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Vasopressin V1a receptor

Receptor for arginine vasopressin. The activity of this receptor is mediated by G proteins which activate a phosphatidyl-inositol-calcium second messenger system.

AlphaFold DB , UniProt , Accession X5D789, Species HUMAN (Homo sapiens, Human), Gene AVPR1A, Length 382 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	27.6	Very low	33.2	Very low	236 Å²	236	135.5 Å²	135.5	100%	1.163	84%	0.843	S	S	*	*				0	134.9	0	-81.9	171.3	168	0	0	108.6
2	R	25.5	Very low	33.1	Very low	229 Å²	229	134.8 Å²	134.8	86%	0.864	85%	0.846	S	S	*	*			trans	46.6	114.2	149.1	-58.6	178.6	178.8	172.8	-1.5	118.6
3	L	25.4	Very low	32.8	Very low	168 Å²	168	129.4 Å²	129.4	88%	0.88	83%	0.832	S	S	*	*				78.5	116.3	50.8	-71.4	169.1	0	0	0	115.8
4	S	26.4	Very low	32.6	Very low	118 Å²	118	131.7 Å²	131.7	83%	0.825	84%	0.835	S	S	*	*			trans	170	136.1	135.1	-111.2	0	0	0	0	108.1
5	A	31.2	Very low	32.6	Very low	93 Å²	93	129.7 Å²	129.7	77%	0.769	83%	0.826	S	S	*	*			cis	60	122.5	15.2	0	0	0	0	0	114.9
6	G	34.4	Very low	32.8	Very low	73 Å²	73	128.6 Å²	128.6	75%	0.753	82%	0.824	S	S	*	*			cis	-151.8	-123	1.9	0	0	0	0	0	110.5
7	P	50.3	Low	33.5	Very low	119 Å²	119	126.9 Å²	126.9	77%	0.773	81%	0.813	S	S	*	*				-122.7	-179.9	-80.6	41.1	-32.7	0	0	0	113
8	D	32.7	Very low	33.2	Very low	154 Å²	154	133.1 Å²	133.1	82%	0.824	82%	0.819	S	S	*	*			trans	173.1	112.8	141.9	-87.8	-18.4	0	0	0	108.9
9	A	32.9	Very low	33	Very low	98 Å²	98	135.1 Å²	135.1	81%	0.81	81%	0.81	S	S	*	*				81.3	112.7	93.1	0	0	0	0	0	114.5
10	G	28.8	Very low	33.2	Very low	77 Å²	77	134.9 Å²	134.9	79%	0.794	81%	0.812	S	S	*	*			trans	-91.5	-148	173.9	0	0	0	0	0	112.6
11	P	50.1	Low	33.1	Very low	126 Å²	126	135.4 Å²	135.4	82%	0.818	81%	0.809	S	S	*	*			cis	-136.7	-169.9	-4.6	42.8	-25.7	0	0	0	114.3
12	S	31.4	Very low	33.3	Very low	126 Å²	126	129 Å²	129	88%	0.881	79%	0.794	S	S	*	*			trans	132.4	147.1	143	70.9	0	0	0	0	117.4
13	G	30.3	Very low	33.6	Very low	65 Å²	65	124.8 Å²	124.8	67%	0.67	79%	0.794	S	S	*	*			trans	101.4	93.8	174.8	0	0	0	0	0	114.5
14	N	29.6	Very low	33.8	Very low	162 Å²	162	120.7 Å²	120.7	87%	0.866	79%	0.792	S	S	*	*				61.7	133	89.3	-71.5	2.5	0	0	0	114.4
15	S	32.2	Very low	34.1	Very low	101 Å²	101	120.5 Å²	120.5	71%	0.706	80%	0.797	S	S	*	*			cis	-171.1	144.6	0.6	37	0	0	0	0	113.4
16	S	36.7	Very low	34	Very low	113 Å²	113	119.7 Å²	119.7	79%	0.79	80%	0.798	S	S	*	*			trans	72.4	139.2	147.4	-55	0	0	0	0	122.8
17	P	43.6	Very low	33.8	Very low	99 Å²	99	123.3 Å²	123.3	64%	0.643	80%	0.8	S	S	*	*			trans	-111	170.3	179.3	42.5	-34.4	0	0	0	114.2
18	W	28	Very low	32.9	Very low	239 Å²	239	123.1 Å²	123.1	91%	0.905	80%	0.797	S	S	*	*			trans	-138	132.9	160.4	-75.3	96.3	0	0	0	112.6
19	W	29.8	Very low	32.9	Very low	171 Å²	171	120.9 Å²	120.9	65%	0.648	79%	0.794	S	S	*	*			trans	-116.6	161.2	176.7	43.6	-92.4	0	0	0	108.9	L21	W19-L21 HydrophobicContact CE3-CB 4.22Å; W19-L21 HydrophobicContact CZ3-CB 4.44Å
20	P	37.8	Very low	32.8	Very low	131 Å²	131	127.7 Å²	127.7	85%	0.851	80%	0.798	S	S	*	*			trans	-121	124.4	139.7	-2.2	23.1	0	0	0	112
21	L	31	Very low	32.9	Very low	146 Å²	146	133 Å²	133	76%	0.764	80%	0.802	S	S	*	*			trans	-98.4	127.7	161.2	-94.7	161.2	0	0	0	106.2	W19	W19-L21 HydrophobicContact CE3-CB 4.22Å; W19-L21 HydrophobicContact CZ3-CB 4.44Å
22	A	31.8	Very low	32.3	Very low	101 Å²	101	131 Å²	131	84%	0.835	80%	0.797	S	S	*	*			trans	-130.7	104.9	167.2	0	0	0	0	0	108.6
23	T	32.3	Very low	32.3	Very low	141 Å²	141	134 Å²	134	87%	0.865	80%	0.797	S	S	*	*			trans	-80.9	130.8	174.4	47	0	0	0	0	110.7
24	G	27.9	Very low	32.4	Very low	81 Å²	81	135.4 Å²	135.4	84%	0.835	80%	0.802	S	S	*	*			trans	-151.9	107	169.1	0	0	0	0	0	110.3
25	A	34	Very low	32.6	Very low	114 Å²	114	135.8 Å²	135.8	94%	0.942	80%	0.804	S	S	*	*			trans	-84.2	141.4	-179.4	0	0	0	0	0	111.4
26	G	28.6	Very low	32.9	Very low	77 Å²	77	134.3 Å²	134.3	79%	0.794	80%	0.804	S	S	*	*			trans	-172.6	56.9	-173.1	0	0	0	0	0	116.3
27	N	29.4	Very low	32.9	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	81%	0.812	S	S	*	*			trans	42.7	113.2	153.6	-95.9	9.6	0	0	0	122.6
28	T	32.5	Very low	32.5	Very low	116 Å²	116	137.6 Å²	137.6	71%	0.712	82%	0.818	S	S	*	*				66.2	119.2	127.6	57.8	0	0	0	0	122.7
29	S	31.7	Very low	33.1	Very low	107 Å²	107	134.8 Å²	134.8	75%	0.748	82%	0.821	S	S	*	*			trans	116.8	124.1	131.2	-55.8	0	0	0	0	117.5
30	R	32.4	Very low	34.2	Very low	240 Å²	240	128.7 Å²	128.7	91%	0.906	81%	0.811	S	S	*	*			trans	67	141	168.5	-65.5	173.3	167	156.3	-5.2	114.2
31	E	30.8	Very low	34.6	Very low	188 Å²	188	126.1 Å²	126.1	88%	0.879	79%	0.794	S	S	*	*			cis	-126.8	154.5	13.7	-108.6	144.7	119	0	0	112.6
32	A	36.4	Very low	35.6	Very low	86 Å²	86	123.4 Å²	123.4	71%	0.711	79%	0.785	S	S	*	*			trans	-96.7	173.5	157.1	0	0	0	0	0	109.2
33	E	32.1	Very low	36.7	Very low	188 Å²	188	127.7 Å²	127.7	88%	0.879	78%	0.78	S	S	*	*			trans	80	100.4	175.4	-54.5	-170	87.7	0	0	118.3
34	A	32.4	Very low	37.7	Very low	94 Å²	94	127.1 Å²	127.1	78%	0.777	77%	0.771	S	S	*	*				-176.6	91	122.8	0	0	0	0	0	108.4
35	L	32.7	Very low	39.1	Very low	171 Å²	171	126.2 Å²	126.2	90%	0.895	75%	0.75	S	S	*	*				52.5	118.5	99.1	-89	165.2	0	0	0	114.8
36	G	38.3	Very low	40.2	Very low	69 Å²	69	125.1 Å²	125.1	71%	0.711	72%	0.721	S	S	*	*			trans	-82.3	-161.7	176.6	0	0	0	0	0	114.4
37	E	37	Very low	41.5	Very low	208 Å²	208	126.2 Å²	126.2	97%	0.972	71%	0.708	S	S	*	*			trans	70.9	100.5	-175.8	-64.5	-152.6	83.1	0	0	116.9
38	G	34.9	Very low	43.3	Very low	73 Å²	73	124.1 Å²	124.1	75%	0.753	69%	0.694	S	S	*	*			trans	177.8	21	172.6	0	0	0	0	0	116.4	G40	G38-G40 PolarHBondContact O-N 3.47Å
39	N	40.6	Very low	44.6	Very low	181 Å²	181	123.2 Å²	123.2	97%	0.968	68%	0.682	S	S	*	*			trans	-76.3	63.6	-174.9	-163.1	17.8	0	0	0	112.8
40	G	53.4	Low	45.8	Very low	43 Å²	43	121.2 Å²	121.2	44%	0.443	66%	0.662	S	S	.	*			trans	-114.9	140.5	169.7	0	0	0	0	0	110.1	G38	G38-G40 PolarHBondContact O-N 3.47Å
41	P	47.7	Very low	47.1	Very low	76 Å²	76	111.6 Å²	111.6	49%	0.494	63%	0.634	S	S	.	*			trans	-59.9	152.1	-173.6	23.4	-34	0	0	0	112.2	V45 R46	P41-V45 HydrophobicContact CB-CG1 4.48Å; P41-R46 HydrophobicContact CG-CG 4.07Å; P41-R46 PolarHBondContact O-NH1 3.38Å
42	P	51.8	Low	48.8	Very low	89 Å²	89	107.3 Å²	107.3	58%	0.578	61%	0.613	S	S	*	*			trans	-51.3	152.5	-176.4	-27.3	34.3	0	0	0	113.6	D44 V45 R46	P42-D44 PolarHBondContact O-N 3.2Å; P42-V45 HydrophobicContact CB-CG2 4.24Å; P42-V45 HydrophobicContact CG-CG2 4.31Å; P42-V45 PolarHBondContact O-N 3.48Å; P42-R46 PolarHBondContact O-N 3.48Å
43	R	54.4	Low	50	Low	192 Å²	192	105.6 Å²	105.6	73%	0.725	59%	0.591	S	S	*	*	H	α-helix	trans	-55.6	-37.6	-178.2	-85.1	179.3	172.3	156.1	1.7	112.8	R46 N47	R43-R46 PolarHBondContact O-N 3.43Å; R43-N47 PolarHBondContact O-N 3.48Å; R43-N47 PolarHBondContact O-ND2 2.97Å; R43-N47 PolarHBondContact O-OD1 3.09Å
44	D	52.1	Low	51.5	Low	129 Å²	129	101.4 Å²	101.4	69%	0.69	57%	0.572	S	S	*	*	H	α-helix	trans	-63.2	-50.7	176.9	-97.9	-28.3	0	0	0	112.9	P42 R46 N47 E48	P42-D44 PolarHBondContact O-N 3.2Å; D44-R46 PolarHBondContact O-N 3.34Å; D44-R46 VanDerWaalsContact O-N 3.14Å; D44-N47 CarbonylContact O-C 3.47Å; D44-N47 WeakPolarHBondContact O-CA 3.23Å; D44-N47 WeakPolarHBondContact O-CB 3.43Å; D44-N47 PolarHBondContact O-N 3.44Å; D44-E48 PolarHBondContact O-N 2.84Å
45	V	57.8	Low	53.2	Low	62 Å²	62	102.2 Å²	102.2	38%	0.376	56%	0.562	S	S	.	*	H	α-helix	trans	-56.3	-36	178.5	-176.6	0	0	0	0	111.1	P41 P42 E49	P41-V45 HydrophobicContact CB-CG1 4.48Å; P42-V45 HydrophobicContact CB-CG2 4.24Å; P42-V45 HydrophobicContact CG-CG2 4.31Å; P42-V45 PolarHBondContact O-N 3.48Å; V45-E49 HydrophobicContact CG1-CG 4.35Å; V45-E49 WeakPolarHBondContact O-CB 3.38Å; V45-E49 VanDerWaalsContact O-CG 3.27Å; V45-E49 WeakPolarHBondContact O-CG 3.29Å; V45-E49 PolarHBondContact O-N 3.08Å
46	R	57.1	Low	54.4	Low	91 Å²	91	96.5 Å²	96.5	34%	0.343	54%	0.539	S	S	.	.	H	α-helix	trans	-71.4	-29	175.6	-61.2	-166.8	-55.8	-119.4	16.9	113.7	P41 P42 R43 D44 L50	P41-R46 HydrophobicContact CG-CG 4.07Å; P41-R46 PolarHBondContact O-NH1 3.38Å; P42-R46 PolarHBondContact O-N 3.48Å; R43-R46 PolarHBondContact O-N 3.43Å; D44-R46 PolarHBondContact O-N 3.34Å; D44-R46 VanDerWaalsContact O-N 3.14Å; R46-L50 WeakPolarHBondContact O-CB 3.32Å; R46-L50 PolarHBondContact O-N 3.46Å
47	N	57.2	Low	55.7	Low	99 Å²	99	94 Å²	94	53%	0.529	51%	0.51	S	S	.	.	H	α-helix	trans	-76.8	-39.4	174.7	-61.4	-22.9	0	0	0	110.5	R43 D44 L50 A51	R43-N47 PolarHBondContact O-N 3.48Å; R43-N47 PolarHBondContact O-ND2 2.97Å; R43-N47 PolarHBondContact O-OD1 3.09Å; D44-N47 CarbonylContact O-C 3.47Å; D44-N47 WeakPolarHBondContact O-CA 3.23Å; D44-N47 WeakPolarHBondContact O-CB 3.43Å; D44-N47 PolarHBondContact O-N 3.44Å; N47-L50 PolarHBondContact O-N 3.07Å; N47-A51 WeakPolarHBondContact O-CB 3.45Å; N47-A51 PolarHBondContact O-N 3.36Å
48	E	65.8	Low	57	Low	105 Å²	105	88.2 Å²	88.2	49%	0.491	49%	0.486	S	S	.	.	H	α-helix	trans	-65.1	-48.4	176.7	-167.1	-165.8	144.2	0	0	111.7	D44 L50 A51 K52	D44-E48 PolarHBondContact O-N 2.84Å; E48-L50 VanDerWaalsContact C-N 3.3Å; E48-L50 PolarHBondContact O-N 3.06Å; E48-A51 PolarHBondContact O-N 2.96Å; E48-K52 WeakPolarHBondContact O-CG 3.37Å; E48-K52 PolarHBondContact O-N 3.13Å; E48-K52 WeakPolarHBondContact OE1-CE 3.33Å; E48-K52 IonicContact OE1-NZ 3.89Å; E48-K52 PolarHBondContact OE1-NZ 3.46Å
49	E	59.8	Low	58.5	Low	96 Å²	96	87.5 Å²	87.5	45%	0.449	47%	0.473	S	S	.	.	H	α-helix	trans	-66.3	-31.8	176.2	-70.3	-64.6	113.2	0	0	112.5	V45 K52 L53	V45-E49 HydrophobicContact CG1-CG 4.35Å; V45-E49 WeakPolarHBondContact O-CB 3.38Å; V45-E49 VanDerWaalsContact O-CG 3.27Å; V45-E49 WeakPolarHBondContact O-CG 3.29Å; V45-E49 PolarHBondContact O-N 3.08Å; E49-K52 WeakPolarHBondContact OE1-CD 3.36Å; E49-K52 IonicContact OE1-NZ 2.75Å; E49-K52 PolarHBondContact OE1-NZ 2.71Å; E49-L53 VanDerWaalsContact O-CB 3.32Å; E49-L53 WeakPolarHBondContact O-CB 3.45Å; E49-L53 PolarHBondContact O-N 3.24Å
50	L	58.3	Low	59.6	Low	66 Å²	66	82.2 Å²	82.2	35%	0.346	45%	0.447	S	S	.	.	H	α-helix	trans	-68.5	-43.2	171.6	-174.1	69.6	0	0	0	111	R46 N47 E48 L53 E54	R46-L50 WeakPolarHBondContact O-CB 3.32Å; R46-L50 PolarHBondContact O-N 3.46Å; N47-L50 PolarHBondContact O-N 3.07Å; E48-L50 VanDerWaalsContact C-N 3.3Å; E48-L50 PolarHBondContact O-N 3.06Å; L50-L53 PolarHBondContact O-N 3.03Å; L50-E54 HydrophobicContact CG-CG 4.49Å; L50-E54 WeakPolarHBondContact O-CB 3.16Å; L50-E54 WeakPolarHBondContact O-CG 3.45Å; L50-E54 PolarHBondContact O-N 3.29Å
51	A	58.7	Low	60.2	Low	38 Å²	38	82.1 Å²	82.1	31%	0.314	44%	0.437	S	S	.	.	H	α-helix	trans	-64.7	-42.5	176.9	0	0	0	0	0	112	N47 E48 L53 E54 I55	N47-A51 WeakPolarHBondContact O-CB 3.45Å; N47-A51 PolarHBondContact O-N 3.36Å; E48-A51 PolarHBondContact O-N 2.96Å; A51-L53 VanDerWaalsContact C-N 3.31Å; A51-L53 PolarHBondContact O-N 2.92Å; A51-E54 PolarHBondContact O-N 3.42Å; A51-I55 WeakPolarHBondContact O-CB 3.46Å; A51-I55 WeakPolarHBondContact O-CD1 3.37Å; A51-I55 WeakPolarHBondContact O-CG1 3.36Å; A51-I55 PolarHBondContact O-N 3.44Å
52	K	67.4	Low	61.1	Low	98 Å²	98	85.5 Å²	85.5	43%	0.426	44%	0.444	S	S	.	.	H	α-helix	trans	-59.2	-42	172	-71.8	171	-169.9	160.9	0	111.7	E48 E49 A56	E48-K52 WeakPolarHBondContact O-CG 3.37Å; E48-K52 PolarHBondContact O-N 3.13Å; E48-K52 WeakPolarHBondContact OE1-CE 3.33Å; E48-K52 IonicContact OE1-NZ 3.89Å; E48-K52 PolarHBondContact OE1-NZ 3.46Å; E49-K52 WeakPolarHBondContact OE1-CD 3.36Å; E49-K52 IonicContact OE1-NZ 2.75Å; E49-K52 PolarHBondContact OE1-NZ 2.71Å; K52-A56 VanDerWaalsContact O-CB 3.24Å; K52-A56 WeakPolarHBondContact O-CB 3.31Å; K52-A56 PolarHBondContact O-N 3.26Å
53	L	60.4	Low	61.8	Low	50 Å²	50	83 Å²	83	26%	0.262	43%	0.432	S	S	.	.	H	α-helix	trans	-67.4	-43	176.9	-175.6	66.4	0	0	0	112	E49 L50 A51 A56 V57 R132 I135	E49-L53 VanDerWaalsContact O-CB 3.32Å; E49-L53 WeakPolarHBondContact O-CB 3.45Å; E49-L53 PolarHBondContact O-N 3.24Å; L50-L53 PolarHBondContact O-N 3.03Å; A51-L53 VanDerWaalsContact C-N 3.31Å; A51-L53 PolarHBondContact O-N 2.92Å; L53-A56 PolarHBondContact O-N 2.99Å; L53-V57 WeakPolarHBondContact O-CB 3.41Å; L53-V57 VanDerWaalsContact O-CG2 3.23Å; L53-V57 WeakPolarHBondContact O-CG2 3.37Å; L53-V57 PolarHBondContact O-N 3.11Å; L53-R132 HydrophobicContact CD2-CG 3.67Å; L53-I135 HydrophobicContact CD2-CD1 4.01Å
54	E	64.6	Low	62.4	Low	100 Å²	100	74.9 Å²	74.9	47%	0.467	40%	0.403	S	S	.	.	H	α-helix	trans	-63.8	-43.1	175.7	-74.5	175.9	177	0	0	111.2	L50 A51 V57 L58	L50-E54 HydrophobicContact CG-CG 4.49Å; L50-E54 WeakPolarHBondContact O-CB 3.16Å; L50-E54 WeakPolarHBondContact O-CG 3.45Å; L50-E54 PolarHBondContact O-N 3.29Å; A51-E54 PolarHBondContact O-N 3.42Å; E54-V57 PolarHBondContact O-N 3.42Å; E54-L58 WeakPolarHBondContact O-CB 3.46Å; E54-L58 VanDerWaalsContact O-CG 3.24Å; E54-L58 WeakPolarHBondContact O-CG 3.39Å; E54-L58 PolarHBondContact O-N 3.47Å
55	I	67.2	Low	63	Low	111 Å²	111	69.5 Å²	69.5	57%	0.569	38%	0.377	S	S	*	.	H	α-helix	trans	-64.8	-44.5	174.7	-69.1	164.2	0	0	0	111.1	A51 L58 A59	A51-I55 WeakPolarHBondContact O-CB 3.46Å; A51-I55 WeakPolarHBondContact O-CD1 3.37Å; A51-I55 WeakPolarHBondContact O-CG1 3.36Å; A51-I55 PolarHBondContact O-N 3.44Å; I55-L58 PolarHBondContact O-N 3.42Å; I55-A59 VanDerWaalsContact O-CB 3.27Å; I55-A59 WeakPolarHBondContact O-CB 3.41Å; I55-A59 PolarHBondContact O-N 3.23Å
56	A	58.2	Low	63.6	Low	51 Å²	51	71.8 Å²	71.8	42%	0.421	38%	0.382	S	S	.	.	H	α-helix	trans	-63.3	-42.6	177.3	0	0	0	0	0	111.7	K52 L53 A59 V60	K52-A56 VanDerWaalsContact O-CB 3.24Å; K52-A56 WeakPolarHBondContact O-CB 3.31Å; K52-A56 PolarHBondContact O-N 3.26Å; L53-A56 PolarHBondContact O-N 2.99Å; A56-A59 PolarHBondContact O-N 2.86Å; A56-V60 WeakPolarHBondContact O-CB 3.21Å; A56-V60 VanDerWaalsContact O-CG2 3.29Å; A56-V60 WeakPolarHBondContact O-CG2 3.18Å; A56-V60 PolarHBondContact O-N 3.44Å
57	V	64.8	Low	64.3	Low	17 Å²	17	72.6 Å²	72.6	10%	0.103	39%	0.388	C	S	.	.	H	α-helix	trans	-62.5	-43.1	174.1	165.7	0	0	0	0	111	L53 E54 T61 M105 I135	L53-V57 WeakPolarHBondContact O-CB 3.41Å; L53-V57 VanDerWaalsContact O-CG2 3.23Å; L53-V57 WeakPolarHBondContact O-CG2 3.37Å; L53-V57 PolarHBondContact O-N 3.11Å; E54-V57 PolarHBondContact O-N 3.42Å; V57-T61 VanDerWaalsContact O-CB 3.26Å; V57-T61 WeakPolarHBondContact O-CB 3.29Å; V57-T61 PolarHBondContact O-N 3.02Å; V57-T61 PolarHBondContact O-OG1 2.96Å; V57-M105 HydrophobicContact CG1-CE 3.68Å; V57-I135 HydrophobicContact CG2-CG2 4.48Å
58	L	65.8	Low	64.9	Low	86 Å²	86	68.4 Å²	68.4	45%	0.45	37%	0.365	S	S	.	.	H	α-helix	trans	-67.1	-41.6	177	-75.2	168.3	0	0	0	112.4	E54 I55 T61 F62	E54-L58 WeakPolarHBondContact O-CB 3.46Å; E54-L58 VanDerWaalsContact O-CG 3.24Å; E54-L58 WeakPolarHBondContact O-CG 3.39Å; E54-L58 PolarHBondContact O-N 3.47Å; I55-L58 PolarHBondContact O-N 3.42Å; L58-T61 PolarHBondContact O-N 2.83Å; L58-F62 WeakPolarHBondContact O-CB 3.29Å; L58-F62 PolarHBondContact O-N 2.88Å
59	A	65.8	Low	65.3	Low	58 Å²	58	65.2 Å²	65.2	48%	0.479	35%	0.353	S	S	.	.	H	α-helix	trans	-65.4	-43.1	177.5	0	0	0	0	0	111.7	I55 A56 F62 A63	I55-A59 VanDerWaalsContact O-CB 3.27Å; I55-A59 WeakPolarHBondContact O-CB 3.41Å; I55-A59 PolarHBondContact O-N 3.23Å; A56-A59 PolarHBondContact O-N 2.86Å; A59-F62 PolarHBondContact O-N 3.47Å; A59-A63 WeakPolarHBondContact O-CB 3.4Å; A59-A63 PolarHBondContact O-N 3.07Å
60	V	63.6	Low	66	Low	70 Å²	70	64.3 Å²	64.3	42%	0.424	35%	0.351	S	S	.	.	H	α-helix	trans	-67	-39.6	173.2	175	0	0	0	0	110.8	A56 F62 A63 V64 W139	A56-V60 WeakPolarHBondContact O-CB 3.21Å; A56-V60 VanDerWaalsContact O-CG2 3.29Å; A56-V60 WeakPolarHBondContact O-CG2 3.18Å; A56-V60 PolarHBondContact O-N 3.44Å; V60-F62 VanDerWaalsContact C-N 3.3Å; V60-F62 PolarHBondContact O-N 3.39Å; V60-A63 PolarHBondContact O-N 3.35Å; V60-V64 HydrophobicContact CG1-CG2 4.23Å; V60-V64 VanDerWaalsContact O-CB 3.28Å; V60-V64 WeakPolarHBondContact O-CB 3.4Å; V60-V64 WeakPolarHBondContact O-CG2 3.43Å; V60-V64 PolarHBondContact O-N 3.27Å; V60-W139 HydrophobicContact CG1-CH2 3.71Å; V60-W139 HydrophobicContact CG1-CZ2 4.28Å; V60-W139 HydrophobicContact CG1-CZ3 4.44Å
61	T	65	Low	66.8	Low	40 Å²	40	62.5 Å²	62.5	25%	0.245	34%	0.343	C	S	.	.	H	α-helix	trans	-62.1	-38.7	174.2	-57.7	0	0	0	0	111.5	V57 L58 A65	V57-T61 VanDerWaalsContact O-CB 3.26Å; V57-T61 WeakPolarHBondContact O-CB 3.29Å; V57-T61 PolarHBondContact O-N 3.02Å; V57-T61 PolarHBondContact O-OG1 2.96Å; L58-T61 PolarHBondContact O-N 2.83Å; T61-A65 VanDerWaalsContact O-CB 3.29Å; T61-A65 WeakPolarHBondContact O-CB 3.25Å; T61-A65 PolarHBondContact O-N 2.93Å
62	F	68.3	Low	67.4	Low	147 Å²	147	63.4 Å²	63.4	65%	0.645	34%	0.341	S	S	*	.	H	α-helix	trans	-70.4	-42.1	177.1	-166.8	-93.9	0	0	0	112	L58 A59 V60 A65 F66	L58-F62 WeakPolarHBondContact O-CB 3.29Å; L58-F62 PolarHBondContact O-N 2.88Å; A59-F62 PolarHBondContact O-N 3.47Å; V60-F62 VanDerWaalsContact C-N 3.3Å; V60-F62 PolarHBondContact O-N 3.39Å; F62-A65 PolarHBondContact O-N 3.01Å; F62-F66 WeakPolarHBondContact O-CB 3.39Å; F62-F66 PolarHBondContact O-N 3.35Å
63	A	66.3	Low	67.6	Low	38 Å²	38	62.2 Å²	62.2	31%	0.314	34%	0.338	S	S	.	.	H	α-helix	trans	-61.6	-44.3	172.6	0	0	0	0	0	111.5	A59 V60 F66 F67	A59-A63 WeakPolarHBondContact O-CB 3.4Å; A59-A63 PolarHBondContact O-N 3.07Å; V60-A63 PolarHBondContact O-N 3.35Å; A63-F66 WeakPolarHBondContact O-CB 3.47Å; A63-F66 PolarHBondContact O-N 3.42Å; A63-F67 HydrophobicContact CB-CE2 4.47Å; A63-F67 WeakPolarHBondContact O-CD2 3.36Å; A63-F67 PolarHBondContact O-N 3.37Å
64	V	65.9	Low	68.3	Low	21 Å²	21	63.2 Å²	63.2	13%	0.127	35%	0.348	C	S	.	.	H	α-helix	trans	-64.1	-40.2	175.2	167.7	0	0	0	0	111.4	V60 F67 Q68	V60-V64 HydrophobicContact CG1-CG2 4.23Å; V60-V64 VanDerWaalsContact O-CB 3.28Å; V60-V64 WeakPolarHBondContact O-CB 3.4Å; V60-V64 WeakPolarHBondContact O-CG2 3.43Å; V60-V64 PolarHBondContact O-N 3.27Å; V64-F67 CarbonylContact O-C 3.47Å; V64-F67 PolarHBondContact O-N 2.97Å; V64-Q68 VanDerWaalsContact O-CB 3.3Å; V64-Q68 WeakPolarHBondContact O-CB 3.44Å; V64-Q68 PolarHBondContact O-N 3.33Å
65	A	66.1	Low	68.6	Low	16 Å²	16	61.7 Å²	61.7	13%	0.132	34%	0.338	C	S	.	.	H	α-helix	trans	-65.2	-37.4	173.7	0	0	0	0	0	112.3	T61 F62 Q68 V69	T61-A65 VanDerWaalsContact O-CB 3.29Å; T61-A65 WeakPolarHBondContact O-CB 3.25Å; T61-A65 PolarHBondContact O-N 2.93Å; F62-A65 PolarHBondContact O-N 3.01Å; A65-Q68 WeakPolarHBondContact O-CB 3.48Å; A65-Q68 PolarHBondContact O-N 2.77Å; A65-Q68 VanDerWaalsContact O-N 3.15Å; A65-V69 WeakPolarHBondContact O-CG2 3.29Å; A65-V69 PolarHBondContact O-N 2.91Å
66	F	70.1	Confident	68.7	Low	110 Å²	110	58.9 Å²	58.9	48%	0.482	32%	0.324	S	S	.	.	H	α-helix	trans	-63.3	-46.6	172.9	-179.9	-95.2	0	0	0	111.3	F62 A63 Q68 L70	F62-F66 WeakPolarHBondContact O-CB 3.39Å; F62-F66 PolarHBondContact O-N 3.35Å; A63-F66 WeakPolarHBondContact O-CB 3.47Å; A63-F66 PolarHBondContact O-N 3.42Å; F66-Q68 PolarHBondContact O-N 3.21Å; F66-L70 HydrophobicContact CD1-CD1 4.05Å; F66-L70 HydrophobicContact CD2-CD1 3.96Å; F66-L70 HydrophobicContact CD2-CG 4.12Å; F66-L70 HydrophobicContact CE1-CD1 3.55Å; F66-L70 HydrophobicContact CE1-CG 4.48Å; F66-L70 HydrophobicContact CE2-CD1 3.44Å; F66-L70 VanDerWaalsContact CE2-CD1 3.44Å; F66-L70 HydrophobicContact CE2-CG 4.06Å; F66-L70 HydrophobicContact CG-CD1 4.25Å; F66-L70 HydrophobicContact CG-CG 4.39Å; F66-L70 HydrophobicContact CZ-CD1 3.23Å; F66-L70 HydrophobicContact CZ-CG 4.26Å; F66-L70 VanDerWaalsContact O-CB 3.31Å; F66-L70 WeakPolarHBondContact O-CB 3.28Å; F66-L70 PolarHBondContact O-N 2.89Å
67	F	70.1	Confident	69.5	Low	107 Å²	107	62.7 Å²	62.7	47%	0.469	34%	0.336	S	S	.	.	H	α-helix	trans	-70.5	-12.2	171.7	-66.4	-58.7	0	0	0	114.1	A63 V64 P71	A63-F67 HydrophobicContact CB-CE2 4.47Å; A63-F67 WeakPolarHBondContact O-CD2 3.36Å; A63-F67 PolarHBondContact O-N 3.37Å; V64-F67 CarbonylContact O-C 3.47Å; V64-F67 PolarHBondContact O-N 2.97Å; F67-P71 WeakPolarHBondContact O-CD 3.12Å; F67-P71 WeakPolarHBondContact O-CG 3.36Å
68	Q	71.3	Confident	69.9	Low	12 Å²	12	64.6 Å²	64.6	6%	0.056	35%	0.347	C	S	.	.	H	α-helix	trans	-84.7	-50.6	172.6	-173.5	-177.9	-10.6	0	0	110.9	V64 A65 F66 Q95	V64-Q68 VanDerWaalsContact O-CB 3.3Å; V64-Q68 WeakPolarHBondContact O-CB 3.44Å; V64-Q68 PolarHBondContact O-N 3.33Å; A65-Q68 WeakPolarHBondContact O-CB 3.48Å; A65-Q68 PolarHBondContact O-N 2.77Å; A65-Q68 VanDerWaalsContact O-N 3.15Å; F66-Q68 PolarHBondContact O-N 3.21Å; Q68-Q95 PolarHBondContact O-NE2 3.16Å; Q68-Q95 VanDerWaalsContact O-NE2 3.09Å
69	V	73.8	Confident	70.1	Confident	38 Å²	38	69.6 Å²	69.6	23%	0.23	36%	0.362	C	S	.	.	H	α-helix	trans	-82.2	-42.6	-172.4	177.8	0	0	0	0	112.4	A65 Q72 M73	A65-V69 WeakPolarHBondContact O-CG2 3.29Å; A65-V69 PolarHBondContact O-N 2.91Å; V69-Q72 WeakPolarHBondContact O-CB 3.44Å; V69-Q72 PolarHBondContact O-N 3.49Å; V69-M73 HydrophobicContact CG1-CE 4.01Å; V69-M73 HydrophobicContact CG1-CG 4Å; V69-M73 WeakPolarHBondContact O-CG 3.47Å; V69-M73 PolarHBondContact O-N 2.88Å
70	L	75.2	Confident	70.3	Confident	76 Å²	76	72.4 Å²	72.4	40%	0.398	36%	0.36	S	S	.	.	H	α-helix	trans	-61.3	-46	-177.9	-76.9	-164.4	0	0	0	113.3	F66 Q72 M73 C74	F66-L70 HydrophobicContact CD1-CD1 4.05Å; F66-L70 HydrophobicContact CD2-CD1 3.96Å; F66-L70 HydrophobicContact CD2-CG 4.12Å; F66-L70 HydrophobicContact CE1-CD1 3.55Å; F66-L70 HydrophobicContact CE1-CG 4.48Å; F66-L70 HydrophobicContact CE2-CD1 3.44Å; F66-L70 VanDerWaalsContact CE2-CD1 3.44Å; F66-L70 HydrophobicContact CE2-CG 4.06Å; F66-L70 HydrophobicContact CG-CD1 4.25Å; F66-L70 HydrophobicContact CG-CG 4.39Å; F66-L70 HydrophobicContact CZ-CD1 3.23Å; F66-L70 HydrophobicContact CZ-CG 4.26Å; F66-L70 VanDerWaalsContact O-CB 3.31Å; F66-L70 WeakPolarHBondContact O-CB 3.28Å; F66-L70 PolarHBondContact O-N 2.89Å; L70-Q72 PolarHBondContact O-N 3.28Å; L70-M73 PolarHBondContact O-N 3.24Å; L70-C74 WeakPolarHBondContact O-CB 3.4Å; L70-C74 PolarHBondContact O-N 2.9Å; L70-C74 PolarHBondContact O-SG 2.93Å
71	P	74.2	Confident	70.9	Confident	29 Å²	29	70.6 Å²	70.6	19%	0.188	35%	0.346	C	S	.	.	H	α-helix	trans	-65.2	-27.4	178.9	-24.5	37.8	0	0	0	113	F67 W75 V91	F67-P71 WeakPolarHBondContact O-CD 3.12Å; F67-P71 WeakPolarHBondContact O-CG 3.36Å; P71-W75 WeakPolarHBondContact O-CB 3.34Å; P71-W75 PolarHBondContact O-N 2.91Å; P71-V91 HydrophobicContact CB-CG1 3.53Å; P71-V91 HydrophobicContact CG-CG1 3.89Å
72	Q	71.3	Confident	71.2	Confident	57 Å²	57	77.8 Å²	77.8	27%	0.266	37%	0.369	S	S	.	.	H	α-helix	trans	-67.5	-51.3	172.3	-162	70.4	18.9	0	0	110.5	V69 L70 C74 W75 D76	V69-Q72 WeakPolarHBondContact O-CB 3.44Å; V69-Q72 PolarHBondContact O-N 3.49Å; L70-Q72 PolarHBondContact O-N 3.28Å; Q72-C74 VanDerWaalsContact C-N 3.34Å; Q72-C74 PolarHBondContact O-N 3.2Å; Q72-W75 WeakPolarHBondContact O-CB 3.33Å; Q72-W75 PolarHBondContact O-N 2.97Å; Q72-W75 VanDerWaalsContact O-N 3.08Å; Q72-D76 PolarHBondContact O-N 3.24Å
73	M	72.6	Confident	71.6	Confident	73 Å²	73	71.9 Å²	71.9	36%	0.36	35%	0.35	S	S	.	.	H	α-helix	trans	-61.3	-40.8	177.2	-64.8	-69.2	166.1	0	0	112.2	V69 L70 W75 D76 I77 L299	V69-M73 HydrophobicContact CG1-CE 4.01Å; V69-M73 HydrophobicContact CG1-CG 4Å; V69-M73 WeakPolarHBondContact O-CG 3.47Å; V69-M73 PolarHBondContact O-N 2.88Å; L70-M73 PolarHBondContact O-N 3.24Å; M73-W75 VanDerWaalsContact C-N 3.32Å; M73-W75 PolarHBondContact O-N 2.85Å; M73-D76 PolarHBondContact O-N 3Å; M73-I77 WeakPolarHBondContact O-CB 3.3Å; M73-I77 WeakPolarHBondContact O-CD1 3.44Å; M73-I77 WeakPolarHBondContact O-CG1 3.29Å; M73-I77 PolarHBondContact O-N 3.05Å; M73-L299 HydrophobicContact CE-CD2 3.49Å; M73-L299 VanDerWaalsContact CE-CD2 3.49Å
74	C	73.4	Confident	72.4	Confident	70 Å²	70	73 Å²	73	47%	0.473	35%	0.354	S	S	.	.	H	α-helix	trans	-63.6	-37.4	174.3	-69.7	0	0	0	0	111.9	L70 Q72 T78	L70-C74 WeakPolarHBondContact O-CB 3.4Å; L70-C74 PolarHBondContact O-N 2.9Å; L70-C74 PolarHBondContact O-SG 2.93Å; Q72-C74 VanDerWaalsContact C-N 3.34Å; Q72-C74 PolarHBondContact O-N 3.2Å; C74-T78 VanDerWaalsContact O-CB 3.3Å; C74-T78 WeakPolarHBondContact O-CB 3.12Å; C74-T78 WeakPolarHBondContact O-CG2 3.4Å; C74-T78 PolarHBondContact O-N 3.35Å; C74-T78 PolarHBondContact O-OG1 3.43Å
75	W	71.7	Confident	73.3	Confident	69 Å²	69	74.7 Å²	74.7	26%	0.261	36%	0.362	S	S	.	.	H	α-helix	trans	-64.1	-50.9	175	-165.6	-72	0	0	0	111.1	P71 Q72 M73 I77 T78 Y79 F81 C167	P71-W75 WeakPolarHBondContact O-CB 3.34Å; P71-W75 PolarHBondContact O-N 2.91Å; Q72-W75 WeakPolarHBondContact O-CB 3.33Å; Q72-W75 PolarHBondContact O-N 2.97Å; Q72-W75 VanDerWaalsContact O-N 3.08Å; M73-W75 VanDerWaalsContact C-N 3.32Å; M73-W75 PolarHBondContact O-N 2.85Å; W75-I77 VanDerWaalsContact C-N 3.32Å; W75-I77 PolarHBondContact O-N 3.23Å; W75-T78 PolarHBondContact O-N 3Å; W75-Y79 WeakPolarHBondContact O-CA 3.43Å; W75-Y79 PolarHBondContact O-N 3.35Å; W75-F81 HydrophobicContact CE3-CB 4.19Å; W75-F81 AromaticContact CE3-CD2 3.98Å; W75-F81 HydrophobicContact CE3-CD2 3.98Å; W75-F81 HydrophobicContact CH2-CB 4.01Å; W75-F81 HydrophobicContact CZ3-CB 3.58Å; W75-F81 AromaticContact CZ3-CD2 3.76Å; W75-F81 HydrophobicContact CZ3-CD2 3.76Å; W75-F81 AromaticContact CZ3-CG 3.99Å; W75-F81 HydrophobicContact CZ3-CG 3.99Å; W75-C167 HydrophobicContact CH2-CB 3.8Å; W75-C167 HydrophobicContact CZ3-CB 3.77Å
76	D	69.4	Low	74.2	Confident	52 Å²	52	82 Å²	82	28%	0.278	39%	0.386	S	S	.	.	H	α-helix	trans	-64.2	-34.6	-178	-63.7	-15.2	0	0	0	112.2	Q72 M73 Y79	Q72-D76 PolarHBondContact O-N 3.24Å; M73-D76 PolarHBondContact O-N 3Å; D76-Y79 WeakPolarHBondContact O-CE2 3.21Å
77	I	75.8	Confident	74.9	Confident	130 Å²	130	79.5 Å²	79.5	67%	0.667	38%	0.378	S	S	*	.	H	α-helix	trans	-76.6	-41.9	177	-68.6	165.7	0	0	0	112.2	M73 W75	M73-I77 WeakPolarHBondContact O-CB 3.3Å; M73-I77 WeakPolarHBondContact O-CD1 3.44Å; M73-I77 WeakPolarHBondContact O-CG1 3.29Å; M73-I77 PolarHBondContact O-N 3.05Å; W75-I77 VanDerWaalsContact C-N 3.32Å; W75-I77 PolarHBondContact O-N 3.23Å
78	T	73.3	Confident	75.6	Confident	57 Å²	57	74.4 Å²	74.4	35%	0.35	36%	0.355	S	S	.	.	H	α-helix	trans	-98.3	-7.9	-169.4	67.9	0	0	0	0	114.3	C74 W75 R80 R82	C74-T78 VanDerWaalsContact O-CB 3.3Å; C74-T78 WeakPolarHBondContact O-CB 3.12Å; C74-T78 WeakPolarHBondContact O-CG2 3.4Å; C74-T78 PolarHBondContact O-N 3.35Å; C74-T78 PolarHBondContact O-OG1 3.43Å; W75-T78 PolarHBondContact O-N 3Å; T78-R80 PolarHBondContact O-N 3.38Å; T78-R80 PolarHBondContact OG1-O 3.22Å; T78-R80 VanDerWaalsContact OG1-O 3.07Å; T78-R82 PolarHBondContact O-NH1 3.19Å
79	Y	68.9	Low	76.4	Confident	191 Å²	191	77 Å²	77	75%	0.749	36%	0.364	S	S	*	.	S	Bend	trans	52.3	9.4	-177.6	-63.3	-90.8	0	0	0	115.4	W75 D76	W75-Y79 WeakPolarHBondContact O-CA 3.43Å; W75-Y79 PolarHBondContact O-N 3.35Å; D76-Y79 WeakPolarHBondContact O-CE2 3.21Å
80	R	71.3	Confident	77	Confident	117 Å²	117	77.4 Å²	77.4	44%	0.442	37%	0.367	S	S	.	.	S	Bend	trans	-156.2	141.5	-174.8	-77	-167.8	168.5	147.7	1.8	112.9	T78 R82 D166	T78-R80 PolarHBondContact O-N 3.38Å; T78-R80 PolarHBondContact OG1-O 3.22Å; T78-R80 VanDerWaalsContact OG1-O 3.07Å; R80-R82 PolarHBondContact O-N 2.9Å; R80-D166 WeakPolarHBondContact CA-OD1 3.36Å
81	F	75.8	Confident	77.4	Confident	32 Å²	32	75 Å²	75	14%	0.14	36%	0.355	C	S	.	.			trans	-80.9	102.2	176.7	-167.1	-101.4	0	0	0	112.7	W75 G83 L87 C88 M155 D166 C167	W75-F81 HydrophobicContact CE3-CB 4.19Å; W75-F81 AromaticContact CE3-CD2 3.98Å; W75-F81 HydrophobicContact CE3-CD2 3.98Å; W75-F81 HydrophobicContact CH2-CB 4.01Å; W75-F81 HydrophobicContact CZ3-CB 3.58Å; W75-F81 AromaticContact CZ3-CD2 3.76Å; W75-F81 HydrophobicContact CZ3-CD2 3.76Å; W75-F81 AromaticContact CZ3-CG 3.99Å; W75-F81 HydrophobicContact CZ3-CG 3.99Å; F81-G83 PolarHBondContact O-N 2.98Å; F81-G83 VanDerWaalsContact O-N 3.11Å; F81-L87 HydrophobicContact CZ-CB 4.42Å; F81-L87 HydrophobicContact CZ-CD2 4.37Å; F81-L87 HydrophobicContact CZ-CG 4.11Å; F81-C88 HydrophobicContact CD1-CB 4.15Å; F81-C88 HydrophobicContact CE1-CB 3.67Å; F81-C88 HydrophobicContact CZ-CB 4.13Å; F81-M155 HydrophobicContact CB-SD 4.36Å; F81-M155 HydrophobicContact CD1-CE 3.98Å; F81-M155 HydrophobicContact CD1-SD 3.51Å; F81-M155 VanDerWaalsContact CD1-SD 3.51Å; F81-M155 HydrophobicContact CE1-SD 4.23Å; F81-M155 HydrophobicContact CG-SD 4.29Å; F81-D166 PolarHBondContact N-OD1 2.87Å; F81-C167 HydrophobicContact CB-CB 4.19Å; F81-C167 HydrophobicContact CD1-CB 4.29Å; F81-C167 HydrophobicContact CG-CB 4.11Å
82	R	70.7	Confident	77.9	Confident	192 Å²	192	75.2 Å²	75.2	73%	0.725	35%	0.354	S	S	*	.			trans	-84	77.9	173.6	-71	175.6	172.3	81.7	-8	111.1	T78 R80	T78-R82 PolarHBondContact O-NH1 3.19Å; R80-R82 PolarHBondContact O-N 2.9Å
83	G	77.1	Confident	78.7	Confident	23 Å²	23	72.7 Å²	72.7	24%	0.237	34%	0.342	C	S	.	.	S	Bend	trans	-166.8	165.7	176.3	0	0	0	0	0	114.9	F81	F81-G83 PolarHBondContact O-N 2.98Å; F81-G83 VanDerWaalsContact O-N 3.11Å
84	P	82.8	Confident	79.2	Confident	61 Å²	61	71.9 Å²	71.9	40%	0.396	34%	0.339	S	S	.	.			trans	-74.5	164.7	174.5	31.6	-36	0	0	0	112.7	W86 L87 C88	P84-W86 HydrophobicContact CG-CD2 4.26Å; P84-W86 HydrophobicContact CG-CG 4.4Å; P84-W86 HydrophobicContact CG-CZ2 3.95Å; P84-W86 VanDerWaalsContact CG-NE1 3.29Å; P84-W86 PolarHBondContact O-N 2.86Å; P84-L87 HydrophobicContact CG-CB 3.85Å; P84-L87 WeakPolarHBondContact O-CB 3.34Å; P84-L87 PolarHBondContact O-N 3.37Å; P84-C88 PolarHBondContact O-N 3.45Å; P84-C88 VanDerWaalsContact O-N 3.15Å
85	D	83.9	Confident	79.7	Confident	57 Å²	57	69.3 Å²	69.3	31%	0.305	32%	0.32	S	S	.	.	H	α-helix	trans	-53.8	-46.1	-177.6	-178.4	68.7	0	0	0	114	L87 C88 R89 S154 M155	D85-L87 PolarHBondContact O-N 3.48Å; D85-C88 WeakPolarHBondContact O-CB 3.19Å; D85-C88 PolarHBondContact O-N 3.07Å; D85-R89 PolarHBondContact O-N 3.47Å; D85-R89 VanDerWaalsContact O-N 3.09Å; D85-R89 IonicContact OD1-CZ 3.28Å; D85-R89 IonicContact OD1-NE 3.23Å; D85-R89 IonicContact OD1-NH2 2.87Å; D85-R89 PolarHBondContact OD1-NH2 2.92Å; D85-R89 IonicContact OD2-CZ 2.67Å; D85-R89 VanDerWaalsContact OD2-CZ 3.28Å; D85-R89 IonicContact OD2-NE 2.8Å; D85-R89 PolarHBondContact OD2-NE 3.43Å; D85-R89 IonicContact OD2-NH2 3.78Å; D85-R89 PolarHBondContact OD2-NH2 3.24Å; D85-S154 WeakPolarHBondContact OD1-CA 3.45Å; D85-M155 HydrophobicContact CB-CB 4.11Å; D85-M155 HydrophobicContact CB-CG 4.18Å; D85-M155 PolarHBondContact OD1-N 3.35Å
86	W	84.9	Confident	80.4	Confident	170 Å²	170	66.4 Å²	66.4	64%	0.644	31%	0.309	S	S	*	.	H	α-helix	trans	-61.2	-33.8	178	67.5	-100.1	0	0	0	112.5	P84 R89 V90	P84-W86 HydrophobicContact CG-CD2 4.26Å; P84-W86 HydrophobicContact CG-CG 4.4Å; P84-W86 HydrophobicContact CG-CZ2 3.95Å; P84-W86 VanDerWaalsContact CG-NE1 3.29Å; P84-W86 PolarHBondContact O-N 2.86Å; W86-R89 PolarHBondContact O-N 3.19Å; W86-V90 WeakPolarHBondContact O-CB 3.07Å; W86-V90 VanDerWaalsContact O-CG2 3.26Å; W86-V90 WeakPolarHBondContact O-CG2 3.16Å; W86-V90 PolarHBondContact O-N 3.01Å
87	L	84.6	Confident	81.3	Confident	57 Å²	57	65.3 Å²	65.3	30%	0.298	30%	0.302	S	S	.	.	H	α-helix	trans	-73	-39.6	179.5	-172.9	65.6	0	0	0	110.9	F81 P84 D85 V90 V91	F81-L87 HydrophobicContact CZ-CB 4.42Å; F81-L87 HydrophobicContact CZ-CD2 4.37Å; F81-L87 HydrophobicContact CZ-CG 4.11Å; P84-L87 HydrophobicContact CG-CB 3.85Å; P84-L87 WeakPolarHBondContact O-CB 3.34Å; P84-L87 PolarHBondContact O-N 3.37Å; D85-L87 PolarHBondContact O-N 3.48Å; L87-V90 PolarHBondContact O-N 2.89Å; L87-V91 HydrophobicContact CD1-CG2 4.34Å; L87-V91 HydrophobicContact CG-CG2 4.39Å; L87-V91 VanDerWaalsContact O-CB 3.31Å; L87-V91 WeakPolarHBondContact O-CB 3.24Å; L87-V91 VanDerWaalsContact O-CG2 3.23Å; L87-V91 WeakPolarHBondContact O-CG2 3.37Å; L87-V91 PolarHBondContact O-N 3.33Å
88	C	85.3	Confident	81.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-54.4	-51.6	170.6	153.7	0	0	0	0	111.1	F81 P84 D85 V91 K92 M155 C167	F81-C88 HydrophobicContact CD1-CB 4.15Å; F81-C88 HydrophobicContact CE1-CB 3.67Å; F81-C88 HydrophobicContact CZ-CB 4.13Å; P84-C88 PolarHBondContact O-N 3.45Å; P84-C88 VanDerWaalsContact O-N 3.15Å; D85-C88 WeakPolarHBondContact O-CB 3.19Å; D85-C88 PolarHBondContact O-N 3.07Å; C88-V91 PolarHBondContact O-N 3.46Å; C88-K92 WeakPolarHBondContact O-CG 3.24Å; C88-K92 PolarHBondContact O-N 3.28Å; C88-M155 HydrophobicContact CB-CG 3.71Å; C88-M155 HydrophobicContact CB-SD 3.83Å; C88-C167 HydrophobicContact CB-CB 3.7Å; C88-C167 WeakPolarHBondContact CB-SG 3.43Å; C88-C167 WeakPolarHBondContact SG-CB 3.39Å; C88-C167 CovalentContact SG-SG 2.03Å; C88-C167 PolarHBondContact SG-SG 2.9Å
89	R	88.1	Confident	82.1	Confident	65 Å²	65	57.7 Å²	57.7	25%	0.245	26%	0.261	C	S	.	.	H	α-helix	trans	-62	-47.3	179.4	-65	-178	-159.5	-98.3	-4.8	112.7	D85 W86 K92 H93 Y150 F153	D85-R89 PolarHBondContact O-N 3.47Å; D85-R89 VanDerWaalsContact O-N 3.09Å; D85-R89 IonicContact OD1-CZ 3.28Å; D85-R89 IonicContact OD1-NE 3.23Å; D85-R89 IonicContact OD1-NH2 2.87Å; D85-R89 PolarHBondContact OD1-NH2 2.92Å; D85-R89 IonicContact OD2-CZ 2.67Å; D85-R89 VanDerWaalsContact OD2-CZ 3.28Å; D85-R89 IonicContact OD2-NE 2.8Å; D85-R89 PolarHBondContact OD2-NE 3.43Å; D85-R89 IonicContact OD2-NH2 3.78Å; D85-R89 PolarHBondContact OD2-NH2 3.24Å; W86-R89 PolarHBondContact O-N 3.19Å; R89-K92 PolarHBondContact O-N 3.03Å; R89-H93 VanDerWaalsContact O-CB 3.31Å; R89-H93 WeakPolarHBondContact O-CB 3.49Å; R89-H93 PolarHBondContact O-N 3.38Å; R89-Y150 HydrophobicContact CB-CD1 3.94Å; R89-Y150 HydrophobicContact CB-CE1 4.23Å; R89-Y150 PolarHBondContact NH1-O 3.35Å; R89-F153 WeakPolarHBondContact CG-O 3.41Å; R89-F153 PolarHBondContact NH1-O 3.45Å; R89-F153 VanDerWaalsContact NH1-O 3.08Å
90	V	86	Confident	83.1	Confident	47 Å²	47	48.6 Å²	48.6	29%	0.285	23%	0.225	S	C	.	.	H	α-helix	trans	-63.2	-43.9	179.6	168.8	0	0	0	0	111.1	W86 L87 H93 L94 Y150	W86-V90 WeakPolarHBondContact O-CB 3.07Å; W86-V90 VanDerWaalsContact O-CG2 3.26Å; W86-V90 WeakPolarHBondContact O-CG2 3.16Å; W86-V90 PolarHBondContact O-N 3.01Å; L87-V90 PolarHBondContact O-N 2.89Å; V90-H93 PolarHBondContact O-N 3.49Å; V90-L94 HydrophobicContact CG1-CD1 3.77Å; V90-L94 HydrophobicContact CG1-CG 4.29Å; V90-L94 WeakPolarHBondContact O-CB 3.07Å; V90-L94 VanDerWaalsContact O-CG 3.27Å; V90-L94 WeakPolarHBondContact O-CG 3.01Å; V90-L94 PolarHBondContact O-N 3.31Å; V90-Y150 HydrophobicContact CG2-CE1 4.37Å
91	V	83.9	Confident	83.8	Confident	25 Å²	25	43.3 Å²	43.3	15%	0.152	21%	0.207	C	C	.	.	H	α-helix	trans	-60.9	-49	176.2	166.6	0	0	0	0	111.2	P71 L87 C88 H93 L94 Q95	P71-V91 HydrophobicContact CB-CG1 3.53Å; P71-V91 HydrophobicContact CG-CG1 3.89Å; L87-V91 HydrophobicContact CD1-CG2 4.34Å; L87-V91 HydrophobicContact CG-CG2 4.39Å; L87-V91 VanDerWaalsContact O-CB 3.31Å; L87-V91 WeakPolarHBondContact O-CB 3.24Å; L87-V91 VanDerWaalsContact O-CG2 3.23Å; L87-V91 WeakPolarHBondContact O-CG2 3.37Å; L87-V91 PolarHBondContact O-N 3.33Å; C88-V91 PolarHBondContact O-N 3.46Å; V91-H93 PolarHBondContact O-N 2.84Å; V91-L94 PolarHBondContact O-N 2.99Å; V91-Q95 WeakPolarHBondContact O-CB 3.36Å; V91-Q95 WeakPolarHBondContact O-CG 3.42Å; V91-Q95 PolarHBondContact O-N 2.84Å
92	K	85.4	Confident	84.2	Confident	35 Å²	35	42.6 Å²	42.6	15%	0.152	21%	0.206	C	C	.	.	H	α-helix	trans	-64.4	-39.7	179	-67.7	-68	174.3	-163.5	0	112.4	C88 R89 V96 F153	C88-K92 WeakPolarHBondContact O-CG 3.24Å; C88-K92 PolarHBondContact O-N 3.28Å; R89-K92 PolarHBondContact O-N 3.03Å; K92-V96 PolarHBondContact O-N 3.4Å; K92-F153 HydrophobicContact CB-CB 4.24Å; K92-F153 HydrophobicContact CB-CD1 4.46Å; K92-F153 HydrophobicContact CB-CD2 4.15Å; K92-F153 HydrophobicContact CB-CG 4.01Å; K92-F153 HydrophobicContact CD-CD1 3.98Å; K92-F153 HydrophobicContact CD-CE1 3.95Å; K92-F153 HydrophobicContact CD-CG 4.38Å; K92-F153 HydrophobicContact CD-CZ 4.34Å; K92-F153 HydrophobicContact CG-CB 4.15Å; K92-F153 HydrophobicContact CG-CD1 3.78Å; K92-F153 HydrophobicContact CG-CD2 4.35Å; K92-F153 HydrophobicContact CG-CE1 4.27Å; K92-F153 HydrophobicContact CG-CG 3.82Å
93	H	87.8	Confident	85	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.019	17%	0.172	C	C	.	.	H	α-helix	trans	-62.7	-47.3	173.5	177.2	76.9	0	0	0	112.3	R89 V90 V91 V96 F97 F143 S146 Q149 Y150	R89-H93 VanDerWaalsContact O-CB 3.31Å; R89-H93 WeakPolarHBondContact O-CB 3.49Å; R89-H93 PolarHBondContact O-N 3.38Å; V90-H93 PolarHBondContact O-N 3.49Å; V91-H93 PolarHBondContact O-N 2.84Å; H93-V96 PolarHBondContact O-N 2.9Å; H93-F97 WeakPolarHBondContact O-CB 3.49Å; H93-F97 PolarHBondContact O-N 2.89Å; H93-F143 AromaticContact CE1-CD2 3.98Å; H93-F143 AromaticContact CE1-CE2 3.85Å; H93-F143 AromaticContact NE2-CD2 3.58Å; H93-F143 AromaticContact NE2-CE2 3.32Å; H93-F143 VanDerWaalsContact NE2-CE2 3.32Å; H93-F143 WeakPolarHBondContact NE2-CE2 3.47Å; H93-S146 PolarHBondContact CE1-OG 2.73Å; H93-S146 PolarHBondContact ND1-O 3.33Å; H93-S146 PolarHBondContact ND1-OG 2.97Å; H93-Q149 HydrophobicContact CB-CB 4.14Å; H93-Y150 HydrophobicContact CB-CD2 4.24Å; H93-Y150 HydrophobicContact CB-CE1 4.42Å; H93-Y150 HydrophobicContact CB-CE2 3.77Å; H93-Y150 AromaticContact CD2-CE2 3.59Å; H93-Y150 AromaticContact CD2-CZ 3.86Å; H93-Y150 PolarHBondContact CD2-OH 2.86Å; H93-Y150 AromaticContact CE1-CE2 3.63Å; H93-Y150 AromaticContact CG-CD2 3.94Å; H93-Y150 AromaticContact CG-CE2 3.26Å; H93-Y150 AromaticContact CG-CZ 3.7Å; H93-Y150 AromaticContact ND1-CD2 3.69Å; H93-Y150 AromaticContact ND1-CE2 3.32Å; H93-Y150 VanDerWaalsContact ND1-CE2 3.32Å; H93-Y150 WeakPolarHBondContact ND1-CE2 3.41Å; H93-Y150 AromaticContact NE2-CE2 3.81Å
94	L	83.9	Confident	85.6	Confident	56 Å²	56	33.5 Å²	33.5	29%	0.293	17%	0.165	S	C	.	.	H	α-helix	trans	-64.3	-39.9	178.8	-72.2	173.9	0	0	0	112.5	V90 V91 V96 F97 G98	V90-L94 HydrophobicContact CG1-CD1 3.77Å; V90-L94 HydrophobicContact CG1-CG 4.29Å; V90-L94 WeakPolarHBondContact O-CB 3.07Å; V90-L94 VanDerWaalsContact O-CG 3.27Å; V90-L94 WeakPolarHBondContact O-CG 3.01Å; V90-L94 PolarHBondContact O-N 3.31Å; V91-L94 PolarHBondContact O-N 2.99Å; L94-V96 PolarHBondContact O-N 3.48Å; L94-F97 HydrophobicContact CD2-CD1 4.41Å; L94-G98 PolarHBondContact O-N 2.87Å
95	Q	83.4	Confident	85.6	Confident	16 Å²	16	31.3 Å²	31.3	8%	0.075	15%	0.149	C	C	.	.	H	α-helix	trans	-55.5	-49.7	173.2	-78.9	-172.6	-43.4	0	0	111.3	Q68 V91 G98 M99	Q68-Q95 PolarHBondContact O-NE2 3.16Å; Q68-Q95 VanDerWaalsContact O-NE2 3.09Å; V91-Q95 WeakPolarHBondContact O-CB 3.36Å; V91-Q95 WeakPolarHBondContact O-CG 3.42Å; V91-Q95 PolarHBondContact O-N 2.84Å; Q95-G98 PolarHBondContact O-N 3.23Å; Q95-M99 PolarHBondContact O-N 3.46Å
96	V	86.1	Confident	85.6	Confident	7 Å²	7	29.1 Å²	29.1	4%	0.042	14%	0.137	C	C	.	.	H	α-helix	trans	-76.3	-38.4	-177.5	172.8	0	0	0	0	113.1	K92 H93 L94 G98 M99 F100 Q149 M184	K92-V96 PolarHBondContact O-N 3.4Å; H93-V96 PolarHBondContact O-N 2.9Å; L94-V96 PolarHBondContact O-N 3.48Å; V96-G98 PolarHBondContact O-N 3.26Å; V96-M99 HydrophobicContact CB-CE 4.14Å; V96-M99 HydrophobicContact CG2-CE 3.64Å; V96-M99 PolarHBondContact O-N 2.97Å; V96-F100 HydrophobicContact CG1-CD2 3.66Å; V96-F100 HydrophobicContact CG1-CE2 3.52Å; V96-F100 WeakPolarHBondContact O-CD2 3.43Å; V96-F100 PolarHBondContact O-N 2.81Å; V96-Q149 HydrophobicContact CB-CG 3.74Å; V96-Q149 HydrophobicContact CG1-CG 4Å; V96-Q149 VanDerWaalsContact CG2-CD 3.41Å; V96-Q149 HydrophobicContact CG2-CG 3.86Å; V96-M184 HydrophobicContact CB-CE 4.29Å; V96-M184 HydrophobicContact CG1-CE 3.67Å; V96-M184 HydrophobicContact CG1-SD 3.75Å; V96-M184 HydrophobicContact CG2-CE 3.72Å
97	F	87.6	Confident	85.9	Confident	29 Å²	29	21.8 Å²	21.8	13%	0.127	11%	0.112	C	C	.	.	H	α-helix	trans	-54.7	-42.8	171	171.7	-114.3	0	0	0	111.2	H93 L94 F100 A101 W139 F143	H93-F97 WeakPolarHBondContact O-CB 3.49Å; H93-F97 PolarHBondContact O-N 2.89Å; L94-F97 HydrophobicContact CD2-CD1 4.41Å; F97-F100 PolarHBondContact O-N 3.48Å; F97-A101 WeakPolarHBondContact O-CB 2.88Å; F97-A101 PolarHBondContact O-N 3.29Å; F97-W139 HydrophobicContact CE1-CE3 4.22Å; F97-W139 AromaticContact CE1-CZ3 3.81Å; F97-W139 HydrophobicContact CE1-CZ3 3.81Å; F97-W139 HydrophobicContact CE2-CE3 4.03Å; F97-W139 HydrophobicContact CE2-CZ3 4.37Å; F97-W139 AromaticContact CZ-CE3 3.44Å; F97-W139 HydrophobicContact CZ-CE3 3.44Å; F97-W139 VanDerWaalsContact CZ-CE3 3.44Å; F97-W139 AromaticContact CZ-CZ3 3.51Å; F97-W139 HydrophobicContact CZ-CZ3 3.51Å; F97-F143 HydrophobicContact CD2-CB 4.22Å; F97-F143 HydrophobicContact CD2-CD2 4.46Å; F97-F143 HydrophobicContact CE2-CB 3.91Å; F97-F143 HydrophobicContact CE2-CD2 4.37Å
98	G	82.1	Confident	85.9	Confident	3 Å²	3	20 Å²	20	3%	0.031	10%	0.103	C	C	.	.	H	α-helix	trans	-63.3	-41.4	176	0	0	0	0	0	114	L94 Q95 V96 A101 S102	L94-G98 PolarHBondContact O-N 2.87Å; Q95-G98 PolarHBondContact O-N 3.23Å; V96-G98 PolarHBondContact O-N 3.26Å; G98-A101 PolarHBondContact O-N 3.05Å; G98-S102 WeakPolarHBondContact O-CB 3.27Å; G98-S102 PolarHBondContact O-N 2.78Å; G98-S102 PolarHBondContact O-OG 3.32Å
99	M	85.4	Confident	85.7	Confident	24 Å²	24	23 Å²	23	12%	0.118	12%	0.118	C	C	.	.	H	α-helix	trans	-60.6	-50.4	174.8	-66.2	-171.5	-74.8	0	0	111.5	Q95 V96 S102 A103 M184 I188 W268	Q95-M99 PolarHBondContact O-N 3.46Å; V96-M99 HydrophobicContact CB-CE 4.14Å; V96-M99 HydrophobicContact CG2-CE 3.64Å; V96-M99 PolarHBondContact O-N 2.97Å; M99-S102 PolarHBondContact O-N 3.01Å; M99-S102 PolarHBondContact O-OG 3.2Å; M99-A103 PolarHBondContact O-N 3.37Å; M99-M184 HydrophobicContact CE-CE 3.75Å; M99-I188 HydrophobicContact CB-CD1 3.9Å; M99-I188 HydrophobicContact CB-CG2 4.41Å; M99-I188 HydrophobicContact CE-CD1 4.29Å; M99-I188 HydrophobicContact SD-CD1 4.41Å; M99-W268 HydrophobicContact CB-CH2 4.36Å; M99-W268 HydrophobicContact CG-CH2 3.65Å; M99-W268 HydrophobicContact CG-CZ2 4.18Å; M99-W268 HydrophobicContact SD-CH2 3.41Å; M99-W268 WeakPolarHBondContact SD-CH2 3.14Å; M99-W268 HydrophobicContact SD-CZ2 4.46Å; M99-W268 HydrophobicContact SD-CZ3 3.83Å
100	F	88.9	Confident	85.5	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61	-48.2	176.1	-78.8	-64.1	0	0	0	112.5	V96 F97 S102 A103 Y104 L145 M184 I188	V96-F100 HydrophobicContact CG1-CD2 3.66Å; V96-F100 HydrophobicContact CG1-CE2 3.52Å; V96-F100 WeakPolarHBondContact O-CD2 3.43Å; V96-F100 PolarHBondContact O-N 2.81Å; F97-F100 PolarHBondContact O-N 3.48Å; F100-S102 VanDerWaalsContact C-N 3.32Å; F100-S102 PolarHBondContact O-N 3.32Å; F100-A103 PolarHBondContact O-N 3.45Å; F100-Y104 HydrophobicContact CB-CD2 4.3Å; F100-Y104 HydrophobicContact CB-CE2 4.43Å; F100-Y104 HydrophobicContact CD1-CD2 4.39Å; F100-Y104 AromaticContact CD1-CE2 3.73Å; F100-Y104 HydrophobicContact CD1-CE2 3.73Å; F100-Y104 HydrophobicContact CE1-CE2 4.49Å; F100-Y104 VanDerWaalsContact O-CD2 3.26Å; F100-Y104 WeakPolarHBondContact O-CD2 3.27Å; F100-Y104 PolarHBondContact O-N 3.03Å; F100-L145 HydrophobicContact CD1-CB 4.15Å; F100-L145 HydrophobicContact CD1-CD1 4.14Å; F100-L145 HydrophobicContact CD2-CB 4.13Å; F100-L145 HydrophobicContact CE1-CB 3.9Å; F100-L145 HydrophobicContact CE1-CD1 4.08Å; F100-L145 HydrophobicContact CE2-CB 3.92Å; F100-L145 WeakPolarHBondContact CE2-O 3.44Å; F100-L145 HydrophobicContact CG-CB 4.25Å; F100-L145 HydrophobicContact CZ-CB 3.79Å; F100-M184 HydrophobicContact CE2-SD 4.12Å; F100-M184 HydrophobicContact CZ-SD 4.26Å; F100-I188 HydrophobicContact CD1-CG1 3.57Å; F100-I188 HydrophobicContact CD2-CG1 4.36Å; F100-I188 HydrophobicContact CE1-CB 4.49Å; F100-I188 HydrophobicContact CE1-CD1 4.39Å; F100-I188 HydrophobicContact CE1-CG1 3.44Å; F100-I188 VanDerWaalsContact CE1-CG1 3.44Å; F100-I188 HydrophobicContact CE2-CD1 4.37Å; F100-I188 HydrophobicContact CE2-CG1 4.22Å; F100-I188 HydrophobicContact CG-CG1 4.06Å; F100-I188 HydrophobicContact CZ-CD1 4.27Å; F100-I188 HydrophobicContact CZ-CG1 3.78Å
101	A	86.3	Confident	85.4	Confident	7 Å²	7	18.7 Å²	18.7	6%	0.058	10%	0.101	C	C	.	.	H	α-helix	trans	-58.4	-44.1	179.6	0	0	0	0	0	111.2	F97 G98 A103 M105 W139 S142	F97-A101 WeakPolarHBondContact O-CB 2.88Å; F97-A101 PolarHBondContact O-N 3.29Å; G98-A101 PolarHBondContact O-N 3.05Å; A101-A103 PolarHBondContact O-N 2.72Å; A101-M105 WeakPolarHBondContact O-CB 2.95Å; A101-M105 WeakPolarHBondContact O-CG 3.31Å; A101-M105 PolarHBondContact O-N 3.01Å; A101-W139 HydrophobicContact CB-CE3 4.15Å; A101-W139 HydrophobicContact CB-CH2 4.37Å; A101-W139 HydrophobicContact CB-CZ3 3.78Å; A101-S142 WeakPolarHBondContact CA-OG 3.25Å; A101-S142 PolarHBondContact N-OG 3.36Å
102	S	83.6	Confident	85.3	Confident	17 Å²	17	19.4 Å²	19.4	12%	0.119	10%	0.103	C	C	.	.	H	α-helix	trans	-59.8	-43.2	177.6	77.4	0	0	0	0	112.5	G98 M99 F100 L106	G98-S102 WeakPolarHBondContact O-CB 3.27Å; G98-S102 PolarHBondContact O-N 2.78Å; G98-S102 PolarHBondContact O-OG 3.32Å; M99-S102 PolarHBondContact O-N 3.01Å; M99-S102 PolarHBondContact O-OG 3.2Å; F100-S102 VanDerWaalsContact C-N 3.32Å; F100-S102 PolarHBondContact O-N 3.32Å; S102-L106 WeakPolarHBondContact O-CB 3.37Å; S102-L106 PolarHBondContact O-N 3.47Å
103	A	88.1	Confident	84.9	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.008	11%	0.112	C	C	.	.	H	α-helix	trans	-72.9	-44.3	-178.1	0	0	0	0	0	112.2	M99 F100 A101 L106 V107 P192 Y264	M99-A103 PolarHBondContact O-N 3.37Å; F100-A103 PolarHBondContact O-N 3.45Å; A101-A103 PolarHBondContact O-N 2.72Å; A103-L106 WeakPolarHBondContact O-CB 3.17Å; A103-L106 PolarHBondContact O-N 3.48Å; A103-V107 PolarHBondContact O-N 3.5Å; A103-P192 HydrophobicContact CB-CB 4.33Å; A103-P192 HydrophobicContact CB-CG 3.93Å; A103-Y264 HydrophobicContact CB-CE2 4.03Å
104	Y	89.6	Confident	84.5	Confident	23 Å²	23	24.3 Å²	24.3	9%	0.09	12%	0.121	C	C	.	.	H	α-helix	trans	-73	-29.9	178	-72.3	-63.7	0	0	0	113.3	F100 L106 V107 V108 L141 L145 G187 P192	F100-Y104 HydrophobicContact CB-CD2 4.3Å; F100-Y104 HydrophobicContact CB-CE2 4.43Å; F100-Y104 HydrophobicContact CD1-CD2 4.39Å; F100-Y104 AromaticContact CD1-CE2 3.73Å; F100-Y104 HydrophobicContact CD1-CE2 3.73Å; F100-Y104 HydrophobicContact CE1-CE2 4.49Å; F100-Y104 VanDerWaalsContact O-CD2 3.26Å; F100-Y104 WeakPolarHBondContact O-CD2 3.27Å; F100-Y104 PolarHBondContact O-N 3.03Å; Y104-L106 VanDerWaalsContact C-N 3.35Å; Y104-V107 WeakPolarHBondContact O-CB 3.35Å; Y104-V107 PolarHBondContact O-N 3.14Å; Y104-V108 WeakPolarHBondContact O-CG2 3.45Å; Y104-V108 PolarHBondContact O-N 2.94Å; Y104-L141 HydrophobicContact CD1-CD2 4.03Å; Y104-L141 HydrophobicContact CD2-CD2 4.49Å; Y104-L141 HydrophobicContact CE1-CD2 3.81Å; Y104-L141 HydrophobicContact CE2-CD2 4.29Å; Y104-L141 HydrophobicContact CE2-CG 4.37Å; Y104-L141 HydrophobicContact CG-CD2 4.38Å; Y104-L145 HydrophobicContact CD2-CD1 4.49Å; Y104-L145 HydrophobicContact CE2-CD1 3.4Å; Y104-L145 VanDerWaalsContact CE2-CD1 3.4Å; Y104-L145 VanDerWaalsContact OH-CD1 3.29Å; Y104-L145 WeakPolarHBondContact OH-CD1 3.29Å; Y104-G187 PolarHBondContact OH-O 2.9Å; Y104-P192 HydrophobicContact CE1-CG 4.44Å
105	M	83.6	Confident	84.2	Confident	14 Å²	14	22.2 Å²	22.2	7%	0.069	11%	0.11	C	C	.	.	H	α-helix	trans	-65.7	-38.5	170.8	-74.7	-60.8	-56	0	0	111.6	V57 A101 V108 M109 I135 A138	V57-M105 HydrophobicContact CG1-CE 3.68Å; A101-M105 WeakPolarHBondContact O-CB 2.95Å; A101-M105 WeakPolarHBondContact O-CG 3.31Å; A101-M105 PolarHBondContact O-N 3.01Å; M105-V108 PolarHBondContact O-N 3.45Å; M105-M109 HydrophobicContact CE-CE 4.47Å; M105-M109 WeakPolarHBondContact O-CB 3.39Å; M105-M109 VanDerWaalsContact O-CG 3.24Å; M105-M109 WeakPolarHBondContact O-CG 3.44Å; M105-M109 PolarHBondContact O-N 2.88Å; M105-I135 HydrophobicContact CE-CG1 4.21Å; M105-I135 HydrophobicContact CE-CG2 4.35Å; M105-I135 HydrophobicContact SD-CG2 4.19Å; M105-A138 HydrophobicContact SD-CB 4.42Å
106	L	83.6	Confident	83.7	Confident	11 Å²	11	22.9 Å²	22.9	6%	0.058	12%	0.118	C	C	.	.	H	α-helix	trans	-62.4	-43	172.4	-166.6	170.8	0	0	0	110.8	S102 A103 Y104 M109 T110 L196 I260 V261 Y264	S102-L106 WeakPolarHBondContact O-CB 3.37Å; S102-L106 PolarHBondContact O-N 3.47Å; A103-L106 WeakPolarHBondContact O-CB 3.17Å; A103-L106 PolarHBondContact O-N 3.48Å; Y104-L106 VanDerWaalsContact C-N 3.35Å; L106-M109 PolarHBondContact O-N 2.9Å; L106-T110 HydrophobicContact CD2-CG2 4.13Å; L106-T110 WeakPolarHBondContact O-CG2 3.21Å; L106-T110 PolarHBondContact O-N 3.01Å; L106-T110 PolarHBondContact O-OG1 3.22Å; L106-L196 HydrophobicContact CD2-CD1 3.57Å; L106-L196 HydrophobicContact CD2-CD2 3.39Å; L106-L196 HydrophobicContact CD2-CG 4.11Å; L106-I260 HydrophobicContact CD1-CG2 3.83Å; L106-I260 HydrophobicContact CG-CG2 4.02Å; L106-V261 HydrophobicContact CD2-CG2 3.73Å; L106-Y264 HydrophobicContact CD1-CD2 3.78Å; L106-Y264 HydrophobicContact CD1-CG 3.75Å
107	V	90.2	Very high	83	Confident	17 Å²	17	23.9 Å²	23.9	10%	0.103	13%	0.125	C	C	.	.	H	α-helix	trans	-58.4	-46.8	170.8	170.3	0	0	0	0	112	A103 Y104 M109 T110 A111 P192 I195 L196	A103-V107 PolarHBondContact O-N 3.5Å; Y104-V107 WeakPolarHBondContact O-CB 3.35Å; Y104-V107 PolarHBondContact O-N 3.14Å; V107-M109 PolarHBondContact O-N 3.25Å; V107-T110 PolarHBondContact O-N 2.89Å; V107-T110 PolarHBondContact O-OG1 3.25Å; V107-A111 VanDerWaalsContact O-CB 3.29Å; V107-A111 WeakPolarHBondContact O-CB 3.42Å; V107-A111 PolarHBondContact O-N 3.37Å; V107-P192 HydrophobicContact CG2-CB 3.9Å; V107-P192 HydrophobicContact CG2-CG 4.44Å; V107-I195 HydrophobicContact CG1-CB 4.36Å; V107-I195 HydrophobicContact CG1-CD1 4.45Å; V107-I195 HydrophobicContact CG1-CG2 3.58Å; V107-I195 HydrophobicContact CG2-CB 4.46Å; V107-I195 HydrophobicContact CG2-CG2 4.46Å; V107-L196 HydrophobicContact CG2-CD2 4.11Å; V107-L196 HydrophobicContact CG2-CG 4.17Å
108	V	86.1	Confident	82.1	Confident	18 Å²	18	23.6 Å²	23.6	11%	0.109	13%	0.126	C	C	.	.	H	α-helix	trans	-62.4	-43	177.8	166.4	0	0	0	0	111.9	Y104 M105 A111 D112 M134 I135 A138	Y104-V108 WeakPolarHBondContact O-CG2 3.45Å; Y104-V108 PolarHBondContact O-N 2.94Å; M105-V108 PolarHBondContact O-N 3.45Å; V108-A111 PolarHBondContact O-N 3.4Å; V108-D112 WeakPolarHBondContact O-CB 3.28Å; V108-D112 PolarHBondContact O-N 3.37Å; V108-M134 HydrophobicContact CG1-CB 4Å; V108-M134 HydrophobicContact CG1-CE 4.45Å; V108-M134 HydrophobicContact CG2-CB 4.37Å; V108-I135 HydrophobicContact CG1-CG1 3.99Å; V108-A138 HydrophobicContact CG2-CB 3.67Å
109	M	80.9	Confident	81.5	Confident	64 Å²	64	27.6 Å²	27.6	32%	0.315	14%	0.143	S	C	.	.	H	α-helix	trans	-60.2	-47.1	176.8	-73	169.3	176.6	0	0	111.5	M105 L106 V107 D112 R113 Y312	M105-M109 HydrophobicContact CE-CE 4.47Å; M105-M109 WeakPolarHBondContact O-CB 3.39Å; M105-M109 VanDerWaalsContact O-CG 3.24Å; M105-M109 WeakPolarHBondContact O-CG 3.44Å; M105-M109 PolarHBondContact O-N 2.88Å; L106-M109 PolarHBondContact O-N 2.9Å; V107-M109 PolarHBondContact O-N 3.25Å; M109-D112 PolarHBondContact O-N 3.06Å; M109-R113 WeakPolarHBondContact O-CG 3.17Å; M109-R113 PolarHBondContact O-N 2.67Å; M109-Y312 PolarHBondContact SD-OH 2.88Å
110	T	82.6	Confident	80.6	Confident	3 Å²	3	29.8 Å²	29.8	2%	0.018	16%	0.159	C	C	.	.	H	α-helix	trans	-69.7	-36.6	178.8	59.5	0	0	0	0	112.9	L106 V107 R113 Y114 L196 Y200 V261	L106-T110 HydrophobicContact CD2-CG2 4.13Å; L106-T110 WeakPolarHBondContact O-CG2 3.21Å; L106-T110 PolarHBondContact O-N 3.01Å; L106-T110 PolarHBondContact O-OG1 3.22Å; V107-T110 PolarHBondContact O-N 2.89Å; V107-T110 PolarHBondContact O-OG1 3.25Å; T110-R113 PolarHBondContact O-N 2.97Å; T110-Y114 WeakPolarHBondContact O-CB 3.34Å; T110-Y114 PolarHBondContact O-N 3.2Å; T110-L196 HydrophobicContact CG2-CD2 3.68Å; T110-L196 WeakPolarHBondContact OG1-CD2 3.17Å; T110-Y200 HydrophobicContact CG2-CE2 3.98Å; T110-Y200 WeakPolarHBondContact CG2-OH 3.36Å; T110-V261 HydrophobicContact CG2-CG2 4.09Å
111	A	84.7	Confident	79.1	Confident	19 Å²	19	36.4 Å²	36.4	16%	0.157	19%	0.194	C	C	.	.	H	α-helix	trans	-62.7	-45.3	173.4	0	0	0	0	0	111.6	V107 V108 R113 Y114 I115 M134	V107-A111 VanDerWaalsContact O-CB 3.29Å; V107-A111 WeakPolarHBondContact O-CB 3.42Å; V107-A111 PolarHBondContact O-N 3.37Å; V108-A111 PolarHBondContact O-N 3.4Å; A111-R113 VanDerWaalsContact C-N 3.34Å; A111-R113 PolarHBondContact O-N 3.48Å; A111-Y114 WeakPolarHBondContact O-CB 3.39Å; A111-Y114 PolarHBondContact O-N 3.05Å; A111-I115 WeakPolarHBondContact O-CD1 3.14Å; A111-I115 WeakPolarHBondContact O-CG1 3.26Å; A111-I115 PolarHBondContact O-N 3Å; A111-M134 HydrophobicContact CB-CE 3.7Å
112	D	80.6	Confident	77.7	Confident	39 Å²	39	44 Å²	44	21%	0.209	23%	0.226	C	C	.	.	H	α-helix	trans	-57.7	-45.2	173.8	173.3	84.3	0	0	0	111.7	V108 M109 I115 A116	V108-D112 WeakPolarHBondContact O-CB 3.28Å; V108-D112 PolarHBondContact O-N 3.37Å; M109-D112 PolarHBondContact O-N 3.06Å; D112-I115 PolarHBondContact O-N 2.86Å; D112-A116 WeakPolarHBondContact O-CB 3.38Å; D112-A116 PolarHBondContact O-N 2.97Å
113	R	77.6	Confident	76.4	Confident	88 Å²	88	45.2 Å²	45.2	33%	0.332	23%	0.233	S	C	.	.	H	α-helix	trans	-64.5	-40.7	175.6	-65.9	-56.5	103.8	139.4	6.3	112.7	M109 T110 A111 I115 A116 V117 T253 T257	M109-R113 WeakPolarHBondContact O-CG 3.17Å; M109-R113 PolarHBondContact O-N 2.67Å; T110-R113 PolarHBondContact O-N 2.97Å; A111-R113 VanDerWaalsContact C-N 3.34Å; A111-R113 PolarHBondContact O-N 3.48Å; R113-I115 PolarHBondContact O-N 3.03Å; R113-A116 PolarHBondContact O-N 2.77Å; R113-V117 WeakPolarHBondContact O-CB 3.48Å; R113-V117 VanDerWaalsContact O-CG2 3.28Å; R113-V117 WeakPolarHBondContact O-CG2 3.37Å; R113-V117 PolarHBondContact O-N 3.44Å; R113-T253 HydrophobicContact CG-CG2 4.36Å; R113-T257 HydrophobicContact CG-CG2 4.15Å
114	Y	79.1	Confident	74.9	Confident	54 Å²	54	51.1 Å²	51.1	21%	0.212	26%	0.263	C	S	.	.	H	α-helix	trans	-55.8	-49.5	171.8	163.9	-112.6	0	0	0	111.1	T110 A111 A116 V117 C118 F202 I203	T110-Y114 WeakPolarHBondContact O-CB 3.34Å; T110-Y114 PolarHBondContact O-N 3.2Å; A111-Y114 WeakPolarHBondContact O-CB 3.39Å; A111-Y114 PolarHBondContact O-N 3.05Å; Y114-A116 PolarHBondContact O-N 3.23Å; Y114-V117 PolarHBondContact O-N 2.84Å; Y114-C118 HydrophobicContact CD2-CB 4.15Å; Y114-C118 VanDerWaalsContact CD2-SG 3.58Å; Y114-C118 HydrophobicContact CE2-CB 3.81Å; Y114-C118 WeakPolarHBondContact CE2-SG 3.28Å; Y114-C118 WeakPolarHBondContact O-CB 3.49Å; Y114-C118 PolarHBondContact O-N 3.37Å; Y114-F202 HydrophobicContact CD2-CB 4.44Å; Y114-F202 HydrophobicContact CE2-CB 3.8Å; Y114-I203 HydrophobicContact CD2-CG1 3.83Å
115	I	77.9	Confident	73.5	Confident	12 Å²	12	58.6 Å²	58.6	6%	0.062	30%	0.299	C	S	.	.	H	α-helix	trans	-60	-47	178.1	-65.8	153.5	0	0	0	111	A111 D112 R113 V117 H119 R130 M134	A111-I115 WeakPolarHBondContact O-CD1 3.14Å; A111-I115 WeakPolarHBondContact O-CG1 3.26Å; A111-I115 PolarHBondContact O-N 3Å; D112-I115 PolarHBondContact O-N 2.86Å; R113-I115 PolarHBondContact O-N 3.03Å; I115-V117 VanDerWaalsContact C-N 3.26Å; I115-V117 PolarHBondContact O-N 3.03Å; I115-H119 CarbonylContact O-C 3.56Å; I115-H119 WeakPolarHBondContact O-CA 3.47Å; I115-H119 PolarHBondContact O-N 3.14Å; I115-R130 VanDerWaalsContact CD1-CZ 3.42Å; I115-M134 HydrophobicContact CD1-CE 4.05Å; I115-M134 HydrophobicContact CD1-SD 4.05Å
116	A	73.9	Confident	72.6	Confident	30 Å²	30	63.3 Å²	63.3	25%	0.248	32%	0.321	C	S	.	.	H	α-helix	trans	-67.3	-23.7	-179.7	0	0	0	0	0	113.7	D112 R113 Y114 K250	D112-A116 WeakPolarHBondContact O-CB 3.38Å; D112-A116 PolarHBondContact O-N 2.97Å; R113-A116 PolarHBondContact O-N 2.77Å; Y114-A116 PolarHBondContact O-N 3.23Å; A116-K250 PolarHBondContact O-NZ 2.92Å
117	V	71.3	Confident	71.9	Confident	29 Å²	29	65.3 Å²	65.3	18%	0.176	34%	0.335	C	S	.	.	H	α-helix	trans	-86.1	-52.8	175	171.9	0	0	0	0	111.2	R113 Y114 I115 V254	R113-V117 WeakPolarHBondContact O-CB 3.48Å; R113-V117 VanDerWaalsContact O-CG2 3.28Å; R113-V117 WeakPolarHBondContact O-CG2 3.37Å; R113-V117 PolarHBondContact O-N 3.44Å; Y114-V117 PolarHBondContact O-N 2.84Å; I115-V117 VanDerWaalsContact C-N 3.26Å; I115-V117 PolarHBondContact O-N 3.03Å; V117-V254 HydrophobicContact CG2-CG2 4.01Å
118	C	68.9	Low	71	Confident	22 Å²	22	66.5 Å²	66.5	15%	0.149	35%	0.346	C	S	.	.	H	α-helix	trans	-87.2	-26.7	-169.5	-63.8	0	0	0	0	114.4	Y114 P120	Y114-C118 HydrophobicContact CD2-CB 4.15Å; Y114-C118 VanDerWaalsContact CD2-SG 3.58Å; Y114-C118 HydrophobicContact CE2-CB 3.81Å; Y114-C118 WeakPolarHBondContact CE2-SG 3.28Å; Y114-C118 WeakPolarHBondContact O-CB 3.49Å; Y114-C118 PolarHBondContact O-N 3.37Å; C118-P120 VanDerWaalsContact C-CD 3.48Å
119	H	69.2	Low	70.5	Confident	87 Å²	87	73.6 Å²	73.6	40%	0.403	37%	0.371	S	S	.	.			trans	-129.9	59.4	-175.9	-63.2	-46	0	0	0	113.4	I115 L121 K122 T123	I115-H119 CarbonylContact O-C 3.56Å; I115-H119 WeakPolarHBondContact O-CA 3.47Å; I115-H119 PolarHBondContact O-N 3.14Å; H119-L121 PolarHBondContact O-N 3.14Å; H119-K122 HydrophobicContact CB-CB 4.38Å; H119-K122 PolarHBondContact O-N 3.19Å; H119-T123 PolarHBondContact O-N 3.15Å; H119-T123 PolarHBondContact O-OG1 3.43Å
120	P	65.3	Low	70.4	Confident	70 Å²	70	75.8 Å²	75.8	46%	0.455	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.5	-175.5	25.5	-35.7	0	0	0	114.3	C118	C118-P120 VanDerWaalsContact C-CD 3.48Å
121	L	58	Low	70.1	Confident	140 Å²	140	76.5 Å²	76.5	73%	0.733	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-38.7	-179.7	-63.6	172.9	0	0	0	112.9	H119 T123 L124	H119-L121 PolarHBondContact O-N 3.14Å; L121-T123 PolarHBondContact O-N 3.06Å; L121-L124 HydrophobicContact CD2-CD1 4.08Å; L121-L124 PolarHBondContact O-N 3.38Å
122	K	56.8	Low	69.8	Low	165 Å²	165	82.3 Å²	82.3	72%	0.717	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-20.1	175.9	-76	-169.1	173.9	-176.5	0	112.8	H119 L124	H119-K122 HydrophobicContact CB-CB 4.38Å; H119-K122 PolarHBondContact O-N 3.19Å; K122-L124 VanDerWaalsContact C-N 3.3Å
123	T	57.3	Low	70	Confident	43 Å²	43	86.4 Å²	86.4	26%	0.264	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-12.3	177.5	-49.8	0	0	0	0	113.1	H119 L121 P127	H119-T123 PolarHBondContact O-N 3.15Å; H119-T123 PolarHBondContact O-OG1 3.43Å; L121-T123 PolarHBondContact O-N 3.06Å; T123-P127 HydrophobicContact CG2-CB 4.09Å; T123-P127 WeakPolarHBondContact O-CD 3.2Å
124	L	56.5	Low	70.4	Confident	125 Å²	125	84.2 Å²	84.2	65%	0.654	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-35.1	-173.5	-72.9	168	0	0	0	114.5	L121 K122	L121-L124 HydrophobicContact CD2-CD1 4.08Å; L121-L124 PolarHBondContact O-N 3.38Å; K122-L124 VanDerWaalsContact C-N 3.3Å
125	Q	58.5	Low	70.6	Confident	181 Å²	181	82.7 Å²	82.7	85%	0.846	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-46.8	-171.1	-83	173.9	-36	0	0	114
126	Q	66.5	Low	70.9	Confident	113 Å²	113	84.4 Å²	84.4	53%	0.528	43%	0.425	S	S	.	.			trans	-149	73.5	176.1	-67.2	-163.9	-1.3	0	0	114.3	R129 R130	Q126-R129 HydrophobicContact CB-CB 4.3Å; Q126-R130 PolarHBondContact O-N 3.38Å
127	P	68.5	Low	71.7	Confident	53 Å²	53	85.7 Å²	85.7	34%	0.344	44%	0.436	S	S	.	.	H	α-helix	trans	-65.8	-45.3	-178.2	24.5	-31.4	0	0	0	113.1	T123 R129 R130 S131	T123-P127 HydrophobicContact CG2-CB 4.09Å; T123-P127 WeakPolarHBondContact O-CD 3.2Å; P127-R129 PolarHBondContact O-N 3.38Å; P127-R130 PolarHBondContact O-N 3Å; P127-S131 PolarHBondContact O-N 3.32Å
128	A	69.9	Low	72.5	Confident	41 Å²	41	84.6 Å²	84.6	34%	0.339	43%	0.43	S	S	.	.	H	α-helix	trans	-69.9	-30.7	-174.7	0	0	0	0	0	114.1	R132	A128-R132 WeakPolarHBondContact O-CB 3.26Å; A128-R132 VanDerWaalsContact O-CG 3.29Å; A128-R132 WeakPolarHBondContact O-CG 3.48Å; A128-R132 PolarHBondContact O-N 2.98Å; A128-R132 PolarHBondContact O-NE 3.05Å
129	R	75.8	Confident	73.4	Confident	168 Å²	168	86 Å²	86	63%	0.634	43%	0.432	S	S	*	.	H	α-helix	trans	-71.1	-42	175.3	-170.7	-177.5	-177.9	-179.1	0.9	111	Q126 P127 L133	Q126-R129 HydrophobicContact CB-CB 4.3Å; P127-R129 PolarHBondContact O-N 3.38Å; R129-L133 WeakPolarHBondContact O-CB 3.37Å; R129-L133 PolarHBondContact O-N 3.22Å
130	R	80	Confident	74.5	Confident	109 Å²	109	86.5 Å²	86.5	41%	0.411	44%	0.441	S	S	.	.	H	α-helix	trans	-64.5	-48.6	177.6	-177.2	-176.3	-178.7	165.3	5.9	112	I115 Q126 P127 R132 L133 M134	I115-R130 VanDerWaalsContact CD1-CZ 3.42Å; Q126-R130 PolarHBondContact O-N 3.38Å; P127-R130 PolarHBondContact O-N 3Å; R130-R132 PolarHBondContact O-N 3.44Å; R130-L133 PolarHBondContact O-N 3.04Å; R130-M134 HydrophobicContact CG-SD 4.01Å; R130-M134 WeakPolarHBondContact O-CG 3.46Å; R130-M134 PolarHBondContact O-N 3.34Å
131	S	75.6	Confident	75.8	Confident	18 Å²	18	86.7 Å²	86.7	13%	0.126	44%	0.438	C	S	.	.	H	α-helix	trans	-59.3	-47.9	178.6	177.2	0	0	0	0	111.1	P127 L133 M134 I135	P127-S131 PolarHBondContact O-N 3.32Å; S131-L133 VanDerWaalsContact C-N 3.33Å; S131-L133 PolarHBondContact O-N 3.36Å; S131-M134 PolarHBondContact O-N 3.35Å; S131-M134 VanDerWaalsContact O-N 3.14Å; S131-I135 VanDerWaalsContact O-CG1 3.3Å; S131-I135 WeakPolarHBondContact O-CG1 3.21Å; S131-I135 PolarHBondContact O-N 2.98Å
132	R	78.5	Confident	77.5	Confident	142 Å²	142	80 Å²	80	54%	0.536	40%	0.403	S	S	.	.	H	α-helix	trans	-57.4	-40.6	174.1	-75	-177.9	-65.9	-178.9	3.9	113.5	L53 A128 R130 A136	L53-R132 HydrophobicContact CD2-CG 3.67Å; A128-R132 WeakPolarHBondContact O-CB 3.26Å; A128-R132 VanDerWaalsContact O-CG 3.29Å; A128-R132 WeakPolarHBondContact O-CG 3.48Å; A128-R132 PolarHBondContact O-N 2.98Å; A128-R132 PolarHBondContact O-NE 3.05Å; R130-R132 PolarHBondContact O-N 3.44Å; R132-A136 VanDerWaalsContact O-CB 3.27Å; R132-A136 WeakPolarHBondContact O-CB 3.17Å; R132-A136 PolarHBondContact O-N 2.92Å
133	L	84.2	Confident	79.1	Confident	125 Å²	125	77.1 Å²	77.1	65%	0.654	39%	0.39	S	S	*	.	H	α-helix	trans	-65.4	-42.3	175.9	-178	64.6	0	0	0	112.2	R129 R130 S131 A136 A137	R129-L133 WeakPolarHBondContact O-CB 3.37Å; R129-L133 PolarHBondContact O-N 3.22Å; R130-L133 PolarHBondContact O-N 3.04Å; S131-L133 VanDerWaalsContact C-N 3.33Å; S131-L133 PolarHBondContact O-N 3.36Å; L133-A136 PolarHBondContact O-N 3.1Å; L133-A137 VanDerWaalsContact O-CB 3.29Å; L133-A137 WeakPolarHBondContact O-CB 3.24Å; L133-A137 PolarHBondContact O-N 3.33Å
134	M	85.7	Confident	80.8	Confident	42 Å²	42	78.8 Å²	78.8	21%	0.207	40%	0.4	C	S	.	.	H	α-helix	trans	-65.3	-41.9	177.4	-70.8	173.7	58.3	0	0	111.7	V108 A111 I115 R130 S131 A137 A138	V108-M134 HydrophobicContact CG1-CB 4Å; V108-M134 HydrophobicContact CG1-CE 4.45Å; V108-M134 HydrophobicContact CG2-CB 4.37Å; A111-M134 HydrophobicContact CB-CE 3.7Å; I115-M134 HydrophobicContact CD1-CE 4.05Å; I115-M134 HydrophobicContact CD1-SD 4.05Å; R130-M134 HydrophobicContact CG-SD 4.01Å; R130-M134 WeakPolarHBondContact O-CG 3.46Å; R130-M134 PolarHBondContact O-N 3.34Å; S131-M134 PolarHBondContact O-N 3.35Å; S131-M134 VanDerWaalsContact O-N 3.14Å; M134-A137 PolarHBondContact O-N 3.09Å; M134-A138 PolarHBondContact O-N 3Å
135	I	83.9	Confident	82.5	Confident	22 Å²	22	73.8 Å²	73.8	11%	0.113	37%	0.374	C	S	.	.	H	α-helix	trans	-62.4	-51.1	174.5	-67.5	165.5	0	0	0	110.2	L53 V57 M105 V108 S131 A137 A138 W139	L53-I135 HydrophobicContact CD2-CD1 4.01Å; V57-I135 HydrophobicContact CG2-CG2 4.48Å; M105-I135 HydrophobicContact CE-CG1 4.21Å; M105-I135 HydrophobicContact CE-CG2 4.35Å; M105-I135 HydrophobicContact SD-CG2 4.19Å; V108-I135 HydrophobicContact CG1-CG1 3.99Å; S131-I135 VanDerWaalsContact O-CG1 3.3Å; S131-I135 WeakPolarHBondContact O-CG1 3.21Å; S131-I135 PolarHBondContact O-N 2.98Å; I135-A137 VanDerWaalsContact C-N 3.32Å; I135-A137 PolarHBondContact O-N 3.05Å; I135-A138 PolarHBondContact O-N 3.22Å; I135-A138 VanDerWaalsContact O-N 3.13Å; I135-W139 PolarHBondContact O-N 3.22Å
136	A	84.7	Confident	84.1	Confident	48 Å²	48	65.2 Å²	65.2	40%	0.397	33%	0.334	S	S	.	.	H	α-helix	trans	-58.9	-41.6	178.4	0	0	0	0	0	112.3	R132 L133 W139 V140	R132-A136 VanDerWaalsContact O-CB 3.27Å; R132-A136 WeakPolarHBondContact O-CB 3.17Å; R132-A136 PolarHBondContact O-N 2.92Å; L133-A136 PolarHBondContact O-N 3.1Å; A136-W139 PolarHBondContact O-N 3.14Å; A136-V140 WeakPolarHBondContact O-CG2 3.47Å; A136-V140 PolarHBondContact O-N 3.21Å
137	A	90.1	Very high	85.2	Confident	56 Å²	56	62.2 Å²	62.2	46%	0.463	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-41.3	175.2	0	0	0	0	0	112.2	L133 M134 I135 L141	L133-A137 VanDerWaalsContact O-CB 3.29Å; L133-A137 WeakPolarHBondContact O-CB 3.24Å; L133-A137 PolarHBondContact O-N 3.33Å; M134-A137 PolarHBondContact O-N 3.09Å; I135-A137 VanDerWaalsContact C-N 3.32Å; I135-A137 PolarHBondContact O-N 3.05Å; A137-L141 WeakPolarHBondContact O-CB 3.46Å; A137-L141 PolarHBondContact O-N 2.92Å
138	A	88.6	Confident	86.1	Confident	7 Å²	7	61.6 Å²	61.6	6%	0.058	32%	0.319	C	S	.	.	H	α-helix	trans	-65.2	-39.9	175.6	0	0	0	0	0	112.8	M105 V108 M134 I135 S142	M105-A138 HydrophobicContact SD-CB 4.42Å; V108-A138 HydrophobicContact CG2-CB 3.67Å; M134-A138 PolarHBondContact O-N 3Å; I135-A138 PolarHBondContact O-N 3.22Å; I135-A138 VanDerWaalsContact O-N 3.13Å; A138-S142 VanDerWaalsContact O-CB 3.28Å; A138-S142 WeakPolarHBondContact O-CB 3.36Å; A138-S142 PolarHBondContact O-N 3.19Å; A138-S142 PolarHBondContact O-OG 3.3Å
139	W	88.8	Confident	86.9	Confident	52 Å²	52	59.7 Å²	59.7	20%	0.197	30%	0.304	C	S	.	.	H	α-helix	trans	-63.9	-48.5	174.5	-76.2	111.5	0	0	0	112.3	V60 F97 A101 I135 A136 S142 F143	V60-W139 HydrophobicContact CG1-CH2 3.71Å; V60-W139 HydrophobicContact CG1-CZ2 4.28Å; V60-W139 HydrophobicContact CG1-CZ3 4.44Å; F97-W139 HydrophobicContact CE1-CE3 4.22Å; F97-W139 AromaticContact CE1-CZ3 3.81Å; F97-W139 HydrophobicContact CE1-CZ3 3.81Å; F97-W139 HydrophobicContact CE2-CE3 4.03Å; F97-W139 HydrophobicContact CE2-CZ3 4.37Å; F97-W139 AromaticContact CZ-CE3 3.44Å; F97-W139 HydrophobicContact CZ-CE3 3.44Å; F97-W139 VanDerWaalsContact CZ-CE3 3.44Å; F97-W139 AromaticContact CZ-CZ3 3.51Å; F97-W139 HydrophobicContact CZ-CZ3 3.51Å; A101-W139 HydrophobicContact CB-CE3 4.15Å; A101-W139 HydrophobicContact CB-CH2 4.37Å; A101-W139 HydrophobicContact CB-CZ3 3.78Å; I135-W139 PolarHBondContact O-N 3.22Å; A136-W139 PolarHBondContact O-N 3.14Å; W139-S142 PolarHBondContact O-N 3.4Å; W139-F143 PolarHBondContact O-N 2.93Å
140	V	91.4	Very high	87.4	Confident	96 Å²	96	55.6 Å²	55.6	58%	0.582	29%	0.289	S	S	*	.	H	α-helix	trans	-62	-45	177.8	172.1	0	0	0	0	110.8	A136 S142 F143 V144	A136-V140 WeakPolarHBondContact O-CG2 3.47Å; A136-V140 PolarHBondContact O-N 3.21Å; V140-S142 PolarHBondContact O-N 3.21Å; V140-F143 PolarHBondContact O-N 3.49Å; V140-V144 HydrophobicContact CG1-CG2 4.44Å; V140-V144 VanDerWaalsContact O-CG2 3.31Å; V140-V144 WeakPolarHBondContact O-CG2 3.45Å; V140-V144 PolarHBondContact O-N 3.47Å
141	L	93.1	Very high	87.7	Confident	74 Å²	74	58.4 Å²	58.4	39%	0.387	30%	0.304	S	S	.	.	H	α-helix	trans	-60	-45.4	175.9	-178.7	61.8	0	0	0	111.4	Y104 A137 F143 V144 L145	Y104-L141 HydrophobicContact CD1-CD2 4.03Å; Y104-L141 HydrophobicContact CD2-CD2 4.49Å; Y104-L141 HydrophobicContact CE1-CD2 3.81Å; Y104-L141 HydrophobicContact CE2-CD2 4.29Å; Y104-L141 HydrophobicContact CE2-CG 4.37Å; Y104-L141 HydrophobicContact CG-CD2 4.38Å; A137-L141 WeakPolarHBondContact O-CB 3.46Å; A137-L141 PolarHBondContact O-N 2.92Å; L141-F143 VanDerWaalsContact C-N 3.34Å; L141-F143 PolarHBondContact O-N 2.67Å; L141-V144 PolarHBondContact O-N 2.88Å; L141-L145 HydrophobicContact CD1-CD1 3.79Å; L141-L145 HydrophobicContact CD1-CD2 4.49Å; L141-L145 HydrophobicContact CD1-CG 4.02Å; L141-L145 HydrophobicContact CD2-CD1 4.5Å; L141-L145 HydrophobicContact CG-CD1 3.75Å; L141-L145 HydrophobicContact CG-CG 4.36Å; L141-L145 WeakPolarHBondContact O-CB 3.46Å; L141-L145 WeakPolarHBondContact O-CG 3.33Å; L141-L145 PolarHBondContact O-N 3.13Å
142	S	92.5	Very high	88.2	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63	-39.9	179	-57.9	0	0	0	0	112.4	A101 A138 W139 V140 S146	A101-S142 WeakPolarHBondContact CA-OG 3.25Å; A101-S142 PolarHBondContact N-OG 3.36Å; A138-S142 VanDerWaalsContact O-CB 3.28Å; A138-S142 WeakPolarHBondContact O-CB 3.36Å; A138-S142 PolarHBondContact O-N 3.19Å; A138-S142 PolarHBondContact O-OG 3.3Å; W139-S142 PolarHBondContact O-N 3.4Å; V140-S142 PolarHBondContact O-N 3.21Å; S142-S146 WeakPolarHBondContact O-CB 3.35Å; S142-S146 PolarHBondContact O-N 2.89Å; S142-S146 VanDerWaalsContact O-N 3.1Å; S142-S146 PolarHBondContact O-OG 2.86Å; S142-S146 VanDerWaalsContact O-OG 3.1Å
143	F	90.6	Very high	88.5	Confident	105 Å²	105	53.1 Å²	53.1	46%	0.461	29%	0.285	S	S	.	.	H	α-helix	trans	-65.6	-45.5	175	-175.9	-97.8	0	0	0	111.8	H93 F97 W139 V140 L141 L145 S146 T147	H93-F143 AromaticContact CE1-CD2 3.98Å; H93-F143 AromaticContact CE1-CE2 3.85Å; H93-F143 AromaticContact NE2-CD2 3.58Å; H93-F143 AromaticContact NE2-CE2 3.32Å; H93-F143 VanDerWaalsContact NE2-CE2 3.32Å; H93-F143 WeakPolarHBondContact NE2-CE2 3.47Å; F97-F143 HydrophobicContact CD2-CB 4.22Å; F97-F143 HydrophobicContact CD2-CD2 4.46Å; F97-F143 HydrophobicContact CE2-CB 3.91Å; F97-F143 HydrophobicContact CE2-CD2 4.37Å; W139-F143 PolarHBondContact O-N 2.93Å; V140-F143 PolarHBondContact O-N 3.49Å; L141-F143 VanDerWaalsContact C-N 3.34Å; L141-F143 PolarHBondContact O-N 2.67Å; F143-L145 PolarHBondContact O-N 3.36Å; F143-S146 PolarHBondContact O-N 3.44Å; F143-S146 PolarHBondContact O-OG 3.33Å; F143-T147 HydrophobicContact CE1-CG2 4.49Å; F143-T147 WeakPolarHBondContact O-CG2 3.47Å; F143-T147 PolarHBondContact O-N 3.18Å; F143-T147 VanDerWaalsContact O-N 3.17Å
144	V	93.8	Very high	88.4	Confident	78 Å²	78	48 Å²	48	47%	0.473	26%	0.259	S	S	.	.	H	α-helix	trans	-60.8	-46.5	177.4	169.6	0	0	0	0	110.9	V140 L141 S146 T147	V140-V144 HydrophobicContact CG1-CG2 4.44Å; V140-V144 VanDerWaalsContact O-CG2 3.31Å; V140-V144 WeakPolarHBondContact O-CG2 3.45Å; V140-V144 PolarHBondContact O-N 3.47Å; L141-V144 PolarHBondContact O-N 2.88Å; V144-S146 VanDerWaalsContact C-N 3.29Å; V144-S146 PolarHBondContact O-N 2.96Å; V144-T147 WeakPolarHBondContact O-CB 3.49Å; V144-T147 PolarHBondContact O-N 3.35Å; V144-T147 PolarHBondContact O-OG1 2.99Å
145	L	92.4	Very high	88.2	Confident	20 Å²	20	47.6 Å²	47.6	11%	0.105	26%	0.257	C	S	.	.	H	α-helix	trans	-69.6	-22.6	-179.3	-63.4	171	0	0	0	113.5	F100 Y104 L141 F143 P148 W183	F100-L145 HydrophobicContact CD1-CB 4.15Å; F100-L145 HydrophobicContact CD1-CD1 4.14Å; F100-L145 HydrophobicContact CD2-CB 4.13Å; F100-L145 HydrophobicContact CE1-CB 3.9Å; F100-L145 HydrophobicContact CE1-CD1 4.08Å; F100-L145 HydrophobicContact CE2-CB 3.92Å; F100-L145 WeakPolarHBondContact CE2-O 3.44Å; F100-L145 HydrophobicContact CG-CB 4.25Å; F100-L145 HydrophobicContact CZ-CB 3.79Å; Y104-L145 HydrophobicContact CD2-CD1 4.49Å; Y104-L145 HydrophobicContact CE2-CD1 3.4Å; Y104-L145 VanDerWaalsContact CE2-CD1 3.4Å; Y104-L145 VanDerWaalsContact OH-CD1 3.29Å; Y104-L145 WeakPolarHBondContact OH-CD1 3.29Å; L141-L145 HydrophobicContact CD1-CD1 3.79Å; L141-L145 HydrophobicContact CD1-CD2 4.49Å; L141-L145 HydrophobicContact CD1-CG 4.02Å; L141-L145 HydrophobicContact CD2-CD1 4.5Å; L141-L145 HydrophobicContact CG-CD1 3.75Å; L141-L145 HydrophobicContact CG-CG 4.36Å; L141-L145 WeakPolarHBondContact O-CB 3.46Å; L141-L145 WeakPolarHBondContact O-CG 3.33Å; L141-L145 PolarHBondContact O-N 3.13Å; F143-L145 PolarHBondContact O-N 3.36Å; L145-P148 VanDerWaalsContact O-CD 3.28Å; L145-P148 WeakPolarHBondContact O-CD 3.26Å; L145-W183 HydrophobicContact CB-CZ2 4.47Å; L145-W183 HydrophobicContact CD2-CH2 3.54Å; L145-W183 HydrophobicContact CD2-CZ2 3.32Å; L145-W183 HydrophobicContact CG-CZ2 4.47Å
146	S	91.1	Very high	88	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-90.1	-3.1	173.1	68.7	0	0	0	0	114.5	H93 S142 F143 V144 Q149	H93-S146 PolarHBondContact CE1-OG 2.73Å; H93-S146 PolarHBondContact ND1-O 3.33Å; H93-S146 PolarHBondContact ND1-OG 2.97Å; S142-S146 WeakPolarHBondContact O-CB 3.35Å; S142-S146 PolarHBondContact O-N 2.89Å; S142-S146 VanDerWaalsContact O-N 3.1Å; S142-S146 PolarHBondContact O-OG 2.86Å; S142-S146 VanDerWaalsContact O-OG 3.1Å; F143-S146 PolarHBondContact O-N 3.44Å; F143-S146 PolarHBondContact O-OG 3.33Å; V144-S146 VanDerWaalsContact C-N 3.29Å; V144-S146 PolarHBondContact O-N 2.96Å; S146-Q149 WeakPolarHBondContact O-CB 3.32Å; S146-Q149 VanDerWaalsContact O-CG 3.25Å; S146-Q149 WeakPolarHBondContact O-CG 3.38Å; S146-Q149 PolarHBondContact O-N 2.67Å
147	T	89.3	Confident	87.7	Confident	51 Å²	51	50.9 Å²	50.9	31%	0.313	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-33.7	174.7	57.6	0	0	0	0	115.5	F143 V144 Q149 Y150	F143-T147 HydrophobicContact CE1-CG2 4.49Å; F143-T147 WeakPolarHBondContact O-CG2 3.47Å; F143-T147 PolarHBondContact O-N 3.18Å; F143-T147 VanDerWaalsContact O-N 3.17Å; V144-T147 WeakPolarHBondContact O-CB 3.49Å; V144-T147 PolarHBondContact O-N 3.35Å; V144-T147 PolarHBondContact O-OG1 2.99Å; T147-Q149 PolarHBondContact O-N 3.21Å; T147-Y150 PolarHBondContact O-N 3.37Å
148	P	88.4	Confident	86.9	Confident	39 Å²	39	51 Å²	51	25%	0.253	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.3	-178.4	-27.1	37.3	0	0	0	114.4	L145 Y150 F151 V152	L145-P148 VanDerWaalsContact O-CD 3.28Å; L145-P148 WeakPolarHBondContact O-CD 3.26Å; P148-Y150 VanDerWaalsContact C-N 3.28Å; P148-Y150 PolarHBondContact O-N 3.31Å; P148-F151 PolarHBondContact O-N 3.31Å; P148-F151 VanDerWaalsContact O-N 3.16Å; P148-V152 WeakPolarHBondContact O-CG2 3.45Å; P148-V152 PolarHBondContact O-N 2.89Å
149	Q	87.3	Confident	86.2	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.009	28%	0.28	C	S	.	.	H	α-helix	trans	-57.6	-37.7	179.1	-58.5	-55.6	-47.6	0	0	113.3	H93 V96 S146 T147 F151 F153 Y180	H93-Q149 HydrophobicContact CB-CB 4.14Å; V96-Q149 HydrophobicContact CB-CG 3.74Å; V96-Q149 HydrophobicContact CG1-CG 4Å; V96-Q149 VanDerWaalsContact CG2-CD 3.41Å; V96-Q149 HydrophobicContact CG2-CG 3.86Å; S146-Q149 WeakPolarHBondContact O-CB 3.32Å; S146-Q149 VanDerWaalsContact O-CG 3.25Å; S146-Q149 WeakPolarHBondContact O-CG 3.38Å; S146-Q149 PolarHBondContact O-N 2.67Å; T147-Q149 PolarHBondContact O-N 3.21Å; Q149-F151 PolarHBondContact O-N 2.85Å; Q149-F153 PolarHBondContact O-N 2.87Å; Q149-F153 VanDerWaalsContact O-N 3.08Å; Q149-Y180 VanDerWaalsContact NE2-CE2 3.32Å; Q149-Y180 PolarHBondContact NE2-OH 3.4Å; Q149-Y180 PolarHBondContact OE1-OH 2.96Å
150	Y	85.8	Confident	85	Confident	82 Å²	82	59.2 Å²	59.2	32%	0.322	31%	0.307	S	S	.	.	H	α-helix	trans	-64.6	-29.1	-179.7	-80.5	-72.4	0	0	0	113.2	R89 V90 H93 T147 P148	R89-Y150 HydrophobicContact CB-CD1 3.94Å; R89-Y150 HydrophobicContact CB-CE1 4.23Å; R89-Y150 PolarHBondContact NH1-O 3.35Å; V90-Y150 HydrophobicContact CG2-CE1 4.37Å; H93-Y150 HydrophobicContact CB-CD2 4.24Å; H93-Y150 HydrophobicContact CB-CE1 4.42Å; H93-Y150 HydrophobicContact CB-CE2 3.77Å; H93-Y150 AromaticContact CD2-CE2 3.59Å; H93-Y150 AromaticContact CD2-CZ 3.86Å; H93-Y150 PolarHBondContact CD2-OH 2.86Å; H93-Y150 AromaticContact CE1-CE2 3.63Å; H93-Y150 AromaticContact CG-CD2 3.94Å; H93-Y150 AromaticContact CG-CE2 3.26Å; H93-Y150 AromaticContact CG-CZ 3.7Å; H93-Y150 AromaticContact ND1-CD2 3.69Å; H93-Y150 AromaticContact ND1-CE2 3.32Å; H93-Y150 VanDerWaalsContact ND1-CE2 3.32Å; H93-Y150 WeakPolarHBondContact ND1-CE2 3.41Å; H93-Y150 AromaticContact NE2-CE2 3.81Å; T147-Y150 PolarHBondContact O-N 3.37Å; P148-Y150 VanDerWaalsContact C-N 3.28Å; P148-Y150 PolarHBondContact O-N 3.31Å
151	F	85.4	Confident	83.8	Confident	168 Å²	168	61.4 Å²	61.4	74%	0.737	32%	0.32	S	S	*	.	H	α-helix	trans	-91.9	-34.7	-178.1	-56.7	-73.5	0	0	0	112.3	P148 Q149	P148-F151 PolarHBondContact O-N 3.31Å; P148-F151 VanDerWaalsContact O-N 3.16Å; Q149-F151 PolarHBondContact O-N 2.85Å
152	V	86.1	Confident	82.7	Confident	23 Å²	23	62 Å²	62	14%	0.139	33%	0.327	C	S	.	.	H	α-helix	trans	-79.3	-39.7	-178	172.6	0	0	0	0	112.5	P148 A169 T170 F171 Y180	P148-V152 WeakPolarHBondContact O-CG2 3.45Å; P148-V152 PolarHBondContact O-N 2.89Å; V152-A169 HydrophobicContact CG1-CB 3.86Å; V152-A169 CarbonylContact O-C 3.46Å; V152-A169 WeakPolarHBondContact O-CA 3.41Å; V152-T170 PolarHBondContact O-N 3.18Å; V152-T170 PolarHBondContact O-OG1 3.2Å; V152-F171 HydrophobicContact CG1-CD1 4.13Å; V152-F171 HydrophobicContact CG1-CE1 3.53Å; V152-F171 HydrophobicContact CG1-CZ 3.95Å; V152-Y180 HydrophobicContact CG2-CD2 4.4Å
153	F	84.4	Confident	81.6	Confident	26 Å²	26	69.4 Å²	69.4	11%	0.114	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	137.5	-176	-73.7	-90.4	0	0	0	112.4	R89 K92 Q149 W168 A169	R89-F153 WeakPolarHBondContact CG-O 3.41Å; R89-F153 PolarHBondContact NH1-O 3.45Å; R89-F153 VanDerWaalsContact NH1-O 3.08Å; K92-F153 HydrophobicContact CB-CB 4.24Å; K92-F153 HydrophobicContact CB-CD1 4.46Å; K92-F153 HydrophobicContact CB-CD2 4.15Å; K92-F153 HydrophobicContact CB-CG 4.01Å; K92-F153 HydrophobicContact CD-CD1 3.98Å; K92-F153 HydrophobicContact CD-CE1 3.95Å; K92-F153 HydrophobicContact CD-CG 4.38Å; K92-F153 HydrophobicContact CD-CZ 4.34Å; K92-F153 HydrophobicContact CG-CB 4.15Å; K92-F153 HydrophobicContact CG-CD1 3.78Å; K92-F153 HydrophobicContact CG-CD2 4.35Å; K92-F153 HydrophobicContact CG-CE1 4.27Å; K92-F153 HydrophobicContact CG-CG 3.82Å; Q149-F153 PolarHBondContact O-N 2.87Å; Q149-F153 VanDerWaalsContact O-N 3.08Å; F153-W168 WeakPolarHBondContact CA-O 3.12Å; F153-A169 HydrophobicContact CD1-CB 4.17Å; F153-A169 HydrophobicContact CE1-CB 3.79Å; F153-A169 HydrophobicContact CE2-CB 4.47Å; F153-A169 HydrophobicContact CZ-CB 3.96Å
154	S	83.8	Confident	80.7	Confident	16 Å²	16	64.9 Å²	64.9	11%	0.112	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	155.3	175.2	54.9	0	0	0	0	111.2	D85 I156 W168	D85-S154 WeakPolarHBondContact OD1-CA 3.45Å; S154-I156 PolarHBondContact O-N 3.45Å; S154-W168 PolarHBondContact N-O 3.36Å; S154-W168 PolarHBondContact O-N 2.96Å; S154-W168 VanDerWaalsContact O-O 3.12Å
155	M	80.5	Confident	79.9	Confident	34 Å²	34	68.7 Å²	68.7	17%	0.167	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	117.7	169.4	-71.7	-67.7	-70.2	0	0	109.6	F81 D85 C88 R165 D166 C167	F81-M155 HydrophobicContact CB-SD 4.36Å; F81-M155 HydrophobicContact CD1-CE 3.98Å; F81-M155 HydrophobicContact CD1-SD 3.51Å; F81-M155 VanDerWaalsContact CD1-SD 3.51Å; F81-M155 HydrophobicContact CE1-SD 4.23Å; F81-M155 HydrophobicContact CG-SD 4.29Å; D85-M155 HydrophobicContact CB-CB 4.11Å; D85-M155 HydrophobicContact CB-CG 4.18Å; D85-M155 PolarHBondContact OD1-N 3.35Å; C88-M155 HydrophobicContact CB-CG 3.71Å; C88-M155 HydrophobicContact CB-SD 3.83Å; M155-R165 HydrophobicContact CE-CB 3.88Å; M155-R165 WeakPolarHBondContact CE-O 3.48Å; M155-D166 VanDerWaalsContact SD-C 3.52Å; M155-C167 VanDerWaalsContact SD-CA 3.54Å; M155-C167 HydrophobicContact SD-CB 3.65Å; M155-C167 PolarHBondContact SD-N 3.37Å
156	I	80.6	Confident	79.2	Confident	59 Å²	59	68.7 Å²	68.7	30%	0.303	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	159.5	175.9	66.6	174.9	0	0	0	110.6	S154 V158 R165 D166 W168	S154-I156 PolarHBondContact O-N 3.45Å; I156-V158 HydrophobicContact CG1-CG2 4.05Å; I156-V158 PolarHBondContact O-N 3.5Å; I156-R165 VanDerWaalsContact O-CA 3.32Å; I156-R165 WeakPolarHBondContact O-CA 3.35Å; I156-D166 PolarHBondContact N-O 2.87Å; I156-D166 VanDerWaalsContact N-O 3.07Å; I156-D166 PolarHBondContact O-N 2.97Å; I156-W168 HydrophobicContact CD1-CB 3.57Å; I156-W168 HydrophobicContact CD1-CG 3.81Å; I156-W168 HydrophobicContact CG1-CB 3.64Å; I156-W168 HydrophobicContact CG1-CG 4.37Å
157	E	77.9	Confident	78.8	Confident	80 Å²	80	69 Å²	69	37%	0.374	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	105.2	171.9	-71.5	177.5	-161.8	0	0	108.6	A164 R165	E157-A164 WeakPolarHBondContact CA-O 3.49Å; E157-R165 HydrophobicContact CG-CG 3.47Å; E157-R165 VanDerWaalsContact CG-CG 3.47Å; E157-R165 IonicContact OE1-CZ 2.77Å; E157-R165 IonicContact OE1-NE 3.22Å; E157-R165 PolarHBondContact OE1-NE 3.18Å; E157-R165 IonicContact OE1-NH2 3.59Å; E157-R165 PolarHBondContact OE1-NH2 3.22Å
158	V	73.6	Confident	78.4	Confident	59 Å²	59	73.4 Å²	73.4	36%	0.358	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-31	-174.8	176.9	0	0	0	0	111.3	I156 A164 D166 W168	I156-V158 HydrophobicContact CG1-CG2 4.05Å; I156-V158 PolarHBondContact O-N 3.5Å; V158-A164 PolarHBondContact N-O 3.5Å; V158-D166 HydrophobicContact CG2-CB 4Å; V158-W168 HydrophobicContact CG2-CE3 4.41Å
159	N	72.4	Confident	78.1	Confident	87 Å²	87	72.2 Å²	72.2	47%	0.465	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	103	179.3	-84.5	-47.6	0	0	0	111.5	V161 T162 K163 A164	N159-V161 PolarHBondContact O-N 3.33Å; N159-V161 VanDerWaalsContact O-N 3.09Å; N159-T162 VanDerWaalsContact CB-OG1 3.24Å; N159-T162 WeakPolarHBondContact CB-OG1 3.36Å; N159-T162 PolarHBondContact O-N 2.91Å; N159-T162 VanDerWaalsContact O-N 3.14Å; N159-K163 PolarHBondContact O-N 2.91Å; N159-A164 HydrophobicContact CB-CB 4.5Å
160	N	65	Low	77.7	Confident	145 Å²	145	75.5 Å²	75.5	78%	0.775	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-28.3	177.3	-73.7	-14.2	0	0	0	113.8
161	V	66.1	Low	77.5	Confident	142 Å²	142	75.3 Å²	75.3	86%	0.861	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-36.9	-179.2	-175.6	0	0	0	0	112.4	N159	N159-V161 PolarHBondContact O-N 3.33Å; N159-V161 VanDerWaalsContact O-N 3.09Å
162	T	69.9	Low	77.1	Confident	87 Å²	87	74.4 Å²	74.4	53%	0.534	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-2.6	-175.6	53.7	0	0	0	0	113.9	N159 A164	N159-T162 VanDerWaalsContact CB-OG1 3.24Å; N159-T162 WeakPolarHBondContact CB-OG1 3.36Å; N159-T162 PolarHBondContact O-N 2.91Å; N159-T162 VanDerWaalsContact O-N 3.14Å; T162-A164 PolarHBondContact O-N 3.41Å; T162-A164 VanDerWaalsContact O-N 3.09Å
163	K	69.1	Low	76.6	Confident	154 Å²	154	81.3 Å²	81.3	67%	0.67	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	30.5	-173.4	-60.6	-173.6	178.3	-178	0	113.2	N159 R165	N159-K163 PolarHBondContact O-N 2.91Å; K163-R165 PolarHBondContact O-N 3.34Å
164	A	72.8	Confident	76.2	Confident	10 Å²	10	83.6 Å²	83.6	8%	0.083	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	121.3	178.6	0	0	0	0	0	109.5	E157 V158 N159 T162	E157-A164 WeakPolarHBondContact CA-O 3.49Å; V158-A164 PolarHBondContact N-O 3.5Å; N159-A164 HydrophobicContact CB-CB 4.5Å; T162-A164 PolarHBondContact O-N 3.41Å; T162-A164 VanDerWaalsContact O-N 3.09Å
165	R	75.1	Confident	76	Confident	158 Å²	158	90.8 Å²	90.8	60%	0.596	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	123.6	176.1	-69.4	179.9	178.9	175.5	0	109.7	M155 I156 E157 K163	M155-R165 HydrophobicContact CE-CB 3.88Å; M155-R165 WeakPolarHBondContact CE-O 3.48Å; I156-R165 VanDerWaalsContact O-CA 3.32Å; I156-R165 WeakPolarHBondContact O-CA 3.35Å; E157-R165 HydrophobicContact CG-CG 3.47Å; E157-R165 VanDerWaalsContact CG-CG 3.47Å; E157-R165 IonicContact OE1-CZ 2.77Å; E157-R165 IonicContact OE1-NE 3.22Å; E157-R165 PolarHBondContact OE1-NE 3.18Å; E157-R165 IonicContact OE1-NH2 3.59Å; E157-R165 PolarHBondContact OE1-NH2 3.22Å; K163-R165 PolarHBondContact O-N 3.34Å
166	D	79.5	Confident	76.2	Confident	20 Å²	20	90 Å²	90	11%	0.107	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	155.9	177.4	-76.3	-61.7	0	0	0	111	R80 F81 M155 I156 V158 W168	R80-D166 WeakPolarHBondContact CA-OD1 3.36Å; F81-D166 PolarHBondContact N-OD1 2.87Å; M155-D166 VanDerWaalsContact SD-C 3.52Å; I156-D166 PolarHBondContact N-O 2.87Å; I156-D166 VanDerWaalsContact N-O 3.07Å; I156-D166 PolarHBondContact O-N 2.97Å; V158-D166 HydrophobicContact CG2-CB 4Å; D166-W168 PolarHBondContact O-N 3.37Å
167	C	82.6	Confident	76.2	Confident	6 Å²	6	89.4 Å²	89.4	4%	0.041	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	96.2	-177.5	-177.1	0	0	0	0	109.4	W75 F81 C88 M155	W75-C167 HydrophobicContact CH2-CB 3.8Å; W75-C167 HydrophobicContact CZ3-CB 3.77Å; F81-C167 HydrophobicContact CB-CB 4.19Å; F81-C167 HydrophobicContact CD1-CB 4.29Å; F81-C167 HydrophobicContact CG-CB 4.11Å; C88-C167 HydrophobicContact CB-CB 3.7Å; C88-C167 WeakPolarHBondContact CB-SG 3.43Å; C88-C167 WeakPolarHBondContact SG-CB 3.39Å; C88-C167 CovalentContact SG-SG 2.03Å; C88-C167 PolarHBondContact SG-SG 2.9Å; M155-C167 VanDerWaalsContact SD-CA 3.54Å; M155-C167 HydrophobicContact SD-CB 3.65Å; M155-C167 PolarHBondContact SD-N 3.37Å
168	W	80.8	Confident	76.6	Confident	145 Å²	145	89.1 Å²	89.1	55%	0.549	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	159.5	-172.7	-162.6	-97.5	0	0	0	112	F153 S154 I156 V158 D166	F153-W168 WeakPolarHBondContact CA-O 3.12Å; S154-W168 PolarHBondContact N-O 3.36Å; S154-W168 PolarHBondContact O-N 2.96Å; S154-W168 VanDerWaalsContact O-O 3.12Å; I156-W168 HydrophobicContact CD1-CB 3.57Å; I156-W168 HydrophobicContact CD1-CG 3.81Å; I156-W168 HydrophobicContact CG1-CB 3.64Å; I156-W168 HydrophobicContact CG1-CG 4.37Å; V158-W168 HydrophobicContact CG2-CE3 4.41Å; D166-W168 PolarHBondContact O-N 3.37Å
169	A	81.2	Confident	77.4	Confident	14 Å²	14	89.2 Å²	89.2	12%	0.116	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	119.5	176.3	0	0	0	0	0	110.8	V152 F153 F171	V152-A169 HydrophobicContact CG1-CB 3.86Å; V152-A169 CarbonylContact O-C 3.46Å; V152-A169 WeakPolarHBondContact O-CA 3.41Å; F153-A169 HydrophobicContact CD1-CB 4.17Å; F153-A169 HydrophobicContact CE1-CB 3.79Å; F153-A169 HydrophobicContact CE2-CB 4.47Å; F153-A169 HydrophobicContact CZ-CB 3.96Å; A169-F171 HydrophobicContact CB-CD2 4.1Å; A169-F171 HydrophobicContact CB-CE1 4.4Å; A169-F171 HydrophobicContact CB-CE2 3.39Å; A169-F171 HydrophobicContact CB-CZ 3.58Å
170	T	79.1	Confident	78.1	Confident	71 Å²	71	86.9 Å²	86.9	44%	0.436	44%	0.438	S	S	.	.			trans	-91.1	114.5	173.2	50.6	0	0	0	0	109.5	V152	V152-T170 PolarHBondContact O-N 3.18Å; V152-T170 PolarHBondContact O-OG1 3.2Å
171	F	80.8	Confident	79.3	Confident	78 Å²	78	80.6 Å²	80.6	34%	0.342	41%	0.406	S	S	.	.			trans	-112.7	134.7	-179.4	-65.6	-65.6	0	0	0	111.1	V152 A169 Q173 Y180	V152-F171 HydrophobicContact CG1-CD1 4.13Å; V152-F171 HydrophobicContact CG1-CE1 3.53Å; V152-F171 HydrophobicContact CG1-CZ 3.95Å; A169-F171 HydrophobicContact CB-CD2 4.1Å; A169-F171 HydrophobicContact CB-CE1 4.4Å; A169-F171 HydrophobicContact CB-CE2 3.39Å; A169-F171 HydrophobicContact CB-CZ 3.58Å; F171-Q173 PolarHBondContact O-N 3.24Å; F171-Y180 AromaticContact CE1-CD1 3.96Å; F171-Y180 HydrophobicContact CE1-CD1 3.96Å; F171-Y180 HydrophobicContact CE1-CD2 4.2Å; F171-Y180 AromaticContact CE1-CG 3.66Å; F171-Y180 HydrophobicContact CE1-CG 3.66Å; F171-Y180 AromaticContact CZ-CD1 3.92Å; F171-Y180 HydrophobicContact CZ-CD1 3.92Å; F171-Y180 HydrophobicContact CZ-CE1 4.46Å; F171-Y180 HydrophobicContact CZ-CG 4.12Å
172	I	76.8	Confident	80.5	Confident	149 Å²	149	76.3 Å²	76.3	76%	0.764	38%	0.379	S	S	*	.			trans	-70.5	111.6	171.4	-62.1	170.8	0	0	0	108.3	W175 G176	I172-W175 PolarHBondContact O-N 3.07Å; I172-G176 WeakPolarHBondContact O-CA 3.48Å; I172-G176 PolarHBondContact O-N 2.71Å
173	Q	77.4	Confident	81.6	Confident	168 Å²	168	78 Å²	78	79%	0.785	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	146	175.4	-80.6	-83.2	-9.5	0	0	111.2	F171	F171-Q173 PolarHBondContact O-N 3.24Å
174	P	75.3	Confident	82.6	Confident	74 Å²	74	71.3 Å²	71.3	48%	0.481	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	cis	-93.7	-5.1	-4.6	36.5	-35.1	0	0	0	114.4
175	W	80.2	Confident	83.5	Confident	167 Å²	167	71.4 Å²	71.4	63%	0.633	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-15.5	-167.5	-59.3	100.9	0	0	0	115.1	I172 S177 R178 A179	I172-W175 PolarHBondContact O-N 3.07Å; W175-S177 PolarHBondContact O-N 2.93Å; W175-R178 WeakPolarHBondContact O-CB 3.43Å; W175-R178 PolarHBondContact O-N 2.8Å; W175-A179 WeakPolarHBondContact O-CB 3.47Å; W175-A179 PolarHBondContact O-N 2.93Å
176	G	83.6	Confident	84.5	Confident	18 Å²	18	65.2 Å²	65.2	19%	0.186	33%	0.332	C	S	.	.	H	α-helix	trans	-57.9	-46.7	-166.7	0	0	0	0	0	115	I172 Y180	I172-G176 WeakPolarHBondContact O-CA 3.48Å; I172-G176 PolarHBondContact O-N 2.71Å; G176-Y180 WeakPolarHBondContact O-CB 3.1Å; G176-Y180 PolarHBondContact O-N 2.97Å
177	S	81.9	Confident	85.1	Confident	46 Å²	46	64.8 Å²	64.8	32%	0.322	33%	0.333	S	S	.	.	H	α-helix	trans	-66.6	-41.6	177.3	53.1	0	0	0	0	112.3	W175 Y180 V181	W175-S177 PolarHBondContact O-N 2.93Å; S177-Y180 PolarHBondContact O-N 3.38Å; S177-V181 PolarHBondContact O-N 3.23Å
178	R	86.2	Confident	85.5	Confident	74 Å²	74	64.5 Å²	64.5	28%	0.279	33%	0.331	S	S	.	.	H	α-helix	trans	-59.8	-49.5	175.5	-69.7	176.3	175.5	165.5	1.8	112.1	W175 T182 V279	W175-R178 WeakPolarHBondContact O-CB 3.43Å; W175-R178 PolarHBondContact O-N 2.8Å; R178-T182 WeakPolarHBondContact O-CB 3.36Å; R178-T182 PolarHBondContact O-N 3.24Å; R178-T182 VanDerWaalsContact O-N 3.07Å; R178-T182 PolarHBondContact O-OG1 2.92Å; R178-V279 VanDerWaalsContact CA-CG1 3.41Å; R178-V279 HydrophobicContact CB-CG1 4.07Å; R178-V279 HydrophobicContact CG-CG1 3.57Å; R178-V279 WeakPolarHBondContact CG-O 3.29Å; R178-V279 PolarHBondContact NE-O 3.17Å
179	A	89.3	Confident	86	Confident	61 Å²	61	59.2 Å²	59.2	50%	0.504	31%	0.312	S	S	.	.	H	α-helix	trans	-62.1	-45.3	176.6	0	0	0	0	0	111.2	W175 W183	W175-A179 WeakPolarHBondContact O-CB 3.47Å; W175-A179 PolarHBondContact O-N 2.93Å; A179-W183 WeakPolarHBondContact O-CB 3.41Å; A179-W183 PolarHBondContact O-N 3.04Å
180	Y	88.6	Confident	86.7	Confident	37 Å²	37	61.9 Å²	61.9	15%	0.145	33%	0.326	C	S	.	.	H	α-helix	trans	-62.2	-51.4	-179.2	177.8	-98.2	0	0	0	113.4	Q149 V152 F171 G176 S177 W183 M184	Q149-Y180 VanDerWaalsContact NE2-CE2 3.32Å; Q149-Y180 PolarHBondContact NE2-OH 3.4Å; Q149-Y180 PolarHBondContact OE1-OH 2.96Å; V152-Y180 HydrophobicContact CG2-CD2 4.4Å; F171-Y180 AromaticContact CE1-CD1 3.96Å; F171-Y180 HydrophobicContact CE1-CD1 3.96Å; F171-Y180 HydrophobicContact CE1-CD2 4.2Å; F171-Y180 AromaticContact CE1-CG 3.66Å; F171-Y180 HydrophobicContact CE1-CG 3.66Å; F171-Y180 AromaticContact CZ-CD1 3.92Å; F171-Y180 HydrophobicContact CZ-CD1 3.92Å; F171-Y180 HydrophobicContact CZ-CE1 4.46Å; F171-Y180 HydrophobicContact CZ-CG 4.12Å; G176-Y180 WeakPolarHBondContact O-CB 3.1Å; G176-Y180 PolarHBondContact O-N 2.97Å; S177-Y180 PolarHBondContact O-N 3.38Å; Y180-W183 PolarHBondContact O-N 3.44Å; Y180-M184 HydrophobicContact CD1-CG 4.5Å; Y180-M184 HydrophobicContact CE1-CG 4.1Å; Y180-M184 HydrophobicContact CE2-CG 4.19Å; Y180-M184 WeakPolarHBondContact O-CB 3.35Å; Y180-M184 VanDerWaalsContact O-CG 3.26Å; Y180-M184 WeakPolarHBondContact O-CG 3.35Å; Y180-M184 PolarHBondContact O-N 3.44Å
181	V	88.3	Confident	87.5	Confident	14 Å²	14	60.2 Å²	60.2	9%	0.085	32%	0.32	C	S	.	.	H	α-helix	trans	-70.3	-34.8	-178.8	174.4	0	0	0	0	111.7	S177 M184 T185 Q275 M276 V279	S177-V181 PolarHBondContact O-N 3.23Å; V181-M184 PolarHBondContact O-N 3.42Å; V181-T185 WeakPolarHBondContact O-CB 3.27Å; V181-T185 PolarHBondContact O-N 2.95Å; V181-T185 PolarHBondContact O-OG1 3.32Å; V181-Q275 HydrophobicContact CG1-CB 3.84Å; V181-M276 HydrophobicContact CG1-SD 4.04Å; V181-V279 HydrophobicContact CB-CG1 4.41Å; V181-V279 HydrophobicContact CB-CG2 4.32Å; V181-V279 HydrophobicContact CG1-CG2 4.48Å; V181-V279 HydrophobicContact CG2-CG2 4.01Å
182	T	91.5	Very high	88	Confident	51 Å²	51	56.5 Å²	56.5	31%	0.313	30%	0.304	S	S	.	.	H	α-helix	trans	-66.4	-41.9	174	-54.3	0	0	0	0	111.4	R178 G186 M276 W280	R178-T182 WeakPolarHBondContact O-CB 3.36Å; R178-T182 PolarHBondContact O-N 3.24Å; R178-T182 VanDerWaalsContact O-N 3.07Å; R178-T182 PolarHBondContact O-OG1 2.92Å; T182-G186 PolarHBondContact O-N 3.15Å; T182-M276 HydrophobicContact CG2-CE 4.2Å; T182-W280 PolarHBondContact OG1-NE1 3.37Å
183	W	92.9	Very high	88.8	Confident	122 Å²	122	51.3 Å²	51.3	46%	0.462	28%	0.279	S	S	.	.	H	α-helix	trans	-60.3	-49.4	174.1	171.8	-102.6	0	0	0	112.1	L145 A179 Y180 T185 G186 G187	L145-W183 HydrophobicContact CB-CZ2 4.47Å; L145-W183 HydrophobicContact CD2-CH2 3.54Å; L145-W183 HydrophobicContact CD2-CZ2 3.32Å; L145-W183 HydrophobicContact CG-CZ2 4.47Å; A179-W183 WeakPolarHBondContact O-CB 3.41Å; A179-W183 PolarHBondContact O-N 3.04Å; Y180-W183 PolarHBondContact O-N 3.44Å; W183-T185 PolarHBondContact O-N 3.45Å; W183-G186 PolarHBondContact O-N 3.31Å; W183-G187 PolarHBondContact O-N 2.93Å
184	M	90.6	Very high	89.6	Confident	15 Å²	15	47.5 Å²	47.5	7%	0.074	27%	0.267	C	S	.	.	H	α-helix	trans	-60.8	-46.3	178.7	-72	-72.1	-74.5	0	0	111.6	V96 M99 F100 Y180 V181 I188	V96-M184 HydrophobicContact CB-CE 4.29Å; V96-M184 HydrophobicContact CG1-CE 3.67Å; V96-M184 HydrophobicContact CG1-SD 3.75Å; V96-M184 HydrophobicContact CG2-CE 3.72Å; M99-M184 HydrophobicContact CE-CE 3.75Å; F100-M184 HydrophobicContact CE2-SD 4.12Å; F100-M184 HydrophobicContact CZ-SD 4.26Å; Y180-M184 HydrophobicContact CD1-CG 4.5Å; Y180-M184 HydrophobicContact CE1-CG 4.1Å; Y180-M184 HydrophobicContact CE2-CG 4.19Å; Y180-M184 WeakPolarHBondContact O-CB 3.35Å; Y180-M184 VanDerWaalsContact O-CG 3.26Å; Y180-M184 WeakPolarHBondContact O-CG 3.35Å; Y180-M184 PolarHBondContact O-N 3.44Å; V181-M184 PolarHBondContact O-N 3.42Å; M184-I188 HydrophobicContact CE-CD1 3.53Å; M184-I188 VanDerWaalsContact O-CB 3.25Å; M184-I188 WeakPolarHBondContact O-CB 3.32Å; M184-I188 WeakPolarHBondContact O-CG1 3.32Å; M184-I188 PolarHBondContact O-N 3.5Å; M184-I188 HydrophobicContact SD-CD1 4.01Å
185	T	92.5	Very high	90.4	Very high	11 Å²	11	47.1 Å²	47.1	7%	0.067	26%	0.26	C	S	.	.	H	α-helix	trans	-62.9	-45	176.3	-57.3	0	0	0	0	111.9	V181 W183 F189 V190 F272 M276	V181-T185 WeakPolarHBondContact O-CB 3.27Å; V181-T185 PolarHBondContact O-N 2.95Å; V181-T185 PolarHBondContact O-OG1 3.32Å; W183-T185 PolarHBondContact O-N 3.45Å; T185-F189 WeakPolarHBondContact O-CB 3.32Å; T185-F189 PolarHBondContact O-N 3.14Å; T185-V190 HydrophobicContact CG2-CG2 4.21Å; T185-V190 PolarHBondContact O-N 2.94Å; T185-F272 HydrophobicContact CG2-CB 3.94Å; T185-F272 HydrophobicContact CG2-CD1 4.22Å; T185-F272 HydrophobicContact CG2-CG 4.25Å; T185-F272 WeakPolarHBondContact OG1-CD1 3.48Å; T185-M276 HydrophobicContact CG2-CG 3.89Å; T185-M276 HydrophobicContact CG2-SD 4.33Å
186	G	94.8	Very high	90.9	Very high	28 Å²	28	39.2 Å²	39.2	29%	0.289	23%	0.23	S	C	.	.	I	π-helix	trans	-62.1	-49.2	179.8	0	0	0	0	0	112.6	T182 W183 A191	T182-G186 PolarHBondContact O-N 3.15Å; W183-G186 PolarHBondContact O-N 3.31Å; G186-A191 WeakPolarHBondContact O-CB 3.39Å; G186-A191 PolarHBondContact O-N 3.33Å
187	G	92.8	Very high	91.2	Very high	11 Å²	11	40.6 Å²	40.6	11%	0.113	24%	0.244	C	C	.	.	I	π-helix	trans	-79.6	-36.9	-175.8	0	0	0	0	0	114.6	Y104 W183 P192	Y104-G187 PolarHBondContact OH-O 2.9Å; W183-G187 PolarHBondContact O-N 2.93Å; G187-P192 WeakPolarHBondContact O-CD 3.23Å
188	I	91.1	Very high	91.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.25	C	S	.	.	I	π-helix	trans	-83.5	-46.3	-179.1	-59.9	168.8	0	0	0	110.7	M99 F100 M184 P192 Y264 F272	M99-I188 HydrophobicContact CB-CD1 3.9Å; M99-I188 HydrophobicContact CB-CG2 4.41Å; M99-I188 HydrophobicContact CE-CD1 4.29Å; M99-I188 HydrophobicContact SD-CD1 4.41Å; F100-I188 HydrophobicContact CD1-CG1 3.57Å; F100-I188 HydrophobicContact CD2-CG1 4.36Å; F100-I188 HydrophobicContact CE1-CB 4.49Å; F100-I188 HydrophobicContact CE1-CD1 4.39Å; F100-I188 HydrophobicContact CE1-CG1 3.44Å; F100-I188 VanDerWaalsContact CE1-CG1 3.44Å; F100-I188 HydrophobicContact CE2-CD1 4.37Å; F100-I188 HydrophobicContact CE2-CG1 4.22Å; F100-I188 HydrophobicContact CG-CG1 4.06Å; F100-I188 HydrophobicContact CZ-CD1 4.27Å; F100-I188 HydrophobicContact CZ-CG1 3.78Å; M184-I188 HydrophobicContact CE-CD1 3.53Å; M184-I188 VanDerWaalsContact O-CB 3.25Å; M184-I188 WeakPolarHBondContact O-CB 3.32Å; M184-I188 WeakPolarHBondContact O-CG1 3.32Å; M184-I188 PolarHBondContact O-N 3.5Å; M184-I188 HydrophobicContact SD-CD1 4.01Å; I188-P192 WeakPolarHBondContact O-CD 3.33Å; I188-P192 WeakPolarHBondContact O-CG 3.21Å; I188-Y264 PolarHBondContact O-OH 3.42Å; I188-F272 HydrophobicContact CB-CE1 4.48Å; I188-F272 HydrophobicContact CB-CE2 4.19Å; I188-F272 HydrophobicContact CB-CZ 3.67Å; I188-F272 HydrophobicContact CD1-CZ 4.07Å; I188-F272 HydrophobicContact CG1-CZ 4.46Å; I188-F272 HydrophobicContact CG2-CE2 3.84Å; I188-F272 HydrophobicContact CG2-CZ 3.63Å
189	F	92.3	Very high	91.6	Very high	34 Å²	34	39.2 Å²	39.2	15%	0.149	24%	0.243	C	C	.	.	I	π-helix	trans	-102.6	-58.8	-171.4	179.9	-109.8	0	0	0	113.3	T185 V193 Y264 W268 A269 F272	T185-F189 WeakPolarHBondContact O-CB 3.32Å; T185-F189 PolarHBondContact O-N 3.14Å; F189-V193 HydrophobicContact CD2-CG2 4.05Å; F189-V193 HydrophobicContact CE2-CG2 3.94Å; F189-V193 HydrophobicContact CZ-CG2 4.32Å; F189-V193 WeakPolarHBondContact O-CB 3.43Å; F189-V193 VanDerWaalsContact O-CG2 3.24Å; F189-V193 WeakPolarHBondContact O-CG2 3.25Å; F189-V193 PolarHBondContact O-N 2.95Å; F189-Y264 HydrophobicContact CD2-CE1 4.19Å; F189-W268 HydrophobicContact CD2-CB 3.93Å; F189-W268 HydrophobicContact CE2-CB 4.34Å; F189-A269 HydrophobicContact CE2-CB 3.95Å; F189-A269 HydrophobicContact CZ-CB 3.7Å; F189-F272 HydrophobicContact CB-CD2 3.48Å; F189-F272 VanDerWaalsContact CB-CD2 3.48Å; F189-F272 HydrophobicContact CB-CE2 3.76Å; F189-F272 HydrophobicContact CB-CG 4.11Å; F189-F272 HydrophobicContact CD2-CD2 4.25Å; F189-F272 AromaticContact CG-CD2 3.93Å; F189-F272 HydrophobicContact CG-CD2 3.93Å
190	V	94.8	Very high	91.4	Very high	70 Å²	70	37.2 Å²	37.2	42%	0.424	22%	0.222	S	C	.	.	I	π-helix	trans	-65	-51	-169	-178.7	0	0	0	0	111.8	T185 V193 V194	T185-V190 HydrophobicContact CG2-CG2 4.21Å; T185-V190 PolarHBondContact O-N 2.94Å; V190-V193 PolarHBondContact O-N 3.06Å; V190-V194 HydrophobicContact CG1-CG2 4.4Å; V190-V194 WeakPolarHBondContact O-CG2 3.24Å; V190-V194 PolarHBondContact O-N 2.73Å
191	A	95.2	Very high	91.2	Very high	36 Å²	36	37.4 Å²	37.4	30%	0.298	24%	0.235	S	C	.	.	H	α-helix	trans	-62.5	-47.9	-177.8	0	0	0	0	0	112.3	G186 V194 I195	G186-A191 WeakPolarHBondContact O-CB 3.39Å; G186-A191 PolarHBondContact O-N 3.33Å; A191-V194 PolarHBondContact O-N 3.22Å; A191-I195 WeakPolarHBondContact O-CD1 3.42Å; A191-I195 VanDerWaalsContact O-CG1 3.25Å; A191-I195 WeakPolarHBondContact O-CG1 3.47Å; A191-I195 PolarHBondContact O-N 2.76Å
192	P	92.8	Very high	91	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-57	-49	170.7	-33.2	43.4	0	0	0	113.3	A103 Y104 V107 G187 I188 V194 I195 L196	A103-P192 HydrophobicContact CB-CB 4.33Å; A103-P192 HydrophobicContact CB-CG 3.93Å; Y104-P192 HydrophobicContact CE1-CG 4.44Å; V107-P192 HydrophobicContact CG2-CB 3.9Å; V107-P192 HydrophobicContact CG2-CG 4.44Å; G187-P192 WeakPolarHBondContact O-CD 3.23Å; I188-P192 WeakPolarHBondContact O-CD 3.33Å; I188-P192 WeakPolarHBondContact O-CG 3.21Å; P192-V194 VanDerWaalsContact C-N 3.3Å; P192-V194 PolarHBondContact O-N 2.85Å; P192-I195 PolarHBondContact O-N 3.43Å; P192-I195 VanDerWaalsContact O-N 3.16Å; P192-L196 HydrophobicContact CB-CD1 4.45Å; P192-L196 WeakPolarHBondContact O-CB 3.35Å; P192-L196 WeakPolarHBondContact O-CD1 3.33Å; P192-L196 WeakPolarHBondContact O-CG 3.37Å; P192-L196 PolarHBondContact O-N 3.17Å
193	V	93.2	Very high	90.5	Very high	40 Å²	40	39.9 Å²	39.9	24%	0.242	24%	0.241	C	C	.	.	H	α-helix	trans	-57.9	-40.4	179.9	170.4	0	0	0	0	112.5	F189 V190 G197 Y264 I265	F189-V193 HydrophobicContact CD2-CG2 4.05Å; F189-V193 HydrophobicContact CE2-CG2 3.94Å; F189-V193 HydrophobicContact CZ-CG2 4.32Å; F189-V193 WeakPolarHBondContact O-CB 3.43Å; F189-V193 VanDerWaalsContact O-CG2 3.24Å; F189-V193 WeakPolarHBondContact O-CG2 3.25Å; F189-V193 PolarHBondContact O-N 2.95Å; V190-V193 PolarHBondContact O-N 3.06Å; V193-G197 PolarHBondContact O-N 2.94Å; V193-Y264 HydrophobicContact CG2-CE1 4.2Å; V193-I265 HydrophobicContact CG1-CD1 4.42Å; V193-I265 HydrophobicContact CG2-CD1 4.35Å; V193-I265 HydrophobicContact CG2-CG1 3.85Å
194	V	94.2	Very high	89.8	Confident	88 Å²	88	37.8 Å²	37.8	53%	0.533	24%	0.244	S	C	.	.	H	α-helix	trans	-66.7	-44.6	176.3	171.7	0	0	0	0	112	V190 A191 P192 G197 T198	V190-V194 HydrophobicContact CG1-CG2 4.4Å; V190-V194 WeakPolarHBondContact O-CG2 3.24Å; V190-V194 PolarHBondContact O-N 2.73Å; A191-V194 PolarHBondContact O-N 3.22Å; P192-V194 VanDerWaalsContact C-N 3.3Å; P192-V194 PolarHBondContact O-N 2.85Å; V194-G197 PolarHBondContact O-N 2.92Å; V194-T198 WeakPolarHBondContact O-CG2 3.42Å; V194-T198 PolarHBondContact O-N 3.26Å; V194-T198 PolarHBondContact O-OG1 2.9Å
195	I	92.8	Very high	89.3	Confident	65 Å²	65	43.7 Å²	43.7	33%	0.333	27%	0.266	S	S	.	.	H	α-helix	trans	-64.9	-42.6	178.5	-62.9	161.8	0	0	0	110.3	V107 A191 P192 T198 C199	V107-I195 HydrophobicContact CG1-CB 4.36Å; V107-I195 HydrophobicContact CG1-CD1 4.45Å; V107-I195 HydrophobicContact CG1-CG2 3.58Å; V107-I195 HydrophobicContact CG2-CB 4.46Å; V107-I195 HydrophobicContact CG2-CG2 4.46Å; A191-I195 WeakPolarHBondContact O-CD1 3.42Å; A191-I195 VanDerWaalsContact O-CG1 3.25Å; A191-I195 WeakPolarHBondContact O-CG1 3.47Å; A191-I195 PolarHBondContact O-N 2.76Å; P192-I195 PolarHBondContact O-N 3.43Å; P192-I195 VanDerWaalsContact O-N 3.16Å; I195-T198 PolarHBondContact O-OG1 3.37Å; I195-C199 WeakPolarHBondContact O-CB 3.45Å; I195-C199 PolarHBondContact O-N 3.43Å; I195-C199 PolarHBondContact O-SG 2.83Å; I195-C199 VanDerWaalsContact O-SG 3.38Å
196	L	90.1	Very high	88.5	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-62.8	-52	177.2	-63.3	166.9	0	0	0	110.5	L106 V107 T110 P192 T198 C199 Y200 V261	L106-L196 HydrophobicContact CD2-CD1 3.57Å; L106-L196 HydrophobicContact CD2-CD2 3.39Å; L106-L196 HydrophobicContact CD2-CG 4.11Å; V107-L196 HydrophobicContact CG2-CD2 4.11Å; V107-L196 HydrophobicContact CG2-CG 4.17Å; T110-L196 HydrophobicContact CG2-CD2 3.68Å; T110-L196 WeakPolarHBondContact OG1-CD2 3.17Å; P192-L196 HydrophobicContact CB-CD1 4.45Å; P192-L196 WeakPolarHBondContact O-CB 3.35Å; P192-L196 WeakPolarHBondContact O-CD1 3.33Å; P192-L196 WeakPolarHBondContact O-CG 3.37Å; P192-L196 PolarHBondContact O-N 3.17Å; L196-T198 VanDerWaalsContact C-N 3.33Å; L196-T198 PolarHBondContact O-N 2.92Å; L196-C199 PolarHBondContact O-N 3.01Å; L196-Y200 WeakPolarHBondContact O-CD2 3.33Å; L196-Y200 PolarHBondContact O-N 2.86Å; L196-V261 HydrophobicContact CB-CG1 4.21Å; L196-V261 HydrophobicContact CD1-CG1 4.11Å; L196-V261 HydrophobicContact CD1-CG2 4.31Å; L196-V261 HydrophobicContact CD2-CG2 4.18Å
197	G	89.5	Confident	87.6	Confident	46 Å²	46	46.8 Å²	46.8	47%	0.474	28%	0.275	S	S	.	.	H	α-helix	trans	-56.5	-43.6	179.6	0	0	0	0	0	113	V193 V194 G201	V193-G197 PolarHBondContact O-N 2.94Å; V194-G197 PolarHBondContact O-N 2.92Å; G197-G201 PolarHBondContact O-N 3.01Å
198	T	89.8	Confident	86.8	Confident	73 Å²	73	53 Å²	53	45%	0.448	30%	0.295	S	S	.	.	H	α-helix	trans	-66.8	-45.2	175.8	52	0	0	0	0	112.1	V194 I195 L196 Y200 G201 F202	V194-T198 WeakPolarHBondContact O-CG2 3.42Å; V194-T198 PolarHBondContact O-N 3.26Å; V194-T198 PolarHBondContact O-OG1 2.9Å; I195-T198 PolarHBondContact O-OG1 3.37Å; L196-T198 VanDerWaalsContact C-N 3.33Å; L196-T198 PolarHBondContact O-N 2.92Å; T198-Y200 PolarHBondContact O-N 3.05Å; T198-G201 PolarHBondContact O-N 3.17Å; T198-F202 WeakPolarHBondContact O-CD2 3.41Å; T198-F202 PolarHBondContact O-N 2.94Å
199	C	87.4	Confident	86.1	Confident	18 Å²	18	55.1 Å²	55.1	12%	0.122	31%	0.31	C	S	.	.	H	α-helix	trans	-57.4	-45.8	174.5	-76.8	0	0	0	0	112.6	I195 L196 F202 I203	I195-C199 WeakPolarHBondContact O-CB 3.45Å; I195-C199 PolarHBondContact O-N 3.43Å; I195-C199 PolarHBondContact O-SG 2.83Å; I195-C199 VanDerWaalsContact O-SG 3.38Å; L196-C199 PolarHBondContact O-N 3.01Å; C199-F202 PolarHBondContact O-N 3.29Å; C199-I203 VanDerWaalsContact O-CG1 3.31Å; C199-I203 WeakPolarHBondContact O-CG1 3.08Å; C199-I203 PolarHBondContact O-N 3.43Å
200	Y	84.8	Confident	85.1	Confident	20 Å²	20	56.1 Å²	56.1	8%	0.078	32%	0.317	C	S	.	.	H	α-helix	trans	-66.8	-38.3	175.7	-76.5	-69.8	0	0	0	113	T110 L196 T198 F202 I203 C204 T257 F258 V261	T110-Y200 HydrophobicContact CG2-CE2 3.98Å; T110-Y200 WeakPolarHBondContact CG2-OH 3.36Å; L196-Y200 WeakPolarHBondContact O-CD2 3.33Å; L196-Y200 PolarHBondContact O-N 2.86Å; T198-Y200 PolarHBondContact O-N 3.05Å; Y200-F202 VanDerWaalsContact C-N 3.33Å; Y200-F202 PolarHBondContact O-N 3.07Å; Y200-I203 HydrophobicContact CD1-CD1 4.11Å; Y200-I203 HydrophobicContact CE1-CD1 4.3Å; Y200-I203 PolarHBondContact O-N 3.24Å; Y200-C204 WeakPolarHBondContact O-CB 3.19Å; Y200-C204 PolarHBondContact O-N 3.42Å; Y200-C204 PolarHBondContact O-SG 2.76Å; Y200-C204 VanDerWaalsContact O-SG 3.37Å; Y200-T257 WeakPolarHBondContact OH-CB 3.14Å; Y200-T257 PolarHBondContact OH-O 2.96Å; Y200-T257 PolarHBondContact OH-OG1 2.97Å; Y200-F258 HydrophobicContact CE1-CB 4.4Å; Y200-F258 PolarHBondContact OH-N 3.19Å; Y200-V261 HydrophobicContact CE2-CB 4.27Å; Y200-V261 HydrophobicContact CE2-CG1 4.37Å; Y200-V261 HydrophobicContact CE2-CG2 3.5Å; Y200-V261 VanDerWaalsContact CE2-CG2 3.5Å
201	G	84	Confident	84	Confident	40 Å²	40	56.9 Å²	56.9	41%	0.412	32%	0.321	S	S	.	.	H	α-helix	trans	-54.1	-49	172.4	0	0	0	0	0	111.8	G197 T198 C204 Y205	G197-G201 PolarHBondContact O-N 3.01Å; T198-G201 PolarHBondContact O-N 3.17Å; G201-C204 PolarHBondContact O-N 3.04Å; G201-Y205 VanDerWaalsContact O-CB 3.29Å; G201-Y205 WeakPolarHBondContact O-CB 3.22Å; G201-Y205 PolarHBondContact O-N 3.3Å
202	F	83.8	Confident	82.9	Confident	115 Å²	115	62.8 Å²	62.8	50%	0.504	34%	0.336	S	S	.	.	H	α-helix	trans	-66.2	-36.2	176.2	-74.4	-64.9	0	0	0	113.7	Y114 T198 C199 Y200 N206	Y114-F202 HydrophobicContact CD2-CB 4.44Å; Y114-F202 HydrophobicContact CE2-CB 3.8Å; T198-F202 WeakPolarHBondContact O-CD2 3.41Å; T198-F202 PolarHBondContact O-N 2.94Å; C199-F202 PolarHBondContact O-N 3.29Å; Y200-F202 VanDerWaalsContact C-N 3.33Å; Y200-F202 PolarHBondContact O-N 3.07Å; F202-N206 WeakPolarHBondContact O-CB 3.33Å; F202-N206 PolarHBondContact O-N 2.84Å; F202-N206 PolarHBondContact O-ND2 3.07Å
203	I	80.4	Confident	81.7	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-62.1	-52.1	173.7	-68	165.1	0	0	0	110	Y114 C199 Y200 Y205 N206 I207 V254	Y114-I203 HydrophobicContact CD2-CG1 3.83Å; C199-I203 VanDerWaalsContact O-CG1 3.31Å; C199-I203 WeakPolarHBondContact O-CG1 3.08Å; C199-I203 PolarHBondContact O-N 3.43Å; Y200-I203 HydrophobicContact CD1-CD1 4.11Å; Y200-I203 HydrophobicContact CE1-CD1 4.3Å; Y200-I203 PolarHBondContact O-N 3.24Å; I203-Y205 PolarHBondContact O-N 2.85Å; I203-N206 PolarHBondContact O-N 3.39Å; I203-I207 HydrophobicContact CG2-CD1 3.7Å; I203-I207 VanDerWaalsContact O-CG1 3.29Å; I203-I207 WeakPolarHBondContact O-CG1 3.47Å; I203-I207 PolarHBondContact O-N 3.1Å; I203-V254 HydrophobicContact CG2-CG1 4.13Å; I203-V254 HydrophobicContact CG2-CG2 4.45Å
204	C	78.6	Confident	80.4	Confident	78 Å²	78	67.6 Å²	67.6	53%	0.527	37%	0.366	S	S	.	.	H	α-helix	trans	-61.7	-43.9	-179.1	-70.8	0	0	0	0	111.9	Y200 G201 I207 W208	Y200-C204 WeakPolarHBondContact O-CB 3.19Å; Y200-C204 PolarHBondContact O-N 3.42Å; Y200-C204 PolarHBondContact O-SG 2.76Å; Y200-C204 VanDerWaalsContact O-SG 3.37Å; G201-C204 PolarHBondContact O-N 3.04Å; C204-I207 PolarHBondContact O-N 3.1Å; C204-W208 WeakPolarHBondContact O-CB 3.15Å; C204-W208 PolarHBondContact O-N 3.42Å
205	Y	80.8	Confident	78.7	Confident	140 Å²	140	67.3 Å²	67.3	55%	0.549	37%	0.365	S	S	.	.	H	α-helix	trans	-59.9	-49.5	175.5	-179.6	-99	0	0	0	112	G201 I203 I207 W208 C209	G201-Y205 VanDerWaalsContact O-CB 3.29Å; G201-Y205 WeakPolarHBondContact O-CB 3.22Å; G201-Y205 PolarHBondContact O-N 3.3Å; I203-Y205 PolarHBondContact O-N 2.85Å; Y205-I207 VanDerWaalsContact C-N 3.32Å; Y205-I207 PolarHBondContact O-N 3.43Å; Y205-W208 PolarHBondContact O-N 3.2Å; Y205-C209 PolarHBondContact O-N 2.86Å; Y205-C209 PolarHBondContact O-SG 3.43Å; Y205-C209 VanDerWaalsContact O-SG 3.42Å
206	N	75.9	Confident	77.2	Confident	53 Å²	53	67.1 Å²	67.1	28%	0.283	37%	0.372	S	S	.	.	H	α-helix	trans	-60	-40.9	177.2	-86.7	-76.1	0	0	0	112.1	F202 I203 N210	F202-N206 WeakPolarHBondContact O-CB 3.33Å; F202-N206 PolarHBondContact O-N 2.84Å; F202-N206 PolarHBondContact O-ND2 3.07Å; I203-N206 PolarHBondContact O-N 3.39Å; N206-N210 VanDerWaalsContact O-CB 3.32Å; N206-N210 WeakPolarHBondContact O-CB 3.42Å; N206-N210 PolarHBondContact O-N 3.32Å; N206-N210 VanDerWaalsContact O-N 3.11Å; N206-N210 PolarHBondContact O-ND2 3.3Å
207	I	76.1	Confident	75.7	Confident	50 Å²	50	70.2 Å²	70.2	26%	0.256	39%	0.394	S	S	.	.	H	α-helix	trans	-64.7	-46.5	176.5	-67.6	168.6	0	0	0	110.3	I203 C204 Y205 N210 V211 I246	I203-I207 HydrophobicContact CG2-CD1 3.7Å; I203-I207 VanDerWaalsContact O-CG1 3.29Å; I203-I207 WeakPolarHBondContact O-CG1 3.47Å; I203-I207 PolarHBondContact O-N 3.1Å; C204-I207 PolarHBondContact O-N 3.1Å; Y205-I207 VanDerWaalsContact C-N 3.32Å; Y205-I207 PolarHBondContact O-N 3.43Å; I207-N210 PolarHBondContact O-N 2.81Å; I207-V211 HydrophobicContact CG2-CG2 4.45Å; I207-V211 WeakPolarHBondContact O-CG2 3.29Å; I207-V211 PolarHBondContact O-N 2.82Å; I207-I246 HydrophobicContact CG1-CD1 3.98Å; I207-I246 HydrophobicContact CG2-CD1 4.49Å
208	W	76.1	Confident	74.1	Confident	141 Å²	141	78.2 Å²	78.2	53%	0.534	41%	0.41	S	S	.	.	H	α-helix	trans	-61.9	-47.5	-179.6	-180	78.3	0	0	0	112.6	C204 Y205 N210 V211 R212	C204-W208 WeakPolarHBondContact O-CB 3.15Å; C204-W208 PolarHBondContact O-N 3.42Å; Y205-W208 PolarHBondContact O-N 3.2Å; W208-N210 VanDerWaalsContact C-N 3.34Å; W208-N210 PolarHBondContact O-N 2.82Å; W208-V211 PolarHBondContact O-N 2.8Å; W208-R212 VanDerWaalsContact CZ2-NH1 3.27Å; W208-R212 WeakPolarHBondContact O-CB 3.36Å; W208-R212 PolarHBondContact O-N 3.47Å
209	C	75.1	Confident	72.4	Confident	46 Å²	46	81.9 Å²	81.9	31%	0.311	42%	0.422	S	S	.	.	H	α-helix	trans	-59.5	-42.9	175	-69.5	0	0	0	0	111.9	Y205 V211 R212 G213	Y205-C209 PolarHBondContact O-N 2.86Å; Y205-C209 PolarHBondContact O-SG 3.43Å; Y205-C209 VanDerWaalsContact O-SG 3.42Å; C209-V211 PolarHBondContact O-N 2.87Å; C209-R212 PolarHBondContact O-N 3.46Å; C209-G213 PolarHBondContact O-N 2.89Å
210	N	71.8	Confident	70.7	Confident	54 Å²	54	84.6 Å²	84.6	29%	0.289	44%	0.441	S	S	.	.	H	α-helix	trans	-66.3	-33.1	177.5	-84.7	-64.6	0	0	0	113.6	N206 I207 W208 K214 V243	N206-N210 VanDerWaalsContact O-CB 3.32Å; N206-N210 WeakPolarHBondContact O-CB 3.42Å; N206-N210 PolarHBondContact O-N 3.32Å; N206-N210 VanDerWaalsContact O-N 3.11Å; N206-N210 PolarHBondContact O-ND2 3.3Å; I207-N210 PolarHBondContact O-N 2.81Å; W208-N210 VanDerWaalsContact C-N 3.34Å; W208-N210 PolarHBondContact O-N 2.82Å; N210-K214 WeakPolarHBondContact O-CD 3.49Å; N210-K214 WeakPolarHBondContact O-CG 3.47Å; N210-K214 PolarHBondContact O-N 3.3Å; N210-V243 WeakPolarHBondContact OD1-CG1 3.39Å
211	V	71.9	Confident	69.1	Low	86 Å²	86	90.1 Å²	90.1	52%	0.521	47%	0.466	S	S	.	.	H	α-helix	trans	-72.7	-48.7	173.6	171.3	0	0	0	0	110.3	I207 W208 C209 G213 K214 T215	I207-V211 HydrophobicContact CG2-CG2 4.45Å; I207-V211 WeakPolarHBondContact O-CG2 3.29Å; I207-V211 PolarHBondContact O-N 2.82Å; W208-V211 PolarHBondContact O-N 2.8Å; C209-V211 PolarHBondContact O-N 2.87Å; V211-G213 PolarHBondContact O-N 3.05Å; V211-K214 PolarHBondContact O-N 3.36Å; V211-K214 VanDerWaalsContact O-N 3.07Å; V211-T215 PolarHBondContact O-N 3.2Å; V211-T215 PolarHBondContact O-OG1 3.17Å
212	R	72.6	Confident	67.3	Low	160 Å²	160	90.8 Å²	90.8	60%	0.604	47%	0.472	S	S	*	.	H	α-helix	trans	-60.3	-42	-178.7	-170.5	171.6	178.7	168.7	-0.6	112.4	W208 C209 K214 T215 A216	W208-R212 VanDerWaalsContact CZ2-NH1 3.27Å; W208-R212 WeakPolarHBondContact O-CB 3.36Å; W208-R212 PolarHBondContact O-N 3.47Å; C209-R212 PolarHBondContact O-N 3.46Å; R212-K214 VanDerWaalsContact C-N 3.34Å; R212-K214 PolarHBondContact O-N 2.81Å; R212-T215 PolarHBondContact O-N 2.9Å; R212-A216 PolarHBondContact O-N 3.44Å; R212-A216 VanDerWaalsContact O-N 3.07Å
213	G	67.7	Low	65.6	Low	44 Å²	44	88.9 Å²	88.9	45%	0.454	48%	0.478	S	S	.	.	H	α-helix	trans	-63.5	-35.5	174.1	0	0	0	0	0	113.7	C209 V211 S217	C209-G213 PolarHBondContact O-N 2.89Å; V211-G213 PolarHBondContact O-N 3.05Å; G213-S217 WeakPolarHBondContact O-CB 3.47Å; G213-S217 PolarHBondContact O-N 3.19Å
214	K	64.4	Low	63.9	Low	99 Å²	99	95.7 Å²	95.7	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-70.9	-36.1	176.1	-76.9	172.9	-179.4	171.8	0	112.5	N210 V211 R212 R218 V243	N210-K214 WeakPolarHBondContact O-CD 3.49Å; N210-K214 WeakPolarHBondContact O-CG 3.47Å; N210-K214 PolarHBondContact O-N 3.3Å; V211-K214 PolarHBondContact O-N 3.36Å; V211-K214 VanDerWaalsContact O-N 3.07Å; R212-K214 VanDerWaalsContact C-N 3.34Å; R212-K214 PolarHBondContact O-N 2.81Å; K214-R218 PolarHBondContact O-N 3.1Å; K214-R218 VanDerWaalsContact O-N 3.13Å; K214-V243 PolarHBondContact NZ-O 3.23Å
215	T	60	Low	62.2	Low	82 Å²	82	100.3 Å²	100.3	50%	0.503	52%	0.524	S	S	.	.	H	α-helix	trans	-66.1	-46.7	173.6	-52.7	0	0	0	0	111.4	V211 R212 S217 R218 Q219	V211-T215 PolarHBondContact O-N 3.2Å; V211-T215 PolarHBondContact O-OG1 3.17Å; R212-T215 PolarHBondContact O-N 2.9Å; T215-S217 PolarHBondContact O-N 2.91Å; T215-R218 PolarHBondContact O-N 3.06Å; T215-Q219 PolarHBondContact O-N 3.1Å
216	A	60.3	Low	60.4	Low	60 Å²	60	98.3 Å²	98.3	50%	0.496	54%	0.536	S	S	.	.	H	α-helix	trans	-60.7	-44.4	177.9	0	0	0	0	0	112.7	R212 R218 Q219 S220	R212-A216 PolarHBondContact O-N 3.44Å; R212-A216 VanDerWaalsContact O-N 3.07Å; A216-R218 VanDerWaalsContact C-N 3.35Å; A216-R218 PolarHBondContact O-N 3.23Å; A216-Q219 PolarHBondContact O-N 3.42Å; A216-S220 PolarHBondContact O-N 3.07Å; A216-S220 VanDerWaalsContact O-N 3.08Å
217	S	59.1	Low	58.8	Low	68 Å²	68	97.9 Å²	97.9	48%	0.476	55%	0.545	S	S	.	.	H	α-helix	trans	-65.3	-34.9	177.4	-177.3	0	0	0	0	113.1	G213 T215 K221	G213-S217 WeakPolarHBondContact O-CB 3.47Å; G213-S217 PolarHBondContact O-N 3.19Å; T215-S217 PolarHBondContact O-N 2.91Å; S217-K221 PolarHBondContact O-N 2.72Å
218	R	55.4	Low	57.1	Low	214 Å²	214	101.8 Å²	101.8	81%	0.808	57%	0.57	S	S	*	*	H	α-helix	trans	-65.9	-40.7	172.6	-101.1	-177.4	163.5	-172.9	-7.1	112.4	K214 T215 A216 K221 G222	K214-R218 PolarHBondContact O-N 3.1Å; K214-R218 VanDerWaalsContact O-N 3.13Å; T215-R218 PolarHBondContact O-N 3.06Å; A216-R218 VanDerWaalsContact C-N 3.35Å; A216-R218 PolarHBondContact O-N 3.23Å; R218-K221 PolarHBondContact O-N 3.47Å; R218-G222 PolarHBondContact O-N 3.44Å; R218-G222 VanDerWaalsContact O-N 3.09Å
219	Q	53.1	Low	55.5	Low	149 Å²	149	100.2 Å²	100.2	70%	0.696	59%	0.587	S	S	*	*	H	α-helix	trans	-68.5	-39.1	-178.4	-163.8	168.3	5.2	0	0	112	T215 A216 G222 A223	T215-Q219 PolarHBondContact O-N 3.1Å; A216-Q219 PolarHBondContact O-N 3.42Å; Q219-G222 PolarHBondContact O-N 2.94Å; Q219-A223 PolarHBondContact O-N 3.44Å
220	S	51.8	Low	53.6	Low	75 Å²	75	105.4 Å²	105.4	52%	0.524	61%	0.605	S	S	.	*	H	α-helix	trans	-60.1	-45.1	173.5	-165.4	0	0	0	0	112.5	A216 G222 A223 E224	A216-S220 PolarHBondContact O-N 3.07Å; A216-S220 VanDerWaalsContact O-N 3.08Å; S220-G222 VanDerWaalsContact C-N 3.35Å; S220-G222 PolarHBondContact O-N 2.89Å; S220-A223 PolarHBondContact O-N 2.65Å; S220-E224 PolarHBondContact O-N 3.42Å
221	K	52.5	Low	52	Low	137 Å²	137	109.1 Å²	109.1	60%	0.596	62%	0.62	S	S	*	*	H	α-helix	trans	-72	-25.7	179.9	-71.3	-172.2	172.3	-169.4	0	114	S217 R218 A223 Q225	S217-K221 PolarHBondContact O-N 2.72Å; R218-K221 PolarHBondContact O-N 3.47Å; K221-A223 VanDerWaalsContact C-N 3.32Å; K221-Q225 PolarHBondContact O-N 3.36Å
222	G	46.5	Very low	50.1	Low	53 Å²	53	114 Å²	114	55%	0.546	64%	0.635	S	S	.	*	H	α-helix	trans	-70.6	-26	174.9	0	0	0	0	0	113.8	R218 Q219 S220	R218-G222 PolarHBondContact O-N 3.44Å; R218-G222 VanDerWaalsContact O-N 3.09Å; Q219-G222 PolarHBondContact O-N 2.94Å; S220-G222 VanDerWaalsContact C-N 3.35Å; S220-G222 PolarHBondContact O-N 2.89Å
223	A	47.2	Very low	48.8	Very low	76 Å²	76	110.1 Å²	110.1	63%	0.628	65%	0.645	S	S	*	*	H	α-helix	trans	-81.9	-36.8	176.4	0	0	0	0	0	112.7	Q219 S220 K221 Q225	Q219-A223 PolarHBondContact O-N 3.44Å; S220-A223 PolarHBondContact O-N 2.65Å; K221-A223 VanDerWaalsContact C-N 3.32Å; A223-Q225 PolarHBondContact O-N 3.34Å
224	E	44.5	Very low	47.1	Very low	144 Å²	144	117 Å²	117	67%	0.673	66%	0.663	S	S	*	*	H	α-helix	trans	-73.5	-19.1	179.6	-87.5	179.9	136.7	0	0	114.5	S220 A226 G227	S220-E224 PolarHBondContact O-N 3.42Å; E224-A226 VanDerWaalsContact C-N 3.32Å; E224-A226 PolarHBondContact O-N 3.37Å; E224-G227 VanDerWaalsContact O-O 3.05Å
225	Q	43	Very low	45.7	Very low	175 Å²	175	118.8 Å²	118.8	82%	0.818	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-3.3	179.7	-82	-176.2	-51.8	0	0	114.8	K221 A223	K221-Q225 PolarHBondContact O-N 3.36Å; A223-Q225 PolarHBondContact O-N 3.34Å
226	A	43.7	Very low	44.8	Very low	98 Å²	98	122.7 Å²	122.7	81%	0.81	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-2.8	175.2	0	0	0	0	0	113.8	E224	E224-A226 VanDerWaalsContact C-N 3.32Å; E224-A226 PolarHBondContact O-N 3.37Å
227	G	42	Very low	43.6	Very low	45 Å²	45	123.4 Å²	123.4	46%	0.464	70%	0.699	S	S	.	*	S	Bend	trans	-149.9	158.6	179.4	0	0	0	0	0	112.9	E224	E224-G227 VanDerWaalsContact O-O 3.05Å
228	V	39.5	Very low	42.5	Very low	132 Å²	132	125 Å²	125	80%	0.8	71%	0.708	S	S	*	*			trans	70	69.2	174.5	-160.4	0	0	0	0	115.5	F230	V228-F230 HydrophobicContact CG1-CB 4.26Å; V228-F230 PolarHBondContact O-N 3.23Å
229	A	43.3	Very low	41.7	Very low	107 Å²	107	120 Å²	120	88%	0.884	70%	0.704	S	S	*	*			trans	-76.8	72.8	143.4	0	0	0	0	0	110
230	F	35.9	Very low	40.9	Very low	156 Å²	156	119.2 Å²	119.2	68%	0.684	71%	0.709	S	S	*	*			trans	-153	105.5	168.6	-152.7	-107.5	0	0	0	115.7	V228	V228-F230 HydrophobicContact CG1-CB 4.26Å; V228-F230 PolarHBondContact O-N 3.23Å
231	Q	36.7	Very low	40.2	Very low	131 Å²	131	121 Å²	121	61%	0.612	72%	0.721	S	S	*	*			trans	65.2	129.2	137.2	-163.2	168.4	86.3	0	0	122.8
232	K	33.2	Very low	39.5	Very low	189 Å²	189	118.7 Å²	118.7	82%	0.822	72%	0.723	S	S	*	*			trans	69.1	119.3	158.3	-79.8	166.4	-174.4	172	0	117.9
233	G	45.8	Very low	39.5	Very low	79 Å²	79	120.2 Å²	120.2	81%	0.814	72%	0.721	S	S	*	*			trans	-94.8	158.1	173.8	0	0	0	0	0	113.4
234	F	31.8	Very low	39.6	Very low	189 Å²	189	124.7 Å²	124.7	83%	0.829	73%	0.727	S	S	*	*			trans	-150.1	137	155.6	-170.4	-123.9	0	0	0	108.8
235	L	34.1	Very low	39.9	Very low	135 Å²	135	122.7 Å²	122.7	71%	0.707	73%	0.728	S	S	*	*			trans	51.7	87.7	173.7	-57.8	-176.6	0	0	0	117.9	A237	L235-A237 PolarHBondContact O-N 3.26Å
236	L	41.5	Very low	40.6	Very low	165 Å²	165	117.1 Å²	117.1	86%	0.864	70%	0.703	S	S	*	*			trans	-57.6	94.5	156.1	-157.6	148.6	0	0	0	109.9	P238	L236-P238 VanDerWaalsContact O-CD 3.23Å; L236-P238 WeakPolarHBondContact O-CD 3.41Å
237	A	35.9	Very low	41.5	Very low	75 Å²	75	115.5 Å²	115.5	62%	0.62	69%	0.687	S	S	*	*			trans	-86.5	108	166.1	0	0	0	0	0	108.9	L235 C239	L235-A237 PolarHBondContact O-N 3.26Å; A237-C239 PolarHBondContact O-N 3.28Å
238	P	35.6	Very low	42.4	Very low	102 Å²	102	124.3 Å²	124.3	66%	0.662	71%	0.706	S	S	*	*			trans	-75.9	76.2	175	32.7	-34.8	0	0	0	109.3	L236 V240	L236-P238 VanDerWaalsContact O-CD 3.23Å; L236-P238 WeakPolarHBondContact O-CD 3.41Å; P238-V240 WeakPolarHBondContact O-CG2 3.28Å; P238-V240 PolarHBondContact O-N 3.43Å
239	C	38.2	Very low	43.2	Very low	108 Å²	108	120.8 Å²	120.8	73%	0.73	69%	0.691	S	S	*	*			trans	-55.3	111.2	171	-73.5	0	0	0	0	108.8	A237 S241	A237-C239 PolarHBondContact O-N 3.28Å; C239-S241 PolarHBondContact O-N 3.11Å
240	V	36.1	Very low	44.3	Very low	132 Å²	132	119.4 Å²	119.4	80%	0.8	67%	0.665	S	S	*	*			trans	-71.4	70.7	-171.8	-172.5	0	0	0	0	110.6	P238 S242	P238-V240 WeakPolarHBondContact O-CG2 3.28Å; P238-V240 PolarHBondContact O-N 3.43Å; V240-S242 PolarHBondContact O-N 3.46Å
241	S	37.1	Very low	45.9	Very low	112 Å²	112	116.6 Å²	116.6	78%	0.783	66%	0.656	S	S	*	*			trans	-76.4	38	171.6	58.4	0	0	0	0	111.9	C239 V243	C239-S241 PolarHBondContact O-N 3.11Å; S241-V243 PolarHBondContact O-N 3.35Å
242	S	38.4	Very low	47.5	Very low	90 Å²	90	116.3 Å²	116.3	63%	0.629	65%	0.649	S	S	*	*			trans	-80.1	34.6	175.7	-157.4	0	0	0	0	112.3	V240 K244	V240-S242 PolarHBondContact O-N 3.46Å; S242-K244 PolarHBondContact O-N 3.16Å
243	V	47	Very low	49	Very low	84 Å²	84	109.4 Å²	109.4	51%	0.509	62%	0.623	S	S	.	*			trans	-77.1	77.9	158.8	-170	0	0	0	0	107.1	N210 K214 S241	N210-V243 WeakPolarHBondContact OD1-CG1 3.39Å; K214-V243 PolarHBondContact NZ-O 3.23Å; S241-V243 PolarHBondContact O-N 3.35Å
244	K	48.4	Very low	50.3	Low	171 Å²	171	106.8 Å²	106.8	74%	0.743	59%	0.591	S	S	*	*			trans	-28.1	137.2	178	-112.4	167.2	177.1	166.6	0	111.5	S242 I246	S242-K244 PolarHBondContact O-N 3.16Å; K244-I246 PolarHBondContact O-N 2.91Å
245	S	50.1	Low	52.4	Low	102 Å²	102	104.3 Å²	104.3	71%	0.713	58%	0.58	S	S	*	*			trans	-43.8	121.3	157.9	39.6	0	0	0	0	108.3	S247	S245-S247 PolarHBondContact O-N 3.17Å
246	I	58.3	Low	54.3	Low	57 Å²	57	98.6 Å²	98.6	29%	0.292	55%	0.55	S	S	.	.			trans	-63.6	109.6	-178.2	-59.5	179	0	0	0	105.7	I207 K244 R248 K250 I251	I207-I246 HydrophobicContact CG1-CD1 3.98Å; I207-I246 HydrophobicContact CG2-CD1 4.49Å; K244-I246 PolarHBondContact O-N 2.91Å; I246-R248 PolarHBondContact O-N 3.48Å; I246-K250 HydrophobicContact CG2-CB 3.95Å; I246-I251 HydrophobicContact CB-CD1 4.42Å; I246-I251 HydrophobicContact CG2-CD1 4.11Å; I246-I251 HydrophobicContact CG2-CG1 3.78Å
247	S	62.8	Low	56	Low	65 Å²	65	91.2 Å²	91.2	46%	0.455	51%	0.512	S	S	.	.			trans	-55.1	140.7	-176.1	173.6	0	0	0	0	109.7	S245 A249 K250 I251	S245-S247 PolarHBondContact O-N 3.17Å; S247-A249 PolarHBondContact O-N 3.25Å; S247-A249 PolarHBondContact OG-N 2.83Å; S247-K250 WeakPolarHBondContact O-CB 3.09Å; S247-K250 PolarHBondContact O-N 3.26Å; S247-I251 PolarHBondContact O-N 3.24Å
248	R	60.3	Low	58.2	Low	229 Å²	229	93.1 Å²	93.1	86%	0.864	51%	0.506	S	S	*	.	H	α-helix	trans	-52.7	-30.8	175.1	-65	-173.6	-179.9	-160.6	1.2	111.3	I246 I251 R252	I246-R248 PolarHBondContact O-N 3.48Å; R248-I251 PolarHBondContact O-N 3.24Å; R248-R252 VanDerWaalsContact O-CB 3.27Å; R248-R252 WeakPolarHBondContact O-CB 3.32Å; R248-R252 PolarHBondContact O-N 2.75Å
249	A	57.4	Low	60.5	Low	59 Å²	59	91.5 Å²	91.5	49%	0.488	49%	0.494	S	S	.	.	H	α-helix	trans	-63.2	-37	173	0	0	0	0	0	113.9	S247 R252 T253	S247-A249 PolarHBondContact O-N 3.25Å; S247-A249 PolarHBondContact OG-N 2.83Å; A249-R252 WeakPolarHBondContact O-CB 3.39Å; A249-T253 PolarHBondContact O-N 3.16Å; A249-T253 PolarHBondContact O-OG1 3.37Å
250	K	65.7	Low	62.6	Low	77 Å²	77	86.8 Å²	86.8	34%	0.335	46%	0.461	S	S	.	.	H	α-helix	trans	-70.4	-43.9	176.2	-69	-165.3	176.4	-163.5	0	111.8	A116 I246 S247 R252 T253 V254	A116-K250 PolarHBondContact O-NZ 2.92Å; I246-K250 HydrophobicContact CG2-CB 3.95Å; S247-K250 WeakPolarHBondContact O-CB 3.09Å; S247-K250 PolarHBondContact O-N 3.26Å; K250-R252 VanDerWaalsContact C-N 3.28Å; K250-R252 PolarHBondContact O-N 3.36Å; K250-T253 PolarHBondContact O-N 2.74Å; K250-V254 WeakPolarHBondContact O-CG2 3.37Å; K250-V254 PolarHBondContact O-N 3.49Å
251	I	69.4	Low	64.9	Low	98 Å²	98	81 Å²	81	50%	0.503	43%	0.427	S	S	.	.	H	α-helix	trans	-62.7	-39.5	176.2	-68.9	163.2	0	0	0	110.4	I246 S247 R248 V254 K255	I246-I251 HydrophobicContact CB-CD1 4.42Å; I246-I251 HydrophobicContact CG2-CD1 4.11Å; I246-I251 HydrophobicContact CG2-CG1 3.78Å; S247-I251 PolarHBondContact O-N 3.24Å; R248-I251 PolarHBondContact O-N 3.24Å; I251-V254 PolarHBondContact O-N 3.48Å; I251-K255 PolarHBondContact O-N 3.15Å
252	R	69.9	Low	67.3	Low	125 Å²	125	78.7 Å²	78.7	47%	0.472	41%	0.408	S	S	.	.	H	α-helix	trans	-51.4	-65.6	168.8	-176.3	164	-178.7	-170.7	2.1	108.3	R248 A249 K250 V254 K255 M256 F315 S316	R248-R252 VanDerWaalsContact O-CB 3.27Å; R248-R252 WeakPolarHBondContact O-CB 3.32Å; R248-R252 PolarHBondContact O-N 2.75Å; A249-R252 WeakPolarHBondContact O-CB 3.39Å; K250-R252 VanDerWaalsContact C-N 3.28Å; K250-R252 PolarHBondContact O-N 3.36Å; R252-V254 VanDerWaalsContact C-N 3.29Å; R252-V254 PolarHBondContact O-N 3.35Å; R252-V254 VanDerWaalsContact O-N 3.14Å; R252-K255 PolarHBondContact O-N 2.67Å; R252-M256 PolarHBondContact O-N 3.32Å; R252-M256 VanDerWaalsContact O-N 3.09Å; R252-F315 HydrophobicContact CB-CE1 4.02Å; R252-F315 HydrophobicContact CB-CZ 4.28Å; R252-F315 HydrophobicContact CG-CD1 4.06Å; R252-F315 HydrophobicContact CG-CE1 3.13Å; R252-F315 HydrophobicContact CG-CZ 3.61Å; R252-F315 PolarHBondContact NE-O 2.88Å; R252-F315 PolarHBondContact NH2-O 3.01Å; R252-F315 WeakPolarHBondContact O-CE1 3.29Å; R252-F315 WeakPolarHBondContact O-CZ 3.08Å; R252-S316 PolarHBondContact NH2-O 2.73Å
253	T	66.4	Low	69.5	Low	43 Å²	43	75.6 Å²	75.6	26%	0.264	39%	0.388	S	S	.	.	H	α-helix	trans	-60.3	-30.6	-175.9	-40	0	0	0	0	114.9	R113 A249 K250 M256 T257	R113-T253 HydrophobicContact CG-CG2 4.36Å; A249-T253 PolarHBondContact O-N 3.16Å; A249-T253 PolarHBondContact O-OG1 3.37Å; K250-T253 PolarHBondContact O-N 2.74Å; T253-M256 VanDerWaalsContact O-CB 3.24Å; T253-M256 WeakPolarHBondContact O-CB 3.24Å; T253-M256 PolarHBondContact O-N 3.11Å; T253-T257 PolarHBondContact O-N 3.36Å; T253-T257 PolarHBondContact O-OG1 2.95Å
254	V	72.4	Confident	71.5	Confident	25 Å²	25	71.7 Å²	71.7	15%	0.152	36%	0.364	C	S	.	.	H	α-helix	trans	-65.8	-43.3	172.7	173.3	0	0	0	0	111.9	V117 I203 K250 I251 R252 M256 T257 F258	V117-V254 HydrophobicContact CG2-CG2 4.01Å; I203-V254 HydrophobicContact CG2-CG1 4.13Å; I203-V254 HydrophobicContact CG2-CG2 4.45Å; K250-V254 WeakPolarHBondContact O-CG2 3.37Å; K250-V254 PolarHBondContact O-N 3.49Å; I251-V254 PolarHBondContact O-N 3.48Å; R252-V254 VanDerWaalsContact C-N 3.29Å; R252-V254 PolarHBondContact O-N 3.35Å; R252-V254 VanDerWaalsContact O-N 3.14Å; V254-M256 PolarHBondContact O-N 3.16Å; V254-T257 PolarHBondContact O-N 2.85Å; V254-T257 PolarHBondContact O-OG1 3.46Å; V254-F258 PolarHBondContact O-N 2.86Å; V254-F258 VanDerWaalsContact O-N 3.1Å
255	K	75.3	Confident	73.4	Confident	137 Å²	137	66.3 Å²	66.3	60%	0.596	34%	0.343	S	S	*	.	H	α-helix	trans	-61.4	-35.9	175.9	-164.4	-177.5	87.6	160.6	0	111.4	I251 R252 V259 F315	I251-K255 PolarHBondContact O-N 3.15Å; R252-K255 PolarHBondContact O-N 2.67Å; K255-V259 WeakPolarHBondContact O-CG2 3.47Å; K255-V259 PolarHBondContact O-N 2.84Å; K255-F315 HydrophobicContact CB-CE2 4.3Å; K255-F315 HydrophobicContact CB-CZ 4.06Å
256	M	74.2	Confident	75.2	Confident	15 Å²	15	66 Å²	66	7%	0.074	34%	0.336	C	S	.	.	H	α-helix	trans	-57.7	-56.4	174.7	-166.9	175	178.3	0	0	112.2	R252 T253 V254 F258 V259 I260 I311 Y312 F315	R252-M256 PolarHBondContact O-N 3.32Å; R252-M256 VanDerWaalsContact O-N 3.09Å; T253-M256 VanDerWaalsContact O-CB 3.24Å; T253-M256 WeakPolarHBondContact O-CB 3.24Å; T253-M256 PolarHBondContact O-N 3.11Å; V254-M256 PolarHBondContact O-N 3.16Å; M256-F258 VanDerWaalsContact C-N 3.26Å; M256-F258 PolarHBondContact O-N 3.27Å; M256-V259 WeakPolarHBondContact O-CB 3.22Å; M256-V259 PolarHBondContact O-N 3.42Å; M256-I260 HydrophobicContact CE-CD1 4.45Å; M256-I260 HydrophobicContact CG-CD1 4.3Å; M256-I260 WeakPolarHBondContact O-CG1 3.28Å; M256-I260 PolarHBondContact O-N 2.87Å; M256-I311 HydrophobicContact CG-CG2 4.49Å; M256-Y312 HydrophobicContact CE-CD1 3.15Å; M256-Y312 HydrophobicContact CE-CE1 3.48Å; M256-Y312 VanDerWaalsContact CE-CE1 3.48Å; M256-Y312 HydrophobicContact CE-CG 3.8Å; M256-F315 HydrophobicContact CB-CB 4.42Å; M256-F315 HydrophobicContact CB-CD1 3.39Å; M256-F315 HydrophobicContact CB-CD2 3.99Å; M256-F315 HydrophobicContact CB-CE1 3.48Å; M256-F315 VanDerWaalsContact CB-CE1 3.48Å; M256-F315 HydrophobicContact CB-CE2 4.12Å; M256-F315 HydrophobicContact CB-CG 3.63Å; M256-F315 HydrophobicContact CB-CZ 3.9Å; M256-F315 HydrophobicContact CE-CB 3.85Å; M256-F315 HydrophobicContact CE-CG 4.47Å; M256-F315 HydrophobicContact CG-CB 3.69Å; M256-F315 HydrophobicContact CG-CD1 3.48Å; M256-F315 VanDerWaalsContact CG-CD1 3.48Å; M256-F315 HydrophobicContact CG-CD2 4.07Å; M256-F315 HydrophobicContact CG-CE1 4.12Å; M256-F315 HydrophobicContact CG-CG 3.43Å; M256-F315 VanDerWaalsContact CG-CG 3.43Å; M256-F315 HydrophobicContact SD-CB 3.82Å; M256-F315 HydrophobicContact SD-CD1 3.45Å; M256-F315 WeakPolarHBondContact SD-CD1 3.31Å; M256-F315 HydrophobicContact SD-CE1 4.31Å; M256-F315 HydrophobicContact SD-CG 3.83Å
257	T	78.2	Confident	76.6	Confident	10 Å²	10	63.8 Å²	63.8	6%	0.061	33%	0.325	C	S	.	.	H	α-helix	trans	-70.2	-29.3	-172.1	58.6	0	0	0	0	111	R113 Y200 T253 V254 I260 V261	R113-T257 HydrophobicContact CG-CG2 4.15Å; Y200-T257 WeakPolarHBondContact OH-CB 3.14Å; Y200-T257 PolarHBondContact OH-O 2.96Å; Y200-T257 PolarHBondContact OH-OG1 2.97Å; T253-T257 PolarHBondContact O-N 3.36Å; T253-T257 PolarHBondContact O-OG1 2.95Å; V254-T257 PolarHBondContact O-N 2.85Å; V254-T257 PolarHBondContact O-OG1 3.46Å; T257-I260 PolarHBondContact O-N 3.5Å; T257-V261 WeakPolarHBondContact O-CG2 3.26Å; T257-V261 PolarHBondContact O-N 3.47Å
258	F	81.8	Confident	77.8	Confident	115 Å²	115	60.9 Å²	60.9	50%	0.504	31%	0.305	S	S	.	.	H	α-helix	trans	-59.8	-44	168.6	-177.9	-96.2	0	0	0	112.3	Y200 V254 M256 V261 T262	Y200-F258 HydrophobicContact CE1-CB 4.4Å; Y200-F258 PolarHBondContact OH-N 3.19Å; V254-F258 PolarHBondContact O-N 2.86Å; V254-F258 VanDerWaalsContact O-N 3.1Å; M256-F258 VanDerWaalsContact C-N 3.26Å; M256-F258 PolarHBondContact O-N 3.27Å; F258-V261 PolarHBondContact O-N 2.96Å; F258-T262 PolarHBondContact O-N 3.31Å; F258-T262 PolarHBondContact O-OG1 3.08Å
259	V	83.3	Confident	79.2	Confident	68 Å²	68	50.8 Å²	50.8	41%	0.412	27%	0.271	S	S	.	.	H	α-helix	trans	-63.1	-42.1	175.1	172.3	0	0	0	0	111.5	K255 M256 V261 T262 A263 I311	K255-V259 WeakPolarHBondContact O-CG2 3.47Å; K255-V259 PolarHBondContact O-N 2.84Å; M256-V259 WeakPolarHBondContact O-CB 3.22Å; M256-V259 PolarHBondContact O-N 3.42Å; V259-V261 VanDerWaalsContact C-N 3.33Å; V259-V261 PolarHBondContact O-N 3.47Å; V259-T262 PolarHBondContact O-N 2.84Å; V259-A263 WeakPolarHBondContact O-CB 3.27Å; V259-A263 PolarHBondContact O-N 3.31Å; V259-I311 HydrophobicContact CG1-CG2 4.28Å
260	I	82.1	Confident	80.7	Confident	8 Å²	8	49.9 Å²	49.9	4%	0.041	26%	0.259	C	S	.	.	H	α-helix	trans	-58.8	-44.9	175.8	-61.2	172.2	0	0	0	110.9	L106 M256 T257 A263 Y264 I311 Y312	L106-I260 HydrophobicContact CD1-CG2 3.83Å; L106-I260 HydrophobicContact CG-CG2 4.02Å; M256-I260 HydrophobicContact CE-CD1 4.45Å; M256-I260 HydrophobicContact CG-CD1 4.3Å; M256-I260 WeakPolarHBondContact O-CG1 3.28Å; M256-I260 PolarHBondContact O-N 2.87Å; T257-I260 PolarHBondContact O-N 3.5Å; I260-A263 PolarHBondContact O-N 3.36Å; I260-Y264 WeakPolarHBondContact O-CB 3.3Å; I260-Y264 PolarHBondContact O-N 2.65Å; I260-I311 HydrophobicContact CD1-CG2 4.15Å; I260-I311 HydrophobicContact CG1-CB 4.18Å; I260-I311 HydrophobicContact CG1-CD1 4.1Å; I260-I311 HydrophobicContact CG1-CG2 3.46Å; I260-I311 VanDerWaalsContact CG1-CG2 3.46Å; I260-Y312 HydrophobicContact CD1-CE2 4.47Å
261	V	84.8	Confident	81.7	Confident	12 Å²	12	47.9 Å²	47.9	7%	0.073	25%	0.251	C	S	.	.	H	α-helix	trans	-66.7	-42.1	-179.6	173.3	0	0	0	0	111.9	L106 T110 L196 Y200 T257 F258 V259 Y264 I265	L106-V261 HydrophobicContact CD2-CG2 3.73Å; T110-V261 HydrophobicContact CG2-CG2 4.09Å; L196-V261 HydrophobicContact CB-CG1 4.21Å; L196-V261 HydrophobicContact CD1-CG1 4.11Å; L196-V261 HydrophobicContact CD1-CG2 4.31Å; L196-V261 HydrophobicContact CD2-CG2 4.18Å; Y200-V261 HydrophobicContact CE2-CB 4.27Å; Y200-V261 HydrophobicContact CE2-CG1 4.37Å; Y200-V261 HydrophobicContact CE2-CG2 3.5Å; Y200-V261 VanDerWaalsContact CE2-CG2 3.5Å; T257-V261 WeakPolarHBondContact O-CG2 3.26Å; T257-V261 PolarHBondContact O-N 3.47Å; F258-V261 PolarHBondContact O-N 2.96Å; V259-V261 VanDerWaalsContact C-N 3.33Å; V259-V261 PolarHBondContact O-N 3.47Å; V261-Y264 WeakPolarHBondContact O-CB 3.43Å; V261-Y264 PolarHBondContact O-N 2.87Å; V261-I265 HydrophobicContact CG1-CD1 4.07Å; V261-I265 WeakPolarHBondContact O-CG1 3.29Å; V261-I265 PolarHBondContact O-N 3.32Å
262	T	86.4	Confident	82.6	Confident	63 Å²	63	43.5 Å²	43.5	39%	0.387	23%	0.228	S	C	.	.	H	α-helix	trans	-64	-44	176.3	-57.7	0	0	0	0	111.1	F258 V259 Y264 I265 V266	F258-T262 PolarHBondContact O-N 3.31Å; F258-T262 PolarHBondContact O-OG1 3.08Å; V259-T262 PolarHBondContact O-N 2.84Å; T262-Y264 PolarHBondContact O-N 3.44Å; T262-I265 PolarHBondContact O-N 3.28Å; T262-V266 WeakPolarHBondContact O-CG2 3.34Å; T262-V266 PolarHBondContact O-N 3.49Å
263	A	85.9	Confident	83.5	Confident	25 Å²	25	42.6 Å²	42.6	21%	0.207	23%	0.231	C	C	.	.	H	α-helix	trans	-60.6	-45.1	175.5	0	0	0	0	0	111.7	V259 I260 I265 V266 C267 I311	V259-A263 WeakPolarHBondContact O-CB 3.27Å; V259-A263 PolarHBondContact O-N 3.31Å; I260-A263 PolarHBondContact O-N 3.36Å; A263-I265 PolarHBondContact O-N 3.18Å; A263-V266 PolarHBondContact O-N 3.42Å; A263-C267 WeakPolarHBondContact O-CB 3.48Å; A263-C267 PolarHBondContact O-N 2.82Å; A263-C267 PolarHBondContact O-SG 2.92Å; A263-I311 HydrophobicContact CB-CD1 4.16Å
264	Y	87.6	Confident	84.4	Confident	1 Å²	1	42.7 Å²	42.7	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-55.4	-48.9	174.8	172.5	-85.7	0	0	0	111.9	A103 L106 I188 F189 V193 I260 V261 T262 C267 W268 N304	A103-Y264 HydrophobicContact CB-CE2 4.03Å; L106-Y264 HydrophobicContact CD1-CD2 3.78Å; L106-Y264 HydrophobicContact CD1-CG 3.75Å; I188-Y264 PolarHBondContact O-OH 3.42Å; F189-Y264 HydrophobicContact CD2-CE1 4.19Å; V193-Y264 HydrophobicContact CG2-CE1 4.2Å; I260-Y264 WeakPolarHBondContact O-CB 3.3Å; I260-Y264 PolarHBondContact O-N 2.65Å; V261-Y264 WeakPolarHBondContact O-CB 3.43Å; V261-Y264 PolarHBondContact O-N 2.87Å; T262-Y264 PolarHBondContact O-N 3.44Å; Y264-C267 PolarHBondContact O-N 2.79Å; Y264-W268 AromaticContact CD2-CD1 3.43Å; Y264-W268 VanDerWaalsContact CD2-CD1 3.43Å; Y264-W268 AromaticContact CD2-NE1 3.75Å; Y264-W268 AromaticContact CE2-CD1 3.14Å; Y264-W268 HydrophobicContact CE2-CG 4.05Å; Y264-W268 AromaticContact CE2-NE1 3.38Å; Y264-W268 AromaticContact CZ-CD1 3.53Å; Y264-W268 WeakPolarHBondContact O-CB 3.48Å; Y264-W268 PolarHBondContact O-N 3.31Å; Y264-N304 WeakPolarHBondContact CD2-OD1 3.45Å
265	I	89.4	Confident	84.9	Confident	59 Å²	59	43.8 Å²	43.8	30%	0.303	23%	0.234	S	C	.	.	H	α-helix	trans	-61.9	-47.8	179.3	-68.6	166.4	0	0	0	110.9	V193 V261 T262 A263 C267 W268 A269	V193-I265 HydrophobicContact CG1-CD1 4.42Å; V193-I265 HydrophobicContact CG2-CD1 4.35Å; V193-I265 HydrophobicContact CG2-CG1 3.85Å; V261-I265 HydrophobicContact CG1-CD1 4.07Å; V261-I265 WeakPolarHBondContact O-CG1 3.29Å; V261-I265 PolarHBondContact O-N 3.32Å; T262-I265 PolarHBondContact O-N 3.28Å; A263-I265 PolarHBondContact O-N 3.18Å; I265-C267 VanDerWaalsContact C-N 3.33Å; I265-C267 PolarHBondContact O-N 2.91Å; I265-W268 PolarHBondContact O-N 2.83Å; I265-A269 WeakPolarHBondContact O-CB 3.36Å; I265-A269 PolarHBondContact O-N 3.21Å
266	V	88.7	Confident	85.5	Confident	94 Å²	94	39.8 Å²	39.8	57%	0.57	22%	0.217	S	C	*	.	H	α-helix	trans	-64.9	-36	-178	172.6	0	0	0	0	112	T262 A263 P270	T262-V266 WeakPolarHBondContact O-CG2 3.34Å; T262-V266 PolarHBondContact O-N 3.49Å; A263-V266 PolarHBondContact O-N 3.42Å; V266-P270 VanDerWaalsContact O-CD 3.29Å; V266-P270 WeakPolarHBondContact O-CD 3.43Å
267	C	86.6	Confident	86.1	Confident	11 Å²	11	47.2 Å²	47.2	7%	0.074	25%	0.245	C	C	.	.	H	α-helix	trans	-73.1	-40.5	178.3	-65.2	0	0	0	0	112.9	A263 Y264 I265 L300 N304	A263-C267 WeakPolarHBondContact O-CB 3.48Å; A263-C267 PolarHBondContact O-N 2.82Å; A263-C267 PolarHBondContact O-SG 2.92Å; Y264-C267 PolarHBondContact O-N 2.79Å; I265-C267 VanDerWaalsContact C-N 3.33Å; I265-C267 PolarHBondContact O-N 2.91Å; C267-L300 WeakPolarHBondContact CB-O 3.4Å; C267-N304 HydrophobicContact CB-CB 4Å
268	W	87.6	Confident	86.1	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.015	25%	0.253	C	S	.	.	H	α-helix	trans	-92.5	-31.1	-172.6	-77.5	107.5	0	0	0	115.3	M99 F189 Y264 I265 F271 F272 G301 N304	M99-W268 HydrophobicContact CB-CH2 4.36Å; M99-W268 HydrophobicContact CG-CH2 3.65Å; M99-W268 HydrophobicContact CG-CZ2 4.18Å; M99-W268 HydrophobicContact SD-CH2 3.41Å; M99-W268 WeakPolarHBondContact SD-CH2 3.14Å; M99-W268 HydrophobicContact SD-CZ2 4.46Å; M99-W268 HydrophobicContact SD-CZ3 3.83Å; F189-W268 HydrophobicContact CD2-CB 3.93Å; F189-W268 HydrophobicContact CE2-CB 4.34Å; Y264-W268 AromaticContact CD2-CD1 3.43Å; Y264-W268 VanDerWaalsContact CD2-CD1 3.43Å; Y264-W268 AromaticContact CD2-NE1 3.75Å; Y264-W268 AromaticContact CE2-CD1 3.14Å; Y264-W268 HydrophobicContact CE2-CG 4.05Å; Y264-W268 AromaticContact CE2-NE1 3.38Å; Y264-W268 AromaticContact CZ-CD1 3.53Å; Y264-W268 WeakPolarHBondContact O-CB 3.48Å; Y264-W268 PolarHBondContact O-N 3.31Å; I265-W268 PolarHBondContact O-N 2.83Å; W268-F271 HydrophobicContact CE3-CD1 4.06Å; W268-F271 AromaticContact CZ3-CD1 4Å; W268-F271 HydrophobicContact CZ3-CD1 4Å; W268-F271 HydrophobicContact CZ3-CE1 4.3Å; W268-F271 PolarHBondContact O-N 2.8Å; W268-F272 HydrophobicContact CB-CD2 4.06Å; W268-F272 HydrophobicContact CB-CE2 4.08Å; W268-F272 AromaticContact CD2-CE2 3.87Å; W268-F272 HydrophobicContact CD2-CE2 3.87Å; W268-F272 HydrophobicContact CE3-CD2 4.01Å; W268-F272 AromaticContact CE3-CE2 3.27Å; W268-F272 HydrophobicContact CE3-CE2 3.27Å; W268-F272 AromaticContact CE3-CZ 3.84Å; W268-F272 HydrophobicContact CE3-CZ 3.84Å; W268-F272 HydrophobicContact CG-CE2 4.24Å; W268-F272 AromaticContact CZ3-CE2 3.99Å; W268-F272 HydrophobicContact CZ3-CE2 3.99Å; W268-F272 HydrophobicContact CZ3-CZ 4.08Å; W268-F272 WeakPolarHBondContact O-CD2 3.35Å; W268-F272 PolarHBondContact O-N 2.93Å; W268-F272 VanDerWaalsContact O-N 3.15Å; W268-G301 WeakPolarHBondContact CZ2-O 3.29Å; W268-N304 VanDerWaalsContact NE1-CG 3.26Å; W268-N304 PolarHBondContact NE1-ND2 3.01Å
269	A	90.1	Very high	86	Confident	18 Å²	18	44 Å²	44	15%	0.149	24%	0.236	C	C	.	.	H	α-helix	trans	-54.1	-50.9	-177.4	0	0	0	0	0	114.1	F189 I265 F271 F272 I273	F189-A269 HydrophobicContact CE2-CB 3.95Å; F189-A269 HydrophobicContact CZ-CB 3.7Å; I265-A269 WeakPolarHBondContact O-CB 3.36Å; I265-A269 PolarHBondContact O-N 3.21Å; A269-F271 VanDerWaalsContact C-N 3.34Å; A269-F271 PolarHBondContact O-N 3.27Å; A269-F272 PolarHBondContact O-N 3.27Å; A269-I273 HydrophobicContact CB-CD1 4.27Å; A269-I273 WeakPolarHBondContact O-CB 3.21Å; A269-I273 WeakPolarHBondContact O-CD1 3.14Å; A269-I273 WeakPolarHBondContact O-CG1 3.44Å; A269-I273 PolarHBondContact O-N 3.3Å
270	P	89.2	Confident	86	Confident	39 Å²	39	46.9 Å²	46.9	25%	0.253	24%	0.239	S	C	.	.	H	α-helix	trans	-63.3	-39.3	-176.4	23.9	-33.3	0	0	0	112.5	V266 I274 T297 L300	V266-P270 VanDerWaalsContact O-CD 3.29Å; V266-P270 WeakPolarHBondContact O-CD 3.43Å; P270-I274 WeakPolarHBondContact O-CB 3.39Å; P270-I274 WeakPolarHBondContact O-CD1 3.45Å; P270-I274 WeakPolarHBondContact O-CG1 3.32Å; P270-I274 PolarHBondContact O-N 2.92Å; P270-T297 HydrophobicContact CB-CG2 4.17Å; P270-L300 HydrophobicContact CG-CD2 3.59Å
271	F	85.9	Confident	85.9	Confident	35 Å²	35	48.9 Å²	48.9	15%	0.154	25%	0.25	C	S	.	.	H	α-helix	trans	-59.2	-53.8	175.2	176.6	-105.1	0	0	0	111.5	W268 A269 I273 I274 Q275 A298	W268-F271 HydrophobicContact CE3-CD1 4.06Å; W268-F271 AromaticContact CZ3-CD1 4Å; W268-F271 HydrophobicContact CZ3-CD1 4Å; W268-F271 HydrophobicContact CZ3-CE1 4.3Å; W268-F271 PolarHBondContact O-N 2.8Å; A269-F271 VanDerWaalsContact C-N 3.34Å; A269-F271 PolarHBondContact O-N 3.27Å; F271-I273 PolarHBondContact O-N 2.94Å; F271-I274 PolarHBondContact O-N 2.79Å; F271-Q275 HydrophobicContact CD1-CG 4.41Å; F271-Q275 HydrophobicContact CD2-CG 4.17Å; F271-Q275 HydrophobicContact CE1-CG 4.1Å; F271-Q275 HydrophobicContact CE2-CG 3.85Å; F271-Q275 HydrophobicContact CG-CG 4.45Å; F271-Q275 HydrophobicContact CZ-CG 3.81Å; F271-Q275 WeakPolarHBondContact O-CB 3.23Å; F271-Q275 WeakPolarHBondContact O-CG 3.41Å; F271-Q275 PolarHBondContact O-N 2.87Å; F271-A298 HydrophobicContact CD2-CB 4.27Å; F271-A298 HydrophobicContact CE2-CB 4.06Å
272	F	88.3	Confident	85	Confident	7 Å²	7	53.5 Å²	53.5	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-69.4	-31.3	-178	-72.9	-62.6	0	0	0	113.7	T185 I188 F189 W268 A269 M276	T185-F272 HydrophobicContact CG2-CB 3.94Å; T185-F272 HydrophobicContact CG2-CD1 4.22Å; T185-F272 HydrophobicContact CG2-CG 4.25Å; T185-F272 WeakPolarHBondContact OG1-CD1 3.48Å; I188-F272 HydrophobicContact CB-CE1 4.48Å; I188-F272 HydrophobicContact CB-CE2 4.19Å; I188-F272 HydrophobicContact CB-CZ 3.67Å; I188-F272 HydrophobicContact CD1-CZ 4.07Å; I188-F272 HydrophobicContact CG1-CZ 4.46Å; I188-F272 HydrophobicContact CG2-CE2 3.84Å; I188-F272 HydrophobicContact CG2-CZ 3.63Å; F189-F272 HydrophobicContact CB-CD2 3.48Å; F189-F272 VanDerWaalsContact CB-CD2 3.48Å; F189-F272 HydrophobicContact CB-CE2 3.76Å; F189-F272 HydrophobicContact CB-CG 4.11Å; F189-F272 HydrophobicContact CD2-CD2 4.25Å; F189-F272 AromaticContact CG-CD2 3.93Å; F189-F272 HydrophobicContact CG-CD2 3.93Å; W268-F272 HydrophobicContact CB-CD2 4.06Å; W268-F272 HydrophobicContact CB-CE2 4.08Å; W268-F272 AromaticContact CD2-CE2 3.87Å; W268-F272 HydrophobicContact CD2-CE2 3.87Å; W268-F272 HydrophobicContact CE3-CD2 4.01Å; W268-F272 AromaticContact CE3-CE2 3.27Å; W268-F272 HydrophobicContact CE3-CE2 3.27Å; W268-F272 AromaticContact CE3-CZ 3.84Å; W268-F272 HydrophobicContact CE3-CZ 3.84Å; W268-F272 HydrophobicContact CG-CE2 4.24Å; W268-F272 AromaticContact CZ3-CE2 3.99Å; W268-F272 HydrophobicContact CZ3-CE2 3.99Å; W268-F272 HydrophobicContact CZ3-CZ 4.08Å; W268-F272 WeakPolarHBondContact O-CD2 3.35Å; W268-F272 PolarHBondContact O-N 2.93Å; W268-F272 VanDerWaalsContact O-N 3.15Å; A269-F272 PolarHBondContact O-N 3.27Å; F272-M276 WeakPolarHBondContact O-CB 3.26Å; F272-M276 VanDerWaalsContact O-CG 3.26Å; F272-M276 WeakPolarHBondContact O-CG 3.46Å; F272-M276 PolarHBondContact O-N 3.02Å
273	I	89.1	Confident	83.8	Confident	105 Å²	105	57.8 Å²	57.8	54%	0.538	30%	0.298	S	S	.	.	H	α-helix	trans	-62.9	-48.8	173.5	-71.1	163.8	0	0	0	110.4	A269 F271 M276 W277	A269-I273 HydrophobicContact CB-CD1 4.27Å; A269-I273 WeakPolarHBondContact O-CB 3.21Å; A269-I273 WeakPolarHBondContact O-CD1 3.14Å; A269-I273 WeakPolarHBondContact O-CG1 3.44Å; A269-I273 PolarHBondContact O-N 3.3Å; F271-I273 PolarHBondContact O-N 2.94Å; I273-M276 PolarHBondContact O-N 3.09Å; I273-W277 WeakPolarHBondContact O-CB 3.18Å; I273-W277 PolarHBondContact O-N 2.87Å
274	I	85.1	Confident	82.4	Confident	46 Å²	46	58.5 Å²	58.5	24%	0.236	30%	0.301	C	S	.	.	H	α-helix	trans	-66.1	-43.3	179.8	-74.7	157.1	0	0	0	111.3	P270 F271 M276 W277 S278 T293 I294 T297	P270-I274 WeakPolarHBondContact O-CB 3.39Å; P270-I274 WeakPolarHBondContact O-CD1 3.45Å; P270-I274 WeakPolarHBondContact O-CG1 3.32Å; P270-I274 PolarHBondContact O-N 2.92Å; F271-I274 PolarHBondContact O-N 2.79Å; I274-M276 VanDerWaalsContact C-N 3.35Å; I274-M276 PolarHBondContact O-N 3.46Å; I274-W277 PolarHBondContact O-N 2.95Å; I274-S278 WeakPolarHBondContact O-CB 3.18Å; I274-S278 PolarHBondContact O-N 2.84Å; I274-T293 HydrophobicContact CD1-CG2 3.85Å; I274-I294 HydrophobicContact CG2-CG1 4.47Å; I274-T297 HydrophobicContact CD1-CG2 3.74Å
275	Q	84.3	Confident	80.7	Confident	48 Å²	48	64.1 Å²	64.1	22%	0.224	34%	0.336	C	S	.	.	H	α-helix	trans	-61.9	-40.9	177	-70.2	-67.4	99.7	0	0	112.1	V181 F271 V279	V181-Q275 HydrophobicContact CG1-CB 3.84Å; F271-Q275 HydrophobicContact CD1-CG 4.41Å; F271-Q275 HydrophobicContact CD2-CG 4.17Å; F271-Q275 HydrophobicContact CE1-CG 4.1Å; F271-Q275 HydrophobicContact CE2-CG 3.85Å; F271-Q275 HydrophobicContact CG-CG 4.45Å; F271-Q275 HydrophobicContact CZ-CG 3.81Å; F271-Q275 WeakPolarHBondContact O-CB 3.23Å; F271-Q275 WeakPolarHBondContact O-CG 3.41Å; F271-Q275 PolarHBondContact O-N 2.87Å; Q275-V279 WeakPolarHBondContact O-CG2 3.29Å
276	M	87.3	Confident	79	Confident	52 Å²	52	70.9 Å²	70.9	26%	0.256	36%	0.358	S	S	.	.	H	α-helix	trans	-67.7	-42.6	174.8	-73.8	-67.1	-75.1	0	0	111.7	V181 T182 T185 F272 I273 I274 V279 W280	V181-M276 HydrophobicContact CG1-SD 4.04Å; T182-M276 HydrophobicContact CG2-CE 4.2Å; T185-M276 HydrophobicContact CG2-CG 3.89Å; T185-M276 HydrophobicContact CG2-SD 4.33Å; F272-M276 WeakPolarHBondContact O-CB 3.26Å; F272-M276 VanDerWaalsContact O-CG 3.26Å; F272-M276 WeakPolarHBondContact O-CG 3.46Å; F272-M276 PolarHBondContact O-N 3.02Å; I273-M276 PolarHBondContact O-N 3.09Å; I274-M276 VanDerWaalsContact C-N 3.35Å; I274-M276 PolarHBondContact O-N 3.46Å; M276-V279 PolarHBondContact O-N 3.02Å; M276-W280 WeakPolarHBondContact O-CB 3.27Å; M276-W280 VanDerWaalsContact O-CD1 3.3Å; M276-W280 PolarHBondContact O-N 3.13Å; M276-W280 VanDerWaalsContact O-N 3.17Å
277	W	85.6	Confident	76.9	Confident	172 Å²	172	71.5 Å²	71.5	65%	0.652	36%	0.361	S	S	*	.	H	α-helix	trans	-58.1	-53.2	176.7	-165.5	-62.4	0	0	0	111.2	I273 I274 V279 W280 D281	I273-W277 WeakPolarHBondContact O-CB 3.18Å; I273-W277 PolarHBondContact O-N 2.87Å; I274-W277 PolarHBondContact O-N 2.95Å; W277-V279 PolarHBondContact O-N 3.45Å; W277-W280 PolarHBondContact O-N 2.82Å; W277-D281 PolarHBondContact NE1-OD2 3.08Å; W277-D281 WeakPolarHBondContact O-CB 3.26Å; W277-D281 PolarHBondContact O-N 2.83Å
278	S	79.7	Confident	75	Confident	33 Å²	33	78.4 Å²	78.4	23%	0.231	39%	0.393	C	S	.	.	H	α-helix	trans	-57.7	-17.9	-177	177.4	0	0	0	0	115	I274	I274-S278 WeakPolarHBondContact O-CB 3.18Å; I274-S278 PolarHBondContact O-N 2.84Å
279	V	80	Confident	73.2	Confident	23 Å²	23	84 Å²	84	14%	0.139	43%	0.432	C	S	.	.	H	α-helix	trans	-110.9	-20.9	-173.4	169.6	0	0	0	0	112.5	R178 V181 Q275 M276 W277	R178-V279 VanDerWaalsContact CA-CG1 3.41Å; R178-V279 HydrophobicContact CB-CG1 4.07Å; R178-V279 HydrophobicContact CG-CG1 3.57Å; R178-V279 WeakPolarHBondContact CG-O 3.29Å; R178-V279 PolarHBondContact NE-O 3.17Å; V181-V279 HydrophobicContact CB-CG1 4.41Å; V181-V279 HydrophobicContact CB-CG2 4.32Å; V181-V279 HydrophobicContact CG1-CG2 4.48Å; V181-V279 HydrophobicContact CG2-CG2 4.01Å; Q275-V279 WeakPolarHBondContact O-CG2 3.29Å; M276-V279 PolarHBondContact O-N 3.02Å; W277-V279 PolarHBondContact O-N 3.45Å
280	W	83.3	Confident	71.3	Confident	129 Å²	129	91.4 Å²	91.4	49%	0.489	46%	0.464	S	S	.	.	H	α-helix	trans	-102.1	-23.6	177.9	-75.3	95.5	0	0	0	113.8	T182 M276 W277 P282	T182-W280 PolarHBondContact OG1-NE1 3.37Å; M276-W280 WeakPolarHBondContact O-CB 3.27Å; M276-W280 VanDerWaalsContact O-CD1 3.3Å; M276-W280 PolarHBondContact O-N 3.13Å; M276-W280 VanDerWaalsContact O-N 3.17Å; W277-W280 PolarHBondContact O-N 2.82Å; W280-P282 WeakPolarHBondContact O-CD 3.43Å
281	D	80	Confident	70	Confident	51 Å²	51	92 Å²	92	27%	0.273	47%	0.465	S	S	.	.			trans	-87.3	113.8	173.8	-174	-0.5	0	0	0	111.2	W277 M283 S284	W277-D281 PolarHBondContact NE1-OD2 3.08Å; W277-D281 WeakPolarHBondContact O-CB 3.26Å; W277-D281 PolarHBondContact O-N 2.83Å; D281-M283 VanDerWaalsContact C-N 3.32Å; D281-M283 WeakPolarHBondContact OD1-CA 3.43Å; D281-M283 WeakPolarHBondContact OD1-CB 3.48Å; D281-M283 PolarHBondContact OD1-N 3.04Å; D281-S284 PolarHBondContact O-OG 3.45Å; D281-S284 PolarHBondContact OD1-N 3.25Å
282	P	65.7	Low	69.2	Low	109 Å²	109	94.1 Å²	94.1	71%	0.708	48%	0.482	S	S	*	.	S	Bend	trans	-80.2	-11.1	175.6	33.4	-33.9	0	0	0	113.5	W280	W280-P282 WeakPolarHBondContact O-CD 3.43Å
283	M	60.3	Low	68.2	Low	152 Å²	152	97 Å²	97	75%	0.749	50%	0.501	S	S	*	.	S	Bend	trans	-95.4	-12.5	-179.6	-75	-62.9	-58.9	0	0	113.4	D281 V285	D281-M283 VanDerWaalsContact C-N 3.32Å; D281-M283 WeakPolarHBondContact OD1-CA 3.43Å; D281-M283 WeakPolarHBondContact OD1-CB 3.48Å; D281-M283 PolarHBondContact OD1-N 3.04Å; M283-V285 PolarHBondContact O-N 3.1Å
284	S	56.6	Low	67.3	Low	40 Å²	40	95.5 Å²	95.5	28%	0.28	49%	0.493	S	S	.	.	S	Bend	trans	-70.8	80.3	165.6	65	0	0	0	0	109.4	D281 W286	D281-S284 PolarHBondContact O-OG 3.45Å; D281-S284 PolarHBondContact OD1-N 3.25Å; S284-W286 PolarHBondContact O-N 3.36Å
285	V	51.4	Low	66.5	Low	120 Å²	120	96 Å²	96	73%	0.727	50%	0.498	S	S	*	.			trans	-50.1	127.4	169	173.9	0	0	0	0	107.7	M283 T287	M283-V285 PolarHBondContact O-N 3.1Å; V285-T287 PolarHBondContact O-N 3.37Å
286	W	53.4	Low	66	Low	201 Å²	201	98.9 Å²	98.9	76%	0.761	51%	0.514	S	S	*	.			trans	-58.5	85.5	176.3	-59.4	77.6	0	0	0	109.7	S284 E288	S284-W286 PolarHBondContact O-N 3.36Å; W286-E288 PolarHBondContact O-N 3.05Å
287	T	45.7	Very low	65.4	Low	106 Å²	106	96.9 Å²	96.9	65%	0.65	51%	0.505	S	S	*	.			trans	-63.3	119.5	153.2	16.7	0	0	0	0	104.7	V285 N291	V285-T287 PolarHBondContact O-N 3.37Å; T287-N291 VanDerWaalsContact CB-ND2 3.26Å; T287-N291 WeakPolarHBondContact CB-ND2 3.04Å; T287-N291 PolarHBondContact O-ND2 2.79Å; T287-N291 VanDerWaalsContact O-ND2 3.08Å; T287-N291 PolarHBondContact OG1-ND2 3.12Å
288	E	46.7	Very low	64.8	Low	157 Å²	157	89.8 Å²	89.8	73%	0.734	48%	0.483	S	S	*	.			trans	-58.7	-179.3	-158.8	-61.8	-167.6	141.3	0	0	113.9	W286 E290 N291	W286-E288 PolarHBondContact O-N 3.05Å; E288-E290 PolarHBondContact O-N 3.32Å; E288-N291 PolarHBondContact O-N 3.26Å
289	S	48.8	Very low	64.4	Low	121 Å²	121	91.3 Å²	91.3	85%	0.846	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	0.6	-178.9	41.1	0	0	0	0	117.9
290	E	50.6	Low	64.2	Low	174 Å²	174	92.9 Å²	92.9	81%	0.813	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-5.4	175.9	-56.9	-162.2	137.7	0	0	114.3	E288 P292	E288-E290 PolarHBondContact O-N 3.32Å; E290-P292 WeakPolarHBondContact O-CD 3.37Å
291	N	62.2	Low	63.6	Low	52 Å²	52	86.8 Å²	86.8	28%	0.278	47%	0.472	S	S	.	.			trans	-59.4	104.5	178.2	-106.4	-57.8	0	0	0	111.3	T287 E288 T293 I294	T287-N291 VanDerWaalsContact CB-ND2 3.26Å; T287-N291 WeakPolarHBondContact CB-ND2 3.04Å; T287-N291 PolarHBondContact O-ND2 2.79Å; T287-N291 VanDerWaalsContact O-ND2 3.08Å; T287-N291 PolarHBondContact OG1-ND2 3.12Å; E288-N291 PolarHBondContact O-N 3.26Å; N291-T293 PolarHBondContact O-N 2.9Å; N291-I294 HydrophobicContact CB-CD1 4.47Å; N291-I294 PolarHBondContact O-N 3.03Å; N291-I294 VanDerWaalsContact O-N 3.1Å
292	P	68.2	Low	63.2	Low	78 Å²	78	85.3 Å²	85.3	51%	0.506	47%	0.466	S	S	.	.	H	α-helix	trans	-65	-23.1	-171.5	28.4	-35.7	0	0	0	111.4	E290 I294 T295 I296	E290-P292 WeakPolarHBondContact O-CD 3.37Å; P292-I294 VanDerWaalsContact C-N 3.3Å; P292-I294 PolarHBondContact O-N 3.25Å; P292-T295 PolarHBondContact O-N 3.26Å; P292-I296 HydrophobicContact CB-CD1 4.08Å; P292-I296 VanDerWaalsContact O-CB 3.29Å; P292-I296 WeakPolarHBondContact O-CB 3.31Å; P292-I296 WeakPolarHBondContact O-CD1 3.42Å; P292-I296 WeakPolarHBondContact O-CG1 3.27Å; P292-I296 PolarHBondContact O-N 3.28Å
293	T	69.1	Low	63.4	Low	69 Å²	69	84.3 Å²	84.3	42%	0.423	45%	0.454	S	S	.	.	H	α-helix	trans	-51.9	-41	174	-47.1	0	0	0	0	113.3	I274 N291 T297	I274-T293 HydrophobicContact CD1-CG2 3.85Å; N291-T293 PolarHBondContact O-N 2.9Å; T293-T297 WeakPolarHBondContact O-CB 3.38Å; T293-T297 VanDerWaalsContact O-CG2 3.28Å; T293-T297 WeakPolarHBondContact O-CG2 3.14Å; T293-T297 PolarHBondContact O-N 2.74Å; T293-T297 PolarHBondContact O-OG1 3.38Å
294	I	69.5	Low	63.9	Low	73 Å²	73	77.3 Å²	77.3	37%	0.374	42%	0.42	S	S	.	.	H	α-helix	trans	-71.9	-46	-179.5	-63.7	173.2	0	0	0	109.8	I274 N291 P292 T297 A298	I274-I294 HydrophobicContact CG2-CG1 4.47Å; N291-I294 HydrophobicContact CB-CD1 4.47Å; N291-I294 PolarHBondContact O-N 3.03Å; N291-I294 VanDerWaalsContact O-N 3.1Å; P292-I294 VanDerWaalsContact C-N 3.3Å; P292-I294 PolarHBondContact O-N 3.25Å; I294-T297 PolarHBondContact O-N 3.45Å; I294-T297 PolarHBondContact O-OG1 3.24Å; I294-A298 WeakPolarHBondContact O-CB 3.2Å; I294-A298 PolarHBondContact O-N 3.45Å
295	T	69.3	Low	64.5	Low	57 Å²	57	76.1 Å²	76.1	35%	0.35	41%	0.411	S	S	.	.	H	α-helix	trans	-63.1	-46.8	177.3	-49.5	0	0	0	0	111.5	P292 T297 A298 L299	P292-T295 PolarHBondContact O-N 3.26Å; T295-T297 VanDerWaalsContact C-N 3.32Å; T295-T297 PolarHBondContact O-N 3.24Å; T295-A298 PolarHBondContact O-N 3.48Å; T295-L299 HydrophobicContact CG2-CD1 4.16Å; T295-L299 WeakPolarHBondContact O-CB 3.37Å; T295-L299 VanDerWaalsContact O-CG 3.23Å; T295-L299 WeakPolarHBondContact O-CG 2.99Å; T295-L299 PolarHBondContact O-N 2.74Å
296	I	72.1	Confident	65.2	Low	107 Å²	107	73.5 Å²	73.5	55%	0.549	40%	0.398	S	S	.	.	H	α-helix	trans	-59.8	-41	177.4	-70.7	165.6	0	0	0	111.1	P292 L299 L300	P292-I296 HydrophobicContact CB-CD1 4.08Å; P292-I296 VanDerWaalsContact O-CB 3.29Å; P292-I296 WeakPolarHBondContact O-CB 3.31Å; P292-I296 WeakPolarHBondContact O-CD1 3.42Å; P292-I296 WeakPolarHBondContact O-CG1 3.27Å; P292-I296 PolarHBondContact O-N 3.28Å; I296-L299 PolarHBondContact O-N 3.12Å; I296-L300 WeakPolarHBondContact O-CB 3.31Å; I296-L300 PolarHBondContact O-N 3.25Å
297	T	74.9	Confident	65.7	Low	11 Å²	11	65.9 Å²	65.9	7%	0.067	38%	0.375	C	S	.	.	H	α-helix	trans	-76.8	-31.5	179.8	54.2	0	0	0	0	113.2	P270 I274 T293 I294 T295 L300 G301	P270-T297 HydrophobicContact CB-CG2 4.17Å; I274-T297 HydrophobicContact CD1-CG2 3.74Å; T293-T297 WeakPolarHBondContact O-CB 3.38Å; T293-T297 VanDerWaalsContact O-CG2 3.28Å; T293-T297 WeakPolarHBondContact O-CG2 3.14Å; T293-T297 PolarHBondContact O-N 2.74Å; T293-T297 PolarHBondContact O-OG1 3.38Å; I294-T297 PolarHBondContact O-N 3.45Å; I294-T297 PolarHBondContact O-OG1 3.24Å; T295-T297 VanDerWaalsContact C-N 3.32Å; T295-T297 PolarHBondContact O-N 3.24Å; T297-L300 PolarHBondContact O-N 3.04Å; T297-G301 PolarHBondContact O-N 3.23Å
298	A	72.5	Confident	66.8	Low	23 Å²	23	62.2 Å²	62.2	19%	0.19	35%	0.351	C	S	.	.	H	α-helix	trans	-65.9	-38.9	168.6	0	0	0	0	0	112.4	F271 I294 T295 G301 S302	F271-A298 HydrophobicContact CD2-CB 4.27Å; F271-A298 HydrophobicContact CE2-CB 4.06Å; I294-A298 WeakPolarHBondContact O-CB 3.2Å; I294-A298 PolarHBondContact O-N 3.45Å; T295-A298 PolarHBondContact O-N 3.48Å; A298-G301 PolarHBondContact O-N 3.08Å; A298-S302 PolarHBondContact O-N 2.77Å; A298-S302 PolarHBondContact O-OG 3.49Å
299	L	72.4	Confident	67.6	Low	65 Å²	65	58 Å²	58	34%	0.34	34%	0.338	S	S	.	.	H	α-helix	trans	-64	-40.6	171.6	-71.3	169.5	0	0	0	111.3	M73 T295 I296 S302 L303	M73-L299 HydrophobicContact CE-CD2 3.49Å; M73-L299 VanDerWaalsContact CE-CD2 3.49Å; T295-L299 HydrophobicContact CG2-CD1 4.16Å; T295-L299 WeakPolarHBondContact O-CB 3.37Å; T295-L299 VanDerWaalsContact O-CG 3.23Å; T295-L299 WeakPolarHBondContact O-CG 2.99Å; T295-L299 PolarHBondContact O-N 2.74Å; I296-L299 PolarHBondContact O-N 3.12Å; L299-S302 CarbonylContact O-C 3.58Å; L299-S302 WeakPolarHBondContact O-CA 3.38Å; L299-S302 VanDerWaalsContact O-CB 3.32Å; L299-S302 WeakPolarHBondContact O-CB 3.37Å; L299-S302 PolarHBondContact O-N 2.97Å; L299-S302 VanDerWaalsContact O-N 3.09Å; L299-L303 PolarHBondContact O-N 2.81Å
300	L	76	Confident	68	Low	55 Å²	55	59.9 Å²	59.9	29%	0.288	33%	0.326	S	S	.	.	H	α-helix	trans	-65.1	-39.7	176	-173.9	59.7	0	0	0	112.6	C267 P270 I296 T297 S302 L303	C267-L300 WeakPolarHBondContact CB-O 3.4Å; P270-L300 HydrophobicContact CG-CD2 3.59Å; I296-L300 WeakPolarHBondContact O-CB 3.31Å; I296-L300 PolarHBondContact O-N 3.25Å; T297-L300 PolarHBondContact O-N 3.04Å; L300-S302 VanDerWaalsContact C-N 3.27Å; L300-S302 PolarHBondContact O-N 3.19Å; L300-L303 HydrophobicContact CD1-CD1 4.04Å; L300-L303 WeakPolarHBondContact O-CB 3.35Å; L300-L303 PolarHBondContact O-N 2.87Å
301	G	71.1	Confident	68.5	Low	1 Å²	1	52.7 Å²	52.7	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-36	169.3	0	0	0	0	0	112.5	W268 T297 A298 N304	W268-G301 WeakPolarHBondContact CZ2-O 3.29Å; T297-G301 PolarHBondContact O-N 3.23Å; A298-G301 PolarHBondContact O-N 3.08Å; G301-N304 VanDerWaalsContact O-CB 3.29Å; G301-N304 WeakPolarHBondContact O-CB 3.41Å; G301-N304 PolarHBondContact O-N 3.45Å
302	S	70.6	Confident	68.5	Low	20 Å²	20	53.3 Å²	53.3	14%	0.14	29%	0.292	C	S	.	.	H	α-helix	trans	-69.2	-31.8	176.2	-56.7	0	0	0	0	113	A298 L299 L300 N304 S305	A298-S302 PolarHBondContact O-N 2.77Å; A298-S302 PolarHBondContact O-OG 3.49Å; L299-S302 CarbonylContact O-C 3.58Å; L299-S302 WeakPolarHBondContact O-CA 3.38Å; L299-S302 VanDerWaalsContact O-CB 3.32Å; L299-S302 WeakPolarHBondContact O-CB 3.37Å; L299-S302 PolarHBondContact O-N 2.97Å; L299-S302 VanDerWaalsContact O-N 3.09Å; L300-S302 VanDerWaalsContact C-N 3.27Å; L300-S302 PolarHBondContact O-N 3.19Å; S302-N304 PolarHBondContact O-N 2.92Å; S302-S305 PolarHBondContact O-N 3.09Å
303	L	70.2	Confident	68	Low	88 Å²	88	52.5 Å²	52.5	46%	0.461	28%	0.282	S	S	.	.	H	α-helix	trans	-61.3	-25.4	175.5	-73.4	173.3	0	0	0	113.1	L299 L300 S305 C306 C307	L299-L303 PolarHBondContact O-N 2.81Å; L300-L303 HydrophobicContact CD1-CD1 4.04Å; L300-L303 WeakPolarHBondContact O-CB 3.35Å; L300-L303 PolarHBondContact O-N 2.87Å; L303-S305 VanDerWaalsContact C-N 3.26Å; L303-S305 PolarHBondContact O-N 2.03Å; L303-C306 HydrophobicContact CD2-CB 4.5Å; L303-C306 CarbonylContact O-C 3.56Å; L303-C306 WeakPolarHBondContact O-CA 3.4Å; L303-C306 WeakPolarHBondContact O-CB 3.48Å; L303-C306 PolarHBondContact O-N 3.41Å; L303-C307 PolarHBondContact O-N 2.99Å; L303-C307 PolarHBondContact O-SG 2.9Å
304	N	70.7	Confident	67.5	Low	5 Å²	5	56.8 Å²	56.8	3%	0.027	30%	0.295	C	S	.	.	H	α-helix	trans	-53.1	-42.6	173.9	174.7	67.1	0	0	0	112.5	Y264 C267 W268 G301 S302 N308	Y264-N304 WeakPolarHBondContact CD2-OD1 3.45Å; C267-N304 HydrophobicContact CB-CB 4Å; W268-N304 VanDerWaalsContact NE1-CG 3.26Å; W268-N304 PolarHBondContact NE1-ND2 3.01Å; G301-N304 VanDerWaalsContact O-CB 3.29Å; G301-N304 WeakPolarHBondContact O-CB 3.41Å; G301-N304 PolarHBondContact O-N 3.45Å; S302-N304 PolarHBondContact O-N 2.92Å; N304-N308 PolarHBondContact O-ND2 3.34Å
305	S	69.8	Low	66.8	Low	15 Å²	15	54.8 Å²	54.8	11%	0.105	28%	0.284	C	S	.	.	H	α-helix	trans	-67.4	-39.5	177.1	-66.5	0	0	0	0	111.5	S302 L303	S302-S305 PolarHBondContact O-N 3.09Å; L303-S305 VanDerWaalsContact C-N 3.26Å; L303-S305 PolarHBondContact O-N 2.03Å
306	C	65.3	Low	66.2	Low	66 Å²	66	54 Å²	54	45%	0.446	28%	0.281	S	S	.	.	H	α-helix	trans	-68.1	-35.9	177.9	-61.5	0	0	0	0	113	L303 N308 P309	L303-C306 HydrophobicContact CD2-CB 4.5Å; L303-C306 CarbonylContact O-C 3.56Å; L303-C306 WeakPolarHBondContact O-CA 3.4Å; L303-C306 WeakPolarHBondContact O-CB 3.48Å; L303-C306 PolarHBondContact O-N 3.41Å; C306-N308 VanDerWaalsContact C-N 3.28Å; C306-N308 PolarHBondContact O-N 3.46Å; C306-P309 WeakPolarHBondContact O-CD 3.5Å
307	C	65.1	Low	65.2	Low	41 Å²	41	50 Å²	50	28%	0.277	27%	0.266	S	S	.	.	H	α-helix	trans	-66.5	-26.3	-178.3	-72.3	0	0	0	0	113.7	L303 W310 I311	L303-C307 PolarHBondContact O-N 2.99Å; L303-C307 PolarHBondContact O-SG 2.9Å; C307-W310 PolarHBondContact O-N 3.44Å; C307-I311 HydrophobicContact CB-CD1 4.23Å; C307-I311 WeakPolarHBondContact O-CG1 3.48Å; C307-I311 PolarHBondContact O-N 2.81Å; C307-I311 VanDerWaalsContact O-N 3.11Å
308	N	68.5	Low	64.1	Low	28 Å²	28	55.5 Å²	55.5	15%	0.15	29%	0.291	C	S	.	.	H	α-helix	trans	-55.4	-58.4	-173.1	-72.3	-48.8	0	0	0	112.9	N304 C306 W310 I311 Y312	N304-N308 PolarHBondContact O-ND2 3.34Å; C306-N308 VanDerWaalsContact C-N 3.28Å; C306-N308 PolarHBondContact O-N 3.46Å; N308-W310 VanDerWaalsContact C-N 3.3Å; N308-W310 PolarHBondContact O-N 2.87Å; N308-I311 PolarHBondContact O-N 3.33Å; N308-I311 VanDerWaalsContact O-N 3.1Å; N308-Y312 HydrophobicContact CB-CE2 4.42Å; N308-Y312 WeakPolarHBondContact O-CD2 3.47Å; N308-Y312 PolarHBondContact O-N 3.19Å
309	P	61.9	Low	63	Low	69 Å²	69	59.4 Å²	59.4	45%	0.448	31%	0.308	S	S	.	.	H	α-helix	trans	-53	-40	176.9	-28.5	35.1	0	0	0	114.8	C306 I311 Y312 M313	C306-P309 WeakPolarHBondContact O-CD 3.5Å; P309-I311 VanDerWaalsContact C-N 3.35Å; P309-I311 PolarHBondContact O-N 3.15Å; P309-Y312 PolarHBondContact O-N 3.35Å; P309-M313 WeakPolarHBondContact O-CB 3.41Å; P309-M313 PolarHBondContact O-N 3.25Å
310	W	58.7	Low	61.9	Low	161 Å²	161	59 Å²	59	61%	0.61	31%	0.306	S	S	*	.	H	α-helix	trans	-64.5	-39.5	179.1	-61.1	95.6	0	0	0	112	C307 N308 M313 F314	C307-W310 PolarHBondContact O-N 3.44Å; N308-W310 VanDerWaalsContact C-N 3.3Å; N308-W310 PolarHBondContact O-N 2.87Å; W310-M313 HydrophobicContact CE3-CE 3.5Å; W310-M313 HydrophobicContact CZ3-CE 3.68Å; W310-M313 PolarHBondContact O-N 2.85Å; W310-F314 WeakPolarHBondContact O-CD2 3.24Å; W310-F314 PolarHBondContact O-N 3.19Å
311	I	61.6	Low	60.8	Low	23 Å²	23	62.6 Å²	62.6	12%	0.118	32%	0.321	C	S	.	.	H	α-helix	trans	-68.6	-39.3	176.8	-56.9	161	0	0	0	110.3	M256 V259 I260 A263 C307 N308 P309 M313 F315	M256-I311 HydrophobicContact CG-CG2 4.49Å; V259-I311 HydrophobicContact CG1-CG2 4.28Å; I260-I311 HydrophobicContact CD1-CG2 4.15Å; I260-I311 HydrophobicContact CG1-CB 4.18Å; I260-I311 HydrophobicContact CG1-CD1 4.1Å; I260-I311 HydrophobicContact CG1-CG2 3.46Å; I260-I311 VanDerWaalsContact CG1-CG2 3.46Å; A263-I311 HydrophobicContact CB-CD1 4.16Å; C307-I311 HydrophobicContact CB-CD1 4.23Å; C307-I311 WeakPolarHBondContact O-CG1 3.48Å; C307-I311 PolarHBondContact O-N 2.81Å; C307-I311 VanDerWaalsContact O-N 3.11Å; N308-I311 PolarHBondContact O-N 3.33Å; N308-I311 VanDerWaalsContact O-N 3.1Å; P309-I311 VanDerWaalsContact C-N 3.35Å; P309-I311 PolarHBondContact O-N 3.15Å; I311-M313 VanDerWaalsContact C-N 3.33Å; I311-M313 PolarHBondContact O-N 3.09Å; I311-F315 WeakPolarHBondContact O-CB 3.38Å; I311-F315 PolarHBondContact O-N 3.27Å; I311-F315 VanDerWaalsContact O-N 3.16Å
312	Y	60.2	Low	60	Low	65 Å²	65	65.4 Å²	65.4	26%	0.255	34%	0.336	S	S	.	.	H	α-helix	trans	-61.2	-40.5	170.6	-71.1	-76.2	0	0	0	112.2	M109 M256 I260 N308 P309 S316	M109-Y312 PolarHBondContact SD-OH 2.88Å; M256-Y312 HydrophobicContact CE-CD1 3.15Å; M256-Y312 HydrophobicContact CE-CE1 3.48Å; M256-Y312 VanDerWaalsContact CE-CE1 3.48Å; M256-Y312 HydrophobicContact CE-CG 3.8Å; I260-Y312 HydrophobicContact CD1-CE2 4.47Å; N308-Y312 HydrophobicContact CB-CE2 4.42Å; N308-Y312 WeakPolarHBondContact O-CD2 3.47Å; N308-Y312 PolarHBondContact O-N 3.19Å; P309-Y312 PolarHBondContact O-N 3.35Å; Y312-S316 WeakPolarHBondContact O-CB 3.1Å; Y312-S316 PolarHBondContact O-N 2.88Å; Y312-S316 PolarHBondContact O-OG 2.93Å
313	M	58.9	Low	59.2	Low	60 Å²	60	67.6 Å²	67.6	30%	0.296	35%	0.351	S	S	.	.	H	α-helix	trans	-66.7	-56.1	-179.3	-174.1	177.8	78.9	0	0	112.4	P309 W310 I311 F315 S316 G317 L320	P309-M313 WeakPolarHBondContact O-CB 3.41Å; P309-M313 PolarHBondContact O-N 3.25Å; W310-M313 HydrophobicContact CE3-CE 3.5Å; W310-M313 HydrophobicContact CZ3-CE 3.68Å; W310-M313 PolarHBondContact O-N 2.85Å; I311-M313 VanDerWaalsContact C-N 3.33Å; I311-M313 PolarHBondContact O-N 3.09Å; M313-F315 PolarHBondContact O-N 2.96Å; M313-F315 VanDerWaalsContact O-N 3.17Å; M313-S316 PolarHBondContact O-N 3.06Å; M313-G317 PolarHBondContact O-N 3.17Å; M313-L320 HydrophobicContact CE-CD2 4.33Å; M313-L320 HydrophobicContact CG-CD1 3.93Å; M313-L320 HydrophobicContact CG-CD2 4.11Å; M313-L320 HydrophobicContact CG-CG 3.59Å; M313-L320 HydrophobicContact SD-CD2 4.11Å; M313-L320 HydrophobicContact SD-CG 4.26Å
314	F	57.9	Low	58.5	Low	159 Å²	159	66.5 Å²	66.5	70%	0.697	35%	0.347	S	S	*	.	H	α-helix	trans	-54.6	-36	177	-97.1	-79.1	0	0	0	112.4	W310	W310-F314 WeakPolarHBondContact O-CD2 3.24Å; W310-F314 PolarHBondContact O-N 3.19Å
315	F	55	Low	57.6	Low	31 Å²	31	70.8 Å²	70.8	14%	0.136	37%	0.367	C	S	.	.	H	α-helix	trans	-94.1	-27.4	-170.2	-148.3	-85.8	0	0	0	114.5	R252 K255 M256 I311 M313	R252-F315 HydrophobicContact CB-CE1 4.02Å; R252-F315 HydrophobicContact CB-CZ 4.28Å; R252-F315 HydrophobicContact CG-CD1 4.06Å; R252-F315 HydrophobicContact CG-CE1 3.13Å; R252-F315 HydrophobicContact CG-CZ 3.61Å; R252-F315 PolarHBondContact NE-O 2.88Å; R252-F315 PolarHBondContact NH2-O 3.01Å; R252-F315 WeakPolarHBondContact O-CE1 3.29Å; R252-F315 WeakPolarHBondContact O-CZ 3.08Å; K255-F315 HydrophobicContact CB-CE2 4.3Å; K255-F315 HydrophobicContact CB-CZ 4.06Å; M256-F315 HydrophobicContact CB-CB 4.42Å; M256-F315 HydrophobicContact CB-CD1 3.39Å; M256-F315 HydrophobicContact CB-CD2 3.99Å; M256-F315 HydrophobicContact CB-CE1 3.48Å; M256-F315 VanDerWaalsContact CB-CE1 3.48Å; M256-F315 HydrophobicContact CB-CE2 4.12Å; M256-F315 HydrophobicContact CB-CG 3.63Å; M256-F315 HydrophobicContact CB-CZ 3.9Å; M256-F315 HydrophobicContact CE-CB 3.85Å; M256-F315 HydrophobicContact CE-CG 4.47Å; M256-F315 HydrophobicContact CG-CB 3.69Å; M256-F315 HydrophobicContact CG-CD1 3.48Å; M256-F315 VanDerWaalsContact CG-CD1 3.48Å; M256-F315 HydrophobicContact CG-CD2 4.07Å; M256-F315 HydrophobicContact CG-CE1 4.12Å; M256-F315 HydrophobicContact CG-CG 3.43Å; M256-F315 VanDerWaalsContact CG-CG 3.43Å; M256-F315 HydrophobicContact SD-CB 3.82Å; M256-F315 HydrophobicContact SD-CD1 3.45Å; M256-F315 WeakPolarHBondContact SD-CD1 3.31Å; M256-F315 HydrophobicContact SD-CE1 4.31Å; M256-F315 HydrophobicContact SD-CG 3.83Å; I311-F315 WeakPolarHBondContact O-CB 3.38Å; I311-F315 PolarHBondContact O-N 3.27Å; I311-F315 VanDerWaalsContact O-N 3.16Å; M313-F315 PolarHBondContact O-N 2.96Å; M313-F315 VanDerWaalsContact O-N 3.17Å
316	S	57.5	Low	57	Low	41 Å²	41	74.9 Å²	74.9	29%	0.287	40%	0.396	S	S	.	.	H	α-helix	trans	-68.7	-42.5	173.5	-60.8	0	0	0	0	111	R252 Y312 M313 H318	R252-S316 PolarHBondContact NH2-O 2.73Å; Y312-S316 WeakPolarHBondContact O-CB 3.1Å; Y312-S316 PolarHBondContact O-N 2.88Å; Y312-S316 PolarHBondContact O-OG 2.93Å; M313-S316 PolarHBondContact O-N 3.06Å; S316-H318 PolarHBondContact O-N 3.44Å
317	G	50.8	Low	56.5	Low	24 Å²	24	77.4 Å²	77.4	25%	0.247	40%	0.4	C	S	.	.			trans	68.2	-46	178.1	0	0	0	0	0	114.2	M313 L320 Q321	M313-G317 PolarHBondContact O-N 3.17Å; G317-L320 WeakPolarHBondContact O-CB 3.44Å; G317-L320 PolarHBondContact O-N 3.47Å; G317-Q321 WeakPolarHBondContact O-CB 3.23Å; G317-Q321 PolarHBondContact O-N 3.39Å
318	H	52.1	Low	56.1	Low	125 Å²	125	80.2 Å²	80.2	58%	0.579	42%	0.417	S	S	*	.	H	α-helix	trans	-59.6	-48.6	173.3	-159	-66.2	0	0	0	111	S316 L320 Q321 D322	S316-H318 PolarHBondContact O-N 3.44Å; H318-L320 VanDerWaalsContact C-N 3.26Å; H318-L320 PolarHBondContact O-N 3.31Å; H318-Q321 CarbonylContact O-C 3.58Å; H318-Q321 WeakPolarHBondContact O-CA 3.38Å; H318-Q321 VanDerWaalsContact O-CB 3.29Å; H318-Q321 WeakPolarHBondContact O-CB 3.32Å; H318-Q321 PolarHBondContact O-N 2.69Å; H318-D322 IonicContact CE1-OD1 3.42Å; H318-D322 IonicContact CE1-OD2 2.76Å; H318-D322 PolarHBondContact CE1-OD2 3.13Å; H318-D322 IonicContact CG-OD2 3.47Å; H318-D322 IonicContact ND1-OD1 2.72Å; H318-D322 PolarHBondContact ND1-OD1 3.49Å; H318-D322 IonicContact ND1-OD2 3.57Å; H318-D322 PolarHBondContact ND1-OD2 3.35Å; H318-D322 PolarHBondContact O-N 3.18Å; H318-D322 VanDerWaalsContact O-OD2 3.05Å
319	L	48.3	Very low	55.4	Low	105 Å²	105	83.3 Å²	83.3	55%	0.55	44%	0.44	S	S	.	.	H	α-helix	trans	-62.1	-31	176.3	-64	176.8	0	0	0	113.4	C323	L319-C323 WeakPolarHBondContact O-CB 3.45Å; L319-C323 PolarHBondContact O-N 3.05Å
320	L	50.7	Low	54.8	Low	58 Å²	58	82.2 Å²	82.2	30%	0.304	43%	0.434	S	S	.	.	H	α-helix	trans	-68.5	-43.3	169.8	-100.8	165.6	0	0	0	110.7	M313 G317 H318 D322 C323 V324	M313-L320 HydrophobicContact CE-CD2 4.33Å; M313-L320 HydrophobicContact CG-CD1 3.93Å; M313-L320 HydrophobicContact CG-CD2 4.11Å; M313-L320 HydrophobicContact CG-CG 3.59Å; M313-L320 HydrophobicContact SD-CD2 4.11Å; M313-L320 HydrophobicContact SD-CG 4.26Å; G317-L320 WeakPolarHBondContact O-CB 3.44Å; G317-L320 PolarHBondContact O-N 3.47Å; H318-L320 VanDerWaalsContact C-N 3.26Å; H318-L320 PolarHBondContact O-N 3.31Å; L320-D322 VanDerWaalsContact C-N 3.31Å; L320-D322 PolarHBondContact O-N 3.24Å; L320-C323 PolarHBondContact O-N 3.07Å; L320-V324 WeakPolarHBondContact O-CB 3.33Å; L320-V324 WeakPolarHBondContact O-CG2 3.34Å; L320-V324 PolarHBondContact O-N 3.48Å
321	Q	51.7	Low	54.6	Low	129 Å²	129	80.3 Å²	80.3	60%	0.603	43%	0.431	S	S	*	.	H	α-helix	trans	-63.8	-36.1	177.9	-160.1	170.2	-13.4	0	0	111.9	G317 H318 Q325	G317-Q321 WeakPolarHBondContact O-CB 3.23Å; G317-Q321 PolarHBondContact O-N 3.39Å; H318-Q321 CarbonylContact O-C 3.58Å; H318-Q321 WeakPolarHBondContact O-CA 3.38Å; H318-Q321 VanDerWaalsContact O-CB 3.29Å; H318-Q321 WeakPolarHBondContact O-CB 3.32Å; H318-Q321 PolarHBondContact O-N 2.69Å; Q321-Q325 WeakPolarHBondContact O-CB 3.34Å; Q321-Q325 WeakPolarHBondContact O-CG 3.4Å; Q321-Q325 PolarHBondContact O-N 3.47Å; Q321-Q325 VanDerWaalsContact O-N 3.13Å; Q321-Q325 PolarHBondContact O-NE2 3.19Å
322	D	55	Low	54	Low	61 Å²	61	84.8 Å²	84.8	33%	0.326	46%	0.456	S	S	.	.	H	α-helix	trans	-74	-46.2	175.5	-56.9	-36.4	0	0	0	111.4	H318 L320 V324 Q325 S326	H318-D322 IonicContact CE1-OD1 3.42Å; H318-D322 IonicContact CE1-OD2 2.76Å; H318-D322 PolarHBondContact CE1-OD2 3.13Å; H318-D322 IonicContact CG-OD2 3.47Å; H318-D322 IonicContact ND1-OD1 2.72Å; H318-D322 PolarHBondContact ND1-OD1 3.49Å; H318-D322 IonicContact ND1-OD2 3.57Å; H318-D322 PolarHBondContact ND1-OD2 3.35Å; H318-D322 PolarHBondContact O-N 3.18Å; H318-D322 VanDerWaalsContact O-OD2 3.05Å; L320-D322 VanDerWaalsContact C-N 3.31Å; L320-D322 PolarHBondContact O-N 3.24Å; D322-V324 VanDerWaalsContact C-N 3.35Å; D322-V324 PolarHBondContact O-N 3.36Å; D322-Q325 WeakPolarHBondContact O-CA 3.45Å; D322-Q325 WeakPolarHBondContact O-CB 3.41Å; D322-Q325 PolarHBondContact O-N 3.09Å; D322-S326 PolarHBondContact O-N 3.48Å
323	C	52.6	Low	53.5	Low	66 Å²	66	88.2 Å²	88.2	45%	0.446	48%	0.476	S	S	.	.	H	α-helix	trans	-63.6	-39.3	177.3	-170.2	0	0	0	0	111.9	L319 L320 Q325 S326 F327	L319-C323 WeakPolarHBondContact O-CB 3.45Å; L319-C323 PolarHBondContact O-N 3.05Å; L320-C323 PolarHBondContact O-N 3.07Å; C323-Q325 VanDerWaalsContact C-N 3.31Å; C323-Q325 PolarHBondContact O-N 3Å; C323-S326 WeakPolarHBondContact O-CB 3.2Å; C323-S326 PolarHBondContact O-N 3.07Å; C323-S326 VanDerWaalsContact O-N 3.17Å; C323-F327 VanDerWaalsContact O-CD2 3.24Å; C323-F327 WeakPolarHBondContact O-CD2 3.33Å; C323-F327 PolarHBondContact O-N 3.32Å
324	V	55.8	Low	53	Low	64 Å²	64	91.9 Å²	91.9	39%	0.388	49%	0.49	S	S	.	.	H	α-helix	trans	-67.8	-28.4	172.8	170.4	0	0	0	0	112	L320 D322 F327 C330	L320-V324 WeakPolarHBondContact O-CB 3.33Å; L320-V324 WeakPolarHBondContact O-CG2 3.34Å; L320-V324 PolarHBondContact O-N 3.48Å; D322-V324 VanDerWaalsContact C-N 3.35Å; D322-V324 PolarHBondContact O-N 3.36Å; V324-F327 PolarHBondContact O-N 3.27Å; V324-C330 HydrophobicContact CG1-CB 3.8Å; V324-C330 WeakPolarHBondContact O-CB 3.41Å
325	Q	51.8	Low	52.7	Low	95 Å²	95	91.1 Å²	91.1	44%	0.444	49%	0.489	S	S	.	.	H	α-helix	trans	-73.1	-27.3	170.9	-80	170	96.1	0	0	113	Q321 D322 C323 F327 Q331	Q321-Q325 WeakPolarHBondContact O-CB 3.34Å; Q321-Q325 WeakPolarHBondContact O-CG 3.4Å; Q321-Q325 PolarHBondContact O-N 3.47Å; Q321-Q325 VanDerWaalsContact O-N 3.13Å; Q321-Q325 PolarHBondContact O-NE2 3.19Å; D322-Q325 WeakPolarHBondContact O-CA 3.45Å; D322-Q325 WeakPolarHBondContact O-CB 3.41Å; D322-Q325 PolarHBondContact O-N 3.09Å; C323-Q325 VanDerWaalsContact C-N 3.31Å; C323-Q325 PolarHBondContact O-N 3Å; Q325-F327 VanDerWaalsContact C-N 3.32Å; Q325-Q331 PolarHBondContact O-NE2 2.99Å
326	S	57.6	Low	52.3	Low	101 Å²	101	96.5 Å²	96.5	71%	0.706	51%	0.512	S	S	*	.	H	α-helix	trans	-75	-14.2	170.8	-65.8	0	0	0	0	114.1	D322 C323 P328	D322-S326 PolarHBondContact O-N 3.48Å; C323-S326 WeakPolarHBondContact O-CB 3.2Å; C323-S326 PolarHBondContact O-N 3.07Å; C323-S326 VanDerWaalsContact O-N 3.17Å; S326-P328 WeakPolarHBondContact O-CD 3.36Å
327	F	54.4	Low	51.7	Low	120 Å²	120	100.9 Å²	100.9	53%	0.526	53%	0.526	S	S	.	.	S	Bend	trans	-84.3	118.5	172.3	-82.4	-73.7	0	0	0	111.1	C323 V324 Q325 C329 C330	C323-F327 VanDerWaalsContact O-CD2 3.24Å; C323-F327 WeakPolarHBondContact O-CD2 3.33Å; C323-F327 PolarHBondContact O-N 3.32Å; V324-F327 PolarHBondContact O-N 3.27Å; Q325-F327 VanDerWaalsContact C-N 3.32Å; F327-C329 PolarHBondContact O-N 3.34Å; F327-C329 VanDerWaalsContact O-N 3.1Å; F327-C330 PolarHBondContact O-N 3.23Å; F327-C330 VanDerWaalsContact O-N 3.17Å
328	P	57.7	Low	51.5	Low	100 Å²	100	104.3 Å²	104.3	65%	0.649	54%	0.539	S	S	*	.	H	α-helix	trans	-58.8	-29.7	-174.9	-24.3	32.6	0	0	0	114.2	S326 C330 Q331	S326-P328 WeakPolarHBondContact O-CD 3.36Å; P328-C330 VanDerWaalsContact C-N 3.29Å; P328-C330 PolarHBondContact O-N 3.15Å; P328-Q331 PolarHBondContact O-N 3Å
329	C	53.6	Low	51.1	Low	93 Å²	93	105.9 Å²	105.9	63%	0.628	54%	0.544	S	S	*	.	H	α-helix	trans	-68.8	-19.7	-177.9	47.5	0	0	0	0	114.5	F327	F327-C329 PolarHBondContact O-N 3.34Å; F327-C329 VanDerWaalsContact O-N 3.1Å
330	C	49.3	Very low	50.9	Low	46 Å²	46	106.2 Å²	106.2	31%	0.311	54%	0.543	S	S	.	.	H	α-helix	trans	-92.8	-12.3	179.6	-69.2	0	0	0	0	114.2	V324 F327 P328 M333	V324-C330 HydrophobicContact CG1-CB 3.8Å; V324-C330 WeakPolarHBondContact O-CB 3.41Å; F327-C330 PolarHBondContact O-N 3.23Å; F327-C330 VanDerWaalsContact O-N 3.17Å; P328-C330 VanDerWaalsContact C-N 3.29Å; P328-C330 PolarHBondContact O-N 3.15Å; C330-M333 PolarHBondContact O-N 3.34Å
331	Q	54.7	Low	50.5	Low	121 Å²	121	107.6 Å²	107.6	57%	0.565	55%	0.55	S	S	*	*	H	α-helix	trans	-67.5	-42.5	176.8	-63.1	-175.5	-2.2	0	0	111.4	Q325 P328 M333 K334 E335	Q325-Q331 PolarHBondContact O-NE2 2.99Å; P328-Q331 PolarHBondContact O-N 3Å; Q331-M333 VanDerWaalsContact C-N 3.28Å; Q331-M333 PolarHBondContact O-N 3.02Å; Q331-K334 PolarHBondContact O-N 3.08Å; Q331-E335 PolarHBondContact O-N 3.48Å
332	N	48.4	Very low	50.2	Low	117 Å²	117	106.1 Å²	106.1	63%	0.626	55%	0.55	S	S	*	*	H	α-helix	trans	-59.2	-30.6	177.6	-80.1	-23.7	0	0	0	114.1	K334 K336	N332-K334 VanDerWaalsContact C-N 3.35Å; N332-K336 WeakPolarHBondContact O-CB 3.24Å; N332-K336 PolarHBondContact O-N 2.95Å
333	M	50.3	Low	49.8	Very low	137 Å²	137	108.6 Å²	108.6	68%	0.675	56%	0.564	S	S	*	*	H	α-helix	trans	-70.1	-32.6	176.5	-67.5	-145.5	-53.5	0	0	112.3	C330 Q331 K336 F337	C330-M333 PolarHBondContact O-N 3.34Å; Q331-M333 VanDerWaalsContact C-N 3.28Å; Q331-M333 PolarHBondContact O-N 3.02Å; M333-K336 PolarHBondContact O-N 3.4Å; M333-F337 PolarHBondContact O-N 2.81Å
334	K	48.6	Very low	49.3	Very low	137 Å²	137	108.8 Å²	108.8	60%	0.596	57%	0.565	S	S	*	*	H	α-helix	trans	-73.7	-37.5	-179.2	-164.7	178.9	-178.8	-174.6	0	111.9	Q331 N332 N338	Q331-K334 PolarHBondContact O-N 3.08Å; N332-K334 VanDerWaalsContact C-N 3.35Å; K334-N338 WeakPolarHBondContact O-CB 3.47Å; K334-N338 PolarHBondContact O-N 3.02Å; K334-N338 VanDerWaalsContact O-N 3.13Å
335	E	51.5	Low	48.6	Very low	143 Å²	143	111.6 Å²	111.6	67%	0.668	58%	0.576	S	S	*	*	H	α-helix	trans	-64.5	-42.7	171.1	-69.4	-161	143.2	0	0	111.9	Q331 F337 N338 K339	Q331-E335 PolarHBondContact O-N 3.48Å; E335-F337 PolarHBondContact O-N 3.2Å; E335-N338 PolarHBondContact O-N 3.36Å; E335-K339 WeakPolarHBondContact O-CB 3.37Å; E335-K339 PolarHBondContact O-N 3.38Å; E335-K339 VanDerWaalsContact O-N 3.09Å
336	K	46.4	Very low	48.1	Very low	144 Å²	144	110.7 Å²	110.7	63%	0.626	58%	0.58	S	S	*	*	H	α-helix	trans	-63.3	-42.5	-179.9	-158.8	173.8	-176.3	-175.8	0	112.1	N332 M333 K339 E340	N332-K336 WeakPolarHBondContact O-CB 3.24Å; N332-K336 PolarHBondContact O-N 2.95Å; M333-K336 PolarHBondContact O-N 3.4Å; K336-K339 PolarHBondContact O-N 2.86Å; K336-E340 PolarHBondContact O-N 2.96Å
337	F	45	Very low	47.3	Very low	132 Å²	132	115.7 Å²	115.7	58%	0.579	58%	0.584	S	S	*	*	H	α-helix	trans	-67.3	-44.9	178.2	-148.8	-88.2	0	0	0	112.6	M333 E335 K339 E340 D341	M333-F337 PolarHBondContact O-N 2.81Å; E335-F337 PolarHBondContact O-N 3.2Å; F337-K339 PolarHBondContact O-N 3.28Å; F337-E340 PolarHBondContact O-N 3.44Å; F337-D341 PolarHBondContact O-N 3.1Å; F337-D341 VanDerWaalsContact O-N 3.12Å
338	N	46.3	Very low	46.7	Very low	97 Å²	97	119.8 Å²	119.8	52%	0.519	60%	0.595	S	S	.	*	H	α-helix	trans	-61.6	-30.4	175.9	-83.9	-11.8	0	0	0	112.9	K334 E335 T342	K334-N338 WeakPolarHBondContact O-CB 3.47Å; K334-N338 PolarHBondContact O-N 3.02Å; K334-N338 VanDerWaalsContact O-N 3.13Å; E335-N338 PolarHBondContact O-N 3.36Å; N338-T342 PolarHBondContact O-N 3.44Å; N338-T342 PolarHBondContact O-OG1 3.11Å
339	K	43.9	Very low	45.8	Very low	157 Å²	157	121.9 Å²	121.9	68%	0.683	60%	0.597	S	S	*	*	H	α-helix	trans	-73.1	-39	178.6	-157.7	161.1	-174.8	168.1	0	111.9	E335 K336 F337 T342 D343	E335-K339 WeakPolarHBondContact O-CB 3.37Å; E335-K339 PolarHBondContact O-N 3.38Å; E335-K339 VanDerWaalsContact O-N 3.09Å; K336-K339 PolarHBondContact O-N 2.86Å; F337-K339 PolarHBondContact O-N 3.28Å; K339-T342 PolarHBondContact O-N 3.33Å; K339-D343 PolarHBondContact O-N 3.09Å
340	E	43.5	Very low	45.2	Very low	113 Å²	113	122.9 Å²	122.9	53%	0.528	60%	0.6	S	S	.	*	H	α-helix	trans	-69.4	-36.7	176.1	-72.1	174.7	165.9	0	0	113	K336 F337 S344	K336-E340 PolarHBondContact O-N 2.96Å; F337-E340 PolarHBondContact O-N 3.44Å; E340-S344 VanDerWaalsContact O-CB 3.27Å; E340-S344 WeakPolarHBondContact O-CB 3.3Å; E340-S344 PolarHBondContact O-N 3.35Å; E340-S344 VanDerWaalsContact O-N 3.12Å; E340-S344 PolarHBondContact O-OG 2.91Å
341	D	43.5	Very low	44.8	Very low	87 Å²	87	129.5 Å²	129.5	47%	0.465	62%	0.624	S	S	.	*	H	α-helix	trans	-67.5	-36.7	174.1	-87.1	-34.7	0	0	0	112.5	F337 S344 M345	F337-D341 PolarHBondContact O-N 3.1Å; F337-D341 VanDerWaalsContact O-N 3.12Å; D341-S344 PolarHBondContact O-N 3.17Å; D341-M345 PolarHBondContact O-N 3.18Å
342	T	43.5	Very low	44	Very low	98 Å²	98	134.1 Å²	134.1	60%	0.601	64%	0.638	S	S	*	*	H	α-helix	trans	-66.6	-45.7	180	-56.8	0	0	0	0	111.8	N338 K339 S344 M345 S346	N338-T342 PolarHBondContact O-N 3.44Å; N338-T342 PolarHBondContact O-OG1 3.11Å; K339-T342 PolarHBondContact O-N 3.33Å; T342-S344 VanDerWaalsContact C-N 3.33Å; T342-S344 PolarHBondContact O-N 3.23Å; T342-M345 PolarHBondContact O-N 2.75Å; T342-S346 PolarHBondContact O-N 2.8Å
343	D	46.6	Very low	43.4	Very low	113 Å²	113	133.8 Å²	133.8	60%	0.604	64%	0.644	S	S	*	*	H	α-helix	trans	-68.4	-32	175.8	-81	-22.7	0	0	0	112.4	K339 R347	K339-D343 PolarHBondContact O-N 3.09Å; D343-R347 PolarHBondContact O-N 3.14Å
344	S	43.9	Very low	42.7	Very low	69 Å²	69	134.7 Å²	134.7	48%	0.483	65%	0.652	S	S	.	*	H	α-helix	trans	-70.2	-32.9	177.5	-64.4	0	0	0	0	113.4	E340 D341 T342	E340-S344 VanDerWaalsContact O-CB 3.27Å; E340-S344 WeakPolarHBondContact O-CB 3.3Å; E340-S344 PolarHBondContact O-N 3.35Å; E340-S344 VanDerWaalsContact O-N 3.12Å; E340-S344 PolarHBondContact O-OG 2.91Å; D341-S344 PolarHBondContact O-N 3.17Å; T342-S344 VanDerWaalsContact C-N 3.33Å; T342-S344 PolarHBondContact O-N 3.23Å
345	M	41	Very low	42.1	Very low	123 Å²	123	136 Å²	136	61%	0.606	67%	0.666	S	S	*	*	H	α-helix	trans	-73.7	-42.5	173.5	-75.4	-134.6	66.9	0	0	112.4	D341 T342 R347 R348 Q349	D341-M345 PolarHBondContact O-N 3.18Å; T342-M345 PolarHBondContact O-N 2.75Å; M345-R347 VanDerWaalsContact C-N 3.32Å; M345-R347 PolarHBondContact O-N 3.21Å; M345-R348 PolarHBondContact O-N 3.09Å; M345-R348 VanDerWaalsContact O-N 3.11Å; M345-Q349 PolarHBondContact O-N 2.92Å; M345-Q349 VanDerWaalsContact O-N 3.16Å
346	S	40.7	Very low	41.2	Very low	77 Å²	77	140.8 Å²	140.8	54%	0.538	68%	0.677	S	S	.	*	H	α-helix	trans	-58.1	-42.9	178.9	-176.9	0	0	0	0	112.3	T342 R348 T350	T342-S346 PolarHBondContact O-N 2.8Å; S346-R348 VanDerWaalsContact C-N 3.3Å; S346-R348 PolarHBondContact O-N 3.07Å; S346-T350 PolarHBondContact O-OG1 3.47Å
347	R	41.1	Very low	40.6	Very low	206 Å²	206	139.1 Å²	139.1	78%	0.777	68%	0.684	S	S	*	*	H	α-helix	trans	-73.5	-15.2	179.1	-156.8	177.6	-68.9	-145.1	1.3	114.1	D343 M345	D343-R347 PolarHBondContact O-N 3.14Å; M345-R347 VanDerWaalsContact C-N 3.32Å; M345-R347 PolarHBondContact O-N 3.21Å
348	R	40.2	Very low	40.1	Very low	206 Å²	206	139 Å²	139	78%	0.777	70%	0.696	S	S	*	*	H	α-helix	trans	-91.5	-31	175.1	-82.8	-176.1	172.9	169.8	0.9	113.9	M345 S346 T350	M345-R348 PolarHBondContact O-N 3.09Å; M345-R348 VanDerWaalsContact O-N 3.11Å; S346-R348 VanDerWaalsContact C-N 3.3Å; S346-R348 PolarHBondContact O-N 3.07Å; R348-T350 VanDerWaalsContact C-N 3.34Å; R348-T350 PolarHBondContact O-N 2.99Å
349	Q	39.9	Very low	39.4	Very low	144 Å²	144	140.5 Å²	140.5	67%	0.673	71%	0.709	S	S	*	*	H	α-helix	trans	-71.9	-25.1	179.7	-83.1	-175.5	-28.6	0	0	113.8	M345 F351	M345-Q349 PolarHBondContact O-N 2.92Å; M345-Q349 VanDerWaalsContact O-N 3.16Å; Q349-F351 VanDerWaalsContact C-N 3.3Å; Q349-F351 PolarHBondContact O-N 2.63Å
350	T	41.8	Very low	38.7	Very low	113 Å²	113	140.7 Å²	140.7	69%	0.693	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-12	-178.8	24.2	0	0	0	0	115	S346 R348	S346-T350 PolarHBondContact O-OG1 3.47Å; R348-T350 VanDerWaalsContact C-N 3.34Å; R348-T350 PolarHBondContact O-N 2.99Å
351	F	40	Very low	38	Very low	185 Å²	185	141.2 Å²	141.2	81%	0.811	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-5.1	-178	-97.3	-87	0	0	0	115.7	Q349	Q349-F351 VanDerWaalsContact C-N 3.3Å; Q349-F351 PolarHBondContact O-N 2.63Å
352	Y	37.1	Very low	37.4	Very low	219 Å²	219	144.1 Å²	144.1	86%	0.859	76%	0.755	S	S	*	*	S	Bend	trans	-116.4	6.5	-170.1	-101.4	-81.8	0	0	0	116.2
353	S	35.9	Very low	36.7	Very low	109 Å²	109	143.1 Å²	143.1	76%	0.762	76%	0.764	S	S	*	*	S	Bend	trans	-114.2	32.5	-176.2	-167.9	0	0	0	0	114.6
354	N	36	Very low	35.9	Very low	157 Å²	157	145.4 Å²	145.4	84%	0.84	77%	0.773	S	S	*	*			trans	-139.3	60.2	176.2	-146.9	21.5	0	0	0	113.6
355	N	36.3	Very low	35.1	Very low	165 Å²	165	152.8 Å²	152.8	88%	0.882	79%	0.79	S	S	*	*			trans	-162	81.5	158.9	-109.4	-16	0	0	0	111.5
356	R	31.7	Very low	34.5	Very low	242 Å²	242	154.8 Å²	154.8	91%	0.913	80%	0.796	S	S	*	*			trans	-151.8	102.5	159.3	-152.6	171.2	-166.2	161.2	4.5	111.6
357	S	34	Very low	33.9	Very low	109 Å²	109	157.5 Å²	157.5	76%	0.762	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-66.5	140.3	175.4	-39.3	0	0	0	0	111.8
358	P	36.1	Very low	33.4	Very low	130 Å²	130	153 Å²	153	84%	0.844	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-99.3	132.2	159.3	8.7	10.8	0	0	0	110.8
359	T	30.6	Very low	33.8	Very low	128 Å²	128	148.3 Å²	148.3	79%	0.785	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-90.2	131.5	174	44.8	0	0	0	0	112.2
360	N	28.6	Very low	33.2	Very low	161 Å²	161	150.9 Å²	150.9	86%	0.861	81%	0.809	S	S	*	*			trans	54.3	112.6	152.2	-62.9	-3.2	0	0	0	120.4
361	S	29.1	Very low	32.4	Very low	125 Å²	125	150.5 Å²	150.5	87%	0.874	81%	0.811	S	S	*	*				-143.4	154.1	116.5	80.5	0	0	0	0	111.2
362	T	31.5	Very low	31.9	Very low	147 Å²	147	146 Å²	146	90%	0.902	80%	0.803	S	S	*	*			trans	-80.7	140.7	-169.4	42.9	0	0	0	0	114.3
363	G	29.1	Very low	31.6	Very low	77 Å²	77	144.7 Å²	144.7	79%	0.794	80%	0.802	S	S	*	*			trans	-170.4	113.8	165.9	0	0	0	0	0	111.9
364	M	28.6	Very low	31.2	Very low	162 Å²	162	144.5 Å²	144.5	80%	0.798	80%	0.8	S	S	*	*			trans	-72.8	147.2	172.6	-74.3	160	48.5	0	0	110.9
365	W	27.8	Very low	31	Very low	223 Å²	223	144.7 Å²	144.7	85%	0.845	80%	0.8	S	S	*	*				165.9	126.9	116.3	-92	91.5	0	0	0	111.2
366	K	29.4	Very low	30.9	Very low	166 Å²	166	145.7 Å²	145.7	72%	0.722	80%	0.796	S	S	*	*			trans	-14.7	148.2	155	-87.2	177.2	171.4	-177.4	0	117.8
367	D	27.6	Very low	30.7	Very low	133 Å²	133	143.6 Å²	143.6	71%	0.711	79%	0.794	S	S	*	*			cis	-167.9	148.6	46	-100	-40.7	0	0	0	114.4
368	S	29.8	Very low	30.9	Very low	113 Å²	113	145.8 Å²	145.8	79%	0.79	80%	0.795	S	S	*	*			trans	34.2	167.1	132.2	-93.6	0	0	0	0	125.8
369	P	48.4	Very low	31.4	Very low	106 Å²	106	145 Å²	145	69%	0.688	79%	0.79	S	S	*	*			trans	-134.2	-172.4	-134	39.8	-19.2	0	0	0	118.3
370	K	28.5	Very low	31.4	Very low	198 Å²	198	145.2 Å²	145.2	86%	0.861	79%	0.791	S	S	*	*			trans	85.7	133.3	163.9	-57.7	173.3	176.4	176.1	0	118.9
371	S	25.6	Very low	31.7	Very low	105 Å²	105	142.7 Å²	142.7	73%	0.734	79%	0.786	S	S	*	*				139.6	129.3	110.1	-161	0	0	0	0	117
372	S	29.5	Very low	32.3	Very low	90 Å²	90	147.1 Å²	147.1	63%	0.629	81%	0.808	S	S	*	*			trans	79.4	127.9	138.6	-72.8	0	0	0	0	124.9
373	K	30.2	Very low	32.3	Very low	193 Å²	193	147.2 Å²	147.2	84%	0.839	80%	0.804	S	S	*	*			trans	72.1	115.9	140	-66.2	169.8	-175.2	179.9	0	117.3
374	S	27.8	Very low	32.5	Very low	105 Å²	105	150.8 Å²	150.8	73%	0.734	80%	0.804	S	S	*	*				84.1	120.5	57.7	172	0	0	0	0	113.7
375	I	31.4	Very low	32.7	Very low	161 Å²	161	150.2 Å²	150.2	83%	0.826	81%	0.805	S	S	*	*				-167.1	142	126.2	-96.8	150.5	0	0	0	109.6
376	K	33.4	Very low	33	Very low	185 Å²	185	145.9 Å²	145.9	80%	0.804	80%	0.802	S	S	*	*			trans	-77.5	163.5	175	-67.3	170.1	170	176.6	0	110.9
377	F	28.8	Very low	33.3	Very low	199 Å²	199	144.7 Å²	144.7	87%	0.873	81%	0.807	S	S	*	*				-171.4	133.3	116.3	-101.2	-69.7	0	0	0	113.2
378	I	37.3	Very low	33.6	Very low	154 Å²	154	145.5 Å²	145.5	79%	0.79	81%	0.814	S	S	*	*			trans	-145.4	150.4	167.5	-59.1	168.2	0	0	0	102.1
379	P	46.9	Very low	33.9	Very low	113 Å²	113	147.8 Å²	147.8	73%	0.734	82%	0.815	S	S	*	*			cis	-115.5	-154.7	19.8	17.9	10.8	0	0	0	111.2
380	V	30.3	Very low	32.8	Very low	134 Å²	134	151 Å²	151	81%	0.812	83%	0.825	S	S	*	*			cis	-146.5	161.9	16.2	-158.6	0	0	0	0	110.8
381	S	34.3	Very low	33.2	Very low	107 Å²	107	147.1 Å²	147.1	75%	0.748	82%	0.822	S	S	*	*			trans	-91.8	149.3	171.6	45	0	0	0	0	114
382	T	42.3	Very low	33.9	Very low	219 Å²	219	150.9 Å²	150.9	100%	1.344	83%	0.83	S	S	*	*			trans	-142.9	0	151.2	46.8	0	0	0	0	108.3

Retrieved 382 of 382 residues in 60.5 ms (Link to these results)

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