D	85.4	Confident	81.1	Confident	41 Å²	41	62.9 Å²	62.9	22%	0.219	32%	0.318	C	S	.	.	H	α-helix	trans	-63.3	-39.6	-177.7	-71.3	-2	0	0	0	111.3	R323 V325 K331	R323-D327 IonicContact NE-OD2 3.91Å; R323-D327 VanDerWaalsContact O-CB 3.3Å; R323-D327 WeakPolarHBondContact O-CB 3.44Å; R323-D327 PolarHBondContact O-N 3.44Å; V325-D327 PolarHBondContact O-N 3.17Å; D327-K331 WeakPolarHBondContact O-CB 3.37Å; D327-K331 WeakPolarHBondContact O-CD 3.42Å; D327-K331 WeakPolarHBondContact O-CG 3.26Å; D327-K331 PolarHBondContact O-N 3.37Å
328	T	86.4	Confident	79.9	Confident	48 Å²	48	66 Å²	66	29%	0.294	33%	0.327	S	S	.	.	H	α-helix	trans	-65.4	-40.6	177.9	-58.1	0	0	0	0	111.4	R110 F111 Q324 V325 H326 A332	R110-T328 HydrophobicContact CB-CG2 4.38Å; F111-T328 HydrophobicContact CB-CG2 4.04Å; Q324-T328 VanDerWaalsContact O-CB 3.28Å; Q324-T328 WeakPolarHBondContact O-CB 3.49Å; Q324-T328 PolarHBondContact O-N 2.93Å; Q324-T328 PolarHBondContact O-OG1 3.37Å; V325-T328 PolarHBondContact O-N 3.42Å; H326-T328 VanDerWaalsContact C-N 3.33Å; H326-T328 PolarHBondContact O-N 3.15Å; T328-A332 WeakPolarHBondContact O-CB 3.44Å; T328-A332 PolarHBondContact O-N 3.29Å
329	N	87.6	Confident	78.9	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-73	-44.1	-178.1	-73.3	-17.8	0	0	0	112.6	C106 G107 G109 R110 F111 Q112 V325 H326 A332 K333	C106-N329 WeakPolarHBondContact O-CB 3.2Å; C106-N329 PolarHBondContact O-ND2 2.82Å; G107-N329 PolarHBondContact O-ND2 3.38Å; G109-N329 VanDerWaalsContact C-OD1 3.24Å; G109-N329 VanDerWaalsContact CA-OD1 3.3Å; G109-N329 WeakPolarHBondContact CA-OD1 3.32Å; R110-N329 PolarHBondContact N-OD1 2.91Å; F111-N329 WeakPolarHBondContact CB-OD1 3.33Å; F111-N329 PolarHBondContact N-OD1 3.32Å; F111-N329 VanDerWaalsContact N-OD1 3.11Å; Q112-N329 PolarHBondContact NE2-ND2 3.22Å; Q112-N329 VanDerWaalsContact NE2-ND2 3.17Å; Q112-N329 PolarHBondContact OE1-ND2 3.43Å; Q112-N329 PolarHBondContact OE1-OD1 2.94Å; V325-N329 WeakPolarHBondContact O-CB 3.33Å; V325-N329 VanDerWaalsContact O-CG 3.27Å; V325-N329 PolarHBondContact O-N 3.25Å; V325-N329 PolarHBondContact O-ND2 3.4Å; H326-N329 PolarHBondContact O-N 3.42Å; N329-A332 PolarHBondContact O-N 2.95Å; N329-K333 PolarHBondContact O-N 2.96Å
330	W	82.3	Confident	78	Confident	30 Å²	30	69 Å²	69	11%	0.114	35%	0.352	C	S	.	.	H	α-helix	trans	-78.6	-33.2	-179.1	-70.9	119.6	0	0	0	113.3	D105 H326 A332 K333 G334 E335 R338	D105-W330 PolarHBondContact O-NE1 3.1Å; H326-W330 AromaticContact CD2-CD1 3.36Å; H326-W330 AromaticContact CD2-NE1 3.55Å; H326-W330 AromaticContact CE1-CD1 3.47Å; H326-W330 VanDerWaalsContact CE1-CD1 3.47Å; H326-W330 AromaticContact CG-CD1 3.78Å; H326-W330 AromaticContact ND1-CD1 3.86Å; H326-W330 AromaticContact NE2-CD1 3.14Å; H326-W330 AromaticContact NE2-NE1 3.45Å; H326-W330 PolarHBondContact NE2-NE1 3.12Å; H326-W330 PolarHBondContact O-N 3.33Å; W330-A332 VanDerWaalsContact C-N 3.25Å; W330-A332 PolarHBondContact O-N 2.94Å; W330-K333 HydrophobicContact CD2-CD 4.47Å; W330-K333 HydrophobicContact CE3-CB 4.03Å; W330-K333 HydrophobicContact CE3-CD 3.55Å; W330-K333 HydrophobicContact CE3-CG 4.4Å; W330-K333 HydrophobicContact CH2-CD 4.13Å; W330-K333 HydrophobicContact CZ3-CB 4.37Å; W330-K333 HydrophobicContact CZ3-CD 3.35Å; W330-K333 HydrophobicContact CZ3-CG 4.49Å; W330-K333 PolarHBondContact O-N 3.23Å; W330-K333 VanDerWaalsContact O-N 3.12Å; W330-G334 PolarHBondContact O-N 3.09Å; W330-G334 VanDerWaalsContact O-N 3.12Å; W330-E335 WeakPolarHBondContact CB-O 3.36Å; W330-E335 HydrophobicContact CE3-CB 4.46Å; W330-E335 PolarHBondContact O-N 3.25Å; W330-R338 VanDerWaalsContact CH2-NH1 3.26Å; W330-R338 VanDerWaalsContact CZ2-NH1 3.3Å
331	K	81.1	Confident	76.6	Confident	133 Å²	133	68.3 Å²	68.3	58%	0.578	35%	0.353	S	S	*	.	H	α-helix	trans	-58.4	-39.2	167.1	-76.1	171.5	-176.6	172.7	0	111.8	D327 K333 G334 P336	D327-K331 WeakPolarHBondContact O-CB 3.37Å; D327-K331 WeakPolarHBondContact O-CD 3.42Å; D327-K331 WeakPolarHBondContact O-CG 3.26Å; D327-K331 PolarHBondContact O-N 3.37Å; K331-K333 VanDerWaalsContact C-N 3.3Å; K331-K333 PolarHBondContact O-N 2.89Å; K331-G334 PolarHBondContact O-N 3.44Å; K331-P336 HydrophobicContact CG-CB 4.05Å
332	A	76	Confident	75.3	Confident	45 Å²	45	69.1 Å²	69.1	37%	0.372	36%	0.359	S	S	.	.	H	α-helix	trans	-68.9	-28.1	178	0	0	0	0	0	113.3	R110 T328 N329 W330	R110-A332 HydrophobicContact CB-CB 3.97Å; R110-A332 HydrophobicContact CG-CB 3.94Å; T328-A332 WeakPolarHBondContact O-CB 3.44Å; T328-A332 PolarHBondContact O-N 3.29Å; N329-A332 PolarHBondContact O-N 2.95Å; W330-A332 VanDerWaalsContact C-N 3.25Å; W330-A332 PolarHBondContact O-N 2.94Å
333	K	79.1	Confident	73.7	Confident	108 Å²	108	74.7 Å²	74.7	47%	0.47	39%	0.394	S	S	.	.	H	α-helix	trans	-85.8	-6.4	176.6	-72.1	176.3	-178.7	173.3	0	113.8	H108 N329 W330 K331	H108-K333 WeakPolarHBondContact O-CE 3.29Å; H108-K333 PolarHBondContact O-NZ 3.45Å; N329-K333 PolarHBondContact O-N 2.96Å; W330-K333 HydrophobicContact CD2-CD 4.47Å; W330-K333 HydrophobicContact CE3-CB 4.03Å; W330-K333 HydrophobicContact CE3-CD 3.55Å; W330-K333 HydrophobicContact CE3-CG 4.4Å; W330-K333 HydrophobicContact CH2-CD 4.13Å; W330-K333 HydrophobicContact CZ3-CB 4.37Å; W330-K333 HydrophobicContact CZ3-CD 3.35Å; W330-K333 HydrophobicContact CZ3-CG 4.49Å; W330-K333 PolarHBondContact O-N 3.23Å; W330-K333 VanDerWaalsContact O-N 3.12Å; K331-K333 VanDerWaalsContact C-N 3.3Å; K331-K333 PolarHBondContact O-N 2.89Å
334	G	73.9	Confident	72.1	Confident	60 Å²	60	75.5 Å²	75.5	62%	0.619	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	11.2	179.4	0	0	0	0	0	115.1	W330 K331 P336	W330-G334 PolarHBondContact O-N 3.09Å; W330-G334 VanDerWaalsContact O-N 3.12Å; K331-G334 PolarHBondContact O-N 3.44Å; G334-P336 VanDerWaalsContact C-CD 3.42Å; G334-P336 VanDerWaalsContact O-CD 3.3Å; G334-P336 WeakPolarHBondContact O-CD 3.37Å
335	E	73.7	Confident	70.6	Confident	105 Å²	105	71.9 Å²	71.9	49%	0.491	39%	0.39	S	S	.	.			trans	-118.8	67.6	-180	-66.2	-177	171.8	0	0	111.6	W330 E337	W330-E335 WeakPolarHBondContact CB-O 3.36Å; W330-E335 HydrophobicContact CE3-CB 4.46Å; W330-E335 PolarHBondContact O-N 3.25Å; E335-E337 PolarHBondContact O-N 3.49Å
336	P	62.1	Low	68.9	Low	83 Å²	83	80.1 Å²	80.1	54%	0.539	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-10.6	-175.5	30.6	-36.4	0	0	0	114.5	K331 G334	K331-P336 HydrophobicContact CG-CB 4.05Å; G334-P336 VanDerWaalsContact C-CD 3.42Å; G334-P336 VanDerWaalsContact O-CD 3.3Å; G334-P336 WeakPolarHBondContact O-CD 3.37Å
337	E	53	Low	67.4	Low	178 Å²	178	81.3 Å²	81.3	83%	0.832	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-5.3	-172.3	-61.9	-174	168.5	0	0	114.2	E335 V339	E335-E337 PolarHBondContact O-N 3.49Å; E337-V339 PolarHBondContact O-N 3.31Å; E337-V339 VanDerWaalsContact O-N 3.16Å
338	R	59.5	Low	65.6	Low	135 Å²	135	81.5 Å²	81.5	51%	0.509	44%	0.437	S	S	.	.			trans	-65.3	119.6	-180	-148.2	172.1	-178.6	171.9	-3.5	108.8	H326 W330	H326-R338 PolarHBondContact CE1-O 2.91Å; W330-R338 VanDerWaalsContact CH2-NH1 3.26Å; W330-R338 VanDerWaalsContact CZ2-NH1 3.3Å
339	V	61.4	Low	63.9	Low	118 Å²	118	87 Å²	87	72%	0.715	46%	0.459	S	S	*	.			trans	-79.6	129.4	-176.9	-178.7	0	0	0	0	108.9	E337 T341	E337-V339 PolarHBondContact O-N 3.31Å; E337-V339 VanDerWaalsContact O-N 3.16Å; V339-T341 PolarHBondContact O-N 3.2Å; V339-T341 VanDerWaalsContact O-N 3.08Å
340	F	65	Low	62.3	Low	22 Å²	22	90.7 Å²	90.7	10%	0.096	48%	0.482	C	S	.	.			trans	-63.4	110.2	170.5	-169.2	-108.6	0	0	0	109	I102 W319 L322 H326 V342	I102-F340 HydrophobicContact CG2-CE2 3.95Å; I102-F340 HydrophobicContact CG2-CZ 3.62Å; W319-F340 AromaticContact CD1-CE1 3.94Å; W319-F340 HydrophobicContact CZ2-CD1 4.34Å; W319-F340 AromaticContact NE1-CD1 3.71Å; W319-F340 AromaticContact NE1-CE1 3.57Å; L322-F340 HydrophobicContact CB-CZ 3.95Å; H326-F340 HydrophobicContact CB-CD2 3.96Å; H326-F340 HydrophobicContact CB-CE2 4.32Å; H326-F340 AromaticContact CD2-CD2 3.78Å; H326-F340 AromaticContact CG-CD2 3.79Å; F340-V342 VanDerWaalsContact C-N 3.32Å; F340-V342 WeakPolarHBondContact CD1-O 3.4Å; F340-V342 HydrophobicContact CE1-CB 4.03Å; F340-V342 WeakPolarHBondContact CE1-O 3.35Å; F340-V342 HydrophobicContact CZ-CB 4.38Å; F340-V342 PolarHBondContact O-N 2.88Å
341	T	57.8	Low	60.4	Low	94 Å²	94	94.5 Å²	94.5	58%	0.577	50%	0.501	S	S	*	.			trans	-72.3	-22	-167.6	47.8	0	0	0	0	113.5	D105 V339	D105-T341 PolarHBondContact OD2-OG1 3.45Å; V339-T341 PolarHBondContact O-N 3.2Å; V339-T341 VanDerWaalsContact O-N 3.08Å
342	V	60.3	Low	59	Low	35 Å²	35	95.7 Å²	95.7	21%	0.212	51%	0.509	C	S	.	.			trans	-92.9	112.1	-172.2	-177.7	0	0	0	0	111.7	I102 W319 F340 I345	I102-V342 HydrophobicContact CD1-CB 4.44Å; I102-V342 HydrophobicContact CD1-CG1 3.92Å; I102-V342 HydrophobicContact CD1-CG2 4.34Å; I102-V342 HydrophobicContact CG1-CB 4.17Å; I102-V342 HydrophobicContact CG1-CG1 4.17Å; I102-V342 HydrophobicContact CG1-CG2 3.65Å; W319-V342 PolarHBondContact NE1-O 3.41Å; F340-V342 VanDerWaalsContact C-N 3.32Å; F340-V342 WeakPolarHBondContact CD1-O 3.4Å; F340-V342 HydrophobicContact CE1-CB 4.03Å; F340-V342 WeakPolarHBondContact CE1-O 3.35Å; F340-V342 HydrophobicContact CZ-CB 4.38Å; F340-V342 PolarHBondContact O-N 2.88Å; V342-I345 HydrophobicContact CG1-CG1 4.38Å
343	T	53.5	Low	57.7	Low	118 Å²	118	97.6 Å²	97.6	72%	0.724	51%	0.513	S	S	*	.			trans	-96.8	-20.5	-173.9	51.1	0	0	0	0	114.5
344	N	52.4	Low	56.4	Low	134 Å²	134	97.7 Å²	97.7	72%	0.717	52%	0.515	S	S	*	.			trans	-156.8	128.2	177.3	-93.8	-48.9	0	0	0	112.7
345	I	56.9	Low	55.3	Low	17 Å²	17	102 Å²	102	9%	0.087	52%	0.517	C	S	.	.			trans	-96.8	106	172.2	-57.8	167.5	0	0	0	107.3	L95 I102 L310 L322 V342 T347	L95-I345 HydrophobicContact CD1-CG2 3.82Å; I102-I345 HydrophobicContact CD1-CD1 4.23Å; I102-I345 HydrophobicContact CD1-CG1 4.26Å; L310-I345 HydrophobicContact CD1-CD1 4.03Å; L310-I345 HydrophobicContact CD1-CG2 4.25Å; L310-I345 HydrophobicContact CD2-CB 4.06Å; L310-I345 HydrophobicContact CD2-CD1 3.69Å; L310-I345 HydrophobicContact CD2-CG1 4.47Å; L310-I345 HydrophobicContact CD2-CG2 3.67Å; L310-I345 HydrophobicContact CG-CD1 4.45Å; L322-I345 HydrophobicContact CD1-CD1 4Å; V342-I345 HydrophobicContact CG1-CG1 4.38Å; I345-T347 HydrophobicContact CG2-CG2 4.36Å; I345-T347 PolarHBondContact O-N 2.82Å
346	K	52.8	Low	54.3	Low	174 Å²	174	100.3 Å²	100.3	76%	0.757	51%	0.51	S	S	*	.			trans	-79.7	109.2	179.2	-72.9	-179.5	179	177.2	0	109.4
347	T	55.8	Low	54	Low	30 Å²	30	102.8 Å²	102.8	18%	0.184	51%	0.514	C	S	.	.			trans	-113.5	143.4	160.7	82.5	0	0	0	0	110.4	L95 H315 I345 Q349	L95-T347 HydrophobicContact CD1-CG2 3.98Å; L95-T347 HydrophobicContact CD2-CG2 4.02Å; H315-T347 WeakPolarHBondContact CE1-CG2 3.42Å; H315-T347 PolarHBondContact CE1-OG1 3.06Å; H315-T347 PolarHBondContact NE2-OG1 3.18Å; I345-T347 HydrophobicContact CG2-CG2 4.36Å; I345-T347 PolarHBondContact O-N 2.82Å; T347-Q349 PolarHBondContact O-N 3.18Å
348	P	47.9	Very low	54	Low	44 Å²	44	99.5 Å²	99.5	29%	0.286	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-73.7	121.7	171.3	30.4	-33.7	0	0	0	109.5	A88 A91 T350	A88-P348 HydrophobicContact CB-CB 3.62Å; A88-P348 HydrophobicContact CB-CG 3.72Å; A91-P348 HydrophobicContact CB-CG 4.26Å; P348-T350 PolarHBondContact O-N 3.02Å
349	Q	50.3	Low	53.7	Low	164 Å²	164	99.5 Å²	99.5	77%	0.766	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-60.5	120.8	166.7	-79.2	175.4	-22.8	0	0	109.4	T347	T347-Q349 PolarHBondContact O-N 3.18Å
350	T	52.4	Low	53.2	Low	77 Å²	77	94.7 Å²	94.7	47%	0.472	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-82.7	129.6	174.7	18.4	0	0	0	0	110.5	P348 E352 D353	P348-T350 PolarHBondContact O-N 3.02Å; T350-E352 PolarHBondContact O-N 2.83Å; T350-D353 PolarHBondContact O-N 3.26Å; T350-D353 VanDerWaalsContact O-N 3.09Å; T350-D353 PolarHBondContact OG1-OD2 2.96Å
351	Q	44.3	Very low	52.8	Low	110 Å²	110	99.1 Å²	99.1	51%	0.514	50%	0.504	S	S	.	.	H	α-helix	trans	-53.8	-21.7	178.4	-89.2	-170.5	-38.1	0	0	114.5	F355	Q351-F355 WeakPolarHBondContact O-CD2 3.47Å
352	E	50	Low	52.8	Low	159 Å²	159	100 Å²	100	74%	0.743	51%	0.509	S	S	*	.	H	α-helix	trans	-72.4	-29.6	-179.9	-69.3	179.3	178.1	0	0	112.7	T350 I356	T350-E352 PolarHBondContact O-N 2.83Å; E352-I356 WeakPolarHBondContact O-CG1 3.36Å
353	D	49.8	Very low	52.9	Low	85 Å²	85	100 Å²	100	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-75.3	-36.4	-179.9	-61.1	-52	0	0	0	111.6	T350 I356 E357	T350-D353 PolarHBondContact O-N 3.26Å; T350-D353 VanDerWaalsContact O-N 3.09Å; T350-D353 PolarHBondContact OG1-OD2 2.96Å; D353-I356 PolarHBondContact O-N 3.18Å; D353-E357 PolarHBondContact O-N 2.7Å
354	E	51.7	Low	54	Low	110 Å²	110	98.4 Å²	98.4	51%	0.514	51%	0.506	S	S	.	.	H	α-helix	trans	-65.5	-38.9	177.8	-134.1	178.5	-178.4	0	0	112	I356 E357 I358	E354-I356 PolarHBondContact O-N 3.15Å; E354-E357 PolarHBondContact O-N 3.12Å; E354-I358 WeakPolarHBondContact O-CD1 3.49Å; E354-I358 VanDerWaalsContact O-CG1 3.27Å; E354-I358 WeakPolarHBondContact O-CG1 3.41Å; E354-I358 PolarHBondContact O-N 3.17Å
355	F	50.2	Low	55.2	Low	150 Å²	150	95.4 Å²	95.4	66%	0.658	50%	0.5	S	S	*	.	H	α-helix	trans	-68.1	-34.5	179	-99.7	-88.9	0	0	0	113.1	Q351 Q359	Q351-F355 WeakPolarHBondContact O-CD2 3.47Å; F355-Q359 PolarHBondContact O-N 2.98Å
356	I	53.1	Low	56.2	Low	69 Å²	69	101.6 Å²	101.6	35%	0.354	53%	0.526	S	S	.	.	H	α-helix	trans	-71.3	-36.5	177.7	-64.8	169.5	0	0	0	110.5	E352 D353 E354 S360	E352-I356 WeakPolarHBondContact O-CG1 3.36Å; D353-I356 PolarHBondContact O-N 3.18Å; E354-I356 PolarHBondContact O-N 3.15Å; I356-S360 WeakPolarHBondContact O-CB 3.31Å; I356-S360 PolarHBondContact O-N 3.01Å
357	E	56.6	Low	57.3	Low	135 Å²	135	98.5 Å²	98.5	63%	0.631	51%	0.514	S	S	*	.	H	α-helix	trans	-60.8	-49	175.7	-120.3	176.1	177.6	0	0	111.3	D353 E354 Q359 S360	D353-E357 PolarHBondContact O-N 2.7Å; E354-E357 PolarHBondContact O-N 3.12Å; E357-Q359 PolarHBondContact O-N 3.07Å; E357-S360 PolarHBondContact O-N 3.26Å; E357-S360 VanDerWaalsContact O-N 3.16Å; E357-S360 PolarHBondContact O-OG 2.85Å
358	I	52.5	Low	58.3	Low	109 Å²	109	101.5 Å²	101.5	56%	0.559	52%	0.522	S	S	*	.	H	α-helix	trans	-65.2	-37.9	-177.8	-63.3	163.2	0	0	0	112.4	E354 S360 T362	E354-I358 WeakPolarHBondContact O-CD1 3.49Å; E354-I358 VanDerWaalsContact O-CG1 3.27Å; E354-I358 WeakPolarHBondContact O-CG1 3.41Å; E354-I358 PolarHBondContact O-N 3.17Å; I358-S360 VanDerWaalsContact C-N 3.29Å; I358-S360 PolarHBondContact O-N 3.05Å; I358-T362 PolarHBondContact O-OG1 3.43Å
359	Q	52.2	Low	59.8	Low	136 Å²	136	106.6 Å²	106.6	64%	0.636	54%	0.536	S	S	*	.	H	α-helix	trans	-74.6	-21.5	178.4	-136.3	178.2	8.4	0	0	112.6	F355 E357	F355-Q359 PolarHBondContact O-N 2.98Å; E357-Q359 PolarHBondContact O-N 3.07Å
360	S	51.9	Low	61.2	Low	16 Å²	16	101.1 Å²	101.1	11%	0.112	51%	0.514	C	S	.	.	H	α-helix	trans	-81.3	-14.3	-179.4	90	0	0	0	0	114.1	I356 E357 I358 R368 R372	I356-S360 WeakPolarHBondContact O-CB 3.31Å; I356-S360 PolarHBondContact O-N 3.01Å; E357-S360 PolarHBondContact O-N 3.26Å; E357-S360 VanDerWaalsContact O-N 3.16Å; E357-S360 PolarHBondContact O-OG 2.85Å; I358-S360 VanDerWaalsContact C-N 3.29Å; I358-S360 PolarHBondContact O-N 3.05Å; S360-R368 WeakPolarHBondContact O-CD 3.47Å; S360-R368 VanDerWaalsContact O-CG 3.28Å; S360-R368 WeakPolarHBondContact O-CG 3.48Å; S360-R372 PolarHBondContact OG-NH2 3.47Å; S360-R372 VanDerWaalsContact OG-NH2 3.17Å
361	D	56.2	Low	62.5	Low	116 Å²	116	100.5 Å²	100.5	62%	0.62	51%	0.51	S	S	*	.	H	α-helix	trans	-95.4	-15.7	179.5	-83.8	-19.9	0	0	0	114
362	T	57.2	Low	64.1	Low	112 Å²	112	101.2 Å²	101.2	69%	0.687	51%	0.508	S	S	*	.	S	Bend	trans	-106.9	85.4	-176.3	41.1	0	0	0	0	111.4	I358	I358-T362 PolarHBondContact O-OG1 3.43Å
363	G	63.8	Low	65.6	Low	34 Å²	34	98.6 Å²	98.6	35%	0.351	49%	0.494	S	S	.	.	S	Bend	trans	167.8	170.3	172.6	0	0	0	0	0	116	R368	G363-R368 PolarHBondContact O-NE 3.13Å
364	T	76.3	Confident	67.1	Low	85 Å²	85	100.2 Å²	100.2	52%	0.521	50%	0.501	S	S	.	.			trans	-62.7	153.8	172.7	55.9	0	0	0	0	111.3	F366 Q367 R368	T364-F366 PolarHBondContact O-N 3.25Å; T364-F366 VanDerWaalsContact O-N 3.16Å; T364-Q367 PolarHBondContact O-N 3.43Å; T364-Q367 VanDerWaalsContact OG1-CD 3.29Å; T364-Q367 WeakPolarHBondContact OG1-CG 3.4Å; T364-Q367 PolarHBondContact OG1-OE1 3.16Å; T364-R368 PolarHBondContact O-N 3.41Å
365	A	76.6	Confident	68.5	Low	71 Å²	71	96.5 Å²	96.5	59%	0.587	49%	0.485	S	S	*	.	H	α-helix	trans	-55.3	-36.8	-176.1	0	0	0	0	0	113.4	W369	A365-W369 PolarHBondContact O-N 3.46Å
366	F	78.6	Confident	69.9	Low	147 Å²	147	92.2 Å²	92.2	65%	0.645	47%	0.468	S	S	*	.	H	α-helix	trans	-68.6	-44.5	175.5	-177	-101.6	0	0	0	112.4	T364 R368 W369 T370	T364-F366 PolarHBondContact O-N 3.25Å; T364-F366 VanDerWaalsContact O-N 3.16Å; F366-R368 VanDerWaalsContact C-N 3.34Å; F366-R368 PolarHBondContact O-N 2.91Å; F366-W369 HydrophobicContact CE2-CE3 4.48Å; F366-W369 PolarHBondContact O-N 3.36Å; F366-T370 WeakPolarHBondContact O-CB 3.41Å; F366-T370 PolarHBondContact O-N 2.89Å; F366-T370 PolarHBondContact O-OG1 3.47Å
367	Q	76	Confident	71.4	Confident	109 Å²	109	94.1 Å²	94.1	51%	0.509	48%	0.479	S	S	.	.	H	α-helix	trans	-61.4	-42	175.6	-77.2	169.7	-34.6	0	0	111.6	T364 W369 T370 V371	T364-Q367 PolarHBondContact O-N 3.43Å; T364-Q367 VanDerWaalsContact OG1-CD 3.29Å; T364-Q367 WeakPolarHBondContact OG1-CG 3.4Å; T364-Q367 PolarHBondContact OG1-OE1 3.16Å; Q367-W369 PolarHBondContact O-N 3Å; Q367-T370 PolarHBondContact O-N 3.36Å; Q367-V371 WeakPolarHBondContact O-CB 3.36Å; Q367-V371 VanDerWaalsContact O-CG2 3.23Å; Q367-V371 WeakPolarHBondContact O-CG2 3.31Å; Q367-V371 PolarHBondContact O-N 3.32Å
368	R	76.5	Confident	72.7	Confident	93 Å²	93	93.6 Å²	93.6	35%	0.351	48%	0.476	S	S	.	.	H	α-helix	trans	-61.4	-43.7	175.8	-70.5	-171.6	-77.8	170.2	-2.4	112.3	S360 G363 T364 F366 R372	S360-R368 WeakPolarHBondContact O-CD 3.47Å; S360-R368 VanDerWaalsContact O-CG 3.28Å; S360-R368 WeakPolarHBondContact O-CG 3.48Å; G363-R368 PolarHBondContact O-NE 3.13Å; T364-R368 PolarHBondContact O-N 3.41Å; F366-R368 VanDerWaalsContact C-N 3.34Å; F366-R368 PolarHBondContact O-N 2.91Å; R368-R372 VanDerWaalsContact O-CB 3.32Å; R368-R372 WeakPolarHBondContact O-CB 3.44Å; R368-R372 VanDerWaalsContact O-CG 3.23Å; R368-R372 WeakPolarHBondContact O-CG 3.28Å; R368-R372 PolarHBondContact O-N 3.15Å
369	W	78.9	Confident	74	Confident	151 Å²	151	91.2 Å²	91.2	57%	0.572	46%	0.462	S	S	*	.	H	α-helix	trans	-63	-47	175.9	179.2	88.1	0	0	0	111.8	A365 F366 Q367 R372 K373	A365-W369 PolarHBondContact O-N 3.46Å; F366-W369 HydrophobicContact CE2-CE3 4.48Å; F366-W369 PolarHBondContact O-N 3.36Å; Q367-W369 PolarHBondContact O-N 3Å; W369-R372 PolarHBondContact O-N 3.13Å; W369-K373 HydrophobicContact CD2-CG 4.24Å; W369-K373 HydrophobicContact CZ2-CG 4.09Å; W369-K373 WeakPolarHBondContact O-CG 3.45Å; W369-K373 PolarHBondContact O-N 3.34Å
370	T	79.7	Confident	75.6	Confident	50 Å²	50	85.3 Å²	85.3	31%	0.307	44%	0.436	S	S	.	.	H	α-helix	trans	-63.3	-47.4	-179.7	-59.2	0	0	0	0	111.5	F366 Q367 R372 K373 M374	F366-T370 WeakPolarHBondContact O-CB 3.41Å; F366-T370 PolarHBondContact O-N 2.89Å; F366-T370 PolarHBondContact O-OG1 3.47Å; Q367-T370 PolarHBondContact O-N 3.36Å; T370-R372 PolarHBondContact O-N 3.11Å; T370-K373 PolarHBondContact O-N 3.21Å; T370-M374 WeakPolarHBondContact O-CB 3.36Å; T370-M374 PolarHBondContact O-N 2.9Å
371	V	80	Confident	77.2	Confident	64 Å²	64	89.3 Å²	89.3	39%	0.388	45%	0.454	S	S	.	.	H	α-helix	trans	-60.2	-47.5	177.3	172	0	0	0	0	110.2	Q367 K373 M374 T375	Q367-V371 WeakPolarHBondContact O-CB 3.36Å; Q367-V371 VanDerWaalsContact O-CG2 3.23Å; Q367-V371 WeakPolarHBondContact O-CG2 3.31Å; Q367-V371 PolarHBondContact O-N 3.32Å; V371-K373 VanDerWaalsContact C-N 3.34Å; V371-K373 PolarHBondContact O-N 2.9Å; V371-M374 PolarHBondContact O-N 2.85Å; V371-T375 HydrophobicContact CG1-CG2 4.18Å; V371-T375 WeakPolarHBondContact O-CB 3.07Å; V371-T375 WeakPolarHBondContact O-CG2 3.4Å; V371-T375 PolarHBondContact O-N 3.16Å; V371-T375 PolarHBondContact O-OG1 3.16Å
372	R	78.5	Confident	78.6	Confident	124 Å²	124	86.4 Å²	86.4	47%	0.468	45%	0.446	S	S	.	.	H	α-helix	trans	-60.4	-39.4	177.8	-75.7	176.3	178.7	179.3	1.5	113.2	S360 R368 W369 T370 T375 M376	S360-R372 PolarHBondContact OG-NH2 3.47Å; S360-R372 VanDerWaalsContact OG-NH2 3.17Å; R368-R372 VanDerWaalsContact O-CB 3.32Å; R368-R372 WeakPolarHBondContact O-CB 3.44Å; R368-R372 VanDerWaalsContact O-CG 3.23Å; R368-R372 WeakPolarHBondContact O-CG 3.28Å; R368-R372 PolarHBondContact O-N 3.15Å; W369-R372 PolarHBondContact O-N 3.13Å; T370-R372 PolarHBondContact O-N 3.11Å; R372-T375 WeakPolarHBondContact CA-OG1 3.31Å; R372-T375 PolarHBondContact O-OG1 3.41Å; R372-T375 VanDerWaalsContact O-OG1 3.11Å; R372-M376 WeakPolarHBondContact O-CB 3.27Å; R372-M376 WeakPolarHBondContact O-CG 3.21Å; R372-M376 PolarHBondContact O-N 3.28Å; R372-M376 VanDerWaalsContact O-N 3.08Å
373	K	81.2	Confident	79.9	Confident	104 Å²	104	81.8 Å²	81.8	45%	0.452	42%	0.417	S	S	.	.	H	α-helix	trans	-72.4	-40.6	177.7	-70.8	-62.3	-177.6	-175.4	0	112.1	W369 T370 V371 L377	W369-K373 HydrophobicContact CD2-CG 4.24Å; W369-K373 HydrophobicContact CZ2-CG 4.09Å; W369-K373 WeakPolarHBondContact O-CG 3.45Å; W369-K373 PolarHBondContact O-N 3.34Å; T370-K373 PolarHBondContact O-N 3.21Å; V371-K373 VanDerWaalsContact C-N 3.34Å; V371-K373 PolarHBondContact O-N 2.9Å; K373-L377 WeakPolarHBondContact O-CB 3.48Å; K373-L377 PolarHBondContact O-N 3.06Å
374	M	81.4	Confident	81	Confident	120 Å²	120	82.5 Å²	82.5	59%	0.591	42%	0.415	S	S	*	.	H	α-helix	trans	-64.8	-44.7	175.7	-113	-169.5	157.8	0	0	111.9	T370 V371 L377 Q378	T370-M374 WeakPolarHBondContact O-CB 3.36Å; T370-M374 PolarHBondContact O-N 2.9Å; V371-M374 PolarHBondContact O-N 2.85Å; M374-L377 PolarHBondContact O-N 3.3Å; M374-Q378 WeakPolarHBondContact O-CB 3.34Å; M374-Q378 VanDerWaalsContact O-CG 3.31Å; M374-Q378 WeakPolarHBondContact O-CG 3.48Å; M374-Q378 PolarHBondContact O-N 3.49Å
375	T	80.3	Confident	81.5	Confident	32 Å²	32	85.4 Å²	85.4	20%	0.196	42%	0.424	C	S	.	.	H	α-helix	trans	-65.4	-42.3	178.5	53.5	0	0	0	0	111.4	V371 R372 L377 Q378 Q379	V371-T375 HydrophobicContact CG1-CG2 4.18Å; V371-T375 WeakPolarHBondContact O-CB 3.07Å; V371-T375 WeakPolarHBondContact O-CG2 3.4Å; V371-T375 PolarHBondContact O-N 3.16Å; V371-T375 PolarHBondContact O-OG1 3.16Å; R372-T375 WeakPolarHBondContact CA-OG1 3.31Å; R372-T375 PolarHBondContact O-OG1 3.41Å; R372-T375 VanDerWaalsContact O-OG1 3.11Å; T375-L377 VanDerWaalsContact C-N 3.35Å; T375-L377 PolarHBondContact O-N 3.07Å; T375-Q378 PolarHBondContact O-N 3.09Å; T375-Q379 WeakPolarHBondContact O-CB 3.27Å; T375-Q379 VanDerWaalsContact O-CG 3.24Å; T375-Q379 WeakPolarHBondContact O-CG 3.16Å; T375-Q379 PolarHBondContact O-N 3.12Å
376	M	81.3	Confident	81.9	Confident	59 Å²	59	83.4 Å²	83.4	29%	0.291	41%	0.406	S	S	.	.	H	α-helix	trans	-59.7	-44.6	172.9	-79.4	-154.3	-172.2	0	0	112.1	M176 R372 Q378 Q379 V380	M176-M376 HydrophobicContact CG-CE 4.22Å; M176-M376 HydrophobicContact CG-SD 3.93Å; M176-M376 HydrophobicContact SD-SD 4.41Å; R372-M376 WeakPolarHBondContact O-CB 3.27Å; R372-M376 WeakPolarHBondContact O-CG 3.21Å; R372-M376 PolarHBondContact O-N 3.28Å; R372-M376 VanDerWaalsContact O-N 3.08Å; M376-Q378 PolarHBondContact O-N 3.02Å; M376-Q379 PolarHBondContact O-N 3.38Å; M376-V380 WeakPolarHBondContact O-CG2 3.41Å; M376-V380 PolarHBondContact O-N 3.26Å
377	L	84.4	Confident	82.2	Confident	110 Å²	110	77.4 Å²	77.4	58%	0.576	38%	0.38	S	S	*	.	H	α-helix	trans	-62.3	-44.3	177.7	-174.1	70.5	0	0	0	111.4	K373 M374 T375 Q379 V380 M381	K373-L377 WeakPolarHBondContact O-CB 3.48Å; K373-L377 PolarHBondContact O-N 3.06Å; M374-L377 PolarHBondContact O-N 3.3Å; T375-L377 VanDerWaalsContact C-N 3.35Å; T375-L377 PolarHBondContact O-N 3.07Å; L377-Q379 VanDerWaalsContact C-N 3.31Å; L377-Q379 PolarHBondContact O-N 3.36Å; L377-V380 PolarHBondContact O-N 2.95Å; L377-M381 WeakPolarHBondContact O-CG 3.28Å; L377-M381 PolarHBondContact O-N 3.01Å
378	Q	84	Confident	82.6	Confident	123 Å²	123	76.4 Å²	76.4	58%	0.575	39%	0.385	S	S	*	.	H	α-helix	trans	-59.9	-41.7	175.8	-75.7	175.2	-15.6	0	0	111.6	M374 T375 M376 M381 A382	M374-Q378 WeakPolarHBondContact O-CB 3.34Å; M374-Q378 VanDerWaalsContact O-CG 3.31Å; M374-Q378 WeakPolarHBondContact O-CG 3.48Å; M374-Q378 PolarHBondContact O-N 3.49Å; T375-Q378 PolarHBondContact O-N 3.09Å; M376-Q378 PolarHBondContact O-N 3.02Å; Q378-M381 PolarHBondContact O-N 2.69Å; Q378-A382 WeakPolarHBondContact O-CB 3.37Å; Q378-A382 PolarHBondContact O-N 3.27Å
379	Q	80	Confident	83	Confident	59 Å²	59	73.5 Å²	73.5	28%	0.276	38%	0.381	S	S	.	.	H	α-helix	trans	-65.9	-40.8	176.6	-73.8	175.7	-8	0	0	112.6	K175 T375 M376 L377 A382 N383	K175-Q379 HydrophobicContact CD-CB 4.32Å; T375-Q379 WeakPolarHBondContact O-CB 3.27Å; T375-Q379 VanDerWaalsContact O-CG 3.24Å; T375-Q379 WeakPolarHBondContact O-CG 3.16Å; T375-Q379 PolarHBondContact O-N 3.12Å; M376-Q379 PolarHBondContact O-N 3.38Å; L377-Q379 VanDerWaalsContact C-N 3.31Å; L377-Q379 PolarHBondContact O-N 3.36Å; Q379-A382 PolarHBondContact O-N 3.31Å; Q379-N383 PolarHBondContact O-N 3.39Å
380	V	85.6	Confident	83.2	Confident	13 Å²	13	71.4 Å²	71.4	8%	0.079	39%	0.387	C	S	.	.	H	α-helix	trans	-63.5	-45.3	174.8	174.1	0	0	0	0	110.3	K175 M376 L377 A382 N383 V384	K175-V380 HydrophobicContact CG-CG2 4.32Å; M376-V380 WeakPolarHBondContact O-CG2 3.41Å; M376-V380 PolarHBondContact O-N 3.26Å; L377-V380 PolarHBondContact O-N 2.95Å; V380-A382 VanDerWaalsContact C-N 3.31Å; V380-A382 PolarHBondContact O-N 2.7Å; V380-N383 WeakPolarHBondContact O-CB 3.07Å; V380-N383 PolarHBondContact O-N 3.49Å; V380-V384 WeakPolarHBondContact O-CG2 3.46Å; V380-V384 PolarHBondContact O-N 3.47Å
381	M	85.8	Confident	83.3	Confident	99 Å²	99	77 Å²	77	49%	0.488	41%	0.41	S	S	.	.	H	α-helix	trans	-63.3	-36.9	176	-68	-60.8	102.1	0	0	112.2	L377 Q378 V384 M385	L377-M381 WeakPolarHBondContact O-CG 3.28Å; L377-M381 PolarHBondContact O-N 3.01Å; Q378-M381 PolarHBondContact O-N 2.69Å; M381-V384 HydrophobicContact CE-CG2 4.31Å; M381-V384 PolarHBondContact O-N 3.49Å; M381-M385 WeakPolarHBondContact O-CG 3.46Å; M381-M385 PolarHBondContact O-N 3.45Å
382	A	84.8	Confident	83.4	Confident	56 Å²	56	75.3 Å²	75.3	46%	0.463	40%	0.398	S	S	.	.	H	α-helix	trans	-63.3	-41.4	173.7	0	0	0	0	0	111.7	Q378 Q379 V380 M385 S386	Q378-A382 WeakPolarHBondContact O-CB 3.37Å; Q378-A382 PolarHBondContact O-N 3.27Å; Q379-A382 PolarHBondContact O-N 3.31Å; V380-A382 VanDerWaalsContact C-N 3.31Å; V380-A382 PolarHBondContact O-N 2.7Å; A382-M385 PolarHBondContact O-N 3.45Å; A382-S386 VanDerWaalsContact O-CB 3.28Å; A382-S386 WeakPolarHBondContact O-CB 3.43Å; A382-S386 PolarHBondContact O-N 3.08Å
383	N	85.4	Confident	83.8	Confident	15 Å²	15	77.2 Å²	77.2	8%	0.08	41%	0.405	C	S	.	.	H	α-helix	trans	-59	-48	173	-86.1	6.7	0	0	0	111.2	Q379 V380 M385 S386 L387 S627 T631	Q379-N383 PolarHBondContact O-N 3.39Å; V380-N383 WeakPolarHBondContact O-CB 3.07Å; V380-N383 PolarHBondContact O-N 3.49Å; N383-M385 PolarHBondContact O-N 3.01Å; N383-S386 PolarHBondContact O-N 3.49Å; N383-S386 PolarHBondContact O-OG 2.93Å; N383-L387 PolarHBondContact O-N 2.54Å; N383-S627 PolarHBondContact ND2-O 3.06Å; N383-T631 HydrophobicContact CB-CG2 4.23Å
384	V	86.8	Confident	84.1	Confident	49 Å²	49	77 Å²	77	30%	0.297	41%	0.409	S	S	.	.	H	α-helix	trans	-56.9	-50	176.4	175.2	0	0	0	0	111.2	V380 M381 S386 L387 T631 I635	V380-V384 WeakPolarHBondContact O-CG2 3.46Å; V380-V384 PolarHBondContact O-N 3.47Å; M381-V384 HydrophobicContact CE-CG2 4.31Å; M381-V384 PolarHBondContact O-N 3.49Å; V384-S386 VanDerWaalsContact C-N 3.25Å; V384-S386 PolarHBondContact O-N 2.67Å; V384-L387 WeakPolarHBondContact O-CB 3.23Å; V384-L387 PolarHBondContact O-N 3.47Å; V384-T631 HydrophobicContact CB-CG2 4.5Å; V384-T631 HydrophobicContact CG2-CG2 3.57Å; V384-I635 HydrophobicContact CG1-CD1 4.09Å; V384-I635 HydrophobicContact CG2-CD1 4.24Å
385	M	86	Confident	84.4	Confident	146 Å²	146	73.8 Å²	73.8	72%	0.719	39%	0.393	S	S	*	.	H	α-helix	trans	-62.1	-35.9	179.1	-72.8	-62	-155.6	0	0	112.3	M381 A382 N383 L387 S388	M381-M385 WeakPolarHBondContact O-CG 3.46Å; M381-M385 PolarHBondContact O-N 3.45Å; A382-M385 PolarHBondContact O-N 3.45Å; N383-M385 PolarHBondContact O-N 3.01Å; M385-L387 PolarHBondContact O-N 3.23Å; M385-S388 WeakPolarHBondContact O-CB 2.98Å; M385-S388 PolarHBondContact O-N 3.04Å; M385-S388 VanDerWaalsContact O-N 3.12Å
386	S	84.6	Confident	84.9	Confident	28 Å²	28	72.8 Å²	72.8	20%	0.196	39%	0.388	C	S	.	.	H	α-helix	trans	-70.6	-16.2	-179.7	81.7	0	0	0	0	114	A382 N383 V384 S388 A389 K628	A382-S386 VanDerWaalsContact O-CB 3.28Å; A382-S386 WeakPolarHBondContact O-CB 3.43Å; A382-S386 PolarHBondContact O-N 3.08Å; N383-S386 PolarHBondContact O-N 3.49Å; N383-S386 PolarHBondContact O-OG 2.93Å; V384-S386 VanDerWaalsContact C-N 3.25Å; V384-S386 PolarHBondContact O-N 2.67Å; S386-S388 PolarHBondContact O-N 3.41Å; S386-A389 WeakPolarHBondContact O-CB 3.4Å; S386-A389 PolarHBondContact O-N 3.26Å; S386-K628 VanDerWaalsContact CB-NZ 3.28Å; S386-K628 WeakPolarHBondContact OG-CD 3.49Å; S386-K628 WeakPolarHBondContact OG-CE 3.01Å; S386-K628 PolarHBondContact OG-NZ 3.46Å
387	L	85.5	Confident	85.4	Confident	22 Å²	22	74.5 Å²	74.5	12%	0.115	40%	0.398	C	S	.	.	H	α-helix	trans	-69	-23.7	171.8	-64.7	169.3	0	0	0	111.8	N383 V384 M385 A389 Y624 K628 T631 A632 I635	N383-L387 PolarHBondContact O-N 2.54Å; V384-L387 WeakPolarHBondContact O-CB 3.23Å; V384-L387 PolarHBondContact O-N 3.47Å; M385-L387 PolarHBondContact O-N 3.23Å; L387-A389 PolarHBondContact O-N 2.94Å; L387-Y624 HydrophobicContact CD2-CD1 3.71Å; L387-Y624 HydrophobicContact CD2-CE1 3.74Å; L387-K628 HydrophobicContact CD2-CB 4.34Å; L387-T631 HydrophobicContact CD1-CG2 4.17Å; L387-A632 HydrophobicContact CD1-CB 4.06Å; L387-A632 HydrophobicContact CD2-CB 3.77Å; L387-I635 HydrophobicContact CD1-CD1 3.57Å
388	S	84.6	Confident	85.8	Confident	87 Å²	87	71.8 Å²	71.8	61%	0.608	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	6.2	173.6	-58.9	0	0	0	0	113.3	M385 S386	M385-S388 WeakPolarHBondContact O-CB 2.98Å; M385-S388 PolarHBondContact O-N 3.04Å; M385-S388 VanDerWaalsContact O-N 3.12Å; S386-S388 PolarHBondContact O-N 3.41Å
389	A	84.6	Confident	86.2	Confident	33 Å²	33	65.9 Å²	65.9	27%	0.273	35%	0.354	S	S	.	.	S	Bend	trans	-58.7	146.2	176.1	0	0	0	0	0	111.3	S386 L387 E391 L392 R393	S386-A389 WeakPolarHBondContact O-CB 3.4Å; S386-A389 PolarHBondContact O-N 3.26Å; L387-A389 PolarHBondContact O-N 2.94Å; A389-E391 PolarHBondContact O-N 3.4Å; A389-L392 PolarHBondContact O-N 2.58Å; A389-R393 WeakPolarHBondContact O-CB 3.48Å; A389-R393 PolarHBondContact O-N 3.28Å
390	P	82.1	Confident	86.9	Confident	107 Å²	107	65.1 Å²	65.1	70%	0.695	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-27.8	-174.4	20.3	-31.6	0	0	0	114
391	E	82.4	Confident	87.4	Confident	168 Å²	168	67.3 Å²	67.3	79%	0.785	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-36.8	177.9	-62	176.2	-175.2	0	0	112.9	A389	A389-E391 PolarHBondContact O-N 3.4Å
392	L	82.5	Confident	87.9	Confident	27 Å²	27	62.6 Å²	62.6	14%	0.141	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-21.6	-172.8	-67.2	170.1	0	0	0	113.2	A389 L394 Q395 G396	A389-L392 PolarHBondContact O-N 2.58Å; L392-L394 VanDerWaalsContact C-N 3.32Å; L392-L394 PolarHBondContact O-N 3.05Å; L392-Q395 PolarHBondContact O-N 2.92Å; L392-G396 PolarHBondContact O-N 3.45Å
393	R	85.9	Confident	88.4	Confident	164 Å²	164	60.1 Å²	60.1	62%	0.619	32%	0.319	S	S	*	.	H	α-helix	trans	-56.9	-38.9	-169.6	70	178.7	-176.2	160.3	3.8	114.4	A389 L397	A389-R393 WeakPolarHBondContact O-CB 3.48Å; A389-R393 PolarHBondContact O-N 3.28Å; R393-L397 VanDerWaalsContact O-CB 3.26Å; R393-L397 WeakPolarHBondContact O-CB 3.43Å; R393-L397 PolarHBondContact O-N 2.61Å
394	L	88.8	Confident	88.9	Confident	101 Å²	101	62.8 Å²	62.8	53%	0.529	33%	0.33	S	S	.	.	H	α-helix	trans	-75.5	-43.5	-176.2	-173.5	67.7	0	0	0	110.9	L392 L397 F398	L392-L394 VanDerWaalsContact C-N 3.32Å; L392-L394 PolarHBondContact O-N 3.05Å; L394-L397 PolarHBondContact O-N 3.19Å; L394-F398 HydrophobicContact CD1-CE1 4.04Å; L394-F398 HydrophobicContact CD1-CE2 4.3Å; L394-F398 HydrophobicContact CD1-CZ 3.78Å; L394-F398 HydrophobicContact CD2-CE2 4.3Å; L394-F398 HydrophobicContact CD2-CZ 4.37Å; L394-F398 HydrophobicContact CG-CE2 3.94Å; L394-F398 HydrophobicContact CG-CZ 3.94Å; L394-F398 WeakPolarHBondContact O-CG 3.25Å; L394-F398 PolarHBondContact O-N 3.09Å
395	Q	87.1	Confident	89.4	Confident	52 Å²	52	61.1 Å²	61.1	24%	0.243	32%	0.321	C	S	.	.	H	α-helix	trans	-66.3	-41.6	177.6	-60.8	175.5	-6	0	0	110.6	L392 F398 L399 L623 P681	L392-Q395 PolarHBondContact O-N 2.92Å; Q395-F398 PolarHBondContact O-N 3.47Å; Q395-L399 WeakPolarHBondContact O-CB 3.4Å; Q395-L399 PolarHBondContact O-N 3.33Å; Q395-L623 HydrophobicContact CB-CD1 4.42Å; Q395-L623 HydrophobicContact CB-CD2 4.1Å; Q395-P681 HydrophobicContact CG-CG 4.18Å
396	G	89.8	Confident	89.9	Confident	10 Å²	10	54.1 Å²	54.1	10%	0.103	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-42.6	173.7	0	0	0	0	0	112.7	L392 L399 V400 Y624	L392-G396 PolarHBondContact O-N 3.45Å; G396-L399 PolarHBondContact O-N 3.32Å; G396-V400 WeakPolarHBondContact O-CB 3.34Å; G396-V400 VanDerWaalsContact O-CG2 3.28Å; G396-V400 WeakPolarHBondContact O-CG2 3.21Å; G396-V400 PolarHBondContact O-N 3.27Å; G396-Y624 WeakPolarHBondContact CA-OH 3.49Å
397	L	91.8	Very high	90.4	Very high	96 Å²	96	52.8 Å²	52.8	50%	0.503	28%	0.277	S	S	.	.	H	α-helix	trans	-61.7	-46.3	176.1	-179.2	66.9	0	0	0	112	R393 L394 L399 V400 I401	R393-L397 VanDerWaalsContact O-CB 3.26Å; R393-L397 WeakPolarHBondContact O-CB 3.43Å; R393-L397 PolarHBondContact O-N 2.61Å; L394-L397 PolarHBondContact O-N 3.19Å; L397-L399 VanDerWaalsContact C-N 3.33Å; L397-L399 PolarHBondContact O-N 2.88Å; L397-V400 PolarHBondContact O-N 2.92Å; L397-I401 HydrophobicContact CD1-CD1 4.41Å; L397-I401 HydrophobicContact CG-CD1 4.13Å; L397-I401 WeakPolarHBondContact O-CG1 3.39Å; L397-I401 PolarHBondContact O-N 3.47Å
398	F	93.6	Very high	90.8	Very high	52 Å²	52	52.6 Å²	52.6	23%	0.228	28%	0.275	C	S	.	.	H	α-helix	trans	-60.5	-45.1	175.9	-68	-18.9	0	0	0	111.3	L394 Q395 V400 I401 V402 V676 K679 L680	L394-F398 HydrophobicContact CD1-CE1 4.04Å; L394-F398 HydrophobicContact CD1-CE2 4.3Å; L394-F398 HydrophobicContact CD1-CZ 3.78Å; L394-F398 HydrophobicContact CD2-CE2 4.3Å; L394-F398 HydrophobicContact CD2-CZ 4.37Å; L394-F398 HydrophobicContact CG-CE2 3.94Å; L394-F398 HydrophobicContact CG-CZ 3.94Å; L394-F398 WeakPolarHBondContact O-CG 3.25Å; L394-F398 PolarHBondContact O-N 3.09Å; Q395-F398 PolarHBondContact O-N 3.47Å; F398-V400 VanDerWaalsContact C-N 3.35Å; F398-V400 PolarHBondContact O-N 2.88Å; F398-I401 PolarHBondContact O-N 2.9Å; F398-V402 VanDerWaalsContact O-CG2 3.25Å; F398-V402 WeakPolarHBondContact O-CG2 3.39Å; F398-V402 PolarHBondContact O-N 3.44Å; F398-V676 HydrophobicContact CB-CG1 3.83Å; F398-V676 HydrophobicContact CD1-CG1 3.91Å; F398-V676 HydrophobicContact CG-CG1 4.02Å; F398-K679 HydrophobicContact CD2-CB 4.22Å; F398-K679 HydrophobicContact CE2-CB 4Å; F398-L680 HydrophobicContact CB-CD2 3.65Å; F398-L680 HydrophobicContact CB-CG 4.33Å
399	L	92.9	Very high	91.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.5	-40.6	179.2	-170.1	58.2	0	0	0	111.9	Q395 G396 L397 I401 V402 W403 L616 I619 L623 Y624 L636 L680	Q395-L399 WeakPolarHBondContact O-CB 3.4Å; Q395-L399 PolarHBondContact O-N 3.33Å; G396-L399 PolarHBondContact O-N 3.32Å; L397-L399 VanDerWaalsContact C-N 3.33Å; L397-L399 PolarHBondContact O-N 2.88Å; L399-I401 PolarHBondContact O-N 3.04Å; L399-V402 PolarHBondContact O-N 2.94Å; L399-W403 WeakPolarHBondContact O-CB 3.33Å; L399-W403 VanDerWaalsContact O-CD1 3.28Å; L399-W403 PolarHBondContact O-N 3.47Å; L399-L616 HydrophobicContact CD1-CD2 3.86Å; L399-I619 HydrophobicContact CD1-CG2 3.76Å; L399-L623 HydrophobicContact CD2-CD2 3.83Å; L399-Y624 HydrophobicContact CD2-CE2 3.94Å; L399-L636 HydrophobicContact CB-CD2 4.46Å; L399-L636 HydrophobicContact CD2-CD1 3.47Å; L399-L636 VanDerWaalsContact CD2-CD1 3.47Å; L399-L636 HydrophobicContact CD2-CD2 4.41Å; L399-L636 HydrophobicContact CG-CD1 3.91Å; L399-L636 HydrophobicContact CG-CD2 4.03Å; L399-L680 HydrophobicContact CB-CD2 4.44Å; L399-L680 HydrophobicContact CD1-CD1 4.3Å
400	V	95	Very high	91.8	Very high	43 Å²	43	47.7 Å²	47.7	26%	0.261	24%	0.237	S	C	.	.	H	α-helix	trans	-58.5	-45	173.4	163.3	0	0	0	0	111.7	G396 L397 F398 F404 L636 I639	G396-V400 WeakPolarHBondContact O-CB 3.34Å; G396-V400 VanDerWaalsContact O-CG2 3.28Å; G396-V400 WeakPolarHBondContact O-CG2 3.21Å; G396-V400 PolarHBondContact O-N 3.27Å; L397-V400 PolarHBondContact O-N 2.92Å; F398-V400 VanDerWaalsContact C-N 3.35Å; F398-V400 PolarHBondContact O-N 2.88Å; V400-F404 VanDerWaalsContact O-CB 3.31Å; V400-F404 WeakPolarHBondContact O-CB 3.46Å; V400-F404 PolarHBondContact O-N 3.06Å; V400-L636 HydrophobicContact CB-CD2 4.47Å; V400-L636 HydrophobicContact CG2-CD2 3.69Å; V400-I639 HydrophobicContact CB-CD1 4.39Å; V400-I639 HydrophobicContact CG1-CD1 3.83Å; V400-I639 HydrophobicContact CG1-CG2 4.46Å; V400-I639 HydrophobicContact CG2-CD1 3.77Å
401	I	95.5	Very high	92.2	Very high	59 Å²	59	43.8 Å²	43.8	30%	0.303	21%	0.209	S	C	.	.	H	α-helix	trans	-62.9	-46.1	178.1	-68.3	164.8	0	0	0	110.5	L397 F398 L399 F404 C405 V676	L397-I401 HydrophobicContact CD1-CD1 4.41Å; L397-I401 HydrophobicContact CG-CD1 4.13Å; L397-I401 WeakPolarHBondContact O-CG1 3.39Å; L397-I401 PolarHBondContact O-N 3.47Å; F398-I401 PolarHBondContact O-N 2.9Å; L399-I401 PolarHBondContact O-N 3.04Å; I401-F404 PolarHBondContact O-N 3.03Å; I401-C405 WeakPolarHBondContact O-CB 3.3Å; I401-C405 PolarHBondContact O-N 3.48Å; I401-C405 PolarHBondContact O-SG 3.36Å; I401-C405 VanDerWaalsContact O-SG 3.35Å; I401-V676 HydrophobicContact CB-CG1 4.36Å; I401-V676 HydrophobicContact CG2-CB 4.43Å; I401-V676 HydrophobicContact CG2-CG1 4.25Å; I401-V676 HydrophobicContact CG2-CG2 4.23Å
402	V	96	Very high	92.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.8	-45.9	-179.7	-178.8	0	0	0	0	110.9	F398 L399 C405 M406 I575 M579 L616 V676 A677 L680	F398-V402 VanDerWaalsContact O-CG2 3.25Å; F398-V402 WeakPolarHBondContact O-CG2 3.39Å; F398-V402 PolarHBondContact O-N 3.44Å; L399-V402 PolarHBondContact O-N 2.94Å; V402-C405 PolarHBondContact O-N 2.87Å; V402-M406 VanDerWaalsContact O-CB 3.25Å; V402-M406 WeakPolarHBondContact O-CB 3.39Å; V402-M406 PolarHBondContact O-N 3.31Å; V402-I575 HydrophobicContact CG1-CG2 4.02Å; V402-M579 HydrophobicContact CG1-CE 4.23Å; V402-M579 HydrophobicContact CG1-SD 3.69Å; V402-L616 HydrophobicContact CB-CD2 4.14Å; V402-L616 HydrophobicContact CG1-CD1 4.25Å; V402-L616 HydrophobicContact CG1-CD2 3.48Å; V402-L616 VanDerWaalsContact CG1-CD2 3.48Å; V402-L616 HydrophobicContact CG1-CG 4.29Å; V402-V676 HydrophobicContact CG2-CB 4.18Å; V402-V676 HydrophobicContact CG2-CG1 3.92Å; V402-A677 HydrophobicContact CG1-CB 4.06Å; V402-A677 HydrophobicContact CG2-CB 3.87Å; V402-L680 HydrophobicContact CG2-CD1 4.46Å
403	W	95.4	Very high	92.9	Very high	3 Å²	3	34.5 Å²	34.5	1%	0.011	17%	0.165	C	C	.	.	H	α-helix	trans	-58.7	-47.1	174.9	-93	87	0	0	0	112	L399 A407 W613 L616 E617 S620 F633 L636 C640	L399-W403 WeakPolarHBondContact O-CB 3.33Å; L399-W403 VanDerWaalsContact O-CD1 3.28Å; L399-W403 PolarHBondContact O-N 3.47Å; W403-A407 WeakPolarHBondContact O-CB 3.41Å; W403-A407 PolarHBondContact O-N 2.98Å; W403-W613 HydrophobicContact CE3-CH2 4.42Å; W403-W613 AromaticContact CE3-CZ3 3.74Å; W403-W613 HydrophobicContact CE3-CZ3 3.74Å; W403-W613 HydrophobicContact CH2-CZ3 4.21Å; W403-W613 HydrophobicContact CZ3-CE3 4.39Å; W403-W613 HydrophobicContact CZ3-CH2 4.43Å; W403-W613 AromaticContact CZ3-CZ3 3.56Å; W403-W613 HydrophobicContact CZ3-CZ3 3.56Å; W403-L616 HydrophobicContact CG-CD2 4.41Å; W403-L616 HydrophobicContact CZ2-CB 4.22Å; W403-E617 HydrophobicContact CH2-CG 4.35Å; W403-S620 PolarHBondContact NE1-OG 3.49Å; W403-F633 AromaticContact CH2-CE2 3.7Å; W403-F633 HydrophobicContact CH2-CE2 3.7Å; W403-F633 HydrophobicContact CH2-CZ 4.48Å; W403-F633 HydrophobicContact CZ2-CD2 4.36Å; W403-F633 AromaticContact CZ2-CE2 3.71Å; W403-F633 HydrophobicContact CZ2-CE2 3.71Å; W403-F633 HydrophobicContact CZ2-CZ 4.4Å; W403-L636 HydrophobicContact CD2-CB 4.13Å; W403-L636 HydrophobicContact CG-CB 4.27Å; W403-L636 HydrophobicContact CG-CD2 4.21Å; W403-C640 HydrophobicContact CE3-CB 3.65Å; W403-C640 HydrophobicContact CZ3-CB 3.75Å
404	F	96.6	Very high	92.9	Very high	71 Å²	71	27.5 Å²	27.5	31%	0.311	14%	0.144	S	C	.	.	H	α-helix	trans	-61.9	-49.9	178.5	-178.7	-87.1	0	0	0	111.6	V400 I401 M406 A407 F408 I639 F642 A643	V400-F404 VanDerWaalsContact O-CB 3.31Å; V400-F404 WeakPolarHBondContact O-CB 3.46Å; V400-F404 PolarHBondContact O-N 3.06Å; I401-F404 PolarHBondContact O-N 3.03Å; F404-M406 PolarHBondContact O-N 3.31Å; F404-A407 PolarHBondContact O-N 3.43Å; F404-F408 HydrophobicContact CE1-CB 4.41Å; F404-F408 HydrophobicContact CE1-CD2 4.47Å; F404-F408 HydrophobicContact CZ-CD2 4.42Å; F404-F408 WeakPolarHBondContact O-CB 3.48Å; F404-F408 PolarHBondContact O-N 3.36Å; F404-I639 HydrophobicContact CB-CG2 4.15Å; F404-I639 HydrophobicContact CD2-CG2 4.22Å; F404-F642 HydrophobicContact CE2-CD1 4.2Å; F404-F642 HydrophobicContact CE2-CE1 4.34Å; F404-A643 HydrophobicContact CD2-CB 3.59Å; F404-A643 HydrophobicContact CE2-CB 3.74Å; F404-A643 HydrophobicContact CG-CB 4.18Å; F404-A643 HydrophobicContact CZ-CB 4.45Å
405	C	96.7	Very high	92.6	Very high	14 Å²	14	25 Å²	25	10%	0.095	13%	0.133	C	C	.	.	H	α-helix	trans	-61.2	-43.3	179.7	-76.7	0	0	0	0	112.3	I401 V402 S409 M579 A669	I401-C405 WeakPolarHBondContact O-CB 3.3Å; I401-C405 PolarHBondContact O-N 3.48Å; I401-C405 PolarHBondContact O-SG 3.36Å; I401-C405 VanDerWaalsContact O-SG 3.35Å; V402-C405 PolarHBondContact O-N 2.87Å; C405-S409 PolarHBondContact O-N 3.34Å; C405-S409 PolarHBondContact O-OG 3.06Å; C405-M579 HydrophobicContact CB-CE 4.4Å; C405-A669 HydrophobicContact CB-CB 4.44Å; C405-A669 VanDerWaalsContact CB-O 3.27Å; C405-A669 WeakPolarHBondContact CB-O 3.32Å; C405-A669 PolarHBondContact SG-O 3.14Å
406	M	95.6	Very high	92.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-65.5	-48.9	177.8	-173.1	62.6	-173.6	0	0	111.3	V402 F404 F408 S409 Y410 M579 S609 A612 W613 L616 L670	V402-M406 VanDerWaalsContact O-CB 3.25Å; V402-M406 WeakPolarHBondContact O-CB 3.39Å; V402-M406 PolarHBondContact O-N 3.31Å; F404-M406 PolarHBondContact O-N 3.31Å; M406-F408 PolarHBondContact O-N 3.15Å; M406-S409 PolarHBondContact O-N 3.08Å; M406-Y410 HydrophobicContact CE-CD2 4.36Å; M406-Y410 WeakPolarHBondContact O-CB 3.31Å; M406-Y410 PolarHBondContact O-N 3.48Å; M406-M579 HydrophobicContact CB-CE 4.02Å; M406-M579 HydrophobicContact SD-CE 4.22Å; M406-M579 HydrophobicContact SD-CG 4.09Å; M406-S609 WeakPolarHBondContact CE-O 3.41Å; M406-A612 HydrophobicContact CE-CB 3.65Å; M406-A612 HydrophobicContact SD-CB 3.87Å; M406-W613 HydrophobicContact CB-CH2 4.48Å; M406-W613 HydrophobicContact CE-CD2 4.32Å; M406-W613 HydrophobicContact CE-CG 4.07Å; M406-W613 HydrophobicContact CG-CD2 4.08Å; M406-W613 HydrophobicContact CG-CE3 4.4Å; M406-W613 HydrophobicContact CG-CH2 4.12Å; M406-W613 HydrophobicContact CG-CZ2 3.8Å; M406-W613 HydrophobicContact CG-CZ3 4.4Å; M406-L616 HydrophobicContact CB-CD1 3.8Å; M406-L616 HydrophobicContact CG-CD1 3.82Å; M406-L670 HydrophobicContact SD-CD2 3.98Å
407	A	94.9	Very high	92.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.6	-44.7	179.1	0	0	0	0	0	112.3	W403 F404 S409 H411 W613 C640 A643	W403-A407 WeakPolarHBondContact O-CB 3.41Å; W403-A407 PolarHBondContact O-N 2.98Å; F404-A407 PolarHBondContact O-N 3.43Å; A407-S409 PolarHBondContact O-N 3.04Å; A407-H411 WeakPolarHBondContact O-CB 3.45Å; A407-H411 PolarHBondContact O-CD2 3.35Å; A407-H411 PolarHBondContact O-N 2.92Å; A407-W613 HydrophobicContact CB-CH2 3.9Å; A407-W613 HydrophobicContact CB-CZ2 4.41Å; A407-C640 HydrophobicContact CB-CB 4.23Å; A407-C640 VanDerWaalsContact CB-SG 3.6Å; A407-A643 HydrophobicContact CB-CB 3.68Å
408	F	95.7	Very high	91.9	Very high	17 Å²	17	20 Å²	20	8%	0.075	11%	0.108	C	C	.	.	H	α-helix	trans	-58.3	-48.6	179.2	-178.8	-93.5	0	0	0	111.3	F404 M406 G412 A643 V646 A647 I650 F651 L665 A669	F404-F408 HydrophobicContact CE1-CB 4.41Å; F404-F408 HydrophobicContact CE1-CD2 4.47Å; F404-F408 HydrophobicContact CZ-CD2 4.42Å; F404-F408 WeakPolarHBondContact O-CB 3.48Å; F404-F408 PolarHBondContact O-N 3.36Å; M406-F408 PolarHBondContact O-N 3.15Å; F408-G412 WeakPolarHBondContact O-CA 3.32Å; F408-G412 PolarHBondContact O-N 3.08Å; F408-A643 HydrophobicContact CB-CB 4.4Å; F408-V646 HydrophobicContact CE2-CG1 4.25Å; F408-A647 HydrophobicContact CD2-CB 3.64Å; F408-A647 HydrophobicContact CE2-CB 3.95Å; F408-A647 HydrophobicContact CG-CB 4.1Å; F408-A647 WeakPolarHBondContact O-CB 3.29Å; F408-I650 HydrophobicContact CE2-CD1 4.07Å; F408-I650 HydrophobicContact CZ-CD1 4.3Å; F408-F651 HydrophobicContact CD1-CE2 4.34Å; F408-F651 AromaticContact CE1-CE2 3.66Å; F408-F651 HydrophobicContact CE1-CE2 3.66Å; F408-F651 HydrophobicContact CE1-CZ 4.14Å; F408-F651 HydrophobicContact CE2-CE2 4.48Å; F408-F651 AromaticContact CZ-CE2 3.74Å; F408-F651 HydrophobicContact CZ-CE2 3.74Å; F408-L665 HydrophobicContact CE1-CB 4.28Å; F408-A669 HydrophobicContact CD1-CB 4.07Å
409	S	95.3	Very high	91.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-73.6	-44.6	-179.9	-63.3	0	0	0	0	112.9	C405 M406 A407 L413 A666 A669	C405-S409 PolarHBondContact O-N 3.34Å; C405-S409 PolarHBondContact O-OG 3.06Å; M406-S409 PolarHBondContact O-N 3.08Å; A407-S409 PolarHBondContact O-N 3.04Å; S409-L413 VanDerWaalsContact O-CB 3.24Å; S409-L413 WeakPolarHBondContact O-CB 3.39Å; S409-L413 WeakPolarHBondContact O-CG 3.44Å; S409-L413 PolarHBondContact O-N 3.39Å; S409-A666 WeakPolarHBondContact OG-CA 3.41Å; S409-A666 PolarHBondContact OG-O 3.18Å; S409-A669 WeakPolarHBondContact OG-CB 3.28Å
410	Y	93.2	Very high	90.9	Very high	18 Å²	18	21.3 Å²	21.3	7%	0.071	12%	0.117	C	C	.	.	H	α-helix	trans	-65.9	-50.8	-176.3	-176.7	-92.8	0	0	0	112.2	M406 G414 F605 Y606 W613	M406-Y410 HydrophobicContact CE-CD2 4.36Å; M406-Y410 WeakPolarHBondContact O-CB 3.31Å; M406-Y410 PolarHBondContact O-N 3.48Å; Y410-G414 PolarHBondContact O-N 2.98Å; Y410-F605 HydrophobicContact CD2-CE1 4.24Å; Y410-Y606 HydrophobicContact CD2-CD1 4.15Å; Y410-Y606 HydrophobicContact CD2-CE1 4.3Å; Y410-Y606 HydrophobicContact CE1-CE1 4.48Å; Y410-Y606 AromaticContact CE2-CD1 3.5Å; Y410-Y606 HydrophobicContact CE2-CD1 3.5Å; Y410-Y606 VanDerWaalsContact CE2-CD1 3.5Å; Y410-Y606 AromaticContact CE2-CE1 3.85Å; Y410-Y606 HydrophobicContact CE2-CE1 3.85Å; Y410-Y606 AromaticContact CZ-CD1 3.88Å; Y410-Y606 AromaticContact CZ-CE1 3.92Å; Y410-W613 HydrophobicContact CD1-CZ2 4.11Å; Y410-W613 AromaticContact CD1-NE1 3.42Å; Y410-W613 AromaticContact CD2-CD1 3.82Å; Y410-W613 AromaticContact CD2-NE1 3.19Å; Y410-W613 AromaticContact CE1-NE1 3.78Å; Y410-W613 AromaticContact CE2-CD1 3.79Å; Y410-W613 AromaticContact CE2-NE1 3.53Å; Y410-W613 AromaticContact CG-CE2 3.94Å; Y410-W613 HydrophobicContact CG-CZ2 4.14Å; Y410-W613 AromaticContact CG-NE1 3.13Å; Y410-W613 AromaticContact CZ-NE1 3.84Å
411	H	90.7	Very high	90.3	Very high	24 Å²	24	19.5 Å²	19.5	11%	0.111	11%	0.106	C	C	.	.	H	α-helix	trans	-76	-35.6	179.6	-67.1	-66.3	0	0	0	112.1	A407 G414 V415 A644	A407-H411 WeakPolarHBondContact O-CB 3.45Å; A407-H411 PolarHBondContact O-CD2 3.35Å; A407-H411 PolarHBondContact O-N 2.92Å; H411-G414 PolarHBondContact O-N 3.42Å; H411-V415 PolarHBondContact O-N 2.99Å; H411-A644 HydrophobicContact CB-CB 3.67Å
412	G	90.6	Very high	89.6	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.1	-51.9	175.7	0	0	0	0	0	112.5	F408 G414 V415 W416 F651	F408-G412 WeakPolarHBondContact O-CA 3.32Å; F408-G412 PolarHBondContact O-N 3.08Å; G412-G414 VanDerWaalsContact C-N 3.26Å; G412-G414 PolarHBondContact O-N 3.47Å; G412-V415 PolarHBondContact O-N 2.92Å; G412-W416 VanDerWaalsContact O-CB 3.29Å; G412-W416 WeakPolarHBondContact O-CB 3.25Å; G412-W416 PolarHBondContact O-N 2.93Å; G412-F651 VanDerWaalsContact C-CD1 3.45Å; G412-F651 WeakPolarHBondContact O-CD1 3.32Å
413	L	89.6	Confident	89.1	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.2	-32.8	174.1	-71.6	173	0	0	0	111.7	S409 V415 W416 F417 T586 F605 F651 A666	S409-L413 VanDerWaalsContact O-CB 3.24Å; S409-L413 WeakPolarHBondContact O-CB 3.39Å; S409-L413 WeakPolarHBondContact O-CG 3.44Å; S409-L413 PolarHBondContact O-N 3.39Å; L413-V415 VanDerWaalsContact C-N 3.34Å; L413-V415 PolarHBondContact O-N 3.4Å; L413-W416 HydrophobicContact CD2-CD2 4.44Å; L413-W416 HydrophobicContact CD2-CE3 3.75Å; L413-W416 HydrophobicContact CD2-CZ3 4.18Å; L413-W416 PolarHBondContact O-N 3.5Å; L413-F417 HydrophobicContact CB-CD2 4.16Å; L413-F417 HydrophobicContact CB-CE2 3.69Å; L413-F417 HydrophobicContact CB-CZ 4.19Å; L413-F417 HydrophobicContact CD2-CZ 4.46Å; L413-F417 WeakPolarHBondContact O-CD2 3.49Å; L413-F417 WeakPolarHBondContact O-CG 3.41Å; L413-F417 PolarHBondContact O-N 2.86Å; L413-T586 HydrophobicContact CD1-CG2 3.91Å; L413-F605 HydrophobicContact CB-CE1 4.24Å; L413-F605 HydrophobicContact CD1-CD1 4.48Å; L413-F605 HydrophobicContact CD1-CD2 4.34Å; L413-F605 HydrophobicContact CD1-CE1 4.02Å; L413-F605 HydrophobicContact CD1-CE2 3.86Å; L413-F605 HydrophobicContact CD1-CZ 3.68Å; L413-F651 HydrophobicContact CD2-CD1 4.41Å; L413-F651 HydrophobicContact CD2-CE1 3.84Å; L413-F651 HydrophobicContact CG-CE1 4.01Å; L413-A666 HydrophobicContact CD1-CB 3.73Å; L413-A666 HydrophobicContact CD2-CB 4.19Å; L413-A666 HydrophobicContact CG-CB 3.89Å
414	G	85.8	Confident	88.5	Confident	18 Å²	18	28.5 Å²	28.5	19%	0.186	14%	0.143	C	C	.	.	H	α-helix	trans	-65.5	-33.1	179.4	0	0	0	0	0	115.1	Y410 H411 G412 P418 Y606	Y410-G414 PolarHBondContact O-N 2.98Å; H411-G414 PolarHBondContact O-N 3.42Å; G412-G414 VanDerWaalsContact C-N 3.26Å; G412-G414 PolarHBondContact O-N 3.47Å; G414-P418 WeakPolarHBondContact O-CD 3.13Å; G414-Y606 WeakPolarHBondContact CA-OH 3.38Å
415	V	83.6	Confident	87.8	Confident	48 Å²	48	27.5 Å²	27.5	29%	0.291	14%	0.139	S	C	.	.	H	α-helix	trans	-77.3	-38.3	169.1	175.2	0	0	0	0	111.1	H411 G412 L413 P418	H411-V415 PolarHBondContact O-N 2.99Å; G412-V415 PolarHBondContact O-N 2.92Å; L413-V415 VanDerWaalsContact C-N 3.34Å; L413-V415 PolarHBondContact O-N 3.4Å; V415-P418 WeakPolarHBondContact O-CD 3.39Å
416	W	88.1	Confident	87.1	Confident	6 Å²	6	32 Å²	32	2%	0.023	16%	0.155	C	C	.	.	H	α-helix	trans	-68.5	-36.8	-176.2	-176.8	77.6	0	0	0	114	G412 L413 M420 L589 F651 K659 I663	G412-W416 VanDerWaalsContact O-CB 3.29Å; G412-W416 WeakPolarHBondContact O-CB 3.25Å; G412-W416 PolarHBondContact O-N 2.93Å; L413-W416 HydrophobicContact CD2-CD2 4.44Å; L413-W416 HydrophobicContact CD2-CE3 3.75Å; L413-W416 HydrophobicContact CD2-CZ3 4.18Å; L413-W416 PolarHBondContact O-N 3.5Å; W416-M420 HydrophobicContact CD2-CB 4.38Å; W416-M420 HydrophobicContact CH2-CE 4.38Å; W416-M420 HydrophobicContact CH2-CG 4.36Å; W416-M420 HydrophobicContact CZ2-CE 3.41Å; W416-M420 VanDerWaalsContact CZ2-CE 3.41Å; W416-M420 HydrophobicContact CZ2-CG 4.18Å; W416-M420 WeakPolarHBondContact O-CB 3.44Å; W416-M420 PolarHBondContact O-N 3.49Å; W416-L589 HydrophobicContact CZ3-CD1 4.48Å; W416-F651 HydrophobicContact CB-CB 4.2Å; W416-F651 HydrophobicContact CB-CD1 3.89Å; W416-F651 HydrophobicContact CG-CD1 4.15Å; W416-K659 HydrophobicContact CH2-CB 4.48Å; W416-K659 HydrophobicContact CZ2-CB 3.94Å; W416-I663 HydrophobicContact CH2-CD1 3.85Å; W416-I663 HydrophobicContact CH2-CG1 3.78Å; W416-I663 HydrophobicContact CZ2-CD1 4.43Å; W416-I663 HydrophobicContact CZ2-CG1 4.27Å; W416-I663 HydrophobicContact CZ3-CG1 4.34Å
417	F	85.6	Confident	86.5	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.8	-53.6	-176.4	-71.3	-60.4	0	0	0	113.6	L413 D419 M420 I421 L589 V598 Q602 F605 Y606	L413-F417 HydrophobicContact CB-CD2 4.16Å; L413-F417 HydrophobicContact CB-CE2 3.69Å; L413-F417 HydrophobicContact CB-CZ 4.19Å; L413-F417 HydrophobicContact CD2-CZ 4.46Å; L413-F417 WeakPolarHBondContact O-CD2 3.49Å; L413-F417 WeakPolarHBondContact O-CG 3.41Å; L413-F417 PolarHBondContact O-N 2.86Å; F417-D419 VanDerWaalsContact C-N 3.33Å; F417-D419 PolarHBondContact O-N 3.46Å; F417-M420 PolarHBondContact O-N 2.88Å; F417-I421 VanDerWaalsContact O-CG1 3.31Å; F417-I421 WeakPolarHBondContact O-CG1 3.47Å; F417-I421 PolarHBondContact O-N 3.41Å; F417-L589 HydrophobicContact CE1-CD1 3.66Å; F417-L589 HydrophobicContact CE1-CD2 3.92Å; F417-L589 HydrophobicContact CE1-CG 4.48Å; F417-L589 HydrophobicContact CZ-CD1 3.79Å; F417-V598 HydrophobicContact CD1-CG1 4.07Å; F417-Q602 VanDerWaalsContact CB-CD 3.42Å; F417-Q602 HydrophobicContact CB-CG 4.13Å; F417-Q602 VanDerWaalsContact CB-NE2 3.28Å; F417-Q602 HydrophobicContact CD1-CB 3.9Å; F417-Q602 HydrophobicContact CD1-CG 4.18Å; F417-Q602 HydrophobicContact CD2-CB 4.01Å; F417-Q602 HydrophobicContact CD2-CG 3.49Å; F417-Q602 VanDerWaalsContact CD2-CG 3.49Å; F417-Q602 HydrophobicContact CE1-CB 3.89Å; F417-Q602 HydrophobicContact CE1-CG 4.44Å; F417-Q602 HydrophobicContact CE2-CB 3.99Å; F417-Q602 HydrophobicContact CE2-CG 3.78Å; F417-Q602 HydrophobicContact CG-CB 3.97Å; F417-Q602 HydrophobicContact CG-CG 3.71Å; F417-Q602 HydrophobicContact CZ-CB 3.93Å; F417-Q602 HydrophobicContact CZ-CG 4.26Å; F417-F605 AromaticContact CE2-CD1 3.96Å; F417-F605 HydrophobicContact CE2-CD1 3.96Å; F417-F605 HydrophobicContact CE2-CE1 4.49Å; F417-F605 HydrophobicContact CZ-CD1 4.42Å; F417-Y606 HydrophobicContact CD2-CE2 4.46Å
418	P	79.8	Confident	85.9	Confident	47 Å²	47	41.1 Å²	41.1	31%	0.305	20%	0.198	S	C	.	.	H	α-helix	trans	-61.7	-41.4	179.5	-22	34.7	0	0	0	112.3	G414 V415 I421 K422	G414-P418 WeakPolarHBondContact O-CD 3.13Å; V415-P418 WeakPolarHBondContact O-CD 3.39Å; P418-I421 PolarHBondContact O-N 3.4Å; P418-K422 WeakPolarHBondContact O-CB 3.32Å; P418-K422 PolarHBondContact O-N 2.91Å
419	D	81.2	Confident	85.2	Confident	67 Å²	67	43.5 Å²	43.5	36%	0.358	21%	0.207	S	C	.	.	H	α-helix	trans	-69.7	-35.8	-179.6	-71.7	-18.5	0	0	0	112.3	F417 K422 Y423 I655	F417-D419 VanDerWaalsContact C-N 3.33Å; F417-D419 PolarHBondContact O-N 3.46Å; D419-K422 PolarHBondContact O-N 2.91Å; D419-Y423 VanDerWaalsContact O-CB 3.29Å; D419-Y423 WeakPolarHBondContact O-CB 3.32Å; D419-Y423 PolarHBondContact O-N 3.11Å; D419-I655 HydrophobicContact CB-CD1 3.43Å; D419-I655 VanDerWaalsContact CB-CD1 3.43Å; D419-I655 HydrophobicContact CB-CG1 4.35Å
420	M	84.1	Confident	84.6	Confident	13 Å²	13	48.2 Å²	48.2	6%	0.064	23%	0.229	C	C	.	.	H	α-helix	trans	-67.7	-39.2	174.2	-179.3	57.1	75.2	0	0	111.7	W416 F417 Y423 M424 K659	W416-M420 HydrophobicContact CD2-CB 4.38Å; W416-M420 HydrophobicContact CH2-CE 4.38Å; W416-M420 HydrophobicContact CH2-CG 4.36Å; W416-M420 HydrophobicContact CZ2-CE 3.41Å; W416-M420 VanDerWaalsContact CZ2-CE 3.41Å; W416-M420 HydrophobicContact CZ2-CG 4.18Å; W416-M420 WeakPolarHBondContact O-CB 3.44Å; W416-M420 PolarHBondContact O-N 3.49Å; F417-M420 PolarHBondContact O-N 2.88Å; M420-Y423 PolarHBondContact O-N 3.07Å; M420-Y423 HydrophobicContact SD-CD1 4.39Å; M420-M424 HydrophobicContact CG-CE 3.55Å; M420-M424 PolarHBondContact O-N 2.77Å; M420-M424 HydrophobicContact SD-CE 4.09Å; M420-K659 HydrophobicContact CE-CB 3.96Å
421	I	83.3	Confident	84.1	Confident	5 Å²	5	51.9 Å²	51.9	3%	0.026	26%	0.257	C	S	.	.	H	α-helix	trans	-62.3	-47	172.5	-70.5	164.1	0	0	0	110	F417 P418 Y423 M424 Q425 Q595 V598 I599	F417-I421 VanDerWaalsContact O-CG1 3.31Å; F417-I421 WeakPolarHBondContact O-CG1 3.47Å; F417-I421 PolarHBondContact O-N 3.41Å; P418-I421 PolarHBondContact O-N 3.4Å; I421-Y423 VanDerWaalsContact C-N 3.28Å; I421-Y423 PolarHBondContact O-N 2.94Å; I421-M424 PolarHBondContact O-N 3.19Å; I421-Q425 WeakPolarHBondContact O-CG 3.42Å; I421-Q425 PolarHBondContact O-N 3.17Å; I421-Q595 HydrophobicContact CG2-CG 4.08Å; I421-V598 HydrophobicContact CG1-CG1 4.4Å; I421-I599 HydrophobicContact CD1-CD1 4.34Å; I421-I599 HydrophobicContact CD1-CG1 3.65Å; I421-I599 HydrophobicContact CG1-CG1 4.44Å
422	K	80.2	Confident	84	Confident	134 Å²	134	56.6 Å²	56.6	58%	0.583	28%	0.277	S	S	*	.	H	α-helix	trans	-60.3	-40.1	177	-174.1	176.9	-177.9	174.5	0	111.6	P418 D419 Q425 Y426	P418-K422 WeakPolarHBondContact O-CB 3.32Å; P418-K422 PolarHBondContact O-N 2.91Å; D419-K422 PolarHBondContact O-N 2.91Å; K422-Q425 PolarHBondContact O-N 3.1Å; K422-Y426 WeakPolarHBondContact O-CB 3.41Å; K422-Y426 PolarHBondContact O-N 3.3Å
423	Y	84.2	Confident	83.8	Confident	71 Å²	71	59 Å²	59	28%	0.278	29%	0.291	S	S	.	.	H	α-helix	trans	-63.6	-45.9	175.7	179.9	-94.2	0	0	0	111.9	D419 M420 I421 Q425 Y426 E427 I655	D419-Y423 VanDerWaalsContact O-CB 3.29Å; D419-Y423 WeakPolarHBondContact O-CB 3.32Å; D419-Y423 PolarHBondContact O-N 3.11Å; M420-Y423 PolarHBondContact O-N 3.07Å; M420-Y423 HydrophobicContact SD-CD1 4.39Å; I421-Y423 VanDerWaalsContact C-N 3.28Å; I421-Y423 PolarHBondContact O-N 2.94Å; Y423-Q425 VanDerWaalsContact C-N 3.33Å; Y423-Q425 PolarHBondContact O-N 2.96Å; Y423-Y426 WeakPolarHBondContact O-CB 3.36Å; Y423-Y426 PolarHBondContact O-N 2.85Å; Y423-Y426 VanDerWaalsContact O-N 3.14Å; Y423-E427 HydrophobicContact CD1-CG 4.34Å; Y423-E427 HydrophobicContact CE1-CG 3.73Å; Y423-E427 VanDerWaalsContact CE1-OE1 3.26Å; Y423-E427 WeakPolarHBondContact CE1-OE1 3.35Å; Y423-E427 WeakPolarHBondContact CE1-OE2 3.49Å; Y423-E427 HydrophobicContact CE2-CG 4.46Å; Y423-E427 VanDerWaalsContact CZ-OE1 3.27Å; Y423-E427 PolarHBondContact O-N 3.45Å; Y423-E427 PolarHBondContact OH-OE1 3.21Å; Y423-I655 HydrophobicContact CD2-CG2 4.29Å; Y423-I655 HydrophobicContact CG-CG2 4.25Å
424	M	83.3	Confident	83.8	Confident	45 Å²	45	67 Å²	67	22%	0.222	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-40	175.5	-74.9	-174	-114.1	0	0	112.6	M420 I421 Y426 E427 E428 V598	M420-M424 HydrophobicContact CG-CE 3.55Å; M420-M424 PolarHBondContact O-N 2.77Å; M420-M424 HydrophobicContact SD-CE 4.09Å; I421-M424 PolarHBondContact O-N 3.19Å; M424-Y426 VanDerWaalsContact C-N 3.3Å; M424-E427 PolarHBondContact O-N 3.33Å; M424-E428 WeakPolarHBondContact O-CB 3.4Å; M424-E428 PolarHBondContact O-N 3.29Å; M424-V598 HydrophobicContact CE-CB 4.36Å; M424-V598 HydrophobicContact CE-CG1 4.46Å; M424-V598 HydrophobicContact CE-CG2 3.84Å
425	Q	82.9	Confident	84	Confident	51 Å²	51	70 Å²	70	24%	0.238	34%	0.336	C	S	.	.	H	α-helix	trans	-63.7	-38.9	174.5	-71.8	176.9	-25	0	0	111.6	I421 K422 Y423 Y429	I421-Q425 WeakPolarHBondContact O-CG 3.42Å; I421-Q425 PolarHBondContact O-N 3.17Å; K422-Q425 PolarHBondContact O-N 3.1Å; Y423-Q425 VanDerWaalsContact C-N 3.33Å; Y423-Q425 PolarHBondContact O-N 2.96Å; Q425-Y429 VanDerWaalsContact O-CB 3.25Å; Q425-Y429 WeakPolarHBondContact O-CB 3.35Å; Q425-Y429 PolarHBondContact O-N 3.4Å
426	Y	81.6	Confident	84.4	Confident	108 Å²	108	70.5 Å²	70.5	42%	0.424	34%	0.335	S	S	.	.	H	α-helix	trans	-65	-45.5	175.6	-177.9	-91.5	0	0	0	111.7	K422 Y423 M424 Y429 E430	K422-Y426 WeakPolarHBondContact O-CB 3.41Å; K422-Y426 PolarHBondContact O-N 3.3Å; Y423-Y426 WeakPolarHBondContact O-CB 3.36Å; Y423-Y426 PolarHBondContact O-N 2.85Å; Y423-Y426 VanDerWaalsContact O-N 3.14Å; M424-Y426 VanDerWaalsContact C-N 3.3Å; Y426-Y429 WeakPolarHBondContact O-CB 3.3Å; Y426-Y429 PolarHBondContact O-N 3.49Å; Y426-E430 HydrophobicContact CD1-CG 4.24Å; Y426-E430 HydrophobicContact CE1-CG 3.65Å; Y426-E430 WeakPolarHBondContact CE1-OE1 2.94Å; Y426-E430 WeakPolarHBondContact CE1-OE2 2.97Å; Y426-E430 HydrophobicContact CE2-CG 4.47Å; Y426-E430 VanDerWaalsContact CZ-OE1 3.29Å; Y426-E430 PolarHBondContact O-N 3.34Å; Y426-E430 VanDerWaalsContact OH-CD 3.32Å; Y426-E430 PolarHBondContact OH-OE1 3.48Å
427	E	83.1	Confident	84.7	Confident	95 Å²	95	75.1 Å²	75.1	44%	0.444	36%	0.356	S	S	.	.	H	α-helix	trans	-62	-43	175	-77	-170.7	142.7	0	0	112.1	Y423 M424 Y429 E430 S431	Y423-E427 HydrophobicContact CD1-CG 4.34Å; Y423-E427 HydrophobicContact CE1-CG 3.73Å; Y423-E427 VanDerWaalsContact CE1-OE1 3.26Å; Y423-E427 WeakPolarHBondContact CE1-OE1 3.35Å; Y423-E427 WeakPolarHBondContact CE1-OE2 3.49Å; Y423-E427 HydrophobicContact CE2-CG 4.46Å; Y423-E427 VanDerWaalsContact CZ-OE1 3.27Å; Y423-E427 PolarHBondContact O-N 3.45Å; Y423-E427 PolarHBondContact OH-OE1 3.21Å; M424-E427 PolarHBondContact O-N 3.33Å; E427-Y429 VanDerWaalsContact C-N 3.3Å; E427-Y429 PolarHBondContact O-N 3.34Å; E427-E430 PolarHBondContact O-N 3.45Å; E427-S431 WeakPolarHBondContact O-CB 3.45Å; E427-S431 PolarHBondContact O-N 3.41Å
428	E	82.9	Confident	84.9	Confident	97 Å²	97	83.7 Å²	83.7	45%	0.453	39%	0.389	S	S	.	.	H	α-helix	trans	-63.1	-40	175.5	-172.4	179.5	173.9	0	0	111	M424 S431 K432	M424-E428 WeakPolarHBondContact O-CB 3.4Å; M424-E428 PolarHBondContact O-N 3.29Å; E428-S431 PolarHBondContact O-N 2.85Å; E428-S431 PolarHBondContact O-OG 3.09Å; E428-K432 WeakPolarHBondContact O-CG 3.43Å; E428-K432 PolarHBondContact O-N 3.2Å; E428-K432 WeakPolarHBondContact OE1-CE 3.47Å; E428-K432 IonicContact OE1-NZ 2.74Å; E428-K432 PolarHBondContact OE1-NZ 3.26Å
429	Y	80.9	Confident	85.5	Confident	67 Å²	67	84.8 Å²	84.8	26%	0.263	39%	0.39	S	S	.	.	H	α-helix	trans	-63.2	-49.1	175.1	-173.8	-93.7	0	0	0	111.2	Q425 Y426 E427 S431 K432 V451 N452 S472	Q425-Y429 VanDerWaalsContact O-CB 3.25Å; Q425-Y429 WeakPolarHBondContact O-CB 3.35Å; Q425-Y429 PolarHBondContact O-N 3.4Å; Y426-Y429 WeakPolarHBondContact O-CB 3.3Å; Y426-Y429 PolarHBondContact O-N 3.49Å; E427-Y429 VanDerWaalsContact C-N 3.3Å; E427-Y429 PolarHBondContact O-N 3.34Å; Y429-S431 VanDerWaalsContact C-N 3.32Å; Y429-S431 PolarHBondContact O-N 3.08Å; Y429-K432 PolarHBondContact O-N 2.75Å; Y429-K432 VanDerWaalsContact O-N 3.15Å; Y429-V451 HydrophobicContact CE2-CG1 4.34Å; Y429-V451 WeakPolarHBondContact OH-CG1 3.14Å; Y429-N452 WeakPolarHBondContact CD1-OD1 3.37Å; Y429-N452 HydrophobicContact CE1-CB 3.9Å; Y429-N452 WeakPolarHBondContact CE1-OD1 3.25Å; Y429-N452 HydrophobicContact CE2-CB 4.08Å; Y429-N452 PolarHBondContact O-ND2 2.04Å; Y429-N452 WeakPolarHBondContact OH-CB 3.32Å; Y429-S472 WeakPolarHBondContact OH-CB 3.01Å
430	E	81.4	Confident	86	Confident	99 Å²	99	89.1 Å²	89.1	46%	0.463	40%	0.401	S	S	.	.	H	α-helix	trans	-62.3	-36	176.5	-78.6	-158.8	147.9	0	0	112.8	Y426 E427 K432 V433	Y426-E430 HydrophobicContact CD1-CG 4.24Å; Y426-E430 HydrophobicContact CE1-CG 3.65Å; Y426-E430 WeakPolarHBondContact CE1-OE1 2.94Å; Y426-E430 WeakPolarHBondContact CE1-OE2 2.97Å; Y426-E430 HydrophobicContact CE2-CG 4.47Å; Y426-E430 VanDerWaalsContact CZ-OE1 3.29Å; Y426-E430 PolarHBondContact O-N 3.34Å; Y426-E430 VanDerWaalsContact OH-CD 3.32Å; Y426-E430 PolarHBondContact OH-OE1 3.48Å; E427-E430 PolarHBondContact O-N 3.45Å; E430-K432 PolarHBondContact O-N 2.75Å; E430-V433 WeakPolarHBondContact O-CB 3.32Å; E430-V433 WeakPolarHBondContact O-CG2 3.49Å; E430-V433 PolarHBondContact O-N 3.07Å; E430-V433 VanDerWaalsContact O-N 3.14Å
431	S	84.3	Confident	86.4	Confident	94 Å²	94	90 Å²	90	66%	0.657	41%	0.407	S	S	*	.	H	α-helix	trans	-63.6	-23.3	177.6	77.9	0	0	0	0	113.6	E427 E428 Y429	E427-S431 WeakPolarHBondContact O-CB 3.45Å; E427-S431 PolarHBondContact O-N 3.41Å; E428-S431 PolarHBondContact O-N 2.85Å; E428-S431 PolarHBondContact O-OG 3.09Å; Y429-S431 VanDerWaalsContact C-N 3.32Å; Y429-S431 PolarHBondContact O-N 3.08Å
432	K	86.7	Confident	86.9	Confident	123 Å²	123	94 Å²	94	54%	0.535	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	9.7	180	-66.7	174.3	-172.4	170.2	0	113.1	E428 Y429 E430 R434 N452	E428-K432 WeakPolarHBondContact O-CG 3.43Å; E428-K432 PolarHBondContact O-N 3.2Å; E428-K432 WeakPolarHBondContact OE1-CE 3.47Å; E428-K432 IonicContact OE1-NZ 2.74Å; E428-K432 PolarHBondContact OE1-NZ 3.26Å; Y429-K432 PolarHBondContact O-N 2.75Å; Y429-K432 VanDerWaalsContact O-N 3.15Å; E430-K432 PolarHBondContact O-N 2.75Å; K432-R434 PolarHBondContact O-N 3.16Å; K432-N452 PolarHBondContact O-ND2 3.48Å
433	V	87.9	Confident	87.5	Confident	50 Å²	50	97.3 Å²	97.3	30%	0.303	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-59.7	129.3	178.2	169.3	0	0	0	0	110.1	E430 V435 N452 V454	E430-V433 WeakPolarHBondContact O-CB 3.32Å; E430-V433 WeakPolarHBondContact O-CG2 3.49Å; E430-V433 PolarHBondContact O-N 3.07Å; E430-V433 VanDerWaalsContact O-N 3.14Å; V433-V435 HydrophobicContact CG1-CG2 4.17Å; V433-N452 WeakPolarHBondContact CG2-OD1 3.43Å; V433-N452 PolarHBondContact N-ND2 3.42Å; V433-V454 HydrophobicContact CG1-CB 4.44Å; V433-V454 HydrophobicContact CG1-CG2 3.69Å
434	R	89.3	Confident	87.9	Confident	168 Å²	168	98.2 Å²	98.2	63%	0.634	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.6	173.7	-63.4	-176.3	-177.7	-177.4	0.9	109.5	K432 F436 N452 Q453 V454	K432-R434 PolarHBondContact O-N 3.16Å; R434-F436 HydrophobicContact CB-CE2 3.89Å; R434-F436 HydrophobicContact CB-CZ 4.26Å; R434-N452 PolarHBondContact N-O 2.76Å; R434-Q453 HydrophobicContact CB-CG 4.46Å; R434-Q453 CarbonylContact O-C 3.5Å; R434-Q453 VanDerWaalsContact O-CA 3.28Å; R434-Q453 WeakPolarHBondContact O-CA 3.07Å; R434-V454 PolarHBondContact O-N 3.35Å
435	V	90.8	Very high	88.3	Confident	83 Å²	83	100.3 Å²	100.3	50%	0.503	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	122.5	177.2	-172.5	0	0	0	0	109.3	V433 V454	V433-V435 HydrophobicContact CG1-CG2 4.17Å; V435-V454 CarbonylContact C-O 3.59Å; V435-V454 VanDerWaalsContact CA-O 3.32Å; V435-V454 WeakPolarHBondContact CA-O 3.44Å; V435-V454 HydrophobicContact CG2-CB 4.35Å
436	F	91.9	Very high	88.7	Confident	57 Å²	57	98.9 Å²	98.9	25%	0.25	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	133.5	174.8	-64.1	-76.9	0	0	0	108.6	R434 E439 Q453 V454 H455 R456	R434-F436 HydrophobicContact CB-CE2 3.89Å; R434-F436 HydrophobicContact CB-CZ 4.26Å; F436-E439 HydrophobicContact CB-CG 4.03Å; F436-E439 WeakPolarHBondContact CB-OE2 3.42Å; F436-E439 VanDerWaalsContact CD1-CD 3.45Å; F436-E439 WeakPolarHBondContact CD1-OE1 3.34Å; F436-Q453 HydrophobicContact CD2-CB 4.37Å; F436-Q453 HydrophobicContact CE2-CB 4.21Å; F436-Q453 HydrophobicContact CE2-CG 4.02Å; F436-V454 PolarHBondContact N-O 3.38Å; F436-H455 AromaticContact CD2-CE1 3.36Å; F436-H455 WeakPolarHBondContact CD2-CE1 3.26Å; F436-H455 AromaticContact CD2-ND1 3.78Å; F436-H455 AromaticContact CD2-NE2 3.85Å; F436-H455 AromaticContact CG-CE1 3.87Å; F436-H455 AromaticContact CG-ND1 3.95Å; F436-R456 PolarHBondContact O-N 2.95Å
437	H	92.8	Very high	89.1	Confident	103 Å²	103	99.2 Å²	99.2	48%	0.477	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	128.5	-172.2	-163.5	-56.1	0	0	0	110.3	E439 R456 E457	H437-E439 PolarHBondContact O-N 2.89Å; H437-R456 CarbonylContact C-O 3.52Å; H437-R456 WeakPolarHBondContact CA-O 3.41Å; H437-E457 IonicContact CE1-OE1 3.88Å; H437-E457 IonicContact CE1-OE2 3.38Å; H437-E457 PolarHBondContact CE1-OE2 3.11Å
438	R	90.8	Very high	89.4	Confident	180 Å²	180	99.4 Å²	99.4	68%	0.679	45%	0.451	S	S	*	.	S	Bend	trans	52.8	38	-179.7	-73.3	171.1	-173.4	-178.8	4.4	113.4	R456 E457	R438-R456 PolarHBondContact N-O 2.92Å; R438-E457 WeakPolarHBondContact CA-O 3.4Å; R438-E457 HydrophobicContact CG-CB 3.92Å; R438-E457 WeakPolarHBondContact CG-OE2 3.47Å; R438-E457 IonicContact CZ-OE2 3.28Å; R438-E457 VanDerWaalsContact CZ-OE2 3.28Å; R438-E457 IonicContact NE-OE2 2.68Å; R438-E457 PolarHBondContact NE-OE2 3.34Å; R438-E457 IonicContact NH2-OE1 3.97Å; R438-E457 IonicContact NH2-OE2 2.98Å; R438-E457 PolarHBondContact NH2-OE2 3.35Å
439	E	91.4	Very high	89.7	Confident	70 Å²	70	97.9 Å²	97.9	33%	0.327	45%	0.451	S	S	.	.			trans	-75.6	128.3	173	-70.9	-163.4	144.1	0	0	109.6	F436 H437 H455 G458 E459	F436-E439 HydrophobicContact CB-CG 4.03Å; F436-E439 WeakPolarHBondContact CB-OE2 3.42Å; F436-E439 VanDerWaalsContact CD1-CD 3.45Å; F436-E439 WeakPolarHBondContact CD1-OE1 3.34Å; H437-E439 PolarHBondContact O-N 2.89Å; E439-H455 IonicContact OE2-CE1 3.87Å; E439-H455 IonicContact OE2-ND1 3.14Å; E439-G458 CarbonylContact O-C 3.55Å; E439-G458 VanDerWaalsContact O-CA 3.28Å; E439-G458 WeakPolarHBondContact O-CA 3.38Å; E439-E459 PolarHBondContact O-N 3.09Å
440	R	93.1	Very high	90	Very high	158 Å²	158	95 Å²	95	60%	0.596	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	112.6	171.2	-177.2	171.9	175.6	158.3	-4.9	108.7	E442 E459	R440-E442 HydrophobicContact CG-CG 4.28Å; R440-E442 IonicContact CZ-OE1 3.72Å; R440-E442 IonicContact NE-OE1 3.64Å; R440-E442 PolarHBondContact NE-OE1 3.35Å; R440-E442 IonicContact NH2-OE1 3.38Å; R440-E442 PolarHBondContact NH2-OE1 2.84Å; R440-E459 CarbonylContact C-O 3.55Å; R440-E459 WeakPolarHBondContact CA-O 3.27Å; R440-E459 HydrophobicContact CB-CB 4.29Å; R440-E459 WeakPolarHBondContact CD-OE2 3.29Å; R440-E459 HydrophobicContact CG-CB 4.03Å; R440-E459 IonicContact CZ-OE2 3.53Å; R440-E459 IonicContact NE-OE2 3.94Å; R440-E459 IonicContact NH1-OE2 2.91Å; R440-E459 PolarHBondContact NH1-OE2 2.72Å
441	V	92.3	Very high	90.3	Very high	32 Å²	32	93.4 Å²	93.4	19%	0.194	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.9	178.9	-174.6	0	0	0	0	107.5	F444 F446 E459 Y460 I461	V441-F444 HydrophobicContact CG1-CB 3.43Å; V441-F444 VanDerWaalsContact CG1-CB 3.43Å; V441-F444 HydrophobicContact CG1-CG 4.12Å; V441-F446 HydrophobicContact CG1-CE2 4.29Å; V441-F446 HydrophobicContact CG1-CZ 4.14Å; V441-E459 PolarHBondContact N-O 3.36Å; V441-Y460 HydrophobicContact CB-CD1 3.93Å; V441-Y460 HydrophobicContact CB-CE1 4.27Å; V441-Y460 HydrophobicContact CG2-CD1 4.19Å; V441-Y460 HydrophobicContact CG2-CE1 4.01Å; V441-Y460 WeakPolarHBondContact O-CA 3.3Å; V441-I461 PolarHBondContact O-N 3.41Å
442	E	93.1	Very high	90.5	Very high	89 Å²	89	89.7 Å²	89.7	42%	0.416	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	136.1	178	-56	-169.5	171.2	0	0	111	R440 F444 I461	R440-E442 HydrophobicContact CG-CG 4.28Å; R440-E442 IonicContact CZ-OE1 3.72Å; R440-E442 IonicContact NE-OE1 3.64Å; R440-E442 PolarHBondContact NE-OE1 3.35Å; R440-E442 IonicContact NH2-OE1 3.38Å; R440-E442 PolarHBondContact NH2-OE1 2.84Å; E442-F444 PolarHBondContact O-N 2.97Å; E442-I461 VanDerWaalsContact CA-O 3.24Å; E442-I461 WeakPolarHBondContact CA-O 3.28Å; E442-I461 HydrophobicContact CG-CB 4.12Å; E442-I461 HydrophobicContact CG-CD1 4.44Å; E442-I461 HydrophobicContact CG-CG1 4.46Å
443	R	92.3	Very high	90.8	Very high	203 Å²	203	85 Å²	85	77%	0.766	39%	0.39	S	S	*	.	S	Bend	trans	54.9	35.9	175.6	-56.6	178.4	-178.1	176.3	1.8	113.4	I461 H462 D463	R443-I461 PolarHBondContact N-O 3.26Å; R443-H462 WeakPolarHBondContact CA-O 3.29Å; R443-H462 HydrophobicContact CG-CB 3.97Å; R443-D463 PolarHBondContact N-OD1 3.39Å
444	F	93.4	Very high	91	Very high	90 Å²	90	83.6 Å²	83.6	40%	0.395	38%	0.381	S	S	.	.			trans	-98.4	145.5	178.2	-167.6	-101.2	0	0	0	111.7	V441 E442 F446 F448 D463 K464	V441-F444 HydrophobicContact CG1-CB 3.43Å; V441-F444 VanDerWaalsContact CG1-CB 3.43Å; V441-F444 HydrophobicContact CG1-CG 4.12Å; E442-F444 PolarHBondContact O-N 2.97Å; F444-F446 HydrophobicContact CB-CE2 4.44Å; F444-F446 AromaticContact CD1-CD1 3.87Å; F444-F446 HydrophobicContact CD1-CD1 3.87Å; F444-F446 AromaticContact CD1-CD2 3.71Å; F444-F446 HydrophobicContact CD1-CD2 3.71Å; F444-F446 AromaticContact CD1-CE1 3.82Å; F444-F446 HydrophobicContact CD1-CE1 3.82Å; F444-F446 AromaticContact CD1-CE2 3.66Å; F444-F446 HydrophobicContact CD1-CE2 3.66Å; F444-F446 AromaticContact CD1-CG 3.82Å; F444-F446 HydrophobicContact CD1-CG 3.82Å; F444-F446 AromaticContact CD1-CZ 3.72Å; F444-F446 HydrophobicContact CD1-CZ 3.72Å; F444-F446 AromaticContact CE1-CD1 3.74Å; F444-F446 HydrophobicContact CE1-CD1 3.74Å; F444-F446 HydrophobicContact CE1-CD2 4.36Å; F444-F446 AromaticContact CE1-CE1 3.88Å; F444-F446 HydrophobicContact CE1-CE1 3.88Å; F444-F446 HydrophobicContact CE1-CE2 4.49Å; F444-F446 AromaticContact CE1-CG 4Å; F444-F446 HydrophobicContact CE1-CG 4Å; F444-F446 HydrophobicContact CE1-CZ 4.27Å; F444-F448 AromaticContact CE1-CE1 3.82Å; F444-F448 HydrophobicContact CE1-CE1 3.82Å; F444-F448 HydrophobicContact CE1-CZ 4.28Å; F444-F448 HydrophobicContact CZ-CE1 4.02Å; F444-D463 PolarHBondContact N-OD1 3.41Å; F444-D463 WeakPolarHBondContact O-CA 3.12Å; F444-K464 PolarHBondContact O-N 2.99Å
445	H	92.1	Very high	91.2	Very high	90 Å²	90	76.1 Å²	76.1	42%	0.417	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	103.8	176	-174.7	-102.5	0	0	0	109.8	N447 K464	H445-N447 PolarHBondContact O-N 3.14Å; H445-K464 CarbonylContact C-O 3.56Å; H445-K464 WeakPolarHBondContact CA-O 3.25Å
446	F	91.6	Very high	91.4	Very high	20 Å²	20	77.4 Å²	77.4	9%	0.088	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	109.7	175.7	-68.2	-87.6	0	0	0	109.6	V441 F444 F448 Y460 D463 K464 F465 A466 I468	V441-F446 HydrophobicContact CG1-CE2 4.29Å; V441-F446 HydrophobicContact CG1-CZ 4.14Å; F444-F446 HydrophobicContact CB-CE2 4.44Å; F444-F446 AromaticContact CD1-CD1 3.87Å; F444-F446 HydrophobicContact CD1-CD1 3.87Å; F444-F446 AromaticContact CD1-CD2 3.71Å; F444-F446 HydrophobicContact CD1-CD2 3.71Å; F444-F446 AromaticContact CD1-CE1 3.82Å; F444-F446 HydrophobicContact CD1-CE1 3.82Å; F444-F446 AromaticContact CD1-CE2 3.66Å; F444-F446 HydrophobicContact CD1-CE2 3.66Å; F444-F446 AromaticContact CD1-CG 3.82Å; F444-F446 HydrophobicContact CD1-CG 3.82Å; F444-F446 AromaticContact CD1-CZ 3.72Å; F444-F446 HydrophobicContact CD1-CZ 3.72Å; F444-F446 AromaticContact CE1-CD1 3.74Å; F444-F446 HydrophobicContact CE1-CD1 3.74Å; F444-F446 HydrophobicContact CE1-CD2 4.36Å; F444-F446 AromaticContact CE1-CE1 3.88Å; F444-F446 HydrophobicContact CE1-CE1 3.88Å; F444-F446 HydrophobicContact CE1-CE2 4.49Å; F444-F446 AromaticContact CE1-CG 4Å; F444-F446 HydrophobicContact CE1-CG 4Å; F444-F446 HydrophobicContact CE1-CZ 4.27Å; F446-F448 HydrophobicContact CD1-CE1 4.21Å; F446-F448 HydrophobicContact CD1-CE2 4.37Å; F446-F448 AromaticContact CD1-CZ 3.81Å; F446-F448 HydrophobicContact CD1-CZ 3.81Å; F446-F448 HydrophobicContact CE1-CZ 4.17Å; F446-Y460 HydrophobicContact CZ-CE1 4.37Å; F446-D463 HydrophobicContact CE2-CB 4.34Å; F446-K464 PolarHBondContact N-O 3.18Å; F446-F465 HydrophobicContact CB-CD1 3.68Å; F446-F465 HydrophobicContact CB-CE1 4.15Å; F446-F465 HydrophobicContact CB-CG 4.29Å; F446-F465 HydrophobicContact CD1-CE1 4.17Å; F446-F465 AromaticContact CD2-CD1 3.48Å; F446-F465 HydrophobicContact CD2-CD1 3.48Å; F446-F465 VanDerWaalsContact CD2-CD1 3.48Å; F446-F465 HydrophobicContact CD2-CD2 4.29Å; F446-F465 AromaticContact CD2-CE1 3.16Å; F446-F465 HydrophobicContact CD2-CE1 3.16Å; F446-F465 HydrophobicContact CD2-CE2 4.01Å; F446-F465 HydrophobicContact CD2-CG 4.04Å; F446-F465 AromaticContact CD2-CZ 3.45Å; F446-F465 HydrophobicContact CD2-CZ 3.45Å; F446-F465 VanDerWaalsContact CD2-CZ 3.45Å; F446-F465 HydrophobicContact CE1-CE1 4.39Å; F446-F465 HydrophobicContact CE2-CD1 4.23Å; F446-F465 AromaticContact CE2-CE1 3.44Å; F446-F465 HydrophobicContact CE2-CE1 3.44Å; F446-F465 VanDerWaalsContact CE2-CE1 3.44Å; F446-F465 HydrophobicContact CE2-CE2 4.14Å; F446-F465 AromaticContact CE2-CZ 3.38Å; F446-F465 HydrophobicContact CE2-CZ 3.38Å; F446-F465 AromaticContact CG-CD1 3.65Å; F446-F465 HydrophobicContact CG-CD1 3.65Å; F446-F465 AromaticContact CG-CE1 3.57Å; F446-F465 HydrophobicContact CG-CE1 3.57Å; F446-F465 HydrophobicContact CG-CG 4.45Å; F446-F465 HydrophobicContact CG-CZ 4.31Å; F446-F465 HydrophobicContact CZ-CE1 4.06Å; F446-F465 HydrophobicContact CZ-CZ 4.2Å; F446-A466 PolarHBondContact O-N 3.34Å; F446-I468 HydrophobicContact CB-CD1 4.45Å; F446-I468 VanDerWaalsContact O-CG2 3.28Å; F446-I468 WeakPolarHBondContact O-CG2 3.25Å
447	N	89.6	Confident	91.5	Very high	116 Å²	116	78.4 Å²	78.4	62%	0.62	36%	0.355	S	S	*	.			trans	-119.5	15.8	178	68.9	-14.4	0	0	0	113.1	H445	H445-N447 PolarHBondContact O-N 3.14Å
448	F	89.7	Confident	91.5	Very high	98 Å²	98	73.6 Å²	73.6	43%	0.43	33%	0.333	S	S	.	.	S	Bend	trans	-129.6	152.2	179.9	57.5	-94.1	0	0	0	110.6	F444 F446 L450 I468	F444-F448 AromaticContact CE1-CE1 3.82Å; F444-F448 HydrophobicContact CE1-CE1 3.82Å; F444-F448 HydrophobicContact CE1-CZ 4.28Å; F444-F448 HydrophobicContact CZ-CE1 4.02Å; F446-F448 HydrophobicContact CD1-CE1 4.21Å; F446-F448 HydrophobicContact CD1-CE2 4.37Å; F446-F448 AromaticContact CD1-CZ 3.81Å; F446-F448 HydrophobicContact CD1-CZ 3.81Å; F446-F448 HydrophobicContact CE1-CZ 4.17Å; F448-L450 HydrophobicContact CD2-CD2 4.11Å; F448-L450 HydrophobicContact CE2-CD2 3.58Å; F448-L450 HydrophobicContact CZ-CD2 4.48Å; F448-I468 WeakPolarHBondContact O-CG2 3.31Å
449	S	87.5	Confident	91.7	Very high	65 Å²	65	68.6 Å²	68.6	46%	0.455	32%	0.317	S	S	.	.			trans	-70.5	135.1	-179	-56.9	0	0	0	0	111.8	E469	S449-E469 CarbonylContact C-O 3.45Å; S449-E469 WeakPolarHBondContact CA-O 3.4Å; S449-E469 VanDerWaalsContact CB-O 3.25Å; S449-E469 WeakPolarHBondContact CB-O 3.45Å
450	L	88.7	Confident	91.9	Very high	6 Å²	6	65.4 Å²	65.4	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	119	176.1	-61.2	175.5	0	0	0	108.4	F448 F465 E469 I470 K471 V473 F475	F448-L450 HydrophobicContact CD2-CD2 4.11Å; F448-L450 HydrophobicContact CE2-CD2 3.58Å; F448-L450 HydrophobicContact CZ-CD2 4.48Å; L450-F465 HydrophobicContact CD1-CE1 4.49Å; L450-E469 PolarHBondContact N-O 3.28Å; L450-I470 HydrophobicContact CB-CG2 4.28Å; L450-I470 CarbonylContact O-C 3.53Å; L450-I470 WeakPolarHBondContact O-CA 3.41Å; L450-K471 PolarHBondContact O-N 2.98Å; L450-V473 HydrophobicContact CB-CG2 3.9Å; L450-V473 WeakPolarHBondContact O-CG2 3.35Å; L450-F475 HydrophobicContact CD1-CZ 4.48Å
451	V	87.6	Confident	92	Very high	67 Å²	67	58.7 Å²	58.7	41%	0.406	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	126.2	-174.4	-174.5	0	0	0	0	110.4	Y429 Q453 K471	Y429-V451 HydrophobicContact CE2-CG1 4.34Å; Y429-V451 WeakPolarHBondContact OH-CG1 3.14Å; V451-Q453 WeakPolarHBondContact O-CG 2.99Å; V451-K471 WeakPolarHBondContact CA-O 3.34Å; V451-K471 HydrophobicContact CG1-CB 4.38Å; V451-K471 HydrophobicContact CG2-CB 4.35Å
452	N	88.6	Confident	92.1	Very high	16 Å²	16	61.8 Å²	61.8	9%	0.086	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	59.2	54.5	171.8	-155.5	33.5	0	0	0	114.7	Y429 K432 V433 R434 K471 S472	Y429-N452 WeakPolarHBondContact CD1-OD1 3.37Å; Y429-N452 HydrophobicContact CE1-CB 3.9Å; Y429-N452 WeakPolarHBondContact CE1-OD1 3.25Å; Y429-N452 HydrophobicContact CE2-CB 4.08Å; Y429-N452 PolarHBondContact O-ND2 2.04Å; Y429-N452 WeakPolarHBondContact OH-CB 3.32Å; K432-N452 PolarHBondContact O-ND2 3.48Å; V433-N452 WeakPolarHBondContact CG2-OD1 3.43Å; V433-N452 PolarHBondContact N-ND2 3.42Å; R434-N452 PolarHBondContact N-O 2.76Å; N452-K471 PolarHBondContact N-O 2.93Å; N452-S472 WeakPolarHBondContact CA-O 3.01Å
453	Q	91.6	Very high	92.2	Very high	24 Å²	24	57.6 Å²	57.6	11%	0.112	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	145.5	-174.2	-55.1	178.4	8	0	0	111.4	R434 F436 V451 H455 S472 V473 K474	R434-Q453 HydrophobicContact CB-CG 4.46Å; R434-Q453 CarbonylContact O-C 3.5Å; R434-Q453 VanDerWaalsContact O-CA 3.28Å; R434-Q453 WeakPolarHBondContact O-CA 3.07Å; F436-Q453 HydrophobicContact CD2-CB 4.37Å; F436-Q453 HydrophobicContact CE2-CB 4.21Å; F436-Q453 HydrophobicContact CE2-CG 4.02Å; V451-Q453 WeakPolarHBondContact O-CG 2.99Å; Q453-H455 PolarHBondContact OE1-NE2 3.14Å; Q453-S472 PolarHBondContact N-O 2.69Å; Q453-V473 HydrophobicContact CB-CG1 4.28Å; Q453-V473 HydrophobicContact CB-CG2 4.32Å; Q453-V473 CarbonylContact O-C 3.47Å; Q453-V473 WeakPolarHBondContact O-CA 3.4Å; Q453-V473 WeakPolarHBondContact O-CG1 3.06Å; Q453-K474 PolarHBondContact O-N 2.98Å
454	V	92.6	Very high	92.3	Very high	20 Å²	20	51.5 Å²	51.5	12%	0.121	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	118.8	170.9	-178.8	0	0	0	0	108.1	V433 R434 V435 F436 R456 K474	V433-V454 HydrophobicContact CG1-CB 4.44Å; V433-V454 HydrophobicContact CG1-CG2 3.69Å; R434-V454 PolarHBondContact O-N 3.35Å; V435-V454 CarbonylContact C-O 3.59Å; V435-V454 VanDerWaalsContact CA-O 3.32Å; V435-V454 WeakPolarHBondContact CA-O 3.44Å; V435-V454 HydrophobicContact CG2-CB 4.35Å; F436-V454 PolarHBondContact N-O 3.38Å; V454-R456 HydrophobicContact CG1-CG 4.08Å; V454-K474 CarbonylContact C-O 3.58Å; V454-K474 WeakPolarHBondContact CA-O 3.41Å; V454-K474 HydrophobicContact CG1-CB 4.37Å; V454-K474 HydrophobicContact CG2-CB 4.35Å
455	H	94.2	Very high	92.3	Very high	11 Å²	11	47.3 Å²	47.3	5%	0.051	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	116.5	179.4	-67.6	-87.8	0	0	0	108.5	F436 E439 Q453 Y460 K474 F475 E476	F436-H455 AromaticContact CD2-CE1 3.36Å; F436-H455 WeakPolarHBondContact CD2-CE1 3.26Å; F436-H455 AromaticContact CD2-ND1 3.78Å; F436-H455 AromaticContact CD2-NE2 3.85Å; F436-H455 AromaticContact CG-CE1 3.87Å; F436-H455 AromaticContact CG-ND1 3.95Å; E439-H455 IonicContact OE2-CE1 3.87Å; E439-H455 IonicContact OE2-ND1 3.14Å; Q453-H455 PolarHBondContact OE1-NE2 3.14Å; H455-Y460 WeakPolarHBondContact CB-OH 2.95Å; H455-Y460 PolarHBondContact ND1-OH 3.32Å; H455-K474 PolarHBondContact N-O 2.88Å; H455-F475 HydrophobicContact CB-CD1 3.53Å; H455-F475 HydrophobicContact CB-CE1 3.84Å; H455-F475 HydrophobicContact CB-CG 4.45Å; H455-F475 AromaticContact CD2-CE1 3.53Å; H455-F475 AromaticContact CG-CD1 3.92Å; H455-F475 AromaticContact CG-CE1 3.68Å; H455-E476 PolarHBondContact O-N 3.49Å
456	R	94.8	Very high	92.4	Very high	111 Å²	111	43.3 Å²	43.3	42%	0.419	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	131.3	-177.8	-67.3	-171.8	166.9	169.7	0.3	111.1	F436 H437 R438 V454 G458 E476	F436-R456 PolarHBondContact O-N 2.95Å; H437-R456 CarbonylContact C-O 3.52Å; H437-R456 WeakPolarHBondContact CA-O 3.41Å; R438-R456 PolarHBondContact N-O 2.92Å; V454-R456 HydrophobicContact CG1-CG 4.08Å; R456-G458 PolarHBondContact O-N 3.13Å; R456-E476 WeakPolarHBondContact CA-O 3.38Å; R456-E476 HydrophobicContact CG-CB 4.26Å; R456-E476 IonicContact CZ-OE2 3.13Å; R456-E476 IonicContact NE-OE2 2.69Å; R456-E476 PolarHBondContact NE-OE2 3.48Å; R456-E476 IonicContact NH2-OE2 2.74Å; R456-E476 PolarHBondContact NH2-OE2 2.89Å
457	E	93.6	Very high	92.2	Very high	77 Å²	77	48.2 Å²	48.2	36%	0.36	24%	0.241	S	C	.	.	S	Bend	trans	54.5	33.7	178	-56.1	178.6	-169.3	0	0	112.1	H437 R438 E476 D477	H437-E457 IonicContact CE1-OE1 3.88Å; H437-E457 IonicContact CE1-OE2 3.38Å; H437-E457 PolarHBondContact CE1-OE2 3.11Å; R438-E457 WeakPolarHBondContact CA-O 3.4Å; R438-E457 HydrophobicContact CG-CB 3.92Å; R438-E457 WeakPolarHBondContact CG-OE2 3.47Å; R438-E457 IonicContact CZ-OE2 3.28Å; R438-E457 VanDerWaalsContact CZ-OE2 3.28Å; R438-E457 IonicContact NE-OE2 2.68Å; R438-E457 PolarHBondContact NE-OE2 3.34Å; R438-E457 IonicContact NH2-OE1 3.97Å; R438-E457 IonicContact NH2-OE2 2.98Å; R438-E457 PolarHBondContact NH2-OE2 3.35Å; E457-E476 PolarHBondContact N-O 2.84Å; E457-D477 WeakPolarHBondContact CA-O 3.44Å; E457-D477 HydrophobicContact CG-CB 4.31Å
458	G	92.5	Very high	92.1	Very high	2 Å²	2	42.9 Å²	42.9	2%	0.021	21%	0.213	C	C	.	.			trans	-80.3	146.5	-178.4	0	0	0	0	0	112.5	E439 R456 S478 L479	E439-G458 CarbonylContact O-C 3.55Å; E439-G458 VanDerWaalsContact O-CA 3.28Å; E439-G458 WeakPolarHBondContact O-CA 3.38Å; R456-G458 PolarHBondContact O-N 3.13Å; G458-S478 PolarHBondContact N-OG 2.9Å; G458-S478 CarbonylContact O-C 3.54Å; G458-S478 WeakPolarHBondContact O-CA 3.39Å; G458-S478 WeakPolarHBondContact O-CB 3.08Å; G458-L479 PolarHBondContact O-N 3.11Å
459	E	95	Very high	92	Very high	75 Å²	75	42 Å²	42	35%	0.35	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	113.6	173.8	-68.5	-178.8	179.6	0	0	109.3	E439 R440 V441 L479	E439-E459 PolarHBondContact O-N 3.09Å; R440-E459 CarbonylContact C-O 3.55Å; R440-E459 WeakPolarHBondContact CA-O 3.27Å; R440-E459 HydrophobicContact CB-CB 4.29Å; R440-E459 WeakPolarHBondContact CD-OE2 3.29Å; R440-E459 HydrophobicContact CG-CB 4.03Å; R440-E459 IonicContact CZ-OE2 3.53Å; R440-E459 IonicContact NE-OE2 3.94Å; R440-E459 IonicContact NH1-OE2 2.91Å; R440-E459 PolarHBondContact NH1-OE2 2.72Å; V441-E459 PolarHBondContact N-O 3.36Å; E459-L479 HydrophobicContact CG-CB 4.48Å
460	Y	95.7	Very high	91.9	Very high	3 Å²	3	39 Å²	39	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	113.8	178	-58.6	-83.2	0	0	0	108.7	V441 F446 H455 D463 F465 F475 L479 F480 E481 C483	V441-Y460 HydrophobicContact CB-CD1 3.93Å; V441-Y460 HydrophobicContact CB-CE1 4.27Å; V441-Y460 HydrophobicContact CG2-CD1 4.19Å; V441-Y460 HydrophobicContact CG2-CE1 4.01Å; V441-Y460 WeakPolarHBondContact O-CA 3.3Å; F446-Y460 HydrophobicContact CZ-CE1 4.37Å; H455-Y460 WeakPolarHBondContact CB-OH 2.95Å; H455-Y460 PolarHBondContact ND1-OH 3.32Å; Y460-D463 WeakPolarHBondContact CA-OD2 3.24Å; Y460-D463 VanDerWaalsContact CB-OD2 3.28Å; Y460-D463 WeakPolarHBondContact CB-OD2 3.43Å; Y460-F465 HydrophobicContact CD1-CZ 4.32Å; Y460-F475 HydrophobicContact CE2-CD1 4.01Å; Y460-F475 HydrophobicContact CE2-CE1 4.04Å; Y460-F475 AromaticContact CZ-CE1 3.93Å; Y460-L479 PolarHBondContact N-O 3.08Å; Y460-F480 HydrophobicContact CD1-CE1 4.45Å; Y460-F480 AromaticContact CD2-CD1 3.86Å; Y460-F480 HydrophobicContact CD2-CD1 3.86Å; Y460-F480 HydrophobicContact CD2-CD2 4.46Å; Y460-F480 AromaticContact CD2-CE1 3.34Å; Y460-F480 HydrophobicContact CD2-CE1 3.34Å; Y460-F480 HydrophobicContact CD2-CE2 4.01Å; Y460-F480 HydrophobicContact CD2-CG 4.38Å; Y460-F480 AromaticContact CD2-CZ 3.43Å; Y460-F480 HydrophobicContact CD2-CZ 3.43Å; Y460-F480 VanDerWaalsContact CD2-CZ 3.43Å; Y460-F480 AromaticContact CE2-CE1 3.98Å; Y460-F480 HydrophobicContact CE2-CE1 3.98Å; Y460-F480 HydrophobicContact CE2-CE2 4.36Å; Y460-F480 AromaticContact CE2-CZ 3.69Å; Y460-F480 HydrophobicContact CE2-CZ 3.69Å; Y460-F480 AromaticContact CG-CD1 3.97Å; Y460-F480 HydrophobicContact CG-CD1 3.97Å; Y460-F480 AromaticContact CG-CE1 3.62Å; Y460-F480 HydrophobicContact CG-CE1 3.62Å; Y460-F480 HydrophobicContact CG-CZ 4.18Å; Y460-F480 WeakPolarHBondContact O-CA 3.13Å; Y460-E481 PolarHBondContact O-N 2.85Å; Y460-C483 PolarHBondContact O-SG 3.36Å; Y460-C483 VanDerWaalsContact O-SG 3.36Å
461	I	95.6	Very high	91.7	Very high	18 Å²	18	40.8 Å²	40.8	9%	0.092	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	120.9	-169.9	-42.9	179.8	0	0	0	110.7	V441 E442 R443 D463 E481	V441-I461 PolarHBondContact O-N 3.41Å; E442-I461 VanDerWaalsContact CA-O 3.24Å; E442-I461 WeakPolarHBondContact CA-O 3.28Å; E442-I461 HydrophobicContact CG-CB 4.12Å; E442-I461 HydrophobicContact CG-CD1 4.44Å; E442-I461 HydrophobicContact CG-CG1 4.46Å; R443-I461 PolarHBondContact N-O 3.26Å; I461-D463 PolarHBondContact N-OD2 2.84Å; I461-D463 PolarHBondContact O-N 3.48Å; I461-E481 WeakPolarHBondContact CA-O 3.26Å; I461-E481 HydrophobicContact CG2-CB 4.34Å
462	H	95.3	Very high	91.5	Very high	96 Å²	96	38.9 Å²	38.9	44%	0.444	19%	0.186	S	C	.	.	S	Bend	trans	59.8	29.7	-175.6	-52.8	97.4	0	0	0	114	R443 E481 N482	R443-H462 WeakPolarHBondContact CA-O 3.29Å; R443-H462 HydrophobicContact CG-CB 3.97Å; H462-E481 PolarHBondContact N-O 3.24Å; H462-N482 WeakPolarHBondContact CA-O 3.23Å; H462-N482 PolarHBondContact NE2-ND2 3.42Å
463	D	94.6	Very high	91.6	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.011	18%	0.182	C	C	.	.			trans	-90.3	149.5	-178.7	-62.8	-41.1	0	0	0	112.3	R443 F444 F446 Y460 I461 F465 C483 Y484	R443-D463 PolarHBondContact N-OD1 3.39Å; F444-D463 PolarHBondContact N-OD1 3.41Å; F444-D463 WeakPolarHBondContact O-CA 3.12Å; F446-D463 HydrophobicContact CE2-CB 4.34Å; Y460-D463 WeakPolarHBondContact CA-OD2 3.24Å; Y460-D463 VanDerWaalsContact CB-OD2 3.28Å; Y460-D463 WeakPolarHBondContact CB-OD2 3.43Å; I461-D463 PolarHBondContact N-OD2 2.84Å; I461-D463 PolarHBondContact O-N 3.48Å; D463-F465 HydrophobicContact CB-CE2 3.97Å; D463-C483 CarbonylContact O-C 3.56Å; D463-C483 WeakPolarHBondContact O-CA 3.19Å; D463-Y484 PolarHBondContact O-N 2.97Å
464	K	94.2	Very high	91.6	Very high	75 Å²	75	40.9 Å²	40.9	33%	0.326	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	125.6	175.9	175.9	172.4	177.9	168.2	0	110.7	F444 H445 F446 A466 Y484 E486	F444-K464 PolarHBondContact O-N 2.99Å; H445-K464 CarbonylContact C-O 3.56Å; H445-K464 WeakPolarHBondContact CA-O 3.25Å; F446-K464 PolarHBondContact N-O 3.18Å; K464-A466 HydrophobicContact CG-CB 4.28Å; K464-Y484 CarbonylContact C-O 3.59Å; K464-Y484 WeakPolarHBondContact CA-O 3.34Å; K464-Y484 HydrophobicContact CD-CD1 4.3Å; K464-Y484 HydrophobicContact CG-CD1 4.37Å; K464-E486 WeakPolarHBondContact CE-OE2 3.14Å; K464-E486 IonicContact NZ-OE2 3.78Å; K464-E486 PolarHBondContact NZ-OE2 2.9Å
465	F	94.3	Very high	91.7	Very high	1 Å²	1	40 Å²	40	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	106.4	176.3	-62.4	-97.9	0	0	0	107.8	F446 L450 Y460 D463 I468 F480 Y484 F485 E486 I488	F446-F465 HydrophobicContact CB-CD1 3.68Å; F446-F465 HydrophobicContact CB-CE1 4.15Å; F446-F465 HydrophobicContact CB-CG 4.29Å; F446-F465 HydrophobicContact CD1-CE1 4.17Å; F446-F465 AromaticContact CD2-CD1 3.48Å; F446-F465 HydrophobicContact CD2-CD1 3.48Å; F446-F465 VanDerWaalsContact CD2-CD1 3.48Å; F446-F465 HydrophobicContact CD2-CD2 4.29Å; F446-F465 AromaticContact CD2-CE1 3.16Å; F446-F465 HydrophobicContact CD2-CE1 3.16Å; F446-F465 HydrophobicContact CD2-CE2 4.01Å; F446-F465 HydrophobicContact CD2-CG 4.04Å; F446-F465 AromaticContact CD2-CZ 3.45Å; F446-F465 HydrophobicContact CD2-CZ 3.45Å; F446-F465 VanDerWaalsContact CD2-CZ 3.45Å; F446-F465 HydrophobicContact CE1-CE1 4.39Å; F446-F465 HydrophobicContact CE2-CD1 4.23Å; F446-F465 AromaticContact CE2-CE1 3.44Å; F446-F465 HydrophobicContact CE2-CE1 3.44Å; F446-F465 VanDerWaalsContact CE2-CE1 3.44Å; F446-F465 HydrophobicContact CE2-CE2 4.14Å; F446-F465 AromaticContact CE2-CZ 3.38Å; F446-F465 HydrophobicContact CE2-CZ 3.38Å; F446-F465 AromaticContact CG-CD1 3.65Å; F446-F465 HydrophobicContact CG-CD1 3.65Å; F446-F465 AromaticContact CG-CE1 3.57Å; F446-F465 HydrophobicContact CG-CE1 3.57Å; F446-F465 HydrophobicContact CG-CG 4.45Å; F446-F465 HydrophobicContact CG-CZ 4.31Å; F446-F465 HydrophobicContact CZ-CE1 4.06Å; F446-F465 HydrophobicContact CZ-CZ 4.2Å; L450-F465 HydrophobicContact CD1-CE1 4.49Å; Y460-F465 HydrophobicContact CD1-CZ 4.32Å; D463-F465 HydrophobicContact CB-CE2 3.97Å; F465-I468 HydrophobicContact CB-CD1 3.83Å; F465-I468 HydrophobicContact CB-CG1 4.49Å; F465-I468 HydrophobicContact CD1-CD1 3.68Å; F465-I468 HydrophobicContact CG-CD1 4.25Å; F465-F480 HydrophobicContact CE2-CE1 4.32Å; F465-F480 HydrophobicContact CZ-CE1 4.18Å; F465-Y484 PolarHBondContact N-O 3.35Å; F465-F485 HydrophobicContact CB-CD1 3.78Å; F465-F485 HydrophobicContact CB-CE1 4.13Å; F465-F485 HydrophobicContact CB-CG 4.33Å; F465-F485 HydrophobicContact CD1-CE1 4.22Å; F465-F485 AromaticContact CD2-CD1 3.87Å; F465-F485 HydrophobicContact CD2-CD1 3.87Å; F465-F485 HydrophobicContact CD2-CD2 4.43Å; F465-F485 AromaticContact CD2-CE1 3.47Å; F465-F485 HydrophobicContact CD2-CE1 3.47Å; F465-F485 VanDerWaalsContact CD2-CE1 3.47Å; F465-F485 HydrophobicContact CD2-CE2 4.1Å; F465-F485 HydrophobicContact CD2-CG 4.33Å; F465-F485 AromaticContact CD2-CZ 3.6Å; F465-F485 HydrophobicContact CD2-CZ 3.6Å; F465-F485 AromaticContact CE2-CE1 3.86Å; F465-F485 HydrophobicContact CE2-CE1 3.86Å; F465-F485 HydrophobicContact CE2-CE2 4.33Å; F465-F485 AromaticContact CE2-CZ 3.66Å; F465-F485 HydrophobicContact CE2-CZ 3.66Å; F465-F485 AromaticContact CG-CD1 3.88Å; F465-F485 HydrophobicContact CG-CD1 3.88Å; F465-F485 AromaticContact CG-CE1 3.68Å; F465-F485 HydrophobicContact CG-CE1 3.68Å; F465-F485 HydrophobicContact CG-CZ 4.29Å; F465-F485 HydrophobicContact CZ-CE1 4.38Å; F465-F485 HydrophobicContact CZ-CZ 4.38Å; F465-F485 CarbonylContact O-C 3.57Å; F465-F485 WeakPolarHBondContact O-CA 3.48Å; F465-E486 PolarHBondContact O-N 3.21Å; F465-I488 HydrophobicContact CB-CD1 3.8Å
466	A	92.4	Very high	91.7	Very high	7 Å²	7	41.2 Å²	41.2	6%	0.058	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	132.3	-173.4	0	0	0	0	0	112.4	F446 K464 I468 E486	F446-A466 PolarHBondContact O-N 3.34Å; K464-A466 HydrophobicContact CG-CB 4.28Å; A466-I468 VanDerWaalsContact C-N 3.32Å; A466-I468 WeakPolarHBondContact O-CG2 3.29Å; A466-I468 PolarHBondContact O-N 3.43Å; A466-E486 WeakPolarHBondContact CA-O 3.07Å; A466-E486 HydrophobicContact CB-CB 4.13Å
467	N	88.1	Confident	91.7	Very high	123 Å²	123	40.2 Å²	40.2	66%	0.658	20%	0.196	S	C	*	.	S	Bend	trans	55.1	44	-179.9	-66	-46.3	0	0	0	113.2	E486 D487	N467-E486 PolarHBondContact N-O 2.96Å; N467-D487 VanDerWaalsContact OD1-CB 3.28Å; N467-D487 WeakPolarHBondContact OD1-CB 3.3Å
468	I	88.4	Confident	91.8	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.021	18%	0.18	C	C	.	.			trans	-114.7	150.1	-179.6	64.3	169.4	0	0	0	112.3	F446 F448 F465 A466 I470 I488 R489	F446-I468 HydrophobicContact CB-CD1 4.45Å; F446-I468 VanDerWaalsContact O-CG2 3.28Å; F446-I468 WeakPolarHBondContact O-CG2 3.25Å; F448-I468 WeakPolarHBondContact O-CG2 3.31Å; F465-I468 HydrophobicContact CB-CD1 3.83Å; F465-I468 HydrophobicContact CB-CG1 4.49Å; F465-I468 HydrophobicContact CD1-CD1 3.68Å; F465-I468 HydrophobicContact CG-CD1 4.25Å; A466-I468 VanDerWaalsContact C-N 3.32Å; A466-I468 WeakPolarHBondContact O-CG2 3.29Å; A466-I468 PolarHBondContact O-N 3.43Å; I468-I470 HydrophobicContact CD1-CD1 3.86Å; I468-I470 HydrophobicContact CD1-CG1 3.79Å; I468-I470 HydrophobicContact CG1-CD1 4.45Å; I468-I470 HydrophobicContact CG1-CG1 4.13Å; I468-I488 HydrophobicContact CD1-CD1 4.44Å; I468-I488 HydrophobicContact CG1-CD1 4.24Å; I468-I488 HydrophobicContact CG1-CG1 4.03Å; I468-R489 PolarHBondContact O-N 2.87Å
469	E	85.9	Confident	91.9	Very high	80 Å²	80	38.7 Å²	38.7	37%	0.374	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	128	166.2	-168.9	176.7	176.9	0	0	109.6	S449 L450 R489	S449-E469 CarbonylContact C-O 3.45Å; S449-E469 WeakPolarHBondContact CA-O 3.4Å; S449-E469 VanDerWaalsContact CB-O 3.25Å; S449-E469 WeakPolarHBondContact CB-O 3.45Å; L450-E469 PolarHBondContact N-O 3.28Å; E469-R489 CarbonylContact C-O 3.57Å; E469-R489 WeakPolarHBondContact CA-O 3.24Å; E469-R489 HydrophobicContact CG-CB 4.32Å
470	I	87.4	Confident	92	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	111.3	179.4	-51.3	-179.8	0	0	0	107.9	L450 I468 V473 I488 R489 S490 T491 T493	L450-I470 HydrophobicContact CB-CG2 4.28Å; L450-I470 CarbonylContact O-C 3.53Å; L450-I470 WeakPolarHBondContact O-CA 3.41Å; I468-I470 HydrophobicContact CD1-CD1 3.86Å; I468-I470 HydrophobicContact CD1-CG1 3.79Å; I468-I470 HydrophobicContact CG1-CD1 4.45Å; I468-I470 HydrophobicContact CG1-CG1 4.13Å; I470-V473 HydrophobicContact CG2-CB 3.5Å; I470-V473 VanDerWaalsContact CG2-CB 3.5Å; I470-V473 HydrophobicContact CG2-CG1 4.23Å; I470-V473 HydrophobicContact CG2-CG2 3.51Å; I470-I488 HydrophobicContact CD1-CG2 3.79Å; I470-I488 HydrophobicContact CG1-CG2 4.05Å; I470-R489 PolarHBondContact N-O 3.4Å; I470-S490 CarbonylContact O-C 3.47Å; I470-S490 VanDerWaalsContact O-CA 3.28Å; I470-S490 WeakPolarHBondContact O-CA 3.39Å; I470-T491 PolarHBondContact O-N 2.85Å; I470-T493 HydrophobicContact CB-CG2 4.45Å; I470-T493 HydrophobicContact CG2-CG2 3.66Å; I470-T493 WeakPolarHBondContact CG2-OG1 3.29Å; I470-T493 PolarHBondContact O-OG1 3.47Å
471	K	83.4	Confident	92	Very high	44 Å²	44	38.1 Å²	38.1	19%	0.191	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	119.7	-174.6	-174.5	174.4	-176.8	176.5	0	111.6	L450 V451 N452 V473 T491	L450-K471 PolarHBondContact O-N 2.98Å; V451-K471 WeakPolarHBondContact CA-O 3.34Å; V451-K471 HydrophobicContact CG1-CB 4.38Å; V451-K471 HydrophobicContact CG2-CB 4.35Å; N452-K471 PolarHBondContact N-O 2.93Å; K471-V473 VanDerWaalsContact C-N 3.35Å; K471-V473 PolarHBondContact O-N 3.5Å; K471-T491 WeakPolarHBondContact CA-O 3.25Å; K471-T491 HydrophobicContact CG-CG2 4.46Å
472	S	83.8	Confident	92	Very high	27 Å²	27	40 Å²	40	19%	0.189	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	51.2	51.1	-178.5	-53.3	0	0	0	0	112.3	Y429 N452 Q453 T491 N492	Y429-S472 WeakPolarHBondContact OH-CB 3.01Å; N452-S472 WeakPolarHBondContact CA-O 3.01Å; Q453-S472 PolarHBondContact N-O 2.69Å; S472-T491 PolarHBondContact N-O 2.64Å; S472-N492 WeakPolarHBondContact CA-O 3.17Å
473	V	89.5	Confident	91.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	135.4	176.8	-178.6	0	0	0	0	110.4	L450 Q453 I470 K471 F475 T493 F494	L450-V473 HydrophobicContact CB-CG2 3.9Å; L450-V473 WeakPolarHBondContact O-CG2 3.35Å; Q453-V473 HydrophobicContact CB-CG1 4.28Å; Q453-V473 HydrophobicContact CB-CG2 4.32Å; Q453-V473 CarbonylContact O-C 3.47Å; Q453-V473 WeakPolarHBondContact O-CA 3.4Å; Q453-V473 WeakPolarHBondContact O-CG1 3.06Å; I470-V473 HydrophobicContact CG2-CB 3.5Å; I470-V473 VanDerWaalsContact CG2-CB 3.5Å; I470-V473 HydrophobicContact CG2-CG1 4.23Å; I470-V473 HydrophobicContact CG2-CG2 3.51Å; K471-V473 VanDerWaalsContact C-N 3.35Å; K471-V473 PolarHBondContact O-N 3.5Å; V473-F475 HydrophobicContact CG1-CD2 4.22Å; V473-F475 HydrophobicContact CG1-CE2 3.64Å; V473-F475 HydrophobicContact CG1-CZ 3.82Å; V473-T493 HydrophobicContact CB-CG2 4.36Å; V473-T493 PolarHBondContact N-OG1 2.84Å; V473-T493 WeakPolarHBondContact O-CA 3.29Å; V473-T493 VanDerWaalsContact O-CG2 3.31Å; V473-T493 WeakPolarHBondContact O-CG2 3.37Å; V473-F494 PolarHBondContact O-N 3.21Å; V473-F494 VanDerWaalsContact O-N 3.1Å
474	K	91.9	Very high	91.9	Very high	82 Å²	82	39.2 Å²	39.2	36%	0.357	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	131.8	173.8	-64.5	-177.4	-175.8	175.9	0	110.3	Q453 V454 H455 F494	Q453-K474 PolarHBondContact O-N 2.98Å; V454-K474 CarbonylContact C-O 3.58Å; V454-K474 WeakPolarHBondContact CA-O 3.41Å; V454-K474 HydrophobicContact CG1-CB 4.37Å; V454-K474 HydrophobicContact CG2-CB 4.35Å; H455-K474 PolarHBondContact N-O 2.88Å; K474-F494 WeakPolarHBondContact CA-O 3.18Å
475	F	94.4	Very high	91.9	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.009	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	118.7	168.2	-63.4	-84.3	0	0	0	107.7	L450 H455 Y460 V473 F480 F494 F495 E496 C498	L450-F475 HydrophobicContact CD1-CZ 4.48Å; H455-F475 HydrophobicContact CB-CD1 3.53Å; H455-F475 HydrophobicContact CB-CE1 3.84Å; H455-F475 HydrophobicContact CB-CG 4.45Å; H455-F475 AromaticContact CD2-CE1 3.53Å; H455-F475 AromaticContact CG-CD1 3.92Å; H455-F475 AromaticContact CG-CE1 3.68Å; Y460-F475 HydrophobicContact CE2-CD1 4.01Å; Y460-F475 HydrophobicContact CE2-CE1 4.04Å; Y460-F475 AromaticContact CZ-CE1 3.93Å; V473-F475 HydrophobicContact CG1-CD2 4.22Å; V473-F475 HydrophobicContact CG1-CE2 3.64Å; V473-F475 HydrophobicContact CG1-CZ 3.82Å; F475-F480 HydrophobicContact CB-CE2 4.29Å; F475-F480 HydrophobicContact CB-CZ 4.45Å; F475-F480 HydrophobicContact CD1-CE2 4.24Å; F475-F480 AromaticContact CD1-CZ 3.63Å; F475-F480 HydrophobicContact CD1-CZ 3.63Å; F475-F480 HydrophobicContact CD2-CZ 4.45Å; F475-F480 AromaticContact CE1-CZ 3.92Å; F475-F480 HydrophobicContact CE1-CZ 3.92Å; F475-F480 HydrophobicContact CG-CE2 4.26Å; F475-F480 AromaticContact CG-CZ 3.93Å; F475-F480 HydrophobicContact CG-CZ 3.93Å; F475-F480 HydrophobicContact CZ-CZ 4.44Å; F475-F494 PolarHBondContact N-O 2.9Å; F475-F495 HydrophobicContact CB-CD1 3.75Å; F475-F495 HydrophobicContact CB-CE1 4.12Å; F475-F495 HydrophobicContact CB-CG 4.44Å; F475-F495 AromaticContact CD2-CD1 3.75Å; F475-F495 HydrophobicContact CD2-CD1 3.75Å; F475-F495 AromaticContact CD2-CE1 3.32Å; F475-F495 HydrophobicContact CD2-CE1 3.32Å; F475-F495 HydrophobicContact CD2-CE2 4.27Å; F475-F495 HydrophobicContact CD2-CG 4.39Å; F475-F495 AromaticContact CD2-CZ 3.61Å; F475-F495 HydrophobicContact CD2-CZ 3.61Å; F475-F495 AromaticContact CE2-CE1 3.87Å; F475-F495 HydrophobicContact CE2-CE1 3.87Å; F475-F495 AromaticContact CE2-CZ 3.83Å; F475-F495 HydrophobicContact CE2-CZ 3.83Å; F475-F495 AromaticContact CG-CD1 3.98Å; F475-F495 HydrophobicContact CG-CD1 3.98Å; F475-F495 AromaticContact CG-CE1 3.81Å; F475-F495 HydrophobicContact CG-CE1 3.81Å; F475-E496 PolarHBondContact O-N 3.41Å; F475-C498 PolarHBondContact O-SG 3.41Å
476	E	94.9	Very high	91.8	Very high	36 Å²	36	37.9 Å²	37.9	17%	0.168	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	130.9	-177.3	-67.4	174.2	-178.9	0	0	108.5	H455 R456 E457 S478 E496	H455-E476 PolarHBondContact O-N 3.49Å; R456-E476 WeakPolarHBondContact CA-O 3.38Å; R456-E476 HydrophobicContact CG-CB 4.26Å; R456-E476 IonicContact CZ-OE2 3.13Å; R456-E476 IonicContact NE-OE2 2.69Å; R456-E476 PolarHBondContact NE-OE2 3.48Å; R456-E476 IonicContact NH2-OE2 2.74Å; R456-E476 PolarHBondContact NH2-OE2 2.89Å; E457-E476 PolarHBondContact N-O 2.84Å; E476-S478 PolarHBondContact O-N 2.89Å; E476-S478 PolarHBondContact O-OG 3.44Å; E476-E496 WeakPolarHBondContact CA-O 3.37Å
477	D	94.9	Very high	91.6	Very high	89 Å²	89	39.8 Å²	39.8	48%	0.476	20%	0.196	S	C	.	.	S	Bend	trans	52.4	30.4	175.9	-62.1	-47.2	0	0	0	114.1	E457 E496 N497	E457-D477 WeakPolarHBondContact CA-O 3.44Å; E457-D477 HydrophobicContact CG-CB 4.31Å; D477-E496 PolarHBondContact N-O 3.37Å; D477-E496 VanDerWaalsContact N-O 3.08Å; D477-N497 WeakPolarHBondContact OD1-CB 3.34Å; D477-N497 PolarHBondContact OD1-ND2 3.42Å
478	S	95.6	Very high	91.6	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.014	17%	0.165	C	C	.	.			trans	-100.9	149	-171.3	-60.6	0	0	0	0	112.6	G458 E476 C498 T499	G458-S478 PolarHBondContact N-OG 2.9Å; G458-S478 CarbonylContact O-C 3.54Å; G458-S478 WeakPolarHBondContact O-CA 3.39Å; G458-S478 WeakPolarHBondContact O-CB 3.08Å; E476-S478 PolarHBondContact O-N 2.89Å; E476-S478 PolarHBondContact O-OG 3.44Å; S478-C498 CarbonylContact O-C 3.54Å; S478-C498 WeakPolarHBondContact O-CA 3.46Å; S478-C498 VanDerWaalsContact O-CB 3.32Å; S478-C498 WeakPolarHBondContact O-CB 3.43Å; S478-T499 PolarHBondContact O-N 3.34Å
479	L	95.5	Very high	91.3	Very high	45 Å²	45	40.2 Å²	40.2	24%	0.236	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	127	176.8	176.2	65.8	0	0	0	110.1	G458 E459 Y460 T499	G458-L479 PolarHBondContact O-N 3.11Å; E459-L479 HydrophobicContact CG-CB 4.48Å; Y460-L479 PolarHBondContact N-O 3.08Å; L479-T499 WeakPolarHBondContact CA-O 3.47Å; L479-T499 HydrophobicContact CD1-CG2 3.93Å
480	F	95.9	Very high	91	Very high	1 Å²	1	36.4 Å²	36.4	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	114.2	168.7	-68.1	-92.6	0	0	0	108.5	Y460 F465 F475 F485 F495 T499 I500 K501	Y460-F480 HydrophobicContact CD1-CE1 4.45Å; Y460-F480 AromaticContact CD2-CD1 3.86Å; Y460-F480 HydrophobicContact CD2-CD1 3.86Å; Y460-F480 HydrophobicContact CD2-CD2 4.46Å; Y460-F480 AromaticContact CD2-CE1 3.34Å; Y460-F480 HydrophobicContact CD2-CE1 3.34Å; Y460-F480 HydrophobicContact CD2-CE2 4.01Å; Y460-F480 HydrophobicContact CD2-CG 4.38Å; Y460-F480 AromaticContact CD2-CZ 3.43Å; Y460-F480 HydrophobicContact CD2-CZ 3.43Å; Y460-F480 VanDerWaalsContact CD2-CZ 3.43Å; Y460-F480 AromaticContact CE2-CE1 3.98Å; Y460-F480 HydrophobicContact CE2-CE1 3.98Å; Y460-F480 HydrophobicContact CE2-CE2 4.36Å; Y460-F480 AromaticContact CE2-CZ 3.69Å; Y460-F480 HydrophobicContact CE2-CZ 3.69Å; Y460-F480 AromaticContact CG-CD1 3.97Å; Y460-F480 HydrophobicContact CG-CD1 3.97Å; Y460-F480 AromaticContact CG-CE1 3.62Å; Y460-F480 HydrophobicContact CG-CE1 3.62Å; Y460-F480 HydrophobicContact CG-CZ 4.18Å; Y460-F480 WeakPolarHBondContact O-CA 3.13Å; F465-F480 HydrophobicContact CE2-CE1 4.32Å; F465-F480 HydrophobicContact CZ-CE1 4.18Å; F475-F480 HydrophobicContact CB-CE2 4.29Å; F475-F480 HydrophobicContact CB-CZ 4.45Å; F475-F480 HydrophobicContact CD1-CE2 4.24Å; F475-F480 AromaticContact CD1-CZ 3.63Å; F475-F480 HydrophobicContact CD1-CZ 3.63Å; F475-F480 HydrophobicContact CD2-CZ 4.45Å; F475-F480 AromaticContact CE1-CZ 3.92Å; F475-F480 HydrophobicContact CE1-CZ 3.92Å; F475-F480 HydrophobicContact CG-CE2 4.26Å; F475-F480 AromaticContact CG-CZ 3.93Å; F475-F480 HydrophobicContact CG-CZ 3.93Å; F475-F480 HydrophobicContact CZ-CZ 4.44Å; F480-F485 HydrophobicContact CD1-CE2 4.25Å; F480-F485 AromaticContact CD1-CZ 3.76Å; F480-F485 HydrophobicContact CD1-CZ 3.76Å; F480-F485 AromaticContact CE1-CZ 3.85Å; F480-F485 HydrophobicContact CE1-CZ 3.85Å; F480-F495 HydrophobicContact CE1-CE1 4.46Å; F480-F495 AromaticContact CE2-CD1 3.89Å; F480-F495 HydrophobicContact CE2-CD1 3.89Å; F480-F495 AromaticContact CE2-CE1 3.75Å; F480-F495 HydrophobicContact CE2-CE1 3.75Å; F480-F495 HydrophobicContact CZ-CD1 4.31Å; F480-F495 AromaticContact CZ-CE1 3.72Å; F480-F495 HydrophobicContact CZ-CE1 3.72Å; F480-T499 PolarHBondContact N-O 3.46Å; F480-I500 HydrophobicContact CB-CG1 4.36Å; F480-I500 HydrophobicContact CB-CG2 4.47Å; F480-I500 HydrophobicContact CD2-CG1 4.36Å; F480-I500 CarbonylContact O-C 3.58Å; F480-I500 WeakPolarHBondContact O-CA 3.18Å; F480-K501 PolarHBondContact O-N 3.46Å
481	E	95.6	Very high	90.5	Very high	65 Å²	65	37.1 Å²	37.1	30%	0.304	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125.2	-178.8	-175.4	173.4	-173.2	0	0	111.2	Y460 I461 H462 C483 K501	Y460-E481 PolarHBondContact O-N 2.85Å; I461-E481 WeakPolarHBondContact CA-O 3.26Å; I461-E481 HydrophobicContact CG2-CB 4.34Å; H462-E481 PolarHBondContact N-O 3.24Å; E481-C483 VanDerWaalsContact C-N 3.27Å; E481-C483 PolarHBondContact O-N 3.14Å; E481-K501 WeakPolarHBondContact CA-O 3.46Å; E481-K501 HydrophobicContact CG-CB 4.38Å
482	N	95.5	Very high	90.1	Very high	57 Å²	57	38.8 Å²	38.8	31%	0.305	19%	0.186	S	C	.	.	S	Bend	trans	58.1	35.3	-179	-54.9	-37.6	0	0	0	113.3	H462 K501 N502	H462-N482 WeakPolarHBondContact CA-O 3.23Å; H462-N482 PolarHBondContact NE2-ND2 3.42Å; N482-K501 PolarHBondContact N-O 3.29Å; N482-N502 WeakPolarHBondContact CA-O 3.17Å; N482-N502 WeakPolarHBondContact OD1-CB 3.31Å; N482-N502 PolarHBondContact OD1-ND2 3.06Å
483	C	94.4	Very high	90.1	Very high	4 Å²	4	37.5 Å²	37.5	3%	0.027	18%	0.177	C	C	.	.			trans	-91	157.3	-178.3	-64.8	0	0	0	0	113	Y460 D463 E481 F485 T503 V504	Y460-C483 PolarHBondContact O-SG 3.36Å; Y460-C483 VanDerWaalsContact O-SG 3.36Å; D463-C483 CarbonylContact O-C 3.56Å; D463-C483 WeakPolarHBondContact O-CA 3.19Å; E481-C483 VanDerWaalsContact C-N 3.27Å; E481-C483 PolarHBondContact O-N 3.14Å; C483-F485 HydrophobicContact CB-CD2 4.41Å; C483-F485 HydrophobicContact CB-CE2 3.78Å; C483-T503 HydrophobicContact CB-CG2 4.06Å; C483-T503 PolarHBondContact N-OG1 2.89Å; C483-T503 VanDerWaalsContact O-CA 3.27Å; C483-T503 WeakPolarHBondContact O-CA 3.24Å; C483-T503 WeakPolarHBondContact O-CG2 3.43Å; C483-V504 PolarHBondContact O-N 3.24Å; C483-V504 VanDerWaalsContact O-N 3.09Å
484	Y	94.4	Very high	90.1	Very high	79 Å²	79	39.7 Å²	39.7	31%	0.31	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	118.2	178.8	-161.5	-94.5	0	0	0	111.5	D463 K464 F465 E486 V504	D463-Y484 PolarHBondContact O-N 2.97Å; K464-Y484 CarbonylContact C-O 3.59Å; K464-Y484 WeakPolarHBondContact CA-O 3.34Å; K464-Y484 HydrophobicContact CD-CD1 4.3Å; K464-Y484 HydrophobicContact CG-CD1 4.37Å; F465-Y484 PolarHBondContact N-O 3.35Å; Y484-E486 HydrophobicContact CD1-CB 4.11Å; Y484-E486 HydrophobicContact CE1-CB 3.89Å; Y484-E486 HydrophobicContact CE1-CG 4.39Å; Y484-V504 HydrophobicContact CD2-CB 3.63Å; Y484-V504 HydrophobicContact CD2-CG1 4.16Å; Y484-V504 HydrophobicContact CD2-CG2 4.19Å; Y484-V504 HydrophobicContact CE2-CB 3.64Å; Y484-V504 HydrophobicContact CE2-CG1 3.64Å; Y484-V504 HydrophobicContact CE2-CG2 4.22Å
485	F	94.1	Very high	90.2	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.009	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	117.3	-179.3	-68.3	-100.6	0	0	0	109.3	F465 F480 C483 I488 T503 V504 F505 Y506 T508 L510	F465-F485 HydrophobicContact CB-CD1 3.78Å; F465-F485 HydrophobicContact CB-CE1 4.13Å; F465-F485 HydrophobicContact CB-CG 4.33Å; F465-F485 HydrophobicContact CD1-CE1 4.22Å; F465-F485 AromaticContact CD2-CD1 3.87Å; F465-F485 HydrophobicContact CD2-CD1 3.87Å; F465-F485 HydrophobicContact CD2-CD2 4.43Å; F465-F485 AromaticContact CD2-CE1 3.47Å; F465-F485 HydrophobicContact CD2-CE1 3.47Å; F465-F485 VanDerWaalsContact CD2-CE1 3.47Å; F465-F485 HydrophobicContact CD2-CE2 4.1Å; F465-F485 HydrophobicContact CD2-CG 4.33Å; F465-F485 AromaticContact CD2-CZ 3.6Å; F465-F485 HydrophobicContact CD2-CZ 3.6Å; F465-F485 AromaticContact CE2-CE1 3.86Å; F465-F485 HydrophobicContact CE2-CE1 3.86Å; F465-F485 HydrophobicContact CE2-CE2 4.33Å; F465-F485 AromaticContact CE2-CZ 3.66Å; F465-F485 HydrophobicContact CE2-CZ 3.66Å; F465-F485 AromaticContact CG-CD1 3.88Å; F465-F485 HydrophobicContact CG-CD1 3.88Å; F465-F485 AromaticContact CG-CE1 3.68Å; F465-F485 HydrophobicContact CG-CE1 3.68Å; F465-F485 HydrophobicContact CG-CZ 4.29Å; F465-F485 HydrophobicContact CZ-CE1 4.38Å; F465-F485 HydrophobicContact CZ-CZ 4.38Å; F465-F485 CarbonylContact O-C 3.57Å; F465-F485 WeakPolarHBondContact O-CA 3.48Å; F480-F485 HydrophobicContact CD1-CE2 4.25Å; F480-F485 AromaticContact CD1-CZ 3.76Å; F480-F485 HydrophobicContact CD1-CZ 3.76Å; F480-F485 AromaticContact CE1-CZ 3.85Å; F480-F485 HydrophobicContact CE1-CZ 3.85Å; C483-F485 HydrophobicContact CB-CD2 4.41Å; C483-F485 HydrophobicContact CB-CE2 3.78Å; F485-I488 HydrophobicContact CB-CD1 3.59Å; F485-I488 HydrophobicContact CD1-CD1 3.31Å; F485-I488 HydrophobicContact CE1-CD1 4.39Å; F485-I488 HydrophobicContact CG-CD1 3.89Å; F485-T503 HydrophobicContact CD2-CG2 3.57Å; F485-T503 HydrophobicContact CE2-CG2 3.57Å; F485-V504 PolarHBondContact N-O 3.39Å; F485-F505 HydrophobicContact CB-CD1 3.47Å; F485-F505 VanDerWaalsContact CB-CD1 3.47Å; F485-F505 HydrophobicContact CB-CE1 3.85Å; F485-F505 HydrophobicContact CB-CG 4.29Å; F485-F505 HydrophobicContact CD1-CD1 4.4Å; F485-F505 AromaticContact CD1-CE1 3.95Å; F485-F505 HydrophobicContact CD1-CE1 3.95Å; F485-F505 AromaticContact CD2-CD1 3.92Å; F485-F505 HydrophobicContact CD2-CD1 3.92Å; F485-F505 AromaticContact CD2-CE1 3.47Å; F485-F505 HydrophobicContact CD2-CE1 3.47Å; F485-F505 VanDerWaalsContact CD2-CE1 3.47Å; F485-F505 AromaticContact CD2-CZ 3.9Å; F485-F505 HydrophobicContact CD2-CZ 3.9Å; F485-F505 HydrophobicContact CE1-CE1 4.4Å; F485-F505 AromaticContact CE2-CE1 3.95Å; F485-F505 HydrophobicContact CE2-CE1 3.95Å; F485-F505 HydrophobicContact CE2-CZ 4.08Å; F485-F505 AromaticContact CG-CD1 3.7Å; F485-F505 HydrophobicContact CG-CD1 3.7Å; F485-F505 AromaticContact CG-CE1 3.48Å; F485-F505 HydrophobicContact CG-CE1 3.48Å; F485-F505 VanDerWaalsContact CG-CE1 3.48Å; F485-F505 HydrophobicContact CG-CZ 4.36Å; F485-F505 HydrophobicContact CZ-CE1 4.4Å; F485-F505 CarbonylContact O-C 3.58Å; F485-F505 WeakPolarHBondContact O-CA 3.28Å; F485-Y506 PolarHBondContact O-N 3.44Å; F485-T508 HydrophobicContact CB-CG2 4.26Å; F485-L510 HydrophobicContact CD1-CD1 4.24Å
486	E	92.6	Very high	90.2	Very high	45 Å²	45	38.2 Å²	38.2	21%	0.21	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	129.1	-172.8	-177.9	173.7	-161.7	0	0	110.8	K464 F465 A466 N467 Y484 I488 Y506	K464-E486 WeakPolarHBondContact CE-OE2 3.14Å; K464-E486 IonicContact NZ-OE2 3.78Å; K464-E486 PolarHBondContact NZ-OE2 2.9Å; F465-E486 PolarHBondContact O-N 3.21Å; A466-E486 WeakPolarHBondContact CA-O 3.07Å; A466-E486 HydrophobicContact CB-CB 4.13Å; N467-E486 PolarHBondContact N-O 2.96Å; Y484-E486 HydrophobicContact CD1-CB 4.11Å; Y484-E486 HydrophobicContact CE1-CB 3.89Å; Y484-E486 HydrophobicContact CE1-CG 4.39Å; E486-I488 VanDerWaalsContact C-N 3.34Å; E486-I488 WeakPolarHBondContact O-CG1 3.35Å; E486-I488 PolarHBondContact O-N 3.21Å; E486-Y506 WeakPolarHBondContact CA-O 3.34Å; E486-Y506 HydrophobicContact CG-CD1 4.16Å
487	D	88.2	Confident	90.2	Very high	47 Å²	47	41.2 Å²	41.2	25%	0.251	20%	0.198	S	C	.	.	S	Bend	trans	54.1	45.8	173.3	-76.5	-44.9	0	0	0	114.4	N467 Y506 N507	N467-D487 VanDerWaalsContact OD1-CB 3.28Å; N467-D487 WeakPolarHBondContact OD1-CB 3.3Å; D487-Y506 PolarHBondContact N-O 3.5Å; D487-N507 WeakPolarHBondContact OD1-CB 3.25Å; D487-N507 PolarHBondContact OD1-ND2 3.33Å
488	I	86.3	Confident	90.2	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.175	C	C	.	.			trans	-93	138.9	-177.3	-59.1	-175.8	0	0	0	111.4	F465 I468 I470 F485 E486 T508 D509 L510	F465-I488 HydrophobicContact CB-CD1 3.8Å; I468-I488 HydrophobicContact CD1-CD1 4.44Å; I468-I488 HydrophobicContact CG1-CD1 4.24Å; I468-I488 HydrophobicContact CG1-CG1 4.03Å; I470-I488 HydrophobicContact CD1-CG2 3.79Å; I470-I488 HydrophobicContact CG1-CG2 4.05Å; F485-I488 HydrophobicContact CB-CD1 3.59Å; F485-I488 HydrophobicContact CD1-CD1 3.31Å; F485-I488 HydrophobicContact CE1-CD1 4.39Å; F485-I488 HydrophobicContact CG-CD1 3.89Å; E486-I488 VanDerWaalsContact C-N 3.34Å; E486-I488 WeakPolarHBondContact O-CG1 3.35Å; E486-I488 PolarHBondContact O-N 3.21Å; I488-T508 HydrophobicContact CB-CG2 3.79Å; I488-T508 HydrophobicContact CD1-CG2 4.33Å; I488-T508 HydrophobicContact CG1-CG2 4Å; I488-D509 PolarHBondContact O-N 2.94Å; I488-L510 HydrophobicContact CD1-CD1 4.42Å; I488-L510 HydrophobicContact CG2-CD1 4.18Å; I488-L510 HydrophobicContact CG2-CG 4.49Å
489	R	82.4	Confident	90.2	Very high	136 Å²	136	38.9 Å²	38.9	51%	0.513	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	124.8	169.1	-59.5	-179.5	-170.7	179.7	2.5	109	I468 E469 I470 D509	I468-R489 PolarHBondContact O-N 2.87Å; E469-R489 CarbonylContact C-O 3.57Å; E469-R489 WeakPolarHBondContact CA-O 3.24Å; E469-R489 HydrophobicContact CG-CB 4.32Å; I470-R489 PolarHBondContact N-O 3.4Å; R489-D509 WeakPolarHBondContact CA-OD2 3.48Å
490	S	79.8	Confident	90.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	116.9	-172	71.2	0	0	0	0	113.1	I470 D509 L510 K514 L534	I470-S490 CarbonylContact O-C 3.47Å; I470-S490 VanDerWaalsContact O-CA 3.28Å; I470-S490 WeakPolarHBondContact O-CA 3.39Å; S490-D509 VanDerWaalsContact CB-OD1 3.28Å; S490-D509 WeakPolarHBondContact CB-OD1 3.4Å; S490-D509 VanDerWaalsContact N-CG 3.27Å; S490-D509 PolarHBondContact N-OD1 2.98Å; S490-D509 PolarHBondContact N-OD2 2.89Å; S490-D509 VanDerWaalsContact OG-CG 3.28Å; S490-D509 PolarHBondContact OG-OD1 2.73Å; S490-L510 VanDerWaalsContact OG-CD2 3.3Å; S490-L510 WeakPolarHBondContact OG-CD2 3.47Å; S490-K514 PolarHBondContact O-NZ 3.29Å; S490-L534 VanDerWaalsContact O-CD2 3.31Å; S490-L534 WeakPolarHBondContact O-CD2 3.27Å
491	T	76.4	Confident	90.1	Very high	16 Å²	16	39.6 Å²	39.6	10%	0.098	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.3	178.6	-53.8	0	0	0	0	109.2	I470 K471 S472 T493 F536	I470-T491 PolarHBondContact O-N 2.85Å; K471-T491 WeakPolarHBondContact CA-O 3.25Å; K471-T491 HydrophobicContact CG-CG2 4.46Å; S472-T491 PolarHBondContact N-O 2.64Å; T491-T493 PolarHBondContact O-N 2.97Å; T491-T493 PolarHBondContact O-OG1 2.84Å; T491-F536 HydrophobicContact CG2-CD1 3.85Å; T491-F536 HydrophobicContact CG2-CE1 3.41Å; T491-F536 VanDerWaalsContact CG2-CE1 3.41Å; T491-F536 HydrophobicContact CG2-CZ 4.49Å; T491-F536 WeakPolarHBondContact OG1-CE1 3.41Å
492	N	75.2	Confident	90.1	Very high	80 Å²	80	40 Å²	40	43%	0.428	19%	0.192	S	C	.	.	S	Bend	trans	46	35.9	179.2	-161	30.3	0	0	0	114.7	S472 F494	S472-N492 WeakPolarHBondContact CA-O 3.17Å; N492-F494 WeakPolarHBondContact OD1-CE2 3.19Å
493	T	85.5	Confident	90	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.178	C	C	.	.			trans	-108.1	136.1	-174.4	-66.4	0	0	0	0	110.3	I470 V473 T491 F495 K514	I470-T493 HydrophobicContact CB-CG2 4.45Å; I470-T493 HydrophobicContact CG2-CG2 3.66Å; I470-T493 WeakPolarHBondContact CG2-OG1 3.29Å; I470-T493 PolarHBondContact O-OG1 3.47Å; V473-T493 HydrophobicContact CB-CG2 4.36Å; V473-T493 PolarHBondContact N-OG1 2.84Å; V473-T493 WeakPolarHBondContact O-CA 3.29Å; V473-T493 VanDerWaalsContact O-CG2 3.31Å; V473-T493 WeakPolarHBondContact O-CG2 3.37Å; T491-T493 PolarHBondContact O-N 2.97Å; T491-T493 PolarHBondContact O-OG1 2.84Å; T493-F495 HydrophobicContact CG2-CE2 4.33Å; T493-K514 WeakPolarHBondContact O-CD 3.49Å
494	F	89.3	Confident	90	Very high	45 Å²	45	38.6 Å²	38.6	20%	0.197	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	144.5	-176.9	-60.5	-80.8	0	0	0	112	V473 K474 F475 N492 E496	V473-F494 PolarHBondContact O-N 3.21Å; V473-F494 VanDerWaalsContact O-N 3.1Å; K474-F494 WeakPolarHBondContact CA-O 3.18Å; F475-F494 PolarHBondContact N-O 2.9Å; N492-F494 WeakPolarHBondContact OD1-CE2 3.19Å; F494-E496 HydrophobicContact CB-CG 4.23Å
495	F	93.3	Very high	90	Very high	1 Å²	1	34.9 Å²	34.9	0%	0.004	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	118.8	169	-64.8	-100.2	0	0	0	107.3	F475 F480 T493 C498 L510 K514 F515 K516 C518	F475-F495 HydrophobicContact CB-CD1 3.75Å; F475-F495 HydrophobicContact CB-CE1 4.12Å; F475-F495 HydrophobicContact CB-CG 4.44Å; F475-F495 AromaticContact CD2-CD1 3.75Å; F475-F495 HydrophobicContact CD2-CD1 3.75Å; F475-F495 AromaticContact CD2-CE1 3.32Å; F475-F495 HydrophobicContact CD2-CE1 3.32Å; F475-F495 HydrophobicContact CD2-CE2 4.27Å; F475-F495 HydrophobicContact CD2-CG 4.39Å; F475-F495 AromaticContact CD2-CZ 3.61Å; F475-F495 HydrophobicContact CD2-CZ 3.61Å; F475-F495 AromaticContact CE2-CE1 3.87Å; F475-F495 HydrophobicContact CE2-CE1 3.87Å; F475-F495 AromaticContact CE2-CZ 3.83Å; F475-F495 HydrophobicContact CE2-CZ 3.83Å; F475-F495 AromaticContact CG-CD1 3.98Å; F475-F495 HydrophobicContact CG-CD1 3.98Å; F475-F495 AromaticContact CG-CE1 3.81Å; F475-F495 HydrophobicContact CG-CE1 3.81Å; F480-F495 HydrophobicContact CE1-CE1 4.46Å; F480-F495 AromaticContact CE2-CD1 3.89Å; F480-F495 HydrophobicContact CE2-CD1 3.89Å; F480-F495 AromaticContact CE2-CE1 3.75Å; F480-F495 HydrophobicContact CE2-CE1 3.75Å; F480-F495 HydrophobicContact CZ-CD1 4.31Å; F480-F495 AromaticContact CZ-CE1 3.72Å; F480-F495 HydrophobicContact CZ-CE1 3.72Å; T493-F495 HydrophobicContact CG2-CE2 4.33Å; F495-C498 HydrophobicContact CB-CB 4.44Å; F495-L510 HydrophobicContact CE2-CD1 4.15Å; F495-L510 HydrophobicContact CE2-CD2 3.87Å; F495-L510 HydrophobicContact CZ-CD1 4.38Å; F495-K514 PolarHBondContact N-O 3.27Å; F495-F515 HydrophobicContact CB-CD1 3.56Å; F495-F515 HydrophobicContact CB-CE1 4Å; F495-F515 HydrophobicContact CB-CG 4.47Å; F495-F515 HydrophobicContact CD1-CE1 4.25Å; F495-F515 AromaticContact CD2-CD1 3.96Å; F495-F515 HydrophobicContact CD2-CD1 3.96Å; F495-F515 AromaticContact CD2-CE1 3.62Å; F495-F515 HydrophobicContact CD2-CE1 3.62Å; F495-F515 HydrophobicContact CD2-CZ 4.28Å; F495-F515 HydrophobicContact CE2-CE1 4.16Å; F495-F515 AromaticContact CG-CD1 3.8Å; F495-F515 HydrophobicContact CG-CD1 3.8Å; F495-F515 AromaticContact CG-CE1 3.69Å; F495-F515 HydrophobicContact CG-CE1 3.69Å; F495-F515 CarbonylContact O-C 3.53Å; F495-F515 WeakPolarHBondContact O-CA 3.39Å; F495-K516 PolarHBondContact O-N 3.38Å; F495-C518 PolarHBondContact O-SG 3.21Å
496	E	93.9	Very high	89.9	Confident	53 Å²	53	38.7 Å²	38.7	25%	0.248	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	125.8	-175.3	-55.6	-164.1	164.7	0	0	109.4	F475 E476 D477 F494 C498 K516	F475-E496 PolarHBondContact O-N 3.41Å; E476-E496 WeakPolarHBondContact CA-O 3.37Å; D477-E496 PolarHBondContact N-O 3.37Å; D477-E496 VanDerWaalsContact N-O 3.08Å; F494-E496 HydrophobicContact CB-CG 4.23Å; E496-C498 PolarHBondContact O-N 2.89Å; E496-C498 PolarHBondContact O-SG 3.4Å; E496-C498 VanDerWaalsContact O-SG 3.36Å; E496-K516 WeakPolarHBondContact CA-O 3.28Å; E496-K516 HydrophobicContact CG-CB 4.26Å; E496-K516 HydrophobicContact CG-CD 4.31Å; E496-K516 WeakPolarHBondContact OE1-CD 3.5Å; E496-K516 IonicContact OE1-NZ 3.83Å; E496-K516 PolarHBondContact OE1-NZ 3.12Å
497	N	95.1	Very high	89.6	Confident	98 Å²	98	38.8 Å²	38.8	52%	0.524	19%	0.188	S	C	.	.	S	Bend	trans	53.4	26.9	-178.7	-154.3	29.7	0	0	0	114.7	D477 K516	D477-N497 WeakPolarHBondContact OD1-CB 3.34Å; D477-N497 PolarHBondContact OD1-ND2 3.42Å; N497-K516 PolarHBondContact N-O 3.01Å
498	C	94.6	Very high	89.5	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.177	C	C	.	.			trans	-83.4	149.9	-178.6	-65.6	0	0	0	0	111.8	F475 S478 F495 E496 C518 R519	F475-C498 PolarHBondContact O-SG 3.41Å; S478-C498 CarbonylContact O-C 3.54Å; S478-C498 WeakPolarHBondContact O-CA 3.46Å; S478-C498 VanDerWaalsContact O-CB 3.32Å; S478-C498 WeakPolarHBondContact O-CB 3.43Å; F495-C498 HydrophobicContact CB-CB 4.44Å; E496-C498 PolarHBondContact O-N 2.89Å; E496-C498 PolarHBondContact O-SG 3.4Å; E496-C498 VanDerWaalsContact O-SG 3.36Å; C498-C518 CarbonylContact O-C 3.53Å; C498-C518 WeakPolarHBondContact O-CA 3.27Å; C498-C518 WeakPolarHBondContact O-CB 3.47Å; C498-R519 PolarHBondContact O-N 2.87Å
499	T	95.2	Very high	89.2	Confident	43 Å²	43	37.8 Å²	37.8	26%	0.264	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.1	170.7	-60.3	0	0	0	0	109.1	S478 L479 F480 K501 R519	S478-T499 PolarHBondContact O-N 3.34Å; L479-T499 WeakPolarHBondContact CA-O 3.47Å; L479-T499 HydrophobicContact CD1-CG2 3.93Å; F480-T499 PolarHBondContact N-O 3.46Å; T499-K501 HydrophobicContact CG2-CD 4.32Å; T499-K501 VanDerWaalsContact CG2-CE 3.46Å; T499-K501 HydrophobicContact CG2-CG 3.95Å; T499-R519 WeakPolarHBondContact CA-O 3.32Å
500	I	95.4	Very high	89.4	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	115.6	-176.6	-58	172.2	0	0	0	108	F480 T503 F505 F515 R519 M520 E521 T523	F480-I500 HydrophobicContact CB-CG1 4.36Å; F480-I500 HydrophobicContact CB-CG2 4.47Å; F480-I500 HydrophobicContact CD2-CG1 4.36Å; F480-I500 CarbonylContact O-C 3.58Å; F480-I500 WeakPolarHBondContact O-CA 3.18Å; I500-T503 HydrophobicContact CG2-CG2 3.98Å; I500-F505 HydrophobicContact CG2-CE2 4.35Å; I500-F515 HydrophobicContact CD1-CD1 3.55Å; I500-F515 HydrophobicContact CD1-CE1 3.32Å; I500-F515 HydrophobicContact CD1-CZ 4.32Å; I500-R519 PolarHBondContact N-O 3.37Å; I500-M520 HydrophobicContact CB-CG 4.49Å; I500-M520 HydrophobicContact CD1-CE 4.39Å; I500-M520 CarbonylContact O-C 3.55Å; I500-M520 WeakPolarHBondContact O-CA 3.33Å; I500-E521 PolarHBondContact O-N 3.05Å; I500-T523 HydrophobicContact CG2-CG2 4.25Å
501	K	95.1	Very high	89.6	Confident	60 Å²	60	34.5 Å²	34.5	26%	0.261	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	137.3	-176.5	-55.2	-162.5	179.6	-151.8	0	111.3	F480 E481 N482 T499 T503 E521	F480-K501 PolarHBondContact O-N 3.46Å; E481-K501 WeakPolarHBondContact CA-O 3.46Å; E481-K501 HydrophobicContact CG-CB 4.38Å; N482-K501 PolarHBondContact N-O 3.29Å; T499-K501 HydrophobicContact CG2-CD 4.32Å; T499-K501 VanDerWaalsContact CG2-CE 3.46Å; T499-K501 HydrophobicContact CG2-CG 3.95Å; K501-T503 PolarHBondContact O-N 3.46Å; K501-T503 PolarHBondContact O-OG1 2.98Å; K501-E521 CarbonylContact C-O 3.59Å; K501-E521 VanDerWaalsContact CA-O 3.29Å; K501-E521 WeakPolarHBondContact CA-O 3.34Å; K501-E521 WeakPolarHBondContact CD-OE2 3.31Å; K501-E521 WeakPolarHBondContact CE-OE2 3.36Å; K501-E521 HydrophobicContact CG-CB 4.22Å; K501-E521 IonicContact NZ-OE1 3.34Å; K501-E521 IonicContact NZ-OE2 3.1Å; K501-E521 PolarHBondContact NZ-OE2 3.27Å
502	N	94.8	Very high	89.8	Confident	72 Å²	72	40.3 Å²	40.3	39%	0.385	20%	0.197	S	C	.	.	S	Bend	trans	49	37.3	173.2	-62.5	-29.1	0	0	0	113.4	N482 E521 N522	N482-N502 WeakPolarHBondContact CA-O 3.17Å; N482-N502 WeakPolarHBondContact OD1-CB 3.31Å; N482-N502 PolarHBondContact OD1-ND2 3.06Å; N502-E521 PolarHBondContact N-O 3.34Å; N502-N522 WeakPolarHBondContact CA-O 3.35Å; N502-N522 WeakPolarHBondContact OD1-CB 3.39Å; N502-N522 PolarHBondContact OD1-ND2 2.74Å
503	T	94.4	Very high	90.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.214	C	C	.	.			trans	-107.5	142	-171.9	-66	0	0	0	0	110.6	C483 F485 I500 K501 F505 T523 T524	C483-T503 HydrophobicContact CB-CG2 4.06Å; C483-T503 PolarHBondContact N-OG1 2.89Å; C483-T503 VanDerWaalsContact O-CA 3.27Å; C483-T503 WeakPolarHBondContact O-CA 3.24Å; C483-T503 WeakPolarHBondContact O-CG2 3.43Å; F485-T503 HydrophobicContact CD2-CG2 3.57Å; F485-T503 HydrophobicContact CE2-CG2 3.57Å; I500-T503 HydrophobicContact CG2-CG2 3.98Å; K501-T503 PolarHBondContact O-N 3.46Å; K501-T503 PolarHBondContact O-OG1 2.98Å; T503-F505 HydrophobicContact CG2-CD2 4.3Å; T503-F505 HydrophobicContact CG2-CE2 3.71Å; T503-F505 HydrophobicContact CG2-CZ 3.88Å; T503-T523 WeakPolarHBondContact O-CA 3.41Å; T503-T523 WeakPolarHBondContact O-CG2 3.3Å; T503-T524 PolarHBondContact O-N 3.4Å
504	V	94.6	Very high	90.1	Very high	33 Å²	33	46.3 Å²	46.3	20%	0.2	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.9	178.7	-175.6	0	0	0	0	110.1	C483 Y484 F485 T524 L526	C483-V504 PolarHBondContact O-N 3.24Å; C483-V504 VanDerWaalsContact O-N 3.09Å; Y484-V504 HydrophobicContact CD2-CB 3.63Å; Y484-V504 HydrophobicContact CD2-CG1 4.16Å; Y484-V504 HydrophobicContact CD2-CG2 4.19Å; Y484-V504 HydrophobicContact CE2-CB 3.64Å; Y484-V504 HydrophobicContact CE2-CG1 3.64Å; Y484-V504 HydrophobicContact CE2-CG2 4.22Å; F485-V504 PolarHBondContact N-O 3.39Å; V504-T524 WeakPolarHBondContact CA-O 3.27Å; V504-L526 HydrophobicContact CG1-CD1 4.23Å
505	F	93.1	Very high	90.1	Very high	1 Å²	1	45 Å²	45	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	114.8	171.9	-65.2	-86.3	0	0	0	109.3	F485 I500 T503 L510 F515 T523 T524 F525 L526	F485-F505 HydrophobicContact CB-CD1 3.47Å; F485-F505 VanDerWaalsContact CB-CD1 3.47Å; F485-F505 HydrophobicContact CB-CE1 3.85Å; F485-F505 HydrophobicContact CB-CG 4.29Å; F485-F505 HydrophobicContact CD1-CD1 4.4Å; F485-F505 AromaticContact CD1-CE1 3.95Å; F485-F505 HydrophobicContact CD1-CE1 3.95Å; F485-F505 AromaticContact CD2-CD1 3.92Å; F485-F505 HydrophobicContact CD2-CD1 3.92Å; F485-F505 AromaticContact CD2-CE1 3.47Å; F485-F505 HydrophobicContact CD2-CE1 3.47Å; F485-F505 VanDerWaalsContact CD2-CE1 3.47Å; F485-F505 AromaticContact CD2-CZ 3.9Å; F485-F505 HydrophobicContact CD2-CZ 3.9Å; F485-F505 HydrophobicContact CE1-CE1 4.4Å; F485-F505 AromaticContact CE2-CE1 3.95Å; F485-F505 HydrophobicContact CE2-CE1 3.95Å; F485-F505 HydrophobicContact CE2-CZ 4.08Å; F485-F505 AromaticContact CG-CD1 3.7Å; F485-F505 HydrophobicContact CG-CD1 3.7Å; F485-F505 AromaticContact CG-CE1 3.48Å; F485-F505 HydrophobicContact CG-CE1 3.48Å; F485-F505 VanDerWaalsContact CG-CE1 3.48Å; F485-F505 HydrophobicContact CG-CZ 4.36Å; F485-F505 HydrophobicContact CZ-CE1 4.4Å; F485-F505 CarbonylContact O-C 3.58Å; F485-F505 WeakPolarHBondContact O-CA 3.28Å; I500-F505 HydrophobicContact CG2-CE2 4.35Å; T503-F505 HydrophobicContact CG2-CD2 4.3Å; T503-F505 HydrophobicContact CG2-CE2 3.71Å; T503-F505 HydrophobicContact CG2-CZ 3.88Å; F505-L510 HydrophobicContact CD1-CB 4.29Å; F505-L510 HydrophobicContact CD1-CD1 4.26Å; F505-L510 HydrophobicContact CE1-CB 4.4Å; F505-L510 HydrophobicContact CE1-CD1 3.99Å; F505-F515 HydrophobicContact CE1-CZ 4.09Å; F505-F515 HydrophobicContact CE2-CZ 4.33Å; F505-F515 HydrophobicContact CZ-CE1 4.22Å; F505-F515 AromaticContact CZ-CZ 3.78Å; F505-F515 HydrophobicContact CZ-CZ 3.78Å; F505-T523 HydrophobicContact CD2-CG2 3.79Å; F505-T523 HydrophobicContact CE2-CG2 3.62Å; F505-T524 PolarHBondContact N-O 3.41Å; F505-F525 HydrophobicContact CB-CD1 3.56Å; F505-F525 HydrophobicContact CB-CE1 3.99Å; F505-F525 HydrophobicContact CB-CG 4.32Å; F505-F525 HydrophobicContact CD1-CE1 4.48Å; F505-F525 AromaticContact CD2-CD1 3.74Å; F505-F525 HydrophobicContact CD2-CD1 3.74Å; F505-F525 AromaticContact CD2-CE1 3.35Å; F505-F525 HydrophobicContact CD2-CE1 3.35Å; F505-F525 HydrophobicContact CD2-CE2 4.49Å; F505-F525 HydrophobicContact CD2-CG 4.44Å; F505-F525 AromaticContact CD2-CZ 3.78Å; F505-F525 HydrophobicContact CD2-CZ 3.78Å; F505-F525 AromaticContact CE2-CE1 3.92Å; F505-F525 HydrophobicContact CE2-CE1 3.92Å; F505-F525 HydrophobicContact CE2-CZ 4.04Å; F505-F525 AromaticContact CG-CD1 3.82Å; F505-F525 HydrophobicContact CG-CD1 3.82Å; F505-F525 AromaticContact CG-CE1 3.69Å; F505-F525 HydrophobicContact CG-CE1 3.69Å; F505-F525 CarbonylContact O-C 3.56Å; F505-F525 WeakPolarHBondContact O-CA 3.28Å; F505-L526 PolarHBondContact O-N 3.15Å
506	Y	91.8	Very high	90	Very high	81 Å²	81	49.3 Å²	49.3	32%	0.318	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	122.7	-178	-178.3	-91.6	0	0	0	111.2	F485 E486 D487 T508 L526 H527	F485-Y506 PolarHBondContact O-N 3.44Å; E486-Y506 WeakPolarHBondContact CA-O 3.34Å; E486-Y506 HydrophobicContact CG-CD1 4.16Å; D487-Y506 PolarHBondContact N-O 3.5Å; Y506-T508 VanDerWaalsContact C-N 3.27Å; Y506-T508 WeakPolarHBondContact O-CG2 3.43Å; Y506-T508 PolarHBondContact O-N 3.36Å; Y506-L526 WeakPolarHBondContact CA-O 3.39Å; Y506-L526 HydrophobicContact CD2-CB 3.72Å; Y506-L526 HydrophobicContact CD2-CD1 4.12Å; Y506-L526 HydrophobicContact CE2-CB 4.44Å; Y506-H527 AromaticContact CE2-CD2 3.71Å
507	N	86.7	Confident	89.8	Confident	48 Å²	48	53.8 Å²	53.8	26%	0.257	26%	0.26	S	S	.	.	S	Bend	trans	55.5	35.8	178.8	-157.6	22.9	0	0	0	114.9	D487 L526 H527 K529	D487-N507 WeakPolarHBondContact OD1-CB 3.25Å; D487-N507 PolarHBondContact OD1-ND2 3.33Å; N507-L526 PolarHBondContact N-O 2.79Å; N507-H527 WeakPolarHBondContact CA-O 3.42Å; N507-K529 PolarHBondContact ND2-NZ 3.31Å; N507-K529 PolarHBondContact O-NZ 3.27Å; N507-K529 WeakPolarHBondContact OD1-CE 3.14Å; N507-K529 PolarHBondContact OD1-NZ 3.29Å
508	T	85.8	Confident	89.7	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.018	24%	0.244	C	C	.	.			trans	-105.9	161.7	-178	67.9	0	0	0	0	112.4	F485 I488 Y506 K529	F485-T508 HydrophobicContact CB-CG2 4.26Å; I488-T508 HydrophobicContact CB-CG2 3.79Å; I488-T508 HydrophobicContact CD1-CG2 4.33Å; I488-T508 HydrophobicContact CG1-CG2 4Å; Y506-T508 VanDerWaalsContact C-N 3.27Å; Y506-T508 WeakPolarHBondContact O-CG2 3.43Å; Y506-T508 PolarHBondContact O-N 3.36Å; T508-K529 PolarHBondContact O-N 3.02Å
509	D	81.4	Confident	89.7	Confident	23 Å²	23	58 Å²	58	12%	0.123	27%	0.273	C	S	.	.	S	Bend	trans	-95	5	169.8	62.4	4.6	0	0	0	113.6	I488 R489 S490 W511 K529 L534	I488-D509 PolarHBondContact O-N 2.94Å; R489-D509 WeakPolarHBondContact CA-OD2 3.48Å; S490-D509 VanDerWaalsContact CB-OD1 3.28Å; S490-D509 WeakPolarHBondContact CB-OD1 3.4Å; S490-D509 VanDerWaalsContact N-CG 3.27Å; S490-D509 PolarHBondContact N-OD1 2.98Å; S490-D509 PolarHBondContact N-OD2 2.89Å; S490-D509 VanDerWaalsContact OG-CG 3.28Å; S490-D509 PolarHBondContact OG-OD1 2.73Å; D509-W511 PolarHBondContact O-N 3.47Å; D509-K529 HydrophobicContact CB-CB 4.33Å; D509-L534 VanDerWaalsContact OD2-CD2 3.3Å; D509-L534 WeakPolarHBondContact OD2-CD2 3.33Å
510	L	85.8	Confident	89.5	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	28%	0.278	C	S	.	.			trans	-78	86.2	175.6	-66.4	175.9	0	0	0	110.2	F485 I488 S490 F495 F505 K514 F515 F525	F485-L510 HydrophobicContact CD1-CD1 4.24Å; I488-L510 HydrophobicContact CD1-CD1 4.42Å; I488-L510 HydrophobicContact CG2-CD1 4.18Å; I488-L510 HydrophobicContact CG2-CG 4.49Å; S490-L510 VanDerWaalsContact OG-CD2 3.3Å; S490-L510 WeakPolarHBondContact OG-CD2 3.47Å; F495-L510 HydrophobicContact CE2-CD1 4.15Å; F495-L510 HydrophobicContact CE2-CD2 3.87Å; F495-L510 HydrophobicContact CZ-CD1 4.38Å; F505-L510 HydrophobicContact CD1-CB 4.29Å; F505-L510 HydrophobicContact CD1-CD1 4.26Å; F505-L510 HydrophobicContact CE1-CB 4.4Å; F505-L510 HydrophobicContact CE1-CD1 3.99Å; L510-K514 HydrophobicContact CD2-CB 4.41Å; L510-K514 HydrophobicContact CD2-CG 4.44Å; L510-F515 HydrophobicContact CB-CE2 4.34Å; L510-F515 HydrophobicContact CB-CZ 4.24Å; L510-F525 WeakPolarHBondContact O-CE1 3.39Å
511	W	84.4	Confident	89.4	Confident	66 Å²	66	62.4 Å²	62.4	25%	0.25	29%	0.291	C	S	.	.			trans	-109.2	178.7	177.3	-162.4	-108.4	0	0	0	112.6	D509 E513 K514 F515 F525 P528	D509-W511 PolarHBondContact O-N 3.47Å; W511-E513 PolarHBondContact O-N 3.38Å; W511-K514 WeakPolarHBondContact O-CB 3.41Å; W511-K514 PolarHBondContact O-N 3.04Å; W511-F515 VanDerWaalsContact O-CD2 3.28Å; W511-F515 WeakPolarHBondContact O-CD2 3.28Å; W511-F525 HydrophobicContact CE3-CB 4.33Å; W511-F525 AromaticContact CE3-CD1 3.99Å; W511-F525 HydrophobicContact CE3-CD1 3.99Å; W511-F525 HydrophobicContact CE3-CG 4.21Å; W511-F525 HydrophobicContact CH2-CB 4.22Å; W511-F525 HydrophobicContact CH2-CG 4.47Å; W511-F525 HydrophobicContact CZ3-CB 3.48Å; W511-F525 VanDerWaalsContact CZ3-CB 3.48Å; W511-F525 AromaticContact CZ3-CD1 3.94Å; W511-F525 HydrophobicContact CZ3-CD1 3.94Å; W511-F525 HydrophobicContact CZ3-CD2 4.35Å; W511-F525 AromaticContact CZ3-CG 3.69Å; W511-F525 HydrophobicContact CZ3-CG 3.69Å; W511-P528 HydrophobicContact CD2-CB 4.27Å; W511-P528 HydrophobicContact CE3-CB 3.4Å; W511-P528 HydrophobicContact CE3-CG 4.07Å; W511-P528 HydrophobicContact CH2-CB 4.36Å; W511-P528 HydrophobicContact CH2-CG 4.13Å; W511-P528 HydrophobicContact CZ3-CB 3.43Å; W511-P528 VanDerWaalsContact CZ3-CB 3.43Å; W511-P528 HydrophobicContact CZ3-CG 3.62Å
512	Q	80.9	Confident	89.3	Confident	138 Å²	138	65.7 Å²	65.7	65%	0.645	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-44.3	-36.2	-173.4	-69.7	176.7	-20.9	0	0	114.8	K514 F515	Q512-K514 PolarHBondContact O-N 3.49Å; Q512-F515 PolarHBondContact O-N 2.93Å
513	E	81.6	Confident	89.1	Confident	169 Å²	169	63.8 Å²	63.8	79%	0.79	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-64.9	-21.7	179.8	-62.6	176	-171.6	0	0	114.1	W511	W511-E513 PolarHBondContact O-N 3.38Å
514	K	84.8	Confident	89	Confident	36 Å²	36	67 Å²	67	16%	0.157	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-88.1	-10.5	-178.3	-59.4	-79.1	175.8	162.6	0	112.8	S490 T493 F495 L510 W511 Q512	S490-K514 PolarHBondContact O-NZ 3.29Å; T493-K514 WeakPolarHBondContact O-CD 3.49Å; F495-K514 PolarHBondContact N-O 3.27Å; L510-K514 HydrophobicContact CD2-CB 4.41Å; L510-K514 HydrophobicContact CD2-CG 4.44Å; W511-K514 WeakPolarHBondContact O-CB 3.41Å; W511-K514 PolarHBondContact O-N 3.04Å; Q512-K514 PolarHBondContact O-N 3.49Å
515	F	90.3	Very high	88.8	Confident	19 Å²	19	68 Å²	68	8%	0.083	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	103.2	-177.1	-60	-83.1	0	0	0	110.3	F495 I500 F505 L510 W511 Q512 C518 M520 F525	F495-F515 HydrophobicContact CB-CD1 3.56Å; F495-F515 HydrophobicContact CB-CE1 4Å; F495-F515 HydrophobicContact CB-CG 4.47Å; F495-F515 HydrophobicContact CD1-CE1 4.25Å; F495-F515 AromaticContact CD2-CD1 3.96Å; F495-F515 HydrophobicContact CD2-CD1 3.96Å; F495-F515 AromaticContact CD2-CE1 3.62Å; F495-F515 HydrophobicContact CD2-CE1 3.62Å; F495-F515 HydrophobicContact CD2-CZ 4.28Å; F495-F515 HydrophobicContact CE2-CE1 4.16Å; F495-F515 AromaticContact CG-CD1 3.8Å; F495-F515 HydrophobicContact CG-CD1 3.8Å; F495-F515 AromaticContact CG-CE1 3.69Å; F495-F515 HydrophobicContact CG-CE1 3.69Å; F495-F515 CarbonylContact O-C 3.53Å; F495-F515 WeakPolarHBondContact O-CA 3.39Å; I500-F515 HydrophobicContact CD1-CD1 3.55Å; I500-F515 HydrophobicContact CD1-CE1 3.32Å; I500-F515 HydrophobicContact CD1-CZ 4.32Å; F505-F515 HydrophobicContact CE1-CZ 4.09Å; F505-F515 HydrophobicContact CE2-CZ 4.33Å; F505-F515 HydrophobicContact CZ-CE1 4.22Å; F505-F515 AromaticContact CZ-CZ 3.78Å; F505-F515 HydrophobicContact CZ-CZ 3.78Å; L510-F515 HydrophobicContact CB-CE2 4.34Å; L510-F515 HydrophobicContact CB-CZ 4.24Å; W511-F515 VanDerWaalsContact O-CD2 3.28Å; W511-F515 WeakPolarHBondContact O-CD2 3.28Å; Q512-F515 PolarHBondContact O-N 2.93Å; F515-C518 HydrophobicContact CB-CB 4.08Å; F515-C518 HydrophobicContact CD1-CB 4.47Å; F515-M520 HydrophobicContact CB-CE 3.5Å; F515-M520 HydrophobicContact CD1-CE 3.6Å; F515-M520 HydrophobicContact CD2-CE 3.47Å; F515-M520 VanDerWaalsContact CD2-CE 3.47Å; F515-M520 HydrophobicContact CE1-CE 4.17Å; F515-M520 HydrophobicContact CE2-CE 4.03Å; F515-M520 HydrophobicContact CG-CE 3.22Å; F515-M520 HydrophobicContact CZ-CE 4.36Å; F515-F525 HydrophobicContact CE2-CE1 4.16Å; F515-F525 HydrophobicContact CE2-CZ 4.27Å
516	K	89.6	Confident	88.5	Confident	91 Å²	91	71.8 Å²	71.8	40%	0.396	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	123.3	177.7	-58.2	-177	-163.2	155.3	0	109.9	F495 E496 N497 C518	F495-K516 PolarHBondContact O-N 3.38Å; E496-K516 WeakPolarHBondContact CA-O 3.28Å; E496-K516 HydrophobicContact CG-CB 4.26Å; E496-K516 HydrophobicContact CG-CD 4.31Å; E496-K516 WeakPolarHBondContact OE1-CD 3.5Å; E496-K516 IonicContact OE1-NZ 3.83Å; E496-K516 PolarHBondContact OE1-NZ 3.12Å; N497-K516 PolarHBondContact N-O 3.01Å; K516-C518 PolarHBondContact O-N 2.9Å; K516-C518 VanDerWaalsContact O-N 3.07Å; K516-C518 PolarHBondContact O-SG 3.08Å; K516-C518 VanDerWaalsContact O-SG 3.42Å
517	N	91.3	Very high	88.1	Confident	147 Å²	147	74.1 Å²	74.1	79%	0.786	36%	0.357	S	S	*	.	S	Bend	trans	52.7	29.3	179.1	-59.3	-23.9	0	0	0	114.3
518	C	93	Very high	87.7	Confident	27 Å²	27	73.9 Å²	73.9	18%	0.182	36%	0.359	C	S	.	.			trans	-86.1	140.4	-179.7	-65	0	0	0	0	111.5	F495 C498 F515 K516	F495-C518 PolarHBondContact O-SG 3.21Å; C498-C518 CarbonylContact O-C 3.53Å; C498-C518 WeakPolarHBondContact O-CA 3.27Å; C498-C518 WeakPolarHBondContact O-CB 3.47Å; F515-C518 HydrophobicContact CB-CB 4.08Å; F515-C518 HydrophobicContact CD1-CB 4.47Å; K516-C518 PolarHBondContact O-N 2.9Å; K516-C518 VanDerWaalsContact O-N 3.07Å; K516-C518 PolarHBondContact O-SG 3.08Å; K516-C518 VanDerWaalsContact O-SG 3.42Å
519	R	93.3	Very high	87	Confident	160 Å²	160	77.3 Å²	77.3	60%	0.604	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	116.2	172.6	-178.1	-178.5	-110	-132.5	7.1	109.2	C498 T499 I500 E521	C498-R519 PolarHBondContact O-N 2.87Å; T499-R519 WeakPolarHBondContact CA-O 3.32Å; I500-R519 PolarHBondContact N-O 3.37Å; R519-E521 WeakPolarHBondContact CD-OE1 3.25Å; R519-E521 HydrophobicContact CG-CG 4.32Å; R519-E521 IonicContact CZ-OE1 2.77Å; R519-E521 IonicContact NE-OE1 3.22Å; R519-E521 IonicContact NH1-OE1 3.41Å; R519-E521 PolarHBondContact NH1-OE1 2.63Å
520	M	92.6	Very high	86.2	Confident	73 Å²	73	82.4 Å²	82.4	36%	0.36	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.4	178.6	-62.1	-176.6	-176.3	0	0	110.4	I500 F515 F525	I500-M520 HydrophobicContact CB-CG 4.49Å; I500-M520 HydrophobicContact CD1-CE 4.39Å; I500-M520 CarbonylContact O-C 3.55Å; I500-M520 WeakPolarHBondContact O-CA 3.33Å; F515-M520 HydrophobicContact CB-CE 3.5Å; F515-M520 HydrophobicContact CD1-CE 3.6Å; F515-M520 HydrophobicContact CD2-CE 3.47Å; F515-M520 VanDerWaalsContact CD2-CE 3.47Å; F515-M520 HydrophobicContact CE1-CE 4.17Å; F515-M520 HydrophobicContact CE2-CE 4.03Å; F515-M520 HydrophobicContact CG-CE 3.22Å; F515-M520 HydrophobicContact CZ-CE 4.36Å; M520-F525 HydrophobicContact CE-CZ 4.37Å; M520-F525 HydrophobicContact SD-CE2 4.23Å; M520-F525 HydrophobicContact SD-CZ 4.13Å
521	E	91.9	Very high	84.9	Confident	62 Å²	62	85.3 Å²	85.3	29%	0.29	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	117.6	177.5	-65	177.7	-177.2	0	0	109.2	I500 K501 N502 R519 T523	I500-E521 PolarHBondContact O-N 3.05Å; K501-E521 CarbonylContact C-O 3.59Å; K501-E521 VanDerWaalsContact CA-O 3.29Å; K501-E521 WeakPolarHBondContact CA-O 3.34Å; K501-E521 WeakPolarHBondContact CD-OE2 3.31Å; K501-E521 WeakPolarHBondContact CE-OE2 3.36Å; K501-E521 HydrophobicContact CG-CB 4.22Å; K501-E521 IonicContact NZ-OE1 3.34Å; K501-E521 IonicContact NZ-OE2 3.1Å; K501-E521 PolarHBondContact NZ-OE2 3.27Å; N502-E521 PolarHBondContact N-O 3.34Å; R519-E521 WeakPolarHBondContact CD-OE1 3.25Å; R519-E521 HydrophobicContact CG-CG 4.32Å; R519-E521 IonicContact CZ-OE1 2.77Å; R519-E521 IonicContact NE-OE1 3.22Å; R519-E521 IonicContact NH1-OE1 3.41Å; R519-E521 PolarHBondContact NH1-OE1 2.63Å; E521-T523 PolarHBondContact O-N 3.45Å
522	N	92.8	Very high	83.4	Confident	129 Å²	129	84.4 Å²	84.4	69%	0.69	43%	0.428	S	S	*	.	S	Bend	trans	55.6	45.5	178.9	-163.5	29.3	0	0	0	113.8	N502	N502-N522 WeakPolarHBondContact CA-O 3.35Å; N502-N522 WeakPolarHBondContact OD1-CB 3.39Å; N502-N522 PolarHBondContact OD1-ND2 2.74Å
523	T	91.1	Very high	81.8	Confident	32 Å²	32	85.4 Å²	85.4	20%	0.196	43%	0.432	C	S	.	.			trans	-98.2	136.7	-180	-51.8	0	0	0	0	110.8	I500 T503 F505 E521 F525	I500-T523 HydrophobicContact CG2-CG2 4.25Å; T503-T523 WeakPolarHBondContact O-CA 3.41Å; T503-T523 WeakPolarHBondContact O-CG2 3.3Å; F505-T523 HydrophobicContact CD2-CG2 3.79Å; F505-T523 HydrophobicContact CE2-CG2 3.62Å; E521-T523 PolarHBondContact O-N 3.45Å; T523-F525 HydrophobicContact CG2-CD2 4.46Å; T523-F525 HydrophobicContact CG2-CE2 3.81Å; T523-F525 HydrophobicContact CG2-CZ 4.03Å
524	T	92	Very high	80.2	Confident	69 Å²	69	79.2 Å²	79.2	42%	0.423	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.1	-179.6	5.3	0	0	0	0	111.2	T503 V504 F505	T503-T524 PolarHBondContact O-N 3.4Å; V504-T524 WeakPolarHBondContact CA-O 3.27Å; F505-T524 PolarHBondContact N-O 3.41Å
525	F	90.5	Very high	78.4	Confident	54 Å²	54	82.7 Å²	82.7	24%	0.237	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.3	174.5	-60.6	-96.7	0	0	0	110.6	F505 L510 W511 F515 M520 T523	F505-F525 HydrophobicContact CB-CD1 3.56Å; F505-F525 HydrophobicContact CB-CE1 3.99Å; F505-F525 HydrophobicContact CB-CG 4.32Å; F505-F525 HydrophobicContact CD1-CE1 4.48Å; F505-F525 AromaticContact CD2-CD1 3.74Å; F505-F525 HydrophobicContact CD2-CD1 3.74Å; F505-F525 AromaticContact CD2-CE1 3.35Å; F505-F525 HydrophobicContact CD2-CE1 3.35Å; F505-F525 HydrophobicContact CD2-CE2 4.49Å; F505-F525 HydrophobicContact CD2-CG 4.44Å; F505-F525 AromaticContact CD2-CZ 3.78Å; F505-F525 HydrophobicContact CD2-CZ 3.78Å; F505-F525 AromaticContact CE2-CE1 3.92Å; F505-F525 HydrophobicContact CE2-CE1 3.92Å; F505-F525 HydrophobicContact CE2-CZ 4.04Å; F505-F525 AromaticContact CG-CD1 3.82Å; F505-F525 HydrophobicContact CG-CD1 3.82Å; F505-F525 AromaticContact CG-CE1 3.69Å; F505-F525 HydrophobicContact CG-CE1 3.69Å; F505-F525 CarbonylContact O-C 3.56Å; F505-F525 WeakPolarHBondContact O-CA 3.28Å; L510-F525 WeakPolarHBondContact O-CE1 3.39Å; W511-F525 HydrophobicContact CE3-CB 4.33Å; W511-F525 AromaticContact CE3-CD1 3.99Å; W511-F525 HydrophobicContact CE3-CD1 3.99Å; W511-F525 HydrophobicContact CE3-CG 4.21Å; W511-F525 HydrophobicContact CH2-CB 4.22Å; W511-F525 HydrophobicContact CH2-CG 4.47Å; W511-F525 HydrophobicContact CZ3-CB 3.48Å; W511-F525 VanDerWaalsContact CZ3-CB 3.48Å; W511-F525 AromaticContact CZ3-CD1 3.94Å; W511-F525 HydrophobicContact CZ3-CD1 3.94Å; W511-F525 HydrophobicContact CZ3-CD2 4.35Å; W511-F525 AromaticContact CZ3-CG 3.69Å; W511-F525 HydrophobicContact CZ3-CG 3.69Å; F515-F525 HydrophobicContact CE2-CE1 4.16Å; F515-F525 HydrophobicContact CE2-CZ 4.27Å; M520-F525 HydrophobicContact CE-CZ 4.37Å; M520-F525 HydrophobicContact SD-CE2 4.23Å; M520-F525 HydrophobicContact SD-CZ 4.13Å; T523-F525 HydrophobicContact CG2-CD2 4.46Å; T523-F525 HydrophobicContact CG2-CE2 3.81Å; T523-F525 HydrophobicContact CG2-CZ 4.03Å
526	L	86.6	Confident	76.4	Confident	80 Å²	80	84.5 Å²	84.5	42%	0.419	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	129.8	-175.4	-62	174	0	0	0	109.3	V504 F505 Y506 N507	V504-L526 HydrophobicContact CG1-CD1 4.23Å; F505-L526 PolarHBondContact O-N 3.15Å; Y506-L526 WeakPolarHBondContact CA-O 3.39Å; Y506-L526 HydrophobicContact CD2-CB 3.72Å; Y506-L526 HydrophobicContact CD2-CD1 4.12Å; Y506-L526 HydrophobicContact CE2-CB 4.44Å; N507-L526 PolarHBondContact N-O 2.79Å
527	H	83.6	Confident	74.2	Confident	129 Å²	129	88.5 Å²	88.5	60%	0.597	45%	0.453	S	S	*	.	S	Bend	trans	50.2	54.4	-175.8	-60	-74.1	0	0	0	114.8	Y506 N507 K529	Y506-H527 AromaticContact CE2-CD2 3.71Å; N507-H527 WeakPolarHBondContact CA-O 3.42Å; H527-K529 PolarHBondContact O-N 3.08Å
528	P	78.5	Confident	72.2	Confident	43 Å²	43	84.7 Å²	84.7	28%	0.279	43%	0.43	S	S	.	.			trans	-65	129.1	179.7	29	-35.4	0	0	0	111.3	W511 K530	W511-P528 HydrophobicContact CD2-CB 4.27Å; W511-P528 HydrophobicContact CE3-CB 3.4Å; W511-P528 HydrophobicContact CE3-CG 4.07Å; W511-P528 HydrophobicContact CH2-CB 4.36Å; W511-P528 HydrophobicContact CH2-CG 4.13Å; W511-P528 HydrophobicContact CZ3-CB 3.43Å; W511-P528 VanDerWaalsContact CZ3-CB 3.43Å; W511-P528 HydrophobicContact CZ3-CG 3.62Å; P528-K530 HydrophobicContact CB-CG 4.39Å; P528-K530 PolarHBondContact O-N 3.26Å
529	K	71.4	Confident	70	Confident	75 Å²	75	91 Å²	91	33%	0.326	46%	0.457	S	S	.	.			trans	-78.4	105.1	169.1	-68.3	174.1	177.9	135	0	107.6	N507 T508 D509 H527	N507-K529 PolarHBondContact ND2-NZ 3.31Å; N507-K529 PolarHBondContact O-NZ 3.27Å; N507-K529 WeakPolarHBondContact OD1-CE 3.14Å; N507-K529 PolarHBondContact OD1-NZ 3.29Å; T508-K529 PolarHBondContact O-N 3.02Å; D509-K529 HydrophobicContact CB-CB 4.33Å; H527-K529 PolarHBondContact O-N 3.08Å
530	K	63.8	Low	67.8	Low	130 Å²	130	87.1 Å²	87.1	57%	0.565	45%	0.448	S	S	*	.			trans	-99.1	144.3	-179.4	-62.3	-178.6	-178.9	179.9	0	110.5	P528	P528-K530 HydrophobicContact CB-CG 4.39Å; P528-K530 PolarHBondContact O-N 3.26Å
531	G	58.4	Low	66.1	Low	62 Å²	62	84.8 Å²	84.8	64%	0.639	44%	0.437	S	S	*	.	S	Bend	trans	83.3	-171.8	176.3	0	0	0	0	0	114.7	H533	G531-H533 PolarHBondContact O-N 3.05Å
532	C	53.7	Low	64.6	Low	47 Å²	47	86 Å²	86	32%	0.318	44%	0.444	S	S	.	.	S	Bend	trans	-75.1	24.8	-171.6	-48.2	0	0	0	0	115.5	K142 C145 L534	K142-C532 WeakPolarHBondContact O-CB 3.31Å; C145-C532 WeakPolarHBondContact CA-SG 3.28Å; C145-C532 HydrophobicContact CB-CB 4.25Å; C145-C532 WeakPolarHBondContact CB-SG 3.01Å; C145-C532 WeakPolarHBondContact SG-CB 3.43Å; C145-C532 PolarHBondContact SG-N 3.31Å; C145-C532 CovalentContact SG-SG 2.04Å; C145-C532 PolarHBondContact SG-SG 2.71Å; C532-L534 PolarHBondContact O-N 2.95Å
533	H	47.3	Very low	63.3	Low	159 Å²	159	82 Å²	82	74%	0.736	43%	0.425	S	S	*	.			trans	-68.9	19.6	171.8	-71.6	-65.7	0	0	0	113.7	G531 N535	G531-H533 PolarHBondContact O-N 3.05Å; H533-N535 PolarHBondContact O-N 3.43Å
534	L	48.7	Very low	62.1	Low	39 Å²	39	83.6 Å²	83.6	20%	0.204	43%	0.432	C	S	.	.			trans	-69.5	97.5	168.2	-74.9	143.6	0	0	0	107.1	S490 D509 C532 F536	S490-L534 VanDerWaalsContact O-CD2 3.31Å; S490-L534 WeakPolarHBondContact O-CD2 3.27Å; D509-L534 VanDerWaalsContact OD2-CD2 3.3Å; D509-L534 WeakPolarHBondContact OD2-CD2 3.33Å; C532-L534 PolarHBondContact O-N 2.95Å; L534-F536 HydrophobicContact CB-CD1 4.15Å; L534-F536 HydrophobicContact CB-CD2 3.59Å; L534-F536 HydrophobicContact CB-CE1 3.74Å; L534-F536 HydrophobicContact CB-CE2 3.19Å; L534-F536 HydrophobicContact CB-CG 4.1Å; L534-F536 HydrophobicContact CB-CZ 3.3Å; L534-F536 HydrophobicContact CD1-CE1 4.31Å; L534-F536 HydrophobicContact CD1-CE2 3.94Å; L534-F536 HydrophobicContact CD1-CZ 3.51Å; L534-F536 HydrophobicContact CD2-CE1 3.85Å; L534-F536 HydrophobicContact CD2-CZ 3.9Å; L534-F536 HydrophobicContact CG-CE1 4.16Å; L534-F536 HydrophobicContact CG-CE2 4.06Å; L534-F536 HydrophobicContact CG-CZ 3.72Å; L534-F536 VanDerWaalsContact O-CD2 3.24Å; L534-F536 WeakPolarHBondContact O-CD2 3.11Å; L534-F536 PolarHBondContact O-N 3.43Å
535	N	46.6	Very low	61.1	Low	110 Å²	110	80.8 Å²	80.8	59%	0.588	41%	0.413	S	S	*	.			trans	-61	79.5	159.9	-99.2	-18.1	0	0	0	107.8	H533 Q537	H533-N535 PolarHBondContact O-N 3.43Å; N535-Q537 PolarHBondContact O-N 3.24Å
536	F	47.1	Very low	60.2	Low	56 Å²	56	82.8 Å²	82.8	25%	0.246	43%	0.426	C	S	.	.			trans	-76	78.1	166.6	-61	-65.8	0	0	0	107.1	K142 T491 L534 E538	K142-F536 HydrophobicContact CD-CB 4.14Å; K142-F536 HydrophobicContact CD-CD2 4.19Å; K142-F536 HydrophobicContact CG-CD2 4.15Å; K142-F536 PolarHBondContact NZ-O 3.41Å; T491-F536 HydrophobicContact CG2-CD1 3.85Å; T491-F536 HydrophobicContact CG2-CE1 3.41Å; T491-F536 VanDerWaalsContact CG2-CE1 3.41Å; T491-F536 HydrophobicContact CG2-CZ 4.49Å; T491-F536 WeakPolarHBondContact OG1-CE1 3.41Å; L534-F536 HydrophobicContact CB-CD1 4.15Å; L534-F536 HydrophobicContact CB-CD2 3.59Å; L534-F536 HydrophobicContact CB-CE1 3.74Å; L534-F536 HydrophobicContact CB-CE2 3.19Å; L534-F536 HydrophobicContact CB-CG 4.1Å; L534-F536 HydrophobicContact CB-CZ 3.3Å; L534-F536 HydrophobicContact CD1-CE1 4.31Å; L534-F536 HydrophobicContact CD1-CE2 3.94Å; L534-F536 HydrophobicContact CD1-CZ 3.51Å; L534-F536 HydrophobicContact CD2-CE1 3.85Å; L534-F536 HydrophobicContact CD2-CZ 3.9Å; L534-F536 HydrophobicContact CG-CE1 4.16Å; L534-F536 HydrophobicContact CG-CE2 4.06Å; L534-F536 HydrophobicContact CG-CZ 3.72Å; L534-F536 VanDerWaalsContact O-CD2 3.24Å; L534-F536 WeakPolarHBondContact O-CD2 3.11Å; L534-F536 PolarHBondContact O-N 3.43Å; F536-E538 HydrophobicContact CB-CG 4.33Å; F536-E538 PolarHBondContact O-N 2.99Å
537	Q	43.6	Very low	59.6	Low	176 Å²	176	79.8 Å²	79.8	82%	0.822	41%	0.411	S	S	*	.			trans	-67.5	66.6	155.2	-134.8	173.7	-27	0	0	106.3	N535 E539	N535-Q537 PolarHBondContact O-N 3.24Å; Q537-E539 PolarHBondContact O-N 2.99Å
538	E	49.5	Very low	59.1	Low	66 Å²	66	75.3 Å²	75.3	31%	0.308	39%	0.394	S	S	.	.			trans	-73.1	114.8	174.3	-90.7	-168.7	146.2	0	0	107.6	F536 N540 D541	F536-E538 HydrophobicContact CB-CG 4.33Å; F536-E538 PolarHBondContact O-N 2.99Å; E538-N540 PolarHBondContact O-N 3.11Å; E538-D541 PolarHBondContact O-N 2.6Å
539	E	46.9	Very low	59.2	Low	161 Å²	161	76.6 Å²	76.6	75%	0.752	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-16	167.9	-72.8	176.6	141.1	0	0	113	Q537	Q537-E539 PolarHBondContact O-N 2.99Å
540	N	47.9	Very low	59.5	Low	77 Å²	77	76.3 Å²	76.3	41%	0.412	40%	0.397	S	S	.	.	H	α-helix	trans	-80.7	-18.6	178.8	-67	-17.8	0	0	0	114.5	E538 I542 V543 I544	E538-N540 PolarHBondContact O-N 3.11Å; N540-I542 VanDerWaalsContact C-N 3.29Å; N540-I542 PolarHBondContact O-N 3.23Å; N540-V543 PolarHBondContact O-N 2.88Å; N540-I544 PolarHBondContact O-N 2.81Å
541	D	56.8	Low	60.1	Low	25 Å²	25	70.5 Å²	70.5	13%	0.134	38%	0.375	C	S	.	.	H	α-helix	trans	-66.5	-34.4	178.4	-74.8	-24.9	0	0	0	110.6	K142 E538 V543 I544 Y545	K142-D541 IonicContact NZ-OD2 3.85Å; K142-D541 PolarHBondContact NZ-OD2 3.45Å; E538-D541 PolarHBondContact O-N 2.6Å; D541-V543 VanDerWaalsContact C-N 3.31Å; D541-V543 PolarHBondContact O-N 3.07Å; D541-I544 PolarHBondContact O-N 2.96Å; D541-Y545 HydrophobicContact CB-CE2 4.07Å; D541-Y545 WeakPolarHBondContact O-CD2 3.28Å; D541-Y545 VanDerWaalsContact O-CE2 3.27Å; D541-Y545 WeakPolarHBondContact O-CE2 3.49Å; D541-Y545 PolarHBondContact O-N 3.45Å
542	I	61.1	Low	61.3	Low	86 Å²	86	67.9 Å²	67.9	44%	0.441	35%	0.346	S	S	.	.	H	α-helix	trans	-61.9	-38.9	176.7	-61.4	170.7	0	0	0	111.5	N540 I544 Y545 L546	N540-I542 VanDerWaalsContact C-N 3.29Å; N540-I542 PolarHBondContact O-N 3.23Å; I542-I544 VanDerWaalsContact C-N 3.32Å; I542-I544 PolarHBondContact O-N 2.91Å; I542-Y545 PolarHBondContact O-N 3.39Å; I542-L546 WeakPolarHBondContact O-CB 3.4Å; I542-L546 PolarHBondContact O-N 2.96Å
543	V	63.5	Low	62.9	Low	47 Å²	47	69.3 Å²	69.3	29%	0.285	35%	0.35	S	S	.	.	H	α-helix	trans	-66.6	-37.2	-179.6	-178.5	0	0	0	0	110.7	N540 D541 L546 V547	N540-V543 PolarHBondContact O-N 2.88Å; D541-V543 VanDerWaalsContact C-N 3.31Å; D541-V543 PolarHBondContact O-N 3.07Å; V543-L546 PolarHBondContact O-N 3.04Å; V543-V547 HydrophobicContact CG1-CG2 4.21Å; V543-V547 WeakPolarHBondContact O-CB 3.15Å; V543-V547 VanDerWaalsContact O-CG2 3.27Å; V543-V547 WeakPolarHBondContact O-CG2 3.08Å; V543-V547 PolarHBondContact O-N 3.43Å
544	I	66.8	Low	64.8	Low	65 Å²	65	62.6 Å²	62.6	33%	0.333	32%	0.323	S	S	.	.	H	α-helix	trans	-63	-46.7	176.8	-62.6	169.6	0	0	0	110.3	N540 D541 I542 L546 V547 S548	N540-I544 PolarHBondContact O-N 2.81Å; D541-I544 PolarHBondContact O-N 2.96Å; I542-I544 VanDerWaalsContact C-N 3.32Å; I542-I544 PolarHBondContact O-N 2.91Å; I544-L546 VanDerWaalsContact C-N 3.33Å; I544-L546 PolarHBondContact O-N 2.88Å; I544-V547 PolarHBondContact O-N 3.35Å; I544-S548 PolarHBondContact O-N 2.84Å; I544-S548 PolarHBondContact O-OG 3.24Å
545	Y	71.7	Confident	66.7	Low	10 Å²	10	60.9 Å²	60.9	4%	0.039	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-41.2	175.7	-57.5	-56.1	0	0	0	112	F135 A258 I262 D541 I542 F549	F135-Y545 HydrophobicContact CB-CE1 3.95Å; F135-Y545 AromaticContact CD1-CD1 3.33Å; F135-Y545 HydrophobicContact CD1-CD1 3.33Å; F135-Y545 AromaticContact CD1-CE1 3.44Å; F135-Y545 HydrophobicContact CD1-CE1 3.44Å; F135-Y545 VanDerWaalsContact CD1-CE1 3.44Å; F135-Y545 AromaticContact CE1-CD1 3.68Å; F135-Y545 HydrophobicContact CE1-CD1 3.68Å; F135-Y545 HydrophobicContact CE1-CE1 4.26Å; F135-Y545 HydrophobicContact CG-CD1 4.12Å; F135-Y545 AromaticContact CG-CE1 3.98Å; F135-Y545 HydrophobicContact CG-CE1 3.98Å; A258-Y545 HydrophobicContact CB-CD1 4.02Å; A258-Y545 HydrophobicContact CB-CE1 4.03Å; I262-Y545 HydrophobicContact CD1-CE1 4.08Å; I262-Y545 WeakPolarHBondContact CD1-OH 3.39Å; I262-Y545 WeakPolarHBondContact CG2-OH 3.38Å; D541-Y545 HydrophobicContact CB-CE2 4.07Å; D541-Y545 WeakPolarHBondContact O-CD2 3.28Å; D541-Y545 VanDerWaalsContact O-CE2 3.27Å; D541-Y545 WeakPolarHBondContact O-CE2 3.49Å; D541-Y545 PolarHBondContact O-N 3.45Å; I542-Y545 PolarHBondContact O-N 3.39Å; Y545-F549 VanDerWaalsContact O-CB 3.26Å; Y545-F549 WeakPolarHBondContact O-CB 3.44Å; Y545-F549 PolarHBondContact O-N 3.3Å
546	L	71.1	Confident	68.8	Low	95 Å²	95	57.1 Å²	57.1	50%	0.497	29%	0.293	S	S	.	.	H	α-helix	trans	-66.1	-42.1	178.8	-174.6	69.4	0	0	0	112.1	I542 V543 I544 F549 L550	I542-L546 WeakPolarHBondContact O-CB 3.4Å; I542-L546 PolarHBondContact O-N 2.96Å; V543-L546 PolarHBondContact O-N 3.04Å; I544-L546 VanDerWaalsContact C-N 3.33Å; I544-L546 PolarHBondContact O-N 2.88Å; L546-F549 PolarHBondContact O-N 3.42Å; L546-L550 HydrophobicContact CG-CD1 4.14Å; L546-L550 WeakPolarHBondContact O-CB 2.95Å; L546-L550 VanDerWaalsContact O-CG 3.25Å; L546-L550 WeakPolarHBondContact O-CG 3.43Å; L546-L550 PolarHBondContact O-N 3.49Å
547	V	72.9	Confident	70.8	Confident	18 Å²	18	57.7 Å²	57.7	11%	0.109	30%	0.303	C	S	.	.	H	α-helix	trans	-65.4	-44.2	177.9	170	0	0	0	0	110.7	V543 I544 L550 G551	V543-V547 HydrophobicContact CG1-CG2 4.21Å; V543-V547 WeakPolarHBondContact O-CB 3.15Å; V543-V547 VanDerWaalsContact O-CG2 3.27Å; V543-V547 WeakPolarHBondContact O-CG2 3.08Å; V543-V547 PolarHBondContact O-N 3.43Å; I544-V547 PolarHBondContact O-N 3.35Å; V547-L550 PolarHBondContact O-N 2.82Å; V547-G551 PolarHBondContact O-N 3.21Å
548	S	73.5	Confident	72.9	Confident	35 Å²	35	49.7 Å²	49.7	25%	0.245	27%	0.268	C	S	.	.	H	α-helix	trans	-62.1	-43.1	173.9	-73	0	0	0	0	112.1	I544 G551 S552	I544-S548 PolarHBondContact O-N 2.84Å; I544-S548 PolarHBondContact O-OG 3.24Å; S548-G551 PolarHBondContact O-N 3.35Å; S548-S552 PolarHBondContact O-N 2.95Å; S548-S552 PolarHBondContact O-OG 3.46Å
549	F	80.1	Confident	74.9	Confident	69 Å²	69	46.6 Å²	46.6	30%	0.303	25%	0.253	S	S	.	.	H	α-helix	trans	-59.8	-48	175.9	178	-90.1	0	0	0	112	L252 Y545 L546 G551 S552 L553	L252-F549 HydrophobicContact CD1-CD2 3.52Å; L252-F549 HydrophobicContact CD1-CE2 3.22Å; L252-F549 HydrophobicContact CD1-CG 4.36Å; L252-F549 HydrophobicContact CD1-CZ 3.85Å; L252-F549 HydrophobicContact CG-CE2 4.14Å; Y545-F549 VanDerWaalsContact O-CB 3.26Å; Y545-F549 WeakPolarHBondContact O-CB 3.44Å; Y545-F549 PolarHBondContact O-N 3.3Å; L546-F549 PolarHBondContact O-N 3.42Å; F549-G551 VanDerWaalsContact C-N 3.31Å; F549-G551 PolarHBondContact O-N 3.34Å; F549-S552 PolarHBondContact O-N 3.33Å; F549-L553 HydrophobicContact CE1-CD2 4.17Å; F549-L553 VanDerWaalsContact O-CB 3.29Å; F549-L553 WeakPolarHBondContact O-CB 3.35Å; F549-L553 PolarHBondContact O-N 3.21Å
550	L	78.8	Confident	77	Confident	69 Å²	69	42.1 Å²	42.1	36%	0.361	23%	0.234	S	C	.	.	H	α-helix	trans	-62.9	-39	177.1	-73.1	172.1	0	0	0	111.6	L546 V547 L553 A554	L546-L550 HydrophobicContact CG-CD1 4.14Å; L546-L550 WeakPolarHBondContact O-CB 2.95Å; L546-L550 VanDerWaalsContact O-CG 3.25Å; L546-L550 WeakPolarHBondContact O-CG 3.43Å; L546-L550 PolarHBondContact O-N 3.49Å; V547-L550 PolarHBondContact O-N 2.82Å; L550-L553 PolarHBondContact O-N 3.44Å; L550-A554 WeakPolarHBondContact O-CB 3.24Å; L550-A554 PolarHBondContact O-N 3.49Å
551	G	77	Confident	79	Confident	9 Å²	9	43.1 Å²	43.1	9%	0.093	24%	0.238	C	C	.	.	H	α-helix	trans	-59.3	-53	173.8	0	0	0	0	0	112.1	V547 S548 F549 L553 A554 V555	V547-G551 PolarHBondContact O-N 3.21Å; S548-G551 PolarHBondContact O-N 3.35Å; F549-G551 VanDerWaalsContact C-N 3.31Å; F549-G551 PolarHBondContact O-N 3.34Å; G551-L553 VanDerWaalsContact C-N 3.31Å; G551-L553 PolarHBondContact O-N 3.07Å; G551-A554 PolarHBondContact O-N 3.49Å; G551-V555 WeakPolarHBondContact O-CG2 3.25Å; G551-V555 PolarHBondContact O-N 3.49Å
552	S	82.7	Confident	80.5	Confident	6 Å²	6	42.1 Å²	42.1	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-37.7	177.2	-60.8	0	0	0	0	112.5	S548 F549 V555	S548-S552 PolarHBondContact O-N 2.95Å; S548-S552 PolarHBondContact O-OG 3.46Å; F549-S552 PolarHBondContact O-N 3.33Å; S552-V555 PolarHBondContact O-N 3.28Å
553	L	87.5	Confident	81.7	Confident	77 Å²	77	38 Å²	38	40%	0.403	21%	0.212	S	C	.	.	H	α-helix	trans	-66.6	-39.7	177.4	-173.5	66.5	0	0	0	112	F549 L550 G551 V555 L556 P557	F549-L553 HydrophobicContact CE1-CD2 4.17Å; F549-L553 VanDerWaalsContact O-CB 3.29Å; F549-L553 WeakPolarHBondContact O-CB 3.35Å; F549-L553 PolarHBondContact O-N 3.21Å; L550-L553 PolarHBondContact O-N 3.44Å; G551-L553 VanDerWaalsContact C-N 3.31Å; G551-L553 PolarHBondContact O-N 3.07Å; L553-V555 PolarHBondContact O-N 2.86Å; L553-L556 HydrophobicContact CD1-CD1 4.28Å; L553-L556 PolarHBondContact O-N 3Å; L553-P557 VanDerWaalsContact O-CD 3.24Å; L553-P557 WeakPolarHBondContact O-CD 3.41Å
554	A	87.1	Confident	82.9	Confident	19 Å²	19	40 Å²	40	16%	0.157	22%	0.221	C	C	.	.	H	α-helix	trans	-64.2	-23.9	178.2	0	0	0	0	0	113	L550 G551 P557 C603 A607	L550-A554 WeakPolarHBondContact O-CB 3.24Å; L550-A554 PolarHBondContact O-N 3.49Å; G551-A554 PolarHBondContact O-N 3.49Å; A554-P557 WeakPolarHBondContact O-CD 3.29Å; A554-C603 HydrophobicContact CB-CB 3.81Å; A554-A607 VanDerWaalsContact O-CB 3.25Å; A554-A607 WeakPolarHBondContact O-CB 3.44Å
555	V	89.2	Confident	83.9	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-75.6	-31.6	178.7	178.7	0	0	0	0	112.7	M248 G551 S552 L553 G558 N559 V610	M248-V555 HydrophobicContact CE-CG1 3.86Å; M248-V555 HydrophobicContact CG-CB 4.16Å; M248-V555 HydrophobicContact CG-CG1 3.55Å; M248-V555 HydrophobicContact SD-CB 3.94Å; M248-V555 HydrophobicContact SD-CG1 3.58Å; M248-V555 VanDerWaalsContact SD-CG1 3.58Å; M248-V555 HydrophobicContact SD-CG2 4.11Å; G551-V555 WeakPolarHBondContact O-CG2 3.25Å; G551-V555 PolarHBondContact O-N 3.49Å; S552-V555 PolarHBondContact O-N 3.28Å; L553-V555 PolarHBondContact O-N 2.86Å; V555-G558 PolarHBondContact O-N 2.83Å; V555-G558 VanDerWaalsContact O-N 3.12Å; V555-N559 PolarHBondContact O-N 3.35Å; V555-V610 HydrophobicContact CG1-CB 3.62Å; V555-V610 HydrophobicContact CG1-CG1 3.97Å; V555-V610 HydrophobicContact CG1-CG2 3.32Å
556	L	89.1	Confident	84.5	Confident	31 Å²	31	40.8 Å²	40.8	16%	0.162	22%	0.222	C	C	.	.	H	α-helix	trans	-59.2	-45.9	-174.6	-66.5	177.4	0	0	0	114	M248 L249 L553 G558 N559 I560	M248-L556 HydrophobicContact CB-CD2 4.02Å; L249-L556 HydrophobicContact CD2-CD2 4.36Å; L553-L556 HydrophobicContact CD1-CD1 4.28Å; L553-L556 PolarHBondContact O-N 3Å; L556-G558 VanDerWaalsContact C-N 3.3Å; L556-G558 PolarHBondContact O-N 3.47Å; L556-N559 WeakPolarHBondContact O-CB 3.49Å; L556-N559 PolarHBondContact O-N 3.39Å; L556-I560 WeakPolarHBondContact O-CG1 3.24Å; L556-I560 PolarHBondContact O-N 3.25Å
557	P	90.4	Very high	85	Confident	69 Å²	69	37.5 Å²	37.5	45%	0.448	21%	0.205	S	C	.	.	H	α-helix	trans	-59.1	-40.8	174.6	-24.1	33.8	0	0	0	112.8	L553 A554 N559 I560 I561	L553-P557 VanDerWaalsContact O-CD 3.24Å; L553-P557 WeakPolarHBondContact O-CD 3.41Å; A554-P557 WeakPolarHBondContact O-CD 3.29Å; P557-N559 VanDerWaalsContact C-N 3.33Å; P557-N559 PolarHBondContact O-N 2.94Å; P557-I560 PolarHBondContact O-N 2.94Å; P557-I561 VanDerWaalsContact O-CG1 3.25Å; P557-I561 WeakPolarHBondContact O-CG1 3.25Å; P557-I561 PolarHBondContact O-N 3.27Å
558	G	88.3	Confident	85.5	Confident	8 Å²	8	43.8 Å²	43.8	8%	0.082	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-42.5	177.1	0	0	0	0	0	112.3	V555 L556 I561 S562 A607	V555-G558 PolarHBondContact O-N 2.83Å; V555-G558 VanDerWaalsContact O-N 3.12Å; L556-G558 VanDerWaalsContact C-N 3.3Å; L556-G558 PolarHBondContact O-N 3.47Å; G558-I561 PolarHBondContact O-N 3.27Å; G558-S562 WeakPolarHBondContact O-CB 3.46Å; G558-S562 PolarHBondContact O-N 3.04Å; G558-S562 PolarHBondContact O-OG 3.44Å; G558-A607 VanDerWaalsContact CA-O 3.29Å; G558-A607 WeakPolarHBondContact CA-O 3.42Å
559	N	90.1	Very high	86	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.1	-48.5	175.5	-87.1	-25.7	0	0	0	112.5	M245 V555 L556 P557 I561 S562 A563 V610 N614	M245-N559 HydrophobicContact CG-CB 3.39Å; M245-N559 HydrophobicContact SD-CB 3.92Å; V555-N559 PolarHBondContact O-N 3.35Å; L556-N559 WeakPolarHBondContact O-CB 3.49Å; L556-N559 PolarHBondContact O-N 3.39Å; P557-N559 VanDerWaalsContact C-N 3.33Å; P557-N559 PolarHBondContact O-N 2.94Å; N559-I561 VanDerWaalsContact C-N 3.32Å; N559-I561 PolarHBondContact O-N 3.42Å; N559-S562 PolarHBondContact O-N 3.26Å; N559-S562 PolarHBondContact O-OG 3.48Å; N559-A563 WeakPolarHBondContact O-CB 3.35Å; N559-A563 PolarHBondContact O-N 3.36Å; N559-V610 WeakPolarHBondContact OD1-CG2 3.26Å; N559-N614 PolarHBondContact OD1-ND2 3.37Å; N559-N614 PolarHBondContact OD1-OD1 3.29Å
560	I	91.2	Very high	86.2	Confident	68 Å²	68	42.3 Å²	42.3	35%	0.349	22%	0.223	S	C	.	.	H	α-helix	trans	-59.2	-46.2	178.9	-66.8	162.1	0	0	0	110.4	W242 M245 L556 P557 S562 A563 L564	W242-I560 HydrophobicContact CH2-CG1 4.38Å; W242-I560 HydrophobicContact CH2-CG2 4.16Å; W242-I560 HydrophobicContact CZ3-CG1 4.38Å; M245-I560 HydrophobicContact SD-CG1 3.83Å; L556-I560 WeakPolarHBondContact O-CG1 3.24Å; L556-I560 PolarHBondContact O-N 3.25Å; P557-I560 PolarHBondContact O-N 2.94Å; I560-S562 PolarHBondContact O-N 3.06Å; I560-A563 PolarHBondContact O-N 3.38Å; I560-L564 HydrophobicContact CG2-CD1 3.92Å; I560-L564 HydrophobicContact CG2-CG 4.47Å; I560-L564 VanDerWaalsContact O-CG 3.29Å; I560-L564 WeakPolarHBondContact O-CG 3.44Å; I560-L564 PolarHBondContact O-N 2.9Å
561	I	89.9	Confident	86.6	Confident	98 Å²	98	39.2 Å²	39.2	50%	0.503	21%	0.207	S	C	.	.	H	α-helix	trans	-60	-49.1	177.4	-68.7	167.8	0	0	0	109.9	P557 G558 N559 A563 L564 F565	P557-I561 VanDerWaalsContact O-CG1 3.25Å; P557-I561 WeakPolarHBondContact O-CG1 3.25Å; P557-I561 PolarHBondContact O-N 3.27Å; G558-I561 PolarHBondContact O-N 3.27Å; N559-I561 VanDerWaalsContact C-N 3.32Å; N559-I561 PolarHBondContact O-N 3.42Å; I561-A563 VanDerWaalsContact C-N 3.33Å; I561-A563 PolarHBondContact O-N 2.86Å; I561-L564 PolarHBondContact O-N 3.27Å; I561-F565 HydrophobicContact CG2-CD2 3.77Å; I561-F565 HydrophobicContact CG2-CE2 4.11Å; I561-F565 VanDerWaalsContact O-CD2 3.25Å; I561-F565 WeakPolarHBondContact O-CD2 3.45Å; I561-F565 PolarHBondContact O-N 3.24Å; I561-F565 VanDerWaalsContact O-N 3.08Å
562	S	88.4	Confident	87.2	Confident	3 Å²	3	39.5 Å²	39.5	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-61	-40.9	-179.6	71.8	0	0	0	0	112.4	G558 N559 I560 F565 M566 N614	G558-S562 WeakPolarHBondContact O-CB 3.46Å; G558-S562 PolarHBondContact O-N 3.04Å; G558-S562 PolarHBondContact O-OG 3.44Å; N559-S562 PolarHBondContact O-N 3.26Å; N559-S562 PolarHBondContact O-OG 3.48Å; I560-S562 PolarHBondContact O-N 3.06Å; S562-F565 PolarHBondContact O-N 2.96Å; S562-M566 WeakPolarHBondContact O-CA 3.45Å; S562-M566 WeakPolarHBondContact O-CB 3.12Å; S562-M566 PolarHBondContact O-N 3.29Å; S562-N614 PolarHBondContact OG-ND2 2.81Å
563	A	87.3	Confident	87.6	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-64.2	-44.5	178.9	0	0	0	0	0	112	S241 W242 N559 I560 I561 F565	S241-A563 VanDerWaalsContact CB-CA 3.47Å; W242-A563 HydrophobicContact CD2-CB 4.14Å; W242-A563 HydrophobicContact CG-CB 4.19Å; W242-A563 HydrophobicContact CZ2-CB 4.18Å; N559-A563 WeakPolarHBondContact O-CB 3.35Å; N559-A563 PolarHBondContact O-N 3.36Å; I560-A563 PolarHBondContact O-N 3.38Å; I561-A563 VanDerWaalsContact C-N 3.33Å; I561-A563 PolarHBondContact O-N 2.86Å; A563-F565 VanDerWaalsContact C-N 3.3Å; A563-F565 PolarHBondContact O-N 3.41Å
564	L	88.8	Confident	87.8	Confident	89 Å²	89	44.7 Å²	44.7	47%	0.466	22%	0.22	S	C	.	.	H	α-helix	trans	-68.1	-27.6	179.3	-68.3	174.3	0	0	0	113.6	W242 I560 I561	W242-L564 HydrophobicContact CZ2-CD2 4.08Å; W242-L564 HydrophobicContact CZ2-CG 4.36Å; I560-L564 HydrophobicContact CG2-CD1 3.92Å; I560-L564 HydrophobicContact CG2-CG 4.47Å; I560-L564 VanDerWaalsContact O-CG 3.29Å; I560-L564 WeakPolarHBondContact O-CG 3.44Å; I560-L564 PolarHBondContact O-N 2.9Å; I561-L564 PolarHBondContact O-N 3.27Å
565	F	87.6	Confident	88.1	Confident	90 Å²	90	43.8 Å²	43.8	40%	0.395	21%	0.213	S	C	.	.	H	α-helix	trans	-100.3	-11.6	-178.8	-75.8	-71.5	0	0	0	114.1	I561 S562 A563 D567 K568 I569 I574	I561-F565 HydrophobicContact CG2-CD2 3.77Å; I561-F565 HydrophobicContact CG2-CE2 4.11Å; I561-F565 VanDerWaalsContact O-CD2 3.25Å; I561-F565 WeakPolarHBondContact O-CD2 3.45Å; I561-F565 PolarHBondContact O-N 3.24Å; I561-F565 VanDerWaalsContact O-N 3.08Å; S562-F565 PolarHBondContact O-N 2.96Å; A563-F565 VanDerWaalsContact C-N 3.3Å; A563-F565 PolarHBondContact O-N 3.41Å; F565-D567 VanDerWaalsContact C-N 3.27Å; F565-D567 PolarHBondContact O-N 2.73Å; F565-K568 HydrophobicContact CD1-CB 4.48Å; F565-K568 HydrophobicContact CD1-CD 4.41Å; F565-K568 PolarHBondContact O-N 2.97Å; F565-I569 HydrophobicContact CB-CD1 3.77Å; F565-I569 HydrophobicContact CB-CG1 4.09Å; F565-I569 HydrophobicContact CD1-CD1 3.59Å; F565-I569 HydrophobicContact CD1-CG1 3.91Å; F565-I569 HydrophobicContact CE1-CD1 4.4Å; F565-I569 HydrophobicContact CG-CD1 3.83Å; F565-I569 HydrophobicContact CG-CG1 4.38Å; F565-I569 PolarHBondContact O-N 2.78Å; F565-I574 HydrophobicContact CB-CD1 4.48Å
566	M	84.4	Confident	88.3	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-53.3	-46.7	-177.2	-161	65.2	114.3	0	0	112	S241 S562 K568 G570 R571 I574 N614 G615 V618	S241-M566 WeakPolarHBondContact OG-CE 3.21Å; S562-M566 WeakPolarHBondContact O-CA 3.45Å; S562-M566 WeakPolarHBondContact O-CB 3.12Å; S562-M566 PolarHBondContact O-N 3.29Å; M566-K568 VanDerWaalsContact C-N 3.35Å; M566-G570 PolarHBondContact O-N 2.86Å; M566-R571 HydrophobicContact CG-CG 4.37Å; M566-R571 HydrophobicContact SD-CG 4Å; M566-I574 VanDerWaalsContact CA-CD1 3.42Å; M566-I574 HydrophobicContact CB-CD1 4.38Å; M566-I574 HydrophobicContact SD-CD1 3.67Å; M566-N614 VanDerWaalsContact CE-C 3.49Å; M566-N614 HydrophobicContact CE-CB 4.14Å; M566-N614 WeakPolarHBondContact CE-O 3.26Å; M566-G615 VanDerWaalsContact CE-CA 3.43Å; M566-V618 HydrophobicContact CE-CB 4.02Å; M566-V618 HydrophobicContact CE-CG2 3.7Å
567	D	81.4	Confident	88.5	Confident	26 Å²	26	44 Å²	44	14%	0.139	22%	0.223	C	C	.	.	H	α-helix	trans	-86.2	-6.3	-177.7	-64.7	-14.3	0	0	0	112.6	E238 F565 R571 R684	E238-D567 WeakPolarHBondContact CB-OD2 3.46Å; E238-D567 PolarHBondContact N-OD1 3.41Å; E238-D567 PolarHBondContact N-OD2 2.89Å; F565-D567 VanDerWaalsContact C-N 3.27Å; F565-D567 PolarHBondContact O-N 2.73Å; D567-R571 IonicContact OD1-CZ 2.79Å; D567-R571 IonicContact OD1-NH2 2.76Å; D567-R571 PolarHBondContact OD1-NH2 2.86Å; D567-R684 PolarHBondContact O-NE 3.05Å; D567-R684 VanDerWaalsContact O-NE 3.14Å; D567-R684 PolarHBondContact O-NH1 2.65Å; D567-R684 PolarHBondContact O-NH2 2.83Å
568	K	83.6	Confident	88.7	Confident	150 Å²	150	41.2 Å²	41.2	65%	0.652	21%	0.205	S	C	*	.	H	α-helix	trans	-99.4	-47.8	177.6	-68.9	-177.5	-175.9	173.2	0	113.2	F565 M566 R684	F565-K568 HydrophobicContact CD1-CB 4.48Å; F565-K568 HydrophobicContact CD1-CD 4.41Å; F565-K568 PolarHBondContact O-N 2.97Å; M566-K568 VanDerWaalsContact C-N 3.35Å; K568-R684 PolarHBondContact O-NH1 3.38Å
569	I	84.1	Confident	89	Confident	72 Å²	72	40.9 Å²	40.9	37%	0.369	20%	0.201	S	C	.	.	H	α-helix	trans	-88.8	-26.7	-171.8	-61.6	-177.2	0	0	0	111.3	F565 R573 I574	F565-I569 HydrophobicContact CB-CD1 3.77Å; F565-I569 HydrophobicContact CB-CG1 4.09Å; F565-I569 HydrophobicContact CD1-CD1 3.59Å; F565-I569 HydrophobicContact CD1-CG1 3.91Å; F565-I569 HydrophobicContact CE1-CD1 4.4Å; F565-I569 HydrophobicContact CG-CD1 3.83Å; F565-I569 HydrophobicContact CG-CG1 4.38Å; F565-I569 PolarHBondContact O-N 2.78Å; I569-R573 HydrophobicContact CG2-CB 3.73Å; I569-R573 WeakPolarHBondContact O-CD 3.28Å; I569-I574 HydrophobicContact CB-CD1 4.27Å; I569-I574 HydrophobicContact CB-CG1 4.15Å; I569-I574 HydrophobicContact CG2-CG1 4.08Å
570	G	84.2	Confident	89.3	Confident	2 Å²	2	43.6 Å²	43.6	2%	0.021	22%	0.216	C	C	.	.			trans	93	153.5	-173.7	0	0	0	0	0	112.2	M566 I574	M566-G570 PolarHBondContact O-N 2.86Å; G570-I574 WeakPolarHBondContact O-CG1 3.49Å; G570-I574 PolarHBondContact O-N 3.44Å
571	R	87.7	Confident	89.5	Confident	4 Å²	4	42.4 Å²	42.4	2%	0.015	22%	0.216	C	C	.	.	H	α-helix	trans	-70.4	-44.9	-167.1	-75.7	72.3	-176.2	-176	1.7	110.5	G237 M566 D567 R573 I574 I575 V618 E622 E682	G237-R571 VanDerWaalsContact CA-NH2 3.33Å; M566-R571 HydrophobicContact CG-CG 4.37Å; M566-R571 HydrophobicContact SD-CG 4Å; D567-R571 IonicContact OD1-CZ 2.79Å; D567-R571 IonicContact OD1-NH2 2.76Å; D567-R571 PolarHBondContact OD1-NH2 2.86Å; R571-R573 PolarHBondContact O-N 3.02Å; R571-I574 PolarHBondContact O-N 3.5Å; R571-I575 VanDerWaalsContact O-CG1 3.29Å; R571-I575 WeakPolarHBondContact O-CG1 3.35Å; R571-I575 PolarHBondContact O-N 2.89Å; R571-V618 HydrophobicContact CG-CG1 3.98Å; R571-E622 IonicContact NE-OE2 3.78Å; R571-E682 PolarHBondContact N-OE1 3.4Å
572	I	89.1	Confident	89.8	Confident	15 Å²	15	37.8 Å²	37.8	8%	0.077	19%	0.192	C	C	.	.	H	α-helix	trans	-63.9	-45.2	-177	-64	172.5	0	0	0	111.6	I574 I575 G576 I619 A677 L678 L680 E682	I572-I574 VanDerWaalsContact C-N 3.25Å; I572-I574 PolarHBondContact O-N 3.29Å; I572-I575 PolarHBondContact O-N 3Å; I572-G576 PolarHBondContact O-N 2.84Å; I572-I619 HydrophobicContact CG1-CD1 4.35Å; I572-A677 WeakPolarHBondContact CG2-O 3.06Å; I572-L678 HydrophobicContact CG2-CD2 4.23Å; I572-L680 HydrophobicContact CD1-CB 4.27Å; I572-L680 WeakPolarHBondContact CD1-O 3.38Å; I572-L680 HydrophobicContact CG1-CB 4.32Å; I572-E682 VanDerWaalsContact CD1-CA 3.42Å; I572-E682 HydrophobicContact CD1-CB 3.85Å; I572-E682 VanDerWaalsContact CD1-N 3.27Å
573	R	90.8	Very high	90.1	Very high	176 Å²	176	38 Å²	38	66%	0.664	19%	0.194	S	C	*	.	H	α-helix	trans	-65.1	-34.2	-178.7	-68.6	-173.9	-168	168.3	1.3	111.3	I569 R571 G577	I569-R573 HydrophobicContact CG2-CB 3.73Å; I569-R573 WeakPolarHBondContact O-CD 3.28Å; R571-R573 PolarHBondContact O-N 3.02Å; R573-G577 WeakPolarHBondContact O-CA 3.3Å; R573-G577 PolarHBondContact O-N 3.35Å
574	I	91.7	Very high	90.5	Very high	16 Å²	16	40.3 Å²	40.3	8%	0.082	21%	0.213	C	C	.	.	H	α-helix	trans	-67.1	-49	172.8	-71.3	168.7	0	0	0	110.5	F565 M566 I569 G570 R571 I572 S578 A611	F565-I574 HydrophobicContact CB-CD1 4.48Å; M566-I574 VanDerWaalsContact CA-CD1 3.42Å; M566-I574 HydrophobicContact CB-CD1 4.38Å; M566-I574 HydrophobicContact SD-CD1 3.67Å; I569-I574 HydrophobicContact CB-CD1 4.27Å; I569-I574 HydrophobicContact CB-CG1 4.15Å; I569-I574 HydrophobicContact CG2-CG1 4.08Å; G570-I574 WeakPolarHBondContact O-CG1 3.49Å; G570-I574 PolarHBondContact O-N 3.44Å; R571-I574 PolarHBondContact O-N 3.5Å; I572-I574 VanDerWaalsContact C-N 3.25Å; I572-I574 PolarHBondContact O-N 3.29Å; I574-S578 WeakPolarHBondContact O-CB 3.32Å; I574-S578 PolarHBondContact O-N 3.42Å; I574-S578 PolarHBondContact O-OG 3.02Å; I574-A611 HydrophobicContact CG2-CB 4.05Å; I574-A611 WeakPolarHBondContact CG2-O 3.21Å
575	I	92.9	Very high	90.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.6	-58.8	178.6	-60.9	162.7	0	0	0	110.5	V402 R571 I572 G577 S578 M579 L616 I619 A677	V402-I575 HydrophobicContact CG1-CG2 4.02Å; R571-I575 VanDerWaalsContact O-CG1 3.29Å; R571-I575 WeakPolarHBondContact O-CG1 3.35Å; R571-I575 PolarHBondContact O-N 2.89Å; I572-I575 PolarHBondContact O-N 3Å; I575-G577 PolarHBondContact O-N 3.34Å; I575-S578 PolarHBondContact O-N 3.45Å; I575-S578 PolarHBondContact O-OG 3.32Å; I575-S578 VanDerWaalsContact O-OG 3.11Å; I575-M579 HydrophobicContact CG2-SD 3.91Å; I575-M579 WeakPolarHBondContact O-CB 3.14Å; I575-M579 VanDerWaalsContact O-CG 3.24Å; I575-M579 WeakPolarHBondContact O-CG 3.49Å; I575-M579 PolarHBondContact O-N 2.91Å; I575-L616 HydrophobicContact CG2-CD2 4.36Å; I575-L616 HydrophobicContact CG2-CG 4.32Å; I575-I619 HydrophobicContact CD1-CB 4.41Å; I575-I619 HydrophobicContact CD1-CD1 4.4Å; I575-I619 HydrophobicContact CD1-CG2 3.96Å; I575-A677 HydrophobicContact CB-CB 4.38Å; I575-A677 HydrophobicContact CG2-CB 3.66Å
576	G	93.2	Very high	90.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.4	-44.1	-177.7	0	0	0	0	0	112.7	I572 L580	I572-G576 PolarHBondContact O-N 2.84Å; G576-L580 WeakPolarHBondContact O-CB 3.48Å; G576-L580 VanDerWaalsContact O-CG 3.24Å; G576-L580 WeakPolarHBondContact O-CG 3.18Å; G576-L580 PolarHBondContact O-N 3.27Å
577	G	93.5	Very high	91.2	Very high	38 Å²	38	36.9 Å²	36.9	39%	0.392	20%	0.195	S	C	.	.	H	α-helix	trans	-64.2	-44.1	179.6	0	0	0	0	0	112.9	R573 I575 A581	R573-G577 WeakPolarHBondContact O-CA 3.3Å; R573-G577 PolarHBondContact O-N 3.35Å; I575-G577 PolarHBondContact O-N 3.34Å; G577-A581 VanDerWaalsContact O-CB 3.29Å; G577-A581 WeakPolarHBondContact O-CB 3.41Å; G577-A581 PolarHBondContact O-N 3.24Å
578	S	94.7	Very high	91.7	Very high	10 Å²	10	38.5 Å²	38.5	7%	0.07	20%	0.204	C	C	.	.	H	α-helix	trans	-72.2	-35.8	178.6	60.3	0	0	0	0	112.9	I574 I575 A581 S582 V608 A612	I574-S578 WeakPolarHBondContact O-CB 3.32Å; I574-S578 PolarHBondContact O-N 3.42Å; I574-S578 PolarHBondContact O-OG 3.02Å; I575-S578 PolarHBondContact O-N 3.45Å; I575-S578 PolarHBondContact O-OG 3.32Å; I575-S578 VanDerWaalsContact O-OG 3.11Å; S578-A581 PolarHBondContact O-N 3.42Å; S578-S582 VanDerWaalsContact O-CB 3.25Å; S578-S582 WeakPolarHBondContact O-CB 3.25Å; S578-S582 PolarHBondContact O-N 3.44Å; S578-S582 PolarHBondContact O-OG 3.03Å; S578-V608 WeakPolarHBondContact CB-O 3.29Å; S578-A612 VanDerWaalsContact OG-CA 3.23Å; S578-A612 WeakPolarHBondContact OG-CA 3.2Å; S578-A612 WeakPolarHBondContact OG-CB 3.34Å; S578-A612 PolarHBondContact OG-N 3.44Å
579	M	95.6	Very high	91.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.8	-43.2	173.4	-71.2	-177	82.1	0	0	111.7	V402 C405 M406 I575 S582 S583 A612 L670	V402-M579 HydrophobicContact CG1-CE 4.23Å; V402-M579 HydrophobicContact CG1-SD 3.69Å; C405-M579 HydrophobicContact CB-CE 4.4Å; M406-M579 HydrophobicContact CB-CE 4.02Å; M406-M579 HydrophobicContact SD-CE 4.22Å; M406-M579 HydrophobicContact SD-CG 4.09Å; I575-M579 HydrophobicContact CG2-SD 3.91Å; I575-M579 WeakPolarHBondContact O-CB 3.14Å; I575-M579 VanDerWaalsContact O-CG 3.24Å; I575-M579 WeakPolarHBondContact O-CG 3.49Å; I575-M579 PolarHBondContact O-N 2.91Å; M579-S582 PolarHBondContact O-N 2.85Å; M579-S583 PolarHBondContact O-N 2.99Å; M579-A612 HydrophobicContact CG-CB 3.72Å; M579-L670 HydrophobicContact CE-CD2 4.33Å
580	L	96.1	Very high	92.1	Very high	58 Å²	58	29.7 Å²	29.7	30%	0.304	17%	0.165	S	C	.	.	H	α-helix	trans	-67.3	-41.8	176.4	-67.8	172.7	0	0	0	111.8	G576 S582 S583 A584	G576-L580 WeakPolarHBondContact O-CB 3.48Å; G576-L580 VanDerWaalsContact O-CG 3.24Å; G576-L580 WeakPolarHBondContact O-CG 3.18Å; G576-L580 PolarHBondContact O-N 3.27Å; L580-S582 VanDerWaalsContact C-N 3.31Å; L580-S582 PolarHBondContact O-N 2.86Å; L580-S583 PolarHBondContact O-N 2.71Å; L580-S583 PolarHBondContact O-OG 2.82Å; L580-A584 PolarHBondContact O-N 3.44Å
581	A	95.1	Very high	92.2	Very high	43 Å²	43	35.2 Å²	35.2	36%	0.355	19%	0.193	S	C	.	.	H	α-helix	trans	-63.2	-38.3	174	0	0	0	0	0	112	G577 S578 A584 C585 V608	G577-A581 VanDerWaalsContact O-CB 3.29Å; G577-A581 WeakPolarHBondContact O-CB 3.41Å; G577-A581 PolarHBondContact O-N 3.24Å; S578-A581 PolarHBondContact O-N 3.42Å; A581-A584 WeakPolarHBondContact O-CB 3.39Å; A581-A584 PolarHBondContact O-N 2.88Å; A581-C585 PolarHBondContact O-N 3.44Å; A581-C585 PolarHBondContact O-SG 3.32Å; A581-V608 HydrophobicContact CB-CG1 3.56Å
582	S	95.3	Very high	92.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.2	-36.9	174.5	-59.3	0	0	0	0	112	S578 M579 L580 A584 C585 T586 V608 S609	S578-S582 VanDerWaalsContact O-CB 3.25Å; S578-S582 WeakPolarHBondContact O-CB 3.25Å; S578-S582 PolarHBondContact O-N 3.44Å; S578-S582 PolarHBondContact O-OG 3.03Å; M579-S582 PolarHBondContact O-N 2.85Å; L580-S582 VanDerWaalsContact C-N 3.31Å; L580-S582 PolarHBondContact O-N 2.86Å; S582-A584 VanDerWaalsContact C-N 3.34Å; S582-C585 PolarHBondContact O-N 3.17Å; S582-T586 WeakPolarHBondContact O-CB 3.37Å; S582-T586 PolarHBondContact O-N 3.43Å; S582-T586 PolarHBondContact O-OG1 2.89Å; S582-V608 WeakPolarHBondContact OG-CG1 3.43Å; S582-S609 WeakPolarHBondContact CB-OG 3.15Å; S582-S609 WeakPolarHBondContact OG-CA 3.47Å; S582-S609 PolarHBondContact OG-N 2.95Å; S582-S609 PolarHBondContact OG-OG 3.4Å
583	S	95.5	Very high	91.8	Very high	8 Å²	8	42.7 Å²	42.7	6%	0.056	23%	0.226	C	C	.	.	H	α-helix	trans	-63.2	-39.7	172.4	75.4	0	0	0	0	111.8	M579 L580 C585 T586 F587 F667	M579-S583 PolarHBondContact O-N 2.99Å; L580-S583 PolarHBondContact O-N 2.71Å; L580-S583 PolarHBondContact O-OG 2.82Å; S583-C585 PolarHBondContact O-N 2.92Å; S583-T586 WeakPolarHBondContact O-CB 3.27Å; S583-T586 PolarHBondContact O-N 2.96Å; S583-F587 PolarHBondContact O-N 3.22Å; S583-F667 WeakPolarHBondContact O-CD2 3.22Å
584	A	94.7	Very high	91.5	Very high	50 Å²	50	37.7 Å²	37.7	41%	0.413	22%	0.218	S	C	.	.	H	α-helix	trans	-63.2	-44	176.4	0	0	0	0	0	111.3	L580 A581 S582 T586 F587 L588	L580-A584 PolarHBondContact O-N 3.44Å; A581-A584 WeakPolarHBondContact O-CB 3.39Å; A581-A584 PolarHBondContact O-N 2.88Å; S582-A584 VanDerWaalsContact C-N 3.34Å; A584-T586 VanDerWaalsContact C-N 3.31Å; A584-T586 PolarHBondContact O-N 3.48Å; A584-F587 PolarHBondContact O-N 3.34Å; A584-L588 VanDerWaalsContact O-CG 3.3Å; A584-L588 WeakPolarHBondContact O-CG 3.47Å; A584-L588 PolarHBondContact O-N 3.05Å; A584-L588 VanDerWaalsContact O-N 3.1Å
585	C	92.9	Very high	91.1	Very high	12 Å²	12	39.8 Å²	39.8	8%	0.081	23%	0.227	C	C	.	.	H	α-helix	trans	-60.2	-42.4	174.2	-60.8	0	0	0	0	111.6	A581 S582 S583 L588 L589 W601	A581-C585 PolarHBondContact O-N 3.44Å; A581-C585 PolarHBondContact O-SG 3.32Å; S582-C585 PolarHBondContact O-N 3.17Å; S583-C585 PolarHBondContact O-N 2.92Å; C585-L588 PolarHBondContact O-N 3.39Å; C585-L589 PolarHBondContact O-N 3.23Å; C585-W601 HydrophobicContact CB-CE3 4.41Å
586	T	92	Very high	90.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.5	-41.9	178.6	-55	0	0	0	0	111.4	L413 S582 S583 A584 L588 L589 F605 I663 A666	L413-T586 HydrophobicContact CD1-CG2 3.91Å; S582-T586 WeakPolarHBondContact O-CB 3.37Å; S582-T586 PolarHBondContact O-N 3.43Å; S582-T586 PolarHBondContact O-OG1 2.89Å; S583-T586 WeakPolarHBondContact O-CB 3.27Å; S583-T586 PolarHBondContact O-N 2.96Å; A584-T586 VanDerWaalsContact C-N 3.31Å; A584-T586 PolarHBondContact O-N 3.48Å; T586-L588 VanDerWaalsContact C-N 3.3Å; T586-L588 PolarHBondContact O-N 3.32Å; T586-L589 HydrophobicContact CG2-CD1 4.42Å; T586-L589 VanDerWaalsContact O-CB 3.25Å; T586-L589 WeakPolarHBondContact O-CB 3.4Å; T586-L589 PolarHBondContact O-N 3.47Å; T586-F605 WeakPolarHBondContact OG1-CD2 3.29Å; T586-I663 HydrophobicContact CG2-CG2 4.1Å; T586-I663 WeakPolarHBondContact O-CG2 3.45Å; T586-A666 HydrophobicContact CG2-CB 3.9Å
587	F	92	Very high	90.5	Very high	94 Å²	94	43.4 Å²	43.4	41%	0.412	26%	0.262	S	S	.	.	H	α-helix	trans	-62.6	-38.2	176.4	-176.1	-101.4	0	0	0	112.1	S583 A584 L589 L590 F664 F667	S583-F587 PolarHBondContact O-N 3.22Å; A584-F587 PolarHBondContact O-N 3.34Å; F587-L589 PolarHBondContact O-N 2.96Å; F587-L590 HydrophobicContact CD2-CD1 3.94Å; F587-L590 HydrophobicContact CE2-CD1 3.84Å; F587-L590 HydrophobicContact CZ-CD1 4.44Å; F587-L590 WeakPolarHBondContact O-CB 3.48Å; F587-L590 WeakPolarHBondContact O-CG 3.4Å; F587-L590 PolarHBondContact O-N 3.01Å; F587-L590 VanDerWaalsContact O-N 3.13Å; F587-F664 HydrophobicContact CE2-CE1 4.35Å; F587-F664 HydrophobicContact CE2-CZ 4.34Å; F587-F667 HydrophobicContact CB-CD2 3.87Å; F587-F667 HydrophobicContact CB-CE2 4.04Å; F587-F667 HydrophobicContact CD2-CD2 4.45Å; F587-F667 HydrophobicContact CD2-CE2 4.43Å; F587-F667 HydrophobicContact CG-CE2 4.48Å
588	L	90.8	Very high	90.2	Very high	60 Å²	60	42 Å²	42	31%	0.314	25%	0.246	S	C	.	.	H	α-helix	trans	-68.3	-16.8	178.2	-67	170.9	0	0	0	113.5	A584 C585 T586 L590 L591 W601	A584-L588 VanDerWaalsContact O-CG 3.3Å; A584-L588 WeakPolarHBondContact O-CG 3.47Å; A584-L588 PolarHBondContact O-N 3.05Å; A584-L588 VanDerWaalsContact O-N 3.1Å; C585-L588 PolarHBondContact O-N 3.39Å; T586-L588 VanDerWaalsContact C-N 3.3Å; T586-L588 PolarHBondContact O-N 3.32Å; L588-L590 PolarHBondContact O-N 2.98Å; L588-L591 HydrophobicContact CD2-CD1 4.04Å; L588-L591 PolarHBondContact O-N 3.41Å; L588-L591 VanDerWaalsContact O-N 3.09Å; L588-W601 HydrophobicContact CB-CD2 4.29Å; L588-W601 HydrophobicContact CB-CE3 4.2Å; L588-W601 HydrophobicContact CB-CH2 3.86Å; L588-W601 HydrophobicContact CB-CZ2 3.88Å; L588-W601 HydrophobicContact CB-CZ3 3.99Å; L588-W601 HydrophobicContact CD1-CH2 3.36Å; L588-W601 HydrophobicContact CD1-CZ2 4.11Å; L588-W601 HydrophobicContact CD1-CZ3 3.62Å; L588-W601 HydrophobicContact CG-CH2 4.19Å; L588-W601 HydrophobicContact CG-CZ3 4.45Å
589	L	88.6	Confident	89.8	Confident	5 Å²	5	43.3 Å²	43.3	3%	0.026	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-60	-25.8	169.9	-71.3	165.7	0	0	0	112.7	W416 F417 C585 T586 F587 L591 S592 W601 I663	W416-L589 HydrophobicContact CZ3-CD1 4.48Å; F417-L589 HydrophobicContact CE1-CD1 3.66Å; F417-L589 HydrophobicContact CE1-CD2 3.92Å; F417-L589 HydrophobicContact CE1-CG 4.48Å; F417-L589 HydrophobicContact CZ-CD1 3.79Å; C585-L589 PolarHBondContact O-N 3.23Å; T586-L589 HydrophobicContact CG2-CD1 4.42Å; T586-L589 VanDerWaalsContact O-CB 3.25Å; T586-L589 WeakPolarHBondContact O-CB 3.4Å; T586-L589 PolarHBondContact O-N 3.47Å; F587-L589 PolarHBondContact O-N 2.96Å; L589-L591 PolarHBondContact O-N 3.26Å; L589-S592 VanDerWaalsContact O-CB 3.29Å; L589-S592 WeakPolarHBondContact O-CB 3.45Å; L589-S592 PolarHBondContact O-N 3.45Å; L589-S592 PolarHBondContact O-OG 2.94Å; L589-W601 HydrophobicContact CD2-CB 3.3Å; L589-W601 HydrophobicContact CD2-CG 4.04Å; L589-W601 HydrophobicContact CG-CB 4.05Å; L589-I663 HydrophobicContact CB-CD1 3.88Å; L589-I663 HydrophobicContact CB-CG1 4.36Å
590	L	87.4	Confident	89.4	Confident	33 Å²	33	47.3 Å²	47.3	17%	0.173	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-58.9	-31.7	175.9	-68.4	172.4	0	0	0	112.2	F587 L588 S592 I660 I663 F664	F587-L590 HydrophobicContact CD2-CD1 3.94Å; F587-L590 HydrophobicContact CE2-CD1 3.84Å; F587-L590 HydrophobicContact CZ-CD1 4.44Å; F587-L590 WeakPolarHBondContact O-CB 3.48Å; F587-L590 WeakPolarHBondContact O-CG 3.4Å; F587-L590 PolarHBondContact O-N 3.01Å; F587-L590 VanDerWaalsContact O-N 3.13Å; L588-L590 PolarHBondContact O-N 2.98Å; L590-S592 VanDerWaalsContact C-N 3.25Å; L590-S592 PolarHBondContact O-N 3.49Å; L590-I660 HydrophobicContact CD2-CG1 4.36Å; L590-I663 HydrophobicContact CD2-CB 4.15Å; L590-I663 HydrophobicContact CD2-CD1 3.82Å; L590-I663 HydrophobicContact CD2-CG2 3.93Å; L590-I663 HydrophobicContact CG-CD1 4.36Å; L590-I663 HydrophobicContact CG-CG2 3.88Å; L590-F664 HydrophobicContact CD1-CE2 3.75Å; L590-F664 HydrophobicContact CD1-CZ 3.87Å; L590-F664 HydrophobicContact CD2-CE2 4.23Å
591	L	87.2	Confident	89.1	Confident	118 Å²	118	47.9 Å²	47.9	62%	0.618	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-83.8	0.8	-179.5	-55.7	178.1	0	0	0	112.9	L588 L589 F593	L588-L591 HydrophobicContact CD2-CD1 4.04Å; L588-L591 PolarHBondContact O-N 3.41Å; L588-L591 VanDerWaalsContact O-N 3.09Å; L589-L591 PolarHBondContact O-N 3.26Å; L591-F593 WeakPolarHBondContact O-CD2 3.35Å; L591-F593 WeakPolarHBondContact O-CE2 3.39Å
592	S	85	Confident	88.7	Confident	6 Å²	6	46.1 Å²	46.1	4%	0.042	26%	0.261	C	S	.	.			trans	-88.4	122.3	-176.9	-59.9	0	0	0	0	111.5	L589 L590 K659	L589-S592 VanDerWaalsContact O-CB 3.29Å; L589-S592 WeakPolarHBondContact O-CB 3.45Å; L589-S592 PolarHBondContact O-N 3.45Å; L589-S592 PolarHBondContact O-OG 2.94Å; L590-S592 VanDerWaalsContact C-N 3.25Å; L590-S592 PolarHBondContact O-N 3.49Å; S592-K659 PolarHBondContact O-NZ 2.88Å
593	F	81.9	Confident	88.5	Confident	170 Å²	170	47.6 Å²	47.6	75%	0.746	27%	0.271	S	S	*	.			trans	-121	-7.8	178.2	-58.1	-79.2	0	0	0	113.5	L591	L591-F593 WeakPolarHBondContact O-CD2 3.35Å; L591-F593 WeakPolarHBondContact O-CE2 3.39Å
594	S	85.8	Confident	88.3	Confident	71 Å²	71	50.7 Å²	50.7	50%	0.497	29%	0.287	S	S	.	.	S	Bend	trans	-114.3	145.5	179.5	172.8	0	0	0	0	110.2	G596 A597 V598	S594-G596 VanDerWaalsContact C-N 3.26Å; S594-G596 PolarHBondContact O-N 3.46Å; S594-G596 PolarHBondContact OG-N 2.87Å; S594-A597 WeakPolarHBondContact O-CB 3.03Å; S594-A597 PolarHBondContact O-N 2.94Å; S594-A597 VanDerWaalsContact O-N 3.09Å; S594-V598 PolarHBondContact O-N 3.26Å; S594-V598 VanDerWaalsContact O-N 3.14Å
595	Q	83.6	Confident	88.2	Confident	59 Å²	59	48.3 Å²	48.3	28%	0.276	27%	0.267	S	S	.	.	H	α-helix	trans	-52.7	-44.5	173.8	-173.9	-171.7	-34.8	0	0	111.5	I421 A597 V598 I599	I421-Q595 HydrophobicContact CG2-CG 4.08Å; Q595-A597 VanDerWaalsContact C-N 3.32Å; Q595-A597 PolarHBondContact O-N 3.45Å; Q595-V598 PolarHBondContact O-N 2.74Å; Q595-I599 HydrophobicContact CG-CD1 4.11Å; Q595-I599 WeakPolarHBondContact O-CG1 3.44Å; Q595-I599 PolarHBondContact O-N 3.42Å; Q595-I599 VanDerWaalsContact O-N 3.1Å
596	G	84.6	Confident	88.1	Confident	44 Å²	44	49.1 Å²	49.1	45%	0.454	27%	0.269	S	S	.	.	H	α-helix	trans	-65.2	-34.2	179.7	0	0	0	0	0	113.2	S594 C600	S594-G596 VanDerWaalsContact C-N 3.26Å; S594-G596 PolarHBondContact O-N 3.46Å; S594-G596 PolarHBondContact OG-N 2.87Å; G596-C600 WeakPolarHBondContact O-CB 3.31Å; G596-C600 PolarHBondContact O-N 3.25Å
597	A	87.6	Confident	88.1	Confident	33 Å²	33	50.3 Å²	50.3	27%	0.273	28%	0.278	S	S	.	.	H	α-helix	trans	-66.7	-43.1	175.8	0	0	0	0	0	111.3	S594 Q595 I599 C600 W601	S594-A597 WeakPolarHBondContact O-CB 3.03Å; S594-A597 PolarHBondContact O-N 2.94Å; S594-A597 VanDerWaalsContact O-N 3.09Å; Q595-A597 VanDerWaalsContact C-N 3.32Å; Q595-A597 PolarHBondContact O-N 3.45Å; A597-I599 PolarHBondContact O-N 2.79Å; A597-C600 PolarHBondContact O-N 2.98Å; A597-W601 PolarHBondContact O-N 2.91Å
598	V	86.9	Confident	88.1	Confident	8 Å²	8	47.5 Å²	47.5	5%	0.048	27%	0.269	C	S	.	.	H	α-helix	trans	-63.2	-42.6	177.6	173.6	0	0	0	0	111.8	F417 I421 M424 S594 Q595 C600 W601 Q602	F417-V598 HydrophobicContact CD1-CG1 4.07Å; I421-V598 HydrophobicContact CG1-CG1 4.4Å; M424-V598 HydrophobicContact CE-CB 4.36Å; M424-V598 HydrophobicContact CE-CG1 4.46Å; M424-V598 HydrophobicContact CE-CG2 3.84Å; S594-V598 PolarHBondContact O-N 3.26Å; S594-V598 VanDerWaalsContact O-N 3.14Å; Q595-V598 PolarHBondContact O-N 2.74Å; V598-C600 PolarHBondContact O-N 3.21Å; V598-W601 PolarHBondContact O-N 2.83Å; V598-Q602 VanDerWaalsContact O-CB 3.25Å; V598-Q602 WeakPolarHBondContact O-CB 3.37Å; V598-Q602 PolarHBondContact O-N 2.81Å
599	I	86.3	Confident	88.3	Confident	38 Å²	38	44.7 Å²	44.7	20%	0.195	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-43.3	175.8	-65.5	166.8	0	0	0	111	I421 Q595 A597 Q602 C603	I421-I599 HydrophobicContact CD1-CD1 4.34Å; I421-I599 HydrophobicContact CD1-CG1 3.65Å; I421-I599 HydrophobicContact CG1-CG1 4.44Å; Q595-I599 HydrophobicContact CG-CD1 4.11Å; Q595-I599 WeakPolarHBondContact O-CG1 3.44Å; Q595-I599 PolarHBondContact O-N 3.42Å; Q595-I599 VanDerWaalsContact O-N 3.1Å; A597-I599 PolarHBondContact O-N 2.79Å; I599-Q602 WeakPolarHBondContact O-CB 3.18Å; I599-Q602 PolarHBondContact O-N 2.8Å; I599-C603 PolarHBondContact O-N 3.04Å; I599-C603 PolarHBondContact O-SG 3.34Å; I599-C603 VanDerWaalsContact O-SG 3.34Å
600	C	88.6	Confident	88.4	Confident	84 Å²	84	44.5 Å²	44.5	57%	0.568	25%	0.253	S	S	*	.	H	α-helix	trans	-61	-48.9	179	-174.6	0	0	0	0	111.9	G596 A597 V598 Q602 C603 L604	G596-C600 WeakPolarHBondContact O-CB 3.31Å; G596-C600 PolarHBondContact O-N 3.25Å; A597-C600 PolarHBondContact O-N 2.98Å; V598-C600 PolarHBondContact O-N 3.21Å; C600-Q602 VanDerWaalsContact C-N 3.34Å; C600-Q602 PolarHBondContact O-N 2.81Å; C600-C603 PolarHBondContact O-N 3.48Å; C600-L604 PolarHBondContact O-N 3.09Å
601	W	89.6	Confident	88.7	Confident	69 Å²	69	43.7 Å²	43.7	26%	0.261	25%	0.251	S	S	.	.	H	α-helix	trans	-67.1	-33.6	177.7	-73.5	116.7	0	0	0	113	C585 L588 L589 A597 V598 L604 F605	C585-W601 HydrophobicContact CB-CE3 4.41Å; L588-W601 HydrophobicContact CB-CD2 4.29Å; L588-W601 HydrophobicContact CB-CE3 4.2Å; L588-W601 HydrophobicContact CB-CH2 3.86Å; L588-W601 HydrophobicContact CB-CZ2 3.88Å; L588-W601 HydrophobicContact CB-CZ3 3.99Å; L588-W601 HydrophobicContact CD1-CH2 3.36Å; L588-W601 HydrophobicContact CD1-CZ2 4.11Å; L588-W601 HydrophobicContact CD1-CZ3 3.62Å; L588-W601 HydrophobicContact CG-CH2 4.19Å; L588-W601 HydrophobicContact CG-CZ3 4.45Å; L589-W601 HydrophobicContact CD2-CB 3.3Å; L589-W601 HydrophobicContact CD2-CG 4.04Å; L589-W601 HydrophobicContact CG-CB 4.05Å; A597-W601 PolarHBondContact O-N 2.91Å; V598-W601 PolarHBondContact O-N 2.83Å; W601-L604 HydrophobicContact CE3-CD2 3.76Å; W601-L604 HydrophobicContact CZ3-CD2 3.51Å; W601-L604 PolarHBondContact O-N 2.87Å; W601-F605 VanDerWaalsContact O-CB 3.27Å; W601-F605 WeakPolarHBondContact O-CB 3.34Å; W601-F605 PolarHBondContact O-N 2.93Å
602	Q	87.4	Confident	89	Confident	7 Å²	7	38 Å²	38	3%	0.033	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-50.2	171.8	171.1	-179.7	16.7	0	0	111.3	F417 V598 I599 C600 L604 F605 Y606	F417-Q602 VanDerWaalsContact CB-CD 3.42Å; F417-Q602 HydrophobicContact CB-CG 4.13Å; F417-Q602 VanDerWaalsContact CB-NE2 3.28Å; F417-Q602 HydrophobicContact CD1-CB 3.9Å; F417-Q602 HydrophobicContact CD1-CG 4.18Å; F417-Q602 HydrophobicContact CD2-CB 4.01Å; F417-Q602 HydrophobicContact CD2-CG 3.49Å; F417-Q602 VanDerWaalsContact CD2-CG 3.49Å; F417-Q602 HydrophobicContact CE1-CB 3.89Å; F417-Q602 HydrophobicContact CE1-CG 4.44Å; F417-Q602 HydrophobicContact CE2-CB 3.99Å; F417-Q602 HydrophobicContact CE2-CG 3.78Å; F417-Q602 HydrophobicContact CG-CB 3.97Å; F417-Q602 HydrophobicContact CG-CG 3.71Å; F417-Q602 HydrophobicContact CZ-CB 3.93Å; F417-Q602 HydrophobicContact CZ-CG 4.26Å; V598-Q602 VanDerWaalsContact O-CB 3.25Å; V598-Q602 WeakPolarHBondContact O-CB 3.37Å; V598-Q602 PolarHBondContact O-N 2.81Å; I599-Q602 WeakPolarHBondContact O-CB 3.18Å; I599-Q602 PolarHBondContact O-N 2.8Å; C600-Q602 VanDerWaalsContact C-N 3.34Å; C600-Q602 PolarHBondContact O-N 2.81Å; Q602-L604 VanDerWaalsContact C-N 3.31Å; Q602-L604 PolarHBondContact O-N 3.15Å; Q602-F605 PolarHBondContact O-N 3.34Å; Q602-Y606 HydrophobicContact CG-CD2 3.78Å; Q602-Y606 HydrophobicContact CG-CE2 3.55Å; Q602-Y606 VanDerWaalsContact O-CD2 3.28Å; Q602-Y606 WeakPolarHBondContact O-CD2 3.38Å; Q602-Y606 PolarHBondContact O-N 3.28Å
603	C	89.1	Confident	89.4	Confident	31 Å²	31	38.7 Å²	38.7	21%	0.209	22%	0.223	C	C	.	.	H	α-helix	trans	-59.5	-43.6	177.4	-70.6	0	0	0	0	111.4	A554 I599 C600 Y606 A607	A554-C603 HydrophobicContact CB-CB 3.81Å; I599-C603 PolarHBondContact O-N 3.04Å; I599-C603 PolarHBondContact O-SG 3.34Å; I599-C603 VanDerWaalsContact O-SG 3.34Å; C600-C603 PolarHBondContact O-N 3.48Å; C603-Y606 PolarHBondContact O-N 3.04Å; C603-A607 WeakPolarHBondContact O-CB 3.39Å; C603-A607 PolarHBondContact O-N 2.96Å
604	L	91.7	Very high	89.9	Confident	73 Å²	73	30.6 Å²	30.6	38%	0.382	19%	0.188	S	C	.	.	H	α-helix	trans	-64.9	-43.6	177.7	-174	65.5	0	0	0	112	C600 W601 Q602 Y606 A607 V608	C600-L604 PolarHBondContact O-N 3.09Å; W601-L604 HydrophobicContact CE3-CD2 3.76Å; W601-L604 HydrophobicContact CZ3-CD2 3.51Å; W601-L604 PolarHBondContact O-N 2.87Å; Q602-L604 VanDerWaalsContact C-N 3.31Å; Q602-L604 PolarHBondContact O-N 3.15Å; L604-Y606 VanDerWaalsContact C-N 3.35Å; L604-Y606 PolarHBondContact O-N 2.98Å; L604-A607 PolarHBondContact O-N 3.39Å; L604-V608 HydrophobicContact CD1-CG2 4.26Å; L604-V608 HydrophobicContact CG-CG2 4.5Å; L604-V608 WeakPolarHBondContact O-CG2 3.31Å; L604-V608 PolarHBondContact O-N 2.93Å
605	F	92.7	Very high	90.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-56.4	-48.9	175.9	168.5	-100.8	0	0	0	111.2	Y410 L413 F417 T586 W601 Q602 V608 S609 L670	Y410-F605 HydrophobicContact CD2-CE1 4.24Å; L413-F605 HydrophobicContact CB-CE1 4.24Å; L413-F605 HydrophobicContact CD1-CD1 4.48Å; L413-F605 HydrophobicContact CD1-CD2 4.34Å; L413-F605 HydrophobicContact CD1-CE1 4.02Å; L413-F605 HydrophobicContact CD1-CE2 3.86Å; L413-F605 HydrophobicContact CD1-CZ 3.68Å; F417-F605 AromaticContact CE2-CD1 3.96Å; F417-F605 HydrophobicContact CE2-CD1 3.96Å; F417-F605 HydrophobicContact CE2-CE1 4.49Å; F417-F605 HydrophobicContact CZ-CD1 4.42Å; T586-F605 WeakPolarHBondContact OG1-CD2 3.29Å; W601-F605 VanDerWaalsContact O-CB 3.27Å; W601-F605 WeakPolarHBondContact O-CB 3.34Å; W601-F605 PolarHBondContact O-N 2.93Å; Q602-F605 PolarHBondContact O-N 3.34Å; F605-V608 PolarHBondContact O-N 3.04Å; F605-S609 VanDerWaalsContact CE2-OG 3.25Å; F605-S609 WeakPolarHBondContact CE2-OG 3.4Å; F605-S609 WeakPolarHBondContact CZ-OG 3.44Å; F605-S609 WeakPolarHBondContact O-CB 3.25Å; F605-S609 PolarHBondContact O-N 3.45Å; F605-S609 PolarHBondContact O-OG 2.98Å; F605-L670 HydrophobicContact CE2-CD1 3.84Å
606	Y	90.9	Very high	90.7	Very high	29 Å²	29	24.4 Å²	24.4	11%	0.114	15%	0.151	C	C	.	.	H	α-helix	trans	-64.7	-42.7	178.7	-76.2	-48.5	0	0	0	113.2	Y410 G414 F417 Q602 C603 L604 V608 S609 V610	Y410-Y606 HydrophobicContact CD2-CD1 4.15Å; Y410-Y606 HydrophobicContact CD2-CE1 4.3Å; Y410-Y606 HydrophobicContact CE1-CE1 4.48Å; Y410-Y606 AromaticContact CE2-CD1 3.5Å; Y410-Y606 HydrophobicContact CE2-CD1 3.5Å; Y410-Y606 VanDerWaalsContact CE2-CD1 3.5Å; Y410-Y606 AromaticContact CE2-CE1 3.85Å; Y410-Y606 HydrophobicContact CE2-CE1 3.85Å; Y410-Y606 AromaticContact CZ-CD1 3.88Å; Y410-Y606 AromaticContact CZ-CE1 3.92Å; G414-Y606 WeakPolarHBondContact CA-OH 3.38Å; F417-Y606 HydrophobicContact CD2-CE2 4.46Å; Q602-Y606 HydrophobicContact CG-CD2 3.78Å; Q602-Y606 HydrophobicContact CG-CE2 3.55Å; Q602-Y606 VanDerWaalsContact O-CD2 3.28Å; Q602-Y606 WeakPolarHBondContact O-CD2 3.38Å; Q602-Y606 PolarHBondContact O-N 3.28Å; C603-Y606 PolarHBondContact O-N 3.04Å; L604-Y606 VanDerWaalsContact C-N 3.35Å; L604-Y606 PolarHBondContact O-N 2.98Å; Y606-V608 VanDerWaalsContact C-N 3.3Å; Y606-V608 PolarHBondContact O-N 2.81Å; Y606-S609 PolarHBondContact O-N 2.89Å; Y606-V610 PolarHBondContact O-N 3.42Å; Y606-V610 VanDerWaalsContact O-N 3.15Å
607	A	91.9	Very high	91.1	Very high	24 Å²	24	23.3 Å²	23.3	20%	0.198	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-38.5	178.2	0	0	0	0	0	112.4	A554 G558 C603 L604 V610	A554-A607 VanDerWaalsContact O-CB 3.25Å; A554-A607 WeakPolarHBondContact O-CB 3.44Å; G558-A607 VanDerWaalsContact CA-O 3.29Å; G558-A607 WeakPolarHBondContact CA-O 3.42Å; C603-A607 WeakPolarHBondContact O-CB 3.39Å; C603-A607 PolarHBondContact O-N 2.96Å; L604-A607 PolarHBondContact O-N 3.39Å; A607-V610 WeakPolarHBondContact O-CG1 3.2Å
608	V	93.4	Very high	91.2	Very high	36 Å²	36	21.8 Å²	21.8	22%	0.218	12%	0.121	C	C	.	.	H	α-helix	trans	-80.7	-41.8	179	178.6	0	0	0	0	111.2	S578 A581 S582 L604 F605 Y606 V610 A611	S578-V608 WeakPolarHBondContact CB-O 3.29Å; A581-V608 HydrophobicContact CB-CG1 3.56Å; S582-V608 WeakPolarHBondContact OG-CG1 3.43Å; L604-V608 HydrophobicContact CD1-CG2 4.26Å; L604-V608 HydrophobicContact CG-CG2 4.5Å; L604-V608 WeakPolarHBondContact O-CG2 3.31Å; L604-V608 PolarHBondContact O-N 2.93Å; F605-V608 PolarHBondContact O-N 3.04Å; Y606-V608 VanDerWaalsContact C-N 3.3Å; Y606-V608 PolarHBondContact O-N 2.81Å; V608-V610 VanDerWaalsContact C-N 3.26Å; V608-V610 PolarHBondContact O-N 3.1Å; V608-A611 PolarHBondContact O-N 3.47Å
609	S	93.2	Very high	91.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-63.7	-29.4	-177.1	-75.1	0	0	0	0	113.2	M406 S582 F605 Y606 A611 A612 W613	M406-S609 WeakPolarHBondContact CE-O 3.41Å; S582-S609 WeakPolarHBondContact CB-OG 3.15Å; S582-S609 WeakPolarHBondContact OG-CA 3.47Å; S582-S609 PolarHBondContact OG-N 2.95Å; S582-S609 PolarHBondContact OG-OG 3.4Å; F605-S609 VanDerWaalsContact CE2-OG 3.25Å; F605-S609 WeakPolarHBondContact CE2-OG 3.4Å; F605-S609 WeakPolarHBondContact CZ-OG 3.44Å; F605-S609 WeakPolarHBondContact O-CB 3.25Å; F605-S609 PolarHBondContact O-N 3.45Å; F605-S609 PolarHBondContact O-OG 2.98Å; Y606-S609 PolarHBondContact O-N 2.89Å; S609-A611 PolarHBondContact O-N 2.89Å; S609-A612 WeakPolarHBondContact O-CB 3.33Å; S609-A612 PolarHBondContact O-N 3.03Å; S609-A612 VanDerWaalsContact O-N 3.08Å; S609-W613 PolarHBondContact O-N 3.24Å
610	V	92.4	Very high	91.7	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.006	11%	0.11	C	C	.	.	H	α-helix	trans	-64.3	-29.6	-178.9	80.5	0	0	0	0	113.1	M248 V555 N559 Y606 A607 V608 A612 W613 N614	M248-V610 HydrophobicContact CE-CG2 4.39Å; V555-V610 HydrophobicContact CG1-CB 3.62Å; V555-V610 HydrophobicContact CG1-CG1 3.97Å; V555-V610 HydrophobicContact CG1-CG2 3.32Å; N559-V610 WeakPolarHBondContact OD1-CG2 3.26Å; Y606-V610 PolarHBondContact O-N 3.42Å; Y606-V610 VanDerWaalsContact O-N 3.15Å; A607-V610 WeakPolarHBondContact O-CG1 3.2Å; V608-V610 VanDerWaalsContact C-N 3.26Å; V608-V610 PolarHBondContact O-N 3.1Å; V610-A612 VanDerWaalsContact C-N 3.26Å; V610-A612 PolarHBondContact O-N 3.5Å; V610-W613 WeakPolarHBondContact O-CB 3.5Å; V610-W613 PolarHBondContact O-N 3.32Å; V610-W613 VanDerWaalsContact O-N 3.13Å; V610-N614 PolarHBondContact O-N 2.9Å; V610-N614 PolarHBondContact O-OD1 2.96Å
611	A	92.9	Very high	91.8	Very high	16 Å²	16	15.6 Å²	15.6	13%	0.132	8%	0.083	C	C	.	.	H	α-helix	trans	-63.5	-34.6	175.4	0	0	0	0	0	111.7	I574 V608 S609 G615	I574-A611 HydrophobicContact CG2-CB 4.05Å; I574-A611 WeakPolarHBondContact CG2-O 3.21Å; V608-A611 PolarHBondContact O-N 3.47Å; S609-A611 PolarHBondContact O-N 2.89Å; A611-G615 PolarHBondContact O-N 2.96Å; A611-G615 VanDerWaalsContact O-N 3.09Å
612	A	94.1	Very high	91.7	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-66.9	-42	172.8	0	0	0	0	0	111.5	M406 S578 M579 S609 V610 G615 L616	M406-A612 HydrophobicContact CE-CB 3.65Å; M406-A612 HydrophobicContact SD-CB 3.87Å; S578-A612 VanDerWaalsContact OG-CA 3.23Å; S578-A612 WeakPolarHBondContact OG-CA 3.2Å; S578-A612 WeakPolarHBondContact OG-CB 3.34Å; S578-A612 PolarHBondContact OG-N 3.44Å; M579-A612 HydrophobicContact CG-CB 3.72Å; S609-A612 WeakPolarHBondContact O-CB 3.33Å; S609-A612 PolarHBondContact O-N 3.03Å; S609-A612 VanDerWaalsContact O-N 3.08Å; V610-A612 VanDerWaalsContact C-N 3.26Å; V610-A612 PolarHBondContact O-N 3.5Å; A612-G615 PolarHBondContact O-N 3.36Å; A612-L616 WeakPolarHBondContact O-CB 3.38Å; A612-L616 WeakPolarHBondContact O-CG 3.36Å; A612-L616 PolarHBondContact O-N 3.01Å
613	W	93.3	Very high	91.7	Very high	19 Å²	19	12.8 Å²	12.8	7%	0.072	7%	0.072	C	C	.	.	H	α-helix	trans	-60	-49	176.8	-80.5	122.3	0	0	0	112.2	W403 M406 A407 Y410 S609 V610 G615 L616 E617 C640	W403-W613 HydrophobicContact CE3-CH2 4.42Å; W403-W613 AromaticContact CE3-CZ3 3.74Å; W403-W613 HydrophobicContact CE3-CZ3 3.74Å; W403-W613 HydrophobicContact CH2-CZ3 4.21Å; W403-W613 HydrophobicContact CZ3-CE3 4.39Å; W403-W613 HydrophobicContact CZ3-CH2 4.43Å; W403-W613 AromaticContact CZ3-CZ3 3.56Å; W403-W613 HydrophobicContact CZ3-CZ3 3.56Å; M406-W613 HydrophobicContact CB-CH2 4.48Å; M406-W613 HydrophobicContact CE-CD2 4.32Å; M406-W613 HydrophobicContact CE-CG 4.07Å; M406-W613 HydrophobicContact CG-CD2 4.08Å; M406-W613 HydrophobicContact CG-CE3 4.4Å; M406-W613 HydrophobicContact CG-CH2 4.12Å; M406-W613 HydrophobicContact CG-CZ2 3.8Å; M406-W613 HydrophobicContact CG-CZ3 4.4Å; A407-W613 HydrophobicContact CB-CH2 3.9Å; A407-W613 HydrophobicContact CB-CZ2 4.41Å; Y410-W613 HydrophobicContact CD1-CZ2 4.11Å; Y410-W613 AromaticContact CD1-NE1 3.42Å; Y410-W613 AromaticContact CD2-CD1 3.82Å; Y410-W613 AromaticContact CD2-NE1 3.19Å; Y410-W613 AromaticContact CE1-NE1 3.78Å; Y410-W613 AromaticContact CE2-CD1 3.79Å; Y410-W613 AromaticContact CE2-NE1 3.53Å; Y410-W613 AromaticContact CG-CE2 3.94Å; Y410-W613 HydrophobicContact CG-CZ2 4.14Å; Y410-W613 AromaticContact CG-NE1 3.13Å; Y410-W613 AromaticContact CZ-NE1 3.84Å; S609-W613 PolarHBondContact O-N 3.24Å; V610-W613 WeakPolarHBondContact O-CB 3.5Å; V610-W613 PolarHBondContact O-N 3.32Å; V610-W613 VanDerWaalsContact O-N 3.13Å; W613-G615 VanDerWaalsContact C-N 3.28Å; W613-G615 PolarHBondContact O-N 2.84Å; W613-L616 HydrophobicContact CE3-CD1 4.26Å; W613-L616 HydrophobicContact CZ3-CD1 4.38Å; W613-L616 WeakPolarHBondContact O-CB 3.43Å; W613-L616 PolarHBondContact O-N 3.44Å; W613-L616 VanDerWaalsContact O-N 3.11Å; W613-E617 WeakPolarHBondContact O-CG 3.28Å; W613-E617 PolarHBondContact O-N 2.85Å; W613-C640 VanDerWaalsContact CH2-SG 3.53Å
614	N	92.5	Very high	91.6	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-60.5	-42.5	178.1	-65.8	2.5	0	0	0	111.1	C244 N559 S562 M566 V610 L616 E617 V618	C244-N614 VanDerWaalsContact CB-OD1 3.27Å; C244-N614 WeakPolarHBondContact CB-OD1 3.13Å; C244-N614 PolarHBondContact SG-OD1 3.45Å; N559-N614 PolarHBondContact OD1-ND2 3.37Å; N559-N614 PolarHBondContact OD1-OD1 3.29Å; S562-N614 PolarHBondContact OG-ND2 2.81Å; M566-N614 VanDerWaalsContact CE-C 3.49Å; M566-N614 HydrophobicContact CE-CB 4.14Å; M566-N614 WeakPolarHBondContact CE-O 3.26Å; V610-N614 PolarHBondContact O-N 2.9Å; V610-N614 PolarHBondContact O-OD1 2.96Å; N614-L616 PolarHBondContact O-N 2.98Å; N614-E617 PolarHBondContact O-N 2.63Å; N614-V618 WeakPolarHBondContact O-CB 3.42Å; N614-V618 VanDerWaalsContact O-CG2 3.23Å; N614-V618 WeakPolarHBondContact O-CG2 3.2Å; N614-V618 PolarHBondContact O-N 2.91Å
615	G	91.8	Very high	91.3	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-59.3	-45.6	174.9	0	0	0	0	0	112.7	M566 A611 A612 W613 V618 I619	M566-G615 VanDerWaalsContact CE-CA 3.43Å; A611-G615 PolarHBondContact O-N 2.96Å; A611-G615 VanDerWaalsContact O-N 3.09Å; A612-G615 PolarHBondContact O-N 3.36Å; W613-G615 VanDerWaalsContact C-N 3.28Å; W613-G615 PolarHBondContact O-N 2.84Å; G615-V618 PolarHBondContact O-N 3.43Å; G615-I619 WeakPolarHBondContact O-CB 3.43Å; G615-I619 WeakPolarHBondContact O-CG2 3.35Å; G615-I619 PolarHBondContact O-N 3.21Å
616	L	93.5	Very high	90.7	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-64.2	-42.1	179.4	-79.7	170.9	0	0	0	112.4	L399 V402 W403 M406 I575 A612 W613 N614 I619 S620	L399-L616 HydrophobicContact CD1-CD2 3.86Å; V402-L616 HydrophobicContact CB-CD2 4.14Å; V402-L616 HydrophobicContact CG1-CD1 4.25Å; V402-L616 HydrophobicContact CG1-CD2 3.48Å; V402-L616 VanDerWaalsContact CG1-CD2 3.48Å; V402-L616 HydrophobicContact CG1-CG 4.29Å; W403-L616 HydrophobicContact CG-CD2 4.41Å; W403-L616 HydrophobicContact CZ2-CB 4.22Å; M406-L616 HydrophobicContact CB-CD1 3.8Å; M406-L616 HydrophobicContact CG-CD1 3.82Å; I575-L616 HydrophobicContact CG2-CD2 4.36Å; I575-L616 HydrophobicContact CG2-CG 4.32Å; A612-L616 WeakPolarHBondContact O-CB 3.38Å; A612-L616 WeakPolarHBondContact O-CG 3.36Å; A612-L616 PolarHBondContact O-N 3.01Å; W613-L616 HydrophobicContact CE3-CD1 4.26Å; W613-L616 HydrophobicContact CZ3-CD1 4.38Å; W613-L616 WeakPolarHBondContact O-CB 3.43Å; W613-L616 PolarHBondContact O-N 3.44Å; W613-L616 VanDerWaalsContact O-N 3.11Å; N614-L616 PolarHBondContact O-N 2.98Å; L616-I619 WeakPolarHBondContact O-CG2 3.44Å; L616-S620 VanDerWaalsContact O-CB 3.25Å; L616-S620 WeakPolarHBondContact O-CB 3.36Å; L616-S620 PolarHBondContact O-N 3.36Å; L616-S620 PolarHBondContact O-OG 3.23Å
617	E	92.5	Very high	90.1	Very high	21 Å²	21	10.1 Å²	10.1	10%	0.098	6%	0.062	C	C	.	.	H	α-helix	trans	-65.9	-44.2	178.3	-68.7	174.9	158	0	0	111.2	Y224 C244 W403 W613 N614 S620 V621 F633	Y224-E617 HydrophobicContact CD1-CB 4.28Å; Y224-E617 HydrophobicContact CE1-CB 3.87Å; Y224-E617 HydrophobicContact CE2-CB 4.46Å; Y224-E617 HydrophobicContact CE2-CG 4.49Å; Y224-E617 PolarHBondContact OH-OE2 2.76Å; C244-E617 PolarHBondContact SG-OE2 2.75Å; W403-E617 HydrophobicContact CH2-CG 4.35Å; W613-E617 WeakPolarHBondContact O-CG 3.28Å; W613-E617 PolarHBondContact O-N 2.85Å; N614-E617 PolarHBondContact O-N 2.63Å; E617-S620 PolarHBondContact O-N 3.24Å; E617-V621 PolarHBondContact O-N 2.75Å; E617-F633 HydrophobicContact CB-CZ 4.21Å; E617-F633 HydrophobicContact CG-CZ 4.18Å
618	V	91.3	Very high	89.9	Confident	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-64.1	-49.6	177.5	173.9	0	0	0	0	111.8	L240 M566 R571 N614 G615 S620 V621 E622	L240-V618 HydrophobicContact CB-CG2 3.61Å; L240-V618 HydrophobicContact CD1-CG1 4.3Å; L240-V618 HydrophobicContact CD1-CG2 4.19Å; M566-V618 HydrophobicContact CE-CB 4.02Å; M566-V618 HydrophobicContact CE-CG2 3.7Å; R571-V618 HydrophobicContact CG-CG1 3.98Å; N614-V618 WeakPolarHBondContact O-CB 3.42Å; N614-V618 VanDerWaalsContact O-CG2 3.23Å; N614-V618 WeakPolarHBondContact O-CG2 3.2Å; N614-V618 PolarHBondContact O-N 2.91Å; G615-V618 PolarHBondContact O-N 3.43Å; V618-S620 PolarHBondContact O-N 3.06Å; V618-V621 WeakPolarHBondContact O-CG2 3.49Å; V618-V621 PolarHBondContact O-N 2.89Å; V618-E622 HydrophobicContact CG1-CG 4.37Å; V618-E622 WeakPolarHBondContact CG1-OE1 3.44Å; V618-E622 WeakPolarHBondContact O-CG 3.45Å; V618-E622 PolarHBondContact O-N 3.42Å; V618-E622 VanDerWaalsContact O-N 3.1Å
619	I	91.5	Very high	89.7	Confident	1 Å²	1	9.6 Å²	9.6	1%	0.005	5%	0.052	C	C	.	.	H	α-helix	trans	-66.1	-29.6	-179	-160.4	167.3	0	0	0	111.6	L399 I572 I575 G615 L616 V621 E622 L623 L680 T683	L399-I619 HydrophobicContact CD1-CG2 3.76Å; I572-I619 HydrophobicContact CG1-CD1 4.35Å; I575-I619 HydrophobicContact CD1-CB 4.41Å; I575-I619 HydrophobicContact CD1-CD1 4.4Å; I575-I619 HydrophobicContact CD1-CG2 3.96Å; G615-I619 WeakPolarHBondContact O-CB 3.43Å; G615-I619 WeakPolarHBondContact O-CG2 3.35Å; G615-I619 PolarHBondContact O-N 3.21Å; L616-I619 WeakPolarHBondContact O-CG2 3.44Å; I619-V621 VanDerWaalsContact C-N 3.28Å; I619-V621 PolarHBondContact O-N 3.07Å; I619-E622 PolarHBondContact O-N 3.29Å; I619-L623 WeakPolarHBondContact O-CB 3.41Å; I619-L623 PolarHBondContact O-N 3.34Å; I619-L680 HydrophobicContact CD1-CB 4.31Å; I619-L680 HydrophobicContact CD1-CD1 4.16Å; I619-T683 HydrophobicContact CD1-CG2 4.5Å; I619-T683 HydrophobicContact CG1-CG2 3.99Å
620	S	91.8	Very high	89.6	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-66.6	-29.1	178.7	-61.7	0	0	0	0	112.8	W403 L616 E617 V618 Y624	W403-S620 PolarHBondContact NE1-OG 3.49Å; L616-S620 VanDerWaalsContact O-CB 3.25Å; L616-S620 WeakPolarHBondContact O-CB 3.36Å; L616-S620 PolarHBondContact O-N 3.36Å; L616-S620 PolarHBondContact O-OG 3.23Å; E617-S620 PolarHBondContact O-N 3.24Å; V618-S620 PolarHBondContact O-N 3.06Å; S620-Y624 WeakPolarHBondContact O-CD2 3.43Å
621	V	89.6	Confident	89.6	Confident	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-89.7	-26.8	174.3	-71.5	0	0	0	0	113.3	T225 T228 L240 E617 V618 I619 R629 F633	T225-V621 HydrophobicContact CG2-CG1 4.01Å; T228-V621 HydrophobicContact CG2-CB 3.57Å; T228-V621 HydrophobicContact CG2-CG1 4.09Å; T228-V621 HydrophobicContact CG2-CG2 3.3Å; L240-V621 HydrophobicContact CD1-CG2 3.94Å; E617-V621 PolarHBondContact O-N 2.75Å; V618-V621 WeakPolarHBondContact O-CG2 3.49Å; V618-V621 PolarHBondContact O-N 2.89Å; I619-V621 VanDerWaalsContact C-N 3.28Å; I619-V621 PolarHBondContact O-N 3.07Å; V621-R629 HydrophobicContact CB-CG 4.41Å; V621-R629 HydrophobicContact CG1-CG 4.43Å; V621-R629 WeakPolarHBondContact O-CD 3.43Å; V621-R629 PolarHBondContact O-NE 3.18Å; V621-F633 HydrophobicContact CG1-CD1 3.47Å; V621-F633 VanDerWaalsContact CG1-CD1 3.47Å; V621-F633 HydrophobicContact CG1-CE1 3.64Å
622	E	88.3	Confident	89.6	Confident	14 Å²	14	9 Å²	9	7%	0.065	5%	0.047	C	C	.	.	H	α-helix	trans	-82.4	-27.9	-179.8	-69.8	177.9	174	0	0	113.6	R571 V618 I619 T683 L688	R571-E622 IonicContact NE-OE2 3.78Å; V618-E622 HydrophobicContact CG1-CG 4.37Å; V618-E622 WeakPolarHBondContact CG1-OE1 3.44Å; V618-E622 WeakPolarHBondContact O-CG 3.45Å; V618-E622 PolarHBondContact O-N 3.42Å; V618-E622 VanDerWaalsContact O-N 3.1Å; I619-E622 PolarHBondContact O-N 3.29Å; E622-T683 HydrophobicContact CB-CG2 4.11Å; E622-T683 WeakPolarHBondContact OE2-CB 3.46Å; E622-T683 PolarHBondContact OE2-OG1 2.82Å; E622-L688 HydrophobicContact CB-CD2 4.47Å
623	L	87.5	Confident	89.6	Confident	3 Å²	3	9 Å²	9	2%	0.016	5%	0.047	C	C	.	.	S	Bend	trans	-74.5	-33.7	-174.8	-171	67.2	0	0	0	113.2	Q395 L399 I619 P681	Q395-L623 HydrophobicContact CB-CD1 4.42Å; Q395-L623 HydrophobicContact CB-CD2 4.1Å; L399-L623 HydrophobicContact CD2-CD2 3.83Å; I619-L623 WeakPolarHBondContact O-CB 3.41Å; I619-L623 PolarHBondContact O-N 3.34Å; L623-P681 HydrophobicContact CD1-CG 3.85Å
624	Y	87.8	Confident	89.7	Confident	11 Å²	11	8.1 Å²	8.1	4%	0.043	4%	0.044	C	C	.	.	S	Bend	trans	-102.9	144.4	-171.4	-63.5	-80.7	0	0	0	113.2	L387 G396 L399 S620 R629 A632 L636	L387-Y624 HydrophobicContact CD2-CD1 3.71Å; L387-Y624 HydrophobicContact CD2-CE1 3.74Å; G396-Y624 WeakPolarHBondContact CA-OH 3.49Å; L399-Y624 HydrophobicContact CD2-CE2 3.94Å; S620-Y624 WeakPolarHBondContact O-CD2 3.43Å; Y624-R629 PolarHBondContact O-NE 3.31Å; Y624-A632 HydrophobicContact CD1-CB 3.64Å; Y624-A632 HydrophobicContact CD2-CB 3.43Å; Y624-A632 VanDerWaalsContact CD2-CB 3.43Å; Y624-A632 HydrophobicContact CE1-CB 3.8Å; Y624-A632 HydrophobicContact CE2-CB 3.59Å; Y624-A632 HydrophobicContact CG-CB 3.45Å; Y624-A632 VanDerWaalsContact CG-CB 3.45Å; Y624-L636 HydrophobicContact CE2-CD1 4.08Å
625	P	83.8	Confident	89.8	Confident	20 Å²	20	10.1 Å²	10.1	13%	0.13	5%	0.054	C	C	.	.			trans	-64.2	150	176.6	27	-34.1	0	0	0	111.6	S627 K628 R629 S689	P625-S627 PolarHBondContact O-N 2.85Å; P625-S627 VanDerWaalsContact O-N 3.14Å; P625-K628 HydrophobicContact CG-CB 4.36Å; P625-K628 HydrophobicContact CG-CD 4.21Å; P625-K628 PolarHBondContact O-N 3.04Å; P625-R629 WeakPolarHBondContact O-CB 3.49Å; P625-R629 PolarHBondContact O-N 2.63Å; P625-S689 WeakPolarHBondContact CA-O 3.41Å; P625-S689 WeakPolarHBondContact CB-O 3.48Å; P625-S689 WeakPolarHBondContact CB-OG 3.21Å
626	S	79.9	Confident	89.9	Confident	1 Å²	1	10.2 Å²	10.2	1%	0.007	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-33	-173.6	35.8	0	0	0	0	114.6	R178 R307 E311 K628 S689	R178-S626 PolarHBondContact NH2-O 3.21Å; R307-S626 VanDerWaalsContact NE-CB 3.25Å; R307-S626 PolarHBondContact NE-OG 3.41Å; R307-S626 PolarHBondContact NH2-OG 2.8Å; E311-S626 VanDerWaalsContact OE1-CB 3.26Å; E311-S626 WeakPolarHBondContact OE1-CB 3.39Å; E311-S626 PolarHBondContact OE1-OG 2.79Å; S626-K628 PolarHBondContact O-N 2.98Å; S626-S689 PolarHBondContact N-O 2.68Å
627	S	79.9	Confident	89.9	Confident	44 Å²	44	10.4 Å²	10.4	31%	0.308	6%	0.056	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-15.3	178.6	57.4	0	0	0	0	115.2	E311 N383 P625	E311-S627 PolarHBondContact OE1-N 3.41Å; E311-S627 VanDerWaalsContact OE1-N 3.13Å; E311-S627 WeakPolarHBondContact OE2-CA 3.48Å; N383-S627 PolarHBondContact ND2-O 3.06Å; P625-S627 PolarHBondContact O-N 2.85Å; P625-S627 VanDerWaalsContact O-N 3.14Å
628	K	86	Confident	90	Very high	49 Å²	49	9.5 Å²	9.5	21%	0.213	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.4	-1.2	-175.9	-56.9	172.6	-175.3	-175.7	0	113.2	D174 S386 L387 P625 S626 T631 A632	D174-K628 VanDerWaalsContact OD2-C 3.27Å; D174-K628 WeakPolarHBondContact OD2-CA 3.5Å; S386-K628 VanDerWaalsContact CB-NZ 3.28Å; S386-K628 WeakPolarHBondContact OG-CD 3.49Å; S386-K628 WeakPolarHBondContact OG-CE 3.01Å; S386-K628 PolarHBondContact OG-NZ 3.46Å; L387-K628 HydrophobicContact CD2-CB 4.34Å; P625-K628 HydrophobicContact CG-CB 4.36Å; P625-K628 HydrophobicContact CG-CD 4.21Å; P625-K628 PolarHBondContact O-N 3.04Å; S626-K628 PolarHBondContact O-N 2.98Å; K628-T631 PolarHBondContact O-N 3.27Å; K628-A632 WeakPolarHBondContact O-CB 3.47Å; K628-A632 PolarHBondContact O-N 2.94Å
629	R	90.3	Very high	90.2	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-64.2	-44.2	-170.2	-169.8	-173.8	-68.6	158.4	9.1	111.3	T225 T228 E229 V621 Y624 P625 A632 F633	T225-R629 HydrophobicContact CG2-CB 4.12Å; T225-R629 HydrophobicContact CG2-CG 3.61Å; T228-R629 PolarHBondContact OG1-NH1 3.44Å; E229-R629 IonicContact OE1-NH1 2.74Å; V621-R629 HydrophobicContact CB-CG 4.41Å; V621-R629 HydrophobicContact CG1-CG 4.43Å; V621-R629 WeakPolarHBondContact O-CD 3.43Å; V621-R629 PolarHBondContact O-NE 3.18Å; Y624-R629 PolarHBondContact O-NE 3.31Å; P625-R629 WeakPolarHBondContact O-CB 3.49Å; P625-R629 PolarHBondContact O-N 2.63Å; R629-A632 PolarHBondContact O-N 3.21Å; R629-F633 WeakPolarHBondContact O-CB 3.16Å; R629-F633 PolarHBondContact O-N 3.17Å
630	G	91	Very high	90.4	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62.7	-43.5	177.4	0	0	0	0	0	112	G170 C173 D174 F633 G634	G170-G630 CarbonylContact C-O 3.01Å; G170-G630 WeakPolarHBondContact CA-O 3.46Å; G170-G630 CarbonylContact O-C 3.46Å; C173-G630 VanDerWaalsContact SG-CA 3.57Å; D174-G630 WeakPolarHBondContact OD1-CA 3.49Å; D174-G630 PolarHBondContact OD1-N 3.45Å; D174-G630 PolarHBondContact OD2-N 3.01Å; G630-F633 PolarHBondContact O-N 3.34Å; G630-G634 PolarHBondContact O-N 3.35Å
631	T	92.8	Very high	90.5	Very high	3 Å²	3	12.1 Å²	12.1	2%	0.018	7%	0.066	C	C	.	.	H	α-helix	trans	-61.2	-47.3	177.3	-54.1	0	0	0	0	111	G170 D174 N383 V384 L387 K628 G634 I635	G170-T631 PolarHBondContact O-N 3.33Å; G170-T631 VanDerWaalsContact O-N 3.13Å; D174-T631 WeakPolarHBondContact OD2-CB 3.44Å; D174-T631 PolarHBondContact OD2-N 3Å; D174-T631 PolarHBondContact OD2-OG1 2.83Å; N383-T631 HydrophobicContact CB-CG2 4.23Å; V384-T631 HydrophobicContact CB-CG2 4.5Å; V384-T631 HydrophobicContact CG2-CG2 3.57Å; L387-T631 HydrophobicContact CD1-CG2 4.17Å; K628-T631 PolarHBondContact O-N 3.27Å; T631-G634 PolarHBondContact O-N 3.08Å; T631-I635 HydrophobicContact CG2-CD1 4.28Å; T631-I635 WeakPolarHBondContact O-CG1 3.25Å; T631-I635 PolarHBondContact O-N 3.36Å
632	A	93	Very high	90.7	Very high	2 Å²	2	17.1 Å²	17.1	2%	0.017	9%	0.088	C	C	.	.	H	α-helix	trans	-64.2	-46.4	-179.1	0	0	0	0	0	112.1	L387 Y624 K628 R629 I635 L636	L387-A632 HydrophobicContact CD1-CB 4.06Å; L387-A632 HydrophobicContact CD2-CB 3.77Å; Y624-A632 HydrophobicContact CD1-CB 3.64Å; Y624-A632 HydrophobicContact CD2-CB 3.43Å; Y624-A632 VanDerWaalsContact CD2-CB 3.43Å; Y624-A632 HydrophobicContact CE1-CB 3.8Å; Y624-A632 HydrophobicContact CE2-CB 3.59Å; Y624-A632 HydrophobicContact CG-CB 3.45Å; Y624-A632 VanDerWaalsContact CG-CB 3.45Å; K628-A632 WeakPolarHBondContact O-CB 3.47Å; K628-A632 PolarHBondContact O-N 2.94Å; R629-A632 PolarHBondContact O-N 3.21Å; A632-I635 PolarHBondContact O-N 3.34Å; A632-L636 WeakPolarHBondContact O-CG 3.39Å; A632-L636 PolarHBondContact O-N 3.39Å
633	F	94.1	Very high	91	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65.9	-39.9	176.9	-159.3	164.1	0	0	0	110.9	I220 P221 Y224 W403 E617 V621 R629 G630 I635 L636 N637	I220-F633 HydrophobicContact CG2-CE2 4.13Å; I220-F633 HydrophobicContact CG2-CZ 3.93Å; P221-F633 HydrophobicContact CB-CB 3.84Å; P221-F633 HydrophobicContact CB-CD1 4.26Å; P221-F633 HydrophobicContact CB-CD2 4.25Å; P221-F633 HydrophobicContact CB-CG 3.85Å; Y224-F633 VanDerWaalsContact CB-CE1 3.47Å; Y224-F633 HydrophobicContact CD2-CE1 4.11Å; Y224-F633 HydrophobicContact CD2-CZ 4.17Å; Y224-F633 AromaticContact CG-CE1 3.82Å; Y224-F633 HydrophobicContact CG-CE1 3.82Å; Y224-F633 HydrophobicContact CG-CZ 4.27Å; W403-F633 AromaticContact CH2-CE2 3.7Å; W403-F633 HydrophobicContact CH2-CE2 3.7Å; W403-F633 HydrophobicContact CH2-CZ 4.48Å; W403-F633 HydrophobicContact CZ2-CD2 4.36Å; W403-F633 AromaticContact CZ2-CE2 3.71Å; W403-F633 HydrophobicContact CZ2-CE2 3.71Å; W403-F633 HydrophobicContact CZ2-CZ 4.4Å; E617-F633 HydrophobicContact CB-CZ 4.21Å; E617-F633 HydrophobicContact CG-CZ 4.18Å; V621-F633 HydrophobicContact CG1-CD1 3.47Å; V621-F633 VanDerWaalsContact CG1-CD1 3.47Å; V621-F633 HydrophobicContact CG1-CE1 3.64Å; R629-F633 WeakPolarHBondContact O-CB 3.16Å; R629-F633 PolarHBondContact O-N 3.17Å; G630-F633 PolarHBondContact O-N 3.34Å; F633-I635 VanDerWaalsContact C-N 3.29Å; F633-I635 PolarHBondContact O-N 3.49Å; F633-L636 PolarHBondContact O-N 3.42Å; F633-N637 HydrophobicContact CD2-CB 4.47Å; F633-N637 WeakPolarHBondContact O-CB 3.42Å; F633-N637 PolarHBondContact O-N 3.31Å
634	G	94.2	Very high	91.3	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-55	-42.4	173.2	0	0	0	0	0	113.2	A166 G630 T631 G638	A166-G634 VanDerWaalsContact O-CA 3.25Å; A166-G634 WeakPolarHBondContact O-CA 3.44Å; G630-G634 PolarHBondContact O-N 3.35Å; T631-G634 PolarHBondContact O-N 3.08Å; G634-G638 PolarHBondContact O-N 3.1Å
635	I	94.4	Very high	91.5	Very high	43 Å²	43	17.2 Å²	17.2	22%	0.221	9%	0.089	C	C	.	.	H	α-helix	trans	-65.8	-47.5	175	-67.4	166.6	0	0	0	111.7	L167 V384 L387 T631 A632 F633 N637 G638 I639	L167-I635 HydrophobicContact CD2-CB 4.34Å; L167-I635 HydrophobicContact CD2-CG1 3.95Å; V384-I635 HydrophobicContact CG1-CD1 4.09Å; V384-I635 HydrophobicContact CG2-CD1 4.24Å; L387-I635 HydrophobicContact CD1-CD1 3.57Å; T631-I635 HydrophobicContact CG2-CD1 4.28Å; T631-I635 WeakPolarHBondContact O-CG1 3.25Å; T631-I635 PolarHBondContact O-N 3.36Å; A632-I635 PolarHBondContact O-N 3.34Å; F633-I635 VanDerWaalsContact C-N 3.29Å; F633-I635 PolarHBondContact O-N 3.49Å; I635-N637 VanDerWaalsContact C-N 3.33Å; I635-N637 PolarHBondContact O-N 3.06Å; I635-G638 PolarHBondContact O-N 3.44Å; I635-I639 HydrophobicContact CG2-CD1 3.82Å; I635-I639 WeakPolarHBondContact O-CG1 3.07Å; I635-I639 PolarHBondContact O-N 3.45Å
636	L	94.7	Very high	91.9	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.01	10%	0.095	C	C	.	.	H	α-helix	trans	-61	-42.9	178.7	-68.2	168.3	0	0	0	111.7	L399 V400 W403 Y624 A632 F633 I639 C640	L399-L636 HydrophobicContact CB-CD2 4.46Å; L399-L636 HydrophobicContact CD2-CD1 3.47Å; L399-L636 VanDerWaalsContact CD2-CD1 3.47Å; L399-L636 HydrophobicContact CD2-CD2 4.41Å; L399-L636 HydrophobicContact CG-CD1 3.91Å; L399-L636 HydrophobicContact CG-CD2 4.03Å; V400-L636 HydrophobicContact CB-CD2 4.47Å; V400-L636 HydrophobicContact CG2-CD2 3.69Å; W403-L636 HydrophobicContact CD2-CB 4.13Å; W403-L636 HydrophobicContact CG-CB 4.27Å; W403-L636 HydrophobicContact CG-CD2 4.21Å; Y624-L636 HydrophobicContact CE2-CD1 4.08Å; A632-L636 WeakPolarHBondContact O-CG 3.39Å; A632-L636 PolarHBondContact O-N 3.39Å; F633-L636 PolarHBondContact O-N 3.42Å; L636-I639 PolarHBondContact O-N 3.22Å; L636-C640 PolarHBondContact O-N 2.89Å
637	N	93.9	Very high	92.5	Very high	4 Å²	4	18.3 Å²	18.3	2%	0.021	10%	0.095	C	C	.	.	H	α-helix	trans	-67.9	-37	175.8	-167	35.4	0	0	0	111.6	A166 G217 F633 I635 I639 C640 K641	A166-N637 HydrophobicContact CB-CB 4.14Å; G217-N637 PolarHBondContact O-ND2 3.28Å; F633-N637 HydrophobicContact CD2-CB 4.47Å; F633-N637 WeakPolarHBondContact O-CB 3.42Å; F633-N637 PolarHBondContact O-N 3.31Å; I635-N637 VanDerWaalsContact C-N 3.33Å; I635-N637 PolarHBondContact O-N 3.06Å; N637-I639 PolarHBondContact O-N 3.02Å; N637-C640 WeakPolarHBondContact O-CB 3.49Å; N637-C640 PolarHBondContact O-N 2.9Å; N637-K641 WeakPolarHBondContact O-CG 3.32Å; N637-K641 PolarHBondContact O-N 2.77Å; N637-K641 VanDerWaalsContact O-N 3.09Å
638	G	95	Very high	92.9	Very high	3 Å²	3	17.3 Å²	17.3	3%	0.031	9%	0.088	C	C	.	.	H	α-helix	trans	-59.4	-44.8	171.2	0	0	0	0	0	112.5	M163 G634 I635 C640 K641 F642	M163-G638 WeakPolarHBondContact CG-O 3.21Å; G634-G638 PolarHBondContact O-N 3.1Å; I635-G638 PolarHBondContact O-N 3.44Å; G638-C640 VanDerWaalsContact C-N 3.31Å; G638-C640 PolarHBondContact O-N 3.42Å; G638-K641 PolarHBondContact O-N 2.9Å; G638-F642 PolarHBondContact O-N 2.96Å
639	I	94.9	Very high	93	Very high	39 Å²	39	22.9 Å²	22.9	20%	0.2	11%	0.113	C	C	.	.	H	α-helix	trans	-63.9	-37.5	175.9	-67.9	165.1	0	0	0	111.2	V400 F404 I635 L636 N637 F642 A643	V400-I639 HydrophobicContact CB-CD1 4.39Å; V400-I639 HydrophobicContact CG1-CD1 3.83Å; V400-I639 HydrophobicContact CG1-CG2 4.46Å; V400-I639 HydrophobicContact CG2-CD1 3.77Å; F404-I639 HydrophobicContact CB-CG2 4.15Å; F404-I639 HydrophobicContact CD2-CG2 4.22Å; I635-I639 HydrophobicContact CG2-CD1 3.82Å; I635-I639 WeakPolarHBondContact O-CG1 3.07Å; I635-I639 PolarHBondContact O-N 3.45Å; L636-I639 PolarHBondContact O-N 3.22Å; N637-I639 PolarHBondContact O-N 3.02Å; I639-F642 PolarHBondContact O-N 3.28Å; I639-A643 WeakPolarHBondContact O-CB 3.39Å; I639-A643 PolarHBondContact O-N 3.09Å
640	C	94.4	Very high	93	Very high	4 Å²	4	25.5 Å²	25.5	3%	0.027	13%	0.126	C	C	.	.	H	α-helix	trans	-55.1	-51.2	172.1	-176.5	0	0	0	0	111.6	W403 A407 W613 L636 N637 G638 F642 A643 A644	W403-C640 HydrophobicContact CE3-CB 3.65Å; W403-C640 HydrophobicContact CZ3-CB 3.75Å; A407-C640 HydrophobicContact CB-CB 4.23Å; A407-C640 VanDerWaalsContact CB-SG 3.6Å; W613-C640 VanDerWaalsContact CH2-SG 3.53Å; L636-C640 PolarHBondContact O-N 2.89Å; N637-C640 WeakPolarHBondContact O-CB 3.49Å; N637-C640 PolarHBondContact O-N 2.9Å; G638-C640 VanDerWaalsContact C-N 3.31Å; G638-C640 PolarHBondContact O-N 3.42Å; C640-F642 PolarHBondContact O-N 3.14Å; C640-A643 PolarHBondContact O-N 3.14Å; C640-A644 PolarHBondContact O-N 3.42Å
641	K	94	Very high	93	Very high	12 Å²	12	25.5 Å²	25.5	5%	0.052	13%	0.126	C	C	.	.	H	α-helix	trans	-66.8	-36.6	179.9	-57.1	-50.7	175.8	-178.9	0	112	Y159 M162 M163 N637 G638 A644 I645	Y159-K641 HydrophobicContact CD1-CD 4.12Å; Y159-K641 HydrophobicContact CE1-CD 4.5Å; M162-K641 HydrophobicContact CB-CD 4.35Å; M162-K641 HydrophobicContact CB-CG 4.09Å; M162-K641 HydrophobicContact SD-CD 4.46Å; M163-K641 HydrophobicContact CB-CB 3.86Å; N637-K641 WeakPolarHBondContact O-CG 3.32Å; N637-K641 PolarHBondContact O-N 2.77Å; N637-K641 VanDerWaalsContact O-N 3.09Å; G638-K641 PolarHBondContact O-N 2.9Å; K641-A644 WeakPolarHBondContact O-CB 3.44Å; K641-A644 PolarHBondContact O-N 2.93Å; K641-I645 WeakPolarHBondContact O-CG1 3.37Å; K641-I645 PolarHBondContact O-N 3.4Å
642	F	94.8	Very high	92.7	Very high	106 Å²	106	27.4 Å²	27.4	47%	0.465	14%	0.143	S	C	.	.	H	α-helix	trans	-60.6	-47.5	172.2	178.7	-103.7	0	0	0	112.1	M163 F404 G638 I639 C640 A644 I645 V646	M163-F642 HydrophobicContact SD-CB 3.88Å; M163-F642 HydrophobicContact SD-CD2 4.3Å; F404-F642 HydrophobicContact CE2-CD1 4.2Å; F404-F642 HydrophobicContact CE2-CE1 4.34Å; G638-F642 PolarHBondContact O-N 2.96Å; I639-F642 PolarHBondContact O-N 3.28Å; C640-F642 PolarHBondContact O-N 3.14Å; F642-A644 VanDerWaalsContact C-N 3.3Å; F642-A644 PolarHBondContact O-N 2.76Å; F642-I645 PolarHBondContact O-N 2.86Å; F642-V646 HydrophobicContact CD1-CG2 4.41Å; F642-V646 HydrophobicContact CE1-CG2 3.95Å; F642-V646 HydrophobicContact CE2-CG2 4.14Å; F642-V646 HydrophobicContact CZ-CG2 3.81Å; F642-V646 WeakPolarHBondContact O-CG2 3.43Å; F642-V646 PolarHBondContact O-N 3.4Å
643	A	95.3	Very high	92.4	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.8	-39.5	176.4	0	0	0	0	0	111.9	F404 A407 F408 I639 C640 I645 V646 A647	F404-A643 HydrophobicContact CD2-CB 3.59Å; F404-A643 HydrophobicContact CE2-CB 3.74Å; F404-A643 HydrophobicContact CG-CB 4.18Å; F404-A643 HydrophobicContact CZ-CB 4.45Å; A407-A643 HydrophobicContact CB-CB 3.68Å; F408-A643 HydrophobicContact CB-CB 4.4Å; I639-A643 WeakPolarHBondContact O-CB 3.39Å; I639-A643 PolarHBondContact O-N 3.09Å; C640-A643 PolarHBondContact O-N 3.14Å; A643-I645 PolarHBondContact O-N 2.9Å; A643-V646 PolarHBondContact O-N 3.36Å; A643-A647 WeakPolarHBondContact O-CB 3.25Å; A643-A647 PolarHBondContact O-N 2.83Å
644	A	92.3	Very high	92.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.9	-41.2	175.6	0	0	0	0	0	112.5	Y159 H411 C640 K641 F642 S648	Y159-A644 HydrophobicContact CD1-CB 4.37Å; Y159-A644 HydrophobicContact CE1-CB 4.27Å; H411-A644 HydrophobicContact CB-CB 3.67Å; C640-A644 PolarHBondContact O-N 3.42Å; K641-A644 WeakPolarHBondContact O-CB 3.44Å; K641-A644 PolarHBondContact O-N 2.93Å; F642-A644 VanDerWaalsContact C-N 3.3Å; F642-A644 PolarHBondContact O-N 2.76Å; A644-S648 VanDerWaalsContact O-CB 3.3Å; A644-S648 WeakPolarHBondContact O-CB 3.42Å; A644-S648 PolarHBondContact O-N 2.82Å; A644-S648 PolarHBondContact O-OG 3.48Å
645	I	92.2	Very high	91.6	Very high	30 Å²	30	34.6 Å²	34.6	15%	0.154	19%	0.186	C	C	.	.	H	α-helix	trans	-63	-50.8	176.2	-69	162.7	0	0	0	110.7	L156 Y159 V160 K641 F642 A643 A647 S648 F649	L156-I645 HydrophobicContact CD1-CB 4.35Å; L156-I645 HydrophobicContact CD1-CD1 4.47Å; L156-I645 HydrophobicContact CD1-CG1 4.12Å; L156-I645 HydrophobicContact CD1-CG2 3.4Å; Y159-I645 HydrophobicContact CG-CG1 4.39Å; V160-I645 HydrophobicContact CG2-CD1 3.67Å; K641-I645 WeakPolarHBondContact O-CG1 3.37Å; K641-I645 PolarHBondContact O-N 3.4Å; F642-I645 PolarHBondContact O-N 2.86Å; A643-I645 PolarHBondContact O-N 2.9Å; I645-A647 VanDerWaalsContact C-N 3.33Å; I645-A647 PolarHBondContact O-N 2.81Å; I645-S648 PolarHBondContact O-N 2.88Å; I645-F649 PolarHBondContact O-N 3.24Å; I645-F649 VanDerWaalsContact O-N 3.14Å
646	V	93.2	Very high	90.8	Very high	43 Å²	43	34.4 Å²	34.4	26%	0.261	19%	0.194	S	C	.	.	H	α-helix	trans	-61.6	-44.4	-179.7	175	0	0	0	0	110.6	F408 F642 A643 F649 I650	F408-V646 HydrophobicContact CE2-CG1 4.25Å; F642-V646 HydrophobicContact CD1-CG2 4.41Å; F642-V646 HydrophobicContact CE1-CG2 3.95Å; F642-V646 HydrophobicContact CE2-CG2 4.14Å; F642-V646 HydrophobicContact CZ-CG2 3.81Å; F642-V646 WeakPolarHBondContact O-CG2 3.43Å; F642-V646 PolarHBondContact O-N 3.4Å; A643-V646 PolarHBondContact O-N 3.36Å; V646-F649 PolarHBondContact O-N 3.02Å; V646-I650 HydrophobicContact CG1-CD1 3.71Å; V646-I650 HydrophobicContact CG1-CG1 4.5Å; V646-I650 VanDerWaalsContact O-CG1 3.31Å; V646-I650 WeakPolarHBondContact O-CG1 3.35Å; V646-I650 PolarHBondContact O-N 3.27Å; V646-I650 VanDerWaalsContact O-N 3.07Å
647	A	92.2	Very high	90.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.9	-45.6	178	0	0	0	0	0	112	F408 A643 I645 F649 I650 F651	F408-A647 HydrophobicContact CD2-CB 3.64Å; F408-A647 HydrophobicContact CE2-CB 3.95Å; F408-A647 HydrophobicContact CG-CB 4.1Å; F408-A647 WeakPolarHBondContact O-CB 3.29Å; A643-A647 WeakPolarHBondContact O-CB 3.25Å; A643-A647 PolarHBondContact O-N 2.83Å; I645-A647 VanDerWaalsContact C-N 3.33Å; I645-A647 PolarHBondContact O-N 2.81Å; A647-F649 VanDerWaalsContact C-N 3.27Å; A647-F649 PolarHBondContact O-N 2.84Å; A647-I650 PolarHBondContact O-N 2.82Å; A647-F651 HydrophobicContact CB-CD2 4.32Å; A647-F651 HydrophobicContact CB-CE2 4.38Å; A647-F651 WeakPolarHBondContact O-CB 3.3Å; A647-F651 WeakPolarHBondContact O-CD2 3.32Å; A647-F651 PolarHBondContact O-N 3.37Å
648	S	87.8	Confident	90.1	Very high	24 Å²	24	42 Å²	42	17%	0.168	24%	0.235	C	C	.	.	H	α-helix	trans	-57.5	-42.6	179.2	-59.4	0	0	0	0	111.4	A644 I645 A652	A644-S648 VanDerWaalsContact O-CB 3.3Å; A644-S648 WeakPolarHBondContact O-CB 3.42Å; A644-S648 PolarHBondContact O-N 2.82Å; A644-S648 PolarHBondContact O-OG 3.48Å; I645-S648 PolarHBondContact O-N 2.88Å; S648-A652 WeakPolarHBondContact O-CB 3.41Å; S648-A652 PolarHBondContact O-N 3.21Å; S648-A652 VanDerWaalsContact O-N 3.07Å
649	F	88.3	Confident	89.6	Confident	166 Å²	166	44.9 Å²	44.9	73%	0.728	25%	0.247	S	C	*	.	H	α-helix	trans	-66.9	-46.7	178	-170.9	-98.1	0	0	0	112.5	I645 V646 A647 A653	I645-F649 PolarHBondContact O-N 3.24Å; I645-F649 VanDerWaalsContact O-N 3.14Å; V646-F649 PolarHBondContact O-N 3.02Å; A647-F649 VanDerWaalsContact C-N 3.27Å; A647-F649 PolarHBondContact O-N 2.84Å; F649-A653 WeakPolarHBondContact O-CB 3.26Å; F649-A653 PolarHBondContact O-N 3.21Å
650	I	91.6	Very high	89.4	Confident	54 Å²	54	47.2 Å²	47.2	28%	0.277	26%	0.258	S	S	.	.	H	α-helix	trans	-65.5	-49.2	-178.7	-68.9	173.3	0	0	0	110.8	F408 V646 A647 A653 F654 L665	F408-I650 HydrophobicContact CE2-CD1 4.07Å; F408-I650 HydrophobicContact CZ-CD1 4.3Å; V646-I650 HydrophobicContact CG1-CD1 3.71Å; V646-I650 HydrophobicContact CG1-CG1 4.5Å; V646-I650 VanDerWaalsContact O-CG1 3.31Å; V646-I650 WeakPolarHBondContact O-CG1 3.35Å; V646-I650 PolarHBondContact O-N 3.27Å; V646-I650 VanDerWaalsContact O-N 3.07Å; A647-I650 PolarHBondContact O-N 2.82Å; I650-A653 PolarHBondContact O-N 3.41Å; I650-F654 HydrophobicContact CG2-CD2 4.26Å; I650-F654 HydrophobicContact CG2-CE2 3.98Å; I650-F654 WeakPolarHBondContact O-CD2 3.41Å; I650-L665 HydrophobicContact CG2-CD1 3.96Å
651	F	90.4	Very high	89.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-69.2	-38	-175.4	-78.2	-118.4	0	0	0	111.3	F408 G412 L413 W416 A647 A653 F654 P662 A666	F408-F651 HydrophobicContact CD1-CE2 4.34Å; F408-F651 AromaticContact CE1-CE2 3.66Å; F408-F651 HydrophobicContact CE1-CE2 3.66Å; F408-F651 HydrophobicContact CE1-CZ 4.14Å; F408-F651 HydrophobicContact CE2-CE2 4.48Å; F408-F651 AromaticContact CZ-CE2 3.74Å; F408-F651 HydrophobicContact CZ-CE2 3.74Å; G412-F651 VanDerWaalsContact C-CD1 3.45Å; G412-F651 WeakPolarHBondContact O-CD1 3.32Å; L413-F651 HydrophobicContact CD2-CD1 4.41Å; L413-F651 HydrophobicContact CD2-CE1 3.84Å; L413-F651 HydrophobicContact CG-CE1 4.01Å; W416-F651 HydrophobicContact CB-CB 4.2Å; W416-F651 HydrophobicContact CB-CD1 3.89Å; W416-F651 HydrophobicContact CG-CD1 4.15Å; A647-F651 HydrophobicContact CB-CD2 4.32Å; A647-F651 HydrophobicContact CB-CE2 4.38Å; A647-F651 WeakPolarHBondContact O-CB 3.3Å; A647-F651 WeakPolarHBondContact O-CD2 3.32Å; A647-F651 PolarHBondContact O-N 3.37Å; F651-A653 VanDerWaalsContact C-N 3.3Å; F651-A653 PolarHBondContact O-N 3.18Å; F651-F654 PolarHBondContact O-N 3.09Å; F651-P662 HydrophobicContact CD1-CB 3.65Å; F651-P662 HydrophobicContact CE1-CB 3.79Å; F651-P662 WeakPolarHBondContact CE1-O 3.46Å; F651-P662 HydrophobicContact CG-CB 4.31Å; F651-A666 HydrophobicContact CE1-CB 4.21Å; F651-A666 HydrophobicContact CZ-CB 4.01Å
652	A	85.1	Confident	89.1	Confident	44 Å²	44	49.9 Å²	49.9	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-63	-37	176.2	0	0	0	0	0	112.3	S648 F654 I655	S648-A652 WeakPolarHBondContact O-CB 3.41Å; S648-A652 PolarHBondContact O-N 3.21Å; S648-A652 VanDerWaalsContact O-N 3.07Å; A652-F654 PolarHBondContact O-N 3.1Å; A652-I655 HydrophobicContact CB-CD1 4.4Å; A652-I655 PolarHBondContact O-N 3.31Å
653	A	87.4	Confident	89	Confident	57 Å²	57	44.9 Å²	44.9	47%	0.471	25%	0.25	S	S	.	.	H	α-helix	trans	-66.1	-20.1	-179.3	0	0	0	0	0	114.3	F649 I650 F651 I657	F649-A653 WeakPolarHBondContact O-CB 3.26Å; F649-A653 PolarHBondContact O-N 3.21Å; I650-A653 PolarHBondContact O-N 3.41Å; F651-A653 VanDerWaalsContact C-N 3.3Å; F651-A653 PolarHBondContact O-N 3.18Å; A653-I657 WeakPolarHBondContact O-CD1 3.24Å
654	F	87.6	Confident	89	Confident	55 Å²	55	49.5 Å²	49.5	24%	0.241	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-3.7	-177.6	-74.1	-66.3	0	0	0	114.5	I650 F651 A652 G656 I657 T658 I661 P662	I650-F654 HydrophobicContact CG2-CD2 4.26Å; I650-F654 HydrophobicContact CG2-CE2 3.98Å; I650-F654 WeakPolarHBondContact O-CD2 3.41Å; F651-F654 PolarHBondContact O-N 3.09Å; A652-F654 PolarHBondContact O-N 3.1Å; F654-G656 PolarHBondContact O-N 3.04Å; F654-I657 PolarHBondContact O-N 3.08Å; F654-T658 HydrophobicContact CD1-CG2 4.21Å; F654-T658 PolarHBondContact O-N 3.13Å; F654-I661 HydrophobicContact CD1-CB 4.43Å; F654-I661 HydrophobicContact CD1-CD1 4.1Å; F654-I661 HydrophobicContact CD1-CG2 4.47Å; F654-I661 HydrophobicContact CD2-CG2 4.17Å; F654-I661 HydrophobicContact CE1-CB 4.46Å; F654-I661 HydrophobicContact CE1-CD1 3.68Å; F654-I661 HydrophobicContact CE1-CG2 4.18Å; F654-I661 HydrophobicContact CE2-CG2 3.87Å; F654-I661 HydrophobicContact CG-CG2 4.49Å; F654-I661 HydrophobicContact CZ-CD1 4.26Å; F654-I661 HydrophobicContact CZ-CG2 3.87Å; F654-P662 HydrophobicContact CB-CG 3.61Å; F654-P662 HydrophobicContact CD2-CG 4.35Å; F654-P662 HydrophobicContact CG-CG 4.25Å
655	I	84	Confident	89.1	Confident	41 Å²	41	52.7 Å²	52.7	21%	0.21	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	132	174.9	-60.5	158.5	0	0	0	108.8	D419 Y423 A652 I657	D419-I655 HydrophobicContact CB-CD1 3.43Å; D419-I655 VanDerWaalsContact CB-CD1 3.43Å; D419-I655 HydrophobicContact CB-CG1 4.35Å; Y423-I655 HydrophobicContact CD2-CG2 4.29Å; Y423-I655 HydrophobicContact CG-CG2 4.25Å; A652-I655 HydrophobicContact CB-CD1 4.4Å; A652-I655 PolarHBondContact O-N 3.31Å; I655-I657 PolarHBondContact O-N 2.68Å
656	G	78.2	Confident	89.2	Confident	38 Å²	38	51.3 Å²	51.3	39%	0.392	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	-9.6	-177	0	0	0	0	0	115.9	F654	F654-G656 PolarHBondContact O-N 3.04Å
657	I	86.2	Confident	89.4	Confident	128 Å²	128	52.1 Å²	52.1	66%	0.656	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-57.3	173.3	-56.1	178.4	0	0	0	110.1	A653 F654 I655	A653-I657 WeakPolarHBondContact O-CD1 3.24Å; F654-I657 PolarHBondContact O-N 3.08Å; I655-I657 PolarHBondContact O-N 2.68Å
658	T	86.6	Confident	89.6	Confident	38 Å²	38	54.4 Å²	54.4	23%	0.233	30%	0.299	C	S	.	.			trans	-161.4	135.8	-179.5	-179.7	0	0	0	0	112.1	F654 I660 I661 P662	F654-T658 HydrophobicContact CD1-CG2 4.21Å; F654-T658 PolarHBondContact O-N 3.13Å; T658-I660 VanDerWaalsContact C-N 3.33Å; T658-I660 PolarHBondContact OG1-N 3.16Å; T658-I660 VanDerWaalsContact OG1-N 3.16Å; T658-I661 HydrophobicContact CG2-CB 4.05Å; T658-I661 HydrophobicContact CG2-CD1 3.51Å; T658-I661 HydrophobicContact CG2-CG1 3.66Å; T658-P662 WeakPolarHBondContact O-CD 3.47Å
659	K	85.8	Confident	90	Very high	64 Å²	64	54 Å²	54	28%	0.278	30%	0.297	S	S	.	.	S	Bend	trans	-77.8	-17.9	171.5	67.3	-178.7	-174.6	-180	0	113.5	W416 M420 S592 I663	W416-K659 HydrophobicContact CH2-CB 4.48Å; W416-K659 HydrophobicContact CZ2-CB 3.94Å; M420-K659 HydrophobicContact CE-CB 3.96Å; S592-K659 PolarHBondContact O-NZ 2.88Å; K659-I663 HydrophobicContact CB-CD1 4.5Å; K659-I663 WeakPolarHBondContact O-CD1 3.28Å; K659-I663 WeakPolarHBondContact O-CG1 3.38Å
660	I	89.9	Confident	90.4	Very high	88 Å²	88	46 Å²	46	45%	0.451	26%	0.262	S	S	.	.	H	α-helix	trans	-72.5	-46.5	-169.7	-62.9	177.4	0	0	0	111.4	L590 T658 I663 F664	L590-I660 HydrophobicContact CD2-CG1 4.36Å; T658-I660 VanDerWaalsContact C-N 3.33Å; T658-I660 PolarHBondContact OG1-N 3.16Å; T658-I660 VanDerWaalsContact OG1-N 3.16Å; I660-I663 PolarHBondContact O-N 3.01Å; I660-F664 HydrophobicContact CG2-CD2 3.48Å; I660-F664 VanDerWaalsContact CG2-CD2 3.48Å; I660-F664 HydrophobicContact CG2-CE2 3.64Å; I660-F664 WeakPolarHBondContact O-CD2 3.21Å; I660-F664 PolarHBondContact O-N 2.77Å
661	I	91.3	Very high	90.6	Very high	71 Å²	71	45.2 Å²	45.2	36%	0.364	26%	0.26	S	S	.	.	H	α-helix	trans	-62.4	-50.5	-174	-62.4	173.7	0	0	0	112	F654 T658 I663 F664 L665	F654-I661 HydrophobicContact CD1-CB 4.43Å; F654-I661 HydrophobicContact CD1-CD1 4.1Å; F654-I661 HydrophobicContact CD1-CG2 4.47Å; F654-I661 HydrophobicContact CD2-CG2 4.17Å; F654-I661 HydrophobicContact CE1-CB 4.46Å; F654-I661 HydrophobicContact CE1-CD1 3.68Å; F654-I661 HydrophobicContact CE1-CG2 4.18Å; F654-I661 HydrophobicContact CE2-CG2 3.87Å; F654-I661 HydrophobicContact CG-CG2 4.49Å; F654-I661 HydrophobicContact CZ-CD1 4.26Å; F654-I661 HydrophobicContact CZ-CG2 3.87Å; T658-I661 HydrophobicContact CG2-CB 4.05Å; T658-I661 HydrophobicContact CG2-CD1 3.51Å; T658-I661 HydrophobicContact CG2-CG1 3.66Å; I661-I663 VanDerWaalsContact C-N 3.3Å; I661-I663 PolarHBondContact O-N 3Å; I661-F664 PolarHBondContact O-N 3.25Å; I661-L665 HydrophobicContact CG2-CD1 3.77Å; I661-L665 HydrophobicContact CG2-CG 4.28Å; I661-L665 WeakPolarHBondContact O-CB 3.33Å; I661-L665 WeakPolarHBondContact O-CG 3.44Å; I661-L665 PolarHBondContact O-N 2.91Å
662	P	91.8	Very high	90.9	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-58.9	-40.1	178	-26.6	37.3	0	0	0	113.2	F651 F654 T658 L665 A666	F651-P662 HydrophobicContact CD1-CB 3.65Å; F651-P662 HydrophobicContact CE1-CB 3.79Å; F651-P662 WeakPolarHBondContact CE1-O 3.46Å; F651-P662 HydrophobicContact CG-CB 4.31Å; F654-P662 HydrophobicContact CB-CG 3.61Å; F654-P662 HydrophobicContact CD2-CG 4.35Å; F654-P662 HydrophobicContact CG-CG 4.25Å; T658-P662 WeakPolarHBondContact O-CD 3.47Å; P662-L665 PolarHBondContact O-N 3.17Å; P662-A666 WeakPolarHBondContact O-CB 3.36Å; P662-A666 PolarHBondContact O-N 2.98Å
663	I	92.4	Very high	91.4	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-64.6	-47.1	179.2	-66.7	169.8	0	0	0	111	W416 T586 L589 L590 K659 I660 I661 A666 F667	W416-I663 HydrophobicContact CH2-CD1 3.85Å; W416-I663 HydrophobicContact CH2-CG1 3.78Å; W416-I663 HydrophobicContact CZ2-CD1 4.43Å; W416-I663 HydrophobicContact CZ2-CG1 4.27Å; W416-I663 HydrophobicContact CZ3-CG1 4.34Å; T586-I663 HydrophobicContact CG2-CG2 4.1Å; T586-I663 WeakPolarHBondContact O-CG2 3.45Å; L589-I663 HydrophobicContact CB-CD1 3.88Å; L589-I663 HydrophobicContact CB-CG1 4.36Å; L590-I663 HydrophobicContact CD2-CB 4.15Å; L590-I663 HydrophobicContact CD2-CD1 3.82Å; L590-I663 HydrophobicContact CD2-CG2 3.93Å; L590-I663 HydrophobicContact CG-CD1 4.36Å; L590-I663 HydrophobicContact CG-CG2 3.88Å; K659-I663 HydrophobicContact CB-CD1 4.5Å; K659-I663 WeakPolarHBondContact O-CD1 3.28Å; K659-I663 WeakPolarHBondContact O-CG1 3.38Å; I660-I663 PolarHBondContact O-N 3.01Å; I661-I663 VanDerWaalsContact C-N 3.3Å; I661-I663 PolarHBondContact O-N 3Å; I663-A666 PolarHBondContact O-N 2.97Å; I663-F667 VanDerWaalsContact O-CB 3.26Å; I663-F667 WeakPolarHBondContact O-CB 3.36Å; I663-F667 PolarHBondContact O-N 2.8Å
664	F	94.3	Very high	91.7	Very high	97 Å²	97	43.9 Å²	43.9	43%	0.425	24%	0.243	S	C	.	.	H	α-helix	trans	-67.8	-36.4	179	-88.5	-76.1	0	0	0	112.9	F587 L590 I660 I661 F667 A668	F587-F664 HydrophobicContact CE2-CE1 4.35Å; F587-F664 HydrophobicContact CE2-CZ 4.34Å; L590-F664 HydrophobicContact CD1-CE2 3.75Å; L590-F664 HydrophobicContact CD1-CZ 3.87Å; L590-F664 HydrophobicContact CD2-CE2 4.23Å; I660-F664 HydrophobicContact CG2-CD2 3.48Å; I660-F664 VanDerWaalsContact CG2-CD2 3.48Å; I660-F664 HydrophobicContact CG2-CE2 3.64Å; I660-F664 WeakPolarHBondContact O-CD2 3.21Å; I660-F664 PolarHBondContact O-N 2.77Å; I661-F664 PolarHBondContact O-N 3.25Å; F664-F667 PolarHBondContact O-N 2.89Å; F664-A668 VanDerWaalsContact O-CB 3.28Å; F664-A668 WeakPolarHBondContact O-CB 3.36Å; F664-A668 PolarHBondContact O-N 3.07Å
665	L	94.8	Very high	92.1	Very high	67 Å²	67	45.9 Å²	45.9	35%	0.351	26%	0.256	S	S	.	.	H	α-helix	trans	-61.6	-48.3	173.8	-76.2	171.5	0	0	0	111.1	F408 I650 I661 P662 A668 A669	F408-L665 HydrophobicContact CE1-CB 4.28Å; I650-L665 HydrophobicContact CG2-CD1 3.96Å; I661-L665 HydrophobicContact CG2-CD1 3.77Å; I661-L665 HydrophobicContact CG2-CG 4.28Å; I661-L665 WeakPolarHBondContact O-CB 3.33Å; I661-L665 WeakPolarHBondContact O-CG 3.44Å; I661-L665 PolarHBondContact O-N 2.91Å; P662-L665 PolarHBondContact O-N 3.17Å; L665-A668 PolarHBondContact O-N 3.38Å; L665-A669 WeakPolarHBondContact O-CB 3.46Å; L665-A669 PolarHBondContact O-N 3.49Å
666	A	94.9	Very high	92.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-42.9	177.3	0	0	0	0	0	112.1	S409 L413 T586 F651 P662 I663 A669 L670	S409-A666 WeakPolarHBondContact OG-CA 3.41Å; S409-A666 PolarHBondContact OG-O 3.18Å; L413-A666 HydrophobicContact CD1-CB 3.73Å; L413-A666 HydrophobicContact CD2-CB 4.19Å; L413-A666 HydrophobicContact CG-CB 3.89Å; T586-A666 HydrophobicContact CG2-CB 3.9Å; F651-A666 HydrophobicContact CE1-CB 4.21Å; F651-A666 HydrophobicContact CZ-CB 4.01Å; P662-A666 WeakPolarHBondContact O-CB 3.36Å; P662-A666 PolarHBondContact O-N 2.98Å; I663-A666 PolarHBondContact O-N 2.97Å; A666-A669 PolarHBondContact O-N 2.65Å; A666-L670 WeakPolarHBondContact O-CB 3.28Å; A666-L670 VanDerWaalsContact O-CG 3.26Å; A666-L670 WeakPolarHBondContact O-CG 3.07Å; A666-L670 PolarHBondContact O-N 2.83Å
667	F	95.9	Very high	93.3	Very high	60 Å²	60	43.7 Å²	43.7	26%	0.263	24%	0.237	S	C	.	.	H	α-helix	trans	-58.6	-52.4	176	172.4	-98.6	0	0	0	111.8	S583 F587 I663 F664 A669 L670 V671	S583-F667 WeakPolarHBondContact O-CD2 3.22Å; F587-F667 HydrophobicContact CB-CD2 3.87Å; F587-F667 HydrophobicContact CB-CE2 4.04Å; F587-F667 HydrophobicContact CD2-CD2 4.45Å; F587-F667 HydrophobicContact CD2-CE2 4.43Å; F587-F667 HydrophobicContact CG-CE2 4.48Å; I663-F667 VanDerWaalsContact O-CB 3.26Å; I663-F667 WeakPolarHBondContact O-CB 3.36Å; I663-F667 PolarHBondContact O-N 2.8Å; F664-F667 PolarHBondContact O-N 2.89Å; F667-A669 VanDerWaalsContact C-N 3.35Å; F667-A669 PolarHBondContact O-N 2.71Å; F667-L670 PolarHBondContact O-N 3.39Å; F667-V671 HydrophobicContact CD1-CG2 4.5Å; F667-V671 HydrophobicContact CD2-CG2 4.27Å; F667-V671 HydrophobicContact CE1-CG2 4.11Å; F667-V671 HydrophobicContact CE2-CG2 3.86Å; F667-V671 HydrophobicContact CZ-CG2 3.77Å; F667-V671 WeakPolarHBondContact O-CG2 3.44Å; F667-V671 PolarHBondContact O-N 2.86Å
668	A	96.4	Very high	93.5	Very high	48 Å²	48	41.7 Å²	41.7	40%	0.397	23%	0.227	S	C	.	.	H	α-helix	trans	-61.9	-43.4	-179.2	0	0	0	0	0	111.5	F664 L665 V671 C672	F664-A668 VanDerWaalsContact O-CB 3.28Å; F664-A668 WeakPolarHBondContact O-CB 3.36Å; F664-A668 PolarHBondContact O-N 3.07Å; L665-A668 PolarHBondContact O-N 3.38Å; A668-V671 PolarHBondContact O-N 3.18Å; A668-C672 VanDerWaalsContact O-CB 3.31Å; A668-C672 WeakPolarHBondContact O-CB 3.35Å; A668-C672 PolarHBondContact O-N 2.73Å; A668-C672 PolarHBondContact O-SG 3.33Å
669	A	96.4	Very high	93.6	Very high	15 Å²	15	47.3 Å²	47.3	12%	0.124	25%	0.248	C	C	.	.	H	α-helix	trans	-61.2	-44.7	176.1	0	0	0	0	0	111.9	C405 F408 S409 L665 A666 F667 C672 G673	C405-A669 HydrophobicContact CB-CB 4.44Å; C405-A669 VanDerWaalsContact CB-O 3.27Å; C405-A669 WeakPolarHBondContact CB-O 3.32Å; C405-A669 PolarHBondContact SG-O 3.14Å; F408-A669 HydrophobicContact CD1-CB 4.07Å; S409-A669 WeakPolarHBondContact OG-CB 3.28Å; L665-A669 WeakPolarHBondContact O-CB 3.46Å; L665-A669 PolarHBondContact O-N 3.49Å; A666-A669 PolarHBondContact O-N 2.65Å; F667-A669 VanDerWaalsContact C-N 3.35Å; F667-A669 PolarHBondContact O-N 2.71Å; A669-C672 PolarHBondContact O-N 3.15Å; A669-G673 PolarHBondContact O-N 3.38Å
670	L	96.6	Very high	93.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66.6	-40.2	178.9	-72.4	166.5	0	0	0	112.8	M406 M579 F605 A666 F667 G674	M406-L670 HydrophobicContact SD-CD2 3.98Å; M579-L670 HydrophobicContact CE-CD2 4.33Å; F605-L670 HydrophobicContact CE2-CD1 3.84Å; A666-L670 WeakPolarHBondContact O-CB 3.28Å; A666-L670 VanDerWaalsContact O-CG 3.26Å; A666-L670 WeakPolarHBondContact O-CG 3.07Å; A666-L670 PolarHBondContact O-N 2.83Å; F667-L670 PolarHBondContact O-N 3.39Å; L670-G674 PolarHBondContact O-N 3.44Å
671	V	97	Very high	93.4	Very high	36 Å²	36	42.7 Å²	42.7	22%	0.218	23%	0.23	C	C	.	.	H	α-helix	trans	-65.4	-48.5	176.2	172.5	0	0	0	0	110.5	F667 A668 G674 L675	F667-V671 HydrophobicContact CD1-CG2 4.5Å; F667-V671 HydrophobicContact CD2-CG2 4.27Å; F667-V671 HydrophobicContact CE1-CG2 4.11Å; F667-V671 HydrophobicContact CE2-CG2 3.86Å; F667-V671 HydrophobicContact CZ-CG2 3.77Å; F667-V671 WeakPolarHBondContact O-CG2 3.44Å; F667-V671 PolarHBondContact O-N 2.86Å; A668-V671 PolarHBondContact O-N 3.18Å; V671-G674 PolarHBondContact O-N 2.79Å; V671-L675 HydrophobicContact CG1-CD1 3.97Å; V671-L675 HydrophobicContact CG1-CG 4.42Å; V671-L675 WeakPolarHBondContact O-CB 3.2Å; V671-L675 VanDerWaalsContact O-CG 3.3Å; V671-L675 WeakPolarHBondContact O-CG 3.33Å; V671-L675 PolarHBondContact O-N 2.99Å
672	C	96.2	Very high	92.9	Very high	73 Å²	73	43.1 Å²	43.1	49%	0.493	23%	0.23	S	C	.	.	H	α-helix	trans	-59.5	-49	177.5	-72.8	0	0	0	0	111.4	A668 A669 G674 L675 V676	A668-C672 VanDerWaalsContact O-CB 3.31Å; A668-C672 WeakPolarHBondContact O-CB 3.35Å; A668-C672 PolarHBondContact O-N 2.73Å; A668-C672 PolarHBondContact O-SG 3.33Å; A669-C672 PolarHBondContact O-N 3.15Å; C672-G674 PolarHBondContact O-N 2.9Å; C672-L675 PolarHBondContact O-N 3.19Å; C672-V676 VanDerWaalsContact O-CG2 3.28Å; C672-V676 WeakPolarHBondContact O-CG2 3.28Å; C672-V676 PolarHBondContact O-N 2.88Å
673	G	95.3	Very high	92.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.4	-43.5	176.9	0	0	0	0	0	112.4	A669 L675 V676 A677	A669-G673 PolarHBondContact O-N 3.38Å; G673-L675 PolarHBondContact O-N 2.83Å; G673-V676 PolarHBondContact O-N 2.83Å; G673-A677 WeakPolarHBondContact O-CB 3.42Å; G673-A677 PolarHBondContact O-N 2.67Å
674	G	95.1	Very high	90.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.8	-41.2	177.7	0	0	0	0	0	113.2	L670 V671 C672 A677 L678	L670-G674 PolarHBondContact O-N 3.44Å; V671-G674 PolarHBondContact O-N 2.79Å; C672-G674 PolarHBondContact O-N 2.9Å; G674-A677 PolarHBondContact O-N 3.18Å; G674-L678 WeakPolarHBondContact O-CG 3.39Å; G674-L678 PolarHBondContact O-N 3Å
675	L	95.1	Very high	89.1	Confident	97 Å²	97	51.7 Å²	51.7	51%	0.508	27%	0.268	S	S	.	.	H	α-helix	trans	-69	-38.4	176.7	-69.2	175.3	0	0	0	112.6	V671 C672 G673 L678	V671-L675 HydrophobicContact CG1-CD1 3.97Å; V671-L675 HydrophobicContact CG1-CG 4.42Å; V671-L675 WeakPolarHBondContact O-CB 3.2Å; V671-L675 VanDerWaalsContact O-CG 3.3Å; V671-L675 WeakPolarHBondContact O-CG 3.33Å; V671-L675 PolarHBondContact O-N 2.99Å; C672-L675 PolarHBondContact O-N 3.19Å; G673-L675 PolarHBondContact O-N 2.83Å; L675-L678 PolarHBondContact O-N 2.69Å
676	V	95	Very high	87.5	Confident	34 Å²	34	53.2 Å²	53.2	21%	0.206	27%	0.271	C	S	.	.	H	α-helix	trans	-68.5	-37.7	174.7	173.9	0	0	0	0	110.8	F398 I401 V402 C672 G673 L678 K679	F398-V676 HydrophobicContact CB-CG1 3.83Å; F398-V676 HydrophobicContact CD1-CG1 3.91Å; F398-V676 HydrophobicContact CG-CG1 4.02Å; I401-V676 HydrophobicContact CB-CG1 4.36Å; I401-V676 HydrophobicContact CG2-CB 4.43Å; I401-V676 HydrophobicContact CG2-CG1 4.25Å; I401-V676 HydrophobicContact CG2-CG2 4.23Å; V402-V676 HydrophobicContact CG2-CB 4.18Å; V402-V676 HydrophobicContact CG2-CG1 3.92Å; C672-V676 VanDerWaalsContact O-CG2 3.28Å; C672-V676 WeakPolarHBondContact O-CG2 3.28Å; C672-V676 PolarHBondContact O-N 2.88Å; G673-V676 PolarHBondContact O-N 2.83Å; V676-L678 PolarHBondContact O-N 2.74Å; V676-K679 WeakPolarHBondContact O-CB 3.34Å; V676-K679 PolarHBondContact O-N 3.44Å
677	A	92.9	Very high	85.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.9	-38.5	177.4	0	0	0	0	0	111.8	V402 I572 I575 G673 G674 K679 L680	V402-A677 HydrophobicContact CG1-CB 4.06Å; V402-A677 HydrophobicContact CG2-CB 3.87Å; I572-A677 WeakPolarHBondContact CG2-O 3.06Å; I575-A677 HydrophobicContact CB-CB 4.38Å; I575-A677 HydrophobicContact CG2-CB 3.66Å; G673-A677 WeakPolarHBondContact O-CB 3.42Å; G673-A677 PolarHBondContact O-N 2.67Å; G674-A677 PolarHBondContact O-N 3.18Å; A677-K679 PolarHBondContact O-N 2.77Å; A677-K679 VanDerWaalsContact O-N 3.11Å; A677-L680 WeakPolarHBondContact O-CB 3.38Å; A677-L680 PolarHBondContact O-N 3.22Å; A677-L680 VanDerWaalsContact O-N 3.08Å
678	L	90	Very high	84.1	Confident	86 Å²	86	53.4 Å²	53.4	45%	0.45	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-11.9	176.5	-64.8	174.7	0	0	0	114.4	I572 G674 L675 V676	I572-L678 HydrophobicContact CG2-CD2 4.23Å; G674-L678 WeakPolarHBondContact O-CG 3.39Å; G674-L678 PolarHBondContact O-N 3Å; L675-L678 PolarHBondContact O-N 2.69Å; V676-L678 PolarHBondContact O-N 2.74Å
679	K	89.3	Confident	81.6	Confident	156 Å²	156	54.8 Å²	54.8	68%	0.678	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-3.8	175.9	-62.7	-67.7	-175.4	178.4	0	113.5	F398 V676 A677	F398-K679 HydrophobicContact CD2-CB 4.22Å; F398-K679 HydrophobicContact CE2-CB 4Å; V676-K679 WeakPolarHBondContact O-CB 3.34Å; V676-K679 PolarHBondContact O-N 3.44Å; A677-K679 PolarHBondContact O-N 2.77Å; A677-K679 VanDerWaalsContact O-N 3.11Å
680	L	87.5	Confident	80.9	Confident	11 Å²	11	56.8 Å²	56.8	6%	0.058	29%	0.289	C	S	.	.	S	Bend	trans	-69.9	156.4	174.9	-70.7	168	0	0	0	111.1	F398 L399 V402 I572 I619 A677	F398-L680 HydrophobicContact CB-CD2 3.65Å; F398-L680 HydrophobicContact CB-CG 4.33Å; L399-L680 HydrophobicContact CB-CD2 4.44Å; L399-L680 HydrophobicContact CD1-CD1 4.3Å; V402-L680 HydrophobicContact CG2-CD1 4.46Å; I572-L680 HydrophobicContact CD1-CB 4.27Å; I572-L680 WeakPolarHBondContact CD1-O 3.38Å; I572-L680 HydrophobicContact CG1-CB 4.32Å; I619-L680 HydrophobicContact CD1-CB 4.31Å; I619-L680 HydrophobicContact CD1-CD1 4.16Å; A677-L680 WeakPolarHBondContact O-CB 3.38Å; A677-L680 PolarHBondContact O-N 3.22Å; A677-L680 VanDerWaalsContact O-N 3.08Å
681	P	83.9	Confident	80	Confident	43 Å²	43	59.8 Å²	59.8	28%	0.279	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-78.9	137.2	173.4	32.8	-36	0	0	0	111.5	Q395 L623	Q395-P681 HydrophobicContact CG-CG 4.18Å; L623-P681 HydrophobicContact CD1-CG 3.85Å
682	E	81	Confident	79.1	Confident	80 Å²	80	61.1 Å²	61.1	37%	0.374	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-71.3	132.3	179.9	-173.5	63.9	-118.3	0	0	110.1	R571 I572 R684	R571-E682 PolarHBondContact N-OE1 3.4Å; I572-E682 VanDerWaalsContact CD1-CA 3.42Å; I572-E682 HydrophobicContact CD1-CB 3.85Å; I572-E682 VanDerWaalsContact CD1-N 3.27Å; E682-R684 HydrophobicContact CG-CB 4.1Å
683	T	76.8	Confident	78.1	Confident	6 Å²	6	60.4 Å²	60.4	4%	0.037	30%	0.298	C	S	.	.			trans	-102.7	0.2	-173.9	52.7	0	0	0	0	113.7	I619 E622 E685 K686	I619-T683 HydrophobicContact CD1-CG2 4.5Å; I619-T683 HydrophobicContact CG1-CG2 3.99Å; E622-T683 HydrophobicContact CB-CG2 4.11Å; E622-T683 WeakPolarHBondContact OE2-CB 3.46Å; E622-T683 PolarHBondContact OE2-OG1 2.82Å; T683-E685 VanDerWaalsContact C-N 3.25Å; T683-E685 PolarHBondContact O-N 3.26Å; T683-K686 PolarHBondContact O-N 2.81Å; T683-K686 VanDerWaalsContact O-N 3.12Å
684	R	60.8	Low	77	Confident	105 Å²	105	64.2 Å²	64.2	40%	0.396	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-27.4	-166.8	173.1	165.4	175.4	-169	-2.9	117.3	D567 K568 E682	D567-R684 PolarHBondContact O-NE 3.05Å; D567-R684 VanDerWaalsContact O-NE 3.14Å; D567-R684 PolarHBondContact O-NH1 2.65Å; D567-R684 PolarHBondContact O-NH2 2.83Å; K568-R684 PolarHBondContact O-NH1 3.38Å; E682-R684 HydrophobicContact CG-CB 4.1Å
685	E	60.1	Low	75.8	Confident	169 Å²	169	68.5 Å²	68.5	79%	0.79	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	17.1	-177.7	-61.9	175.7	-179.7	0	0	111.1	T683	T683-E685 VanDerWaalsContact C-N 3.25Å; T683-E685 PolarHBondContact O-N 3.26Å
686	K	61.8	Low	74.4	Confident	98 Å²	98	66.4 Å²	66.4	43%	0.426	33%	0.326	S	S	.	.			trans	-86.9	131.1	-173	-163.8	-179.5	177.5	-170.4	0	110.9	T683 L688	T683-K686 PolarHBondContact O-N 2.81Å; T683-K686 VanDerWaalsContact O-N 3.12Å; K686-L688 PolarHBondContact O-N 2.87Å
687	I	59.4	Low	72.9	Confident	63 Å²	63	68.9 Å²	68.9	32%	0.323	34%	0.335	S	S	.	.			trans	-63	123.6	169.8	-51.6	-178.5	0	0	0	110.8	P96 E97 E100 M233 S689	P96-I687 HydrophobicContact CB-CG2 3.59Å; E97-I687 HydrophobicContact CG-CD1 3.62Å; E100-I687 HydrophobicContact CG-CG2 4.22Å; M233-I687 HydrophobicContact CE-CB 3.87Å; M233-I687 HydrophobicContact CE-CG1 3.81Å; M233-I687 HydrophobicContact CE-CG2 3.94Å; M233-I687 HydrophobicContact SD-CG1 4.23Å; I687-S689 PolarHBondContact O-N 3.38Å
688	L	58.8	Low	71.2	Confident	2 Å²	2	74.7 Å²	74.7	1%	0.01	36%	0.363	C	S	.	.			trans	-60.3	113.7	172.5	-72.1	176.1	0	0	0	106.2	P96 R236 R307 E622 K686	P96-L688 WeakPolarHBondContact CB-O 3.37Å; R236-L688 VanDerWaalsContact NH1-CD1 3.28Å; R307-L688 PolarHBondContact NH1-O 3.43Å; R307-L688 PolarHBondContact NH2-O 3.42Å; E622-L688 HydrophobicContact CB-CD2 4.47Å; K686-L688 PolarHBondContact O-N 2.87Å
689	S	45.1	Very low	69.5	Low	77 Å²	77	73.6 Å²	73.6	54%	0.538	36%	0.355	S	S	.	.			trans	-73.6	0	-179.4	55.9	0	0	0	0	113.7	R307 P625 S626 I687	R307-S689 PolarHBondContact NH2-O 2.98Å; P625-S689 WeakPolarHBondContact CA-O 3.41Å; P625-S689 WeakPolarHBondContact CB-O 3.48Å; P625-S689 WeakPolarHBondContact CB-OG 3.21Å; S626-S689 PolarHBondContact N-O 2.68Å; I687-S689 PolarHBondContact O-N 3.38Å

Retrieved 689 of 689 residues in 147.5 ms (Link to these results)

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