A0A077Z2P6_TRITR Loading...

Vacuolar protein sorting-associated protein 54

AlphaFold DB , UniProt , Accession A0A077Z2P6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 779 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	36.7	Very low	41.6	Very low	247 Å²	247	150.6 Å²	150.6	100%	1.217	77%	0.766	S	S	*	*				0	65.3	0	-61.3	-173.8	-159.9	0	0	110.5
2	R	32.5	Very low	42	Very low	247 Å²	247	151.9 Å²	151.9	93%	0.932	76%	0.755	S	S	*	*			trans	-131.3	66.8	-174.1	-80.3	-173.9	177.4	174.9	-0.8	110.5
3	V	35.7	Very low	42.8	Very low	140 Å²	140	147.6 Å²	147.6	85%	0.848	74%	0.741	S	S	*	*			trans	-154.9	103.2	165.8	-172.9	0	0	0	0	106.9
4	R	37.2	Very low	43.3	Very low	240 Å²	240	146.4 Å²	146.4	91%	0.906	73%	0.734	S	S	*	*			trans	162	64.9	160.6	-91.1	178	-158.5	-154.2	6.7	108.7
5	H	42.8	Very low	44.1	Very low	177 Å²	177	144.1 Å²	144.1	82%	0.819	72%	0.724	S	S	*	*			trans	-125.5	9.1	166.8	-90.2	-42.9	0	0	0	113.5	E7	H5-E7 VanDerWaalsContact C-N 3.33Å; H5-E7 PolarHBondContact O-N 3.15Å
6	D	41.3	Very low	44.4	Very low	158 Å²	158	141.8 Å²	141.8	85%	0.845	71%	0.713	S	S	*	*			trans	-92.5	29.8	179.1	-73	-27.4	0	0	0	114.2	T8	D6-T8 VanDerWaalsContact C-N 3.32Å; D6-T8 PolarHBondContact O-N 3.1Å; D6-T8 VanDerWaalsContact O-N 3.14Å
7	E	40.8	Very low	44.7	Very low	163 Å²	163	136.9 Å²	136.9	76%	0.762	70%	0.696	S	S	*	*	S	Bend	trans	-81.4	91.8	158.4	-82.3	-176.7	177.1	0	0	108.1	H5	H5-E7 VanDerWaalsContact C-N 3.33Å; H5-E7 PolarHBondContact O-N 3.15Å
8	T	50.4	Low	45.1	Very low	84 Å²	84	139.7 Å²	139.7	52%	0.515	70%	0.696	S	S	.	*			trans	-41.4	141.2	-178.5	53.2	0	0	0	0	113.3	D6 A10 S11 R12	D6-T8 VanDerWaalsContact C-N 3.32Å; D6-T8 PolarHBondContact O-N 3.1Å; D6-T8 VanDerWaalsContact O-N 3.14Å; T8-A10 PolarHBondContact O-N 2.98Å; T8-S11 WeakPolarHBondContact O-CB 3.46Å; T8-S11 PolarHBondContact O-N 3.19Å; T8-S11 PolarHBondContact OG1-OG 3Å; T8-R12 PolarHBondContact O-N 3.03Å
9	A	46.1	Very low	45.5	Very low	76 Å²	76	137.7 Å²	137.7	63%	0.628	69%	0.687	S	S	*	*	H	α-helix	trans	-50.8	-29.9	179.1	0	0	0	0	0	113.5	R12 V13	A9-R12 WeakPolarHBondContact O-CB 3.37Å; A9-R12 PolarHBondContact O-N 3.43Å; A9-V13 WeakPolarHBondContact O-CG2 3.35Å; A9-V13 PolarHBondContact O-N 3.29Å
10	A	44	Very low	45.5	Very low	64 Å²	64	140.1 Å²	140.1	53%	0.529	69%	0.688	S	S	.	*	H	α-helix	trans	-60.4	-43	173.6	0	0	0	0	0	112.8	T8 R12 V13 M14	T8-A10 PolarHBondContact O-N 2.98Å; A10-R12 VanDerWaalsContact C-N 3.28Å; A10-R12 PolarHBondContact O-N 2.83Å; A10-V13 PolarHBondContact O-N 3Å; A10-M14 WeakPolarHBondContact O-CB 3.33Å; A10-M14 PolarHBondContact O-N 3.08Å
11	S	49.6	Very low	45.8	Very low	61 Å²	61	136.8 Å²	136.8	43%	0.427	68%	0.678	S	S	.	*	H	α-helix	trans	-62.5	-37.7	175.6	-59.2	0	0	0	0	111.1	T8 L15	T8-S11 WeakPolarHBondContact O-CB 3.46Å; T8-S11 PolarHBondContact O-N 3.19Å; T8-S11 PolarHBondContact OG1-OG 3Å; S11-L15 VanDerWaalsContact O-CB 3.26Å; S11-L15 WeakPolarHBondContact O-CB 3.31Å; S11-L15 PolarHBondContact O-N 3.14Å
12	R	47.3	Very low	46.6	Very low	166 Å²	166	130.5 Å²	130.5	63%	0.626	65%	0.649	S	S	*	*	H	α-helix	trans	-66.2	-42.4	173.4	-75.5	-176.6	174.6	-176.2	-0.6	112.3	T8 A9 A10 L15 I16	T8-R12 PolarHBondContact O-N 3.03Å; A9-R12 WeakPolarHBondContact O-CB 3.37Å; A9-R12 PolarHBondContact O-N 3.43Å; A10-R12 VanDerWaalsContact C-N 3.28Å; A10-R12 PolarHBondContact O-N 2.83Å; R12-L15 PolarHBondContact O-N 3.45Å; R12-I16 WeakPolarHBondContact O-CB 3.43Å; R12-I16 VanDerWaalsContact O-CD1 3.32Å; R12-I16 WeakPolarHBondContact O-CD1 3.44Å; R12-I16 WeakPolarHBondContact O-CG1 3.42Å; R12-I16 PolarHBondContact O-N 2.91Å
13	V	52.6	Low	47.4	Very low	96 Å²	96	120.9 Å²	120.9	58%	0.582	62%	0.623	S	S	*	*	H	α-helix	trans	-66	-43.3	178.2	174.5	0	0	0	0	111.3	A9 A10 I16 S17	A9-V13 WeakPolarHBondContact O-CG2 3.35Å; A9-V13 PolarHBondContact O-N 3.29Å; A10-V13 PolarHBondContact O-N 3Å; V13-I16 PolarHBondContact O-N 3.32Å; V13-S17 PolarHBondContact O-N 3.3Å
14	M	49.7	Very low	48.3	Very low	130 Å²	130	118.7 Å²	118.7	64%	0.64	61%	0.606	S	S	*	*	H	α-helix	trans	-61.6	-43.3	173.3	-87.4	-95.9	-126	0	0	112.1	A10 I16 S17 R18	A10-M14 WeakPolarHBondContact O-CB 3.33Å; A10-M14 PolarHBondContact O-N 3.08Å; M14-I16 VanDerWaalsContact C-N 3.33Å; M14-I16 PolarHBondContact O-N 2.94Å; M14-S17 PolarHBondContact O-N 3.23Å; M14-S17 PolarHBondContact O-OG 3.15Å; M14-R18 WeakPolarHBondContact O-CB 3.43Å; M14-R18 PolarHBondContact O-N 3.44Å
15	L	54.3	Low	49	Very low	112 Å²	112	116.1 Å²	116.1	59%	0.586	60%	0.597	S	S	*	*	H	α-helix	trans	-63.6	-41	175.4	-158.9	89	0	0	0	110.7	S11 R12 I19	S11-L15 VanDerWaalsContact O-CB 3.26Å; S11-L15 WeakPolarHBondContact O-CB 3.31Å; S11-L15 PolarHBondContact O-N 3.14Å; R12-L15 PolarHBondContact O-N 3.45Å; L15-I19 HydrophobicContact CD2-CD1 3.92Å; L15-I19 HydrophobicContact CG-CD1 3.87Å; L15-I19 VanDerWaalsContact O-CB 3.29Å; L15-I19 WeakPolarHBondContact O-CB 3.34Å; L15-I19 WeakPolarHBondContact O-CD1 3.25Å; L15-I19 WeakPolarHBondContact O-CG1 3.47Å; L15-I19 PolarHBondContact O-N 2.99Å
16	I	50.2	Low	49.7	Very low	107 Å²	107	111 Å²	111	55%	0.549	58%	0.58	S	S	.	*	H	α-helix	trans	-63.9	-44.2	176.2	-70.7	162	0	0	0	111	R12 V13 M14 I19 R20	R12-I16 WeakPolarHBondContact O-CB 3.43Å; R12-I16 VanDerWaalsContact O-CD1 3.32Å; R12-I16 WeakPolarHBondContact O-CD1 3.44Å; R12-I16 WeakPolarHBondContact O-CG1 3.42Å; R12-I16 PolarHBondContact O-N 2.91Å; V13-I16 PolarHBondContact O-N 3.32Å; M14-I16 VanDerWaalsContact C-N 3.33Å; M14-I16 PolarHBondContact O-N 2.94Å; I16-I19 PolarHBondContact O-N 3.47Å; I16-R20 VanDerWaalsContact O-CB 3.3Å; I16-R20 WeakPolarHBondContact O-CB 3.36Å; I16-R20 PolarHBondContact O-N 3.35Å
17	S	49.4	Very low	50.5	Low	60 Å²	60	107.1 Å²	107.1	42%	0.42	56%	0.563	S	S	.	*	H	α-helix	trans	-67.7	-42.1	179.2	87.3	0	0	0	0	111.4	V13 M14 R20 C21	V13-S17 PolarHBondContact O-N 3.3Å; M14-S17 PolarHBondContact O-N 3.23Å; M14-S17 PolarHBondContact O-OG 3.15Å; S17-R20 PolarHBondContact O-N 2.92Å; S17-C21 WeakPolarHBondContact O-CB 3.32Å; S17-C21 PolarHBondContact O-N 2.79Å
18	R	50.4	Low	51.6	Low	187 Å²	187	104.7 Å²	104.7	71%	0.706	55%	0.552	S	S	*	*	H	α-helix	trans	-63.3	-42.6	173.7	-95	-178.1	171.5	172.8	-0.7	112.3	M14 R20 N22	M14-R18 WeakPolarHBondContact O-CB 3.43Å; M14-R18 PolarHBondContact O-N 3.44Å; R18-R20 VanDerWaalsContact C-N 3.35Å; R18-N22 VanDerWaalsContact O-CB 3.31Å; R18-N22 WeakPolarHBondContact O-CB 3.36Å; R18-N22 PolarHBondContact O-N 2.78Å
19	I	53.5	Low	52.2	Low	102 Å²	102	110.4 Å²	110.4	52%	0.523	56%	0.564	S	S	.	*	H	α-helix	trans	-64.8	-41.7	176.6	-71.1	164.6	0	0	0	110.2	L15 I16 N22 A23	L15-I19 HydrophobicContact CD2-CD1 3.92Å; L15-I19 HydrophobicContact CG-CD1 3.87Å; L15-I19 VanDerWaalsContact O-CB 3.29Å; L15-I19 WeakPolarHBondContact O-CB 3.34Å; L15-I19 WeakPolarHBondContact O-CD1 3.25Å; L15-I19 WeakPolarHBondContact O-CG1 3.47Å; L15-I19 PolarHBondContact O-N 2.99Å; I16-I19 PolarHBondContact O-N 3.47Å; I19-N22 PolarHBondContact O-N 3.44Å; I19-A23 VanDerWaalsContact O-CB 3.23Å; I19-A23 WeakPolarHBondContact O-CB 3.37Å; I19-A23 PolarHBondContact O-N 3.46Å
20	R	46.2	Very low	53.1	Low	184 Å²	184	113.1 Å²	113.1	69%	0.694	56%	0.563	S	S	*	*	H	α-helix	trans	-67.4	-45.5	179.5	-155.2	176.1	-168.6	179.5	1.8	111.6	I16 S17 R18 A23 D24	I16-R20 VanDerWaalsContact O-CB 3.3Å; I16-R20 WeakPolarHBondContact O-CB 3.36Å; I16-R20 PolarHBondContact O-N 3.35Å; S17-R20 PolarHBondContact O-N 2.92Å; R18-R20 VanDerWaalsContact C-N 3.35Å; R20-A23 PolarHBondContact O-N 2.95Å; R20-D24 PolarHBondContact O-N 2.77Å
21	C	50.1	Low	53.8	Low	72 Å²	72	119.5 Å²	119.5	49%	0.486	57%	0.573	S	S	.	*	H	α-helix	trans	-58.9	-49.8	171.6	-84.7	0	0	0	0	111	S17 A23 D24 W25	S17-C21 WeakPolarHBondContact O-CB 3.32Å; S17-C21 PolarHBondContact O-N 2.79Å; C21-A23 VanDerWaalsContact C-N 3.28Å; C21-A23 PolarHBondContact O-N 3.44Å; C21-D24 PolarHBondContact O-N 3.39Å; C21-W25 WeakPolarHBondContact O-CB 3.38Å; C21-W25 PolarHBondContact O-N 3.37Å
22	N	53.6	Low	54.7	Low	114 Å²	114	125.5 Å²	125.5	61%	0.61	59%	0.587	S	S	*	*	H	α-helix	trans	-63.2	-33.6	178.5	-87.2	-20	0	0	0	113	R18 I19 S26	R18-N22 VanDerWaalsContact O-CB 3.31Å; R18-N22 WeakPolarHBondContact O-CB 3.36Å; R18-N22 PolarHBondContact O-N 2.78Å; I19-N22 PolarHBondContact O-N 3.44Å; N22-S26 WeakPolarHBondContact O-CB 3.07Å; N22-S26 PolarHBondContact O-N 3.17Å; N22-S26 PolarHBondContact O-OG 3.43Å
23	A	50.5	Low	55.7	Low	46 Å²	46	123.2 Å²	123.2	38%	0.38	58%	0.583	S	S	.	*	H	α-helix	trans	-67.6	-44.1	174.6	0	0	0	0	0	111.7	I19 R20 C21 S26 T27	I19-A23 VanDerWaalsContact O-CB 3.23Å; I19-A23 WeakPolarHBondContact O-CB 3.37Å; I19-A23 PolarHBondContact O-N 3.46Å; R20-A23 PolarHBondContact O-N 2.95Å; C21-A23 VanDerWaalsContact C-N 3.28Å; C21-A23 PolarHBondContact O-N 3.44Å; A23-S26 WeakPolarHBondContact CA-OG 3.49Å; A23-S26 PolarHBondContact O-N 3.11Å; A23-S26 PolarHBondContact O-OG 3.28Å; A23-T27 WeakPolarHBondContact O-CB 3.31Å; A23-T27 PolarHBondContact O-N 3.01Å; A23-T27 PolarHBondContact O-OG1 3.38Å
24	D	54.6	Low	56.4	Low	93 Å²	93	121.5 Å²	121.5	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-66.4	-45.8	176.3	-74.6	-25.2	0	0	0	111	R20 C21 S26 T27 Q28	R20-D24 PolarHBondContact O-N 2.77Å; C21-D24 PolarHBondContact O-N 3.39Å; D24-S26 PolarHBondContact O-N 3.31Å; D24-T27 WeakPolarHBondContact CA-OG1 3.45Å; D24-T27 PolarHBondContact O-N 2.9Å; D24-T27 PolarHBondContact O-OG1 2.94Å; D24-T27 VanDerWaalsContact O-OG1 3.06Å; D24-Q28 VanDerWaalsContact O-CB 3.29Å; D24-Q28 WeakPolarHBondContact O-CB 3.37Å; D24-Q28 PolarHBondContact O-N 3.24Å
25	W	51.4	Low	57.2	Low	187 Å²	187	123.2 Å²	123.2	71%	0.708	58%	0.576	S	S	*	*	H	α-helix	trans	-61.8	-42.8	175.8	-83.1	79.4	0	0	0	112.2	C21 Q28 R29	C21-W25 WeakPolarHBondContact O-CB 3.38Å; C21-W25 PolarHBondContact O-N 3.37Å; W25-Q28 PolarHBondContact O-N 3.02Å; W25-R29 WeakPolarHBondContact O-CB 3.33Å; W25-R29 PolarHBondContact O-N 3.26Å
26	S	57.3	Low	58	Low	68 Å²	68	122 Å²	122	48%	0.476	57%	0.567	S	S	.	*	H	α-helix	trans	-69	-40	178	60.2	0	0	0	0	112.7	N22 A23 D24 R29 H30	N22-S26 WeakPolarHBondContact O-CB 3.07Å; N22-S26 PolarHBondContact O-N 3.17Å; N22-S26 PolarHBondContact O-OG 3.43Å; A23-S26 WeakPolarHBondContact CA-OG 3.49Å; A23-S26 PolarHBondContact O-N 3.11Å; A23-S26 PolarHBondContact O-OG 3.28Å; D24-S26 PolarHBondContact O-N 3.31Å; S26-R29 PolarHBondContact O-N 3.11Å; S26-H30 VanDerWaalsContact O-CB 3.32Å; S26-H30 WeakPolarHBondContact O-CB 3.48Å; S26-H30 PolarHBondContact O-N 3.05Å
27	T	59.4	Low	58.7	Low	78 Å²	78	121.9 Å²	121.9	48%	0.479	57%	0.565	S	S	.	*	H	α-helix	trans	-67.2	-36.4	173.7	38.3	0	0	0	0	112.2	A23 D24 H30 R31	A23-T27 WeakPolarHBondContact O-CB 3.31Å; A23-T27 PolarHBondContact O-N 3.01Å; A23-T27 PolarHBondContact O-OG1 3.38Å; D24-T27 WeakPolarHBondContact CA-OG1 3.45Å; D24-T27 PolarHBondContact O-N 2.9Å; D24-T27 PolarHBondContact O-OG1 2.94Å; D24-T27 VanDerWaalsContact O-OG1 3.06Å; T27-H30 PolarHBondContact O-N 2.91Å; T27-R31 WeakPolarHBondContact O-CB 3.4Å; T27-R31 WeakPolarHBondContact O-CG 3.45Å; T27-R31 PolarHBondContact O-N 2.86Å
28	Q	62.4	Low	59.2	Low	112 Å²	112	127.7 Å²	127.7	52%	0.523	58%	0.577	S	S	.	*	H	α-helix	trans	-69.4	-39.5	175.6	-138.1	163.3	11.8	0	0	111.5	D24 W25 R31 R32	D24-Q28 VanDerWaalsContact O-CB 3.29Å; D24-Q28 WeakPolarHBondContact O-CB 3.37Å; D24-Q28 PolarHBondContact O-N 3.24Å; W25-Q28 PolarHBondContact O-N 3.02Å; Q28-R31 PolarHBondContact O-N 2.84Å; Q28-R32 WeakPolarHBondContact O-CB 3.41Å; Q28-R32 WeakPolarHBondContact O-CG 3.36Å; Q28-R32 PolarHBondContact O-N 2.95Å
29	R	64.1	Low	59.9	Low	204 Å²	204	127 Å²	127	77%	0.77	58%	0.575	S	S	*	*	H	α-helix	trans	-61.4	-46.1	171.4	-130.1	-177.2	-159.7	168.3	6	111.2	W25 S26 R32 H33	W25-R29 WeakPolarHBondContact O-CB 3.33Å; W25-R29 PolarHBondContact O-N 3.26Å; S26-R29 PolarHBondContact O-N 3.11Å; R29-R32 PolarHBondContact O-N 3.4Å; R29-H33 WeakPolarHBondContact O-CB 3.28Å; R29-H33 PolarHBondContact O-N 3.22Å
30	H	63.5	Low	60.2	Low	132 Å²	132	127.2 Å²	127.2	61%	0.611	57%	0.574	S	S	*	*	H	α-helix	trans	-64.4	-44	178.9	-165.8	74.4	0	0	0	111.5	S26 T27 R32 H33 V34	S26-H30 VanDerWaalsContact O-CB 3.32Å; S26-H30 WeakPolarHBondContact O-CB 3.48Å; S26-H30 PolarHBondContact O-N 3.05Å; T27-H30 PolarHBondContact O-N 2.91Å; H30-R32 PolarHBondContact O-N 3.19Å; H30-H33 PolarHBondContact O-N 3.29Å; H30-V34 WeakPolarHBondContact O-CB 3.3Å; H30-V34 VanDerWaalsContact O-CG2 3.3Å; H30-V34 WeakPolarHBondContact O-CG2 3.43Å; H30-V34 PolarHBondContact O-N 3.47Å
31	R	59.5	Low	60.5	Low	198 Å²	198	123.2 Å²	123.2	75%	0.747	57%	0.565	S	S	*	*	H	α-helix	trans	-61.1	-44.1	174.3	-81	-176.9	176.1	-171	0.6	112.3	T27 Q28 K35	T27-R31 WeakPolarHBondContact O-CB 3.4Å; T27-R31 WeakPolarHBondContact O-CG 3.45Å; T27-R31 PolarHBondContact O-N 2.86Å; Q28-R31 PolarHBondContact O-N 2.84Å; R31-K35 WeakPolarHBondContact O-CB 3.37Å; R31-K35 PolarHBondContact O-N 3Å
32	R	67.8	Low	60.7	Low	187 Å²	187	129.2 Å²	129.2	71%	0.706	58%	0.578	S	S	*	*	H	α-helix	trans	-62.3	-45	175.5	-76.2	-178.1	-179.3	-173.6	2.2	110.9	Q28 R29 H30 V34 K35 E36	Q28-R32 WeakPolarHBondContact O-CB 3.41Å; Q28-R32 WeakPolarHBondContact O-CG 3.36Å; Q28-R32 PolarHBondContact O-N 2.95Å; R29-R32 PolarHBondContact O-N 3.4Å; H30-R32 PolarHBondContact O-N 3.19Å; R32-V34 PolarHBondContact O-N 3.19Å; R32-K35 PolarHBondContact O-N 3.39Å; R32-E36 WeakPolarHBondContact O-CB 3.35Å; R32-E36 PolarHBondContact O-N 3.18Å
33	H	70.1	Confident	60.7	Low	119 Å²	119	126.5 Å²	126.5	55%	0.551	57%	0.568	S	S	*	*	H	α-helix	trans	-64.7	-41.4	-179.8	-163.6	1.5	0	0	0	112.6	R29 H30 E36 Q37	R29-H33 WeakPolarHBondContact O-CB 3.28Å; R29-H33 PolarHBondContact O-N 3.22Å; H30-H33 PolarHBondContact O-N 3.29Å; H33-E36 PolarHBondContact O-N 2.89Å; H33-Q37 PolarHBondContact O-N 3.42Å
34	V	66.4	Low	60.5	Low	59 Å²	59	127.3 Å²	127.3	36%	0.358	57%	0.571	S	S	.	*	H	α-helix	trans	-65.9	-39.3	174.6	171.4	0	0	0	0	111.4	H30 R32 E36 R38	H30-V34 WeakPolarHBondContact O-CB 3.3Å; H30-V34 VanDerWaalsContact O-CG2 3.3Å; H30-V34 WeakPolarHBondContact O-CG2 3.43Å; H30-V34 PolarHBondContact O-N 3.47Å; R32-V34 PolarHBondContact O-N 3.19Å; V34-E36 VanDerWaalsContact C-N 3.34Å; V34-R38 WeakPolarHBondContact O-CB 3.31Å; V34-R38 WeakPolarHBondContact O-CG 3.32Å; V34-R38 PolarHBondContact O-N 2.9Å
35	K	65.8	Low	60	Low	167 Å²	167	129 Å²	129	73%	0.726	58%	0.579	S	S	*	*	H	α-helix	trans	-63.8	-42.1	175.3	-131.2	-179.4	-176.9	-175	0	111	R31 R32 R38 R39	R31-K35 WeakPolarHBondContact O-CB 3.37Å; R31-K35 PolarHBondContact O-N 3Å; R32-K35 PolarHBondContact O-N 3.39Å; K35-R38 PolarHBondContact O-N 3.39Å; K35-R39 WeakPolarHBondContact O-CB 3.44Å; K35-R39 PolarHBondContact O-N 2.86Å
36	E	71	Confident	59.7	Low	85 Å²	85	124 Å²	124	40%	0.397	58%	0.578	S	S	.	*	H	α-helix	trans	-67.7	-43.2	178.3	-162.2	59.1	-145	0	0	111.5	R32 H33 V34 R38 R39 Q40	R32-E36 WeakPolarHBondContact O-CB 3.35Å; R32-E36 PolarHBondContact O-N 3.18Å; H33-E36 PolarHBondContact O-N 2.89Å; V34-E36 VanDerWaalsContact C-N 3.34Å; E36-R38 PolarHBondContact O-N 2.92Å; E36-R39 CarbonylContact O-C 3.57Å; E36-R39 WeakPolarHBondContact O-CA 3.26Å; E36-R39 WeakPolarHBondContact O-CB 3.13Å; E36-R39 PolarHBondContact O-N 2.87Å; E36-R39 VanDerWaalsContact O-N 3.11Å; E36-Q40 WeakPolarHBondContact O-CB 3.39Å; E36-Q40 WeakPolarHBondContact O-CG 3.41Å; E36-Q40 PolarHBondContact O-N 3.04Å
37	Q	65.5	Low	58.9	Low	105 Å²	105	127.1 Å²	127.1	49%	0.491	59%	0.589	S	S	.	*	H	α-helix	trans	-63.3	-41.1	174.3	-81.9	-150.9	-15.5	0	0	112.5	H33 R39 Q40 L41	H33-Q37 PolarHBondContact O-N 3.42Å; Q37-R39 VanDerWaalsContact C-N 3.26Å; Q37-R39 PolarHBondContact O-N 3.09Å; Q37-Q40 PolarHBondContact O-N 3.03Å; Q37-L41 WeakPolarHBondContact O-CB 3.48Å; Q37-L41 PolarHBondContact O-N 3.23Å
38	R	61.1	Low	57.5	Low	182 Å²	182	126.5 Å²	126.5	69%	0.687	59%	0.591	S	S	*	*	H	α-helix	trans	-62.4	-35.4	173.2	-78.9	-177.2	175.2	-171.4	-1.1	112	V34 K35 E36 R42	V34-R38 WeakPolarHBondContact O-CB 3.31Å; V34-R38 WeakPolarHBondContact O-CG 3.32Å; V34-R38 PolarHBondContact O-N 2.9Å; K35-R38 PolarHBondContact O-N 3.39Å; E36-R38 PolarHBondContact O-N 2.92Å; R38-R42 WeakPolarHBondContact O-CB 3.48Å; R38-R42 WeakPolarHBondContact O-CG 3.39Å; R38-R42 PolarHBondContact O-N 3.41Å
39	R	64	Low	56.1	Low	173 Å²	173	126.2 Å²	126.2	65%	0.653	60%	0.599	S	S	*	*	H	α-helix	trans	-69.2	-44.3	175.7	-171.5	-177.3	171.8	-179.6	-2.1	111.1	K35 E36 Q37 R42 S43	K35-R39 WeakPolarHBondContact O-CB 3.44Å; K35-R39 PolarHBondContact O-N 2.86Å; E36-R39 CarbonylContact O-C 3.57Å; E36-R39 WeakPolarHBondContact O-CA 3.26Å; E36-R39 WeakPolarHBondContact O-CB 3.13Å; E36-R39 PolarHBondContact O-N 2.87Å; E36-R39 VanDerWaalsContact O-N 3.11Å; Q37-R39 VanDerWaalsContact C-N 3.26Å; Q37-R39 PolarHBondContact O-N 3.09Å; R39-R42 PolarHBondContact O-N 2.95Å; R39-S43 PolarHBondContact O-N 3.42Å; R39-S43 PolarHBondContact O-OG 3.38Å
40	Q	60.8	Low	54.7	Low	107 Å²	107	122.9 Å²	122.9	50%	0.5	60%	0.602	S	S	.	*	H	α-helix	trans	-62.1	-42.6	174.8	-74.7	179.8	-4.2	0	0	111.8	E36 Q37 S43 S44	E36-Q40 WeakPolarHBondContact O-CB 3.39Å; E36-Q40 WeakPolarHBondContact O-CG 3.41Å; E36-Q40 PolarHBondContact O-N 3.04Å; Q37-Q40 PolarHBondContact O-N 3.03Å; Q40-S43 VanDerWaalsContact CA-OG 3.28Å; Q40-S43 WeakPolarHBondContact CA-OG 3.31Å; Q40-S43 PolarHBondContact O-N 2.94Å; Q40-S43 PolarHBondContact O-OG 3.28Å; Q40-S44 WeakPolarHBondContact O-CB 3.47Å; Q40-S44 PolarHBondContact O-N 3.12Å; Q40-S44 PolarHBondContact O-OG 2.93Å
41	L	51.6	Low	53.1	Low	99 Å²	99	121.5 Å²	121.5	52%	0.518	61%	0.607	S	S	.	*	H	α-helix	trans	-62.6	-40.3	173.4	-106.7	139.8	0	0	0	112.2	Q37 S44 L45	Q37-L41 WeakPolarHBondContact O-CB 3.48Å; Q37-L41 PolarHBondContact O-N 3.23Å; L41-S44 WeakPolarHBondContact CA-OG 3.39Å; L41-S44 PolarHBondContact O-OG 3.32Å; L41-L45 HydrophobicContact CD2-CD1 4.38Å; L41-L45 VanDerWaalsContact O-CB 3.24Å; L41-L45 WeakPolarHBondContact O-CB 3.24Å; L41-L45 WeakPolarHBondContact O-CD1 3.25Å; L41-L45 WeakPolarHBondContact O-CG 3.38Å; L41-L45 PolarHBondContact O-N 2.86Å
42	R	54.6	Low	51.7	Low	199 Å²	199	117 Å²	117	75%	0.751	61%	0.605	S	S	*	*	H	α-helix	trans	-67.7	-38.7	174.2	-77.8	-179.6	179.2	-158.1	-1.7	111.9	R38 R39 A46	R38-R42 WeakPolarHBondContact O-CB 3.48Å; R38-R42 WeakPolarHBondContact O-CG 3.39Å; R38-R42 PolarHBondContact O-N 3.41Å; R39-R42 PolarHBondContact O-N 2.95Å; R42-A46 VanDerWaalsContact O-CB 3.24Å; R42-A46 WeakPolarHBondContact O-CB 3.44Å; R42-A46 PolarHBondContact O-N 3.08Å
43	S	52.8	Low	49.9	Very low	56 Å²	56	116.3 Å²	116.3	39%	0.392	61%	0.61	S	S	.	*	H	α-helix	trans	-70.8	-36.3	175.5	56.6	0	0	0	0	112.3	R39 Q40 A46 L47	R39-S43 PolarHBondContact O-N 3.42Å; R39-S43 PolarHBondContact O-OG 3.38Å; Q40-S43 VanDerWaalsContact CA-OG 3.28Å; Q40-S43 WeakPolarHBondContact CA-OG 3.31Å; Q40-S43 PolarHBondContact O-N 2.94Å; Q40-S43 PolarHBondContact O-OG 3.28Å; S43-A46 CarbonylContact O-C 3.57Å; S43-A46 PolarHBondContact O-N 3.01Å; S43-L47 VanDerWaalsContact O-CB 3.26Å; S43-L47 WeakPolarHBondContact O-CB 3.36Å; S43-L47 WeakPolarHBondContact O-CD1 3.3Å; S43-L47 VanDerWaalsContact O-CG 3.29Å; S43-L47 WeakPolarHBondContact O-CG 3.44Å; S43-L47 PolarHBondContact O-N 3.39Å
44	S	46.6	Very low	47.9	Very low	64 Å²	64	115.8 Å²	115.8	45%	0.448	62%	0.62	S	S	.	*	H	α-helix	trans	-75.3	-33.4	177	55.7	0	0	0	0	112.3	Q40 L41 A46 L47 A48	Q40-S44 WeakPolarHBondContact O-CB 3.47Å; Q40-S44 PolarHBondContact O-N 3.12Å; Q40-S44 PolarHBondContact O-OG 2.93Å; L41-S44 WeakPolarHBondContact CA-OG 3.39Å; L41-S44 PolarHBondContact O-OG 3.32Å; S44-A46 VanDerWaalsContact C-N 3.29Å; S44-L47 CarbonylContact O-C 3.53Å; S44-L47 PolarHBondContact O-N 2.99Å; S44-A48 PolarHBondContact O-N 2.85Å
45	L	43.6	Very low	45.9	Very low	127 Å²	127	124.1 Å²	124.1	67%	0.665	65%	0.647	S	S	*	*	H	α-helix	trans	-66.1	-32.1	166.5	-80.3	161.3	0	0	0	111.9	L41 L47	L41-L45 HydrophobicContact CD2-CD1 4.38Å; L41-L45 VanDerWaalsContact O-CB 3.24Å; L41-L45 WeakPolarHBondContact O-CB 3.24Å; L41-L45 WeakPolarHBondContact O-CD1 3.25Å; L41-L45 WeakPolarHBondContact O-CG 3.38Å; L41-L45 PolarHBondContact O-N 2.86Å; L45-L47 VanDerWaalsContact C-N 3.32Å
46	A	46.6	Very low	44.2	Very low	83 Å²	83	122.6 Å²	122.6	69%	0.686	66%	0.655	S	S	*	*	H	α-helix	trans	-77.4	-17.4	172.8	0	0	0	0	0	113.4	R42 S43 S44	R42-A46 VanDerWaalsContact O-CB 3.24Å; R42-A46 WeakPolarHBondContact O-CB 3.44Å; R42-A46 PolarHBondContact O-N 3.08Å; S43-A46 CarbonylContact O-C 3.57Å; S43-A46 PolarHBondContact O-N 3.01Å; S44-A46 VanDerWaalsContact C-N 3.29Å
47	L	39	Very low	42.2	Very low	134 Å²	134	124.5 Å²	124.5	70%	0.702	68%	0.678	S	S	*	*	S	Bend	trans	-105.3	3	180	-78.4	160.3	0	0	0	113.1	S43 S44 L45 P49	S43-L47 VanDerWaalsContact O-CB 3.26Å; S43-L47 WeakPolarHBondContact O-CB 3.36Å; S43-L47 WeakPolarHBondContact O-CD1 3.3Å; S43-L47 VanDerWaalsContact O-CG 3.29Å; S43-L47 WeakPolarHBondContact O-CG 3.44Å; S43-L47 PolarHBondContact O-N 3.39Å; S44-L47 CarbonylContact O-C 3.53Å; S44-L47 PolarHBondContact O-N 2.99Å; L45-L47 VanDerWaalsContact C-N 3.32Å; L47-P49 WeakPolarHBondContact O-CD 3.37Å; L47-P49 VanDerWaalsContact O-N 3.11Å
48	A	31.3	Very low	40.3	Very low	64 Å²	64	124 Å²	124	53%	0.529	69%	0.692	S	S	.	*			trans	-69.7	104.1	168.5	0	0	0	0	0	107.3	S44 T50	S44-A48 PolarHBondContact O-N 2.85Å; A48-T50 PolarHBondContact O-N 3.22Å
49	P	32.9	Very low	38.8	Very low	107 Å²	107	123.6 Å²	123.6	70%	0.695	70%	0.698	S	S	*	*			trans	-71.4	121.7	-178.4	-5.1	24.6	0	0	0	106.1	L47 S51	L47-P49 WeakPolarHBondContact O-CD 3.37Å; L47-P49 VanDerWaalsContact O-N 3.11Å; P49-S51 PolarHBondContact O-N 3.24Å
50	T	34.6	Very low	37.3	Very low	134 Å²	134	120.5 Å²	120.5	82%	0.822	70%	0.703	S	S	*	*			trans	-68	64.3	160	52.8	0	0	0	0	108.1	A48 S52	A48-T50 PolarHBondContact O-N 3.22Å; T50-S52 PolarHBondContact O-N 2.95Å
51	S	30.3	Very low	36.1	Very low	103 Å²	103	121.1 Å²	121.1	72%	0.72	71%	0.713	S	S	*	*			trans	-90.1	67.2	172.2	59.6	0	0	0	0	108.1	P49	P49-S51 PolarHBondContact O-N 3.24Å
52	S	29.5	Very low	35.4	Very low	103 Å²	103	123.8 Å²	123.8	72%	0.72	73%	0.728	S	S	*	*			trans	-109.2	9.2	167.2	51.7	0	0	0	0	112.3	T50	T50-S52 PolarHBondContact O-N 2.95Å
53	E	30.4	Very low	34.7	Very low	173 Å²	173	121.3 Å²	121.3	81%	0.808	73%	0.727	S	S	*	*	S	Bend	trans	-138.5	77.2	-174.2	-67.7	-178.9	179	0	0	110.9
54	S	27.6	Very low	34.5	Very low	107 Å²	107	122.4 Å²	122.4	75%	0.748	73%	0.728	S	S	*	*	S	Bend	trans	174.9	64.3	151.4	44.2	0	0	0	0	111.8
55	Y	24.2	Very low	34.7	Very low	235 Å²	235	126.8 Å²	126.8	92%	0.922	75%	0.746	S	S	*	*	S	Bend	trans	-153.9	49.1	157.2	-119.3	-78.9	0	0	0	111.4
56	C	29.3	Very low	35.1	Very low	134 Å²	134	121.7 Å²	121.7	91%	0.905	72%	0.72	S	S	*	*			trans	-141.8	65.2	166.7	-87.3	0	0	0	0	109.4
57	S	29.2	Very low	35.6	Very low	125 Å²	125	119.7 Å²	119.7	87%	0.874	70%	0.699	S	S	*	*			trans	-129.9	46.2	161.5	50.7	0	0	0	0	109.2
58	A	27.3	Very low	36.6	Very low	94 Å²	94	122.1 Å²	122.1	78%	0.777	71%	0.705	S	S	*	*	S	Bend	trans	-102	97.1	162.9	0	0	0	0	0	107
59	E	28.7	Very low	38	Very low	174 Å²	174	120.9 Å²	120.9	81%	0.813	69%	0.689	S	S	*	*			trans	37.9	101.7	152	-67.2	170.5	171.9	0	0	116.2	V61	E59-V61 VanDerWaalsContact C-N 3.3Å; E59-V61 PolarHBondContact O-N 2.96Å
60	S	32.1	Very low	39.4	Very low	109 Å²	109	118.9 Å²	118.9	76%	0.762	67%	0.669	S	S	*	*			trans	-51.4	88.9	161.2	53.3	0	0	0	0	110.6	D62	S60-D62 VanDerWaalsContact C-N 3.32Å; S60-D62 PolarHBondContact O-N 3.48Å; S60-D62 VanDerWaalsContact O-N 3.16Å
61	V	35.5	Very low	40.6	Very low	119 Å²	119	118.7 Å²	118.7	72%	0.721	66%	0.657	S	S	*	*			trans	-79	93.8	160.7	-176.5	0	0	0	0	105.9	E59 M63	E59-V61 VanDerWaalsContact C-N 3.3Å; E59-V61 PolarHBondContact O-N 2.96Å; V61-M63 HydrophobicContact CG1-CB 4.21Å; V61-M63 HydrophobicContact CG1-CG 4.45Å; V61-M63 PolarHBondContact O-N 2.89Å
62	D	37.3	Very low	41.9	Very low	156 Å²	156	115.5 Å²	115.5	83%	0.834	64%	0.635	S	S	*	*			trans	-52.8	95.3	165.2	-79.6	-32	0	0	0	108.8	S60	S60-D62 VanDerWaalsContact C-N 3.32Å; S60-D62 PolarHBondContact O-N 3.48Å; S60-D62 VanDerWaalsContact O-N 3.16Å
63	M	39.4	Very low	43.3	Very low	147 Å²	147	117.2 Å²	117.2	72%	0.724	64%	0.644	S	S	*	*			trans	-147.6	9.4	175.5	-112.2	-132.1	-156.7	0	0	117.7	V61	V61-M63 HydrophobicContact CG1-CB 4.21Å; V61-M63 HydrophobicContact CG1-CG 4.45Å; V61-M63 PolarHBondContact O-N 2.89Å
64	L	48.8	Very low	44.6	Very low	78 Å²	78	113.4 Å²	113.4	41%	0.408	64%	0.636	S	S	.	*			trans	-127.3	105.2	169.6	-69.9	165.1	0	0	0	107	I66	L64-I66 HydrophobicContact CB-CB 4.47Å; L64-I66 HydrophobicContact CB-CD1 3.99Å; L64-I66 HydrophobicContact CB-CG1 4.06Å; L64-I66 HydrophobicContact CD1-CD1 4.43Å; L64-I66 HydrophobicContact CD2-CD1 4.18Å; L64-I66 HydrophobicContact CG-CD1 4.43Å; L64-I66 PolarHBondContact O-N 3.41Å
65	D	50.3	Low	46.1	Very low	157 Å²	157	110.9 Å²	110.9	84%	0.84	61%	0.612	S	S	*	*			trans	-67.2	34.2	171.9	-123.6	-5.6	0	0	0	111.1
66	I	53	Low	47.5	Very low	20 Å²	20	101.8 Å²	101.8	10%	0.103	58%	0.582	C	S	.	*			trans	-87.9	120.6	175.4	-60.4	174.1	0	0	0	105.9	L64 K68 F70 F71 Y151 V155	L64-I66 HydrophobicContact CB-CB 4.47Å; L64-I66 HydrophobicContact CB-CD1 3.99Å; L64-I66 HydrophobicContact CB-CG1 4.06Å; L64-I66 HydrophobicContact CD1-CD1 4.43Å; L64-I66 HydrophobicContact CD2-CD1 4.18Å; L64-I66 HydrophobicContact CG-CD1 4.43Å; L64-I66 PolarHBondContact O-N 3.41Å; I66-K68 PolarHBondContact O-N 3.34Å; I66-F70 HydrophobicContact CG2-CB 4.04Å; I66-F70 HydrophobicContact CG2-CD2 3.78Å; I66-F70 HydrophobicContact CG2-CG 4.26Å; I66-F71 HydrophobicContact CB-CE2 3.85Å; I66-F71 HydrophobicContact CB-CZ 4.03Å; I66-F71 HydrophobicContact CD1-CZ 4.29Å; I66-F71 HydrophobicContact CG2-CE2 3.73Å; I66-F71 HydrophobicContact CG2-CZ 3.97Å; I66-Y151 HydrophobicContact CD1-CD1 4.41Å; I66-Y151 HydrophobicContact CG1-CD1 3.77Å; I66-Y151 HydrophobicContact CG1-CE1 4.22Å; I66-Y151 HydrophobicContact CG1-CG 4.36Å; I66-V155 HydrophobicContact CD1-CG2 3.77Å
67	P	57.1	Low	48.8	Very low	40 Å²	40	102.1 Å²	102.1	26%	0.26	57%	0.574	S	S	.	*			trans	-51.9	133.3	178.9	-28.5	34.1	0	0	0	112.2	I69 F70 L89	P67-I69 HydrophobicContact CB-CG2 4.49Å; P67-I69 PolarHBondContact O-N 3.06Å; P67-F70 HydrophobicContact CB-CD2 3.99Å; P67-F70 HydrophobicContact CB-CE2 4.06Å; P67-F70 HydrophobicContact CG-CD2 4.21Å; P67-F70 HydrophobicContact CG-CE2 3.91Å; P67-F70 WeakPolarHBondContact O-CD2 3.42Å; P67-F70 PolarHBondContact O-N 2.99Å; P67-L89 HydrophobicContact CB-CD1 3.78Å; P67-L89 HydrophobicContact CG-CD1 4.46Å
68	K	59.5	Low	50.2	Low	186 Å²	186	104.8 Å²	104.8	81%	0.809	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-54.4	-19.6	-176	-70.2	-175.9	178.8	178.5	0	114.4	I66 F70 F71	I66-K68 PolarHBondContact O-N 3.34Å; K68-F70 VanDerWaalsContact C-N 3.29Å; K68-F70 PolarHBondContact O-N 3.38Å; K68-F71 PolarHBondContact O-N 2.85Å
69	I	61.9	Low	51.6	Low	38 Å²	38	103.3 Å²	103.3	20%	0.195	55%	0.552	C	S	.	*	G	3₁₀ helix	trans	-63.8	-33.5	179.5	-144.9	160.3	0	0	0	112.7	P67 F71 S72 F75 A85 L86 L89	P67-I69 HydrophobicContact CB-CG2 4.49Å; P67-I69 PolarHBondContact O-N 3.06Å; I69-F71 PolarHBondContact O-N 3.34Å; I69-S72 WeakPolarHBondContact O-CB 3.32Å; I69-S72 PolarHBondContact O-N 2.9Å; I69-S72 VanDerWaalsContact O-N 3.13Å; I69-S72 PolarHBondContact O-OG 3.49Å; I69-F75 HydrophobicContact CG2-CD2 4.41Å; I69-F75 HydrophobicContact CG2-CE2 4.22Å; I69-A85 HydrophobicContact CD1-CB 3.21Å; I69-L86 HydrophobicContact CG2-CD2 4.35Å; I69-L89 HydrophobicContact CB-CD1 4.47Å; I69-L89 HydrophobicContact CG2-CD1 4.12Å
70	F	60.7	Low	53	Low	64 Å²	64	99.9 Å²	99.9	28%	0.281	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-68.5	-19.5	178	-66.9	-69.6	0	0	0	112.9	I66 P67 K68 F75 L86 L148	I66-F70 HydrophobicContact CG2-CB 4.04Å; I66-F70 HydrophobicContact CG2-CD2 3.78Å; I66-F70 HydrophobicContact CG2-CG 4.26Å; P67-F70 HydrophobicContact CB-CD2 3.99Å; P67-F70 HydrophobicContact CB-CE2 4.06Å; P67-F70 HydrophobicContact CG-CD2 4.21Å; P67-F70 HydrophobicContact CG-CE2 3.91Å; P67-F70 WeakPolarHBondContact O-CD2 3.42Å; P67-F70 PolarHBondContact O-N 2.99Å; K68-F70 VanDerWaalsContact C-N 3.29Å; K68-F70 PolarHBondContact O-N 3.38Å; F70-F75 AromaticContact CD1-CE1 3.91Å; F70-F75 HydrophobicContact CD1-CE1 3.91Å; F70-F75 HydrophobicContact CD1-CE2 4.13Å; F70-F75 AromaticContact CD1-CZ 3.64Å; F70-F75 HydrophobicContact CD1-CZ 3.64Å; F70-F75 HydrophobicContact CE1-CE1 4.31Å; F70-F75 HydrophobicContact CE1-CE2 4.3Å; F70-F75 AromaticContact CE1-CZ 3.71Å; F70-F75 HydrophobicContact CE1-CZ 3.71Å; F70-L86 HydrophobicContact CE1-CD2 4.19Å; F70-L86 HydrophobicContact CE2-CD2 4.29Å; F70-L86 HydrophobicContact CZ-CD2 3.66Å; F70-L148 HydrophobicContact CE1-CD1 4.17Å
71	F	60.8	Low	54.3	Low	130 Å²	130	97.8 Å²	97.8	57%	0.57	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-93.1	-0.9	176.1	-58.9	-77.8	0	0	0	113.1	I66 K68 I69	I66-F71 HydrophobicContact CB-CE2 3.85Å; I66-F71 HydrophobicContact CB-CZ 4.03Å; I66-F71 HydrophobicContact CD1-CZ 4.29Å; I66-F71 HydrophobicContact CG2-CE2 3.73Å; I66-F71 HydrophobicContact CG2-CZ 3.97Å; K68-F71 PolarHBondContact O-N 2.85Å; I69-F71 PolarHBondContact O-N 3.34Å
72	S	58.5	Low	55.2	Low	36 Å²	36	92.6 Å²	92.6	25%	0.252	50%	0.499	S	S	.	.			trans	-74.9	131.3	179.4	70.2	0	0	0	0	110.4	I69 S74 F75	I69-S72 WeakPolarHBondContact O-CB 3.32Å; I69-S72 PolarHBondContact O-N 2.9Å; I69-S72 VanDerWaalsContact O-N 3.13Å; I69-S72 PolarHBondContact O-OG 3.49Å; S72-S74 PolarHBondContact O-N 3Å; S72-S74 VanDerWaalsContact O-N 3.11Å; S72-F75 VanDerWaalsContact O-CB 3.22Å; S72-F75 WeakPolarHBondContact O-CB 3.27Å; S72-F75 PolarHBondContact O-N 3.24Å; S72-F75 WeakPolarHBondContact OG-CB 3.44Å; S72-F75 PolarHBondContact OG-N 2.85Å
73	P	58.4	Low	56.2	Low	140 Å²	140	90.5 Å²	90.5	91%	0.909	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-14.4	-179.4	23.6	-31.8	0	0	0	113.4
74	S	56.4	Low	57.1	Low	92 Å²	92	88.6 Å²	88.6	64%	0.643	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	5.8	174.8	48.6	0	0	0	0	113.4	S72 S76	S72-S74 PolarHBondContact O-N 3Å; S72-S74 VanDerWaalsContact O-N 3.11Å; S74-S76 PolarHBondContact O-N 3.2Å; S74-S76 VanDerWaalsContact O-N 3.11Å
75	F	59.4	Low	57.5	Low	55 Å²	55	86.1 Å²	86.1	24%	0.241	46%	0.463	C	S	.	.			trans	-64.3	112.5	175.8	-178.3	-104.9	0	0	0	109.8	I69 F70 S72 L77 C82 L86	I69-F75 HydrophobicContact CG2-CD2 4.41Å; I69-F75 HydrophobicContact CG2-CE2 4.22Å; F70-F75 AromaticContact CD1-CE1 3.91Å; F70-F75 HydrophobicContact CD1-CE1 3.91Å; F70-F75 HydrophobicContact CD1-CE2 4.13Å; F70-F75 AromaticContact CD1-CZ 3.64Å; F70-F75 HydrophobicContact CD1-CZ 3.64Å; F70-F75 HydrophobicContact CE1-CE1 4.31Å; F70-F75 HydrophobicContact CE1-CE2 4.3Å; F70-F75 AromaticContact CE1-CZ 3.71Å; F70-F75 HydrophobicContact CE1-CZ 3.71Å; S72-F75 VanDerWaalsContact O-CB 3.22Å; S72-F75 WeakPolarHBondContact O-CB 3.27Å; S72-F75 PolarHBondContact O-N 3.24Å; S72-F75 WeakPolarHBondContact OG-CB 3.44Å; S72-F75 PolarHBondContact OG-N 2.85Å; F75-L77 HydrophobicContact CE1-CG 4.45Å; F75-L77 HydrophobicContact CZ-CD2 4.3Å; F75-L77 HydrophobicContact CZ-CG 4.47Å; F75-C82 HydrophobicContact CD2-CB 4.47Å; F75-C82 HydrophobicContact CE2-CB 4.49Å; F75-L86 HydrophobicContact CE2-CD1 4.12Å; F75-L86 HydrophobicContact CZ-CD1 4.3Å
76	S	54.3	Low	57.7	Low	44 Å²	44	80.2 Å²	80.2	31%	0.308	43%	0.431	S	S	.	.			trans	-133.9	129.8	172.2	176.9	0	0	0	0	108.8	S74 E78 D79 C82	S74-S76 PolarHBondContact O-N 3.2Å; S74-S76 VanDerWaalsContact O-N 3.11Å; S76-E78 PolarHBondContact O-N 3.42Å; S76-E78 WeakPolarHBondContact OG-CB 3.43Å; S76-E78 PolarHBondContact OG-N 2.9Å; S76-E78 VanDerWaalsContact OG-N 3.12Å; S76-D79 PolarHBondContact O-N 3.43Å; S76-D79 VanDerWaalsContact O-N 3.09Å; S76-C82 WeakPolarHBondContact O-CB 3.44Å
77	L	57.5	Low	57.8	Low	140 Å²	140	82.6 Å²	82.6	73%	0.733	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.4	171.4	-72.9	163.4	0	0	0	112.3	F75	F75-L77 HydrophobicContact CE1-CG 4.45Å; F75-L77 HydrophobicContact CZ-CD2 4.3Å; F75-L77 HydrophobicContact CZ-CG 4.47Å
78	E	57.2	Low	57.7	Low	181 Å²	181	88.2 Å²	88.2	85%	0.846	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-18.2	174.9	-58.1	-175.1	161.9	0	0	112.9	S76 P80	S76-E78 PolarHBondContact O-N 3.42Å; S76-E78 WeakPolarHBondContact OG-CB 3.43Å; S76-E78 PolarHBondContact OG-N 2.9Å; S76-E78 VanDerWaalsContact OG-N 3.12Å; E78-P80 WeakPolarHBondContact O-CD 3.33Å
79	D	57.1	Low	57.1	Low	64 Å²	64	83 Å²	83	34%	0.342	44%	0.44	S	S	.	.			trans	-83.4	116.3	-179.9	-174.2	-7.2	0	0	0	110.7	S76 S81 C82 F83	S76-D79 PolarHBondContact O-N 3.43Å; S76-D79 VanDerWaalsContact O-N 3.09Å; D79-S81 PolarHBondContact O-N 2.94Å; D79-S81 VanDerWaalsContact O-N 3.08Å; D79-S81 WeakPolarHBondContact OD1-CB 3.18Å; D79-S81 PolarHBondContact OD1-N 3.14Å; D79-S81 PolarHBondContact OD1-OG 2.9Å; D79-S81 PolarHBondContact OD2-OG 3.37Å; D79-C82 HydrophobicContact CB-CB 4.32Å; D79-C82 WeakPolarHBondContact O-CB 3.48Å; D79-C82 PolarHBondContact O-N 2.89Å; D79-F83 PolarHBondContact O-N 3.01Å
80	P	58.9	Low	56.5	Low	102 Å²	102	84.7 Å²	84.7	66%	0.662	45%	0.452	S	S	*	.	H	α-helix	trans	-57.6	-26	177.5	-4.4	7.5	0	0	0	113.1	E78 F83 E84	E78-P80 WeakPolarHBondContact O-CD 3.33Å; P80-F83 PolarHBondContact O-N 3.24Å; P80-E84 PolarHBondContact O-N 3.13Å
81	S	58.8	Low	55.9	Low	64 Å²	64	89.1 Å²	89.1	45%	0.448	47%	0.472	S	S	.	.	H	α-helix	trans	-70.4	-34.9	177.5	81	0	0	0	0	112.4	D79 E84 A85	D79-S81 PolarHBondContact O-N 2.94Å; D79-S81 VanDerWaalsContact O-N 3.08Å; D79-S81 WeakPolarHBondContact OD1-CB 3.18Å; D79-S81 PolarHBondContact OD1-N 3.14Å; D79-S81 PolarHBondContact OD1-OG 2.9Å; D79-S81 PolarHBondContact OD2-OG 3.37Å; S81-E84 PolarHBondContact O-N 3.42Å; S81-A85 WeakPolarHBondContact O-CB 3.45Å; S81-A85 PolarHBondContact O-N 3.17Å
82	C	53.7	Low	54.7	Low	10 Å²	10	89.5 Å²	89.5	7%	0.068	48%	0.479	C	S	.	.	H	α-helix	trans	-65.3	-42.4	172.2	-81	0	0	0	0	110.6	F75 S76 D79 E84 A85 L86	F75-C82 HydrophobicContact CD2-CB 4.47Å; F75-C82 HydrophobicContact CE2-CB 4.49Å; S76-C82 WeakPolarHBondContact O-CB 3.44Å; D79-C82 HydrophobicContact CB-CB 4.32Å; D79-C82 WeakPolarHBondContact O-CB 3.48Å; D79-C82 PolarHBondContact O-N 2.89Å; C82-E84 VanDerWaalsContact C-N 3.33Å; C82-E84 PolarHBondContact O-N 3.32Å; C82-A85 PolarHBondContact O-N 3.46Å; C82-L86 WeakPolarHBondContact O-CB 3.36Å; C82-L86 PolarHBondContact O-N 3.06Å
83	F	59.4	Low	53.3	Low	112 Å²	112	92.5 Å²	92.5	49%	0.491	50%	0.5	S	S	.	.	H	α-helix	trans	-60.3	-44.6	174.7	-167.4	-94.3	0	0	0	111.2	D79 P80 A85 L86 N87 F137	D79-F83 PolarHBondContact O-N 3.01Å; P80-F83 PolarHBondContact O-N 3.24Å; F83-A85 VanDerWaalsContact C-N 3.34Å; F83-A85 PolarHBondContact O-N 3.26Å; F83-L86 PolarHBondContact O-N 3.33Å; F83-N87 WeakPolarHBondContact O-CB 3.47Å; F83-N87 PolarHBondContact O-N 2.93Å; F83-F137 HydrophobicContact CZ-CZ 4.47Å
84	E	56.7	Low	52	Low	107 Å²	107	91.3 Å²	91.3	50%	0.5	49%	0.492	S	S	.	.	H	α-helix	trans	-65.2	-37.8	177.8	-159.2	-178.6	-137.7	0	0	112.4	P80 S81 C82 N87 R88	P80-E84 PolarHBondContact O-N 3.13Å; S81-E84 PolarHBondContact O-N 3.42Å; C82-E84 VanDerWaalsContact C-N 3.33Å; C82-E84 PolarHBondContact O-N 3.32Å; E84-N87 WeakPolarHBondContact O-CB 3.28Å; E84-N87 PolarHBondContact O-N 3.33Å; E84-R88 WeakPolarHBondContact O-CG 3.41Å; E84-R88 PolarHBondContact O-N 3.45Å; E84-R88 IonicContact OE2-CZ 2.7Å; E84-R88 IonicContact OE2-NH2 3.25Å; E84-R88 PolarHBondContact OE2-NH2 3.45Å
85	A	58	Low	50.8	Low	27 Å²	27	95 Å²	95	22%	0.223	50%	0.499	C	S	.	.	H	α-helix	trans	-70.4	-39.1	177.4	0	0	0	0	0	112.8	I69 S81 C82 F83 N87 R88 L89	I69-A85 HydrophobicContact CD1-CB 3.21Å; S81-A85 WeakPolarHBondContact O-CB 3.45Å; S81-A85 PolarHBondContact O-N 3.17Å; C82-A85 PolarHBondContact O-N 3.46Å; F83-A85 VanDerWaalsContact C-N 3.34Å; F83-A85 PolarHBondContact O-N 3.26Å; A85-N87 VanDerWaalsContact C-N 3.33Å; A85-R88 PolarHBondContact O-N 3.42Å; A85-L89 PolarHBondContact O-N 2.92Å
86	L	55.5	Low	49.3	Very low	32 Å²	32	103.4 Å²	103.4	17%	0.168	53%	0.529	C	S	.	.	H	α-helix	trans	-59.2	-45	168.5	-81.7	162.7	0	0	0	110.8	I69 F70 F75 C82 F83 R88 L89 V90	I69-L86 HydrophobicContact CG2-CD2 4.35Å; F70-L86 HydrophobicContact CE1-CD2 4.19Å; F70-L86 HydrophobicContact CE2-CD2 4.29Å; F70-L86 HydrophobicContact CZ-CD2 3.66Å; F75-L86 HydrophobicContact CE2-CD1 4.12Å; F75-L86 HydrophobicContact CZ-CD1 4.3Å; C82-L86 WeakPolarHBondContact O-CB 3.36Å; C82-L86 PolarHBondContact O-N 3.06Å; F83-L86 PolarHBondContact O-N 3.33Å; L86-R88 VanDerWaalsContact C-N 3.27Å; L86-R88 PolarHBondContact O-N 2.9Å; L86-L89 PolarHBondContact O-N 3.47Å; L86-L89 VanDerWaalsContact O-N 3.14Å; L86-V90 WeakPolarHBondContact O-CG2 3.3Å; L86-V90 PolarHBondContact O-N 2.84Å
87	N	53.7	Low	48.1	Very low	71 Å²	71	109.6 Å²	109.6	38%	0.38	56%	0.558	S	S	.	*	H	α-helix	trans	-63.3	-33.3	178	-133.9	-17.7	0	0	0	112.2	F83 E84 A85 K91	F83-N87 WeakPolarHBondContact O-CB 3.47Å; F83-N87 PolarHBondContact O-N 2.93Å; E84-N87 WeakPolarHBondContact O-CB 3.28Å; E84-N87 PolarHBondContact O-N 3.33Å; A85-N87 VanDerWaalsContact C-N 3.33Å; N87-K91 WeakPolarHBondContact O-CB 3.41Å; N87-K91 VanDerWaalsContact O-CG 3.24Å; N87-K91 WeakPolarHBondContact O-CG 3.38Å; N87-K91 PolarHBondContact O-N 2.92Å; N87-K91 VanDerWaalsContact O-N 3.11Å
88	R	54.7	Low	46.6	Very low	158 Å²	158	107.3 Å²	107.3	60%	0.596	55%	0.554	S	S	*	*	H	α-helix	trans	-70.1	-40.3	173.2	-72.5	179.6	-146.2	-171.8	7.3	112.3	E84 A85 L86 V90 K91 L92	E84-R88 WeakPolarHBondContact O-CG 3.41Å; E84-R88 PolarHBondContact O-N 3.45Å; E84-R88 IonicContact OE2-CZ 2.7Å; E84-R88 IonicContact OE2-NH2 3.25Å; E84-R88 PolarHBondContact OE2-NH2 3.45Å; A85-R88 PolarHBondContact O-N 3.42Å; L86-R88 VanDerWaalsContact C-N 3.27Å; L86-R88 PolarHBondContact O-N 2.9Å; R88-V90 VanDerWaalsContact C-N 3.33Å; R88-K91 PolarHBondContact O-N 3.31Å; R88-L92 PolarHBondContact O-N 2.96Å
89	L	48	Very low	45.1	Very low	75 Å²	75	105.3 Å²	105.3	39%	0.393	55%	0.549	S	S	.	.	H	α-helix	trans	-62.8	-40.6	177.1	-77.2	164	0	0	0	111.5	P67 I69 A85 L86 L92	P67-L89 HydrophobicContact CB-CD1 3.78Å; P67-L89 HydrophobicContact CG-CD1 4.46Å; I69-L89 HydrophobicContact CB-CD1 4.47Å; I69-L89 HydrophobicContact CG2-CD1 4.12Å; A85-L89 PolarHBondContact O-N 2.92Å; L86-L89 PolarHBondContact O-N 3.47Å; L86-L89 VanDerWaalsContact O-N 3.14Å; L89-L92 PolarHBondContact O-N 3.28Å
90	V	49.4	Very low	43.6	Very low	74 Å²	74	111.9 Å²	111.9	45%	0.448	58%	0.575	S	S	.	*	H	α-helix	trans	-72.1	-34.4	177.4	-179.8	0	0	0	0	111.8	L86 R88 L92 S93	L86-V90 WeakPolarHBondContact O-CG2 3.3Å; L86-V90 PolarHBondContact O-N 2.84Å; R88-V90 VanDerWaalsContact C-N 3.33Å; V90-L92 PolarHBondContact O-N 3.29Å; V90-L92 VanDerWaalsContact O-N 3.14Å; V90-S93 PolarHBondContact O-N 2.93Å
91	K	46.8	Very low	42	Very low	158 Å²	158	116.1 Å²	116.1	69%	0.687	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-9.3	177.4	-80.7	-179.4	-177.4	-175.5	0	114.9	N87 R88 S93	N87-K91 WeakPolarHBondContact O-CB 3.41Å; N87-K91 VanDerWaalsContact O-CG 3.24Å; N87-K91 WeakPolarHBondContact O-CG 3.38Å; N87-K91 PolarHBondContact O-N 2.92Å; N87-K91 VanDerWaalsContact O-N 3.11Å; R88-K91 PolarHBondContact O-N 3.31Å; K91-S93 PolarHBondContact O-N 3.48Å
92	L	36.2	Very low	40.7	Very low	138 Å²	138	118.9 Å²	118.9	72%	0.723	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	15.4	174.3	-75.6	167.1	0	0	0	114.1	R88 L89 V90 P94	R88-L92 PolarHBondContact O-N 2.96Å; L89-L92 PolarHBondContact O-N 3.28Å; V90-L92 PolarHBondContact O-N 3.29Å; V90-L92 VanDerWaalsContact O-N 3.14Å; L92-P94 WeakPolarHBondContact O-CD 3.41Å
93	S	28.5	Very low	39.3	Very low	99 Å²	99	126.6 Å²	126.6	69%	0.692	64%	0.641	S	S	*	*			trans	-103	68	164.9	-43.6	0	0	0	0	111.5	V90 K91 E95	V90-S93 PolarHBondContact O-N 2.93Å; K91-S93 PolarHBondContact O-N 3.48Å; S93-E95 VanDerWaalsContact C-N 3.25Å; S93-E95 PolarHBondContact O-N 3.36Å
94	P	32.2	Very low	37.9	Very low	115 Å²	115	125.1 Å²	125.1	75%	0.747	65%	0.649	S	S	*	*			trans	-84.7	67	178.7	37.3	-35.8	0	0	0	110.1	L92	L92-P94 WeakPolarHBondContact O-CD 3.41Å
95	E	31.3	Very low	36.5	Very low	168 Å²	168	127.1 Å²	127.1	79%	0.785	67%	0.669	S	S	*	*			trans	-120.3	115.5	166.3	-73.5	-175	177.7	0	0	108.2	S93	S93-E95 VanDerWaalsContact C-N 3.25Å; S93-E95 PolarHBondContact O-N 3.36Å
96	R	27.9	Very low	35.1	Very low	233 Å²	233	133.1 Å²	133.1	88%	0.879	70%	0.696	S	S	*	*	S	Bend	trans	86	89.5	-179.2	-47.2	178.1	-148.4	-161.2	5.4	114.3
97	L	28.6	Very low	33.9	Very low	174 Å²	174	136.2 Å²	136.2	91%	0.911	72%	0.72	S	S	*	*				-176.9	89	105.4	-89	161	0	0	0	106.7
98	S	25.7	Very low	32.7	Very low	92 Å²	92	142.7 Å²	142.7	64%	0.643	75%	0.745	S	S	*	*			trans	-55.5	158.7	158.7	49	0	0	0	0	110.2
99	D	25.7	Very low	31.4	Very low	138 Å²	138	140.5 Å²	140.5	74%	0.738	75%	0.749	S	S	*	*			trans	84.2	75	164.5	-46.9	-29.8	0	0	0	116.1
100	F	26.4	Very low	30.6	Very low	203 Å²	203	143.1 Å²	143.1	89%	0.89	77%	0.771	S	S	*	*			trans	-149.9	83.3	134.8	-115	-81.3	0	0	0	109.7
101	Q	25.8	Very low	29.8	Very low	190 Å²	190	145 Å²	145	89%	0.888	78%	0.782	S	S	*	*			trans	-74.2	114	158.8	-74.8	176.8	-23.2	0	0	108
102	T	30.2	Very low	29.1	Very low	123 Å²	123	143.8 Å²	143.8	76%	0.755	78%	0.783	S	S	*	*			trans	-150.1	121	144.2	37.7	0	0	0	0	109.8
103	D	24.5	Very low	28.6	Very low	171 Å²	171	148.1 Å²	148.1	91%	0.914	79%	0.79	S	S	*	*			trans	-54.6	131.5	171.8	-60.1	-58.8	0	0	0	112
104	A	30.7	Very low	28.9	Very low	82 Å²	82	147.2 Å²	147.2	68%	0.678	78%	0.783	S	S	*	*			trans	-163.7	101.4	147.8	0	0	0	0	0	110.4	I106	A104-I106 PolarHBondContact O-N 3.08Å
105	T	27.5	Very low	28.9	Very low	149 Å²	149	148.6 Å²	148.6	91%	0.914	79%	0.785	S	S	*	*			trans	-53.5	97.7	163.7	-33.3	0	0	0	0	109.9
106	I	28.2	Very low	28.7	Very low	153 Å²	153	150.5 Å²	150.5	79%	0.785	79%	0.791	S	S	*	*			trans	-115.2	102.6	169.6	-60.3	180	0	0	0	108.8	A104	A104-I106 PolarHBondContact O-N 3.08Å
107	S	30.2	Very low	29.1	Very low	96 Å²	96	143.9 Å²	143.9	67%	0.671	78%	0.78	S	S	*	*			trans	-54.3	138.3	171.9	132.8	0	0	0	0	111.2	T109	S107-T109 PolarHBondContact O-N 3.22Å; S107-T109 VanDerWaalsContact O-N 3.07Å
108	K	28.4	Very low	29.4	Very low	207 Å²	207	145.2 Å²	145.2	90%	0.9	78%	0.779	S	S	*	*			trans	-58.7	99.7	176.4	-65.7	168.6	174.8	176.6	0	111.1
109	T	28	Very low	29.8	Very low	112 Å²	112	146.8 Å²	146.8	69%	0.687	78%	0.779	S	S	*	*			trans	-126.7	137.4	149.2	49.9	0	0	0	0	109.7	S107 V111	S107-T109 PolarHBondContact O-N 3.22Å; S107-T109 VanDerWaalsContact O-N 3.07Å; T109-V111 PolarHBondContact O-N 2.7Å
110	P	31.2	Very low	30.3	Very low	131 Å²	131	149.6 Å²	149.6	85%	0.851	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-69.3	123.6	-167.6	-8.9	26.4	0	0	0	109.6	D112	P110-D112 PolarHBondContact O-N 3.33Å
111	V	33.2	Very low	31	Very low	114 Å²	114	149.8 Å²	149.8	69%	0.691	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-65.6	120.9	177	177	0	0	0	0	108.5	T109 W113	T109-V111 PolarHBondContact O-N 2.7Å; V111-W113 PolarHBondContact O-NE1 3.29Å
112	D	30.1	Very low	31.8	Very low	132 Å²	132	144.6 Å²	144.6	71%	0.706	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-76.2	118.8	177.8	-162.8	-23.3	0	0	0	109.6	P110 S114	P110-D112 PolarHBondContact O-N 3.33Å; D112-S114 PolarHBondContact O-N 3.25Å; D112-S114 PolarHBondContact OD1-OG 2.86Å
113	W	27.5	Very low	32.5	Very low	229 Å²	229	144.5 Å²	144.5	87%	0.867	76%	0.756	S	S	*	*			trans	-81.9	13.6	-165	-76.3	87.5	0	0	0	114.6	V111 N115	V111-W113 PolarHBondContact O-NE1 3.29Å; W113-N115 PolarHBondContact O-N 2.85Å
114	S	34	Very low	33.4	Very low	79 Å²	79	146.9 Å²	146.9	55%	0.552	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	2.8	-163.1	45.4	0	0	0	0	116.3	D112	D112-S114 PolarHBondContact O-N 3.25Å; D112-S114 PolarHBondContact OD1-OG 2.86Å
115	N	31.1	Very low	34	Very low	145 Å²	145	146 Å²	146	78%	0.775	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121	22	-173	-81.5	-25	0	0	0	117.6	W113 S117	W113-N115 PolarHBondContact O-N 2.85Å; N115-S117 PolarHBondContact O-N 3.01Å
116	F	27.8	Very low	34.8	Very low	208 Å²	208	143.2 Å²	143.2	91%	0.912	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	52	175.6	-105.7	-87.8	0	0	0	113.7
117	S	36.1	Very low	35.7	Very low	94 Å²	94	142.1 Å²	142.1	66%	0.657	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.6	15.2	171.7	62.8	0	0	0	0	114.4	N115 L119	N115-S117 PolarHBondContact O-N 3.01Å; S117-L119 WeakPolarHBondContact O-CD1 3.32Å
118	K	36.4	Very low	36.6	Very low	201 Å²	201	144 Å²	144	87%	0.874	72%	0.717	S	S	*	*			trans	-98.2	65.3	159.5	-73	-173.7	-179.1	176.1	0	109.7
119	L	32.6	Very low	37.4	Very low	126 Å²	126	138.8 Å²	138.8	66%	0.66	70%	0.699	S	S	*	*				59.7	96.4	96.5	-120.9	83.4	0	0	0	114.4	S117 K121	S117-L119 WeakPolarHBondContact O-CD1 3.32Å; L119-K121 PolarHBondContact O-N 3.07Å; L119-K121 VanDerWaalsContact O-N 3.16Å
120	R	36.2	Very low	38.3	Very low	196 Å²	196	140.1 Å²	140.1	74%	0.74	70%	0.697	S	S	*	*	S	Bend		76	-4.3	127.7	-77	-176.7	173.8	163.6	-0.3	121.6
121	K	41.9	Very low	38.9	Very low	208 Å²	208	139 Å²	139	90%	0.904	68%	0.68	S	S	*	*	S	Bend	trans	-94.7	-14.4	177.6	-71.7	-169.1	179.4	-178.8	0	116.9	L119	L119-K121 PolarHBondContact O-N 3.07Å; L119-K121 VanDerWaalsContact O-N 3.16Å
122	S	43.1	Very low	39.7	Very low	81 Å²	81	139.6 Å²	139.6	57%	0.566	68%	0.676	S	S	*	*	S	Bend	trans	-96.4	0.7	171.7	70.1	0	0	0	0	114.1	R124 A125 N126	S122-R124 PolarHBondContact O-N 3.33Å; S122-R124 VanDerWaalsContact O-N 3.1Å; S122-A125 PolarHBondContact O-N 2.85Å; S122-N126 PolarHBondContact O-N 3.44Å
123	Q	44	Very low	40.5	Very low	120 Å²	120	137.5 Å²	137.5	56%	0.561	67%	0.668	S	S	*	*	H	α-helix	trans	-61.8	-24.6	-174.9	-125.4	168.8	-23.9	0	0	113.1	M127	Q123-M127 WeakPolarHBondContact O-CB 3.37Å; Q123-M127 PolarHBondContact O-N 3.37Å
124	R	42.5	Very low	41.2	Very low	221 Å²	221	134 Å²	134	83%	0.834	66%	0.655	S	S	*	*	H	α-helix	trans	-74.5	-37.2	175.4	-152.3	176.7	-170.4	-177.9	2.2	112.9	S122 M127 M128	S122-R124 PolarHBondContact O-N 3.33Å; S122-R124 VanDerWaalsContact O-N 3.1Å; R124-M127 PolarHBondContact O-N 2.96Å; R124-M128 PolarHBondContact O-N 2.85Å
125	A	43.7	Very low	41.7	Very low	64 Å²	64	137.6 Å²	137.6	53%	0.529	66%	0.658	S	S	.	*	H	α-helix	trans	-71.8	-39.2	174.6	0	0	0	0	0	111.1	S122 M127 M128 L129	S122-A125 PolarHBondContact O-N 2.85Å; A125-M127 VanDerWaalsContact C-N 3.34Å; A125-M128 PolarHBondContact O-N 2.94Å; A125-L129 PolarHBondContact O-N 3.28Å
126	N	45.7	Very low	42.4	Very low	90 Å²	90	136.4 Å²	136.4	48%	0.481	65%	0.647	S	S	.	*	H	α-helix	trans	-66.1	-34.5	171.9	-100.9	-12.9	0	0	0	112.4	S122 M128 L129 Q130	S122-N126 PolarHBondContact O-N 3.44Å; N126-M128 VanDerWaalsContact C-N 3.31Å; N126-M128 PolarHBondContact O-N 3.44Å; N126-L129 PolarHBondContact O-N 3.02Å; N126-Q130 WeakPolarHBondContact O-CB 3.34Å; N126-Q130 PolarHBondContact O-N 2.81Å
127	M	47.2	Very low	43.2	Very low	131 Å²	131	132.5 Å²	132.5	65%	0.645	63%	0.63	S	S	*	*	H	α-helix	trans	-61.6	-41.1	172.5	-119.4	175.1	68.4	0	0	111.7	Q123 R124 A125 Q130 E131	Q123-M127 WeakPolarHBondContact O-CB 3.37Å; Q123-M127 PolarHBondContact O-N 3.37Å; R124-M127 PolarHBondContact O-N 2.96Å; A125-M127 VanDerWaalsContact C-N 3.34Å; M127-Q130 PolarHBondContact O-N 3.17Å; M127-E131 WeakPolarHBondContact O-CB 3.43Å; M127-E131 PolarHBondContact O-N 3.03Å
128	M	48.5	Very low	43.6	Very low	136 Å²	136	130.4 Å²	130.4	67%	0.67	61%	0.614	S	S	*	*	H	α-helix	trans	-71.5	-39.4	-179.5	-144.8	177.7	-173.2	0	0	112	R124 A125 N126 Q130 E131 Q132	R124-M128 PolarHBondContact O-N 2.85Å; A125-M128 PolarHBondContact O-N 2.94Å; N126-M128 VanDerWaalsContact C-N 3.31Å; N126-M128 PolarHBondContact O-N 3.44Å; M128-Q130 VanDerWaalsContact C-N 3.33Å; M128-E131 PolarHBondContact O-N 3.18Å; M128-Q132 PolarHBondContact O-N 3.18Å
129	L	44.2	Very low	44	Very low	97 Å²	97	124.3 Å²	124.3	51%	0.508	60%	0.596	S	S	.	*	H	α-helix	trans	-65.5	-36.7	169.9	-73.5	174	0	0	0	111.6	A125 N126 E131 Q132 V133	A125-L129 PolarHBondContact O-N 3.28Å; N126-L129 PolarHBondContact O-N 3.02Å; L129-E131 VanDerWaalsContact C-N 3.34Å; L129-Q132 PolarHBondContact O-N 3.28Å; L129-V133 VanDerWaalsContact O-CB 3.28Å; L129-V133 WeakPolarHBondContact O-CB 3.28Å; L129-V133 WeakPolarHBondContact O-CG2 3.44Å; L129-V133 PolarHBondContact O-N 3.18Å
130	Q	47	Very low	44.6	Very low	139 Å²	139	124.4 Å²	124.4	65%	0.65	59%	0.589	S	S	*	*	H	α-helix	trans	-72.1	-31.3	178.4	-166.5	153.5	7.7	0	0	111.8	N126 M127 M128 Y134	N126-Q130 WeakPolarHBondContact O-CB 3.34Å; N126-Q130 PolarHBondContact O-N 2.81Å; M127-Q130 PolarHBondContact O-N 3.17Å; M128-Q130 VanDerWaalsContact C-N 3.33Å; Q130-Y134 WeakPolarHBondContact O-CB 3.34Å; Q130-Y134 PolarHBondContact O-N 3.06Å
131	E	44.1	Very low	45	Very low	107 Å²	107	122.9 Å²	122.9	50%	0.5	58%	0.583	S	S	.	*	H	α-helix	trans	-71.5	-43.4	171.5	-157.9	174.3	-167.5	0	0	111.1	M127 M128 L129 Y134 Y135	M127-E131 WeakPolarHBondContact O-CB 3.43Å; M127-E131 PolarHBondContact O-N 3.03Å; M128-E131 PolarHBondContact O-N 3.18Å; L129-E131 VanDerWaalsContact C-N 3.34Å; E131-Y134 PolarHBondContact O-N 3.19Å; E131-Y135 HydrophobicContact CG-CD2 4.06Å; E131-Y135 HydrophobicContact CG-CE2 3.86Å; E131-Y135 VanDerWaalsContact O-CD2 3.24Å; E131-Y135 WeakPolarHBondContact O-CD2 3.4Å; E131-Y135 PolarHBondContact O-N 3.46Å
132	Q	49.6	Very low	45.2	Very low	128 Å²	128	120.1 Å²	120.1	60%	0.598	57%	0.571	S	S	*	*	H	α-helix	trans	-62.5	-43.7	172	-86.1	-176.6	-25.4	0	0	112.5	M128 L129 Y134 Y135 Q136	M128-Q132 PolarHBondContact O-N 3.18Å; L129-Q132 PolarHBondContact O-N 3.28Å; Q132-Y134 VanDerWaalsContact C-N 3.3Å; Q132-Y134 PolarHBondContact O-N 3.2Å; Q132-Y135 PolarHBondContact O-N 3.37Å; Q132-Q136 WeakPolarHBondContact O-CB 3.36Å; Q132-Q136 PolarHBondContact O-N 2.9Å
133	V	48.4	Very low	45.5	Very low	88 Å²	88	121 Å²	121	53%	0.533	57%	0.57	S	S	.	*	H	α-helix	trans	-62.7	-39.3	174.6	169.4	0	0	0	0	110.3	L129 Q136 F137	L129-V133 VanDerWaalsContact O-CB 3.28Å; L129-V133 WeakPolarHBondContact O-CB 3.28Å; L129-V133 WeakPolarHBondContact O-CG2 3.44Å; L129-V133 PolarHBondContact O-N 3.18Å; V133-Q136 PolarHBondContact O-N 2.99Å; V133-F137 HydrophobicContact CG1-CD2 4.38Å; V133-F137 VanDerWaalsContact O-CB 3.31Å; V133-F137 WeakPolarHBondContact O-CB 3.24Å; V133-F137 PolarHBondContact O-N 3Å
134	Y	42	Very low	45.6	Very low	154 Å²	154	120.2 Å²	120.2	60%	0.604	57%	0.566	S	S	*	*	H	α-helix	trans	-65.8	-44.4	175.6	-178.2	-99.9	0	0	0	112.3	Q130 E131 Q132 F137 V138	Q130-Y134 WeakPolarHBondContact O-CB 3.34Å; Q130-Y134 PolarHBondContact O-N 3.06Å; E131-Y134 PolarHBondContact O-N 3.19Å; Q132-Y134 VanDerWaalsContact C-N 3.3Å; Q132-Y134 PolarHBondContact O-N 3.2Å; Y134-F137 CarbonylContact O-C 3.25Å; Y134-F137 WeakPolarHBondContact O-CA 3.34Å; Y134-F137 WeakPolarHBondContact O-CB 3.44Å; Y134-F137 PolarHBondContact O-N 3.47Å; Y134-F137 VanDerWaalsContact O-N 3.16Å; Y134-V138 HydrophobicContact CD1-CG2 4.01Å; Y134-V138 HydrophobicContact CD2-CG2 4.42Å; Y134-V138 HydrophobicContact CE1-CG2 3.61Å; Y134-V138 HydrophobicContact CE2-CG2 4.06Å; Y134-V138 HydrophobicContact CG-CG2 4.4Å; Y134-V138 VanDerWaalsContact O-CG2 3.31Å; Y134-V138 WeakPolarHBondContact O-CG2 3.32Å; Y134-V138 PolarHBondContact O-N 3.3Å
135	Y	42.7	Very low	46	Very low	155 Å²	155	114.5 Å²	114.5	61%	0.608	55%	0.552	S	S	*	*	H	α-helix	trans	-65.3	-39.2	175.4	-85.4	-72.8	0	0	0	112.3	E131 Q132 F137 V138 S139	E131-Y135 HydrophobicContact CG-CD2 4.06Å; E131-Y135 HydrophobicContact CG-CE2 3.86Å; E131-Y135 VanDerWaalsContact O-CD2 3.24Å; E131-Y135 WeakPolarHBondContact O-CD2 3.4Å; E131-Y135 PolarHBondContact O-N 3.46Å; Q132-Y135 PolarHBondContact O-N 3.37Å; Y135-F137 VanDerWaalsContact C-N 3.33Å; Y135-V138 PolarHBondContact O-N 3.2Å; Y135-S139 WeakPolarHBondContact O-CB 3.45Å; Y135-S139 PolarHBondContact O-N 3.44Å
136	Q	46.3	Very low	46.4	Very low	120 Å²	120	119 Å²	119	56%	0.561	56%	0.559	S	S	*	*	H	α-helix	trans	-60.9	-45.3	171	-158.6	105.2	21.9	0	0	109.8	Q132 V133 V138 S139 Y140	Q132-Q136 WeakPolarHBondContact O-CB 3.36Å; Q132-Q136 PolarHBondContact O-N 2.9Å; V133-Q136 PolarHBondContact O-N 2.99Å; Q136-V138 PolarHBondContact O-N 3.32Å; Q136-S139 PolarHBondContact O-N 3.32Å; Q136-Y140 HydrophobicContact CG-CD2 3.75Å; Q136-Y140 HydrophobicContact CG-CE2 3.61Å; Q136-Y140 WeakPolarHBondContact O-CB 3.36Å; Q136-Y140 WeakPolarHBondContact O-CD2 3.49Å; Q136-Y140 PolarHBondContact O-N 3.31Å
137	F	44.1	Very low	46.9	Very low	126 Å²	126	119.3 Å²	119.3	55%	0.553	56%	0.558	S	S	*	*	H	α-helix	trans	-61.3	-40.8	176.5	-122.8	-89.2	0	0	0	113.3	F83 V133 Y134 Y135 R141	F83-F137 HydrophobicContact CZ-CZ 4.47Å; V133-F137 HydrophobicContact CG1-CD2 4.38Å; V133-F137 VanDerWaalsContact O-CB 3.31Å; V133-F137 WeakPolarHBondContact O-CB 3.24Å; V133-F137 PolarHBondContact O-N 3Å; Y134-F137 CarbonylContact O-C 3.25Å; Y134-F137 WeakPolarHBondContact O-CA 3.34Å; Y134-F137 WeakPolarHBondContact O-CB 3.44Å; Y134-F137 PolarHBondContact O-N 3.47Å; Y134-F137 VanDerWaalsContact O-N 3.16Å; Y135-F137 VanDerWaalsContact C-N 3.33Å; F137-R141 VanDerWaalsContact O-CB 3.28Å; F137-R141 WeakPolarHBondContact O-CB 3.31Å; F137-R141 PolarHBondContact O-N 3.48Å
138	V	45.5	Very low	47.2	Very low	51 Å²	51	116.8 Å²	116.8	31%	0.309	55%	0.547	S	S	.	.	H	α-helix	trans	-72.1	-36.6	179.5	171.9	0	0	0	0	111	Y134 Y135 Q136 K142	Y134-V138 HydrophobicContact CD1-CG2 4.01Å; Y134-V138 HydrophobicContact CD2-CG2 4.42Å; Y134-V138 HydrophobicContact CE1-CG2 3.61Å; Y134-V138 HydrophobicContact CE2-CG2 4.06Å; Y134-V138 HydrophobicContact CG-CG2 4.4Å; Y134-V138 VanDerWaalsContact O-CG2 3.31Å; Y134-V138 WeakPolarHBondContact O-CG2 3.32Å; Y134-V138 PolarHBondContact O-N 3.3Å; Y135-V138 PolarHBondContact O-N 3.2Å; Q136-V138 PolarHBondContact O-N 3.32Å; V138-K142 PolarHBondContact O-N 3.45Å
139	S	45.6	Very low	47.7	Very low	73 Å²	73	111.6 Å²	111.6	51%	0.51	53%	0.528	S	S	.	.	H	α-helix	trans	-66	-46.2	172.2	-166	0	0	0	0	111.2	Y135 Q136 R141 K142 D143	Y135-S139 WeakPolarHBondContact O-CB 3.45Å; Y135-S139 PolarHBondContact O-N 3.44Å; Q136-S139 PolarHBondContact O-N 3.32Å; S139-R141 VanDerWaalsContact C-N 3.33Å; S139-R141 PolarHBondContact O-N 3.26Å; S139-K142 PolarHBondContact O-N 3.43Å; S139-D143 PolarHBondContact O-N 2.92Å; S139-D143 VanDerWaalsContact O-N 3.09Å
140	Y	45.5	Very low	48.7	Very low	128 Å²	128	111.4 Å²	111.4	50%	0.502	52%	0.524	S	S	.	.	H	α-helix	trans	-59.8	-41.9	175.1	-90.2	-72.3	0	0	0	111.8	Q136 K142 D143 E144	Q136-Y140 HydrophobicContact CG-CD2 3.75Å; Q136-Y140 HydrophobicContact CG-CE2 3.61Å; Q136-Y140 WeakPolarHBondContact O-CB 3.36Å; Q136-Y140 WeakPolarHBondContact O-CD2 3.49Å; Q136-Y140 PolarHBondContact O-N 3.31Å; Y140-K142 VanDerWaalsContact C-N 3.35Å; Y140-K142 PolarHBondContact O-N 2.88Å; Y140-D143 PolarHBondContact O-N 2.85Å; Y140-E144 PolarHBondContact O-N 3Å
141	R	43.7	Very low	49.5	Very low	164 Å²	164	107.8 Å²	107.8	62%	0.619	51%	0.505	S	S	*	.	H	α-helix	trans	-64	-37.6	177	-173	177.1	-114.6	167.3	-3.6	112.4	F137 S139 E144 D145	F137-R141 VanDerWaalsContact O-CB 3.28Å; F137-R141 WeakPolarHBondContact O-CB 3.31Å; F137-R141 PolarHBondContact O-N 3.48Å; S139-R141 VanDerWaalsContact C-N 3.33Å; S139-R141 PolarHBondContact O-N 3.26Å; R141-E144 PolarHBondContact O-N 3.44Å; R141-D145 WeakPolarHBondContact O-CB 3.34Å; R141-D145 VanDerWaalsContact O-CG 3.25Å; R141-D145 PolarHBondContact O-N 2.93Å
142	K	46.1	Very low	50.6	Low	150 Å²	150	107.6 Å²	107.6	65%	0.652	51%	0.507	S	S	*	.	H	α-helix	trans	-66.9	-39.5	175.1	-81.3	-174.3	175.6	-176.5	0	112.5	V138 S139 Y140 F146	V138-K142 PolarHBondContact O-N 3.45Å; S139-K142 PolarHBondContact O-N 3.43Å; Y140-K142 VanDerWaalsContact C-N 3.35Å; Y140-K142 PolarHBondContact O-N 2.88Å; K142-F146 WeakPolarHBondContact O-CB 3.39Å; K142-F146 PolarHBondContact O-N 3.27Å
143	D	48.8	Very low	51.5	Low	100 Å²	100	105.9 Å²	105.9	54%	0.535	50%	0.502	S	S	.	.	H	α-helix	trans	-70.6	-37.7	175.1	-83.3	-28.9	0	0	0	111.7	S139 Y140 F146 Q147	S139-D143 PolarHBondContact O-N 2.92Å; S139-D143 VanDerWaalsContact O-N 3.09Å; Y140-D143 PolarHBondContact O-N 2.85Å; D143-F146 PolarHBondContact O-N 3.29Å; D143-Q147 VanDerWaalsContact O-CB 3.25Å; D143-Q147 WeakPolarHBondContact O-CB 3.47Å; D143-Q147 WeakPolarHBondContact O-CG 3.43Å; D143-Q147 PolarHBondContact O-N 3.37Å
144	E	47.3	Very low	52.4	Low	102 Å²	102	107.3 Å²	107.3	48%	0.477	50%	0.498	S	S	.	.	H	α-helix	trans	-63.7	-44.7	172.6	-79.2	-175.9	167.3	0	0	111.8	Y140 R141 F146 Q147 L148	Y140-E144 PolarHBondContact O-N 3Å; R141-E144 PolarHBondContact O-N 3.44Å; E144-F146 VanDerWaalsContact C-N 3.32Å; E144-F146 PolarHBondContact O-N 3.24Å; E144-Q147 PolarHBondContact O-N 3.49Å; E144-L148 WeakPolarHBondContact O-CB 3.41Å; E144-L148 PolarHBondContact O-N 3.29Å
145	D	50.2	Low	53.5	Low	101 Å²	101	102.3 Å²	102.3	54%	0.54	48%	0.483	S	S	.	.	H	α-helix	trans	-65	-36.2	176.7	-73.1	-23	0	0	0	111.3	R141 G149	R141-D145 WeakPolarHBondContact O-CB 3.34Å; R141-D145 VanDerWaalsContact O-CG 3.25Å; R141-D145 PolarHBondContact O-N 2.93Å; D145-G149 WeakPolarHBondContact O-CA 3.39Å; D145-G149 PolarHBondContact O-N 2.89Å
146	F	51.4	Low	54.9	Low	158 Å²	158	101.1 Å²	101.1	69%	0.693	48%	0.483	S	S	*	.	H	α-helix	trans	-72.8	-40.2	176.6	-161.5	-90.3	0	0	0	112.2	K142 D143 E144 H150	K142-F146 WeakPolarHBondContact O-CB 3.39Å; K142-F146 PolarHBondContact O-N 3.27Å; D143-F146 PolarHBondContact O-N 3.29Å; E144-F146 VanDerWaalsContact C-N 3.32Å; E144-F146 PolarHBondContact O-N 3.24Å; F146-H150 VanDerWaalsContact O-CB 3.26Å; F146-H150 WeakPolarHBondContact O-CB 3.48Å; F146-H150 PolarHBondContact O-N 3.48Å
147	Q	57.2	Low	56	Low	98 Å²	98	100.2 Å²	100.2	46%	0.458	48%	0.481	S	S	.	.	H	α-helix	trans	-64.4	-46.3	173.6	-73	-80	-23.9	0	0	110.3	D143 E144 H150 Y151	D143-Q147 VanDerWaalsContact O-CB 3.25Å; D143-Q147 WeakPolarHBondContact O-CB 3.47Å; D143-Q147 WeakPolarHBondContact O-CG 3.43Å; D143-Q147 PolarHBondContact O-N 3.37Å; E144-Q147 PolarHBondContact O-N 3.49Å; Q147-H150 PolarHBondContact O-N 3.31Å; Q147-Y151 HydrophobicContact CB-CD2 4.42Å; Q147-Y151 HydrophobicContact CB-CE2 4.03Å; Q147-Y151 WeakPolarHBondContact O-CB 3.19Å; Q147-Y151 WeakPolarHBondContact O-CD2 3.38Å; Q147-Y151 VanDerWaalsContact O-CG 3.3Å; Q147-Y151 PolarHBondContact O-N 2.95Å; Q147-Y151 PolarHBondContact OE1-OH 3.13Å
148	L	53.1	Low	56.9	Low	78 Å²	78	98.2 Å²	98.2	41%	0.408	47%	0.474	S	S	.	.	H	α-helix	trans	-66	-40.1	178.4	-161.2	75.2	0	0	0	111.5	F70 E144 Y151 L152	F70-L148 HydrophobicContact CE1-CD1 4.17Å; E144-L148 WeakPolarHBondContact O-CB 3.41Å; E144-L148 PolarHBondContact O-N 3.29Å; L148-Y151 PolarHBondContact O-N 3.22Å; L148-L152 WeakPolarHBondContact O-CB 3.38Å; L148-L152 PolarHBondContact O-N 3.44Å
149	G	59.7	Low	57.9	Low	26 Å²	26	100.1 Å²	100.1	27%	0.268	48%	0.481	S	S	.	.	H	α-helix	trans	-60.4	-46.4	171.5	0	0	0	0	0	111.9	D145 Y151 L152 D153	D145-G149 WeakPolarHBondContact O-CA 3.39Å; D145-G149 PolarHBondContact O-N 2.89Å; G149-Y151 PolarHBondContact O-N 3.48Å; G149-L152 CarbonylContact O-C 3.53Å; G149-L152 WeakPolarHBondContact O-CB 3.29Å; G149-L152 PolarHBondContact O-N 3.25Å; G149-D153 WeakPolarHBondContact O-CB 3.37Å; G149-D153 PolarHBondContact O-N 3.36Å
150	H	64.2	Low	58.9	Low	93 Å²	93	99.3 Å²	99.3	43%	0.431	48%	0.479	S	S	.	.	H	α-helix	trans	-65.8	-37.1	176.3	-178.4	-91.1	0	0	0	112.7	F146 Q147 R154	F146-H150 VanDerWaalsContact O-CB 3.26Å; F146-H150 WeakPolarHBondContact O-CB 3.48Å; F146-H150 PolarHBondContact O-N 3.48Å; Q147-H150 PolarHBondContact O-N 3.31Å; H150-R154 WeakPolarHBondContact O-CB 3.28Å; H150-R154 PolarHBondContact O-N 3.47Å
151	Y	63.3	Low	59.9	Low	63 Å²	63	97.4 Å²	97.4	25%	0.247	48%	0.477	C	S	.	.	H	α-helix	trans	-66.1	-40.8	172.3	-68.8	-52.8	0	0	0	111.3	I66 Q147 L148 G149 R154 V155	I66-Y151 HydrophobicContact CD1-CD1 4.41Å; I66-Y151 HydrophobicContact CG1-CD1 3.77Å; I66-Y151 HydrophobicContact CG1-CE1 4.22Å; I66-Y151 HydrophobicContact CG1-CG 4.36Å; Q147-Y151 HydrophobicContact CB-CD2 4.42Å; Q147-Y151 HydrophobicContact CB-CE2 4.03Å; Q147-Y151 WeakPolarHBondContact O-CB 3.19Å; Q147-Y151 WeakPolarHBondContact O-CD2 3.38Å; Q147-Y151 VanDerWaalsContact O-CG 3.3Å; Q147-Y151 PolarHBondContact O-N 2.95Å; Q147-Y151 PolarHBondContact OE1-OH 3.13Å; L148-Y151 PolarHBondContact O-N 3.22Å; G149-Y151 PolarHBondContact O-N 3.48Å; Y151-R154 PolarHBondContact O-N 3.36Å; Y151-V155 WeakPolarHBondContact O-CB 3.3Å; Y151-V155 WeakPolarHBondContact O-CG2 3.36Å; Y151-V155 PolarHBondContact O-N 2.91Å
152	L	67	Low	60.8	Low	104 Å²	104	94.7 Å²	94.7	55%	0.545	47%	0.472	S	S	.	.	H	α-helix	trans	-62.9	-48.9	174.2	-91.3	162.9	0	0	0	111.6	L148 G149 R154 V155 E156	L148-L152 WeakPolarHBondContact O-CB 3.38Å; L148-L152 PolarHBondContact O-N 3.44Å; G149-L152 CarbonylContact O-C 3.53Å; G149-L152 WeakPolarHBondContact O-CB 3.29Å; G149-L152 PolarHBondContact O-N 3.25Å; L152-R154 VanDerWaalsContact C-N 3.29Å; L152-R154 PolarHBondContact O-N 3.09Å; L152-V155 CarbonylContact O-C 3.54Å; L152-V155 PolarHBondContact O-N 2.92Å; L152-E156 WeakPolarHBondContact O-CB 3.37Å; L152-E156 PolarHBondContact O-N 3Å
153	D	69.2	Low	61.4	Low	92 Å²	92	90.1 Å²	90.1	49%	0.492	45%	0.454	S	S	.	.	H	α-helix	trans	-59.5	-42.6	177.1	-75.2	-12.7	0	0	0	110.7	G149 E156 I157	G149-D153 WeakPolarHBondContact O-CB 3.37Å; G149-D153 PolarHBondContact O-N 3.36Å; D153-E156 PolarHBondContact O-N 2.71Å; D153-I157 WeakPolarHBondContact O-CB 3.23Å; D153-I157 WeakPolarHBondContact O-CG1 3.24Å; D153-I157 PolarHBondContact O-N 2.77Å
154	R	67.4	Low	62.3	Low	118 Å²	118	88.2 Å²	88.2	45%	0.445	45%	0.452	S	S	.	.	H	α-helix	trans	-69.3	-38	179.3	-170.4	165.1	167.8	174.6	-7.4	111.8	H150 Y151 L152 E158	H150-R154 WeakPolarHBondContact O-CB 3.28Å; H150-R154 PolarHBondContact O-N 3.47Å; Y151-R154 PolarHBondContact O-N 3.36Å; L152-R154 VanDerWaalsContact C-N 3.29Å; L152-R154 PolarHBondContact O-N 3.09Å; R154-E158 WeakPolarHBondContact O-CB 3.27Å; R154-E158 PolarHBondContact O-N 3.34Å
155	V	64.6	Low	63.1	Low	49 Å²	49	88.7 Å²	88.7	30%	0.297	46%	0.462	S	S	.	.	H	α-helix	trans	-66.8	-40.3	171.3	169.5	0	0	0	0	110.6	I66 Y151 L152 E158 I159	I66-V155 HydrophobicContact CD1-CG2 3.77Å; Y151-V155 WeakPolarHBondContact O-CB 3.3Å; Y151-V155 WeakPolarHBondContact O-CG2 3.36Å; Y151-V155 PolarHBondContact O-N 2.91Å; L152-V155 CarbonylContact O-C 3.54Å; L152-V155 PolarHBondContact O-N 2.92Å; V155-E158 PolarHBondContact O-N 3.18Å; V155-I159 HydrophobicContact CG1-CD1 3.53Å; V155-I159 HydrophobicContact CG1-CG1 4.17Å; V155-I159 VanDerWaalsContact O-CB 3.23Å; V155-I159 WeakPolarHBondContact O-CB 3.35Å; V155-I159 WeakPolarHBondContact O-CG1 3.09Å; V155-I159 PolarHBondContact O-N 3.3Å
156	E	71.8	Confident	63.7	Low	129 Å²	129	90.9 Å²	90.9	60%	0.603	47%	0.467	S	S	*	.	H	α-helix	trans	-64	-44.8	175.9	-93.2	-167.3	164.6	0	0	112.1	L152 D153 E158 I159 A160	L152-E156 WeakPolarHBondContact O-CB 3.37Å; L152-E156 PolarHBondContact O-N 3Å; D153-E156 PolarHBondContact O-N 2.71Å; E156-E158 VanDerWaalsContact C-N 3.34Å; E156-I159 PolarHBondContact O-N 2.98Å; E156-A160 VanDerWaalsContact O-CB 3.26Å; E156-A160 WeakPolarHBondContact O-CB 3.38Å; E156-A160 PolarHBondContact O-N 3.32Å
157	I	69.6	Low	64.2	Low	102 Å²	102	85.2 Å²	85.2	52%	0.523	45%	0.447	S	S	.	.	H	α-helix	trans	-62.1	-44.8	175.7	-70.4	164.7	0	0	0	110	D153 A160 N161	D153-I157 WeakPolarHBondContact O-CB 3.23Å; D153-I157 WeakPolarHBondContact O-CG1 3.24Å; D153-I157 PolarHBondContact O-N 2.77Å; I157-A160 PolarHBondContact O-N 2.87Å; I157-N161 WeakPolarHBondContact O-CB 3.45Å; I157-N161 PolarHBondContact O-N 2.76Å
158	E	64.4	Low	64.6	Low	84 Å²	84	87.3 Å²	87.3	39%	0.393	46%	0.457	S	S	.	.	H	α-helix	trans	-69.9	-37.9	-179.1	-154.3	61.2	-150	0	0	111.5	R154 V155 E156 N161 H162	R154-E158 WeakPolarHBondContact O-CB 3.27Å; R154-E158 PolarHBondContact O-N 3.34Å; V155-E158 PolarHBondContact O-N 3.18Å; E156-E158 VanDerWaalsContact C-N 3.34Å; E158-N161 PolarHBondContact O-N 3.39Å; E158-H162 VanDerWaalsContact O-CB 3.28Å; E158-H162 WeakPolarHBondContact O-CB 3.32Å; E158-H162 PolarHBondContact O-N 3Å; E158-H162 IonicContact OE1-CD2 3.03Å
159	I	66.2	Low	65.2	Low	90 Å²	90	86.3 Å²	86.3	46%	0.462	46%	0.46	S	S	.	.	H	α-helix	trans	-61.1	-45.3	170.8	-73.6	170.5	0	0	0	109.6	V155 E156 H162 L163	V155-I159 HydrophobicContact CG1-CD1 3.53Å; V155-I159 HydrophobicContact CG1-CG1 4.17Å; V155-I159 VanDerWaalsContact O-CB 3.23Å; V155-I159 WeakPolarHBondContact O-CB 3.35Å; V155-I159 WeakPolarHBondContact O-CG1 3.09Å; V155-I159 PolarHBondContact O-N 3.3Å; E156-I159 PolarHBondContact O-N 2.98Å; I159-H162 PolarHBondContact O-N 3.36Å; I159-L163 HydrophobicContact CG2-CD1 3.38Å; I159-L163 VanDerWaalsContact O-CB 3.25Å; I159-L163 WeakPolarHBondContact O-CB 3.45Å; I159-L163 VanDerWaalsContact O-CD1 3.28Å; I159-L163 WeakPolarHBondContact O-CD1 3.44Å; I159-L163 PolarHBondContact O-N 2.79Å
160	A	67	Low	65.5	Low	57 Å²	57	89.5 Å²	89.5	47%	0.471	47%	0.466	S	S	.	.	H	α-helix	trans	-63.6	-41.2	177.7	0	0	0	0	0	112	E156 I157 L163 A164	E156-A160 VanDerWaalsContact O-CB 3.26Å; E156-A160 WeakPolarHBondContact O-CB 3.38Å; E156-A160 PolarHBondContact O-N 3.32Å; I157-A160 PolarHBondContact O-N 2.87Å; A160-L163 PolarHBondContact O-N 3.5Å; A160-A164 VanDerWaalsContact O-CB 3.31Å; A160-A164 WeakPolarHBondContact O-CB 3.21Å; A160-A164 PolarHBondContact O-N 3.38Å
161	N	65.2	Low	65.7	Low	87 Å²	87	89.6 Å²	89.6	47%	0.465	47%	0.466	S	S	.	.	H	α-helix	trans	-67.7	-43.5	175.7	-91.4	-17.9	0	0	0	112.2	I157 E158 A164 T165	I157-N161 WeakPolarHBondContact O-CB 3.45Å; I157-N161 PolarHBondContact O-N 2.76Å; E158-N161 PolarHBondContact O-N 3.39Å; N161-A164 PolarHBondContact O-N 2.86Å; N161-T165 WeakPolarHBondContact O-CB 3.39Å; N161-T165 PolarHBondContact O-N 3.22Å; N161-T165 PolarHBondContact O-OG1 3.08Å
162	H	62.2	Low	66	Low	108 Å²	108	92.3 Å²	92.3	50%	0.5	48%	0.481	S	S	.	.	H	α-helix	trans	-64.8	-41.5	174.3	-93.1	-126.1	0	0	0	111.4	E158 I159 A164 T165 K166	E158-H162 VanDerWaalsContact O-CB 3.28Å; E158-H162 WeakPolarHBondContact O-CB 3.32Å; E158-H162 PolarHBondContact O-N 3Å; E158-H162 IonicContact OE1-CD2 3.03Å; I159-H162 PolarHBondContact O-N 3.36Å; H162-A164 VanDerWaalsContact C-N 3.33Å; H162-T165 PolarHBondContact O-OG1 2.98Å; H162-K166 WeakPolarHBondContact O-CB 3.31Å; H162-K166 PolarHBondContact O-N 3.26Å
163	L	59.8	Low	66.1	Low	53 Å²	53	92.9 Å²	92.9	28%	0.277	48%	0.484	S	S	.	.	H	α-helix	trans	-63.1	-38.9	172.6	-101.2	114.7	0	0	0	110.8	I159 A160 S167 F170 F171	I159-L163 HydrophobicContact CG2-CD1 3.38Å; I159-L163 VanDerWaalsContact O-CB 3.25Å; I159-L163 WeakPolarHBondContact O-CB 3.45Å; I159-L163 VanDerWaalsContact O-CD1 3.28Å; I159-L163 WeakPolarHBondContact O-CD1 3.44Å; I159-L163 PolarHBondContact O-N 2.79Å; A160-L163 PolarHBondContact O-N 3.5Å; L163-S167 WeakPolarHBondContact O-CA 3.39Å; L163-S167 WeakPolarHBondContact O-CB 3.1Å; L163-S167 PolarHBondContact O-N 3.21Å; L163-F170 HydrophobicContact CD2-CD1 3.66Å; L163-F170 HydrophobicContact CD2-CE1 3.52Å; L163-F170 HydrophobicContact CD2-CZ 4.32Å; L163-F170 HydrophobicContact CG-CD1 4.15Å; L163-F170 HydrophobicContact CG-CE1 4.18Å; L163-F171 HydrophobicContact CD2-CE1 4.35Å; L163-F171 HydrophobicContact CD2-CE2 4.46Å; L163-F171 HydrophobicContact CD2-CZ 3.82Å
164	A	68.1	Low	66.3	Low	60 Å²	60	92.4 Å²	92.4	50%	0.496	48%	0.48	S	S	.	.	H	α-helix	trans	-70.7	-46.9	179.3	0	0	0	0	0	112.1	A160 N161 H162 S167	A160-A164 VanDerWaalsContact O-CB 3.31Å; A160-A164 WeakPolarHBondContact O-CB 3.21Å; A160-A164 PolarHBondContact O-N 3.38Å; N161-A164 PolarHBondContact O-N 2.86Å; H162-A164 VanDerWaalsContact C-N 3.33Å; A164-S167 VanDerWaalsContact O-CB 3.28Å; A164-S167 WeakPolarHBondContact O-CB 3.49Å; A164-S167 PolarHBondContact O-N 3.22Å; A164-S167 PolarHBondContact O-OG 3.45Å
165	T	63.8	Low	66.7	Low	113 Å²	113	91.3 Å²	91.3	69%	0.693	49%	0.486	S	S	*	.	H	α-helix	trans	-74.3	-32.7	-175.9	48.6	0	0	0	0	113.5	N161 H162	N161-T165 WeakPolarHBondContact O-CB 3.39Å; N161-T165 PolarHBondContact O-N 3.22Å; N161-T165 PolarHBondContact O-OG1 3.08Å; H162-T165 PolarHBondContact O-OG1 2.98Å
166	K	61.6	Low	67.3	Low	146 Å²	146	95.1 Å²	95.1	64%	0.635	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	11.1	172	-67.2	-167.7	176.1	-178.4	0	113.6	H162 Q168 A169 F170	H162-K166 WeakPolarHBondContact O-CB 3.31Å; H162-K166 PolarHBondContact O-N 3.26Å; K166-Q168 VanDerWaalsContact C-N 3.33Å; K166-Q168 PolarHBondContact O-N 3.35Å; K166-Q168 VanDerWaalsContact O-N 3.15Å; K166-A169 PolarHBondContact O-N 3.15Å; K166-A169 VanDerWaalsContact O-N 3.14Å; K166-F170 PolarHBondContact O-N 3.17Å
167	S	63.7	Low	67.7	Low	40 Å²	40	94.4 Å²	94.4	28%	0.28	50%	0.495	S	S	.	.	H	α-helix	trans	-45.3	-51.9	-170.1	47.4	0	0	0	0	113.5	L163 A164 A169 F170 F171	L163-S167 WeakPolarHBondContact O-CA 3.39Å; L163-S167 WeakPolarHBondContact O-CB 3.1Å; L163-S167 PolarHBondContact O-N 3.21Å; A164-S167 VanDerWaalsContact O-CB 3.28Å; A164-S167 WeakPolarHBondContact O-CB 3.49Å; A164-S167 PolarHBondContact O-N 3.22Å; A164-S167 PolarHBondContact O-OG 3.45Å; S167-A169 VanDerWaalsContact C-N 3.35Å; S167-A169 PolarHBondContact O-N 3.21Å; S167-F170 PolarHBondContact O-N 3.29Å; S167-F171 WeakPolarHBondContact O-CB 2.97Å; S167-F171 WeakPolarHBondContact O-CD2 3.41Å; S167-F171 PolarHBondContact O-N 3.45Å
168	Q	65	Low	68.1	Low	141 Å²	141	93.6 Å²	93.6	66%	0.659	49%	0.492	S	S	*	.	H	α-helix	trans	-63.6	-42.4	-172	-166	171.4	8.3	0	0	112.3	K166 Q172	K166-Q168 VanDerWaalsContact C-N 3.33Å; K166-Q168 PolarHBondContact O-N 3.35Å; K166-Q168 VanDerWaalsContact O-N 3.15Å; Q168-Q172 VanDerWaalsContact O-CB 3.23Å; Q168-Q172 WeakPolarHBondContact O-CB 3.34Å; Q168-Q172 WeakPolarHBondContact O-CG 3.26Å; Q168-Q172 PolarHBondContact O-N 3.48Å
169	A	64.9	Low	69	Low	57 Å²	57	93.2 Å²	93.2	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-70.3	-39.7	176.8	0	0	0	0	0	111.6	K166 S167 L173	K166-A169 PolarHBondContact O-N 3.15Å; K166-A169 VanDerWaalsContact O-N 3.14Å; S167-A169 VanDerWaalsContact C-N 3.35Å; S167-A169 PolarHBondContact O-N 3.21Å; A169-L173 VanDerWaalsContact O-CB 3.29Å; A169-L173 WeakPolarHBondContact O-CB 3.12Å; A169-L173 PolarHBondContact O-N 2.75Å
170	F	66.6	Low	69.6	Low	93 Å²	93	92.1 Å²	92.1	41%	0.408	49%	0.485	S	S	.	.	H	α-helix	trans	-64.5	-48.3	177.1	178.4	-94.9	0	0	0	112	L163 K166 S167 L173 M174	L163-F170 HydrophobicContact CD2-CD1 3.66Å; L163-F170 HydrophobicContact CD2-CE1 3.52Å; L163-F170 HydrophobicContact CD2-CZ 4.32Å; L163-F170 HydrophobicContact CG-CD1 4.15Å; L163-F170 HydrophobicContact CG-CE1 4.18Å; K166-F170 PolarHBondContact O-N 3.17Å; S167-F170 PolarHBondContact O-N 3.29Å; F170-L173 CarbonylContact O-C 3.6Å; F170-L173 PolarHBondContact O-N 3.5Å; F170-M174 HydrophobicContact CD1-CE 4.33Å; F170-M174 HydrophobicContact CE1-CE 3.73Å; F170-M174 HydrophobicContact CE1-SD 3.72Å; F170-M174 HydrophobicContact CZ-SD 4Å; F170-M174 VanDerWaalsContact O-CB 3.28Å; F170-M174 WeakPolarHBondContact O-CB 3.26Å; F170-M174 PolarHBondContact O-N 2.95Å
171	F	68.3	Low	70.5	Confident	96 Å²	96	93.8 Å²	93.8	42%	0.421	48%	0.483	S	S	.	.	H	α-helix	trans	-69	-35.4	178.1	-69	-66.1	0	0	0	111.7	L163 S167 M174 T175	L163-F171 HydrophobicContact CD2-CE1 4.35Å; L163-F171 HydrophobicContact CD2-CE2 4.46Å; L163-F171 HydrophobicContact CD2-CZ 3.82Å; S167-F171 WeakPolarHBondContact O-CB 2.97Å; S167-F171 WeakPolarHBondContact O-CD2 3.41Å; S167-F171 PolarHBondContact O-N 3.45Å; F171-M174 HydrophobicContact CD1-CE 3.34Å; F171-M174 HydrophobicContact CE1-CE 3.53Å; F171-M174 PolarHBondContact O-N 2.98Å; F171-T175 WeakPolarHBondContact O-CB 3.24Å; F171-T175 VanDerWaalsContact O-CG2 3.28Å; F171-T175 WeakPolarHBondContact O-CG2 3.38Å; F171-T175 PolarHBondContact O-N 2.97Å; F171-T175 PolarHBondContact O-OG1 3.24Å; F171-T175 VanDerWaalsContact O-OG1 3.11Å
172	Q	69.6	Low	71.5	Confident	119 Å²	119	94.6 Å²	94.6	56%	0.556	48%	0.482	S	S	*	.	H	α-helix	trans	-62.9	-46.2	170.7	-79.4	176.3	-7.6	0	0	111.4	Q168 M174 T175 F176	Q168-Q172 VanDerWaalsContact O-CB 3.23Å; Q168-Q172 WeakPolarHBondContact O-CB 3.34Å; Q168-Q172 WeakPolarHBondContact O-CG 3.26Å; Q168-Q172 PolarHBondContact O-N 3.48Å; Q172-M174 VanDerWaalsContact C-N 3.3Å; Q172-M174 PolarHBondContact O-N 3.01Å; Q172-T175 WeakPolarHBondContact CA-OG1 3.35Å; Q172-T175 PolarHBondContact O-N 3.08Å; Q172-T175 PolarHBondContact O-OG1 3.42Å; Q172-F176 VanDerWaalsContact O-CB 3.24Å; Q172-F176 WeakPolarHBondContact O-CB 3.43Å; Q172-F176 PolarHBondContact O-N 3.33Å
173	L	68.5	Low	72.6	Confident	117 Å²	117	94.2 Å²	94.2	61%	0.613	48%	0.481	S	S	*	.	H	α-helix	trans	-61.9	-37.6	173.4	-90.8	155.8	0	0	0	112.1	A169 F170 F176 H177	A169-L173 VanDerWaalsContact O-CB 3.29Å; A169-L173 WeakPolarHBondContact O-CB 3.12Å; A169-L173 PolarHBondContact O-N 2.75Å; F170-L173 CarbonylContact O-C 3.6Å; F170-L173 PolarHBondContact O-N 3.5Å; L173-F176 PolarHBondContact O-N 2.99Å; L173-H177 WeakPolarHBondContact O-CB 3.34Å; L173-H177 PolarHBondContact O-N 2.84Å
174	M	73.8	Confident	74	Confident	82 Å²	82	96.7 Å²	96.7	40%	0.404	49%	0.493	S	S	.	.	H	α-helix	trans	-71.4	-40.8	179.2	-167.1	162.7	59	0	0	111.2	F170 F171 Q172 H177 D178	F170-M174 HydrophobicContact CD1-CE 4.33Å; F170-M174 HydrophobicContact CE1-CE 3.73Å; F170-M174 HydrophobicContact CE1-SD 3.72Å; F170-M174 HydrophobicContact CZ-SD 4Å; F170-M174 VanDerWaalsContact O-CB 3.28Å; F170-M174 WeakPolarHBondContact O-CB 3.26Å; F170-M174 PolarHBondContact O-N 2.95Å; F171-M174 HydrophobicContact CD1-CE 3.34Å; F171-M174 HydrophobicContact CE1-CE 3.53Å; F171-M174 PolarHBondContact O-N 2.98Å; Q172-M174 VanDerWaalsContact C-N 3.3Å; Q172-M174 PolarHBondContact O-N 3.01Å; M174-H177 PolarHBondContact O-N 3.3Å; M174-D178 WeakPolarHBondContact O-CB 3.33Å; M174-D178 PolarHBondContact O-N 3.43Å
175	T	77	Confident	75	Confident	95 Å²	95	98.2 Å²	98.2	58%	0.583	49%	0.493	S	S	*	.	H	α-helix	trans	-66.1	-37.8	171.7	58.1	0	0	0	0	112.2	F171 Q172 D178 E179	F171-T175 WeakPolarHBondContact O-CB 3.24Å; F171-T175 VanDerWaalsContact O-CG2 3.28Å; F171-T175 WeakPolarHBondContact O-CG2 3.38Å; F171-T175 PolarHBondContact O-N 2.97Å; F171-T175 PolarHBondContact O-OG1 3.24Å; F171-T175 VanDerWaalsContact O-OG1 3.11Å; Q172-T175 WeakPolarHBondContact CA-OG1 3.35Å; Q172-T175 PolarHBondContact O-N 3.08Å; Q172-T175 PolarHBondContact O-OG1 3.42Å; T175-D178 PolarHBondContact O-N 3.33Å; T175-E179 WeakPolarHBondContact O-CB 3.4Å; T175-E179 PolarHBondContact O-N 2.96Å
176	F	75.8	Confident	76.3	Confident	128 Å²	128	100.8 Å²	100.8	56%	0.561	49%	0.49	S	S	*	.	H	α-helix	trans	-68.2	-38.3	174.2	-171.4	-99.6	0	0	0	111.1	Q172 L173 E179 L180	Q172-F176 VanDerWaalsContact O-CB 3.24Å; Q172-F176 WeakPolarHBondContact O-CB 3.43Å; Q172-F176 PolarHBondContact O-N 3.33Å; L173-F176 PolarHBondContact O-N 2.99Å; F176-E179 PolarHBondContact O-N 3.44Å; F176-L180 HydrophobicContact CD1-CD1 3.67Å; F176-L180 HydrophobicContact CD1-CG 4.01Å; F176-L180 HydrophobicContact CE1-CD1 3.36Å; F176-L180 HydrophobicContact CE1-CD2 4.31Å; F176-L180 HydrophobicContact CE1-CG 3.78Å; F176-L180 HydrophobicContact CZ-CD1 4.21Å; F176-L180 HydrophobicContact CZ-CD2 4.37Å; F176-L180 HydrophobicContact CZ-CG 4.24Å; F176-L180 VanDerWaalsContact O-CB 3.31Å; F176-L180 WeakPolarHBondContact O-CB 3.5Å; F176-L180 VanDerWaalsContact O-CG 3.29Å; F176-L180 WeakPolarHBondContact O-CG 3.46Å; F176-L180 PolarHBondContact O-N 2.98Å
177	H	80.1	Confident	77.6	Confident	115 Å²	115	96.3 Å²	96.3	53%	0.532	48%	0.48	S	S	.	.	H	α-helix	trans	-66.8	-44.2	174.6	-164.9	83	0	0	0	110.9	L173 M174 E179 L180 Q181	L173-H177 WeakPolarHBondContact O-CB 3.34Å; L173-H177 PolarHBondContact O-N 2.84Å; M174-H177 PolarHBondContact O-N 3.3Å; H177-E179 VanDerWaalsContact C-N 3.32Å; H177-E179 PolarHBondContact O-N 3.41Å; H177-L180 CarbonylContact O-C 3.49Å; H177-L180 PolarHBondContact O-N 2.96Å; H177-Q181 WeakPolarHBondContact O-CB 3.39Å; H177-Q181 PolarHBondContact O-N 2.83Å
178	D	79.4	Confident	78.9	Confident	84 Å²	84	97.9 Å²	97.9	45%	0.449	49%	0.491	S	S	.	.	H	α-helix	trans	-60.5	-40.8	173.9	-110.9	10.9	0	0	0	111.7	M174 T175 Q181 K182	M174-D178 WeakPolarHBondContact O-CB 3.33Å; M174-D178 PolarHBondContact O-N 3.43Å; T175-D178 PolarHBondContact O-N 3.33Å; D178-Q181 PolarHBondContact O-N 2.65Å; D178-K182 WeakPolarHBondContact O-CB 3.4Å; D178-K182 VanDerWaalsContact O-CG 3.25Å; D178-K182 WeakPolarHBondContact O-CG 3.49Å; D178-K182 PolarHBondContact O-N 3.21Å
179	E	82.9	Confident	80.2	Confident	76 Å²	76	94.8 Å²	94.8	36%	0.355	49%	0.485	S	S	.	.	H	α-helix	trans	-70	-41.9	176.4	-175.6	56.4	-150.6	0	0	111.5	T175 F176 H177 Q181 K182 Q183	T175-E179 WeakPolarHBondContact O-CB 3.4Å; T175-E179 PolarHBondContact O-N 2.96Å; F176-E179 PolarHBondContact O-N 3.44Å; H177-E179 VanDerWaalsContact C-N 3.32Å; H177-E179 PolarHBondContact O-N 3.41Å; E179-Q181 VanDerWaalsContact C-N 3.3Å; E179-Q181 PolarHBondContact O-N 3.15Å; E179-K182 PolarHBondContact O-N 3.41Å; E179-Q183 WeakPolarHBondContact O-CB 3.39Å; E179-Q183 VanDerWaalsContact O-CG 3.3Å; E179-Q183 WeakPolarHBondContact O-CG 3.28Å; E179-Q183 PolarHBondContact O-N 3.38Å; E179-Q183 PolarHBondContact OE1-NE2 2.98Å
180	L	79.2	Confident	81.5	Confident	67 Å²	67	94.9 Å²	94.9	35%	0.351	49%	0.486	S	S	.	.	H	α-helix	trans	-61.4	-40.7	172	-79.6	-177.4	0	0	0	111.2	F176 H177 Q183 I184	F176-L180 HydrophobicContact CD1-CD1 3.67Å; F176-L180 HydrophobicContact CD1-CG 4.01Å; F176-L180 HydrophobicContact CE1-CD1 3.36Å; F176-L180 HydrophobicContact CE1-CD2 4.31Å; F176-L180 HydrophobicContact CE1-CG 3.78Å; F176-L180 HydrophobicContact CZ-CD1 4.21Å; F176-L180 HydrophobicContact CZ-CD2 4.37Å; F176-L180 HydrophobicContact CZ-CG 4.24Å; F176-L180 VanDerWaalsContact O-CB 3.31Å; F176-L180 WeakPolarHBondContact O-CB 3.5Å; F176-L180 VanDerWaalsContact O-CG 3.29Å; F176-L180 WeakPolarHBondContact O-CG 3.46Å; F176-L180 PolarHBondContact O-N 2.98Å; H177-L180 CarbonylContact O-C 3.49Å; H177-L180 PolarHBondContact O-N 2.96Å; L180-Q183 CarbonylContact O-C 3.59Å; L180-Q183 PolarHBondContact O-N 3.49Å; L180-I184 VanDerWaalsContact O-CB 3.3Å; L180-I184 WeakPolarHBondContact O-CB 3.48Å; L180-I184 WeakPolarHBondContact O-CD1 3.24Å; L180-I184 WeakPolarHBondContact O-CG1 3.22Å; L180-I184 PolarHBondContact O-N 3.43Å
181	Q	84.3	Confident	82.6	Confident	92 Å²	92	93.4 Å²	93.4	43%	0.43	48%	0.484	S	S	.	.	H	α-helix	trans	-67.8	-42.8	179.8	-163.2	167.4	-6.9	0	0	110.2	H177 D178 E179 Q183 I184 D185	H177-Q181 WeakPolarHBondContact O-CB 3.39Å; H177-Q181 PolarHBondContact O-N 2.83Å; D178-Q181 PolarHBondContact O-N 2.65Å; E179-Q181 VanDerWaalsContact C-N 3.3Å; E179-Q181 PolarHBondContact O-N 3.15Å; Q181-Q183 VanDerWaalsContact C-N 3.35Å; Q181-Q183 PolarHBondContact O-N 3.17Å; Q181-I184 CarbonylContact O-C 3.58Å; Q181-I184 PolarHBondContact O-N 3Å; Q181-D185 WeakPolarHBondContact O-CB 3.43Å; Q181-D185 VanDerWaalsContact O-CG 3.25Å; Q181-D185 PolarHBondContact O-N 3.16Å
182	K	87.6	Confident	83.8	Confident	104 Å²	104	95.1 Å²	95.1	45%	0.452	49%	0.492	S	S	.	.	H	α-helix	trans	-61	-40.6	170.1	-74.2	169.1	-170.6	163.8	0	112.5	D178 E179 D185 R186	D178-K182 WeakPolarHBondContact O-CB 3.4Å; D178-K182 VanDerWaalsContact O-CG 3.25Å; D178-K182 WeakPolarHBondContact O-CG 3.49Å; D178-K182 PolarHBondContact O-N 3.21Å; E179-K182 PolarHBondContact O-N 3.41Å; K182-D185 PolarHBondContact O-N 2.9Å; K182-R186 WeakPolarHBondContact O-CB 3.39Å; K182-R186 VanDerWaalsContact O-CG 3.27Å; K182-R186 WeakPolarHBondContact O-CG 3.29Å; K182-R186 PolarHBondContact O-N 2.74Å
183	Q	84.6	Confident	84.9	Confident	100 Å²	100	95 Å²	95	47%	0.467	49%	0.493	S	S	.	.	H	α-helix	trans	-68.1	-39.2	176.1	-75.9	-175	24	0	0	111.8	E179 L180 Q181 D185 R186 A187	E179-Q183 WeakPolarHBondContact O-CB 3.39Å; E179-Q183 VanDerWaalsContact O-CG 3.3Å; E179-Q183 WeakPolarHBondContact O-CG 3.28Å; E179-Q183 PolarHBondContact O-N 3.38Å; E179-Q183 PolarHBondContact OE1-NE2 2.98Å; L180-Q183 CarbonylContact O-C 3.59Å; L180-Q183 PolarHBondContact O-N 3.49Å; Q181-Q183 VanDerWaalsContact C-N 3.35Å; Q181-Q183 PolarHBondContact O-N 3.17Å; Q183-D185 VanDerWaalsContact C-N 3.35Å; Q183-R186 PolarHBondContact O-N 3.04Å; Q183-A187 WeakPolarHBondContact O-CB 3.42Å; Q183-A187 PolarHBondContact O-N 3.41Å
184	I	88.3	Confident	85.9	Confident	106 Å²	106	94 Å²	94	54%	0.544	49%	0.488	S	S	.	.	H	α-helix	trans	-64.4	-40.7	173.9	-73.3	164.8	0	0	0	110	L180 Q181 A187 S188	L180-I184 VanDerWaalsContact O-CB 3.3Å; L180-I184 WeakPolarHBondContact O-CB 3.48Å; L180-I184 WeakPolarHBondContact O-CD1 3.24Å; L180-I184 WeakPolarHBondContact O-CG1 3.22Å; L180-I184 PolarHBondContact O-N 3.43Å; Q181-I184 CarbonylContact O-C 3.58Å; Q181-I184 PolarHBondContact O-N 3Å; I184-A187 PolarHBondContact O-N 2.66Å; I184-S188 WeakPolarHBondContact O-CA 3.41Å; I184-S188 WeakPolarHBondContact O-CB 3.47Å; I184-S188 PolarHBondContact O-N 3.18Å
185	D	90.4	Very high	86.8	Confident	92 Å²	92	98.8 Å²	98.8	49%	0.492	50%	0.501	S	S	.	.	H	α-helix	trans	-68.5	-41.5	178.1	-74.5	-26.9	0	0	0	112	Q181 K182 Q183 S188 S189	Q181-D185 WeakPolarHBondContact O-CB 3.43Å; Q181-D185 VanDerWaalsContact O-CG 3.25Å; Q181-D185 PolarHBondContact O-N 3.16Å; K182-D185 PolarHBondContact O-N 2.9Å; Q183-D185 VanDerWaalsContact C-N 3.35Å; D185-S188 PolarHBondContact O-N 3.39Å; D185-S189 VanDerWaalsContact O-CB 3.25Å; D185-S189 WeakPolarHBondContact O-CB 2.94Å; D185-S189 PolarHBondContact O-N 3.14Å; D185-S189 PolarHBondContact O-OG 3.49Å
186	R	90.4	Very high	87.4	Confident	167 Å²	167	99.3 Å²	99.3	63%	0.63	50%	0.497	S	S	*	.	H	α-helix	trans	-63.8	-45.6	172.4	-74.1	175.5	-174.1	161.5	4.5	111.2	K182 Q183 S189 A190	K182-R186 WeakPolarHBondContact O-CB 3.39Å; K182-R186 VanDerWaalsContact O-CG 3.27Å; K182-R186 WeakPolarHBondContact O-CG 3.29Å; K182-R186 PolarHBondContact O-N 2.74Å; Q183-R186 PolarHBondContact O-N 3.04Å; R186-S189 PolarHBondContact O-N 3.19Å; R186-A190 VanDerWaalsContact O-CB 3.29Å; R186-A190 WeakPolarHBondContact O-CB 3.4Å; R186-A190 PolarHBondContact O-N 3.33Å
187	A	89.3	Confident	88.1	Confident	52 Å²	52	98.8 Å²	98.8	43%	0.43	50%	0.496	S	S	.	.	H	α-helix	trans	-62.1	-47.3	176.7	0	0	0	0	0	110.2	Q183 I184 S189 A190 T191	Q183-A187 WeakPolarHBondContact O-CB 3.42Å; Q183-A187 PolarHBondContact O-N 3.41Å; I184-A187 PolarHBondContact O-N 2.66Å; A187-S189 PolarHBondContact O-N 2.67Å; A187-A190 CarbonylContact O-C 3.5Å; A187-A190 PolarHBondContact O-N 2.91Å; A187-T191 WeakPolarHBondContact O-CB 3.47Å; A187-T191 PolarHBondContact O-N 2.88Å; A187-T191 PolarHBondContact O-OG1 3.05Å
188	S	91.8	Very high	88.2	Confident	72 Å²	72	99.3 Å²	99.3	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-59.6	-45.7	177.8	-175.1	0	0	0	0	111.4	I184 D185 T191 K192	I184-S188 WeakPolarHBondContact O-CA 3.41Å; I184-S188 WeakPolarHBondContact O-CB 3.47Å; I184-S188 PolarHBondContact O-N 3.18Å; D185-S188 PolarHBondContact O-N 3.39Å; S188-T191 PolarHBondContact O-N 3.16Å; S188-K192 WeakPolarHBondContact O-CB 3.27Å; S188-K192 PolarHBondContact O-N 3.43Å
189	S	92.3	Very high	88.5	Confident	76 Å²	76	102.1 Å²	102.1	53%	0.531	51%	0.511	S	S	.	.	H	α-helix	trans	-60.3	-47	173.7	-64.6	0	0	0	0	112.3	D185 R186 A187 T191 K192 M193	D185-S189 VanDerWaalsContact O-CB 3.25Å; D185-S189 WeakPolarHBondContact O-CB 2.94Å; D185-S189 PolarHBondContact O-N 3.14Å; D185-S189 PolarHBondContact O-OG 3.49Å; R186-S189 PolarHBondContact O-N 3.19Å; A187-S189 PolarHBondContact O-N 2.67Å; S189-T191 VanDerWaalsContact C-N 3.34Å; S189-T191 PolarHBondContact O-N 2.97Å; S189-K192 WeakPolarHBondContact O-CB 3.38Å; S189-K192 PolarHBondContact O-N 2.81Å; S189-M193 PolarHBondContact O-N 3.36Å
190	A	91.6	Very high	88.5	Confident	59 Å²	59	100.1 Å²	100.1	49%	0.488	51%	0.51	S	S	.	.	H	α-helix	trans	-64.3	-39.1	176.5	0	0	0	0	0	112	R186 A187 K192 M193 L194	R186-A190 VanDerWaalsContact O-CB 3.29Å; R186-A190 WeakPolarHBondContact O-CB 3.4Å; R186-A190 PolarHBondContact O-N 3.33Å; A187-A190 CarbonylContact O-C 3.5Å; A187-A190 PolarHBondContact O-N 2.91Å; A190-K192 VanDerWaalsContact C-N 3.33Å; A190-M193 PolarHBondContact O-N 3.48Å; A190-L194 WeakPolarHBondContact O-CB 3.3Å; A190-L194 PolarHBondContact O-N 2.83Å
191	T	90.3	Very high	88.5	Confident	62 Å²	62	101.7 Å²	101.7	38%	0.38	52%	0.518	S	S	.	.	H	α-helix	trans	-67.4	-37.1	176.9	-25.7	0	0	0	0	110.6	A187 S188 S189 L194 R195	A187-T191 WeakPolarHBondContact O-CB 3.47Å; A187-T191 PolarHBondContact O-N 2.88Å; A187-T191 PolarHBondContact O-OG1 3.05Å; S188-T191 PolarHBondContact O-N 3.16Å; S189-T191 VanDerWaalsContact C-N 3.34Å; S189-T191 PolarHBondContact O-N 2.97Å; T191-L194 PolarHBondContact O-N 3.48Å; T191-R195 WeakPolarHBondContact O-CB 3.39Å; T191-R195 VanDerWaalsContact O-CG 3.24Å; T191-R195 WeakPolarHBondContact O-CG 3.43Å; T191-R195 PolarHBondContact O-N 3.14Å
192	K	93	Very high	88.3	Confident	132 Å²	132	99.9 Å²	99.9	57%	0.574	52%	0.515	S	S	*	.	H	α-helix	trans	-64.8	-48.7	175.3	-172	-179.5	176.4	-175.7	0	111.1	S188 S189 A190 L194 R195 E196	S188-K192 WeakPolarHBondContact O-CB 3.27Å; S188-K192 PolarHBondContact O-N 3.43Å; S189-K192 WeakPolarHBondContact O-CB 3.38Å; S189-K192 PolarHBondContact O-N 2.81Å; A190-K192 VanDerWaalsContact C-N 3.33Å; K192-L194 VanDerWaalsContact C-N 3.33Å; K192-L194 PolarHBondContact O-N 2.88Å; K192-R195 WeakPolarHBondContact O-CB 3.13Å; K192-R195 PolarHBondContact O-N 3.38Å; K192-E196 WeakPolarHBondContact CE-OE1 3.49Å; K192-E196 WeakPolarHBondContact O-CG 3.36Å; K192-E196 PolarHBondContact O-N 3.33Å
193	M	93.3	Very high	87.8	Confident	118 Å²	118	97.5 Å²	97.5	58%	0.581	52%	0.516	S	S	*	.	H	α-helix	trans	-56.4	-46.2	172.8	-95.5	-174.1	64.6	0	0	112.1	S189 A190 R195 E196 Q197	S189-M193 PolarHBondContact O-N 3.36Å; A190-M193 PolarHBondContact O-N 3.48Å; M193-R195 VanDerWaalsContact C-N 3.32Å; M193-R195 PolarHBondContact O-N 3.04Å; M193-E196 PolarHBondContact O-N 3.46Å; M193-Q197 WeakPolarHBondContact O-CG 3.34Å; M193-Q197 PolarHBondContact O-N 3.03Å
194	L	89.4	Confident	87.4	Confident	96 Å²	96	97.9 Å²	97.9	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-62.7	-40.3	178.4	-177.6	65.9	0	0	0	111.6	A190 T191 K192 Q197 M198	A190-L194 WeakPolarHBondContact O-CB 3.3Å; A190-L194 PolarHBondContact O-N 2.83Å; T191-L194 PolarHBondContact O-N 3.48Å; K192-L194 VanDerWaalsContact C-N 3.33Å; K192-L194 PolarHBondContact O-N 2.88Å; L194-Q197 PolarHBondContact O-N 3.28Å; L194-M198 WeakPolarHBondContact O-CB 3.48Å; L194-M198 PolarHBondContact O-N 2.95Å
195	R	91.2	Very high	86.9	Confident	181 Å²	181	97.4 Å²	97.4	68%	0.683	52%	0.518	S	S	*	.	H	α-helix	trans	-62.9	-43.9	175.5	-77.3	174.5	-177	178.2	3.7	111.5	T191 K192 M193 M198 Q199	T191-R195 WeakPolarHBondContact O-CB 3.39Å; T191-R195 VanDerWaalsContact O-CG 3.24Å; T191-R195 WeakPolarHBondContact O-CG 3.43Å; T191-R195 PolarHBondContact O-N 3.14Å; K192-R195 WeakPolarHBondContact O-CB 3.13Å; K192-R195 PolarHBondContact O-N 3.38Å; M193-R195 VanDerWaalsContact C-N 3.32Å; M193-R195 PolarHBondContact O-N 3.04Å; R195-M198 PolarHBondContact O-N 3.49Å; R195-Q199 VanDerWaalsContact O-CB 3.3Å; R195-Q199 WeakPolarHBondContact O-CB 3.28Å; R195-Q199 PolarHBondContact O-N 2.92Å
196	E	90.5	Very high	86.2	Confident	107 Å²	107	95.1 Å²	95.1	50%	0.5	51%	0.509	S	S	.	.	H	α-helix	trans	-63.1	-42.5	176.3	-72.1	170.7	-172.3	0	0	111.5	K192 M193 Q199 G200	K192-E196 WeakPolarHBondContact CE-OE1 3.49Å; K192-E196 WeakPolarHBondContact O-CG 3.36Å; K192-E196 PolarHBondContact O-N 3.33Å; M193-E196 PolarHBondContact O-N 3.46Å; E196-Q199 PolarHBondContact O-N 3.39Å; E196-G200 PolarHBondContact O-N 2.91Å
197	Q	89.9	Confident	85.6	Confident	116 Å²	116	91.9 Å²	91.9	54%	0.542	51%	0.505	S	S	.	.	H	α-helix	trans	-64.5	-44.6	174.2	-73.4	-171.8	-12.9	0	0	112.6	M193 L194 Q199 G200 I201	M193-Q197 WeakPolarHBondContact O-CG 3.34Å; M193-Q197 PolarHBondContact O-N 3.03Å; L194-Q197 PolarHBondContact O-N 3.28Å; Q197-Q199 VanDerWaalsContact C-N 3.25Å; Q197-Q199 PolarHBondContact O-N 3.16Å; Q197-G200 PolarHBondContact O-N 2.76Å; Q197-I201 WeakPolarHBondContact O-CG1 3.49Å; Q197-I201 PolarHBondContact O-N 3.2Å
198	M	82.6	Confident	85	Confident	127 Å²	127	97.9 Å²	97.9	63%	0.626	52%	0.516	S	S	*	.	H	α-helix	trans	-60.4	-37.3	173.7	-93.6	-176.5	69.1	0	0	111.6	L194 R195 I201 S202	L194-M198 WeakPolarHBondContact O-CB 3.48Å; L194-M198 PolarHBondContact O-N 2.95Å; R195-M198 PolarHBondContact O-N 3.49Å; M198-I201 PolarHBondContact O-N 3.23Å; M198-S202 VanDerWaalsContact O-CB 3.23Å; M198-S202 WeakPolarHBondContact O-CB 3.03Å; M198-S202 PolarHBondContact O-N 3.31Å
199	Q	85.5	Confident	84.2	Confident	143 Å²	143	102 Å²	102	67%	0.668	52%	0.521	S	S	*	.	H	α-helix	trans	-69	-38.8	177.9	-152.7	170	19.4	0	0	111.1	R195 E196 Q197 S202 A203	R195-Q199 VanDerWaalsContact O-CB 3.3Å; R195-Q199 WeakPolarHBondContact O-CB 3.28Å; R195-Q199 PolarHBondContact O-N 2.92Å; E196-Q199 PolarHBondContact O-N 3.39Å; Q197-Q199 VanDerWaalsContact C-N 3.25Å; Q197-Q199 PolarHBondContact O-N 3.16Å; Q199-S202 PolarHBondContact O-N 3.31Å; Q199-A203 WeakPolarHBondContact O-CB 3.28Å; Q199-A203 PolarHBondContact O-N 3.18Å
200	G	82.7	Confident	83.5	Confident	33 Å²	33	103.4 Å²	103.4	34%	0.34	52%	0.522	S	S	.	.	H	α-helix	trans	-63	-44.5	171.3	0	0	0	0	0	113	E196 Q197 A203 L204	E196-G200 PolarHBondContact O-N 2.91Å; Q197-G200 PolarHBondContact O-N 2.76Å; G200-A203 PolarHBondContact O-N 3.37Å; G200-L204 WeakPolarHBondContact O-CB 3.36Å; G200-L204 WeakPolarHBondContact O-CG 3.37Å; G200-L204 PolarHBondContact O-N 2.9Å
201	I	80.3	Confident	82.9	Confident	100 Å²	100	107.3 Å²	107.3	51%	0.513	53%	0.528	S	S	.	.	H	α-helix	trans	-64.8	-40.6	175.8	-68.1	168	0	0	0	110.8	Q197 M198 L204 L205	Q197-I201 WeakPolarHBondContact O-CG1 3.49Å; Q197-I201 PolarHBondContact O-N 3.2Å; M198-I201 PolarHBondContact O-N 3.23Å; I201-L204 PolarHBondContact O-N 2.72Å; I201-L205 HydrophobicContact CG2-CD1 3.81Å; I201-L205 HydrophobicContact CG2-CG 4.38Å; I201-L205 VanDerWaalsContact O-CB 3.29Å; I201-L205 WeakPolarHBondContact O-CB 3.42Å; I201-L205 PolarHBondContact O-N 3.44Å
202	S	78.8	Confident	82.3	Confident	54 Å²	54	109 Å²	109	38%	0.378	53%	0.534	S	S	.	.	I	π-helix	trans	-62.7	-47.3	174.4	177.6	0	0	0	0	111.1	M198 Q199 L204 S206 D207	M198-S202 VanDerWaalsContact O-CB 3.23Å; M198-S202 WeakPolarHBondContact O-CB 3.03Å; M198-S202 PolarHBondContact O-N 3.31Å; Q199-S202 PolarHBondContact O-N 3.31Å; S202-L204 VanDerWaalsContact C-N 3.33Å; S202-L204 PolarHBondContact O-N 3.16Å; S202-S206 VanDerWaalsContact C-OG 3.3Å; S202-S206 WeakPolarHBondContact CA-OG 3.21Å; S202-S206 WeakPolarHBondContact O-CA 3.4Å; S202-S206 WeakPolarHBondContact O-CB 3.49Å; S202-S206 PolarHBondContact O-N 3.03Å; S202-S206 PolarHBondContact O-OG 3.46Å; S202-S206 PolarHBondContact OG-OG 2.9Å; S202-D207 PolarHBondContact O-N 2.99Å; S202-D207 VanDerWaalsContact O-N 3.09Å
203	A	78.4	Confident	81.3	Confident	55 Å²	55	106.6 Å²	106.6	46%	0.455	53%	0.526	S	S	.	.	I	π-helix	trans	-62.5	-38.1	177.8	0	0	0	0	0	112.8	Q199 G200	Q199-A203 WeakPolarHBondContact O-CB 3.28Å; Q199-A203 PolarHBondContact O-N 3.18Å; G200-A203 PolarHBondContact O-N 3.37Å
204	L	76	Confident	80.7	Confident	107 Å²	107	103.8 Å²	103.8	56%	0.56	52%	0.518	S	S	*	.	I	π-helix	trans	-77.8	-45.1	-179.9	-77.5	166.6	0	0	0	113.1	G200 I201 S202 R208	G200-L204 WeakPolarHBondContact O-CB 3.36Å; G200-L204 WeakPolarHBondContact O-CG 3.37Å; G200-L204 PolarHBondContact O-N 2.9Å; I201-L204 PolarHBondContact O-N 2.72Å; S202-L204 VanDerWaalsContact C-N 3.33Å; S202-L204 PolarHBondContact O-N 3.16Å; L204-R208 WeakPolarHBondContact O-CB 3.09Å; L204-R208 WeakPolarHBondContact O-CD 3.45Å; L204-R208 WeakPolarHBondContact O-CG 3.28Å
205	L	76.8	Confident	80.2	Confident	97 Å²	97	102.8 Å²	102.8	51%	0.508	51%	0.513	S	S	.	.	I	π-helix	trans	-97.4	-56.8	-174.4	-61	-179.8	0	0	0	111.7	I201 D207 W209	I201-L205 HydrophobicContact CG2-CD1 3.81Å; I201-L205 HydrophobicContact CG2-CG 4.38Å; I201-L205 VanDerWaalsContact O-CB 3.29Å; I201-L205 WeakPolarHBondContact O-CB 3.42Å; I201-L205 PolarHBondContact O-N 3.44Å; L205-D207 PolarHBondContact O-N 3.43Å; L205-W209 VanDerWaalsContact O-CB 3.29Å; L205-W209 WeakPolarHBondContact O-CB 3.32Å; L205-W209 PolarHBondContact O-N 3.26Å; L205-W209 VanDerWaalsContact O-N 3.17Å
206	S	75.8	Confident	79.7	Confident	43 Å²	43	100.2 Å²	100.2	30%	0.301	51%	0.509	S	S	.	.	I	π-helix	trans	-65.8	-46.7	-173.5	68.6	0	0	0	0	112	S202 L210	S202-S206 VanDerWaalsContact C-OG 3.3Å; S202-S206 WeakPolarHBondContact CA-OG 3.21Å; S202-S206 WeakPolarHBondContact O-CA 3.4Å; S202-S206 WeakPolarHBondContact O-CB 3.49Å; S202-S206 PolarHBondContact O-N 3.03Å; S202-S206 PolarHBondContact O-OG 3.46Å; S202-S206 PolarHBondContact OG-OG 2.9Å; S206-L210 WeakPolarHBondContact O-CB 3.34Å; S206-L210 WeakPolarHBondContact O-CD1 3.34Å; S206-L210 WeakPolarHBondContact O-CG 3.39Å; S206-L210 PolarHBondContact O-N 3.29Å
207	D	78.9	Confident	79.1	Confident	100 Å²	100	99.3 Å²	99.3	54%	0.535	51%	0.508	S	S	.	.	H	α-helix	trans	-70.1	-40.9	-174	-83.4	3.6	0	0	0	113.3	S202 L205 K211	S202-D207 PolarHBondContact O-N 2.99Å; S202-D207 VanDerWaalsContact O-N 3.09Å; L205-D207 PolarHBondContact O-N 3.43Å; D207-K211 WeakPolarHBondContact O-CB 3.46Å; D207-K211 PolarHBondContact O-N 3.23Å
208	R	76	Confident	78.4	Confident	177 Å²	177	100.3 Å²	100.3	67%	0.668	51%	0.506	S	S	*	.	H	α-helix	trans	-66	-44.3	177.5	-71.6	-171.3	175.8	-169.9	-0.1	111.8	L204 K211 L212	L204-R208 WeakPolarHBondContact O-CB 3.09Å; L204-R208 WeakPolarHBondContact O-CD 3.45Å; L204-R208 WeakPolarHBondContact O-CG 3.28Å; R208-K211 PolarHBondContact O-N 2.99Å; R208-L212 WeakPolarHBondContact O-CB 3.43Å; R208-L212 PolarHBondContact O-N 3.47Å
209	W	75.5	Confident	78.1	Confident	160 Å²	160	103.2 Å²	103.2	61%	0.606	51%	0.51	S	S	*	.	H	α-helix	trans	-71.5	-39	179.8	-72.7	82.2	0	0	0	111.6	L205 K211 L212 I213	L205-W209 VanDerWaalsContact O-CB 3.29Å; L205-W209 WeakPolarHBondContact O-CB 3.32Å; L205-W209 PolarHBondContact O-N 3.26Å; L205-W209 VanDerWaalsContact O-N 3.17Å; W209-K211 VanDerWaalsContact C-N 3.3Å; W209-K211 PolarHBondContact O-N 3.04Å; W209-L212 HydrophobicContact CE3-CD2 4.35Å; W209-L212 HydrophobicContact CZ3-CD2 4.49Å; W209-L212 WeakPolarHBondContact O-CB 3.26Å; W209-L212 PolarHBondContact O-N 3.22Å; W209-I213 VanDerWaalsContact O-CG1 3.26Å; W209-I213 WeakPolarHBondContact O-CG1 3.4Å; W209-I213 PolarHBondContact O-N 3.42Å
210	L	77	Confident	77.3	Confident	104 Å²	104	99.2 Å²	99.2	55%	0.545	50%	0.501	S	S	.	.	H	α-helix	trans	-63.3	-36.8	171.5	-72.6	170.7	0	0	0	111.7	S206 I213 S214	S206-L210 WeakPolarHBondContact O-CB 3.34Å; S206-L210 WeakPolarHBondContact O-CD1 3.34Å; S206-L210 WeakPolarHBondContact O-CG 3.39Å; S206-L210 PolarHBondContact O-N 3.29Å; L210-I213 PolarHBondContact O-N 3.3Å; L210-S214 VanDerWaalsContact O-CB 3.32Å; L210-S214 WeakPolarHBondContact O-CB 3.4Å; L210-S214 PolarHBondContact O-N 3.45Å; L210-S214 PolarHBondContact O-OG 3.5Å
211	K	79.2	Confident	76.7	Confident	142 Å²	142	105.2 Å²	105.2	62%	0.617	51%	0.514	S	S	*	.	H	α-helix	trans	-68.8	-37.7	173.6	-163.8	167.3	-173.8	173.7	0	111.9	D207 R208 W209 S214 L215	D207-K211 WeakPolarHBondContact O-CB 3.46Å; D207-K211 PolarHBondContact O-N 3.23Å; R208-K211 PolarHBondContact O-N 2.99Å; W209-K211 VanDerWaalsContact C-N 3.3Å; W209-K211 PolarHBondContact O-N 3.04Å; K211-S214 WeakPolarHBondContact CA-OG 3.49Å; K211-S214 PolarHBondContact O-N 3.21Å; K211-S214 PolarHBondContact O-OG 3.18Å; K211-L215 HydrophobicContact CG-CD1 4.34Å; K211-L215 VanDerWaalsContact O-CB 3.28Å; K211-L215 WeakPolarHBondContact O-CB 3.17Å; K211-L215 WeakPolarHBondContact O-CG 3.18Å; K211-L215 PolarHBondContact O-N 3.4Å
212	L	77.3	Confident	76.2	Confident	96 Å²	96	104.6 Å²	104.6	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-46.6	173	-171.8	73.7	0	0	0	111.1	R208 W209 S214 L215 Q216	R208-L212 WeakPolarHBondContact O-CB 3.43Å; R208-L212 PolarHBondContact O-N 3.47Å; W209-L212 HydrophobicContact CE3-CD2 4.35Å; W209-L212 HydrophobicContact CZ3-CD2 4.49Å; W209-L212 WeakPolarHBondContact O-CB 3.26Å; W209-L212 PolarHBondContact O-N 3.22Å; L212-S214 PolarHBondContact O-N 3.15Å; L212-L215 PolarHBondContact O-N 3.23Å; L212-Q216 WeakPolarHBondContact O-CB 3.31Å; L212-Q216 PolarHBondContact O-N 3.45Å
213	I	72.7	Confident	75.7	Confident	82 Å²	82	105.1 Å²	105.1	42%	0.421	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-42.9	176.8	-67.2	163.3	0	0	0	110.4	W209 L210 L215 Q216 N217	W209-I213 VanDerWaalsContact O-CG1 3.26Å; W209-I213 WeakPolarHBondContact O-CG1 3.4Å; W209-I213 PolarHBondContact O-N 3.42Å; L210-I213 PolarHBondContact O-N 3.3Å; I213-L215 VanDerWaalsContact C-N 3.35Å; I213-L215 PolarHBondContact O-N 3.08Å; I213-Q216 PolarHBondContact O-N 3.01Å; I213-N217 WeakPolarHBondContact O-CB 3.39Å; I213-N217 VanDerWaalsContact O-CG 3.25Å; I213-N217 PolarHBondContact O-N 3.28Å; I213-N217 PolarHBondContact O-ND2 3.11Å
214	S	80.2	Confident	74.8	Confident	59 Å²	59	107 Å²	107	41%	0.413	51%	0.511	S	S	.	.	H	α-helix	trans	-66.7	-36.9	178.4	76.3	0	0	0	0	112.1	L210 K211 L212 R218	L210-S214 VanDerWaalsContact O-CB 3.32Å; L210-S214 WeakPolarHBondContact O-CB 3.4Å; L210-S214 PolarHBondContact O-N 3.45Å; L210-S214 PolarHBondContact O-OG 3.5Å; K211-S214 WeakPolarHBondContact CA-OG 3.49Å; K211-S214 PolarHBondContact O-N 3.21Å; K211-S214 PolarHBondContact O-OG 3.18Å; L212-S214 PolarHBondContact O-N 3.15Å; S214-R218 VanDerWaalsContact O-CB 3.24Å; S214-R218 WeakPolarHBondContact O-CB 3.41Å; S214-R218 PolarHBondContact O-N 3.34Å
215	L	80.1	Confident	74.1	Confident	75 Å²	75	106.8 Å²	106.8	39%	0.393	51%	0.51	S	S	.	.	H	α-helix	trans	-68.2	-38.8	172.7	-73.5	172.5	0	0	0	112.3	K211 L212 I213 R218 R219	K211-L215 HydrophobicContact CG-CD1 4.34Å; K211-L215 VanDerWaalsContact O-CB 3.28Å; K211-L215 WeakPolarHBondContact O-CB 3.17Å; K211-L215 WeakPolarHBondContact O-CG 3.18Å; K211-L215 PolarHBondContact O-N 3.4Å; L212-L215 PolarHBondContact O-N 3.23Å; I213-L215 VanDerWaalsContact C-N 3.35Å; I213-L215 PolarHBondContact O-N 3.08Å; L215-R218 VanDerWaalsContact CD2-NH2 3.31Å; L215-R218 CarbonylContact O-C 3.54Å; L215-R218 PolarHBondContact O-N 3.02Å; L215-R219 WeakPolarHBondContact O-CB 3.27Å; L215-R219 PolarHBondContact O-N 2.85Å
216	Q	80.4	Confident	73.2	Confident	128 Å²	128	104.7 Å²	104.7	60%	0.598	50%	0.503	S	S	*	.	H	α-helix	trans	-67.3	-43.3	176.1	-169.1	176.9	-4.6	0	0	111.1	L212 I213 R218 R219 A220	L212-Q216 WeakPolarHBondContact O-CB 3.31Å; L212-Q216 PolarHBondContact O-N 3.45Å; I213-Q216 PolarHBondContact O-N 3.01Å; Q216-R218 VanDerWaalsContact C-N 3.3Å; Q216-R218 PolarHBondContact O-N 3.14Å; Q216-R219 PolarHBondContact O-N 2.84Å; Q216-A220 WeakPolarHBondContact O-CB 3.36Å; Q216-A220 PolarHBondContact O-N 2.92Å
217	N	76.8	Confident	72.2	Confident	88 Å²	88	108.9 Å²	108.9	47%	0.471	52%	0.516	S	S	.	.	H	α-helix	trans	-65.5	-33.5	172.4	-71.8	-19.5	0	0	0	111.9	I213 R221	I213-N217 WeakPolarHBondContact O-CB 3.39Å; I213-N217 VanDerWaalsContact O-CG 3.25Å; I213-N217 PolarHBondContact O-N 3.28Å; I213-N217 PolarHBondContact O-ND2 3.11Å; N217-R221 WeakPolarHBondContact O-CB 3.17Å; N217-R221 WeakPolarHBondContact O-CG 3.45Å; N217-R221 PolarHBondContact O-N 2.75Å; N217-R221 PolarHBondContact O-NE 3.42Å
218	R	76.3	Confident	71.1	Confident	136 Å²	136	111.1 Å²	111.1	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-67.9	-43.8	172.3	-174	170.9	69.4	97.5	-2.9	111.1	S214 L215 Q216 R221 I222	S214-R218 VanDerWaalsContact O-CB 3.24Å; S214-R218 WeakPolarHBondContact O-CB 3.41Å; S214-R218 PolarHBondContact O-N 3.34Å; L215-R218 VanDerWaalsContact CD2-NH2 3.31Å; L215-R218 CarbonylContact O-C 3.54Å; L215-R218 PolarHBondContact O-N 3.02Å; Q216-R218 VanDerWaalsContact C-N 3.3Å; Q216-R218 PolarHBondContact O-N 3.14Å; R218-R221 PolarHBondContact O-N 2.92Å; R218-I222 HydrophobicContact CG-CD1 3.89Å; R218-I222 HydrophobicContact CG-CG1 4.41Å; R218-I222 WeakPolarHBondContact O-CB 3.37Å; R218-I222 VanDerWaalsContact O-CG1 3.27Å; R218-I222 WeakPolarHBondContact O-CG1 3.48Å; R218-I222 PolarHBondContact O-N 2.78Å
219	R	76.3	Confident	70.1	Confident	189 Å²	189	106.9 Å²	106.9	71%	0.713	51%	0.51	S	S	*	.	H	α-helix	trans	-60.6	-46.7	174.6	-179.7	179.6	168.4	-179.8	-2.9	111.1	L215 Q216 R221 I222 V223	L215-R219 WeakPolarHBondContact O-CB 3.27Å; L215-R219 PolarHBondContact O-N 2.85Å; Q216-R219 PolarHBondContact O-N 2.84Å; R219-R221 VanDerWaalsContact C-N 3.35Å; R219-R221 PolarHBondContact O-N 3.34Å; R219-I222 PolarHBondContact O-N 3.48Å; R219-V223 WeakPolarHBondContact O-CG2 3.38Å; R219-V223 PolarHBondContact O-N 3.26Å
220	A	68.2	Low	68.9	Low	58 Å²	58	104.5 Å²	104.5	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-58.9	-45.2	175.8	0	0	0	0	0	111.6	Q216 I222 V223 E224	Q216-A220 WeakPolarHBondContact O-CB 3.36Å; Q216-A220 PolarHBondContact O-N 2.92Å; A220-I222 PolarHBondContact O-N 3.05Å; A220-V223 PolarHBondContact O-N 3.32Å; A220-E224 WeakPolarHBondContact O-CB 3.48Å; A220-E224 PolarHBondContact O-N 2.93Å
221	R	70.6	Confident	67.7	Low	159 Å²	159	102.1 Å²	102.1	60%	0.6	50%	0.498	S	S	*	.	H	α-helix	trans	-63.6	-38.4	174.1	-79.2	-176.6	-71.9	-167.3	0.6	113.3	N217 R218 R219 E224 L225	N217-R221 WeakPolarHBondContact O-CB 3.17Å; N217-R221 WeakPolarHBondContact O-CG 3.45Å; N217-R221 PolarHBondContact O-N 2.75Å; N217-R221 PolarHBondContact O-NE 3.42Å; R218-R221 PolarHBondContact O-N 2.92Å; R219-R221 VanDerWaalsContact C-N 3.35Å; R219-R221 PolarHBondContact O-N 3.34Å; R221-E224 PolarHBondContact O-N 2.91Å; R221-L225 VanDerWaalsContact O-CB 3.26Å; R221-L225 WeakPolarHBondContact O-CB 3.35Å; R221-L225 WeakPolarHBondContact O-CG 3.09Å; R221-L225 PolarHBondContact O-N 3.3Å
222	I	68.6	Low	66.2	Low	87 Å²	87	101.4 Å²	101.4	45%	0.446	50%	0.497	S	S	.	.	H	α-helix	trans	-66.6	-39.5	175.9	-71.4	167.5	0	0	0	110.6	R218 R219 A220 L225 S226	R218-I222 HydrophobicContact CG-CD1 3.89Å; R218-I222 HydrophobicContact CG-CG1 4.41Å; R218-I222 WeakPolarHBondContact O-CB 3.37Å; R218-I222 VanDerWaalsContact O-CG1 3.27Å; R218-I222 WeakPolarHBondContact O-CG1 3.48Å; R218-I222 PolarHBondContact O-N 2.78Å; R219-I222 PolarHBondContact O-N 3.48Å; A220-I222 PolarHBondContact O-N 3.05Å; I222-L225 CarbonylContact O-C 3.54Å; I222-L225 PolarHBondContact O-N 3.46Å; I222-S226 WeakPolarHBondContact O-CB 3.48Å; I222-S226 PolarHBondContact O-N 3.25Å; I222-S226 PolarHBondContact O-OG 2.96Å
223	V	68.1	Low	64.8	Low	66 Å²	66	98.9 Å²	98.9	40%	0.4	49%	0.49	S	S	.	.	H	α-helix	trans	-66.4	-41	175.6	171.8	0	0	0	0	111	R219 A220 S226 K227	R219-V223 WeakPolarHBondContact O-CG2 3.38Å; R219-V223 PolarHBondContact O-N 3.26Å; A220-V223 PolarHBondContact O-N 3.32Å; V223-S226 WeakPolarHBondContact CA-OG 3.32Å; V223-S226 PolarHBondContact O-N 2.93Å; V223-S226 PolarHBondContact O-OG 3.42Å; V223-K227 WeakPolarHBondContact O-CG 3.36Å; V223-K227 PolarHBondContact O-N 3.27Å
224	E	60.1	Low	63.5	Low	95 Å²	95	97.4 Å²	97.4	44%	0.444	48%	0.484	S	S	.	.	H	α-helix	trans	-64.5	-43.6	175	-168.3	64.4	-157.6	0	0	111.3	A220 R221 K227 R228	A220-E224 WeakPolarHBondContact O-CB 3.48Å; A220-E224 PolarHBondContact O-N 2.93Å; R221-E224 PolarHBondContact O-N 2.91Å; E224-K227 PolarHBondContact O-N 3.47Å; E224-R228 WeakPolarHBondContact O-CB 3.16Å; E224-R228 WeakPolarHBondContact O-CG 3.5Å; E224-R228 PolarHBondContact O-N 2.77Å; E224-R228 IonicContact OE1-NE 3.75Å
225	L	60.5	Low	61.8	Low	102 Å²	102	96.9 Å²	96.9	53%	0.534	48%	0.479	S	S	.	.	H	α-helix	trans	-65	-39.3	173.4	-75.1	167.6	0	0	0	111.3	R221 I222 K227 R228 V229	R221-L225 VanDerWaalsContact O-CB 3.26Å; R221-L225 WeakPolarHBondContact O-CB 3.35Å; R221-L225 WeakPolarHBondContact O-CG 3.09Å; R221-L225 PolarHBondContact O-N 3.3Å; I222-L225 CarbonylContact O-C 3.54Å; I222-L225 PolarHBondContact O-N 3.46Å; L225-K227 VanDerWaalsContact C-N 3.35Å; L225-R228 CarbonylContact O-C 3.57Å; L225-R228 PolarHBondContact O-N 3.05Å; L225-V229 WeakPolarHBondContact O-CA 3.38Å; L225-V229 WeakPolarHBondContact O-CB 3.38Å; L225-V229 WeakPolarHBondContact O-CG2 3.47Å; L225-V229 PolarHBondContact O-N 3.08Å
226	S	59	Low	60.2	Low	53 Å²	53	97.9 Å²	97.9	37%	0.371	49%	0.492	S	S	.	.	H	α-helix	trans	-66.7	-38.4	177.2	67.9	0	0	0	0	111.1	I222 V223 V229 I230	I222-S226 WeakPolarHBondContact O-CB 3.48Å; I222-S226 PolarHBondContact O-N 3.25Å; I222-S226 PolarHBondContact O-OG 2.96Å; V223-S226 WeakPolarHBondContact CA-OG 3.32Å; V223-S226 PolarHBondContact O-N 2.93Å; V223-S226 PolarHBondContact O-OG 3.42Å; S226-V229 PolarHBondContact O-N 3.38Å; S226-I230 WeakPolarHBondContact O-CB 3.06Å; S226-I230 WeakPolarHBondContact O-CD1 3.17Å; S226-I230 WeakPolarHBondContact O-CG1 3.48Å; S226-I230 PolarHBondContact O-N 3.19Å
227	K	54.5	Low	58.8	Low	130 Å²	130	97.5 Å²	97.5	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-60.6	-49.7	170.1	-74.3	-178.1	176.6	-167.7	0	110.9	V223 E224 L225 V229 I230 V231	V223-K227 WeakPolarHBondContact O-CG 3.36Å; V223-K227 PolarHBondContact O-N 3.27Å; E224-K227 PolarHBondContact O-N 3.47Å; L225-K227 VanDerWaalsContact C-N 3.35Å; K227-V229 VanDerWaalsContact C-N 3.33Å; K227-V229 PolarHBondContact O-N 3.43Å; K227-I230 PolarHBondContact O-N 2.88Å; K227-V231 VanDerWaalsContact O-CG2 3.29Å; K227-V231 WeakPolarHBondContact O-CG2 3.42Å; K227-V231 PolarHBondContact O-N 3.01Å
228	R	56	Low	57.3	Low	148 Å²	148	99 Å²	99	56%	0.558	50%	0.495	S	S	*	.	H	α-helix	trans	-66.5	-30.5	179	-73.5	-176.7	-178.4	-140.9	-1.7	113.9	E224 L225 H232	E224-R228 WeakPolarHBondContact O-CB 3.16Å; E224-R228 WeakPolarHBondContact O-CG 3.5Å; E224-R228 PolarHBondContact O-N 2.77Å; E224-R228 IonicContact OE1-NE 3.75Å; L225-R228 CarbonylContact O-C 3.57Å; L225-R228 PolarHBondContact O-N 3.05Å; R228-H232 VanDerWaalsContact O-CB 3.28Å; R228-H232 WeakPolarHBondContact O-CB 3.45Å; R228-H232 PolarHBondContact O-N 3.1Å; R228-H232 PolarHBondContact O-ND1 3.4Å
229	V	55.2	Low	55.9	Low	87 Å²	87	98.4 Å²	98.4	53%	0.527	51%	0.507	S	S	.	.	H	α-helix	trans	-78.4	-37.1	175.7	169.1	0	0	0	0	109.8	L225 S226 K227 V231 H232 A233	L225-V229 WeakPolarHBondContact O-CA 3.38Å; L225-V229 WeakPolarHBondContact O-CB 3.38Å; L225-V229 WeakPolarHBondContact O-CG2 3.47Å; L225-V229 PolarHBondContact O-N 3.08Å; S226-V229 PolarHBondContact O-N 3.38Å; K227-V229 VanDerWaalsContact C-N 3.33Å; K227-V229 PolarHBondContact O-N 3.43Å; V229-V231 VanDerWaalsContact C-N 3.3Å; V229-H232 PolarHBondContact O-N 3.11Å; V229-A233 WeakPolarHBondContact O-CA 3.38Å; V229-A233 WeakPolarHBondContact O-CB 3.42Å; V229-A233 PolarHBondContact O-N 2.8Å
230	I	50.9	Low	54.5	Low	110 Å²	110	94.3 Å²	94.3	56%	0.564	50%	0.499	S	S	*	.	H	α-helix	trans	-61.5	-44.5	169.2	-69.4	162.5	0	0	0	109.3	S226 K227 V234	S226-I230 WeakPolarHBondContact O-CB 3.06Å; S226-I230 WeakPolarHBondContact O-CD1 3.17Å; S226-I230 WeakPolarHBondContact O-CG1 3.48Å; S226-I230 PolarHBondContact O-N 3.19Å; K227-I230 PolarHBondContact O-N 2.88Å; I230-V234 VanDerWaalsContact O-CB 3.31Å; I230-V234 WeakPolarHBondContact O-CB 3.38Å; I230-V234 WeakPolarHBondContact O-CG2 3.31Å; I230-V234 PolarHBondContact O-N 3.03Å; I230-V234 VanDerWaalsContact O-N 3.08Å
231	V	50.7	Low	53.7	Low	55 Å²	55	98.4 Å²	98.4	33%	0.333	51%	0.512	S	S	.	.	H	α-helix	trans	-58.6	-58.1	172.8	173.1	0	0	0	0	110.3	K227 V229 A233 V234 T235 L247	K227-V231 VanDerWaalsContact O-CG2 3.29Å; K227-V231 WeakPolarHBondContact O-CG2 3.42Å; K227-V231 PolarHBondContact O-N 3.01Å; V229-V231 VanDerWaalsContact C-N 3.3Å; V231-A233 PolarHBondContact O-N 2.93Å; V231-V234 PolarHBondContact O-N 3.2Å; V231-T235 WeakPolarHBondContact O-CB 3.5Å; V231-T235 PolarHBondContact O-N 3.36Å; V231-T235 PolarHBondContact O-OG1 2.7Å; V231-L247 HydrophobicContact CG2-CD1 4.48Å
232	H	48.8	Very low	52.9	Low	127 Å²	127	94.2 Å²	94.2	59%	0.588	51%	0.507	S	S	*	.	H	α-helix	trans	-66.7	-37	-176.8	-87.2	96.3	0	0	0	114.7	R228 V229 V234 T235 S236	R228-H232 VanDerWaalsContact O-CB 3.28Å; R228-H232 WeakPolarHBondContact O-CB 3.45Å; R228-H232 PolarHBondContact O-N 3.1Å; R228-H232 PolarHBondContact O-ND1 3.4Å; V229-H232 PolarHBondContact O-N 3.11Å; H232-V234 VanDerWaalsContact C-N 3.31Å; H232-T235 CarbonylContact O-C 3.17Å; H232-T235 PolarHBondContact O-N 2.9Å; H232-S236 WeakPolarHBondContact O-CB 3.36Å; H232-S236 PolarHBondContact O-N 3.19Å
233	A	46.7	Very low	52.2	Low	43 Å²	43	91.7 Å²	91.7	36%	0.355	50%	0.495	S	S	.	.	H	α-helix	trans	-69.6	-34.5	178.6	0	0	0	0	0	110.2	V229 V231 I237	V229-A233 WeakPolarHBondContact O-CA 3.38Å; V229-A233 WeakPolarHBondContact O-CB 3.42Å; V229-A233 PolarHBondContact O-N 2.8Å; V231-A233 PolarHBondContact O-N 2.93Å; A233-I237 WeakPolarHBondContact O-CD1 3.36Å; A233-I237 WeakPolarHBondContact O-CG1 3.38Å; A233-I237 PolarHBondContact O-N 3.32Å
234	V	46.4	Very low	51.3	Low	50 Å²	50	91.7 Å²	91.7	30%	0.303	50%	0.495	S	S	.	.	H	α-helix	trans	-71	-41	169.1	176.3	0	0	0	0	110.4	I230 V231 H232 S236 I237 F238 V243	I230-V234 VanDerWaalsContact O-CB 3.31Å; I230-V234 WeakPolarHBondContact O-CB 3.38Å; I230-V234 WeakPolarHBondContact O-CG2 3.31Å; I230-V234 PolarHBondContact O-N 3.03Å; I230-V234 VanDerWaalsContact O-N 3.08Å; V231-V234 PolarHBondContact O-N 3.2Å; H232-V234 VanDerWaalsContact C-N 3.31Å; V234-S236 PolarHBondContact O-N 2.74Å; V234-I237 PolarHBondContact O-N 2.51Å; V234-F238 HydrophobicContact CG1-CD2 4.48Å; V234-F238 PolarHBondContact O-N 3.32Å; V234-V243 HydrophobicContact CG1-CG1 3.76Å
235	T	43	Very low	51	Low	48 Å²	48	91.3 Å²	91.3	29%	0.294	50%	0.496	S	S	.	.	H	α-helix	trans	-63.6	-34.8	175.9	-50.9	0	0	0	0	113.3	V231 H232 I237 F238	V231-T235 WeakPolarHBondContact O-CB 3.5Å; V231-T235 PolarHBondContact O-N 3.36Å; V231-T235 PolarHBondContact O-OG1 2.7Å; H232-T235 CarbonylContact O-C 3.17Å; H232-T235 PolarHBondContact O-N 2.9Å; T235-I237 VanDerWaalsContact C-N 3.34Å; T235-F238 CarbonylContact O-C 3.53Å; T235-F238 VanDerWaalsContact O-C 3.25Å
236	S	46.3	Very low	50.9	Low	96 Å²	96	88.7 Å²	88.7	67%	0.671	49%	0.489	S	S	*	.	H	α-helix	trans	-78.6	-21.9	178.5	87.5	0	0	0	0	112.5	H232 V234	H232-S236 WeakPolarHBondContact O-CB 3.36Å; H232-S236 PolarHBondContact O-N 3.19Å; V234-S236 PolarHBondContact O-N 2.74Å
237	I	51.6	Low	50.8	Low	120 Å²	120	89.5 Å²	89.5	62%	0.615	49%	0.489	S	S	*	.	H	α-helix	trans	-84.4	-28.6	174	-63	169.1	0	0	0	110.3	A233 V234 T235	A233-I237 WeakPolarHBondContact O-CD1 3.36Å; A233-I237 WeakPolarHBondContact O-CG1 3.38Å; A233-I237 PolarHBondContact O-N 3.32Å; V234-I237 PolarHBondContact O-N 2.51Å; T235-I237 VanDerWaalsContact C-N 3.34Å
238	F	44.9	Very low	51.1	Low	119 Å²	119	88.2 Å²	88.2	52%	0.522	49%	0.488	S	S	.	.			trans	-130.2	97.8	178.9	-61.3	-81.4	0	0	0	109.9	V234 T235 D240 V243	V234-F238 HydrophobicContact CG1-CD2 4.48Å; V234-F238 PolarHBondContact O-N 3.32Å; T235-F238 CarbonylContact O-C 3.53Å; T235-F238 VanDerWaalsContact O-C 3.25Å; F238-D240 PolarHBondContact O-N 3.27Å; F238-V243 HydrophobicContact CB-CG2 4.09Å
239	T	47.2	Very low	51.3	Low	124 Å²	124	84.4 Å²	84.4	76%	0.761	48%	0.476	S	S	*	.			trans	-65.3	8.4	-179.1	43.2	0	0	0	0	115.2
240	D	47	Very low	51.7	Low	103 Å²	103	85.6 Å²	85.6	55%	0.551	48%	0.479	S	S	*	.			trans	-92.5	117.9	-178.3	-62.5	-27.9	0	0	0	109.7	F238 S242 V243	F238-D240 PolarHBondContact O-N 3.27Å; D240-S242 VanDerWaalsContact CB-OG 3.28Å; D240-S242 WeakPolarHBondContact CB-OG 3.29Å; D240-S242 PolarHBondContact O-N 3.29Å; D240-V243 PolarHBondContact O-N 3.47Å
241	I	51.8	Low	52.5	Low	144 Å²	144	85.5 Å²	85.5	74%	0.738	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	-25	172.1	-70.5	165.9	0	0	0	111.9	V243 V244	I241-V243 PolarHBondContact O-N 3.34Å; I241-V244 PolarHBondContact O-N 3.22Å
242	S	54.8	Low	53.3	Low	71 Å²	71	84 Å²	84	50%	0.497	47%	0.47	S	S	.	.	H	α-helix	trans	-56.2	-26.7	175.6	64.5	0	0	0	0	114.8	D240 A246	D240-S242 VanDerWaalsContact CB-OG 3.28Å; D240-S242 WeakPolarHBondContact CB-OG 3.29Å; D240-S242 PolarHBondContact O-N 3.29Å; S242-A246 VanDerWaalsContact O-CB 3.27Å; S242-A246 WeakPolarHBondContact O-CB 3.36Å; S242-A246 PolarHBondContact O-N 2.9Å
243	V	52	Low	54.3	Low	34 Å²	34	80.2 Å²	80.2	21%	0.206	45%	0.453	C	S	.	.	H	α-helix	trans	-81	-33.8	-175.8	-173.6	0	0	0	0	112.5	V234 F238 D240 I241 D245 A246 L247	V234-V243 HydrophobicContact CG1-CG1 3.76Å; F238-V243 HydrophobicContact CB-CG2 4.09Å; D240-V243 PolarHBondContact O-N 3.47Å; I241-V243 PolarHBondContact O-N 3.34Å; V243-D245 VanDerWaalsContact C-N 3.33Å; V243-A246 PolarHBondContact O-N 3.42Å; V243-L247 HydrophobicContact CG1-CD1 4.5Å; V243-L247 HydrophobicContact CG1-CG 4.46Å; V243-L247 WeakPolarHBondContact O-CG 3.25Å; V243-L247 PolarHBondContact O-N 3.03Å
244	V	50.6	Low	55.4	Low	67 Å²	67	80.5 Å²	80.5	41%	0.406	45%	0.453	S	S	.	.	H	α-helix	trans	-65.7	-43.7	174	177.1	0	0	0	0	109.5	I241 A246 L247 L248	I241-V244 PolarHBondContact O-N 3.22Å; V244-A246 VanDerWaalsContact C-N 3.31Å; V244-A246 PolarHBondContact O-N 3Å; V244-L247 PolarHBondContact O-N 3.48Å; V244-L248 WeakPolarHBondContact O-CB 3.23Å; V244-L248 PolarHBondContact O-N 3.33Å
245	D	53.7	Low	56.7	Low	87 Å²	87	81.8 Å²	81.8	47%	0.465	46%	0.461	S	S	.	.	H	α-helix	trans	-60	-43.3	171.8	-71	-14.8	0	0	0	110.4	V243 L247 L248 Q249	V243-D245 VanDerWaalsContact C-N 3.33Å; D245-L247 PolarHBondContact O-N 3.38Å; D245-L248 PolarHBondContact O-N 3.39Å; D245-Q249 VanDerWaalsContact O-CB 3.29Å; D245-Q249 WeakPolarHBondContact O-CB 3.38Å; D245-Q249 WeakPolarHBondContact O-CG 3.21Å; D245-Q249 PolarHBondContact O-N 3.21Å
246	A	58.5	Low	58.1	Low	46 Å²	46	79.7 Å²	79.7	38%	0.38	45%	0.448	S	S	.	.	H	α-helix	trans	-63.6	-37.1	176.8	0	0	0	0	0	113.7	S242 V243 V244 Q249 L250	S242-A246 VanDerWaalsContact O-CB 3.27Å; S242-A246 WeakPolarHBondContact O-CB 3.36Å; S242-A246 PolarHBondContact O-N 2.9Å; V243-A246 PolarHBondContact O-N 3.42Å; V244-A246 VanDerWaalsContact C-N 3.31Å; V244-A246 PolarHBondContact O-N 3Å; A246-Q249 WeakPolarHBondContact O-CB 3.46Å; A246-L250 WeakPolarHBondContact O-CB 3.17Å; A246-L250 PolarHBondContact O-N 3.39Å
247	L	57.3	Low	59.5	Low	70 Å²	70	80.2 Å²	80.2	37%	0.366	45%	0.447	S	S	.	.	H	α-helix	trans	-73.1	-40.5	177.4	-75.3	174.7	0	0	0	112.1	V231 V243 V244 D245 Q249 L250 D251	V231-L247 HydrophobicContact CG2-CD1 4.48Å; V243-L247 HydrophobicContact CG1-CD1 4.5Å; V243-L247 HydrophobicContact CG1-CG 4.46Å; V243-L247 WeakPolarHBondContact O-CG 3.25Å; V243-L247 PolarHBondContact O-N 3.03Å; V244-L247 PolarHBondContact O-N 3.48Å; D245-L247 PolarHBondContact O-N 3.38Å; L247-Q249 VanDerWaalsContact C-N 3.3Å; L247-L250 PolarHBondContact O-N 3.25Å; L247-L250 VanDerWaalsContact O-N 3.12Å; L247-D251 PolarHBondContact O-N 2.81Å
248	L	59.6	Low	61	Low	103 Å²	103	79.5 Å²	79.5	54%	0.539	44%	0.441	S	S	.	.	H	α-helix	trans	-61.2	-44.5	172.4	-178.3	65.8	0	0	0	109.9	V244 D245 L250 D251 I252	V244-L248 WeakPolarHBondContact O-CB 3.23Å; V244-L248 PolarHBondContact O-N 3.33Å; D245-L248 PolarHBondContact O-N 3.39Å; L248-L250 VanDerWaalsContact C-N 3.27Å; L248-L250 PolarHBondContact O-N 3.3Å; L248-D251 PolarHBondContact O-N 3.01Å; L248-I252 HydrophobicContact CG-CD1 4.09Å; L248-I252 VanDerWaalsContact O-CG1 3.26Å; L248-I252 WeakPolarHBondContact O-CG1 3.25Å; L248-I252 PolarHBondContact O-N 3.45Å
249	Q	60	Low	62.8	Low	68 Å²	68	74 Å²	74	32%	0.318	42%	0.417	S	S	.	.	H	α-helix	trans	-56.7	-41.9	171.5	-73.1	174.9	-8.6	0	0	110.9	D245 A246 L247 D251 I252 I253 L290	D245-Q249 VanDerWaalsContact O-CB 3.29Å; D245-Q249 WeakPolarHBondContact O-CB 3.38Å; D245-Q249 WeakPolarHBondContact O-CG 3.21Å; D245-Q249 PolarHBondContact O-N 3.21Å; A246-Q249 WeakPolarHBondContact O-CB 3.46Å; L247-Q249 VanDerWaalsContact C-N 3.3Å; Q249-D251 PolarHBondContact O-N 3.46Å; Q249-I252 PolarHBondContact O-N 3.25Å; Q249-I253 VanDerWaalsContact O-CB 3.32Å; Q249-I253 WeakPolarHBondContact O-CB 3.28Å; Q249-I253 WeakPolarHBondContact O-CD1 3.4Å; Q249-I253 WeakPolarHBondContact O-CG1 3.44Å; Q249-I253 PolarHBondContact O-N 3.01Å; Q249-L290 HydrophobicContact CB-CD2 3.97Å; Q249-L290 HydrophobicContact CG-CD2 3.75Å
250	L	64.6	Low	64.5	Low	112 Å²	112	74.3 Å²	74.3	59%	0.586	41%	0.409	S	S	*	.	H	α-helix	trans	-66.8	-35.6	-179.1	-154.6	137.3	0	0	0	113.6	A246 L247 L248 I253 S254	A246-L250 WeakPolarHBondContact O-CB 3.17Å; A246-L250 PolarHBondContact O-N 3.39Å; L247-L250 PolarHBondContact O-N 3.25Å; L247-L250 VanDerWaalsContact O-N 3.12Å; L248-L250 VanDerWaalsContact C-N 3.27Å; L248-L250 PolarHBondContact O-N 3.3Å; L250-I253 WeakPolarHBondContact O-CB 3.49Å; L250-I253 PolarHBondContact O-N 3.31Å; L250-S254 PolarHBondContact O-N 3.09Å
251	D	67.8	Low	66.4	Low	109 Å²	109	72.9 Å²	72.9	58%	0.583	41%	0.407	S	S	*	.	H	α-helix	trans	-69.4	-43	173.4	-159.4	27.7	0	0	0	111	L247 L248 Q249 I253 S254 T255	L247-D251 PolarHBondContact O-N 2.81Å; L248-D251 PolarHBondContact O-N 3.01Å; Q249-D251 PolarHBondContact O-N 3.46Å; D251-I253 VanDerWaalsContact C-N 3.3Å; D251-I253 PolarHBondContact O-N 2.88Å; D251-S254 WeakPolarHBondContact O-CB 3.21Å; D251-S254 PolarHBondContact O-N 3.36Å; D251-S254 VanDerWaalsContact O-N 3.15Å; D251-T255 PolarHBondContact O-N 2.88Å
252	I	66.6	Low	68	Low	23 Å²	23	68.6 Å²	68.6	12%	0.118	39%	0.388	C	S	.	.	H	α-helix	trans	-59.2	-44.2	172.9	-63.7	167.9	0	0	0	110.2	L248 Q249 S254 T255 I256 V285 D289 L290	L248-I252 HydrophobicContact CG-CD1 4.09Å; L248-I252 VanDerWaalsContact O-CG1 3.26Å; L248-I252 WeakPolarHBondContact O-CG1 3.25Å; L248-I252 PolarHBondContact O-N 3.45Å; Q249-I252 PolarHBondContact O-N 3.25Å; I252-S254 VanDerWaalsContact C-N 3.32Å; I252-S254 PolarHBondContact O-N 2.97Å; I252-T255 PolarHBondContact O-N 3.13Å; I252-T255 VanDerWaalsContact O-N 3.13Å; I252-T255 PolarHBondContact O-OG1 2.97Å; I252-I256 HydrophobicContact CG2-CD1 3.81Å; I252-I256 HydrophobicContact CG2-CG1 4.43Å; I252-I256 VanDerWaalsContact O-CG1 3.31Å; I252-I256 WeakPolarHBondContact O-CG1 3.46Å; I252-I256 PolarHBondContact O-N 3.49Å; I252-V285 HydrophobicContact CD1-CG1 4.43Å; I252-V285 HydrophobicContact CG2-CG1 3.33Å; I252-D289 HydrophobicContact CD1-CB 4.16Å; I252-L290 HydrophobicContact CG2-CD1 3.67Å; I252-L290 HydrophobicContact CG2-CD2 4.34Å; I252-L290 HydrophobicContact CG2-CG 4.13Å
253	I	69.2	Low	69.6	Low	47 Å²	47	65.5 Å²	65.5	24%	0.241	37%	0.366	C	S	.	.	H	α-helix	trans	-57.9	-44.9	175.5	-72.2	170.1	0	0	0	111.1	Q249 L250 D251 T255 I256 V257 F296	Q249-I253 VanDerWaalsContact O-CB 3.32Å; Q249-I253 WeakPolarHBondContact O-CB 3.28Å; Q249-I253 WeakPolarHBondContact O-CD1 3.4Å; Q249-I253 WeakPolarHBondContact O-CG1 3.44Å; Q249-I253 PolarHBondContact O-N 3.01Å; L250-I253 WeakPolarHBondContact O-CB 3.49Å; L250-I253 PolarHBondContact O-N 3.31Å; D251-I253 VanDerWaalsContact C-N 3.3Å; D251-I253 PolarHBondContact O-N 2.88Å; I253-T255 VanDerWaalsContact C-N 3.33Å; I253-T255 PolarHBondContact O-N 3.35Å; I253-I256 PolarHBondContact O-N 3.45Å; I253-V257 HydrophobicContact CG2-CG2 4.48Å; I253-V257 WeakPolarHBondContact O-CG2 3.48Å; I253-V257 PolarHBondContact O-N 2.91Å; I253-F296 HydrophobicContact CB-CZ 4.07Å; I253-F296 HydrophobicContact CD1-CE2 4Å; I253-F296 HydrophobicContact CD1-CZ 4.22Å; I253-F296 HydrophobicContact CG1-CE2 3.54Å; I253-F296 HydrophobicContact CG1-CZ 3.57Å; I253-F296 HydrophobicContact CG2-CZ 3.75Å
254	S	71	Confident	71.2	Confident	50 Å²	50	68 Å²	68	35%	0.35	38%	0.376	S	S	.	.	H	α-helix	trans	-59.3	-43.6	175.7	178.3	0	0	0	0	111.7	L250 D251 I252 I256 V257 Q258	L250-S254 PolarHBondContact O-N 3.09Å; D251-S254 WeakPolarHBondContact O-CB 3.21Å; D251-S254 PolarHBondContact O-N 3.36Å; D251-S254 VanDerWaalsContact O-N 3.15Å; I252-S254 VanDerWaalsContact C-N 3.32Å; I252-S254 PolarHBondContact O-N 2.97Å; S254-I256 VanDerWaalsContact C-N 3.32Å; S254-I256 PolarHBondContact O-N 2.85Å; S254-V257 PolarHBondContact O-N 3.33Å; S254-Q258 WeakPolarHBondContact O-CG 3.45Å; S254-Q258 PolarHBondContact O-N 3.2Å
255	T	72.8	Confident	73	Confident	77 Å²	77	68.3 Å²	68.3	47%	0.472	38%	0.381	S	S	.	.	H	α-helix	trans	-63.1	-38.7	175.4	64.5	0	0	0	0	112.2	D251 I252 I253 Q258 I259	D251-T255 PolarHBondContact O-N 2.88Å; I252-T255 PolarHBondContact O-N 3.13Å; I252-T255 VanDerWaalsContact O-N 3.13Å; I252-T255 PolarHBondContact O-OG1 2.97Å; I253-T255 VanDerWaalsContact C-N 3.33Å; I253-T255 PolarHBondContact O-N 3.35Å; T255-Q258 PolarHBondContact O-N 3.27Å; T255-I259 PolarHBondContact O-N 3.32Å
256	I	73.1	Confident	74.6	Confident	4 Å²	4	66 Å²	66	2%	0.021	37%	0.368	C	S	.	.	H	α-helix	trans	-66.5	-42.6	179.3	-69.2	166.7	0	0	0	111.7	I252 I253 S254 Q258 I259 T282 L286 L290 F296 M299	I252-I256 HydrophobicContact CG2-CD1 3.81Å; I252-I256 HydrophobicContact CG2-CG1 4.43Å; I252-I256 VanDerWaalsContact O-CG1 3.31Å; I252-I256 WeakPolarHBondContact O-CG1 3.46Å; I252-I256 PolarHBondContact O-N 3.49Å; I253-I256 PolarHBondContact O-N 3.45Å; S254-I256 VanDerWaalsContact C-N 3.32Å; S254-I256 PolarHBondContact O-N 2.85Å; I256-Q258 PolarHBondContact O-N 2.99Å; I256-I259 HydrophobicContact CB-CD1 4.33Å; I256-I259 HydrophobicContact CG1-CD1 4.27Å; I256-I259 HydrophobicContact CG2-CD1 4.39Å; I256-I259 WeakPolarHBondContact O-CB 3.38Å; I256-I259 PolarHBondContact O-N 3.3Å; I256-I259 VanDerWaalsContact O-N 3.09Å; I256-T282 HydrophobicContact CG1-CG2 4.07Å; I256-L286 HydrophobicContact CD1-CD2 3.89Å; I256-L286 HydrophobicContact CD1-CG 4.32Å; I256-L290 HydrophobicContact CD1-CD1 3.15Å; I256-F296 HydrophobicContact CG2-CD1 4.29Å; I256-F296 HydrophobicContact CG2-CE1 4.1Å; I256-M299 HydrophobicContact CG2-CE 3.87Å; I256-M299 HydrophobicContact CG2-CG 4.44Å
257	V	76.5	Confident	75.9	Confident	107 Å²	107	64.6 Å²	64.6	65%	0.648	35%	0.354	S	S	*	.	H	α-helix	trans	-62.3	-30.1	176.7	172.9	0	0	0	0	111.4	I253 S254	I253-V257 HydrophobicContact CG2-CG2 4.48Å; I253-V257 WeakPolarHBondContact O-CG2 3.48Å; I253-V257 PolarHBondContact O-N 2.91Å; S254-V257 PolarHBondContact O-N 3.33Å
258	Q	81.1	Confident	77.3	Confident	105 Å²	105	67 Å²	67	49%	0.491	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-0.2	178	-66.1	178.5	15.3	0	0	114.1	S254 T255 I256 H260 S261 T262	S254-Q258 WeakPolarHBondContact O-CG 3.45Å; S254-Q258 PolarHBondContact O-N 3.2Å; T255-Q258 PolarHBondContact O-N 3.27Å; I256-Q258 PolarHBondContact O-N 2.99Å; Q258-H260 PolarHBondContact O-N 3.11Å; Q258-S261 PolarHBondContact O-N 3.25Å; Q258-S261 PolarHBondContact O-OG 2.82Å; Q258-T262 WeakPolarHBondContact O-CB 3.3Å; Q258-T262 PolarHBondContact O-N 2.92Å; Q258-T262 PolarHBondContact O-OG1 3.31Å
259	I	83.1	Confident	78.5	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-61.1	-47.3	-178.8	-79	169.9	0	0	0	111.5	T255 I256 S261 T262 V263 T282 L303 M306	T255-I259 PolarHBondContact O-N 3.32Å; I256-I259 HydrophobicContact CB-CD1 4.33Å; I256-I259 HydrophobicContact CG1-CD1 4.27Å; I256-I259 HydrophobicContact CG2-CD1 4.39Å; I256-I259 WeakPolarHBondContact O-CB 3.38Å; I256-I259 PolarHBondContact O-N 3.3Å; I256-I259 VanDerWaalsContact O-N 3.09Å; I259-S261 VanDerWaalsContact C-N 3.3Å; I259-S261 PolarHBondContact O-N 2.82Å; I259-T262 PolarHBondContact O-N 2.86Å; I259-T262 VanDerWaalsContact O-N 3.1Å; I259-V263 HydrophobicContact CG2-CG2 3.84Å; I259-V263 WeakPolarHBondContact O-CB 3.36Å; I259-V263 WeakPolarHBondContact O-CG2 3.43Å; I259-V263 PolarHBondContact O-N 3.31Å; I259-T282 HydrophobicContact CD1-CG2 3.12Å; I259-T282 WeakPolarHBondContact CD1-OG1 3.47Å; I259-L303 HydrophobicContact CD1-CD2 4.43Å; I259-L303 HydrophobicContact CG2-CD2 4.11Å; I259-M306 HydrophobicContact CG2-CE 4.25Å; I259-M306 HydrophobicContact CG2-SD 4.06Å
260	H	84	Confident	79.5	Confident	130 Å²	130	63.6 Å²	63.6	60%	0.602	36%	0.36	S	S	*	.	H	α-helix	trans	-58.7	-43.5	-176.6	-175.3	-83.1	0	0	0	111.5	Q258 Q264	Q258-H260 PolarHBondContact O-N 3.11Å; H260-Q264 VanDerWaalsContact O-CB 3.31Å; H260-Q264 WeakPolarHBondContact O-CB 3.31Å; H260-Q264 PolarHBondContact O-N 3.35Å
261	S	85.6	Confident	80.5	Confident	72 Å²	72	59.3 Å²	59.3	50%	0.503	34%	0.337	S	S	.	.	H	α-helix	trans	-70.3	-35.4	177.2	57.4	0	0	0	0	112.8	Q258 I259 S265	Q258-S261 PolarHBondContact O-N 3.25Å; Q258-S261 PolarHBondContact O-OG 2.82Å; I259-S261 VanDerWaalsContact C-N 3.3Å; I259-S261 PolarHBondContact O-N 2.82Å; S261-S265 WeakPolarHBondContact O-CB 3.44Å; S261-S265 PolarHBondContact O-N 2.89Å
262	T	86.9	Confident	81.3	Confident	55 Å²	55	54.7 Å²	54.7	34%	0.337	31%	0.312	S	S	.	.	H	α-helix	trans	-72.4	-45.8	179.9	-52.4	0	0	0	0	111.4	Q258 I259 Q264 S265 L266 L278	Q258-T262 WeakPolarHBondContact O-CB 3.3Å; Q258-T262 PolarHBondContact O-N 2.92Å; Q258-T262 PolarHBondContact O-OG1 3.31Å; I259-T262 PolarHBondContact O-N 2.86Å; I259-T262 VanDerWaalsContact O-N 3.1Å; T262-Q264 VanDerWaalsContact C-N 3.35Å; T262-Q264 PolarHBondContact O-N 3.47Å; T262-S265 WeakPolarHBondContact O-CB 3.49Å; T262-S265 PolarHBondContact O-N 3.47Å; T262-L266 HydrophobicContact CG2-CD1 4.27Å; T262-L266 WeakPolarHBondContact O-CG 3.23Å; T262-L266 PolarHBondContact O-N 2.87Å; T262-L278 HydrophobicContact CG2-CD2 3.61Å
263	V	87.1	Confident	82	Confident	6 Å²	6	55.9 Å²	55.9	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-59.2	-47.4	174.1	171.3	0	0	0	0	109.7	I259 S265 L266 L267 A275 L278 V279 I310	I259-V263 HydrophobicContact CG2-CG2 3.84Å; I259-V263 WeakPolarHBondContact O-CB 3.36Å; I259-V263 WeakPolarHBondContact O-CG2 3.43Å; I259-V263 PolarHBondContact O-N 3.31Å; V263-S265 VanDerWaalsContact C-N 3.29Å; V263-S265 PolarHBondContact O-N 3.06Å; V263-L266 PolarHBondContact O-N 2.74Å; V263-L266 VanDerWaalsContact O-N 3.1Å; V263-L267 HydrophobicContact CG1-CD1 3.96Å; V263-L267 HydrophobicContact CG1-CG 4.23Å; V263-L267 VanDerWaalsContact O-CG 3.28Å; V263-L267 WeakPolarHBondContact O-CG 3.23Å; V263-L267 PolarHBondContact O-N 3.09Å; V263-A275 HydrophobicContact CG1-CB 4.48Å; V263-L278 HydrophobicContact CG2-CD2 4.03Å; V263-V279 HydrophobicContact CG2-CG2 4.11Å; V263-I310 HydrophobicContact CG1-CD1 4.01Å
264	Q	86.8	Confident	82.7	Confident	87 Å²	87	54.9 Å²	54.9	41%	0.407	32%	0.316	S	S	.	.	H	α-helix	trans	-59.9	-39.6	176.8	-167.7	65.6	32.7	0	0	112.3	H260 T262 L267 N268	H260-Q264 VanDerWaalsContact O-CB 3.31Å; H260-Q264 WeakPolarHBondContact O-CB 3.31Å; H260-Q264 PolarHBondContact O-N 3.35Å; T262-Q264 VanDerWaalsContact C-N 3.35Å; T262-Q264 PolarHBondContact O-N 3.47Å; Q264-L267 PolarHBondContact O-N 3.42Å; Q264-N268 PolarHBondContact O-N 3.05Å; Q264-N268 PolarHBondContact O-ND2 2.81Å; Q264-N268 PolarHBondContact O-OD1 3.29Å
265	S	87.3	Confident	83.5	Confident	73 Å²	73	52.5 Å²	52.5	51%	0.51	30%	0.299	S	S	.	.	H	α-helix	trans	-64.9	-38.9	175.4	-172.9	0	0	0	0	112.5	S261 T262 V263 N268 S269	S261-S265 WeakPolarHBondContact O-CB 3.44Å; S261-S265 PolarHBondContact O-N 2.89Å; T262-S265 WeakPolarHBondContact O-CB 3.49Å; T262-S265 PolarHBondContact O-N 3.47Å; V263-S265 VanDerWaalsContact C-N 3.29Å; V263-S265 PolarHBondContact O-N 3.06Å; S265-N268 PolarHBondContact O-N 3.4Å; S265-S269 PolarHBondContact O-N 3.26Å; S265-S269 PolarHBondContact O-OG 3.26Å
266	L	87.5	Confident	84.1	Confident	38 Å²	38	49 Å²	49	20%	0.199	28%	0.278	C	S	.	.	H	α-helix	trans	-70.5	-37.5	178.4	-70.6	171.2	0	0	0	111.9	T262 V263 N268 S269 S270 D271 A274 A275 L278	T262-L266 HydrophobicContact CG2-CD1 4.27Å; T262-L266 WeakPolarHBondContact O-CG 3.23Å; T262-L266 PolarHBondContact O-N 2.87Å; V263-L266 PolarHBondContact O-N 2.74Å; V263-L266 VanDerWaalsContact O-N 3.1Å; L266-N268 VanDerWaalsContact C-N 3.34Å; L266-S269 WeakPolarHBondContact CA-OG 3.1Å; L266-S269 CarbonylContact O-C 3.52Å; L266-S269 PolarHBondContact O-N 2.81Å; L266-S269 PolarHBondContact O-OG 3.21Å; L266-S270 PolarHBondContact O-N 2.9Å; L266-D271 HydrophobicContact CD2-CB 4.43Å; L266-D271 PolarHBondContact O-N 3.17Å; L266-A274 HydrophobicContact CD1-CB 4.22Å; L266-A274 HydrophobicContact CD2-CB 4.14Å; L266-A275 HydrophobicContact CB-CB 4Å; L266-A275 HydrophobicContact CD1-CB 4.25Å; L266-L278 HydrophobicContact CD1-CD2 4.26Å
267	L	87	Confident	84.6	Confident	16 Å²	16	52.4 Å²	52.4	8%	0.084	29%	0.294	C	S	.	.	H	α-helix	trans	-64.5	-38.9	173.5	-67.2	177.9	0	0	0	111.8	V263 Q264 S269 S270 Y272 A275 I310 I313	V263-L267 HydrophobicContact CG1-CD1 3.96Å; V263-L267 HydrophobicContact CG1-CG 4.23Å; V263-L267 VanDerWaalsContact O-CG 3.28Å; V263-L267 WeakPolarHBondContact O-CG 3.23Å; V263-L267 PolarHBondContact O-N 3.09Å; Q264-L267 PolarHBondContact O-N 3.42Å; L267-S269 PolarHBondContact O-N 3.36Å; L267-S270 PolarHBondContact O-N 3.1Å; L267-Y272 HydrophobicContact CD2-CD1 3.49Å; L267-Y272 VanDerWaalsContact CD2-CD1 3.49Å; L267-Y272 HydrophobicContact CD2-CE1 3.78Å; L267-A275 HydrophobicContact CD2-CB 4.4Å; L267-I310 HydrophobicContact CD1-CG1 4.33Å; L267-I310 HydrophobicContact CD2-CG1 4.11Å; L267-I310 HydrophobicContact CD2-CG2 4.42Å; L267-I313 HydrophobicContact CD1-CD1 4.02Å
268	N	85.5	Confident	85.1	Confident	122 Å²	122	49.6 Å²	49.6	65%	0.652	28%	0.275	S	S	*	.	H	α-helix	trans	-67.8	-24.2	174.6	-68.6	-17.4	0	0	0	113	Q264 S265 L266	Q264-N268 PolarHBondContact O-N 3.05Å; Q264-N268 PolarHBondContact O-ND2 2.81Å; Q264-N268 PolarHBondContact O-OD1 3.29Å; S265-N268 PolarHBondContact O-N 3.4Å; L266-N268 VanDerWaalsContact C-N 3.34Å
269	S	84.6	Confident	85.3	Confident	70 Å²	70	44.6 Å²	44.6	49%	0.49	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	11.2	174.1	64.2	0	0	0	0	113.7	S265 L266 L267 D271	S265-S269 PolarHBondContact O-N 3.26Å; S265-S269 PolarHBondContact O-OG 3.26Å; L266-S269 WeakPolarHBondContact CA-OG 3.1Å; L266-S269 CarbonylContact O-C 3.52Å; L266-S269 PolarHBondContact O-N 2.81Å; L266-S269 PolarHBondContact O-OG 3.21Å; L267-S269 PolarHBondContact O-N 3.36Å; S269-D271 PolarHBondContact O-N 3.14Å; S269-D271 VanDerWaalsContact O-N 3.11Å
270	S	81.7	Confident	85.4	Confident	29 Å²	29	46.2 Å²	46.2	20%	0.203	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	22.9	-175.6	-61.2	0	0	0	0	114.8	L266 L267 Y272 E342 S345	L266-S270 PolarHBondContact O-N 2.9Å; L267-S270 PolarHBondContact O-N 3.1Å; S270-Y272 WeakPolarHBondContact O-CD2 2.91Å; S270-Y272 PolarHBondContact O-N 2.95Å; S270-E342 PolarHBondContact OG-OE1 3.23Å; S270-S345 WeakPolarHBondContact O-CB 3.42Å; S270-S345 PolarHBondContact O-OG 2.89Å
271	D	85.1	Confident	85.5	Confident	22 Å²	22	43.8 Å²	43.8	12%	0.118	26%	0.257	C	S	.	.			trans	-97.8	68.7	176.8	-158	-27.7	0	0	0	110.8	L266 S269 M273 A274 A275 Y341	L266-D271 HydrophobicContact CD2-CB 4.43Å; L266-D271 PolarHBondContact O-N 3.17Å; S269-D271 PolarHBondContact O-N 3.14Å; S269-D271 VanDerWaalsContact O-N 3.11Å; D271-M273 VanDerWaalsContact C-N 3.28Å; D271-M273 PolarHBondContact O-N 3.33Å; D271-A274 HydrophobicContact CB-CB 4.32Å; D271-A274 VanDerWaalsContact OD1-CB 3.23Å; D271-A274 WeakPolarHBondContact OD1-CB 3.5Å; D271-A274 PolarHBondContact OD1-N 2.84Å; D271-A275 PolarHBondContact O-N 3.01Å; D271-A275 VanDerWaalsContact O-N 3.17Å; D271-Y341 HydrophobicContact CB-CE1 4.46Å; D271-Y341 PolarHBondContact OD2-OH 3.18Å
272	Y	84.3	Confident	85.4	Confident	12 Å²	12	40.8 Å²	40.8	5%	0.047	24%	0.236	C	C	.	.	H	α-helix	trans	-62.7	-33.8	177.1	-51.9	-70.3	0	0	0	112.5	L267 S270 A275 L276 I313 L314 S345 I346	L267-Y272 HydrophobicContact CD2-CD1 3.49Å; L267-Y272 VanDerWaalsContact CD2-CD1 3.49Å; L267-Y272 HydrophobicContact CD2-CE1 3.78Å; S270-Y272 WeakPolarHBondContact O-CD2 2.91Å; S270-Y272 PolarHBondContact O-N 2.95Å; Y272-A275 PolarHBondContact O-N 3Å; Y272-L276 WeakPolarHBondContact O-CG 3.37Å; Y272-L276 PolarHBondContact O-N 3.32Å; Y272-I313 HydrophobicContact CD1-CG2 4.45Å; Y272-I313 HydrophobicContact CE1-CG2 3.62Å; Y272-L314 VanDerWaalsContact CB-CD2 3.49Å; Y272-L314 HydrophobicContact CD1-CD2 4.04Å; Y272-L314 HydrophobicContact CD1-CG 4.41Å; Y272-L314 HydrophobicContact CD2-CD2 3.72Å; Y272-L314 HydrophobicContact CE2-CD2 4.48Å; Y272-L314 HydrophobicContact CG-CD2 3.46Å; Y272-L314 VanDerWaalsContact CG-CD2 3.46Å; Y272-L314 HydrophobicContact CG-CG 4.25Å; Y272-S345 WeakPolarHBondContact CD2-OG 3.25Å; Y272-S345 PolarHBondContact N-OG 3.28Å; Y272-I346 HydrophobicContact CD2-CB 4.47Å; Y272-I346 HydrophobicContact CD2-CG1 3.61Å; Y272-I346 HydrophobicContact CE2-CD1 4.18Å; Y272-I346 HydrophobicContact CE2-CG1 3.43Å; Y272-I346 VanDerWaalsContact CE2-CG1 3.43Å
273	M	82.9	Confident	85.3	Confident	47 Å²	47	39.6 Å²	39.6	23%	0.232	23%	0.226	C	C	.	.	H	α-helix	trans	-63.6	-51.2	178.4	-176.5	-160.2	72.6	0	0	110.8	D271 A275 L276 E277 S345	D271-M273 VanDerWaalsContact C-N 3.28Å; D271-M273 PolarHBondContact O-N 3.33Å; M273-A275 VanDerWaalsContact C-N 3.26Å; M273-A275 PolarHBondContact O-N 3.16Å; M273-L276 PolarHBondContact O-N 2.87Å; M273-E277 WeakPolarHBondContact O-CG 3.28Å; M273-E277 PolarHBondContact O-N 2.87Å; M273-S345 PolarHBondContact N-OG 3.38Å
274	A	83	Confident	85.1	Confident	26 Å²	26	41.6 Å²	41.6	22%	0.215	24%	0.243	C	C	.	.	H	α-helix	trans	-62.6	-35	177	0	0	0	0	0	111.9	L266 D271 E277 L278	L266-A274 HydrophobicContact CD1-CB 4.22Å; L266-A274 HydrophobicContact CD2-CB 4.14Å; D271-A274 HydrophobicContact CB-CB 4.32Å; D271-A274 VanDerWaalsContact OD1-CB 3.23Å; D271-A274 WeakPolarHBondContact OD1-CB 3.5Å; D271-A274 PolarHBondContact OD1-N 2.84Å; A274-E277 PolarHBondContact O-N 2.93Å; A274-L278 WeakPolarHBondContact O-CB 3.18Å; A274-L278 PolarHBondContact O-N 3.16Å
275	A	87.8	Confident	84.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.3	-46.6	176	0	0	0	0	0	112.1	V263 L266 L267 D271 Y272 M273 E277 L278 V279 I310	V263-A275 HydrophobicContact CG1-CB 4.48Å; L266-A275 HydrophobicContact CB-CB 4Å; L266-A275 HydrophobicContact CD1-CB 4.25Å; L267-A275 HydrophobicContact CD2-CB 4.4Å; D271-A275 PolarHBondContact O-N 3.01Å; D271-A275 VanDerWaalsContact O-N 3.17Å; Y272-A275 PolarHBondContact O-N 3Å; M273-A275 VanDerWaalsContact C-N 3.26Å; M273-A275 PolarHBondContact O-N 3.16Å; A275-E277 VanDerWaalsContact C-N 3.35Å; A275-L278 PolarHBondContact O-N 2.76Å; A275-V279 WeakPolarHBondContact O-CG2 3.33Å; A275-V279 PolarHBondContact O-N 2.93Å; A275-I310 HydrophobicContact CB-CD1 4.21Å
276	L	84.5	Confident	84.1	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-65.9	-37.4	176.2	-73.4	178.3	0	0	0	112.3	Y272 M273 V279 S280 E307 I310 L314 Q353	Y272-L276 WeakPolarHBondContact O-CG 3.37Å; Y272-L276 PolarHBondContact O-N 3.32Å; M273-L276 PolarHBondContact O-N 2.87Å; L276-V279 PolarHBondContact O-N 3.36Å; L276-S280 WeakPolarHBondContact O-CB 3.17Å; L276-S280 PolarHBondContact O-N 3.46Å; L276-S280 PolarHBondContact O-OG 3.48Å; L276-E307 HydrophobicContact CD2-CG 4.41Å; L276-I310 HydrophobicContact CD1-CG2 4.37Å; L276-I310 HydrophobicContact CD2-CB 4.01Å; L276-I310 HydrophobicContact CD2-CD1 4Å; L276-I310 HydrophobicContact CD2-CG2 3.63Å; L276-I310 HydrophobicContact CG-CG2 3.83Å; L276-L314 HydrophobicContact CD1-CD1 3.93Å; L276-Q353 HydrophobicContact CD1-CG 3.9Å; L276-Q353 HydrophobicContact CD2-CG 4.33Å
277	E	84.7	Confident	83.6	Confident	76 Å²	76	39.5 Å²	39.5	36%	0.355	23%	0.231	S	C	.	.	H	α-helix	trans	-59.8	-50.3	173.1	-80.7	-171.6	167.4	0	0	111.2	M273 A274 A275 V279 S280 T281 R352	M273-E277 WeakPolarHBondContact O-CG 3.28Å; M273-E277 PolarHBondContact O-N 2.87Å; A274-E277 PolarHBondContact O-N 2.93Å; A275-E277 VanDerWaalsContact C-N 3.35Å; E277-V279 VanDerWaalsContact C-N 3.33Å; E277-V279 PolarHBondContact O-N 3.39Å; E277-S280 WeakPolarHBondContact CA-OG 3.24Å; E277-S280 PolarHBondContact O-N 2.86Å; E277-S280 VanDerWaalsContact O-N 3.1Å; E277-S280 PolarHBondContact O-OG 3.2Å; E277-T281 WeakPolarHBondContact O-CG2 3.26Å; E277-T281 PolarHBondContact O-N 3.41Å; E277-T281 PolarHBondContact O-OG1 3.06Å; E277-T281 VanDerWaalsContact O-OG1 3.09Å; E277-R352 IonicContact OE1-NH1 3.42Å; E277-R352 PolarHBondContact OE1-NH1 2.81Å
278	L	86.3	Confident	82.9	Confident	49 Å²	49	45.6 Å²	45.6	26%	0.257	26%	0.259	S	S	.	.	H	α-helix	trans	-57.1	-44.7	177.6	-177.7	64.2	0	0	0	112.3	T262 V263 L266 A274 A275 T281 T282	T262-L278 HydrophobicContact CG2-CD2 3.61Å; V263-L278 HydrophobicContact CG2-CD2 4.03Å; L266-L278 HydrophobicContact CD1-CD2 4.26Å; A274-L278 WeakPolarHBondContact O-CB 3.18Å; A274-L278 PolarHBondContact O-N 3.16Å; A275-L278 PolarHBondContact O-N 2.76Å; L278-T281 WeakPolarHBondContact CA-OG1 3.31Å; L278-T281 PolarHBondContact O-OG1 2.82Å; L278-T282 WeakPolarHBondContact O-CB 3.42Å; L278-T282 PolarHBondContact O-N 2.88Å; L278-T282 PolarHBondContact O-OG1 3.35Å
279	V	86.2	Confident	82.1	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-46.3	175.8	171.4	0	0	0	0	110.4	V263 A275 L276 E277 T282 K283 L303 E307 I310	V263-V279 HydrophobicContact CG2-CG2 4.11Å; A275-V279 WeakPolarHBondContact O-CG2 3.33Å; A275-V279 PolarHBondContact O-N 2.93Å; L276-V279 PolarHBondContact O-N 3.36Å; E277-V279 VanDerWaalsContact C-N 3.33Å; E277-V279 PolarHBondContact O-N 3.39Å; V279-T282 WeakPolarHBondContact O-CB 3.22Å; V279-T282 PolarHBondContact O-N 3.44Å; V279-K283 WeakPolarHBondContact O-CG 3.48Å; V279-K283 PolarHBondContact O-N 3.36Å; V279-L303 HydrophobicContact CG1-CB 4.27Å; V279-L303 HydrophobicContact CG1-CD2 4.17Å; V279-L303 HydrophobicContact CG2-CD2 4.49Å; V279-E307 HydrophobicContact CG1-CB 4.4Å; V279-I310 HydrophobicContact CG2-CD1 4.18Å
280	S	84.7	Confident	81.2	Confident	38 Å²	38	40.7 Å²	40.7	27%	0.266	23%	0.227	S	C	.	.	H	α-helix	trans	-65.5	-42.8	-179.6	70.7	0	0	0	0	113	L276 E277 T282 K283 A284 R352	L276-S280 WeakPolarHBondContact O-CB 3.17Å; L276-S280 PolarHBondContact O-N 3.46Å; L276-S280 PolarHBondContact O-OG 3.48Å; E277-S280 WeakPolarHBondContact CA-OG 3.24Å; E277-S280 PolarHBondContact O-N 2.86Å; E277-S280 VanDerWaalsContact O-N 3.1Å; E277-S280 PolarHBondContact O-OG 3.2Å; S280-T282 VanDerWaalsContact C-N 3.27Å; S280-T282 PolarHBondContact O-N 3.47Å; S280-K283 PolarHBondContact O-N 2.85Å; S280-A284 PolarHBondContact O-N 3.46Å; S280-A284 VanDerWaalsContact O-N 3.08Å; S280-R352 PolarHBondContact OG-NH2 3.35Å
281	T	85.1	Confident	80.5	Confident	78 Å²	78	47.9 Å²	47.9	48%	0.479	26%	0.255	S	S	.	.	H	α-helix	trans	-64.7	-35.8	175.9	52.7	0	0	0	0	110.9	E277 L278 A284 V285	E277-T281 WeakPolarHBondContact O-CG2 3.26Å; E277-T281 PolarHBondContact O-N 3.41Å; E277-T281 PolarHBondContact O-OG1 3.06Å; E277-T281 VanDerWaalsContact O-OG1 3.09Å; L278-T281 WeakPolarHBondContact CA-OG1 3.31Å; L278-T281 PolarHBondContact O-OG1 2.82Å; T281-A284 PolarHBondContact O-N 2.86Å; T281-V285 VanDerWaalsContact O-CG2 3.28Å; T281-V285 WeakPolarHBondContact O-CG2 3.39Å; T281-V285 PolarHBondContact O-N 3.24Å
282	T	84	Confident	79.5	Confident	10 Å²	10	50.2 Å²	50.2	6%	0.061	28%	0.284	C	S	.	.	H	α-helix	trans	-67.2	-43.5	175.7	-55.1	0	0	0	0	111.5	I256 I259 L278 V279 S280 A284 V285 L286 L303	I256-T282 HydrophobicContact CG1-CG2 4.07Å; I259-T282 HydrophobicContact CD1-CG2 3.12Å; I259-T282 WeakPolarHBondContact CD1-OG1 3.47Å; L278-T282 WeakPolarHBondContact O-CB 3.42Å; L278-T282 PolarHBondContact O-N 2.88Å; L278-T282 PolarHBondContact O-OG1 3.35Å; V279-T282 WeakPolarHBondContact O-CB 3.22Å; V279-T282 PolarHBondContact O-N 3.44Å; S280-T282 VanDerWaalsContact C-N 3.27Å; S280-T282 PolarHBondContact O-N 3.47Å; T282-A284 PolarHBondContact O-N 2.77Å; T282-V285 PolarHBondContact O-N 2.91Å; T282-L286 HydrophobicContact CG2-CD1 3.99Å; T282-L286 HydrophobicContact CG2-CG 4.26Å; T282-L286 WeakPolarHBondContact O-CB 3.29Å; T282-L286 WeakPolarHBondContact O-CG 3.16Å; T282-L286 PolarHBondContact O-N 2.97Å; T282-L303 HydrophobicContact CG2-CD1 3.65Å; T282-L303 HydrophobicContact CG2-CD2 4.24Å
283	K	84.2	Confident	78.7	Confident	30 Å²	30	51.8 Å²	51.8	13%	0.13	29%	0.293	C	S	.	.	H	α-helix	trans	-57.7	-40.3	175.4	-73.4	-176.9	-179.8	-171.8	0	111.3	V279 S280 N287 L303 E307	V279-K283 WeakPolarHBondContact O-CG 3.48Å; V279-K283 PolarHBondContact O-N 3.36Å; S280-K283 PolarHBondContact O-N 2.85Å; K283-N287 WeakPolarHBondContact O-CB 3.05Å; K283-N287 VanDerWaalsContact O-CG 3.3Å; K283-N287 PolarHBondContact O-N 3.39Å; K283-N287 PolarHBondContact O-ND2 3.29Å; K283-L303 HydrophobicContact CD-CB 4.49Å; K283-L303 WeakPolarHBondContact CE-O 3.25Å; K283-L303 HydrophobicContact CG-CB 4.09Å; K283-L303 HydrophobicContact CG-CD1 3.87Å; K283-L303 PolarHBondContact NZ-O 3.02Å; K283-E307 IonicContact NZ-OE2 2.82Å; K283-E307 PolarHBondContact NZ-OE2 3.2Å
284	A	82.9	Confident	77.7	Confident	47 Å²	47	55.4 Å²	55.4	39%	0.388	32%	0.318	S	S	.	.	H	α-helix	trans	-63.3	-51.4	175	0	0	0	0	0	111.8	S280 T281 T282 L286 N287 E288	S280-A284 PolarHBondContact O-N 3.46Å; S280-A284 VanDerWaalsContact O-N 3.08Å; T281-A284 PolarHBondContact O-N 2.86Å; T282-A284 PolarHBondContact O-N 2.77Å; A284-L286 VanDerWaalsContact C-N 3.32Å; A284-L286 PolarHBondContact O-N 2.95Å; A284-N287 PolarHBondContact O-N 3.08Å; A284-E288 PolarHBondContact O-N 3.26Å
285	V	79.5	Confident	76.8	Confident	42 Å²	42	58.6 Å²	58.6	26%	0.255	34%	0.337	S	S	.	.	H	α-helix	trans	-61.4	-37.1	179.7	172	0	0	0	0	112.5	I252 T281 T282 N287 D289 L290	I252-V285 HydrophobicContact CD1-CG1 4.43Å; I252-V285 HydrophobicContact CG2-CG1 3.33Å; T281-V285 VanDerWaalsContact O-CG2 3.28Å; T281-V285 WeakPolarHBondContact O-CG2 3.39Å; T281-V285 PolarHBondContact O-N 3.24Å; T282-V285 PolarHBondContact O-N 2.91Å; V285-N287 VanDerWaalsContact C-N 3.33Å; V285-N287 PolarHBondContact O-N 3.11Å; V285-D289 HydrophobicContact CG1-CB 4.27Å; V285-D289 WeakPolarHBondContact O-CB 3.42Å; V285-D289 PolarHBondContact O-N 3.4Å; V285-L290 PolarHBondContact O-N 2.95Å
286	L	75.3	Confident	75.8	Confident	16 Å²	16	59.8 Å²	59.8	8%	0.084	34%	0.342	C	S	.	.	H	α-helix	trans	-64.8	-36.4	174.7	-79.4	169.9	0	0	0	112.8	I256 T282 A284 L290 K291 F296 M299 L303	I256-L286 HydrophobicContact CD1-CD2 3.89Å; I256-L286 HydrophobicContact CD1-CG 4.32Å; T282-L286 HydrophobicContact CG2-CD1 3.99Å; T282-L286 HydrophobicContact CG2-CG 4.26Å; T282-L286 WeakPolarHBondContact O-CB 3.29Å; T282-L286 WeakPolarHBondContact O-CG 3.16Å; T282-L286 PolarHBondContact O-N 2.97Å; A284-L286 VanDerWaalsContact C-N 3.32Å; A284-L286 PolarHBondContact O-N 2.95Å; L286-L290 HydrophobicContact CD2-CB 4.38Å; L286-L290 HydrophobicContact CD2-CD1 4.03Å; L286-L290 CarbonylContact O-C 3.57Å; L286-K291 PolarHBondContact O-N 3.32Å; L286-F296 HydrophobicContact CD2-CB 3.94Å; L286-F296 HydrophobicContact CD2-CD2 4.36Å; L286-F296 HydrophobicContact CD2-CG 4.17Å; L286-M299 HydrophobicContact CD1-CB 4.16Å; L286-L303 HydrophobicContact CD1-CD1 3.32Å
287	N	75.3	Confident	75.2	Confident	96 Å²	96	69.2 Å²	69.2	51%	0.513	38%	0.378	S	S	.	.	H	α-helix	trans	-81.3	-31.3	-177.7	-75.4	-19.5	0	0	0	113.1	K283 A284 V285	K283-N287 WeakPolarHBondContact O-CB 3.05Å; K283-N287 VanDerWaalsContact O-CG 3.3Å; K283-N287 PolarHBondContact O-N 3.39Å; K283-N287 PolarHBondContact O-ND2 3.29Å; A284-N287 PolarHBondContact O-N 3.08Å; V285-N287 VanDerWaalsContact C-N 3.33Å; V285-N287 PolarHBondContact O-N 3.11Å
288	E	73.9	Confident	74.8	Confident	145 Å²	145	71.8 Å²	71.8	68%	0.678	39%	0.39	S	S	*	.	H	α-helix	trans	-91.2	-65	179.8	-66.1	-174.8	169.1	0	0	111.7	A284	A284-E288 PolarHBondContact O-N 3.26Å
289	D	67.7	Low	74.5	Confident	83 Å²	83	70.7 Å²	70.7	44%	0.444	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-33.4	-166.5	-64.5	-29.2	0	0	0	113.6	I252 V285	I252-D289 HydrophobicContact CD1-CB 4.16Å; V285-D289 HydrophobicContact CG1-CB 4.27Å; V285-D289 WeakPolarHBondContact O-CB 3.42Å; V285-D289 PolarHBondContact O-N 3.4Å
290	L	66.4	Low	74.2	Confident	6 Å²	6	74.6 Å²	74.6	3%	0.031	40%	0.402	C	S	.	.	S	Bend	trans	-108.8	20.3	-173.1	-57.4	-179.4	0	0	0	113.9	Q249 I252 I256 V285 L286 G292 I293 F296	Q249-L290 HydrophobicContact CB-CD2 3.97Å; Q249-L290 HydrophobicContact CG-CD2 3.75Å; I252-L290 HydrophobicContact CG2-CD1 3.67Å; I252-L290 HydrophobicContact CG2-CD2 4.34Å; I252-L290 HydrophobicContact CG2-CG 4.13Å; I256-L290 HydrophobicContact CD1-CD1 3.15Å; V285-L290 PolarHBondContact O-N 2.95Å; L286-L290 HydrophobicContact CD2-CB 4.38Å; L286-L290 HydrophobicContact CD2-CD1 4.03Å; L286-L290 CarbonylContact O-C 3.57Å; L290-G292 PolarHBondContact O-N 2.94Å; L290-G292 VanDerWaalsContact O-N 3.14Å; L290-I293 HydrophobicContact CB-CD1 3.87Å; L290-I293 HydrophobicContact CB-CG1 4.42Å; L290-I293 HydrophobicContact CD2-CD1 3.46Å; L290-I293 VanDerWaalsContact CD2-CD1 3.46Å; L290-I293 HydrophobicContact CG-CD1 4.17Å; L290-I293 PolarHBondContact O-N 3.15Å; L290-F296 HydrophobicContact CD1-CD2 4.27Å; L290-F296 HydrophobicContact CD1-CE2 4.21Å
291	K	66	Low	74.3	Confident	179 Å²	179	75.1 Å²	75.1	78%	0.778	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	117.9	-178.6	-169	175.7	-177.9	174.9	0	111.2	L286	L286-K291 PolarHBondContact O-N 3.32Å
292	G	65.5	Low	74.3	Confident	72 Å²	72	75.6 Å²	75.6	74%	0.742	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.7	-2.8	177.3	0	0	0	0	0	115	L290 V294	L290-G292 PolarHBondContact O-N 2.94Å; L290-G292 VanDerWaalsContact O-N 3.14Å; G292-V294 PolarHBondContact O-N 3.3Å
293	I	66.4	Low	74.4	Confident	45 Å²	45	75.1 Å²	75.1	23%	0.231	40%	0.402	C	S	.	.			trans	-75	115.3	176.3	-59.4	-176.8	0	0	0	110.2	L290 C295 F296	L290-I293 HydrophobicContact CB-CD1 3.87Å; L290-I293 HydrophobicContact CB-CG1 4.42Å; L290-I293 HydrophobicContact CD2-CD1 3.46Å; L290-I293 VanDerWaalsContact CD2-CD1 3.46Å; L290-I293 HydrophobicContact CG-CD1 4.17Å; L290-I293 PolarHBondContact O-N 3.15Å; I293-C295 VanDerWaalsContact C-N 3.35Å; I293-C295 WeakPolarHBondContact CG2-SG 3.35Å; I293-C295 PolarHBondContact O-N 3.43Å; I293-F296 HydrophobicContact CB-CD2 4.07Å; I293-F296 HydrophobicContact CG2-CD2 3.69Å; I293-F296 HydrophobicContact CG2-CE2 3.81Å; I293-F296 PolarHBondContact O-N 2.91Å
294	V	61.6	Low	74.5	Confident	123 Å²	123	76.8 Å²	76.8	75%	0.745	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-64.2	-34.4	-171.9	-178.8	0	0	0	0	113.1	G292 F296 R297	G292-V294 PolarHBondContact O-N 3.3Å; V294-F296 PolarHBondContact O-N 3.4Å; V294-F296 VanDerWaalsContact O-N 3.13Å; V294-R297 WeakPolarHBondContact O-CB 3.32Å; V294-R297 PolarHBondContact O-N 2.75Å; V294-R297 VanDerWaalsContact O-N 3.17Å
295	C	64.4	Low	74.8	Confident	93 Å²	93	80.9 Å²	80.9	63%	0.628	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-65.6	-16	-177.8	58.2	0	0	0	0	113.9	I293	I293-C295 VanDerWaalsContact C-N 3.35Å; I293-C295 WeakPolarHBondContact CG2-SG 3.35Å; I293-C295 PolarHBondContact O-N 3.43Å
296	F	67.2	Low	75.2	Confident	25 Å²	25	80 Å²	80	11%	0.11	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-106.3	14	177.7	-54.2	-55.3	0	0	0	114.3	I253 I256 L286 L290 I293 V294 H298 M299	I253-F296 HydrophobicContact CB-CZ 4.07Å; I253-F296 HydrophobicContact CD1-CE2 4Å; I253-F296 HydrophobicContact CD1-CZ 4.22Å; I253-F296 HydrophobicContact CG1-CE2 3.54Å; I253-F296 HydrophobicContact CG1-CZ 3.57Å; I253-F296 HydrophobicContact CG2-CZ 3.75Å; I256-F296 HydrophobicContact CG2-CD1 4.29Å; I256-F296 HydrophobicContact CG2-CE1 4.1Å; L286-F296 HydrophobicContact CD2-CB 3.94Å; L286-F296 HydrophobicContact CD2-CD2 4.36Å; L286-F296 HydrophobicContact CD2-CG 4.17Å; L290-F296 HydrophobicContact CD1-CD2 4.27Å; L290-F296 HydrophobicContact CD1-CE2 4.21Å; I293-F296 HydrophobicContact CB-CD2 4.07Å; I293-F296 HydrophobicContact CG2-CD2 3.69Å; I293-F296 HydrophobicContact CG2-CE2 3.81Å; I293-F296 PolarHBondContact O-N 2.91Å; V294-F296 PolarHBondContact O-N 3.4Å; V294-F296 VanDerWaalsContact O-N 3.13Å; F296-H298 PolarHBondContact O-N 2.98Å; F296-H298 VanDerWaalsContact O-N 3.07Å; F296-M299 HydrophobicContact CB-CB 4.02Å; F296-M299 HydrophobicContact CB-CG 3.72Å; F296-M299 HydrophobicContact CD1-CB 4.48Å; F296-M299 HydrophobicContact CD1-CG 3.39Å; F296-M299 HydrophobicContact CD1-SD 4.37Å; F296-M299 HydrophobicContact CE1-CG 4.42Å; F296-M299 HydrophobicContact CG-CG 3.97Å; F296-M299 WeakPolarHBondContact O-CB 3.26Å; F296-M299 PolarHBondContact O-N 2.9Å
297	R	70.8	Confident	75.8	Confident	201 Å²	201	81.5 Å²	81.5	76%	0.758	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-32.7	177.8	-174.4	177.9	177.1	-178.4	-1.2	112.7	V294	V294-R297 WeakPolarHBondContact O-CB 3.32Å; V294-R297 PolarHBondContact O-N 2.75Å; V294-R297 VanDerWaalsContact O-N 3.17Å
298	H	76.7	Confident	76.4	Confident	130 Å²	130	81.5 Å²	81.5	60%	0.602	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-20.3	179	-60	-69.7	0	0	0	113.8	F296 H300 A301 E302	F296-H298 PolarHBondContact O-N 2.98Å; F296-H298 VanDerWaalsContact O-N 3.07Å; H298-H300 PolarHBondContact O-N 3.25Å; H298-A301 WeakPolarHBondContact O-CB 3.26Å; H298-A301 PolarHBondContact O-N 3.13Å; H298-E302 PolarHBondContact O-N 3.23Å
299	M	80	Confident	77.1	Confident	26 Å²	26	79.1 Å²	79.1	13%	0.128	41%	0.414	C	S	.	.	H	α-helix	trans	-60.1	-33.8	-177.4	-70.8	-58.1	-51.7	0	0	113.2	I256 L286 F296 A301 E302 L303	I256-M299 HydrophobicContact CG2-CE 3.87Å; I256-M299 HydrophobicContact CG2-CG 4.44Å; L286-M299 HydrophobicContact CD1-CB 4.16Å; F296-M299 HydrophobicContact CB-CB 4.02Å; F296-M299 HydrophobicContact CB-CG 3.72Å; F296-M299 HydrophobicContact CD1-CB 4.48Å; F296-M299 HydrophobicContact CD1-CG 3.39Å; F296-M299 HydrophobicContact CD1-SD 4.37Å; F296-M299 HydrophobicContact CE1-CG 4.42Å; F296-M299 HydrophobicContact CG-CG 3.97Å; F296-M299 WeakPolarHBondContact O-CB 3.26Å; F296-M299 PolarHBondContact O-N 2.9Å; M299-A301 VanDerWaalsContact C-N 3.28Å; M299-A301 PolarHBondContact O-N 3.32Å; M299-E302 PolarHBondContact O-N 3.46Å; M299-L303 WeakPolarHBondContact O-CB 3.37Å; M299-L303 VanDerWaalsContact O-CG 3.27Å; M299-L303 WeakPolarHBondContact O-CG 3.34Å; M299-L303 PolarHBondContact O-N 3.41Å
300	H	80.9	Confident	78.1	Confident	82 Å²	82	75.2 Å²	75.2	38%	0.38	39%	0.393	S	S	.	.	H	α-helix	trans	-62.6	-40.6	178.1	-167.9	74.3	0	0	0	111.2	H298 I304	H298-H300 PolarHBondContact O-N 3.25Å; H300-I304 WeakPolarHBondContact O-CD1 3.42Å; H300-I304 VanDerWaalsContact O-CG1 3.29Å; H300-I304 WeakPolarHBondContact O-CG1 3.19Å; H300-I304 PolarHBondContact O-N 3.29Å; H300-I304 VanDerWaalsContact O-N 3.16Å
301	A	85.8	Confident	78.9	Confident	49 Å²	49	75.2 Å²	75.2	41%	0.405	39%	0.393	S	S	.	.	H	α-helix	trans	-66.6	-44.9	173.8	0	0	0	0	0	111	H298 M299 L303 I304 E305	H298-A301 WeakPolarHBondContact O-CB 3.26Å; H298-A301 PolarHBondContact O-N 3.13Å; M299-A301 VanDerWaalsContact C-N 3.28Å; M299-A301 PolarHBondContact O-N 3.32Å; A301-L303 VanDerWaalsContact C-N 3.3Å; A301-L303 PolarHBondContact O-N 3.18Å; A301-I304 WeakPolarHBondContact O-CA 3.33Å; A301-I304 WeakPolarHBondContact O-CB 3.48Å; A301-I304 PolarHBondContact O-N 2.98Å; A301-E305 WeakPolarHBondContact O-CG 3.31Å; A301-E305 PolarHBondContact O-N 3.46Å
302	E	85.2	Confident	79.9	Confident	87 Å²	87	72.9 Å²	72.9	41%	0.407	39%	0.385	S	S	.	.	H	α-helix	trans	-59.6	-37.7	176.9	-66.6	177.2	-165.1	0	0	112.7	H298 M299 I304 E305 M306	H298-E302 PolarHBondContact O-N 3.23Å; M299-E302 PolarHBondContact O-N 3.46Å; E302-I304 VanDerWaalsContact C-N 3.34Å; E302-E305 PolarHBondContact O-N 3.41Å; E302-M306 HydrophobicContact CB-CE 4.01Å; E302-M306 WeakPolarHBondContact O-CB 3.26Å; E302-M306 WeakPolarHBondContact O-CE 3.42Å; E302-M306 VanDerWaalsContact O-CG 3.3Å; E302-M306 WeakPolarHBondContact O-CG 3.16Å; E302-M306 PolarHBondContact O-N 2.86Å
303	L	86.6	Confident	80.9	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-71.5	-27.8	175.8	-70.1	170.4	0	0	0	112.9	I259 V279 T282 K283 L286 M299 A301 M306 E307	I259-L303 HydrophobicContact CD1-CD2 4.43Å; I259-L303 HydrophobicContact CG2-CD2 4.11Å; V279-L303 HydrophobicContact CG1-CB 4.27Å; V279-L303 HydrophobicContact CG1-CD2 4.17Å; V279-L303 HydrophobicContact CG2-CD2 4.49Å; T282-L303 HydrophobicContact CG2-CD1 3.65Å; T282-L303 HydrophobicContact CG2-CD2 4.24Å; K283-L303 HydrophobicContact CD-CB 4.49Å; K283-L303 WeakPolarHBondContact CE-O 3.25Å; K283-L303 HydrophobicContact CG-CB 4.09Å; K283-L303 HydrophobicContact CG-CD1 3.87Å; K283-L303 PolarHBondContact NZ-O 3.02Å; L286-L303 HydrophobicContact CD1-CD1 3.32Å; M299-L303 WeakPolarHBondContact O-CB 3.37Å; M299-L303 VanDerWaalsContact O-CG 3.27Å; M299-L303 WeakPolarHBondContact O-CG 3.34Å; M299-L303 PolarHBondContact O-N 3.41Å; A301-L303 VanDerWaalsContact C-N 3.3Å; A301-L303 PolarHBondContact O-N 3.18Å; L303-M306 HydrophobicContact CD2-CE 3.84Å; L303-M306 HydrophobicContact CG-CE 4.34Å; L303-E307 VanDerWaalsContact O-CB 3.31Å; L303-E307 WeakPolarHBondContact O-CB 3.34Å; L303-E307 PolarHBondContact O-N 3.5Å; L303-E307 VanDerWaalsContact O-N 3.08Å
304	I	87.2	Confident	81.7	Confident	66 Å²	66	69.4 Å²	69.4	34%	0.338	35%	0.35	S	S	.	.	H	α-helix	trans	-71.8	-46	170.8	-67.3	163.4	0	0	0	109.4	H300 A301 E302 M306 E307 D308	H300-I304 WeakPolarHBondContact O-CD1 3.42Å; H300-I304 VanDerWaalsContact O-CG1 3.29Å; H300-I304 WeakPolarHBondContact O-CG1 3.19Å; H300-I304 PolarHBondContact O-N 3.29Å; H300-I304 VanDerWaalsContact O-N 3.16Å; A301-I304 WeakPolarHBondContact O-CA 3.33Å; A301-I304 WeakPolarHBondContact O-CB 3.48Å; A301-I304 PolarHBondContact O-N 2.98Å; E302-I304 VanDerWaalsContact C-N 3.34Å; I304-M306 VanDerWaalsContact C-N 3.34Å; I304-M306 PolarHBondContact O-N 3.42Å; I304-E307 WeakPolarHBondContact O-CA 3.19Å; I304-E307 WeakPolarHBondContact O-CB 3.43Å; I304-E307 PolarHBondContact O-N 2.7Å; I304-E307 VanDerWaalsContact O-N 3.08Å; I304-D308 PolarHBondContact O-N 2.78Å
305	E	89.2	Confident	82.5	Confident	133 Å²	133	66.7 Å²	66.7	62%	0.621	33%	0.328	S	S	*	.	H	α-helix	trans	-61.8	-40.7	176.1	-70.2	177.9	-169.9	0	0	112	A301 E302 E307 D308 L309	A301-E305 WeakPolarHBondContact O-CG 3.31Å; A301-E305 PolarHBondContact O-N 3.46Å; E302-E305 PolarHBondContact O-N 3.41Å; E305-E307 VanDerWaalsContact C-N 3.33Å; E305-D308 PolarHBondContact O-N 3.03Å; E305-L309 VanDerWaalsContact O-CB 3.29Å; E305-L309 WeakPolarHBondContact O-CB 3.45Å; E305-L309 PolarHBondContact O-N 2.81Å
306	M	86.5	Confident	83.3	Confident	22 Å²	22	65.7 Å²	65.7	11%	0.108	32%	0.316	C	S	.	.	H	α-helix	trans	-62.2	-41.1	172.3	-78.6	-175.6	-101	0	0	111.4	I259 E302 L303 I304 L309 I310	I259-M306 HydrophobicContact CG2-CE 4.25Å; I259-M306 HydrophobicContact CG2-SD 4.06Å; E302-M306 HydrophobicContact CB-CE 4.01Å; E302-M306 WeakPolarHBondContact O-CB 3.26Å; E302-M306 WeakPolarHBondContact O-CE 3.42Å; E302-M306 VanDerWaalsContact O-CG 3.3Å; E302-M306 WeakPolarHBondContact O-CG 3.16Å; E302-M306 PolarHBondContact O-N 2.86Å; L303-M306 HydrophobicContact CD2-CE 3.84Å; L303-M306 HydrophobicContact CG-CE 4.34Å; I304-M306 VanDerWaalsContact C-N 3.34Å; I304-M306 PolarHBondContact O-N 3.42Å; M306-L309 PolarHBondContact O-N 3.41Å; M306-I310 WeakPolarHBondContact O-CB 3.49Å; M306-I310 WeakPolarHBondContact O-CD1 3.33Å; M306-I310 WeakPolarHBondContact O-CG1 3.41Å; M306-I310 PolarHBondContact O-N 3.35Å
307	E	89.1	Confident	84	Confident	48 Å²	48	64.7 Å²	64.7	22%	0.224	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-43.1	176.1	-174.5	170.5	-148.5	0	0	112	L276 V279 K283 L303 I304 E305 I310 T311 Q353	L276-E307 HydrophobicContact CD2-CG 4.41Å; V279-E307 HydrophobicContact CG1-CB 4.4Å; K283-E307 IonicContact NZ-OE2 2.82Å; K283-E307 PolarHBondContact NZ-OE2 3.2Å; L303-E307 VanDerWaalsContact O-CB 3.31Å; L303-E307 WeakPolarHBondContact O-CB 3.34Å; L303-E307 PolarHBondContact O-N 3.5Å; L303-E307 VanDerWaalsContact O-N 3.08Å; I304-E307 WeakPolarHBondContact O-CA 3.19Å; I304-E307 WeakPolarHBondContact O-CB 3.43Å; I304-E307 PolarHBondContact O-N 2.7Å; I304-E307 VanDerWaalsContact O-N 3.08Å; E305-E307 VanDerWaalsContact C-N 3.33Å; E307-I310 PolarHBondContact O-N 3.38Å; E307-T311 WeakPolarHBondContact O-CB 3.34Å; E307-T311 PolarHBondContact O-N 3.1Å; E307-T311 PolarHBondContact O-OG1 3.17Å; E307-Q353 PolarHBondContact OE1-NE2 3.31Å; E307-Q353 PolarHBondContact OE1-OE1 2.97Å
308	D	88	Confident	84.2	Confident	97 Å²	97	55.1 Å²	55.1	52%	0.519	28%	0.276	S	S	.	.	H	α-helix	trans	-65.7	-39.8	175.8	-74.1	-27.2	0	0	0	111.7	I304 E305 T311 H312	I304-D308 PolarHBondContact O-N 2.78Å; E305-D308 PolarHBondContact O-N 3.03Å; D308-T311 WeakPolarHBondContact O-CB 3.43Å; D308-T311 PolarHBondContact O-N 3.48Å; D308-H312 PolarHBondContact O-N 3.3Å
309	L	89	Confident	83.9	Confident	94 Å²	94	51 Å²	51	49%	0.492	26%	0.258	S	S	.	.	H	α-helix	trans	-62.9	-49.5	175.1	-178.3	73.5	0	0	0	111.1	E305 M306 T311 H312 I313	E305-L309 VanDerWaalsContact O-CB 3.29Å; E305-L309 WeakPolarHBondContact O-CB 3.45Å; E305-L309 PolarHBondContact O-N 2.81Å; M306-L309 PolarHBondContact O-N 3.41Å; L309-T311 PolarHBondContact O-N 2.72Å; L309-H312 WeakPolarHBondContact O-CB 3.29Å; L309-H312 PolarHBondContact O-N 2.93Å; L309-H312 VanDerWaalsContact O-N 3.12Å; L309-I313 HydrophobicContact CG-CD1 4.05Å; L309-I313 WeakPolarHBondContact O-CG1 3.26Å; L309-I313 PolarHBondContact O-N 3.01Å
310	I	87.5	Confident	83.7	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-59.1	-41.5	176.4	-64.5	165.8	0	0	0	109.4	V263 L267 A275 L276 V279 M306 E307 H312 I313 L314	V263-I310 HydrophobicContact CG1-CD1 4.01Å; L267-I310 HydrophobicContact CD1-CG1 4.33Å; L267-I310 HydrophobicContact CD2-CG1 4.11Å; L267-I310 HydrophobicContact CD2-CG2 4.42Å; A275-I310 HydrophobicContact CB-CD1 4.21Å; L276-I310 HydrophobicContact CD1-CG2 4.37Å; L276-I310 HydrophobicContact CD2-CB 4.01Å; L276-I310 HydrophobicContact CD2-CD1 4Å; L276-I310 HydrophobicContact CD2-CG2 3.63Å; L276-I310 HydrophobicContact CG-CG2 3.83Å; V279-I310 HydrophobicContact CG2-CD1 4.18Å; M306-I310 WeakPolarHBondContact O-CB 3.49Å; M306-I310 WeakPolarHBondContact O-CD1 3.33Å; M306-I310 WeakPolarHBondContact O-CG1 3.41Å; M306-I310 PolarHBondContact O-N 3.35Å; E307-I310 PolarHBondContact O-N 3.38Å; I310-H312 VanDerWaalsContact C-N 3.33Å; I310-H312 PolarHBondContact O-N 2.84Å; I310-I313 PolarHBondContact O-N 3.13Å; I310-L314 HydrophobicContact CG2-CD1 3.91Å; I310-L314 HydrophobicContact CG2-CG 4.15Å; I310-L314 VanDerWaalsContact O-CB 3.27Å; I310-L314 WeakPolarHBondContact O-CB 3.24Å; I310-L314 WeakPolarHBondContact O-CG 3.42Å; I310-L314 PolarHBondContact O-N 3.26Å
311	T	84.2	Confident	83.2	Confident	6 Å²	6	52.7 Å²	52.7	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-40.8	176.1	-61.6	0	0	0	0	112.5	E307 D308 L309 K315 Q353 Q355	E307-T311 WeakPolarHBondContact O-CB 3.34Å; E307-T311 PolarHBondContact O-N 3.1Å; E307-T311 PolarHBondContact O-OG1 3.17Å; D308-T311 WeakPolarHBondContact O-CB 3.43Å; D308-T311 PolarHBondContact O-N 3.48Å; L309-T311 PolarHBondContact O-N 2.72Å; T311-K315 WeakPolarHBondContact O-CG 3.49Å; T311-K315 PolarHBondContact O-N 3Å; T311-Q353 WeakPolarHBondContact OG1-CG 3.49Å; T311-Q353 PolarHBondContact OG1-OE1 3.02Å; T311-Q355 HydrophobicContact CG2-CG 3.63Å
312	H	85.6	Confident	82.2	Confident	130 Å²	130	50.6 Å²	50.6	60%	0.602	24%	0.242	S	C	*	.	H	α-helix	trans	-66.5	-46.1	175.6	-174	75.9	0	0	0	111.8	D308 L309 I310 L314 K315 D316	D308-H312 PolarHBondContact O-N 3.3Å; L309-H312 WeakPolarHBondContact O-CB 3.29Å; L309-H312 PolarHBondContact O-N 2.93Å; L309-H312 VanDerWaalsContact O-N 3.12Å; I310-H312 VanDerWaalsContact C-N 3.33Å; I310-H312 PolarHBondContact O-N 2.84Å; H312-L314 VanDerWaalsContact C-N 3.28Å; H312-L314 PolarHBondContact O-N 3.18Å; H312-K315 PolarHBondContact O-N 3.41Å; H312-D316 PolarHBondContact O-N 3.15Å
313	I	86.4	Confident	81.3	Confident	45 Å²	45	52 Å²	52	23%	0.231	24%	0.244	C	C	.	.	H	α-helix	trans	-59.6	-42	176.3	-65.1	166.6	0	0	0	110.5	L267 Y272 L309 I310 D316 A317	L267-I313 HydrophobicContact CD1-CD1 4.02Å; Y272-I313 HydrophobicContact CD1-CG2 4.45Å; Y272-I313 HydrophobicContact CE1-CG2 3.62Å; L309-I313 HydrophobicContact CG-CD1 4.05Å; L309-I313 WeakPolarHBondContact O-CG1 3.26Å; L309-I313 PolarHBondContact O-N 3.01Å; I310-I313 PolarHBondContact O-N 3.13Å; I313-D316 PolarHBondContact O-N 2.95Å; I313-A317 WeakPolarHBondContact O-CB 3.31Å; I313-A317 PolarHBondContact O-N 3.41Å
314	L	84.6	Confident	80.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-45.3	176.8	-80.9	175	0	0	0	112.2	Y272 L276 I310 H312 F318 I346 L350	Y272-L314 VanDerWaalsContact CB-CD2 3.49Å; Y272-L314 HydrophobicContact CD1-CD2 4.04Å; Y272-L314 HydrophobicContact CD1-CG 4.41Å; Y272-L314 HydrophobicContact CD2-CD2 3.72Å; Y272-L314 HydrophobicContact CE2-CD2 4.48Å; Y272-L314 HydrophobicContact CG-CD2 3.46Å; Y272-L314 VanDerWaalsContact CG-CD2 3.46Å; Y272-L314 HydrophobicContact CG-CG 4.25Å; L276-L314 HydrophobicContact CD1-CD1 3.93Å; I310-L314 HydrophobicContact CG2-CD1 3.91Å; I310-L314 HydrophobicContact CG2-CG 4.15Å; I310-L314 VanDerWaalsContact O-CB 3.27Å; I310-L314 WeakPolarHBondContact O-CB 3.24Å; I310-L314 WeakPolarHBondContact O-CG 3.42Å; I310-L314 PolarHBondContact O-N 3.26Å; H312-L314 VanDerWaalsContact C-N 3.28Å; H312-L314 PolarHBondContact O-N 3.18Å; L314-F318 WeakPolarHBondContact O-CB 3.38Å; L314-F318 PolarHBondContact O-N 3.28Å; L314-I346 VanDerWaalsContact CD2-CA 3.41Å; L314-I346 HydrophobicContact CD2-CB 4.12Å; L314-I346 HydrophobicContact CD2-CG1 4.29Å; L314-I346 HydrophobicContact CD2-CG2 4.11Å; L314-I346 WeakPolarHBondContact CD2-O 3.33Å; L314-L350 HydrophobicContact CB-CD2 3.74Å; L314-L350 HydrophobicContact CB-CG 4.01Å
315	K	78.1	Confident	79.1	Confident	65 Å²	65	52.9 Å²	52.9	28%	0.283	25%	0.251	S	S	.	.	H	α-helix	trans	-62.9	-44.6	176.6	-74.4	175	-179.3	177.1	0	111.4	T311 H312 F318 L319 L350 Q355	T311-K315 WeakPolarHBondContact O-CG 3.49Å; T311-K315 PolarHBondContact O-N 3Å; H312-K315 PolarHBondContact O-N 3.41Å; K315-F318 PolarHBondContact O-N 3.02Å; K315-L319 WeakPolarHBondContact O-CB 3.25Å; K315-L319 VanDerWaalsContact O-CG 3.3Å; K315-L319 WeakPolarHBondContact O-CG 3.48Å; K315-L319 PolarHBondContact O-N 3.31Å; K315-L350 HydrophobicContact CG-CD2 3.84Å; K315-Q355 VanDerWaalsContact CE-OE1 3.27Å
316	D	81.9	Confident	77.4	Confident	73 Å²	73	47.1 Å²	47.1	39%	0.39	22%	0.224	S	C	.	.	H	α-helix	trans	-67.8	-45.7	179.5	-179.2	66.6	0	0	0	112.2	H312 I313 F318 L319 R320	H312-D316 PolarHBondContact O-N 3.15Å; I313-D316 PolarHBondContact O-N 2.95Å; D316-F318 VanDerWaalsContact C-N 3.31Å; D316-F318 PolarHBondContact O-N 2.94Å; D316-L319 PolarHBondContact O-N 3.39Å; D316-R320 WeakPolarHBondContact O-CB 3.48Å; D316-R320 WeakPolarHBondContact O-CG 3.36Å; D316-R320 PolarHBondContact O-N 3.36Å; D316-R320 IonicContact OD2-CZ 3.94Å; D316-R320 IonicContact OD2-NE 3.35Å; D316-R320 PolarHBondContact OD2-NE 3.2Å; D316-R320 IonicContact OD2-NH2 3.84Å; D316-R320 PolarHBondContact OD2-NH2 3.45Å
317	A	80.9	Confident	76.1	Confident	4 Å²	4	52 Å²	52	3%	0.033	25%	0.247	C	C	.	.	H	α-helix	trans	-60.9	-41.4	175.2	0	0	0	0	0	111.5	I313 R320 F321 I346	I313-A317 WeakPolarHBondContact O-CB 3.31Å; I313-A317 PolarHBondContact O-N 3.41Å; A317-R320 PolarHBondContact O-N 3.46Å; A317-F321 WeakPolarHBondContact O-CB 3.49Å; A317-F321 PolarHBondContact O-N 3.42Å; A317-I346 HydrophobicContact CB-CD1 3.74Å; A317-I346 HydrophobicContact CB-CG1 4.17Å
318	F	75	Confident	74.5	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-47.5	174.5	178.6	-106.4	0	0	0	112.4	L314 K315 D316 F321 F322 I346 L350 F358 I362 F450	L314-F318 WeakPolarHBondContact O-CB 3.38Å; L314-F318 PolarHBondContact O-N 3.28Å; K315-F318 PolarHBondContact O-N 3.02Å; D316-F318 VanDerWaalsContact C-N 3.31Å; D316-F318 PolarHBondContact O-N 2.94Å; F318-F321 WeakPolarHBondContact O-CB 3.42Å; F318-F321 PolarHBondContact O-N 3.44Å; F318-F322 HydrophobicContact CZ-CD2 4.16Å; F318-F322 WeakPolarHBondContact O-CB 3.46Å; F318-F322 PolarHBondContact O-N 3.23Å; F318-I346 HydrophobicContact CB-CG2 3.66Å; F318-I346 HydrophobicContact CD2-CG2 4.22Å; F318-I346 HydrophobicContact CG-CG2 4.41Å; F318-L350 HydrophobicContact CB-CD1 3.78Å; F318-L350 HydrophobicContact CD1-CD1 4.28Å; F318-L350 HydrophobicContact CD2-CD1 4.2Å; F318-L350 HydrophobicContact CG-CD1 3.78Å; F318-F358 HydrophobicContact CD1-CB 4.3Å; F318-F358 HydrophobicContact CD1-CD2 4.21Å; F318-F358 HydrophobicContact CE1-CB 4.42Å; F318-F358 AromaticContact CE1-CD2 3.71Å; F318-F358 HydrophobicContact CE1-CD2 3.71Å; F318-F358 HydrophobicContact CE1-CG 4.43Å; F318-F358 AromaticContact CZ-CD2 4Å; F318-F358 HydrophobicContact CZ-CD2 4Å; F318-F358 HydrophobicContact CZ-CE2 4.41Å; F318-I362 HydrophobicContact CE1-CD1 3.98Å; F318-I362 HydrophobicContact CE1-CG1 3.57Å; F318-I362 HydrophobicContact CZ-CD1 3.59Å; F318-I362 HydrophobicContact CZ-CG1 3.65Å; F318-F450 HydrophobicContact CD2-CE2 4.25Å; F318-F450 HydrophobicContact CD2-CZ 4.2Å; F318-F450 HydrophobicContact CE2-CD2 4.3Å; F318-F450 HydrophobicContact CE2-CE1 4.01Å; F318-F450 AromaticContact CE2-CE2 3.42Å; F318-F450 HydrophobicContact CE2-CE2 3.42Å; F318-F450 VanDerWaalsContact CE2-CE2 3.42Å; F318-F450 AromaticContact CE2-CZ 3.23Å; F318-F450 HydrophobicContact CE2-CZ 3.23Å; F318-F450 HydrophobicContact CZ-CE1 4.19Å; F318-F450 HydrophobicContact CZ-CE2 4.31Å; F318-F450 AromaticContact CZ-CZ 3.85Å; F318-F450 HydrophobicContact CZ-CZ 3.85Å
319	L	71.3	Confident	72.6	Confident	42 Å²	42	48.5 Å²	48.5	22%	0.22	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-40.4	178.2	-74.7	175	0	0	0	112.1	K315 D316 F322 R323	K315-L319 WeakPolarHBondContact O-CB 3.25Å; K315-L319 VanDerWaalsContact O-CG 3.3Å; K315-L319 WeakPolarHBondContact O-CG 3.48Å; K315-L319 PolarHBondContact O-N 3.31Å; D316-L319 PolarHBondContact O-N 3.39Å; L319-F322 PolarHBondContact O-N 3.28Å; L319-R323 WeakPolarHBondContact O-CB 3.43Å; L319-R323 VanDerWaalsContact O-CG 3.32Å; L319-R323 WeakPolarHBondContact O-CG 3.28Å; L319-R323 PolarHBondContact O-N 3.4Å
320	R	75.4	Confident	70.7	Confident	125 Å²	125	46.5 Å²	46.5	47%	0.472	23%	0.227	S	C	.	.	H	α-helix	trans	-58.4	-49.3	172.8	-79.1	-173.1	-84.6	115	-4.8	111	D316 A317 F322 R323 T324	D316-R320 WeakPolarHBondContact O-CB 3.48Å; D316-R320 WeakPolarHBondContact O-CG 3.36Å; D316-R320 PolarHBondContact O-N 3.36Å; D316-R320 IonicContact OD2-CZ 3.94Å; D316-R320 IonicContact OD2-NE 3.35Å; D316-R320 PolarHBondContact OD2-NE 3.2Å; D316-R320 IonicContact OD2-NH2 3.84Å; D316-R320 PolarHBondContact OD2-NH2 3.45Å; A317-R320 PolarHBondContact O-N 3.46Å; R320-F322 VanDerWaalsContact C-N 3.35Å; R320-F322 PolarHBondContact O-N 2.81Å; R320-R323 PolarHBondContact O-N 2.81Å; R320-T324 PolarHBondContact O-N 2.97Å; R320-T324 PolarHBondContact O-OG1 2.93Å
321	F	70.1	Confident	68.8	Low	20 Å²	20	53.5 Å²	53.5	9%	0.088	26%	0.258	C	S	.	.	H	α-helix	trans	-55.8	-49.3	176.2	-177.7	-86.8	0	0	0	111.7	A317 F318 R323 T324 E325 F338 L343 F450	A317-F321 WeakPolarHBondContact O-CB 3.49Å; A317-F321 PolarHBondContact O-N 3.42Å; F318-F321 WeakPolarHBondContact O-CB 3.42Å; F318-F321 PolarHBondContact O-N 3.44Å; F321-R323 PolarHBondContact O-N 3.39Å; F321-T324 PolarHBondContact O-N 2.78Å; F321-E325 HydrophobicContact CD1-CG 4.44Å; F321-E325 HydrophobicContact CE1-CG 3.81Å; F321-E325 HydrophobicContact CZ-CG 4.01Å; F321-E325 PolarHBondContact O-N 2.85Å; F321-F338 HydrophobicContact CD2-CD1 4.27Å; F321-F338 HydrophobicContact CD2-CG 4.4Å; F321-F338 HydrophobicContact CE2-CB 3.73Å; F321-F338 AromaticContact CE2-CD1 3.83Å; F321-F338 HydrophobicContact CE2-CD1 3.83Å; F321-F338 AromaticContact CE2-CD2 3.87Å; F321-F338 HydrophobicContact CE2-CD2 3.87Å; F321-F338 HydrophobicContact CE2-CE1 4.41Å; F321-F338 HydrophobicContact CE2-CE2 4.42Å; F321-F338 AromaticContact CE2-CG 3.53Å; F321-F338 HydrophobicContact CE2-CG 3.53Å; F321-F338 HydrophobicContact CZ-CB 4.26Å; F321-F338 HydrophobicContact CZ-CD2 4.02Å; F321-F338 HydrophobicContact CZ-CG 4.12Å; F321-L343 HydrophobicContact CD1-CD1 3.46Å; F321-L343 VanDerWaalsContact CD1-CD1 3.46Å; F321-L343 HydrophobicContact CD2-CD1 4.01Å; F321-L343 HydrophobicContact CE1-CD1 3.4Å; F321-L343 VanDerWaalsContact CE1-CD1 3.4Å; F321-L343 HydrophobicContact CE1-CD2 3.78Å; F321-L343 HydrophobicContact CE1-CG 4.17Å; F321-L343 HydrophobicContact CE2-CB 4.26Å; F321-L343 HydrophobicContact CE2-CD1 3.94Å; F321-L343 HydrophobicContact CE2-CD2 4.29Å; F321-L343 HydrophobicContact CE2-CG 4.39Å; F321-L343 HydrophobicContact CG-CD1 3.79Å; F321-L343 HydrophobicContact CZ-CB 4.36Å; F321-L343 HydrophobicContact CZ-CD1 3.67Å; F321-L343 HydrophobicContact CZ-CD2 3.58Å; F321-L343 HydrophobicContact CZ-CG 4.06Å; F321-F450 HydrophobicContact CE1-CD2 4.39Å
322	F	63.8	Low	66.9	Low	4 Å²	4	58.6 Å²	58.6	2%	0.018	29%	0.285	C	S	.	.	H	α-helix	trans	-62.7	-43.2	-179.2	-160	-92.3	0	0	0	112	F318 L319 R320 E325 F326 I362 E365 V366 L369 L447	F318-F322 HydrophobicContact CZ-CD2 4.16Å; F318-F322 WeakPolarHBondContact O-CB 3.46Å; F318-F322 PolarHBondContact O-N 3.23Å; L319-F322 PolarHBondContact O-N 3.28Å; R320-F322 VanDerWaalsContact C-N 3.35Å; R320-F322 PolarHBondContact O-N 2.81Å; F322-E325 PolarHBondContact O-N 3.29Å; F322-F326 AromaticContact CD1-CD2 3.61Å; F322-F326 HydrophobicContact CD1-CD2 3.61Å; F322-F326 AromaticContact CD1-CE2 3.81Å; F322-F326 HydrophobicContact CD1-CE2 3.81Å; F322-F326 HydrophobicContact CD1-CG 4.36Å; F322-F326 HydrophobicContact CD2-CD2 4.33Å; F322-F326 HydrophobicContact CD2-CE2 4.03Å; F322-F326 HydrophobicContact CE1-CD1 4.49Å; F322-F326 AromaticContact CE1-CD2 3.39Å; F322-F326 HydrophobicContact CE1-CD2 3.39Å; F322-F326 HydrophobicContact CE1-CE1 4.27Å; F322-F326 AromaticContact CE1-CE2 3.17Å; F322-F326 HydrophobicContact CE1-CE2 3.17Å; F322-F326 HydrophobicContact CE1-CG 4.08Å; F322-F326 AromaticContact CE1-CZ 3.62Å; F322-F326 HydrophobicContact CE1-CZ 3.62Å; F322-F326 HydrophobicContact CE2-CD2 4.14Å; F322-F326 AromaticContact CE2-CE2 3.42Å; F322-F326 HydrophobicContact CE2-CE2 3.42Å; F322-F326 VanDerWaalsContact CE2-CE2 3.42Å; F322-F326 HydrophobicContact CE2-CZ 4.14Å; F322-F326 HydrophobicContact CG-CD2 4.1Å; F322-F326 HydrophobicContact CG-CE2 4.21Å; F322-F326 AromaticContact CZ-CD2 3.68Å; F322-F326 HydrophobicContact CZ-CD2 3.68Å; F322-F326 HydrophobicContact CZ-CE1 4.34Å; F322-F326 AromaticContact CZ-CE2 2.94Å; F322-F326 HydrophobicContact CZ-CE2 2.94Å; F322-F326 AromaticContact CZ-CZ 3.33Å; F322-F326 HydrophobicContact CZ-CZ 3.33Å; F322-F326 WeakPolarHBondContact O-CB 3Å; F322-F326 WeakPolarHBondContact O-CD2 3.37Å; F322-F326 PolarHBondContact O-N 3.09Å; F322-I362 HydrophobicContact CD2-CG1 4.44Å; F322-I362 HydrophobicContact CE1-CG2 4.39Å; F322-I362 HydrophobicContact CE2-CD1 4.41Å; F322-I362 HydrophobicContact CE2-CG1 4.14Å; F322-I362 HydrophobicContact CE2-CG2 3.91Å; F322-I362 HydrophobicContact CZ-CB 4.41Å; F322-I362 HydrophobicContact CZ-CG1 4.48Å; F322-I362 HydrophobicContact CZ-CG2 3.6Å; F322-E365 HydrophobicContact CD1-CB 4.05Å; F322-E365 HydrophobicContact CD1-CG 3.78Å; F322-E365 HydrophobicContact CE1-CB 4.16Å; F322-E365 HydrophobicContact CE1-CG 4.27Å; F322-V366 HydrophobicContact CE1-CG2 3.9Å; F322-V366 HydrophobicContact CZ-CG2 3.8Å; F322-L369 HydrophobicContact CD1-CD1 4.33Å; F322-L369 HydrophobicContact CE1-CD1 4.2Å; F322-L447 HydrophobicContact CE2-CD2 3.94Å; F322-L447 HydrophobicContact CZ-CD2 3.99Å
323	R	67.8	Low	64.9	Low	118 Å²	118	61.9 Å²	61.9	45%	0.445	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-43.8	175.8	-77.5	176.7	178	-174.4	4.7	112.3	L319 R320 F321 F326 Q327 E365	L319-R323 WeakPolarHBondContact O-CB 3.43Å; L319-R323 VanDerWaalsContact O-CG 3.32Å; L319-R323 WeakPolarHBondContact O-CG 3.28Å; L319-R323 PolarHBondContact O-N 3.4Å; R320-R323 PolarHBondContact O-N 2.81Å; F321-R323 PolarHBondContact O-N 3.39Å; R323-F326 PolarHBondContact O-N 2.87Å; R323-Q327 VanDerWaalsContact O-CB 3.25Å; R323-Q327 WeakPolarHBondContact O-CB 3.22Å; R323-Q327 WeakPolarHBondContact O-CG 3.42Å; R323-Q327 PolarHBondContact O-N 3.45Å; R323-E365 HydrophobicContact CG-CG 4.11Å; R323-E365 WeakPolarHBondContact CG-OE1 3.41Å; R323-E365 IonicContact CZ-OE1 3.19Å; R323-E365 IonicContact CZ-OE2 3.5Å; R323-E365 IonicContact NE-OE1 2.76Å; R323-E365 PolarHBondContact NE-OE1 2.82Å; R323-E365 IonicContact NE-OE2 2.75Å; R323-E365 PolarHBondContact NE-OE2 3.21Å; R323-E365 VanDerWaalsContact NE-OE2 3.11Å; R323-E365 IonicContact NH2-OE1 2.74Å; R323-E365 PolarHBondContact NH2-OE1 2.8Å; R323-E365 IonicContact NH2-OE2 3.49Å; R323-E365 PolarHBondContact NH2-OE2 2.87Å
324	T	67.1	Low	62.9	Low	69 Å²	69	62.2 Å²	62.2	42%	0.423	31%	0.31	S	S	.	.	H	α-helix	trans	-65.1	-45	179.7	-50.5	0	0	0	0	111.2	R320 F321 S328 F338	R320-T324 PolarHBondContact O-N 2.97Å; R320-T324 PolarHBondContact O-OG1 2.93Å; F321-T324 PolarHBondContact O-N 2.78Å; T324-S328 WeakPolarHBondContact O-CB 3.23Å; T324-S328 PolarHBondContact O-N 3.48Å; T324-F338 HydrophobicContact CG2-CE1 4.22Å; T324-F338 HydrophobicContact CG2-CZ 3.69Å
325	E	60.6	Low	61.2	Low	14 Å²	14	67 Å²	67	7%	0.065	34%	0.343	C	S	.	.	H	α-helix	trans	-57.7	-48.6	173.4	-91.7	-74.3	150	0	0	112.2	F321 F322 A329 L336 F338 R449	F321-E325 HydrophobicContact CD1-CG 4.44Å; F321-E325 HydrophobicContact CE1-CG 3.81Å; F321-E325 HydrophobicContact CZ-CG 4.01Å; F321-E325 PolarHBondContact O-N 2.85Å; F322-E325 PolarHBondContact O-N 3.29Å; E325-A329 WeakPolarHBondContact O-CB 3.26Å; E325-A329 PolarHBondContact O-N 3.22Å; E325-L336 VanDerWaalsContact OE1-CB 3.28Å; E325-L336 WeakPolarHBondContact OE1-CB 3.4Å; E325-F338 HydrophobicContact CG-CD2 4.2Å; E325-F338 HydrophobicContact CG-CE2 3.71Å; E325-F338 WeakPolarHBondContact OE1-CD2 3.41Å; E325-F338 WeakPolarHBondContact OE1-CE2 3.11Å; E325-R449 IonicContact OE2-CZ 3.51Å; E325-R449 IonicContact OE2-NE 3.28Å; E325-R449 IonicContact OE2-NH2 2.55Å; E325-R449 PolarHBondContact OE2-NH2 3.49Å
326	F	53.4	Low	59.7	Low	13 Å²	13	66.1 Å²	66.1	6%	0.057	34%	0.341	C	S	.	.	H	α-helix	trans	-75.4	-39.1	-175	-90	-102.4	0	0	0	113.8	F322 R323 V330 V366 L369 A443 R446	F322-F326 AromaticContact CD1-CD2 3.61Å; F322-F326 HydrophobicContact CD1-CD2 3.61Å; F322-F326 AromaticContact CD1-CE2 3.81Å; F322-F326 HydrophobicContact CD1-CE2 3.81Å; F322-F326 HydrophobicContact CD1-CG 4.36Å; F322-F326 HydrophobicContact CD2-CD2 4.33Å; F322-F326 HydrophobicContact CD2-CE2 4.03Å; F322-F326 HydrophobicContact CE1-CD1 4.49Å; F322-F326 AromaticContact CE1-CD2 3.39Å; F322-F326 HydrophobicContact CE1-CD2 3.39Å; F322-F326 HydrophobicContact CE1-CE1 4.27Å; F322-F326 AromaticContact CE1-CE2 3.17Å; F322-F326 HydrophobicContact CE1-CE2 3.17Å; F322-F326 HydrophobicContact CE1-CG 4.08Å; F322-F326 AromaticContact CE1-CZ 3.62Å; F322-F326 HydrophobicContact CE1-CZ 3.62Å; F322-F326 HydrophobicContact CE2-CD2 4.14Å; F322-F326 AromaticContact CE2-CE2 3.42Å; F322-F326 HydrophobicContact CE2-CE2 3.42Å; F322-F326 VanDerWaalsContact CE2-CE2 3.42Å; F322-F326 HydrophobicContact CE2-CZ 4.14Å; F322-F326 HydrophobicContact CG-CD2 4.1Å; F322-F326 HydrophobicContact CG-CE2 4.21Å; F322-F326 AromaticContact CZ-CD2 3.68Å; F322-F326 HydrophobicContact CZ-CD2 3.68Å; F322-F326 HydrophobicContact CZ-CE1 4.34Å; F322-F326 AromaticContact CZ-CE2 2.94Å; F322-F326 HydrophobicContact CZ-CE2 2.94Å; F322-F326 AromaticContact CZ-CZ 3.33Å; F322-F326 HydrophobicContact CZ-CZ 3.33Å; F322-F326 WeakPolarHBondContact O-CB 3Å; F322-F326 WeakPolarHBondContact O-CD2 3.37Å; F322-F326 PolarHBondContact O-N 3.09Å; R323-F326 PolarHBondContact O-N 2.87Å; F326-V330 WeakPolarHBondContact O-CG2 3.34Å; F326-V366 HydrophobicContact CE1-CG2 4.14Å; F326-V366 HydrophobicContact CZ-CG2 4.03Å; F326-L369 HydrophobicContact CB-CD1 3.23Å; F326-L369 HydrophobicContact CB-CD2 3.89Å; F326-L369 HydrophobicContact CB-CG 4.12Å; F326-L369 HydrophobicContact CD1-CB 4.46Å; F326-L369 HydrophobicContact CD1-CD1 3.51Å; F326-L369 HydrophobicContact CD2-CD1 4.2Å; F326-L369 HydrophobicContact CE1-CD1 4.34Å; F326-L369 HydrophobicContact CG-CD1 3.39Å; F326-A443 HydrophobicContact CE1-CB 4.16Å; F326-R446 VanDerWaalsContact CD1-CD 3.49Å; F326-R446 HydrophobicContact CD2-CB 4.33Å; F326-R446 HydrophobicContact CE1-CB 4.09Å; F326-R446 HydrophobicContact CE1-CG 4.46Å; F326-R446 HydrophobicContact CE2-CB 3.57Å; F326-R446 HydrophobicContact CE2-CG 4.38Å; F326-R446 HydrophobicContact CZ-CB 3.47Å; F326-R446 VanDerWaalsContact CZ-CB 3.47Å; F326-R446 HydrophobicContact CZ-CG 4.27Å
327	Q	57.9	Low	58.2	Low	125 Å²	125	71.8 Å²	71.8	58%	0.584	37%	0.366	S	S	*	.	H	α-helix	trans	-72.4	-42.5	177.7	-71.6	-178.3	-9.2	0	0	111.7	R323 L369	R323-Q327 VanDerWaalsContact O-CB 3.25Å; R323-Q327 WeakPolarHBondContact O-CB 3.22Å; R323-Q327 WeakPolarHBondContact O-CG 3.42Å; R323-Q327 PolarHBondContact O-N 3.45Å; Q327-L369 HydrophobicContact CG-CD2 3.92Å
328	S	55.8	Low	57.1	Low	61 Å²	61	74.5 Å²	74.5	43%	0.427	38%	0.377	S	S	.	.	H	α-helix	trans	-68.6	-37.2	-178	-170.4	0	0	0	0	111.8	T324 V330	T324-S328 WeakPolarHBondContact O-CB 3.23Å; T324-S328 PolarHBondContact O-N 3.48Å; S328-V330 VanDerWaalsContact C-N 3.28Å; S328-V330 PolarHBondContact O-N 3.44Å
329	A	49.3	Very low	56.4	Low	10 Å²	10	79.4 Å²	79.4	8%	0.083	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	9.3	-175.4	0	0	0	0	0	114.2	E325 F331 L336 R446	E325-A329 WeakPolarHBondContact O-CB 3.26Å; E325-A329 PolarHBondContact O-N 3.22Å; A329-F331 PolarHBondContact O-N 3.07Å; A329-L336 HydrophobicContact CB-CD1 4.15Å; A329-R446 PolarHBondContact O-NH2 3.2Å
330	V	48.1	Very low	56	Low	51 Å²	51	81.6 Å²	81.6	31%	0.309	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-22.7	169.2	-179.6	0	0	0	0	110.7	F326 S328 L373	F326-V330 WeakPolarHBondContact O-CG2 3.34Å; S328-V330 VanDerWaalsContact C-N 3.28Å; S328-V330 PolarHBondContact O-N 3.44Å; V330-L373 HydrophobicContact CG1-CD2 3.98Å
331	F	46.8	Very low	55.8	Low	148 Å²	148	81.6 Å²	81.6	65%	0.649	41%	0.413	S	S	*	.	S	Bend	trans	-126.6	-8.3	-169.1	-60.9	-69.8	0	0	0	116.6	A329	A329-F331 PolarHBondContact O-N 3.07Å
332	D	45.4	Very low	55.9	Low	113 Å²	113	83.3 Å²	83.3	60%	0.604	42%	0.421	S	S	*	.			trans	-138.9	126	-175.3	-110.8	-33.6	0	0	0	111.9	A334	D332-A334 HydrophobicContact CB-CB 3.9Å; D332-A334 PolarHBondContact O-N 2.85Å; D332-A334 VanDerWaalsContact O-N 3.1Å
333	E	44.1	Very low	56.1	Low	200 Å²	200	83.3 Å²	83.3	94%	0.935	42%	0.422	S	S	*	.			trans	-63.8	-0.9	163.9	-79.1	-172	162.2	0	0	112.2	S335	E333-S335 PolarHBondContact O-N 2.78Å
334	A	44.3	Very low	56.1	Low	51 Å²	51	79.7 Å²	79.7	42%	0.421	41%	0.411	S	S	.	.			trans	-54.6	114	175.5	0	0	0	0	0	109.7	D332 L336	D332-A334 HydrophobicContact CB-CB 3.9Å; D332-A334 PolarHBondContact O-N 2.85Å; D332-A334 VanDerWaalsContact O-N 3.1Å; A334-L336 PolarHBondContact O-N 3.29Å
335	S	47.7	Very low	56.5	Low	101 Å²	101	76.6 Å²	76.6	71%	0.706	39%	0.392	S	S	*	.			trans	-49.4	101.8	163.7	44.9	0	0	0	0	108.6	E333 E337	E333-S335 PolarHBondContact O-N 2.78Å; S335-E337 PolarHBondContact O-N 2.83Å
336	L	47.1	Very low	57.1	Low	46 Å²	46	76 Å²	76	24%	0.241	39%	0.389	C	S	.	.			trans	-61.3	109.2	175.5	-86.5	132.5	0	0	0	108.3	E325 A329 A334 F338	E325-L336 VanDerWaalsContact OE1-CB 3.28Å; E325-L336 WeakPolarHBondContact OE1-CB 3.4Å; A329-L336 HydrophobicContact CB-CD1 4.15Å; A334-L336 PolarHBondContact O-N 3.29Å; L336-F338 HydrophobicContact CB-CD2 3.69Å; L336-F338 HydrophobicContact CB-CE2 3.62Å; L336-F338 HydrophobicContact CD1-CE2 4.39Å; L336-F338 HydrophobicContact CD2-CD2 4.21Å; L336-F338 HydrophobicContact CD2-CE2 3.35Å; L336-F338 HydrophobicContact CD2-CZ 3.71Å; L336-F338 HydrophobicContact CG-CE2 3.94Å; L336-F338 PolarHBondContact O-N 3.37Å
337	E	50.8	Low	57.7	Low	193 Å²	193	75.5 Å²	75.5	90%	0.902	39%	0.387	S	S	*	.			trans	-76.3	76.2	172.3	-71.2	-171.8	163.1	0	0	109	S335	S335-E337 PolarHBondContact O-N 2.83Å
338	F	56.9	Low	58.2	Low	60 Å²	60	69.8 Å²	69.8	26%	0.263	36%	0.361	S	S	.	.			trans	-82.6	155	167.3	-77	-75.8	0	0	0	111.9	F321 T324 E325 L336 Q340	F321-F338 HydrophobicContact CD2-CD1 4.27Å; F321-F338 HydrophobicContact CD2-CG 4.4Å; F321-F338 HydrophobicContact CE2-CB 3.73Å; F321-F338 AromaticContact CE2-CD1 3.83Å; F321-F338 HydrophobicContact CE2-CD1 3.83Å; F321-F338 AromaticContact CE2-CD2 3.87Å; F321-F338 HydrophobicContact CE2-CD2 3.87Å; F321-F338 HydrophobicContact CE2-CE1 4.41Å; F321-F338 HydrophobicContact CE2-CE2 4.42Å; F321-F338 AromaticContact CE2-CG 3.53Å; F321-F338 HydrophobicContact CE2-CG 3.53Å; F321-F338 HydrophobicContact CZ-CB 4.26Å; F321-F338 HydrophobicContact CZ-CD2 4.02Å; F321-F338 HydrophobicContact CZ-CG 4.12Å; T324-F338 HydrophobicContact CG2-CE1 4.22Å; T324-F338 HydrophobicContact CG2-CZ 3.69Å; E325-F338 HydrophobicContact CG-CD2 4.2Å; E325-F338 HydrophobicContact CG-CE2 3.71Å; E325-F338 WeakPolarHBondContact OE1-CD2 3.41Å; E325-F338 WeakPolarHBondContact OE1-CE2 3.11Å; L336-F338 HydrophobicContact CB-CD2 3.69Å; L336-F338 HydrophobicContact CB-CE2 3.62Å; L336-F338 HydrophobicContact CD1-CE2 4.39Å; L336-F338 HydrophobicContact CD2-CD2 4.21Å; L336-F338 HydrophobicContact CD2-CE2 3.35Å; L336-F338 HydrophobicContact CD2-CZ 3.71Å; L336-F338 HydrophobicContact CG-CE2 3.94Å; L336-F338 PolarHBondContact O-N 3.37Å; F338-Q340 PolarHBondContact O-N 3.13Å
339	D	60.9	Low	59.1	Low	104 Å²	104	66.9 Å²	66.9	56%	0.556	34%	0.34	S	S	*	.			trans	-64.1	102.8	168.9	-168.5	-14.9	0	0	0	109.7	Y341 E342 L343	D339-Y341 PolarHBondContact O-N 3.11Å; D339-Y341 VanDerWaalsContact O-N 3.14Å; D339-Y341 VanDerWaalsContact OD1-CB 3.25Å; D339-Y341 WeakPolarHBondContact OD1-CB 3.46Å; D339-Y341 PolarHBondContact OD1-N 3.09Å; D339-E342 HydrophobicContact CB-CB 4.35Å; D339-E342 PolarHBondContact O-N 2.97Å; D339-L343 PolarHBondContact O-N 3.11Å
340	Q	63.6	Low	60.2	Low	87 Å²	87	66.4 Å²	66.4	41%	0.407	34%	0.336	S	S	.	.	H	α-helix	trans	-58.8	-26.2	179.7	-63.4	179.6	14.7	0	0	111.8	F338 I344 F453	F338-Q340 PolarHBondContact O-N 3.13Å; Q340-I344 WeakPolarHBondContact O-CB 3.28Å; Q340-I344 VanDerWaalsContact O-CD1 3.27Å; Q340-I344 WeakPolarHBondContact O-CD1 3.4Å; Q340-I344 WeakPolarHBondContact O-CG1 3.24Å; Q340-I344 PolarHBondContact O-N 3.24Å; Q340-F453 HydrophobicContact CG-CD1 4.12Å; Q340-F453 HydrophobicContact CG-CE1 3.84Å
341	Y	69.7	Low	61	Low	125 Å²	125	64 Å²	64	49%	0.49	32%	0.322	S	S	.	.	H	α-helix	trans	-72	-45.4	-178.7	-167.9	-93.9	0	0	0	111.9	D271 D339 L343 I344 S345	D271-Y341 HydrophobicContact CB-CE1 4.46Å; D271-Y341 PolarHBondContact OD2-OH 3.18Å; D339-Y341 PolarHBondContact O-N 3.11Å; D339-Y341 VanDerWaalsContact O-N 3.14Å; D339-Y341 VanDerWaalsContact OD1-CB 3.25Å; D339-Y341 WeakPolarHBondContact OD1-CB 3.46Å; D339-Y341 PolarHBondContact OD1-N 3.09Å; Y341-L343 PolarHBondContact O-N 2.78Å; Y341-I344 PolarHBondContact O-N 3.47Å; Y341-S345 VanDerWaalsContact O-CB 3.3Å; Y341-S345 WeakPolarHBondContact O-CB 3.45Å; Y341-S345 PolarHBondContact O-N 3.03Å
342	E	72.3	Confident	62.2	Low	56 Å²	56	61 Å²	61	26%	0.262	31%	0.306	S	S	.	.	H	α-helix	trans	-61.2	-45.7	178.1	175.7	168.7	-138	0	0	111.1	S270 D339 I344 S345 I346	S270-E342 PolarHBondContact OG-OE1 3.23Å; D339-E342 HydrophobicContact CB-CB 4.35Å; D339-E342 PolarHBondContact O-N 2.97Å; E342-I344 PolarHBondContact O-N 3.14Å; E342-S345 WeakPolarHBondContact O-CB 3.5Å; E342-S345 PolarHBondContact O-N 2.77Å; E342-I346 HydrophobicContact CG-CD1 3.74Å; E342-I346 HydrophobicContact CG-CG1 4.34Å; E342-I346 VanDerWaalsContact O-CG1 3.28Å; E342-I346 WeakPolarHBondContact O-CG1 3.35Å; E342-I346 PolarHBondContact O-N 3.12Å
343	L	69	Low	63.6	Low	5 Å²	5	56.8 Å²	56.8	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-47.6	177.8	-174.7	63.3	0	0	0	111.7	F321 D339 Y341 S345 I346 V347 F450 F453	F321-L343 HydrophobicContact CD1-CD1 3.46Å; F321-L343 VanDerWaalsContact CD1-CD1 3.46Å; F321-L343 HydrophobicContact CD2-CD1 4.01Å; F321-L343 HydrophobicContact CE1-CD1 3.4Å; F321-L343 VanDerWaalsContact CE1-CD1 3.4Å; F321-L343 HydrophobicContact CE1-CD2 3.78Å; F321-L343 HydrophobicContact CE1-CG 4.17Å; F321-L343 HydrophobicContact CE2-CB 4.26Å; F321-L343 HydrophobicContact CE2-CD1 3.94Å; F321-L343 HydrophobicContact CE2-CD2 4.29Å; F321-L343 HydrophobicContact CE2-CG 4.39Å; F321-L343 HydrophobicContact CG-CD1 3.79Å; F321-L343 HydrophobicContact CZ-CB 4.36Å; F321-L343 HydrophobicContact CZ-CD1 3.67Å; F321-L343 HydrophobicContact CZ-CD2 3.58Å; F321-L343 HydrophobicContact CZ-CG 4.06Å; D339-L343 PolarHBondContact O-N 3.11Å; Y341-L343 PolarHBondContact O-N 2.78Å; L343-S345 VanDerWaalsContact C-N 3.3Å; L343-S345 PolarHBondContact O-N 2.78Å; L343-I346 PolarHBondContact O-N 3.16Å; L343-V347 HydrophobicContact CD1-CG2 4.03Å; L343-V347 HydrophobicContact CG-CG2 4.28Å; L343-V347 WeakPolarHBondContact O-CB 3.49Å; L343-V347 WeakPolarHBondContact O-CG2 3.47Å; L343-V347 PolarHBondContact O-N 3.18Å; L343-F450 HydrophobicContact CD1-CD2 4.06Å; L343-F450 HydrophobicContact CD1-CE2 3.68Å; L343-F450 HydrophobicContact CD2-CD2 4.17Å; L343-F450 HydrophobicContact CD2-CE2 4.4Å; L343-F450 HydrophobicContact CG-CE2 4.29Å; L343-F453 HydrophobicContact CD2-CB 3.67Å; L343-F453 HydrophobicContact CD2-CD2 3.93Å; L343-F453 HydrophobicContact CD2-CG 3.84Å
344	I	67.3	Low	64.8	Low	41 Å²	41	53 Å²	53	21%	0.21	26%	0.263	C	S	.	.	H	α-helix	trans	-57.5	-47.5	178.3	-71.5	166.1	0	0	0	109.8	Q340 Y341 E342 V347 T348	Q340-I344 WeakPolarHBondContact O-CB 3.28Å; Q340-I344 VanDerWaalsContact O-CD1 3.27Å; Q340-I344 WeakPolarHBondContact O-CD1 3.4Å; Q340-I344 WeakPolarHBondContact O-CG1 3.24Å; Q340-I344 PolarHBondContact O-N 3.24Å; Y341-I344 PolarHBondContact O-N 3.47Å; E342-I344 PolarHBondContact O-N 3.14Å; I344-V347 PolarHBondContact O-N 3.1Å; I344-T348 PolarHBondContact O-N 3.37Å; I344-T348 PolarHBondContact O-OG1 2.97Å
345	S	76.3	Confident	65.8	Low	4 Å²	4	53.1 Å²	53.1	3%	0.028	26%	0.255	C	S	.	.	H	α-helix	trans	-59.2	-47.6	178.7	172.6	0	0	0	0	113	S270 Y272 M273 Y341 E342 L343 V347 T348 G349	S270-S345 WeakPolarHBondContact O-CB 3.42Å; S270-S345 PolarHBondContact O-OG 2.89Å; Y272-S345 WeakPolarHBondContact CD2-OG 3.25Å; Y272-S345 PolarHBondContact N-OG 3.28Å; M273-S345 PolarHBondContact N-OG 3.38Å; Y341-S345 VanDerWaalsContact O-CB 3.3Å; Y341-S345 WeakPolarHBondContact O-CB 3.45Å; Y341-S345 PolarHBondContact O-N 3.03Å; E342-S345 WeakPolarHBondContact O-CB 3.5Å; E342-S345 PolarHBondContact O-N 2.77Å; L343-S345 VanDerWaalsContact C-N 3.3Å; L343-S345 PolarHBondContact O-N 2.78Å; S345-V347 PolarHBondContact O-N 3.15Å; S345-T348 PolarHBondContact O-OG1 3.15Å; S345-G349 PolarHBondContact O-N 3.09Å
346	I	71.6	Confident	66.4	Low	2 Å²	2	51.3 Å²	51.3	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-45.6	176.9	-69.9	166.1	0	0	0	110.2	Y272 L314 A317 F318 E342 L343 G349 L350	Y272-I346 HydrophobicContact CD2-CB 4.47Å; Y272-I346 HydrophobicContact CD2-CG1 3.61Å; Y272-I346 HydrophobicContact CE2-CD1 4.18Å; Y272-I346 HydrophobicContact CE2-CG1 3.43Å; Y272-I346 VanDerWaalsContact CE2-CG1 3.43Å; L314-I346 VanDerWaalsContact CD2-CA 3.41Å; L314-I346 HydrophobicContact CD2-CB 4.12Å; L314-I346 HydrophobicContact CD2-CG1 4.29Å; L314-I346 HydrophobicContact CD2-CG2 4.11Å; L314-I346 WeakPolarHBondContact CD2-O 3.33Å; A317-I346 HydrophobicContact CB-CD1 3.74Å; A317-I346 HydrophobicContact CB-CG1 4.17Å; F318-I346 HydrophobicContact CB-CG2 3.66Å; F318-I346 HydrophobicContact CD2-CG2 4.22Å; F318-I346 HydrophobicContact CG-CG2 4.41Å; E342-I346 HydrophobicContact CG-CD1 3.74Å; E342-I346 HydrophobicContact CG-CG1 4.34Å; E342-I346 VanDerWaalsContact O-CG1 3.28Å; E342-I346 WeakPolarHBondContact O-CG1 3.35Å; E342-I346 PolarHBondContact O-N 3.12Å; L343-I346 PolarHBondContact O-N 3.16Å; I346-G349 PolarHBondContact O-N 2.87Å; I346-L350 HydrophobicContact CG2-CD1 4.18Å; I346-L350 WeakPolarHBondContact O-CG 3.25Å; I346-L350 PolarHBondContact O-N 3.35Å
347	V	66.4	Low	66.9	Low	2 Å²	2	58 Å²	58	1%	0.012	26%	0.257	C	S	.	.	H	α-helix	trans	-74.8	-46.4	-170.4	165.3	0	0	0	0	112.8	L343 I344 S345 G349 L350 L351 F450 R454 F459	L343-V347 HydrophobicContact CD1-CG2 4.03Å; L343-V347 HydrophobicContact CG-CG2 4.28Å; L343-V347 WeakPolarHBondContact O-CB 3.49Å; L343-V347 WeakPolarHBondContact O-CG2 3.47Å; L343-V347 PolarHBondContact O-N 3.18Å; I344-V347 PolarHBondContact O-N 3.1Å; S345-V347 PolarHBondContact O-N 3.15Å; V347-G349 PolarHBondContact O-N 3.48Å; V347-L350 PolarHBondContact O-N 3.26Å; V347-L351 PolarHBondContact O-N 3.49Å; V347-L351 VanDerWaalsContact O-N 3.16Å; V347-F450 HydrophobicContact CG2-CE2 3.56Å; V347-F450 HydrophobicContact CG2-CZ 3.56Å; V347-R454 HydrophobicContact CG1-CG 4.07Å; V347-R454 VanDerWaalsContact CG1-NE 3.27Å; V347-F459 HydrophobicContact CG1-CE2 3.84Å
348	T	68	Low	67.2	Low	5 Å²	5	48.9 Å²	48.9	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-36.4	172.2	41.2	0	0	0	0	110.4	I344 S345 L351 R352 F459 T462	I344-T348 PolarHBondContact O-N 3.37Å; I344-T348 PolarHBondContact O-OG1 2.97Å; S345-T348 PolarHBondContact O-OG1 3.15Å; T348-L351 PolarHBondContact O-N 2.95Å; T348-R352 WeakPolarHBondContact O-CB 3.13Å; T348-R352 PolarHBondContact O-N 3.49Å; T348-F459 HydrophobicContact CG2-CD2 4.08Å; T348-F459 HydrophobicContact CG2-CE2 4.37Å; T348-T462 HydrophobicContact CG2-CG2 4.33Å
349	G	75.2	Confident	66.9	Low	0 Å²	0	46.4 Å²	46.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.3	-50.3	174.4	0	0	0	0	0	113.1	S345 I346 V347 L351 R352 Q353	S345-G349 PolarHBondContact O-N 3.09Å; I346-G349 PolarHBondContact O-N 2.87Å; V347-G349 PolarHBondContact O-N 3.48Å; G349-L351 VanDerWaalsContact C-N 3.32Å; G349-L351 PolarHBondContact O-N 3.27Å; G349-R352 PolarHBondContact O-N 3.33Å; G349-Q353 WeakPolarHBondContact O-CB 3.49Å; G349-Q353 WeakPolarHBondContact O-CG 3.49Å; G349-Q353 PolarHBondContact O-N 3.4Å
350	L	72.1	Confident	66.9	Low	0 Å²	0	45.1 Å²	45.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-37.7	178.6	-75.8	173	0	0	0	113.2	L314 K315 F318 I346 V347 K354 Q355 F358	L314-L350 HydrophobicContact CB-CD2 3.74Å; L314-L350 HydrophobicContact CB-CG 4.01Å; K315-L350 HydrophobicContact CG-CD2 3.84Å; F318-L350 HydrophobicContact CB-CD1 3.78Å; F318-L350 HydrophobicContact CD1-CD1 4.28Å; F318-L350 HydrophobicContact CD2-CD1 4.2Å; F318-L350 HydrophobicContact CG-CD1 3.78Å; I346-L350 HydrophobicContact CG2-CD1 4.18Å; I346-L350 WeakPolarHBondContact O-CG 3.25Å; I346-L350 PolarHBondContact O-N 3.35Å; V347-L350 PolarHBondContact O-N 3.26Å; L350-K354 PolarHBondContact O-N 3.42Å; L350-Q355 HydrophobicContact CD2-CB 4.41Å; L350-Q355 PolarHBondContact O-N 3.47Å; L350-Q355 VanDerWaalsContact O-N 3.07Å; L350-F358 HydrophobicContact CB-CD1 3.72Å; L350-F358 HydrophobicContact CB-CE1 3.9Å; L350-F358 HydrophobicContact CD1-CB 4.18Å; L350-F358 HydrophobicContact CD1-CD1 3.8Å; L350-F358 HydrophobicContact CD1-CD2 4.42Å; L350-F358 HydrophobicContact CD1-CE1 4.44Å; L350-F358 HydrophobicContact CD1-CG 3.88Å; L350-F358 HydrophobicContact CD2-CD1 4.37Å; L350-F358 HydrophobicContact CG-CD1 4.18Å
351	L	65.2	Low	66.7	Low	0 Å²	0	42.8 Å²	42.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-69.8	-43.2	176.8	-75.5	-178.3	0	0	0	112.6	V347 T348 G349 Q353 K354 F356 F358 F459 L463	V347-L351 PolarHBondContact O-N 3.49Å; V347-L351 VanDerWaalsContact O-N 3.16Å; T348-L351 PolarHBondContact O-N 2.95Å; G349-L351 VanDerWaalsContact C-N 3.32Å; G349-L351 PolarHBondContact O-N 3.27Å; L351-Q353 PolarHBondContact O-N 3.12Å; L351-K354 WeakPolarHBondContact O-CA 3.31Å; L351-K354 PolarHBondContact O-N 3.12Å; L351-F356 HydrophobicContact CD2-CD1 4.24Å; L351-F356 HydrophobicContact CD2-CE1 4.04Å; L351-F358 HydrophobicContact CD2-CE1 4.38Å; L351-F459 HydrophobicContact CD1-CE2 3.69Å; L351-F459 HydrophobicContact CD1-CZ 3.41Å; L351-F459 VanDerWaalsContact CD1-CZ 3.41Å; L351-L463 HydrophobicContact CB-CD2 3.91Å; L351-L463 HydrophobicContact CD1-CD1 3.57Å; L351-L463 HydrophobicContact CD1-CD2 3.59Å; L351-L463 HydrophobicContact CD1-CG 4.2Å; L351-L463 HydrophobicContact CG-CD2 4.44Å
352	R	72.3	Confident	66.1	Low	85 Å²	85	37.1 Å²	37.1	32%	0.321	17%	0.168	S	C	.	.	H	α-helix	trans	-60.9	-36.2	176.5	-171.1	175.7	-176.7	131.4	-6.3	111.7	E277 S280 T348 G349 K354 E467	E277-R352 IonicContact OE1-NH1 3.42Å; E277-R352 PolarHBondContact OE1-NH1 2.81Å; S280-R352 PolarHBondContact OG-NH2 3.35Å; T348-R352 WeakPolarHBondContact O-CB 3.13Å; T348-R352 PolarHBondContact O-N 3.49Å; G349-R352 PolarHBondContact O-N 3.33Å; R352-K354 PolarHBondContact O-N 3Å; R352-E467 WeakPolarHBondContact CA-OE1 3.26Å
353	Q	75.3	Confident	65.5	Low	25 Å²	25	37.7 Å²	37.7	12%	0.117	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	1.6	172.3	-70.5	-58.7	-35.2	0	0	114	L276 E307 T311 G349 L351 Q355	L276-Q353 HydrophobicContact CD1-CG 3.9Å; L276-Q353 HydrophobicContact CD2-CG 4.33Å; E307-Q353 PolarHBondContact OE1-NE2 3.31Å; E307-Q353 PolarHBondContact OE1-OE1 2.97Å; T311-Q353 WeakPolarHBondContact OG1-CG 3.49Å; T311-Q353 PolarHBondContact OG1-OE1 3.02Å; G349-Q353 WeakPolarHBondContact O-CB 3.49Å; G349-Q353 WeakPolarHBondContact O-CG 3.49Å; G349-Q353 PolarHBondContact O-N 3.4Å; L351-Q353 PolarHBondContact O-N 3.12Å; Q353-Q355 HydrophobicContact CB-CG 3.85Å; Q353-Q355 PolarHBondContact O-N 2.73Å
354	K	69.1	Low	65.2	Low	121 Å²	121	41.3 Å²	41.3	53%	0.526	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	26.3	-177.7	-55.1	-172.7	-179	-163.7	0	112.6	L350 L351 R352 F356 E466	L350-K354 PolarHBondContact O-N 3.42Å; L351-K354 WeakPolarHBondContact O-CA 3.31Å; L351-K354 PolarHBondContact O-N 3.12Å; R352-K354 PolarHBondContact O-N 3Å; K354-F356 HydrophobicContact CB-CE2 3.82Å; K354-F356 HydrophobicContact CB-CZ 4.27Å; K354-F356 WeakPolarHBondContact O-CD2 3.47Å; K354-F356 WeakPolarHBondContact O-CE2 3.48Å; K354-F356 PolarHBondContact O-N 3.06Å; K354-E466 IonicContact NZ-OE2 3.92Å; K354-E466 PolarHBondContact NZ-OE2 2.78Å
355	Q	65.9	Low	65	Low	53 Å²	53	40.1 Å²	40.1	25%	0.248	18%	0.183	C	C	.	.			trans	-84.1	60.6	-176.9	-71	-69.7	-31.8	0	0	111	T311 K315 L350 Q353 R357 F358	T311-Q355 HydrophobicContact CG2-CG 3.63Å; K315-Q355 VanDerWaalsContact CE-OE1 3.27Å; L350-Q355 HydrophobicContact CD2-CB 4.41Å; L350-Q355 PolarHBondContact O-N 3.47Å; L350-Q355 VanDerWaalsContact O-N 3.07Å; Q353-Q355 HydrophobicContact CB-CG 3.85Å; Q353-Q355 PolarHBondContact O-N 2.73Å; Q355-R357 PolarHBondContact O-N 2.98Å; Q355-F358 WeakPolarHBondContact O-CD1 3.26Å; Q355-F358 WeakPolarHBondContact O-CE1 3.43Å; Q355-F358 PolarHBondContact O-N 2.8Å
356	F	59.2	Low	64.1	Low	63 Å²	63	40.2 Å²	40.2	28%	0.276	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-17.1	-178	-51.6	-73	0	0	0	113.7	L351 K354 F358 C359	L351-F356 HydrophobicContact CD2-CD1 4.24Å; L351-F356 HydrophobicContact CD2-CE1 4.04Å; K354-F356 HydrophobicContact CB-CE2 3.82Å; K354-F356 HydrophobicContact CB-CZ 4.27Å; K354-F356 WeakPolarHBondContact O-CD2 3.47Å; K354-F356 WeakPolarHBondContact O-CE2 3.48Å; K354-F356 PolarHBondContact O-N 3.06Å; F356-F358 VanDerWaalsContact C-N 3.26Å; F356-F358 PolarHBondContact O-N 3.3Å; F356-C359 PolarHBondContact O-N 2.97Å
357	R	58.4	Low	63.6	Low	188 Å²	188	40.6 Å²	40.6	71%	0.709	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-11.1	176.5	-66.5	-167.1	-176.6	171.8	1.2	115.2	Q355 C359 D360 S361	Q355-R357 PolarHBondContact O-N 2.98Å; R357-C359 PolarHBondContact O-N 3.17Å; R357-C359 VanDerWaalsContact O-N 3.07Å; R357-D360 WeakPolarHBondContact O-CB 2.79Å; R357-D360 PolarHBondContact O-N 3.09Å; R357-S361 PolarHBondContact O-N 3.21Å; R357-S361 PolarHBondContact O-OG 2.96Å
358	F	56.5	Low	63.5	Low	1 Å²	1	42.4 Å²	42.4	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-58.9	-20.9	171.5	71.2	-103.5	0	0	0	111.2	F318 L350 L351 Q355 F356 S361 I362 R454 M474	F318-F358 HydrophobicContact CD1-CB 4.3Å; F318-F358 HydrophobicContact CD1-CD2 4.21Å; F318-F358 HydrophobicContact CE1-CB 4.42Å; F318-F358 AromaticContact CE1-CD2 3.71Å; F318-F358 HydrophobicContact CE1-CD2 3.71Å; F318-F358 HydrophobicContact CE1-CG 4.43Å; F318-F358 AromaticContact CZ-CD2 4Å; F318-F358 HydrophobicContact CZ-CD2 4Å; F318-F358 HydrophobicContact CZ-CE2 4.41Å; L350-F358 HydrophobicContact CB-CD1 3.72Å; L350-F358 HydrophobicContact CB-CE1 3.9Å; L350-F358 HydrophobicContact CD1-CB 4.18Å; L350-F358 HydrophobicContact CD1-CD1 3.8Å; L350-F358 HydrophobicContact CD1-CD2 4.42Å; L350-F358 HydrophobicContact CD1-CE1 4.44Å; L350-F358 HydrophobicContact CD1-CG 3.88Å; L350-F358 HydrophobicContact CD2-CD1 4.37Å; L350-F358 HydrophobicContact CG-CD1 4.18Å; L351-F358 HydrophobicContact CD2-CE1 4.38Å; Q355-F358 WeakPolarHBondContact O-CD1 3.26Å; Q355-F358 WeakPolarHBondContact O-CE1 3.43Å; Q355-F358 PolarHBondContact O-N 2.8Å; F356-F358 VanDerWaalsContact C-N 3.26Å; F356-F358 PolarHBondContact O-N 3.3Å; F358-S361 CarbonylContact O-C 3.58Å; F358-S361 WeakPolarHBondContact O-CA 3.28Å; F358-S361 WeakPolarHBondContact O-CB 3.31Å; F358-S361 PolarHBondContact O-N 3.27Å; F358-S361 VanDerWaalsContact O-N 3.15Å; F358-I362 HydrophobicContact CD2-CD1 4.14Å; F358-I362 HydrophobicContact CE2-CD1 4.16Å; F358-I362 PolarHBondContact O-N 3.23Å; F358-R454 VanDerWaalsContact CZ-NH2 3.33Å; F358-M474 HydrophobicContact CZ-CE 4.49Å; F358-M474 HydrophobicContact CZ-SD 4.05Å
359	C	51.8	Low	63	Low	8 Å²	8	43 Å²	43	5%	0.054	20%	0.203	C	C	.	.	H	α-helix	trans	-74.1	-30.7	173.4	-76.5	0	0	0	0	114.6	F356 R357 S361 I362 K363 M474 I478	F356-C359 PolarHBondContact O-N 2.97Å; R357-C359 PolarHBondContact O-N 3.17Å; R357-C359 VanDerWaalsContact O-N 3.07Å; C359-S361 PolarHBondContact O-N 2.96Å; C359-I362 CarbonylContact O-C 3.6Å; C359-I362 WeakPolarHBondContact O-CA 3.28Å; C359-I362 VanDerWaalsContact O-CB 3.31Å; C359-I362 WeakPolarHBondContact O-CB 3.41Å; C359-I362 PolarHBondContact O-N 2.87Å; C359-K363 PolarHBondContact O-N 3.45Å; C359-M474 HydrophobicContact CB-CG 3.65Å; C359-M474 HydrophobicContact CB-SD 3.94Å; C359-M474 VanDerWaalsContact SG-CE 3.59Å; C359-M474 VanDerWaalsContact SG-CG 3.52Å; C359-M474 PolarHBondContact SG-SD 3.36Å; C359-I478 HydrophobicContact CB-CD1 4.07Å
360	D	59.5	Low	62	Low	77 Å²	77	43.3 Å²	43.3	41%	0.412	21%	0.205	S	C	.	.	H	α-helix	trans	-60.8	-34.3	166.1	-59.7	-37.8	0	0	0	109.4	R357 K363 N364	R357-D360 WeakPolarHBondContact O-CB 2.79Å; R357-D360 PolarHBondContact O-N 3.09Å; D360-K363 PolarHBondContact O-N 2.92Å; D360-N364 WeakPolarHBondContact O-CB 3.25Å; D360-N364 PolarHBondContact O-N 3.21Å; D360-N364 PolarHBondContact O-ND2 3.41Å; D360-N364 VanDerWaalsContact O-ND2 3.16Å
361	S	60.6	Low	61.6	Low	38 Å²	38	46.4 Å²	46.4	27%	0.266	22%	0.219	S	C	.	.	H	α-helix	trans	-68.5	-38.7	172.7	-38	0	0	0	0	111.9	R357 F358 C359 N364 E365	R357-S361 PolarHBondContact O-N 3.21Å; R357-S361 PolarHBondContact O-OG 2.96Å; F358-S361 CarbonylContact O-C 3.58Å; F358-S361 WeakPolarHBondContact O-CA 3.28Å; F358-S361 WeakPolarHBondContact O-CB 3.31Å; F358-S361 PolarHBondContact O-N 3.27Å; F358-S361 VanDerWaalsContact O-N 3.15Å; C359-S361 PolarHBondContact O-N 2.96Å; S361-N364 PolarHBondContact O-N 2.82Å; S361-E365 WeakPolarHBondContact O-CB 3.36Å; S361-E365 PolarHBondContact O-N 3.38Å
362	I	55.4	Low	61.3	Low	5 Å²	5	49.7 Å²	49.7	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-57.7	-49.1	169.8	-67.7	178.6	0	0	0	110.7	F318 F322 F358 C359 E365 V366 L447 F450	F318-I362 HydrophobicContact CE1-CD1 3.98Å; F318-I362 HydrophobicContact CE1-CG1 3.57Å; F318-I362 HydrophobicContact CZ-CD1 3.59Å; F318-I362 HydrophobicContact CZ-CG1 3.65Å; F322-I362 HydrophobicContact CD2-CG1 4.44Å; F322-I362 HydrophobicContact CE1-CG2 4.39Å; F322-I362 HydrophobicContact CE2-CD1 4.41Å; F322-I362 HydrophobicContact CE2-CG1 4.14Å; F322-I362 HydrophobicContact CE2-CG2 3.91Å; F322-I362 HydrophobicContact CZ-CB 4.41Å; F322-I362 HydrophobicContact CZ-CG1 4.48Å; F322-I362 HydrophobicContact CZ-CG2 3.6Å; F358-I362 HydrophobicContact CD2-CD1 4.14Å; F358-I362 HydrophobicContact CE2-CD1 4.16Å; F358-I362 PolarHBondContact O-N 3.23Å; C359-I362 CarbonylContact O-C 3.6Å; C359-I362 WeakPolarHBondContact O-CA 3.28Å; C359-I362 VanDerWaalsContact O-CB 3.31Å; C359-I362 WeakPolarHBondContact O-CB 3.41Å; C359-I362 PolarHBondContact O-N 2.87Å; I362-E365 PolarHBondContact O-N 2.77Å; I362-V366 HydrophobicContact CG2-CG2 4.15Å; I362-V366 WeakPolarHBondContact O-CB 3.44Å; I362-V366 VanDerWaalsContact O-CG2 3.29Å; I362-V366 WeakPolarHBondContact O-CG2 3.45Å; I362-V366 PolarHBondContact O-N 3.22Å; I362-L447 HydrophobicContact CG2-CD2 3.47Å; I362-L447 VanDerWaalsContact CG2-CD2 3.47Å; I362-F450 HydrophobicContact CD1-CE1 4.42Å
363	K	60.3	Low	60.6	Low	69 Å²	69	47.8 Å²	47.8	30%	0.3	24%	0.236	S	C	.	.	H	α-helix	trans	-56.7	-53.8	177.4	177.7	-171.9	-172.6	165.7	0	110.6	C359 D360 E365 V366 L367 D481	C359-K363 PolarHBondContact O-N 3.45Å; D360-K363 PolarHBondContact O-N 2.92Å; K363-E365 PolarHBondContact O-N 2.85Å; K363-V366 PolarHBondContact O-N 3.26Å; K363-L367 HydrophobicContact CG-CD1 4.04Å; K363-L367 HydrophobicContact CG-CG 4.48Å; K363-L367 WeakPolarHBondContact O-CB 3.36Å; K363-L367 VanDerWaalsContact O-CG 3.26Å; K363-L367 WeakPolarHBondContact O-CG 3.38Å; K363-L367 PolarHBondContact O-N 2.86Å; K363-D481 VanDerWaalsContact CD-OD2 3.31Å; K363-D481 WeakPolarHBondContact CD-OD2 3.29Å; K363-D481 WeakPolarHBondContact CE-OD2 3.43Å; K363-D481 IonicContact NZ-OD1 2.82Å; K363-D481 PolarHBondContact NZ-OD1 3.07Å; K363-D481 IonicContact NZ-OD2 3.2Å; K363-D481 PolarHBondContact NZ-OD2 3.39Å
364	N	63.3	Low	59.8	Low	80 Å²	80	47 Å²	47	43%	0.428	23%	0.232	S	C	.	.	H	α-helix	trans	-58.4	-36.1	179.2	-70.4	-26	0	0	0	111.8	D360 S361 A368	D360-N364 WeakPolarHBondContact O-CB 3.25Å; D360-N364 PolarHBondContact O-N 3.21Å; D360-N364 PolarHBondContact O-ND2 3.41Å; D360-N364 VanDerWaalsContact O-ND2 3.16Å; S361-N364 PolarHBondContact O-N 2.82Å; N364-A368 VanDerWaalsContact O-CB 3.23Å; N364-A368 WeakPolarHBondContact O-CB 3.5Å; N364-A368 PolarHBondContact O-N 3.48Å
365	E	63.2	Low	59.5	Low	17 Å²	17	48.6 Å²	48.6	8%	0.079	24%	0.235	C	C	.	.	H	α-helix	trans	-76	-44	179.6	-158.9	62.6	-142.5	0	0	111.7	F322 R323 S361 I362 K363 L367 A368 L369	F322-E365 HydrophobicContact CD1-CB 4.05Å; F322-E365 HydrophobicContact CD1-CG 3.78Å; F322-E365 HydrophobicContact CE1-CB 4.16Å; F322-E365 HydrophobicContact CE1-CG 4.27Å; R323-E365 HydrophobicContact CG-CG 4.11Å; R323-E365 WeakPolarHBondContact CG-OE1 3.41Å; R323-E365 IonicContact CZ-OE1 3.19Å; R323-E365 IonicContact CZ-OE2 3.5Å; R323-E365 IonicContact NE-OE1 2.76Å; R323-E365 PolarHBondContact NE-OE1 2.82Å; R323-E365 IonicContact NE-OE2 2.75Å; R323-E365 PolarHBondContact NE-OE2 3.21Å; R323-E365 VanDerWaalsContact NE-OE2 3.11Å; R323-E365 IonicContact NH2-OE1 2.74Å; R323-E365 PolarHBondContact NH2-OE1 2.8Å; R323-E365 IonicContact NH2-OE2 3.49Å; R323-E365 PolarHBondContact NH2-OE2 2.87Å; S361-E365 WeakPolarHBondContact O-CB 3.36Å; S361-E365 PolarHBondContact O-N 3.38Å; I362-E365 PolarHBondContact O-N 2.77Å; K363-E365 PolarHBondContact O-N 2.85Å; E365-L367 VanDerWaalsContact C-N 3.29Å; E365-L367 PolarHBondContact O-N 3.38Å; E365-A368 CarbonylContact O-C 3.6Å; E365-A368 WeakPolarHBondContact O-CA 3.42Å; E365-A368 WeakPolarHBondContact O-CB 3.47Å; E365-A368 PolarHBondContact O-N 3.46Å; E365-L369 HydrophobicContact CG-CD1 3.92Å; E365-L369 HydrophobicContact CG-CG 4.49Å; E365-L369 VanDerWaalsContact O-CB 3.32Å; E365-L369 WeakPolarHBondContact O-CB 3.45Å; E365-L369 VanDerWaalsContact O-CD1 3.24Å; E365-L369 WeakPolarHBondContact O-CD1 3.33Å; E365-L369 WeakPolarHBondContact O-CG 3.37Å; E365-L369 PolarHBondContact O-N 2.89Å
366	V	57.4	Low	59.1	Low	5 Å²	5	51 Å²	51	3%	0.03	25%	0.246	C	C	.	.	H	α-helix	trans	-54.6	-48.6	170.9	169	0	0	0	0	109.4	F322 F326 I362 K363 A368 L369 L370 A443 F482	F322-V366 HydrophobicContact CE1-CG2 3.9Å; F322-V366 HydrophobicContact CZ-CG2 3.8Å; F326-V366 HydrophobicContact CE1-CG2 4.14Å; F326-V366 HydrophobicContact CZ-CG2 4.03Å; I362-V366 HydrophobicContact CG2-CG2 4.15Å; I362-V366 WeakPolarHBondContact O-CB 3.44Å; I362-V366 VanDerWaalsContact O-CG2 3.29Å; I362-V366 WeakPolarHBondContact O-CG2 3.45Å; I362-V366 PolarHBondContact O-N 3.22Å; K363-V366 PolarHBondContact O-N 3.26Å; V366-A368 PolarHBondContact O-N 2.94Å; V366-L369 PolarHBondContact O-N 2.91Å; V366-L370 HydrophobicContact CG1-CD1 3.87Å; V366-L370 HydrophobicContact CG1-CG 4.4Å; V366-L370 WeakPolarHBondContact O-CB 3.49Å; V366-L370 WeakPolarHBondContact O-CG 3.31Å; V366-L370 PolarHBondContact O-N 3.21Å; V366-A443 HydrophobicContact CG1-CB 3.77Å; V366-F482 HydrophobicContact CG1-CZ 4.17Å
367	L	61.5	Low	58.9	Low	11 Å²	11	50.5 Å²	50.5	6%	0.058	25%	0.249	C	C	.	.	H	α-helix	trans	-60.6	-41.2	174.4	-68.4	175.8	0	0	0	112.6	K363 E365 L369 L370 K371 M402 I404 L485	K363-L367 HydrophobicContact CG-CD1 4.04Å; K363-L367 HydrophobicContact CG-CG 4.48Å; K363-L367 WeakPolarHBondContact O-CB 3.36Å; K363-L367 VanDerWaalsContact O-CG 3.26Å; K363-L367 WeakPolarHBondContact O-CG 3.38Å; K363-L367 PolarHBondContact O-N 2.86Å; E365-L367 VanDerWaalsContact C-N 3.29Å; E365-L367 PolarHBondContact O-N 3.38Å; L367-L369 VanDerWaalsContact C-N 3.31Å; L367-L369 PolarHBondContact O-N 3.31Å; L367-L370 HydrophobicContact CD2-CD1 4.22Å; L367-L370 PolarHBondContact O-N 2.84Å; L367-K371 PolarHBondContact O-N 3.39Å; L367-M402 HydrophobicContact CD2-CE 4.26Å; L367-I404 HydrophobicContact CB-CG1 4.24Å; L367-I404 HydrophobicContact CD2-CG1 4.13Å; L367-L485 HydrophobicContact CD2-CD1 4.15Å; L367-L485 HydrophobicContact CD2-CD2 4.06Å
368	A	64.4	Low	58.7	Low	40 Å²	40	41.7 Å²	41.7	33%	0.331	22%	0.216	S	C	.	.	H	α-helix	trans	-66.9	-31.7	177.1	0	0	0	0	0	112.8	N364 E365 V366 P372	N364-A368 VanDerWaalsContact O-CB 3.23Å; N364-A368 WeakPolarHBondContact O-CB 3.5Å; N364-A368 PolarHBondContact O-N 3.48Å; E365-A368 CarbonylContact O-C 3.6Å; E365-A368 WeakPolarHBondContact O-CA 3.42Å; E365-A368 WeakPolarHBondContact O-CB 3.47Å; E365-A368 PolarHBondContact O-N 3.46Å; V366-A368 PolarHBondContact O-N 2.94Å; A368-P372 WeakPolarHBondContact O-CD 3.48Å
369	L	56.8	Low	58.8	Low	17 Å²	17	45.5 Å²	45.5	9%	0.089	24%	0.235	C	C	.	.	H	α-helix	trans	-81.3	-25.6	177.8	-69.7	159	0	0	0	112.4	F322 F326 Q327 E365 V366 L367 K371 P372	F322-L369 HydrophobicContact CD1-CD1 4.33Å; F322-L369 HydrophobicContact CE1-CD1 4.2Å; F326-L369 HydrophobicContact CB-CD1 3.23Å; F326-L369 HydrophobicContact CB-CD2 3.89Å; F326-L369 HydrophobicContact CB-CG 4.12Å; F326-L369 HydrophobicContact CD1-CB 4.46Å; F326-L369 HydrophobicContact CD1-CD1 3.51Å; F326-L369 HydrophobicContact CD2-CD1 4.2Å; F326-L369 HydrophobicContact CE1-CD1 4.34Å; F326-L369 HydrophobicContact CG-CD1 3.39Å; Q327-L369 HydrophobicContact CG-CD2 3.92Å; E365-L369 HydrophobicContact CG-CD1 3.92Å; E365-L369 HydrophobicContact CG-CG 4.49Å; E365-L369 VanDerWaalsContact O-CB 3.32Å; E365-L369 WeakPolarHBondContact O-CB 3.45Å; E365-L369 VanDerWaalsContact O-CD1 3.24Å; E365-L369 WeakPolarHBondContact O-CD1 3.33Å; E365-L369 WeakPolarHBondContact O-CG 3.37Å; E365-L369 PolarHBondContact O-N 2.89Å; V366-L369 PolarHBondContact O-N 2.91Å; L367-L369 VanDerWaalsContact C-N 3.31Å; L367-L369 PolarHBondContact O-N 3.31Å; L369-K371 VanDerWaalsContact C-N 3.34Å; L369-P372 VanDerWaalsContact O-CD 3.23Å; L369-P372 WeakPolarHBondContact O-CD 3.29Å; L369-P372 VanDerWaalsContact O-CG 3.26Å; L369-P372 WeakPolarHBondContact O-CG 3.43Å
370	L	54.6	Low	58.9	Low	6 Å²	6	49 Å²	49	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-67.4	-34.7	171.2	-73.1	166.2	0	0	0	112.1	V366 L367 L373 V374 M402 I439 L485	V366-L370 HydrophobicContact CG1-CD1 3.87Å; V366-L370 HydrophobicContact CG1-CG 4.4Å; V366-L370 WeakPolarHBondContact O-CB 3.49Å; V366-L370 WeakPolarHBondContact O-CG 3.31Å; V366-L370 PolarHBondContact O-N 3.21Å; L367-L370 HydrophobicContact CD2-CD1 4.22Å; L367-L370 PolarHBondContact O-N 2.84Å; L370-L373 PolarHBondContact O-N 2.85Å; L370-L373 VanDerWaalsContact O-N 3.14Å; L370-V374 WeakPolarHBondContact O-CG2 3.44Å; L370-V374 PolarHBondContact O-N 3.46Å; L370-M402 HydrophobicContact CB-CE 3.15Å; L370-M402 HydrophobicContact CB-SD 4.28Å; L370-M402 HydrophobicContact CD1-CE 3.19Å; L370-M402 HydrophobicContact CD2-CE 4.14Å; L370-M402 HydrophobicContact CG-CE 3.59Å; L370-I439 HydrophobicContact CD2-CB 3.4Å; L370-I439 VanDerWaalsContact CD2-CB 3.4Å; L370-I439 HydrophobicContact CD2-CD1 4.07Å; L370-I439 HydrophobicContact CD2-CG1 4.33Å; L370-I439 HydrophobicContact CD2-CG2 3.04Å; L370-I439 HydrophobicContact CG-CG2 4.4Å; L370-L485 HydrophobicContact CD1-CD2 4.18Å
371	K	62.3	Low	58.6	Low	66 Å²	66	50 Å²	50	29%	0.287	26%	0.263	S	S	.	.	H	α-helix	trans	-51	-54.8	177.1	-69.3	178.3	-178.7	-178.4	0	113.8	L367 L369 L373 R375 I404	L367-K371 PolarHBondContact O-N 3.39Å; L369-K371 VanDerWaalsContact C-N 3.34Å; K371-L373 VanDerWaalsContact C-N 3.33Å; K371-L373 PolarHBondContact O-N 3.26Å; K371-R375 WeakPolarHBondContact O-CB 3.45Å; K371-R375 PolarHBondContact O-N 3.01Å; K371-I404 VanDerWaalsContact CE-CG2 3.47Å; K371-I404 HydrophobicContact CG-CD1 3.91Å
372	P	59.9	Low	58.3	Low	69 Å²	69	49.4 Å²	49.4	45%	0.448	26%	0.255	S	S	.	.	H	α-helix	trans	-66.1	-32.1	178.5	22.5	-31.5	0	0	0	113.1	A368 L369 R375 Q376	A368-P372 WeakPolarHBondContact O-CD 3.48Å; L369-P372 VanDerWaalsContact O-CD 3.23Å; L369-P372 WeakPolarHBondContact O-CD 3.29Å; L369-P372 VanDerWaalsContact O-CG 3.26Å; L369-P372 WeakPolarHBondContact O-CG 3.43Å; P372-R375 PolarHBondContact O-N 3.39Å; P372-Q376 WeakPolarHBondContact O-CB 3.46Å; P372-Q376 PolarHBondContact O-N 3.22Å
373	L	57.6	Low	58.3	Low	44 Å²	44	53.1 Å²	53.1	23%	0.23	28%	0.281	C	S	.	.	H	α-helix	trans	-65.6	-50.1	175.9	-76	159.6	0	0	0	111.3	V330 L370 K371 R375 Q376 V377 I439	V330-L373 HydrophobicContact CG1-CD2 3.98Å; L370-L373 PolarHBondContact O-N 2.85Å; L370-L373 VanDerWaalsContact O-N 3.14Å; K371-L373 VanDerWaalsContact C-N 3.33Å; K371-L373 PolarHBondContact O-N 3.26Å; L373-R375 VanDerWaalsContact C-N 3.29Å; L373-R375 PolarHBondContact O-N 3.06Å; L373-Q376 PolarHBondContact O-N 3.42Å; L373-Q376 VanDerWaalsContact O-N 3.16Å; L373-V377 WeakPolarHBondContact O-CG2 3.43Å; L373-V377 PolarHBondContact O-N 2.94Å; L373-V377 VanDerWaalsContact O-N 3.11Å; L373-I439 HydrophobicContact CB-CD1 4.33Å; L373-I439 HydrophobicContact CB-CG2 4.28Å; L373-I439 HydrophobicContact CD1-CG2 3.48Å; L373-I439 VanDerWaalsContact CD1-CG2 3.48Å; L373-I439 HydrophobicContact CG-CG2 4.4Å
374	V	58.9	Low	57.9	Low	8 Å²	8	55.9 Å²	55.9	5%	0.048	30%	0.299	C	S	.	.	H	α-helix	trans	-55.7	-46.4	173.6	169.8	0	0	0	0	110.6	L370 Q376 V377 L378 Y395 A398 M402 L432 I439	L370-V374 WeakPolarHBondContact O-CG2 3.44Å; L370-V374 PolarHBondContact O-N 3.46Å; V374-Q376 PolarHBondContact O-N 2.92Å; V374-V377 PolarHBondContact O-N 3.33Å; V374-L378 HydrophobicContact CG1-CD1 3.65Å; V374-L378 HydrophobicContact CG1-CG 4.33Å; V374-L378 WeakPolarHBondContact O-CB 3.37Å; V374-L378 WeakPolarHBondContact O-CG 3.48Å; V374-L378 PolarHBondContact O-N 3.48Å; V374-Y395 HydrophobicContact CG1-CD2 4.3Å; V374-A398 HydrophobicContact CG1-CB 3.53Å; V374-M402 HydrophobicContact CG2-SD 3.91Å; V374-L432 HydrophobicContact CG1-CD2 4.49Å; V374-I439 HydrophobicContact CG2-CD1 4.12Å
375	R	61.6	Low	57.3	Low	155 Å²	155	55.4 Å²	55.4	59%	0.585	31%	0.313	S	S	*	.	H	α-helix	trans	-59.7	-44.2	177.5	-176.5	176.1	177.2	172.5	0.3	112.2	K371 P372 L373 V377 I379 Y395	K371-R375 WeakPolarHBondContact O-CB 3.45Å; K371-R375 PolarHBondContact O-N 3.01Å; P372-R375 PolarHBondContact O-N 3.39Å; L373-R375 VanDerWaalsContact C-N 3.29Å; L373-R375 PolarHBondContact O-N 3.06Å; R375-V377 VanDerWaalsContact C-N 3.31Å; R375-V377 PolarHBondContact O-N 2.71Å; R375-I379 HydrophobicContact CG-CD1 3.81Å; R375-I379 HydrophobicContact CG-CG1 4.41Å; R375-I379 VanDerWaalsContact O-CD1 3.32Å; R375-I379 WeakPolarHBondContact O-CD1 3.34Å; R375-I379 WeakPolarHBondContact O-CG1 3.47Å; R375-I379 PolarHBondContact O-N 2.8Å; R375-I379 VanDerWaalsContact O-N 3.12Å; R375-Y395 HydrophobicContact CB-CD2 4.08Å; R375-Y395 HydrophobicContact CB-CE2 3.92Å
376	Q	57.2	Low	56.7	Low	103 Å²	103	59 Å²	59	48%	0.481	34%	0.34	S	S	.	.	H	α-helix	trans	-67.1	-32.4	-177.4	-170.1	174.7	6.2	0	0	112.3	P372 L373 V374 P380	P372-Q376 WeakPolarHBondContact O-CB 3.46Å; P372-Q376 PolarHBondContact O-N 3.22Å; L373-Q376 PolarHBondContact O-N 3.42Å; L373-Q376 VanDerWaalsContact O-N 3.16Å; V374-Q376 PolarHBondContact O-N 2.92Å; Q376-P380 WeakPolarHBondContact O-CD 3.43Å
377	V	54.8	Low	56.5	Low	54 Å²	54	60.9 Å²	60.9	33%	0.327	35%	0.35	S	S	.	.	H	α-helix	trans	-83.4	-33.4	178.6	-172.8	0	0	0	0	112.7	L373 V374 R375 P380 L435	L373-V377 WeakPolarHBondContact O-CG2 3.43Å; L373-V377 PolarHBondContact O-N 2.94Å; L373-V377 VanDerWaalsContact O-N 3.11Å; V374-V377 PolarHBondContact O-N 3.33Å; R375-V377 VanDerWaalsContact C-N 3.31Å; R375-V377 PolarHBondContact O-N 2.71Å; V377-P380 WeakPolarHBondContact O-CD 3.44Å; V377-L435 HydrophobicContact CB-CD1 3.91Å; V377-L435 HydrophobicContact CG1-CD1 3.25Å; V377-L435 HydrophobicContact CG1-CD2 3.88Å; V377-L435 HydrophobicContact CG1-CG 4.2Å
378	L	54.2	Low	56.2	Low	2 Å²	2	68.3 Å²	68.3	1%	0.01	38%	0.382	C	S	.	.	H	α-helix	trans	-71.1	-31.4	175.6	-73.2	173.7	0	0	0	113.2	V374 L381 Y382 A394 L428	V374-L378 HydrophobicContact CG1-CD1 3.65Å; V374-L378 HydrophobicContact CG1-CG 4.33Å; V374-L378 WeakPolarHBondContact O-CB 3.37Å; V374-L378 WeakPolarHBondContact O-CG 3.48Å; V374-L378 PolarHBondContact O-N 3.48Å; L378-L381 PolarHBondContact O-N 2.82Å; L378-Y382 HydrophobicContact CD2-CE2 4.3Å; L378-Y382 PolarHBondContact O-N 3.41Å; L378-A394 HydrophobicContact CD1-CB 4.02Å; L378-A394 HydrophobicContact CD2-CB 4.09Å; L378-L428 HydrophobicContact CD2-CD1 3.62Å
379	I	58.9	Low	55.7	Low	82 Å²	82	69.1 Å²	69.1	42%	0.421	38%	0.384	S	S	.	.	H	α-helix	trans	-57.3	-50.3	-178.5	-76.6	162.9	0	0	0	112.4	R375 Y382 S383	R375-I379 HydrophobicContact CG-CD1 3.81Å; R375-I379 HydrophobicContact CG-CG1 4.41Å; R375-I379 VanDerWaalsContact O-CD1 3.32Å; R375-I379 WeakPolarHBondContact O-CD1 3.34Å; R375-I379 WeakPolarHBondContact O-CG1 3.47Å; R375-I379 PolarHBondContact O-N 2.8Å; R375-I379 VanDerWaalsContact O-N 3.12Å; I379-Y382 PolarHBondContact O-N 3.37Å; I379-S383 WeakPolarHBondContact O-CA 3.18Å; I379-S383 WeakPolarHBondContact O-CB 3.29Å; I379-S383 PolarHBondContact O-N 3.38Å; I379-S383 VanDerWaalsContact O-N 3.09Å
380	P	55.3	Low	55.5	Low	80 Å²	80	70.4 Å²	70.4	52%	0.519	39%	0.388	S	S	.	.	H	α-helix	trans	-59.5	-43	176.6	-26	32.2	0	0	0	114.1	Q376 V377 Y382 S383	Q376-P380 WeakPolarHBondContact O-CD 3.43Å; V377-P380 WeakPolarHBondContact O-CD 3.44Å; P380-Y382 PolarHBondContact O-N 2.89Å; P380-S383 WeakPolarHBondContact O-CB 3.21Å; P380-S383 PolarHBondContact O-N 3.26Å; P380-S383 PolarHBondContact O-OG 2.98Å
381	L	52.1	Low	55.5	Low	99 Å²	99	71.8 Å²	71.8	52%	0.518	40%	0.397	S	S	.	.	H	α-helix	trans	-62.3	-27.6	-176.3	-70.6	172.6	0	0	0	113.1	L378	L378-L381 PolarHBondContact O-N 2.82Å
382	Y	55.4	Low	55.3	Low	25 Å²	25	73.6 Å²	73.6	10%	0.098	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	22.7	-178.8	-67.5	-85.7	0	0	0	112.4	L378 I379 P380 D384 N387 F390 V391 A394	L378-Y382 HydrophobicContact CD2-CE2 4.3Å; L378-Y382 PolarHBondContact O-N 3.41Å; I379-Y382 PolarHBondContact O-N 3.37Å; P380-Y382 PolarHBondContact O-N 2.89Å; Y382-D384 PolarHBondContact O-N 3.26Å; Y382-N387 HydrophobicContact CD1-CB 4.22Å; Y382-F390 HydrophobicContact CD1-CB 4.09Å; Y382-F390 HydrophobicContact CE1-CB 4.14Å; Y382-V391 VanDerWaalsContact CB-CG2 3.44Å; Y382-V391 HydrophobicContact CG-CG2 4.25Å; Y382-A394 HydrophobicContact CE2-CB 4.25Å
383	S	54.7	Low	55.2	Low	83 Å²	83	71.7 Å²	71.7	58%	0.58	39%	0.391	S	S	*	.			trans	-71.5	-7.9	-176.6	59.8	0	0	0	0	114.5	I379 P380 G385	I379-S383 WeakPolarHBondContact O-CA 3.18Å; I379-S383 WeakPolarHBondContact O-CB 3.29Å; I379-S383 PolarHBondContact O-N 3.38Å; I379-S383 VanDerWaalsContact O-N 3.09Å; P380-S383 WeakPolarHBondContact O-CB 3.21Å; P380-S383 PolarHBondContact O-N 3.26Å; P380-S383 PolarHBondContact O-OG 2.98Å; S383-G385 PolarHBondContact O-N 2.79Å
384	D	52	Low	55	Low	128 Å²	128	69.6 Å²	69.6	68%	0.684	38%	0.38	S	S	*	.	S	Bend	trans	-63.6	111.4	164.4	-86.2	-14.6	0	0	0	108.4	Y382 S386 N387	Y382-D384 PolarHBondContact O-N 3.26Å; D384-S386 PolarHBondContact O-N 2.8Å; D384-N387 PolarHBondContact O-N 3.42Å; D384-N387 VanDerWaalsContact O-N 3.07Å
385	G	50.6	Low	54.8	Low	69 Å²	69	72 Å²	72	71%	0.711	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	0.3	-164.4	0	0	0	0	0	117.7	S383	S383-G385 PolarHBondContact O-N 2.79Å
386	S	51.3	Low	54.8	Low	92 Å²	92	65.3 Å²	65.3	64%	0.643	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-21.8	171.2	55.5	0	0	0	0	114.1	D384	D384-S386 PolarHBondContact O-N 2.8Å
387	N	52.7	Low	55	Low	45 Å²	45	63.1 Å²	63.1	24%	0.241	35%	0.354	C	S	.	.			trans	-105.9	20.2	-160.9	-78.5	4.2	0	0	0	116.6	Y382 D384 P389 F390 V391	Y382-N387 HydrophobicContact CD1-CB 4.22Å; D384-N387 PolarHBondContact O-N 3.42Å; D384-N387 VanDerWaalsContact O-N 3.07Å; N387-P389 VanDerWaalsContact C-CD 3.47Å; N387-F390 HydrophobicContact CB-CB 4.26Å; N387-F390 HydrophobicContact CB-CD2 3.69Å; N387-F390 HydrophobicContact CB-CG 4.42Å; N387-F390 VanDerWaalsContact CG-CD2 3.43Å; N387-F390 WeakPolarHBondContact O-CA 3.46Å; N387-F390 WeakPolarHBondContact O-CB 3.48Å; N387-F390 PolarHBondContact O-N 2.78Å; N387-F390 WeakPolarHBondContact OD1-CD2 3.43Å; N387-V391 PolarHBondContact O-N 3.19Å; N387-V391 VanDerWaalsContact O-N 3.12Å
388	K	54.6	Low	55.2	Low	167 Å²	167	60.7 Å²	60.7	73%	0.726	34%	0.339	S	S	*	.	H	α-helix	trans	-46.4	-45.2	176.3	-71.1	-177	-179.8	176.3	0	115.7	F390 V391 K392	K388-F390 VanDerWaalsContact C-N 3.31Å; K388-F390 PolarHBondContact O-N 3.29Å; K388-V391 PolarHBondContact O-N 2.77Å; K388-K392 PolarHBondContact O-N 2.86Å
389	P	53.7	Low	55.5	Low	58 Å²	58	61 Å²	61	38%	0.377	34%	0.341	S	S	.	.	H	α-helix	trans	-63.2	-37.1	176.1	19.9	-29.6	0	0	0	112.5	N387 V391 K392 I393 V418	N387-P389 VanDerWaalsContact C-CD 3.47Å; P389-V391 PolarHBondContact O-N 3Å; P389-K392 WeakPolarHBondContact O-CB 3.15Å; P389-K392 PolarHBondContact O-N 2.81Å; P389-I393 WeakPolarHBondContact O-CD1 3.46Å; P389-I393 VanDerWaalsContact O-CG1 3.3Å; P389-I393 WeakPolarHBondContact O-CG1 3.49Å; P389-I393 PolarHBondContact O-N 3.24Å; P389-I393 VanDerWaalsContact O-N 3.13Å; P389-V418 HydrophobicContact CB-CG2 3.85Å
390	F	53.7	Low	55.6	Low	43 Å²	43	60.1 Å²	60.1	19%	0.189	34%	0.337	C	S	.	.	H	α-helix	trans	-64.8	-38.3	177.2	-61	-72.2	0	0	0	112.6	Y382 N387 K388 K392 I393 A394 V418 L420	Y382-F390 HydrophobicContact CD1-CB 4.09Å; Y382-F390 HydrophobicContact CE1-CB 4.14Å; N387-F390 HydrophobicContact CB-CB 4.26Å; N387-F390 HydrophobicContact CB-CD2 3.69Å; N387-F390 HydrophobicContact CB-CG 4.42Å; N387-F390 VanDerWaalsContact CG-CD2 3.43Å; N387-F390 WeakPolarHBondContact O-CA 3.46Å; N387-F390 WeakPolarHBondContact O-CB 3.48Å; N387-F390 PolarHBondContact O-N 2.78Å; N387-F390 WeakPolarHBondContact OD1-CD2 3.43Å; K388-F390 VanDerWaalsContact C-N 3.31Å; K388-F390 PolarHBondContact O-N 3.29Å; F390-K392 VanDerWaalsContact C-N 3.26Å; F390-K392 PolarHBondContact O-N 2.73Å; F390-I393 HydrophobicContact CD1-CD1 4.24Å; F390-I393 PolarHBondContact O-N 2.92Å; F390-A394 WeakPolarHBondContact O-CB 3.27Å; F390-A394 PolarHBondContact O-N 3.23Å; F390-V418 HydrophobicContact CD1-CG1 4.42Å; F390-V418 HydrophobicContact CE1-CG1 4.07Å; F390-L420 HydrophobicContact CD1-CD2 3.48Å; F390-L420 VanDerWaalsContact CD1-CD2 3.48Å; F390-L420 HydrophobicContact CD1-CG 4.4Å; F390-L420 HydrophobicContact CE1-CD2 4.12Å; F390-L420 HydrophobicContact CG-CD2 4.48Å
391	V	54.1	Low	55.7	Low	35 Å²	35	61.2 Å²	61.2	21%	0.212	33%	0.331	C	S	.	.	H	α-helix	trans	-56.1	-42.9	173.2	-178.9	0	0	0	0	111.2	Y382 N387 K388 P389 Y395	Y382-V391 VanDerWaalsContact CB-CG2 3.44Å; Y382-V391 HydrophobicContact CG-CG2 4.25Å; N387-V391 PolarHBondContact O-N 3.19Å; N387-V391 VanDerWaalsContact O-N 3.12Å; K388-V391 PolarHBondContact O-N 2.77Å; P389-V391 PolarHBondContact O-N 3Å; V391-Y395 WeakPolarHBondContact O-CB 3.28Å; V391-Y395 PolarHBondContact O-N 3.31Å
392	K	58.3	Low	55.9	Low	105 Å²	105	56.7 Å²	56.7	46%	0.457	31%	0.307	S	S	.	.	H	α-helix	trans	-66.2	-48.1	-179.7	-174.1	-176.6	170.4	-163.9	0	110.7	K388 P389 F390 A394 Y395 D396 E417	K388-K392 PolarHBondContact O-N 2.86Å; P389-K392 WeakPolarHBondContact O-CB 3.15Å; P389-K392 PolarHBondContact O-N 2.81Å; F390-K392 VanDerWaalsContact C-N 3.26Å; F390-K392 PolarHBondContact O-N 2.73Å; K392-A394 VanDerWaalsContact C-N 3.33Å; K392-A394 PolarHBondContact O-N 2.98Å; K392-Y395 WeakPolarHBondContact O-CB 2.92Å; K392-Y395 PolarHBondContact O-N 2.78Å; K392-D396 VanDerWaalsContact O-CB 3.32Å; K392-D396 WeakPolarHBondContact O-CB 3.43Å; K392-D396 PolarHBondContact O-N 2.96Å; K392-E417 IonicContact NZ-OE2 3.07Å; K392-E417 PolarHBondContact NZ-OE2 3.46Å; K392-E417 VanDerWaalsContact NZ-OE2 3.07Å
393	I	57.2	Low	55.9	Low	28 Å²	28	61 Å²	61	14%	0.144	33%	0.331	C	S	.	.	H	α-helix	trans	-64.3	-41.5	179	-49.8	151.4	0	0	0	110.9	P389 F390 Y395 D396 E397 V418 L420	P389-I393 WeakPolarHBondContact O-CD1 3.46Å; P389-I393 VanDerWaalsContact O-CG1 3.3Å; P389-I393 WeakPolarHBondContact O-CG1 3.49Å; P389-I393 PolarHBondContact O-N 3.24Å; P389-I393 VanDerWaalsContact O-N 3.13Å; F390-I393 HydrophobicContact CD1-CD1 4.24Å; F390-I393 PolarHBondContact O-N 2.92Å; I393-Y395 VanDerWaalsContact C-N 3.28Å; I393-Y395 PolarHBondContact O-N 3.4Å; I393-D396 PolarHBondContact O-N 3.27Å; I393-D396 VanDerWaalsContact O-N 3.17Å; I393-E397 WeakPolarHBondContact O-CB 2.99Å; I393-E397 PolarHBondContact O-N 2.83Å; I393-V418 HydrophobicContact CD1-CB 3.42Å; I393-V418 VanDerWaalsContact CD1-CB 3.42Å; I393-V418 HydrophobicContact CD1-CG1 3.51Å; I393-V418 HydrophobicContact CD1-CG2 4.43Å; I393-V418 HydrophobicContact CG1-CB 4.32Å; I393-L420 HydrophobicContact CB-CD1 4.07Å; I393-L420 HydrophobicContact CB-CG 4.34Å; I393-L420 HydrophobicContact CD1-CD2 4.33Å; I393-L420 HydrophobicContact CD1-CG 3.98Å; I393-L420 HydrophobicContact CG2-CD1 3.33Å; I393-L420 HydrophobicContact CG2-CG 3.9Å
394	A	54.2	Low	55.9	Low	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-58.4	-44.3	176.9	0	0	0	0	0	112	L378 Y382 F390 K392 A398 L428	L378-A394 HydrophobicContact CD1-CB 4.02Å; L378-A394 HydrophobicContact CD2-CB 4.09Å; Y382-A394 HydrophobicContact CE2-CB 4.25Å; F390-A394 WeakPolarHBondContact O-CB 3.27Å; F390-A394 PolarHBondContact O-N 3.23Å; K392-A394 VanDerWaalsContact C-N 3.33Å; K392-A394 PolarHBondContact O-N 2.98Å; A394-A398 WeakPolarHBondContact O-CB 3.24Å; A394-A398 PolarHBondContact O-N 2.97Å; A394-L428 VanDerWaalsContact CA-CD2 3.49Å; A394-L428 HydrophobicContact CB-CD1 3.36Å; A394-L428 HydrophobicContact CB-CD2 3.91Å; A394-L428 HydrophobicContact CB-CG 4.23Å
395	Y	54.8	Low	55.8	Low	60 Å²	60	56 Å²	56	24%	0.235	30%	0.303	C	S	.	.	H	α-helix	trans	-65.4	-42.2	174.4	175.6	-99.8	0	0	0	112.1	V374 R375 V391 K392 I393 A398 I399	V374-Y395 HydrophobicContact CG1-CD2 4.3Å; R375-Y395 HydrophobicContact CB-CD2 4.08Å; R375-Y395 HydrophobicContact CB-CE2 3.92Å; V391-Y395 WeakPolarHBondContact O-CB 3.28Å; V391-Y395 PolarHBondContact O-N 3.31Å; K392-Y395 WeakPolarHBondContact O-CB 2.92Å; K392-Y395 PolarHBondContact O-N 2.78Å; I393-Y395 VanDerWaalsContact C-N 3.28Å; I393-Y395 PolarHBondContact O-N 3.4Å; Y395-A398 WeakPolarHBondContact O-CB 3.29Å; Y395-A398 PolarHBondContact O-N 3.15Å; Y395-I399 HydrophobicContact CD1-CD1 3.67Å; Y395-I399 HydrophobicContact CE1-CD1 3.18Å; Y395-I399 HydrophobicContact CE1-CG1 4.29Å; Y395-I399 HydrophobicContact CE2-CD1 4.23Å; Y395-I399 HydrophobicContact CG-CD1 4.39Å; Y395-I399 VanDerWaalsContact CZ-CD1 3.5Å; Y395-I399 VanDerWaalsContact O-CG1 3.29Å; Y395-I399 WeakPolarHBondContact O-CG1 3.2Å; Y395-I399 PolarHBondContact O-N 3.17Å
396	D	60.9	Low	55.7	Low	13 Å²	13	54.6 Å²	54.6	7%	0.07	28%	0.279	C	S	.	.	H	α-helix	trans	-67.1	-40.7	-179.9	-71.6	-10.9	0	0	0	112.1	K392 I393 I399 L400 M414	K392-D396 VanDerWaalsContact O-CB 3.32Å; K392-D396 WeakPolarHBondContact O-CB 3.43Å; K392-D396 PolarHBondContact O-N 2.96Å; I393-D396 PolarHBondContact O-N 3.27Å; I393-D396 VanDerWaalsContact O-N 3.17Å; D396-I399 WeakPolarHBondContact O-CB 3.23Å; D396-I399 PolarHBondContact O-N 2.86Å; D396-L400 PolarHBondContact O-N 3.4Å; D396-M414 HydrophobicContact CB-CB 4.45Å; D396-M414 HydrophobicContact CB-CE 3.48Å; D396-M414 VanDerWaalsContact CB-CE 3.48Å; D396-M414 HydrophobicContact CB-SD 3.91Å; D396-M414 VanDerWaalsContact OD2-SD 3.37Å
397	E	61.7	Low	55.6	Low	58 Å²	58	57.3 Å²	57.3	27%	0.271	28%	0.281	S	S	.	.	H	α-helix	trans	-65	-41.9	173.5	178.7	60	-152.9	0	0	111.3	I393 I399 L400 R401 L428	I393-E397 WeakPolarHBondContact O-CB 2.99Å; I393-E397 PolarHBondContact O-N 2.83Å; E397-I399 VanDerWaalsContact C-N 3.34Å; E397-I399 PolarHBondContact O-N 3.11Å; E397-L400 WeakPolarHBondContact O-CB 3.48Å; E397-L400 PolarHBondContact O-N 2.87Å; E397-R401 PolarHBondContact O-N 2.83Å; E397-R401 IonicContact OE1-CZ 3.83Å; E397-R401 IonicContact OE1-NH1 3.73Å; E397-R401 PolarHBondContact OE1-NH1 3.21Å; E397-L428 HydrophobicContact CB-CD2 3.91Å; E397-L428 HydrophobicContact CG-CD2 3.9Å
398	A	57.5	Low	55.3	Low	2 Å²	2	61 Å²	61	2%	0.017	30%	0.301	C	S	.	.	H	α-helix	trans	-60	-44.6	172.9	0	0	0	0	0	111.3	V374 A394 Y395 L400 R401 M402 L432	V374-A398 HydrophobicContact CG1-CB 3.53Å; A394-A398 WeakPolarHBondContact O-CB 3.24Å; A394-A398 PolarHBondContact O-N 2.97Å; Y395-A398 WeakPolarHBondContact O-CB 3.29Å; Y395-A398 PolarHBondContact O-N 3.15Å; A398-L400 VanDerWaalsContact C-N 3.31Å; A398-L400 PolarHBondContact O-N 3.45Å; A398-R401 PolarHBondContact O-N 3.02Å; A398-M402 WeakPolarHBondContact O-CB 3.47Å; A398-M402 WeakPolarHBondContact O-CG 3.28Å; A398-M402 PolarHBondContact O-N 2.55Å; A398-L432 HydrophobicContact CB-CD1 3.8Å; A398-L432 HydrophobicContact CB-CD2 3.5Å; A398-L432 VanDerWaalsContact CB-CD2 3.5Å; A398-L432 HydrophobicContact CB-CG 4.32Å
399	I	60.8	Low	55	Low	9 Å²	9	55.1 Å²	55.1	5%	0.046	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-41.7	175.6	-72.6	173.5	0	0	0	111.7	Y395 D396 E397 M402 N403 I404 M406	Y395-I399 HydrophobicContact CD1-CD1 3.67Å; Y395-I399 HydrophobicContact CE1-CD1 3.18Å; Y395-I399 HydrophobicContact CE1-CG1 4.29Å; Y395-I399 HydrophobicContact CE2-CD1 4.23Å; Y395-I399 HydrophobicContact CG-CD1 4.39Å; Y395-I399 VanDerWaalsContact CZ-CD1 3.5Å; Y395-I399 VanDerWaalsContact O-CG1 3.29Å; Y395-I399 WeakPolarHBondContact O-CG1 3.2Å; Y395-I399 PolarHBondContact O-N 3.17Å; D396-I399 WeakPolarHBondContact O-CB 3.23Å; D396-I399 PolarHBondContact O-N 2.86Å; E397-I399 VanDerWaalsContact C-N 3.34Å; E397-I399 PolarHBondContact O-N 3.11Å; I399-M402 PolarHBondContact O-N 2.91Å; I399-N403 PolarHBondContact O-N 3.33Å; I399-I404 HydrophobicContact CB-CD1 4.42Å; I399-I404 HydrophobicContact CG1-CD1 4.21Å; I399-I404 HydrophobicContact CG2-CB 3.95Å; I399-I404 HydrophobicContact CG2-CD1 4.25Å; I399-I404 HydrophobicContact CG2-CG1 4.49Å; I399-I404 HydrophobicContact CG2-CG2 4.47Å; I399-I404 PolarHBondContact O-N 2.89Å; I399-M406 HydrophobicContact CG2-CG 3.94Å; I399-M406 HydrophobicContact CG2-SD 3.54Å; I399-M406 VanDerWaalsContact CG2-SD 3.54Å
400	L	61.2	Low	54.8	Low	63 Å²	63	56.6 Å²	56.6	33%	0.33	29%	0.29	S	S	.	.	H	α-helix	trans	-64.3	-50.3	178.1	-94	154.6	0	0	0	112	D396 E397 A398 M402 N403	D396-L400 PolarHBondContact O-N 3.4Å; E397-L400 WeakPolarHBondContact O-CB 3.48Å; E397-L400 PolarHBondContact O-N 2.87Å; A398-L400 VanDerWaalsContact C-N 3.31Å; A398-L400 PolarHBondContact O-N 3.45Å; L400-M402 PolarHBondContact O-N 3.49Å; L400-N403 PolarHBondContact O-N 2.98Å
401	R	58.4	Low	54.4	Low	104 Å²	104	58.6 Å²	58.6	39%	0.392	30%	0.299	S	S	.	.	H	α-helix	trans	-59.5	-35	174.4	-83.6	-162.4	159.6	98	-20.5	112.2	E397 A398 N403 C429	E397-R401 PolarHBondContact O-N 2.83Å; E397-R401 IonicContact OE1-CZ 3.83Å; E397-R401 IonicContact OE1-NH1 3.73Å; E397-R401 PolarHBondContact OE1-NH1 3.21Å; A398-R401 PolarHBondContact O-N 3.02Å; R401-N403 PolarHBondContact O-N 3Å; R401-N403 VanDerWaalsContact O-N 3.16Å; R401-C429 VanDerWaalsContact CZ-SG 3.53Å; R401-C429 PolarHBondContact NH1-SG 3.25Å; R401-C429 PolarHBondContact NH2-SG 3.29Å
402	M	55.4	Low	53.7	Low	3 Å²	3	64.1 Å²	64.1	2%	0.015	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	2.5	177.1	-71.6	-177.1	75	0	0	114.4	L367 L370 V374 A398 I399 L400 I404 L436 L485	L367-M402 HydrophobicContact CD2-CE 4.26Å; L370-M402 HydrophobicContact CB-CE 3.15Å; L370-M402 HydrophobicContact CB-SD 4.28Å; L370-M402 HydrophobicContact CD1-CE 3.19Å; L370-M402 HydrophobicContact CD2-CE 4.14Å; L370-M402 HydrophobicContact CG-CE 3.59Å; V374-M402 HydrophobicContact CG2-SD 3.91Å; A398-M402 WeakPolarHBondContact O-CB 3.47Å; A398-M402 WeakPolarHBondContact O-CG 3.28Å; A398-M402 PolarHBondContact O-N 2.55Å; I399-M402 PolarHBondContact O-N 2.91Å; L400-M402 PolarHBondContact O-N 3.49Å; M402-I404 HydrophobicContact CB-CD1 3.85Å; M402-I404 HydrophobicContact CB-CG1 3.63Å; M402-I404 HydrophobicContact CE-CD1 4.21Å; M402-I404 PolarHBondContact O-N 3.48Å; M402-I404 HydrophobicContact SD-CD1 4.16Å; M402-L436 HydrophobicContact CE-CD1 4.44Å; M402-L436 HydrophobicContact CG-CD1 3.62Å; M402-L436 HydrophobicContact SD-CD1 4.13Å; M402-L485 HydrophobicContact CB-CD1 3.99Å; M402-L485 HydrophobicContact CG-CD1 4.4Å; M402-L485 WeakPolarHBondContact O-CD1 3.31Å
403	N	56.1	Low	53.1	Low	116 Å²	116	66.2 Å²	66.2	62%	0.62	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.7	34.4	-178.7	-159.2	21	0	0	0	112.7	I399 L400 R401	I399-N403 PolarHBondContact O-N 3.33Å; L400-N403 PolarHBondContact O-N 2.98Å; R401-N403 PolarHBondContact O-N 3Å; R401-N403 VanDerWaalsContact O-N 3.16Å
404	I	54.9	Low	52.6	Low	12 Å²	12	66.2 Å²	66.2	6%	0.062	33%	0.333	C	S	.	.			trans	-70.4	128.4	-179.5	-60.9	178.6	0	0	0	106.4	L367 K371 I399 M402 M406	L367-I404 HydrophobicContact CB-CG1 4.24Å; L367-I404 HydrophobicContact CD2-CG1 4.13Å; K371-I404 VanDerWaalsContact CE-CG2 3.47Å; K371-I404 HydrophobicContact CG-CD1 3.91Å; I399-I404 HydrophobicContact CB-CD1 4.42Å; I399-I404 HydrophobicContact CG1-CD1 4.21Å; I399-I404 HydrophobicContact CG2-CB 3.95Å; I399-I404 HydrophobicContact CG2-CD1 4.25Å; I399-I404 HydrophobicContact CG2-CG1 4.49Å; I399-I404 HydrophobicContact CG2-CG2 4.47Å; I399-I404 PolarHBondContact O-N 2.89Å; M402-I404 HydrophobicContact CB-CD1 3.85Å; M402-I404 HydrophobicContact CB-CG1 3.63Å; M402-I404 HydrophobicContact CE-CD1 4.21Å; M402-I404 PolarHBondContact O-N 3.48Å; M402-I404 HydrophobicContact SD-CD1 4.16Å; I404-M406 PolarHBondContact O-N 2.66Å
405	P	49	Very low	51.9	Low	95 Å²	95	72.3 Å²	72.3	62%	0.617	37%	0.365	S	S	*	.			trans	-57.4	117.7	178.1	21.4	-30.8	0	0	0	109.6
406	M	48.3	Very low	51.3	Low	39 Å²	39	74.7 Å²	74.7	19%	0.192	39%	0.389	C	S	.	.			trans	-119.1	143.1	173.2	-72.3	-150.6	69.5	0	0	108.4	I399 I404 D408 Q410 K411 M414	I399-M406 HydrophobicContact CG2-CG 3.94Å; I399-M406 HydrophobicContact CG2-SD 3.54Å; I399-M406 VanDerWaalsContact CG2-SD 3.54Å; I404-M406 PolarHBondContact O-N 2.66Å; M406-D408 PolarHBondContact O-N 2.96Å; M406-Q410 HydrophobicContact CE-CB 3.44Å; M406-Q410 VanDerWaalsContact CE-CB 3.44Å; M406-Q410 HydrophobicContact CE-CG 4.16Å; M406-K411 HydrophobicContact CB-CG 4.3Å; M406-M414 HydrophobicContact CE-CE 4.22Å; M406-M414 HydrophobicContact CE-SD 4.01Å; M406-M414 HydrophobicContact SD-CE 3.68Å; M406-M414 HydrophobicContact SD-SD 4.24Å
407	E	50.5	Low	50.6	Low	148 Å²	148	80.5 Å²	80.5	69%	0.692	42%	0.416	S	S	*	.			trans	-60.8	134.8	170.8	-67.6	-179.1	168.4	0	0	109	G409 Q410 K411	E407-G409 PolarHBondContact O-N 3.35Å; E407-Q410 WeakPolarHBondContact O-CB 3.28Å; E407-Q410 PolarHBondContact O-N 2.94Å; E407-K411 PolarHBondContact O-N 3.44Å
408	D	46.1	Very low	49.9	Very low	122 Å²	122	80.3 Å²	80.3	65%	0.652	42%	0.418	S	S	*	.	H	α-helix	trans	-53.8	-32	-172.3	-73.2	-38.8	0	0	0	113.3	M406 Q410 K411	M406-D408 PolarHBondContact O-N 2.96Å; D408-Q410 VanDerWaalsContact C-N 3.31Å; D408-Q410 PolarHBondContact O-N 3.18Å; D408-K411 PolarHBondContact O-N 2.98Å
409	G	47.4	Very low	49.5	Very low	45 Å²	45	88.6 Å²	88.6	46%	0.464	46%	0.459	S	S	.	.	H	α-helix	trans	-65	-29.8	176.1	0	0	0	0	0	114.2	E407 Q413	E407-G409 PolarHBondContact O-N 3.35Å; G409-Q413 PolarHBondContact O-N 3.04Å
410	Q	49.4	Very low	49.1	Very low	89 Å²	89	88.9 Å²	88.9	42%	0.416	46%	0.461	S	S	.	.	H	α-helix	trans	-76.6	-37.4	177.1	-68	177.6	-17.4	0	0	111.4	M406 E407 D408 Q412 Q413 M414	M406-Q410 HydrophobicContact CE-CB 3.44Å; M406-Q410 VanDerWaalsContact CE-CB 3.44Å; M406-Q410 HydrophobicContact CE-CG 4.16Å; E407-Q410 WeakPolarHBondContact O-CB 3.28Å; E407-Q410 PolarHBondContact O-N 2.94Å; D408-Q410 VanDerWaalsContact C-N 3.31Å; D408-Q410 PolarHBondContact O-N 3.18Å; Q410-Q412 VanDerWaalsContact C-N 3.31Å; Q410-Q412 PolarHBondContact O-N 3.36Å; Q410-Q413 PolarHBondContact O-N 3.43Å; Q410-M414 VanDerWaalsContact O-CG 3.28Å; Q410-M414 WeakPolarHBondContact O-CG 3.19Å; Q410-M414 PolarHBondContact O-N 3.37Å; Q410-M414 VanDerWaalsContact O-N 3.12Å
411	K	45.2	Very low	49	Very low	85 Å²	85	88.5 Å²	88.5	37%	0.37	46%	0.463	S	S	.	.	H	α-helix	trans	-55.6	-44.9	176.9	-81.9	-178.6	175.3	173.3	0	112.5	M406 E407 D408	M406-K411 HydrophobicContact CB-CG 4.3Å; E407-K411 PolarHBondContact O-N 3.44Å; D408-K411 PolarHBondContact O-N 2.98Å
412	Q	40	Very low	49	Very low	151 Å²	151	89.2 Å²	89.2	71%	0.706	48%	0.475	S	S	*	.	H	α-helix	trans	-76	-33.7	-177.6	-78.7	163.7	-22.6	0	0	113.1	Q410	Q410-Q412 VanDerWaalsContact C-N 3.31Å; Q410-Q412 PolarHBondContact O-N 3.36Å
413	Q	47	Very low	49.5	Very low	149 Å²	149	96.4 Å²	96.4	70%	0.696	51%	0.506	S	S	*	.	H	α-helix	trans	-70.2	-33.3	176.2	-88.8	-177.4	-18.8	0	0	112.9	G409 Q410	G409-Q413 PolarHBondContact O-N 3.04Å; Q410-Q413 PolarHBondContact O-N 3.43Å
414	M	45.6	Very low	49.8	Very low	28 Å²	28	92.5 Å²	92.5	14%	0.138	49%	0.485	C	S	.	.	H	α-helix	trans	-73.1	-35.4	-173.4	-70.5	-169.7	-25.8	0	0	114.6	D396 M406 Q410 C416	D396-M414 HydrophobicContact CB-CB 4.45Å; D396-M414 HydrophobicContact CB-CE 3.48Å; D396-M414 VanDerWaalsContact CB-CE 3.48Å; D396-M414 HydrophobicContact CB-SD 3.91Å; D396-M414 VanDerWaalsContact OD2-SD 3.37Å; M406-M414 HydrophobicContact CE-CE 4.22Å; M406-M414 HydrophobicContact CE-SD 4.01Å; M406-M414 HydrophobicContact SD-CE 3.68Å; M406-M414 HydrophobicContact SD-SD 4.24Å; Q410-M414 VanDerWaalsContact O-CG 3.28Å; Q410-M414 WeakPolarHBondContact O-CG 3.19Å; Q410-M414 PolarHBondContact O-N 3.37Å; Q410-M414 VanDerWaalsContact O-N 3.12Å; M414-C416 VanDerWaalsContact C-N 3.25Å; M414-C416 PolarHBondContact O-N 3.13Å
415	L	38.9	Very low	49.8	Very low	128 Å²	128	95.8 Å²	95.8	67%	0.67	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-19.9	-179.1	-85.2	160.8	0	0	0	113.7
416	C	43.8	Very low	50.5	Low	109 Å²	109	96 Å²	96	74%	0.736	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-16.5	-169.6	-74.5	0	0	0	0	114.8	M414	M414-C416 VanDerWaalsContact C-N 3.25Å; M414-C416 PolarHBondContact O-N 3.13Å
417	E	44.9	Very low	51.4	Low	136 Å²	136	96.7 Å²	96.7	64%	0.636	50%	0.502	S	S	*	.	S	Bend	trans	-87	-27.3	-163.1	-79.4	-172.2	152.8	0	0	115.8	K392	K392-E417 IonicContact NZ-OE2 3.07Å; K392-E417 PolarHBondContact NZ-OE2 3.46Å; K392-E417 VanDerWaalsContact NZ-OE2 3.07Å
418	V	48.6	Very low	51.9	Low	53 Å²	53	89.7 Å²	89.7	32%	0.321	47%	0.469	S	S	.	.			trans	-154.9	126	177.1	169.8	0	0	0	0	110.8	P389 F390 I393 L420	P389-V418 HydrophobicContact CB-CG2 3.85Å; F390-V418 HydrophobicContact CD1-CG1 4.42Å; F390-V418 HydrophobicContact CE1-CG1 4.07Å; I393-V418 HydrophobicContact CD1-CB 3.42Å; I393-V418 VanDerWaalsContact CD1-CB 3.42Å; I393-V418 HydrophobicContact CD1-CG1 3.51Å; I393-V418 HydrophobicContact CD1-CG2 4.43Å; I393-V418 HydrophobicContact CG1-CB 4.32Å; V418-L420 PolarHBondContact O-N 3.07Å
419	M	48.9	Very low	53	Low	176 Å²	176	85 Å²	85	87%	0.867	45%	0.445	S	S	*	.			trans	-72.8	106	169	-77.8	-81.1	-103.6	0	0	108.9
420	L	51.7	Low	54	Low	16 Å²	16	88.1 Å²	88.1	8%	0.084	45%	0.451	C	S	.	.			trans	-57.3	140.2	163.2	-77.3	160.6	0	0	0	109.3	F390 I393 V418 D424 K425	F390-L420 HydrophobicContact CD1-CD2 3.48Å; F390-L420 VanDerWaalsContact CD1-CD2 3.48Å; F390-L420 HydrophobicContact CD1-CG 4.4Å; F390-L420 HydrophobicContact CE1-CD2 4.12Å; F390-L420 HydrophobicContact CG-CD2 4.48Å; I393-L420 HydrophobicContact CB-CD1 4.07Å; I393-L420 HydrophobicContact CB-CG 4.34Å; I393-L420 HydrophobicContact CD1-CD2 4.33Å; I393-L420 HydrophobicContact CD1-CG 3.98Å; I393-L420 HydrophobicContact CG2-CD1 3.33Å; I393-L420 HydrophobicContact CG2-CG 3.9Å; V418-L420 PolarHBondContact O-N 3.07Å; L420-D424 HydrophobicContact CB-CB 4.43Å; L420-D424 HydrophobicContact CD2-CB 3.63Å; L420-K425 HydrophobicContact CB-CD 4.32Å; L420-K425 HydrophobicContact CB-CG 3.56Å; L420-K425 HydrophobicContact CD1-CG 3.9Å; L420-K425 HydrophobicContact CG-CG 4.35Å
421	S	58.8	Low	54.9	Low	54 Å²	54	84.9 Å²	84.9	38%	0.378	44%	0.439	S	S	.	.			trans	-63.5	152.8	165.5	75.9	0	0	0	0	109.4	F423 D424 K425	S421-F423 PolarHBondContact O-N 2.95Å; S421-D424 WeakPolarHBondContact CB-OD2 3.34Å; S421-D424 PolarHBondContact N-OD2 3.22Å; S421-D424 PolarHBondContact O-N 2.76Å; S421-D424 PolarHBondContact OG-N 2.82Å; S421-D424 VanDerWaalsContact OG-N 3.16Å; S421-D424 PolarHBondContact OG-OD2 3.28Å; S421-K425 PolarHBondContact O-N 2.78Å
422	D	59.2	Low	55.9	Low	120 Å²	120	81.4 Å²	81.4	64%	0.642	42%	0.424	S	S	*	.	H	α-helix	trans	-58.6	-33.3	178.5	-65.5	-34.4	0	0	0	111.2	K425 D426	D422-K425 PolarHBondContact O-N 2.87Å; D422-K425 IonicContact OD1-NZ 3.11Å; D422-D426 VanDerWaalsContact O-CG 3.27Å; D422-D426 PolarHBondContact O-N 3.41Å
423	F	65.3	Low	57.3	Low	153 Å²	153	78.7 Å²	78.7	67%	0.671	42%	0.415	S	S	*	.	H	α-helix	trans	-63.7	-43.2	173.7	-179.1	-96.3	0	0	0	113.4	S421 K425 D426 T427	S421-F423 PolarHBondContact O-N 2.95Å; F423-K425 VanDerWaalsContact C-N 3.32Å; F423-D426 PolarHBondContact O-N 3.15Å; F423-T427 WeakPolarHBondContact O-CB 3.32Å; F423-T427 PolarHBondContact O-N 3.45Å; F423-T427 PolarHBondContact O-OG1 2.96Å
424	D	61.6	Low	58.6	Low	35 Å²	35	78 Å²	78	19%	0.187	41%	0.411	C	S	.	.	H	α-helix	trans	-67.9	-35.5	178	-62	-49.3	0	0	0	111.2	L420 S421 L428	L420-D424 HydrophobicContact CB-CB 4.43Å; L420-D424 HydrophobicContact CD2-CB 3.63Å; S421-D424 WeakPolarHBondContact CB-OD2 3.34Å; S421-D424 PolarHBondContact N-OD2 3.22Å; S421-D424 PolarHBondContact O-N 2.76Å; S421-D424 PolarHBondContact OG-N 2.82Å; S421-D424 VanDerWaalsContact OG-N 3.16Å; S421-D424 PolarHBondContact OG-OD2 3.28Å; D424-L428 WeakPolarHBondContact O-CB 3.3Å; D424-L428 PolarHBondContact O-N 3.49Å
425	K	56.5	Low	59.6	Low	80 Å²	80	78.2 Å²	78.2	35%	0.348	41%	0.413	S	S	.	.	H	α-helix	trans	-63.2	-48.4	173.6	-69.7	180	-173.6	165.2	0	110.8	L420 S421 D422 F423 L428 C429	L420-K425 HydrophobicContact CB-CD 4.32Å; L420-K425 HydrophobicContact CB-CG 3.56Å; L420-K425 HydrophobicContact CD1-CG 3.9Å; L420-K425 HydrophobicContact CG-CG 4.35Å; S421-K425 PolarHBondContact O-N 2.78Å; D422-K425 PolarHBondContact O-N 2.87Å; D422-K425 IonicContact OD1-NZ 3.11Å; F423-K425 VanDerWaalsContact C-N 3.32Å; K425-L428 WeakPolarHBondContact O-CB 3.48Å; K425-L428 PolarHBondContact O-N 3.03Å; K425-C429 WeakPolarHBondContact O-CB 3.4Å; K425-C429 PolarHBondContact O-N 3.21Å; K425-C429 PolarHBondContact O-SG 3.14Å
426	D	63.9	Low	61	Low	100 Å²	100	73.3 Å²	73.3	54%	0.535	39%	0.387	S	S	.	.	H	α-helix	trans	-62.8	-47.3	-179	-69.9	-17.6	0	0	0	110.8	D422 F423 L428 C429 D430	D422-D426 VanDerWaalsContact O-CG 3.27Å; D422-D426 PolarHBondContact O-N 3.41Å; F423-D426 PolarHBondContact O-N 3.15Å; D426-L428 VanDerWaalsContact C-N 3.28Å; D426-L428 PolarHBondContact O-N 2.75Å; D426-C429 WeakPolarHBondContact O-CB 3.29Å; D426-C429 PolarHBondContact O-N 2.81Å; D426-C429 VanDerWaalsContact O-N 3.1Å; D426-D430 VanDerWaalsContact O-CG 3.3Å; D426-D430 PolarHBondContact O-N 3.46Å
427	T	66.2	Low	62.3	Low	54 Å²	54	69.3 Å²	69.3	33%	0.331	36%	0.36	S	S	.	.	H	α-helix	trans	-59.8	-39.3	177.9	-52	0	0	0	0	112.3	F423 S431	F423-T427 WeakPolarHBondContact O-CB 3.32Å; F423-T427 PolarHBondContact O-N 3.45Å; F423-T427 PolarHBondContact O-OG1 2.96Å; T427-S431 WeakPolarHBondContact O-CB 3.33Å; T427-S431 PolarHBondContact O-N 2.94Å; T427-S431 PolarHBondContact O-OG 3.02Å
428	L	61.4	Low	63.5	Low	1 Å²	1	67.8 Å²	67.8	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-66.7	-45.4	175.1	175.4	69.9	0	0	0	111.6	L378 A394 E397 D424 K425 D426 D430 S431 L432	L378-L428 HydrophobicContact CD2-CD1 3.62Å; A394-L428 VanDerWaalsContact CA-CD2 3.49Å; A394-L428 HydrophobicContact CB-CD1 3.36Å; A394-L428 HydrophobicContact CB-CD2 3.91Å; A394-L428 HydrophobicContact CB-CG 4.23Å; E397-L428 HydrophobicContact CB-CD2 3.91Å; E397-L428 HydrophobicContact CG-CD2 3.9Å; D424-L428 WeakPolarHBondContact O-CB 3.3Å; D424-L428 PolarHBondContact O-N 3.49Å; K425-L428 WeakPolarHBondContact O-CB 3.48Å; K425-L428 PolarHBondContact O-N 3.03Å; D426-L428 VanDerWaalsContact C-N 3.28Å; D426-L428 PolarHBondContact O-N 2.75Å; L428-D430 VanDerWaalsContact C-N 3.32Å; L428-D430 PolarHBondContact O-N 2.99Å; L428-S431 PolarHBondContact O-N 2.88Å; L428-L432 HydrophobicContact CD1-CD1 4.1Å; L428-L432 HydrophobicContact CD1-CG 4.21Å; L428-L432 HydrophobicContact CD2-CD1 4.47Å; L428-L432 HydrophobicContact CG-CD1 3.93Å; L428-L432 HydrophobicContact CG-CG 4.4Å; L428-L432 WeakPolarHBondContact O-CB 3.41Å; L428-L432 VanDerWaalsContact O-CG 3.29Å; L428-L432 WeakPolarHBondContact O-CG 3.13Å; L428-L432 PolarHBondContact O-N 2.85Å
429	C	68.1	Low	64.3	Low	22 Å²	22	66.3 Å²	66.3	15%	0.149	34%	0.343	C	S	.	.	H	α-helix	trans	-58.8	-47.3	177.4	-66.2	0	0	0	0	110.1	R401 K425 D426 S431 L432 D433	R401-C429 VanDerWaalsContact CZ-SG 3.53Å; R401-C429 PolarHBondContact NH1-SG 3.25Å; R401-C429 PolarHBondContact NH2-SG 3.29Å; K425-C429 WeakPolarHBondContact O-CB 3.4Å; K425-C429 PolarHBondContact O-N 3.21Å; K425-C429 PolarHBondContact O-SG 3.14Å; D426-C429 WeakPolarHBondContact O-CB 3.29Å; D426-C429 PolarHBondContact O-N 2.81Å; D426-C429 VanDerWaalsContact O-N 3.1Å; C429-S431 VanDerWaalsContact C-N 3.34Å; C429-S431 PolarHBondContact O-N 2.91Å; C429-L432 PolarHBondContact O-N 2.87Å; C429-D433 VanDerWaalsContact O-CB 3.31Å; C429-D433 WeakPolarHBondContact O-CB 3.36Å; C429-D433 PolarHBondContact O-N 3.49Å
430	D	69.7	Low	65.3	Low	111 Å²	111	58.2 Å²	58.2	59%	0.594	30%	0.304	S	S	*	.	H	α-helix	trans	-59.2	-44.6	177.8	-68.8	-20.8	0	0	0	111.6	D426 L428 L432 D433 E434	D426-D430 VanDerWaalsContact O-CG 3.3Å; D426-D430 PolarHBondContact O-N 3.46Å; L428-D430 VanDerWaalsContact C-N 3.32Å; L428-D430 PolarHBondContact O-N 2.99Å; D430-L432 PolarHBondContact O-N 2.92Å; D430-D433 PolarHBondContact O-N 3.27Å; D430-E434 WeakPolarHBondContact O-CB 3.31Å; D430-E434 PolarHBondContact O-N 3.48Å
431	S	67.4	Low	66.2	Low	22 Å²	22	61.6 Å²	61.6	15%	0.154	32%	0.319	C	S	.	.	H	α-helix	trans	-64.2	-41.2	177.6	-58.4	0	0	0	0	112	T427 L428 C429 L435	T427-S431 WeakPolarHBondContact O-CB 3.33Å; T427-S431 PolarHBondContact O-N 2.94Å; T427-S431 PolarHBondContact O-OG 3.02Å; L428-S431 PolarHBondContact O-N 2.88Å; C429-S431 VanDerWaalsContact C-N 3.34Å; C429-S431 PolarHBondContact O-N 2.91Å; S431-L435 WeakPolarHBondContact O-CB 3.41Å; S431-L435 VanDerWaalsContact O-CD1 3.29Å; S431-L435 WeakPolarHBondContact O-CD1 3.02Å; S431-L435 WeakPolarHBondContact O-CG 3.38Å; S431-L435 PolarHBondContact O-N 3.39Å; S431-L435 VanDerWaalsContact O-N 3.1Å
432	L	65.9	Low	66.6	Low	11 Å²	11	60.3 Å²	60.3	6%	0.058	31%	0.311	C	S	.	.	H	α-helix	trans	-69.2	-42.7	177.9	-71.7	173.5	0	0	0	111.5	V374 A398 L428 C429 D430 E434 L435 L436	V374-L432 HydrophobicContact CG1-CD2 4.49Å; A398-L432 HydrophobicContact CB-CD1 3.8Å; A398-L432 HydrophobicContact CB-CD2 3.5Å; A398-L432 VanDerWaalsContact CB-CD2 3.5Å; A398-L432 HydrophobicContact CB-CG 4.32Å; L428-L432 HydrophobicContact CD1-CD1 4.1Å; L428-L432 HydrophobicContact CD1-CG 4.21Å; L428-L432 HydrophobicContact CD2-CD1 4.47Å; L428-L432 HydrophobicContact CG-CD1 3.93Å; L428-L432 HydrophobicContact CG-CG 4.4Å; L428-L432 WeakPolarHBondContact O-CB 3.41Å; L428-L432 VanDerWaalsContact O-CG 3.29Å; L428-L432 WeakPolarHBondContact O-CG 3.13Å; L428-L432 PolarHBondContact O-N 2.85Å; C429-L432 PolarHBondContact O-N 2.87Å; D430-L432 PolarHBondContact O-N 2.92Å; L432-E434 PolarHBondContact O-N 3.16Å; L432-L435 PolarHBondContact O-N 3.44Å; L432-L436 WeakPolarHBondContact O-CB 3.42Å; L432-L436 PolarHBondContact O-N 3.43Å
433	D	70.9	Confident	67	Low	95 Å²	95	54.8 Å²	54.8	51%	0.508	28%	0.282	S	S	.	.	H	α-helix	trans	-65	-30.4	178.5	-71.2	-19.8	0	0	0	111.4	C429 D430 P437	C429-D433 VanDerWaalsContact O-CB 3.31Å; C429-D433 WeakPolarHBondContact O-CB 3.36Å; C429-D433 PolarHBondContact O-N 3.49Å; D430-D433 PolarHBondContact O-N 3.27Å; D433-P437 WeakPolarHBondContact O-CD 3.24Å; D433-P437 WeakPolarHBondContact O-CG 3.47Å
434	E	72.6	Confident	67.2	Low	134 Å²	134	48.1 Å²	48.1	63%	0.626	25%	0.254	S	S	*	.	H	α-helix	trans	-73.2	-40.5	172.3	-173.9	178.8	177.8	0	0	113.1	D430 L432 Q438	D430-E434 WeakPolarHBondContact O-CB 3.31Å; D430-E434 PolarHBondContact O-N 3.48Å; L432-E434 PolarHBondContact O-N 3.16Å; E434-Q438 PolarHBondContact O-NE2 2.86Å
435	L	67.1	Low	67.6	Low	33 Å²	33	51 Å²	51	17%	0.173	27%	0.266	C	S	.	.	H	α-helix	trans	-87.1	-42.6	-171.1	-68.4	166.2	0	0	0	113.4	V377 S431 L432 P437 Q438 I439	V377-L435 HydrophobicContact CB-CD1 3.91Å; V377-L435 HydrophobicContact CG1-CD1 3.25Å; V377-L435 HydrophobicContact CG1-CD2 3.88Å; V377-L435 HydrophobicContact CG1-CG 4.2Å; S431-L435 WeakPolarHBondContact O-CB 3.41Å; S431-L435 VanDerWaalsContact O-CD1 3.29Å; S431-L435 WeakPolarHBondContact O-CD1 3.02Å; S431-L435 WeakPolarHBondContact O-CG 3.38Å; S431-L435 PolarHBondContact O-N 3.39Å; S431-L435 VanDerWaalsContact O-N 3.1Å; L432-L435 PolarHBondContact O-N 3.44Å; L435-P437 VanDerWaalsContact C-CD 3.44Å; L435-P437 VanDerWaalsContact C-N 3.3Å; L435-Q438 WeakPolarHBondContact O-CA 3.15Å; L435-Q438 WeakPolarHBondContact O-CB 3.42Å; L435-Q438 PolarHBondContact O-N 3.44Å; L435-I439 WeakPolarHBondContact O-CG1 3.47Å; L435-I439 PolarHBondContact O-N 3.44Å; L435-I439 VanDerWaalsContact O-N 3.13Å
436	L	69.4	Low	68.1	Low	24 Å²	24	49 Å²	49	13%	0.126	26%	0.256	C	S	.	.	H	α-helix	trans	-52.9	-41.3	-173.8	-168	98.6	0	0	0	112.7	M402 L432 Q438 I439 C440 L485 C486	M402-L436 HydrophobicContact CE-CD1 4.44Å; M402-L436 HydrophobicContact CG-CD1 3.62Å; M402-L436 HydrophobicContact SD-CD1 4.13Å; L432-L436 WeakPolarHBondContact O-CB 3.42Å; L432-L436 PolarHBondContact O-N 3.43Å; L436-Q438 PolarHBondContact O-N 2.88Å; L436-I439 PolarHBondContact O-N 2.93Å; L436-C440 WeakPolarHBondContact O-CB 3.26Å; L436-C440 PolarHBondContact O-N 3.42Å; L436-L485 VanDerWaalsContact CD2-O 3.25Å; L436-L485 WeakPolarHBondContact CD2-O 3.23Å; L436-C486 HydrophobicContact CD2-CB 4.04Å; L436-C486 WeakPolarHBondContact CD2-SG 3.29Å; L436-C486 VanDerWaalsContact CG-SG 3.5Å
437	P	71.1	Confident	68.3	Low	25 Å²	25	44.5 Å²	44.5	16%	0.162	23%	0.232	C	C	.	.	H	α-helix	trans	-56.9	-43.8	170.7	-28.5	38.2	0	0	0	114.4	D433 L435 I439 C440 Q441	D433-P437 WeakPolarHBondContact O-CD 3.24Å; D433-P437 WeakPolarHBondContact O-CG 3.47Å; L435-P437 VanDerWaalsContact C-CD 3.44Å; L435-P437 VanDerWaalsContact C-N 3.3Å; P437-I439 VanDerWaalsContact C-N 3.3Å; P437-I439 PolarHBondContact O-N 2.69Å; P437-C440 PolarHBondContact O-N 2.99Å; P437-Q441 WeakPolarHBondContact O-CB 3.05Å; P437-Q441 VanDerWaalsContact O-CG 3.3Å; P437-Q441 WeakPolarHBondContact O-CG 2.83Å; P437-Q441 PolarHBondContact O-N 3.48Å
438	Q	68.8	Low	68.4	Low	105 Å²	105	42.8 Å²	42.8	49%	0.491	22%	0.222	S	C	.	.	H	α-helix	trans	-63.4	-40.8	-179.5	-58	180	33.6	0	0	110.5	E434 L435 L436 Q441 A442	E434-Q438 PolarHBondContact O-NE2 2.86Å; L435-Q438 WeakPolarHBondContact O-CA 3.15Å; L435-Q438 WeakPolarHBondContact O-CB 3.42Å; L435-Q438 PolarHBondContact O-N 3.44Å; L436-Q438 PolarHBondContact O-N 2.88Å; Q438-Q441 PolarHBondContact O-N 3.45Å; Q438-A442 WeakPolarHBondContact O-CB 3.21Å; Q438-A442 PolarHBondContact O-N 3.38Å
439	I	66.5	Low	68.6	Low	21 Å²	21	47.2 Å²	47.2	11%	0.108	24%	0.239	C	C	.	.	H	α-helix	trans	-73.9	-37	-179.8	-33.8	165.5	0	0	0	111.8	L370 L373 V374 L435 L436 P437 A442 A443	L370-I439 HydrophobicContact CD2-CB 3.4Å; L370-I439 VanDerWaalsContact CD2-CB 3.4Å; L370-I439 HydrophobicContact CD2-CD1 4.07Å; L370-I439 HydrophobicContact CD2-CG1 4.33Å; L370-I439 HydrophobicContact CD2-CG2 3.04Å; L370-I439 HydrophobicContact CG-CG2 4.4Å; L373-I439 HydrophobicContact CB-CD1 4.33Å; L373-I439 HydrophobicContact CB-CG2 4.28Å; L373-I439 HydrophobicContact CD1-CG2 3.48Å; L373-I439 VanDerWaalsContact CD1-CG2 3.48Å; L373-I439 HydrophobicContact CG-CG2 4.4Å; V374-I439 HydrophobicContact CG2-CD1 4.12Å; L435-I439 WeakPolarHBondContact O-CG1 3.47Å; L435-I439 PolarHBondContact O-N 3.44Å; L435-I439 VanDerWaalsContact O-N 3.13Å; L436-I439 PolarHBondContact O-N 2.93Å; P437-I439 VanDerWaalsContact C-N 3.3Å; P437-I439 PolarHBondContact O-N 2.69Å; I439-A442 PolarHBondContact O-N 3.42Å; I439-A443 WeakPolarHBondContact O-CB 3.48Å; I439-A443 PolarHBondContact O-N 2.85Å
440	C	69.7	Low	68.4	Low	7 Å²	7	46.7 Å²	46.7	5%	0.047	23%	0.234	C	C	.	.	H	α-helix	trans	-58.7	-45.5	170.5	-98.8	0	0	0	0	111.8	L436 P437 A442 A443 E444 F482 C486	L436-C440 WeakPolarHBondContact O-CB 3.26Å; L436-C440 PolarHBondContact O-N 3.42Å; P437-C440 PolarHBondContact O-N 2.99Å; C440-A442 VanDerWaalsContact C-N 3.35Å; C440-A442 PolarHBondContact O-N 2.99Å; C440-A443 PolarHBondContact O-N 3.49Å; C440-E444 WeakPolarHBondContact O-CB 3.3Å; C440-E444 PolarHBondContact O-N 3.37Å; C440-F482 HydrophobicContact CB-CD1 4.35Å; C440-F482 HydrophobicContact CB-CE1 4.4Å; C440-C486 HydrophobicContact CB-CB 3.92Å; C440-C486 WeakPolarHBondContact CB-SG 3.31Å; C440-C486 WeakPolarHBondContact SG-CB 3.35Å; C440-C486 CovalentContact SG-SG 2.05Å; C440-C486 PolarHBondContact SG-SG 3.1Å
441	Q	71.1	Confident	68	Low	86 Å²	86	42 Å²	42	40%	0.402	21%	0.209	S	C	.	.	H	α-helix	trans	-61.6	-41.7	175.3	-74.3	174.8	11.7	0	0	112.2	P437 Q438 A443 E444 E445	P437-Q441 WeakPolarHBondContact O-CB 3.05Å; P437-Q441 VanDerWaalsContact O-CG 3.3Å; P437-Q441 WeakPolarHBondContact O-CG 2.83Å; P437-Q441 PolarHBondContact O-N 3.48Å; Q438-Q441 PolarHBondContact O-N 3.45Å; Q441-A443 VanDerWaalsContact C-N 3.34Å; Q441-E444 WeakPolarHBondContact O-CB 3.02Å; Q441-E444 PolarHBondContact O-N 3.37Å; Q441-E445 WeakPolarHBondContact O-CG 3.34Å; Q441-E445 PolarHBondContact O-N 3.01Å
442	A	66.4	Low	67.8	Low	27 Å²	27	42.6 Å²	42.6	22%	0.223	22%	0.215	C	C	.	.	H	α-helix	trans	-67.6	-36.4	178.5	0	0	0	0	0	111.6	Q438 I439 C440 R446	Q438-A442 WeakPolarHBondContact O-CB 3.21Å; Q438-A442 PolarHBondContact O-N 3.38Å; I439-A442 PolarHBondContact O-N 3.42Å; C440-A442 VanDerWaalsContact C-N 3.35Å; C440-A442 PolarHBondContact O-N 2.99Å; A442-R446 WeakPolarHBondContact O-CG 3.11Å; A442-R446 PolarHBondContact O-N 3.12Å; A442-R446 PolarHBondContact O-NH1 3.35Å
443	A	66.8	Low	67.4	Low	4 Å²	4	44.2 Å²	44.2	3%	0.033	22%	0.222	C	C	.	.	H	α-helix	trans	-66.8	-42.8	172	0	0	0	0	0	111.2	F326 V366 I439 C440 Q441 R446 L447 F482	F326-A443 HydrophobicContact CE1-CB 4.16Å; V366-A443 HydrophobicContact CG1-CB 3.77Å; I439-A443 WeakPolarHBondContact O-CB 3.48Å; I439-A443 PolarHBondContact O-N 2.85Å; C440-A443 PolarHBondContact O-N 3.49Å; Q441-A443 VanDerWaalsContact C-N 3.34Å; A443-R446 PolarHBondContact O-N 2.92Å; A443-L447 WeakPolarHBondContact O-CG 3.24Å; A443-L447 PolarHBondContact O-N 3.3Å; A443-F482 HydrophobicContact CB-CE1 4.15Å; A443-F482 HydrophobicContact CB-CZ 4.07Å
444	E	70.8	Confident	66.6	Low	14 Å²	14	40 Å²	40	7%	0.065	20%	0.199	C	C	.	.	H	α-helix	trans	-59.4	-47	176.4	-171.9	-170.7	-171.6	0	0	112.1	C440 Q441 R446 L447 C448 I490 T491 K492 V493	C440-E444 WeakPolarHBondContact O-CB 3.3Å; C440-E444 PolarHBondContact O-N 3.37Å; Q441-E444 WeakPolarHBondContact O-CB 3.02Å; Q441-E444 PolarHBondContact O-N 3.37Å; E444-R446 VanDerWaalsContact C-N 3.27Å; E444-R446 PolarHBondContact O-N 3.41Å; E444-L447 CarbonylContact O-C 3.58Å; E444-L447 WeakPolarHBondContact O-CB 3.48Å; E444-L447 PolarHBondContact O-N 3.13Å; E444-C448 WeakPolarHBondContact O-CB 3.36Å; E444-C448 PolarHBondContact O-N 3.27Å; E444-C448 PolarHBondContact O-SG 3.08Å; E444-I490 HydrophobicContact CB-CG2 4.28Å; E444-I490 HydrophobicContact CG-CB 3.99Å; E444-I490 HydrophobicContact CG-CG2 3.92Å; E444-I490 WeakPolarHBondContact OE1-CA 3.42Å; E444-T491 PolarHBondContact OE1-N 3.5Å; E444-K492 HydrophobicContact CG-CB 4.33Å; E444-K492 WeakPolarHBondContact OE1-CA 3.31Å; E444-K492 VanDerWaalsContact OE1-CB 3.31Å; E444-K492 WeakPolarHBondContact OE1-CB 3.35Å; E444-K492 PolarHBondContact OE1-N 2.97Å; E444-V493 HydrophobicContact CG-CG2 3.68Å; E444-V493 PolarHBondContact OE1-N 3.29Å; E444-V493 VanDerWaalsContact OE1-N 3.11Å
445	E	69	Low	65.6	Low	96 Å²	96	35.3 Å²	35.3	45%	0.449	19%	0.186	S	C	.	.	H	α-helix	trans	-59.7	-38.9	178	-76.9	-177.3	169.7	0	0	112.1	Q441 C448 R449 K492	Q441-E445 WeakPolarHBondContact O-CG 3.34Å; Q441-E445 PolarHBondContact O-N 3.01Å; E445-C448 WeakPolarHBondContact O-CB 3.41Å; E445-C448 PolarHBondContact O-N 3.23Å; E445-R449 WeakPolarHBondContact O-CG 3.46Å; E445-R449 PolarHBondContact O-N 3.38Å; E445-K492 HydrophobicContact CG-CD 4.07Å; E445-K492 IonicContact OE1-NZ 2.8Å; E445-K492 PolarHBondContact OE1-NZ 3.34Å
446	R	67.3	Low	65	Low	38 Å²	38	38.5 Å²	38.5	14%	0.143	20%	0.199	C	C	.	.	H	α-helix	trans	-70.6	-41.1	177	-69.7	175.2	-178.7	91.3	-3	111.8	F326 A329 A442 A443 E444 C448 R449 F450	F326-R446 VanDerWaalsContact CD1-CD 3.49Å; F326-R446 HydrophobicContact CD2-CB 4.33Å; F326-R446 HydrophobicContact CE1-CB 4.09Å; F326-R446 HydrophobicContact CE1-CG 4.46Å; F326-R446 HydrophobicContact CE2-CB 3.57Å; F326-R446 HydrophobicContact CE2-CG 4.38Å; F326-R446 HydrophobicContact CZ-CB 3.47Å; F326-R446 VanDerWaalsContact CZ-CB 3.47Å; F326-R446 HydrophobicContact CZ-CG 4.27Å; A329-R446 PolarHBondContact O-NH2 3.2Å; A442-R446 WeakPolarHBondContact O-CG 3.11Å; A442-R446 PolarHBondContact O-N 3.12Å; A442-R446 PolarHBondContact O-NH1 3.35Å; A443-R446 PolarHBondContact O-N 2.92Å; E444-R446 VanDerWaalsContact C-N 3.27Å; E444-R446 PolarHBondContact O-N 3.41Å; R446-C448 VanDerWaalsContact C-N 3.27Å; R446-C448 PolarHBondContact O-N 3.28Å; R446-R449 PolarHBondContact O-N 3.38Å; R446-F450 WeakPolarHBondContact O-CB 3.34Å; R446-F450 PolarHBondContact O-N 3.28Å
447	L	68	Low	64.1	Low	4 Å²	4	43.9 Å²	43.9	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-58.9	-42.2	169.9	-70.1	173.2	0	0	0	110.8	F322 I362 A443 E444 F450 I451 I478 F482 V493	F322-L447 HydrophobicContact CE2-CD2 3.94Å; F322-L447 HydrophobicContact CZ-CD2 3.99Å; I362-L447 HydrophobicContact CG2-CD2 3.47Å; I362-L447 VanDerWaalsContact CG2-CD2 3.47Å; A443-L447 WeakPolarHBondContact O-CG 3.24Å; A443-L447 PolarHBondContact O-N 3.3Å; E444-L447 CarbonylContact O-C 3.58Å; E444-L447 WeakPolarHBondContact O-CB 3.48Å; E444-L447 PolarHBondContact O-N 3.13Å; L447-F450 PolarHBondContact O-N 2.94Å; L447-I451 WeakPolarHBondContact O-CB 3.35Å; L447-I451 WeakPolarHBondContact O-CG1 3.44Å; L447-I451 PolarHBondContact O-N 3.34Å; L447-I478 HydrophobicContact CD1-CG2 4.39Å; L447-F482 HydrophobicContact CD1-CE2 3.89Å; L447-F482 HydrophobicContact CD1-CZ 3.79Å; L447-V493 HydrophobicContact CB-CG2 3.97Å
448	C	68.9	Low	63.1	Low	19 Å²	19	48.8 Å²	48.8	13%	0.128	24%	0.243	C	C	.	.	H	α-helix	trans	-61	-45.8	174.1	-70.2	0	0	0	0	111.3	E444 E445 R446 F450 I451 A452 K492 V493	E444-C448 WeakPolarHBondContact O-CB 3.36Å; E444-C448 PolarHBondContact O-N 3.27Å; E444-C448 PolarHBondContact O-SG 3.08Å; E445-C448 WeakPolarHBondContact O-CB 3.41Å; E445-C448 PolarHBondContact O-N 3.23Å; R446-C448 VanDerWaalsContact C-N 3.27Å; R446-C448 PolarHBondContact O-N 3.28Å; C448-F450 VanDerWaalsContact C-N 3.32Å; C448-F450 PolarHBondContact O-N 3.27Å; C448-I451 PolarHBondContact O-N 3.06Å; C448-A452 WeakPolarHBondContact O-CA 3.21Å; C448-A452 WeakPolarHBondContact O-CB 3.45Å; C448-A452 PolarHBondContact O-N 3Å; C448-K492 WeakPolarHBondContact SG-CB 3.39Å; C448-V493 WeakPolarHBondContact SG-CG2 3.5Å; C448-V493 PolarHBondContact SG-N 2.86Å
449	R	66	Low	62.3	Low	93 Å²	93	44 Å²	44	35%	0.351	22%	0.221	S	C	.	.	H	α-helix	trans	-58.9	-46.2	175.9	-70.3	-167.3	-55.3	-155.4	14.4	110.9	E325 E445 R446 A452 F453	E325-R449 IonicContact OE2-CZ 3.51Å; E325-R449 IonicContact OE2-NE 3.28Å; E325-R449 IonicContact OE2-NH2 2.55Å; E325-R449 PolarHBondContact OE2-NH2 3.49Å; E445-R449 WeakPolarHBondContact O-CG 3.46Å; E445-R449 PolarHBondContact O-N 3.38Å; R446-R449 PolarHBondContact O-N 3.38Å; R449-A452 WeakPolarHBondContact O-CA 3.26Å; R449-A452 WeakPolarHBondContact O-CB 3.28Å; R449-A452 PolarHBondContact O-N 3.22Å; R449-A452 VanDerWaalsContact O-N 3.12Å; R449-F453 WeakPolarHBondContact O-CD2 3.46Å; R449-F453 PolarHBondContact O-N 3.06Å
450	F	62.8	Low	61.6	Low	12 Å²	12	45.2 Å²	45.2	5%	0.053	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-47.6	177.8	172.3	-106.4	0	0	0	112.9	F318 F321 L343 V347 I362 R446 L447 C448 A452 F453	F318-F450 HydrophobicContact CD2-CE2 4.25Å; F318-F450 HydrophobicContact CD2-CZ 4.2Å; F318-F450 HydrophobicContact CE2-CD2 4.3Å; F318-F450 HydrophobicContact CE2-CE1 4.01Å; F318-F450 AromaticContact CE2-CE2 3.42Å; F318-F450 HydrophobicContact CE2-CE2 3.42Å; F318-F450 VanDerWaalsContact CE2-CE2 3.42Å; F318-F450 AromaticContact CE2-CZ 3.23Å; F318-F450 HydrophobicContact CE2-CZ 3.23Å; F318-F450 HydrophobicContact CZ-CE1 4.19Å; F318-F450 HydrophobicContact CZ-CE2 4.31Å; F318-F450 AromaticContact CZ-CZ 3.85Å; F318-F450 HydrophobicContact CZ-CZ 3.85Å; F321-F450 HydrophobicContact CE1-CD2 4.39Å; L343-F450 HydrophobicContact CD1-CD2 4.06Å; L343-F450 HydrophobicContact CD1-CE2 3.68Å; L343-F450 HydrophobicContact CD2-CD2 4.17Å; L343-F450 HydrophobicContact CD2-CE2 4.4Å; L343-F450 HydrophobicContact CG-CE2 4.29Å; V347-F450 HydrophobicContact CG2-CE2 3.56Å; V347-F450 HydrophobicContact CG2-CZ 3.56Å; I362-F450 HydrophobicContact CD1-CE1 4.42Å; R446-F450 WeakPolarHBondContact O-CB 3.34Å; R446-F450 PolarHBondContact O-N 3.28Å; L447-F450 PolarHBondContact O-N 2.94Å; C448-F450 VanDerWaalsContact C-N 3.32Å; C448-F450 PolarHBondContact O-N 3.27Å; F450-A452 VanDerWaalsContact C-N 3.25Å; F450-A452 PolarHBondContact O-N 2.92Å; F450-F453 PolarHBondContact O-N 3.04Å
451	I	61.8	Low	61.1	Low	12 Å²	12	50.5 Å²	50.5	6%	0.062	25%	0.254	C	S	.	.	H	α-helix	trans	-68	-31.2	175	-57.7	165.6	0	0	0	109.9	L447 C448 F453 R454 G455 F471 V493 Y496 V497 M500	L447-I451 WeakPolarHBondContact O-CB 3.35Å; L447-I451 WeakPolarHBondContact O-CG1 3.44Å; L447-I451 PolarHBondContact O-N 3.34Å; C448-I451 PolarHBondContact O-N 3.06Å; I451-F453 PolarHBondContact O-N 3.32Å; I451-R454 CarbonylContact O-C 3.6Å; I451-R454 VanDerWaalsContact O-CA 3.24Å; I451-R454 WeakPolarHBondContact O-CA 3.29Å; I451-R454 WeakPolarHBondContact O-CB 3.14Å; I451-R454 PolarHBondContact O-N 3.47Å; I451-G455 PolarHBondContact O-N 3.24Å; I451-F471 HydrophobicContact CG2-CZ 3.76Å; I451-V493 HydrophobicContact CD1-CG1 3.64Å; I451-V493 HydrophobicContact CD1-CG2 4.43Å; I451-Y496 HydrophobicContact CB-CD1 4.05Å; I451-Y496 HydrophobicContact CB-CE1 4.38Å; I451-Y496 HydrophobicContact CG2-CD1 3.37Å; I451-Y496 HydrophobicContact CG2-CE1 3.68Å; I451-Y496 HydrophobicContact CG2-CG 4.47Å; I451-Y496 VanDerWaalsContact O-CE1 3.23Å; I451-Y496 WeakPolarHBondContact O-CE1 3.25Å; I451-V497 HydrophobicContact CD1-CG2 4.44Å; I451-V497 HydrophobicContact CG2-CG2 4.47Å; I451-M500 HydrophobicContact CG2-SD 3.48Å; I451-M500 WeakPolarHBondContact CG2-SD 3.17Å
452	A	62.7	Low	60.5	Low	35 Å²	35	49.3 Å²	49.3	29%	0.289	25%	0.252	S	S	.	.	H	α-helix	trans	-64	-39.9	178.2	0	0	0	0	0	113	C448 R449 F450 R454 G455 Y496	C448-A452 WeakPolarHBondContact O-CA 3.21Å; C448-A452 WeakPolarHBondContact O-CB 3.45Å; C448-A452 PolarHBondContact O-N 3Å; R449-A452 WeakPolarHBondContact O-CA 3.26Å; R449-A452 WeakPolarHBondContact O-CB 3.28Å; R449-A452 PolarHBondContact O-N 3.22Å; R449-A452 VanDerWaalsContact O-N 3.12Å; F450-A452 VanDerWaalsContact C-N 3.25Å; F450-A452 PolarHBondContact O-N 2.92Å; A452-R454 PolarHBondContact O-N 2.94Å; A452-R454 VanDerWaalsContact O-N 3.17Å; A452-G455 PolarHBondContact O-N 3.26Å; A452-Y496 VanDerWaalsContact CA-OH 3.24Å; A452-Y496 WeakPolarHBondContact CA-OH 3.49Å; A452-Y496 HydrophobicContact CB-CD2 4.42Å; A452-Y496 HydrophobicContact CB-CE2 3.79Å; A452-Y496 PolarHBondContact O-OH 3.28Å; A452-Y496 VanDerWaalsContact O-OH 3.09Å
453	F	57.4	Low	60.3	Low	45 Å²	45	48.7 Å²	48.7	20%	0.197	25%	0.245	C	C	.	.	H	α-helix	trans	-57.7	-27.1	168.8	-75.6	-70	0	0	0	112.5	Q340 L343 R449 F450 I451	Q340-F453 HydrophobicContact CG-CD1 4.12Å; Q340-F453 HydrophobicContact CG-CE1 3.84Å; L343-F453 HydrophobicContact CD2-CB 3.67Å; L343-F453 HydrophobicContact CD2-CD2 3.93Å; L343-F453 HydrophobicContact CD2-CG 3.84Å; R449-F453 WeakPolarHBondContact O-CD2 3.46Å; R449-F453 PolarHBondContact O-N 3.06Å; F450-F453 PolarHBondContact O-N 3.04Å; I451-F453 PolarHBondContact O-N 3.32Å
454	R	54.6	Low	60.3	Low	6 Å²	6	51 Å²	51	2%	0.023	27%	0.265	C	S	.	.	H	α-helix	trans	-79.7	-15.1	172.3	-47.4	-158.2	-167.6	-148.8	1.8	115	V347 F358 I451 A452 K456 F459 M500	V347-R454 HydrophobicContact CG1-CG 4.07Å; V347-R454 VanDerWaalsContact CG1-NE 3.27Å; F358-R454 VanDerWaalsContact CZ-NH2 3.33Å; I451-R454 CarbonylContact O-C 3.6Å; I451-R454 VanDerWaalsContact O-CA 3.24Å; I451-R454 WeakPolarHBondContact O-CA 3.29Å; I451-R454 WeakPolarHBondContact O-CB 3.14Å; I451-R454 PolarHBondContact O-N 3.47Å; A452-R454 PolarHBondContact O-N 2.94Å; A452-R454 VanDerWaalsContact O-N 3.17Å; R454-K456 VanDerWaalsContact C-N 3.3Å; R454-K456 PolarHBondContact O-N 3.34Å; R454-F459 HydrophobicContact CB-CD1 3.86Å; R454-F459 HydrophobicContact CB-CD2 3.95Å; R454-F459 HydrophobicContact CB-CE1 3.89Å; R454-F459 HydrophobicContact CB-CE2 4.02Å; R454-F459 HydrophobicContact CB-CG 3.87Å; R454-F459 HydrophobicContact CB-CZ 3.95Å; R454-F459 VanDerWaalsContact CD-CE2 3.5Å; R454-F459 HydrophobicContact CG-CD2 4.39Å; R454-F459 HydrophobicContact CG-CE2 4.12Å; R454-F459 HydrophobicContact CG-CZ 4.19Å; R454-F459 WeakPolarHBondContact O-CB 3.22Å; R454-F459 WeakPolarHBondContact O-CD1 3.28Å; R454-F459 WeakPolarHBondContact O-CG 3.49Å; R454-M500 HydrophobicContact CB-CE 4.04Å
455	G	51.6	Low	60.3	Low	35 Å²	35	53.1 Å²	53.1	36%	0.361	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-4.2	179.8	0	0	0	0	0	114.6	I451 A452 Y496	I451-G455 PolarHBondContact O-N 3.24Å; A452-G455 PolarHBondContact O-N 3.26Å; G455-Y496 WeakPolarHBondContact CA-OH 3.41Å; G455-Y496 PolarHBondContact N-OH 2.99Å
456	K	53.6	Low	60.4	Low	101 Å²	101	54.8 Å²	54.8	44%	0.439	29%	0.286	S	S	.	.	S	Bend	trans	-67.2	143.1	176.1	-64.4	-168.4	-178.4	-176	0	110.1	R454 H458 F459	R454-K456 VanDerWaalsContact C-N 3.3Å; R454-K456 PolarHBondContact O-N 3.34Å; K456-H458 PolarHBondContact O-N 3.06Å; K456-F459 PolarHBondContact O-N 2.93Å
457	E	51.2	Low	60.4	Low	136 Å²	136	54.2 Å²	54.2	64%	0.636	29%	0.285	S	S	*	.	H	α-helix	trans	-38.1	-36.4	-166.5	-72.2	-170.8	161.4	0	0	116.3	F459 S460 K461	E457-F459 PolarHBondContact O-N 3.28Å; E457-S460 PolarHBondContact O-OG 3.4Å; E457-K461 WeakPolarHBondContact O-CG 3.43Å; E457-K461 PolarHBondContact O-N 3.48Å; E457-K461 IonicContact OE2-NZ 3.97Å
458	H	50.6	Low	60.6	Low	128 Å²	128	54.4 Å²	54.4	59%	0.593	29%	0.286	S	S	*	.	H	α-helix	trans	-59	-44.2	-179.3	-75	-82.8	0	0	0	113.4	K456 S460 K461 T462	K456-H458 PolarHBondContact O-N 3.06Å; H458-S460 PolarHBondContact O-N 3.48Å; H458-K461 WeakPolarHBondContact O-CB 3.42Å; H458-K461 PolarHBondContact O-N 3.18Å; H458-K461 VanDerWaalsContact O-N 3.13Å; H458-T462 PolarHBondContact O-N 2.89Å; H458-T462 PolarHBondContact O-OG1 2.9Å
459	F	51.4	Low	60.7	Low	6 Å²	6	53.7 Å²	53.7	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-68.8	-40.6	-174	-171.8	-97	0	0	0	112.5	V347 T348 L351 R454 K456 E457 K461 T462 L463 M500	V347-F459 HydrophobicContact CG1-CE2 3.84Å; T348-F459 HydrophobicContact CG2-CD2 4.08Å; T348-F459 HydrophobicContact CG2-CE2 4.37Å; L351-F459 HydrophobicContact CD1-CE2 3.69Å; L351-F459 HydrophobicContact CD1-CZ 3.41Å; L351-F459 VanDerWaalsContact CD1-CZ 3.41Å; R454-F459 HydrophobicContact CB-CD1 3.86Å; R454-F459 HydrophobicContact CB-CD2 3.95Å; R454-F459 HydrophobicContact CB-CE1 3.89Å; R454-F459 HydrophobicContact CB-CE2 4.02Å; R454-F459 HydrophobicContact CB-CG 3.87Å; R454-F459 HydrophobicContact CB-CZ 3.95Å; R454-F459 VanDerWaalsContact CD-CE2 3.5Å; R454-F459 HydrophobicContact CG-CD2 4.39Å; R454-F459 HydrophobicContact CG-CE2 4.12Å; R454-F459 HydrophobicContact CG-CZ 4.19Å; R454-F459 WeakPolarHBondContact O-CB 3.22Å; R454-F459 WeakPolarHBondContact O-CD1 3.28Å; R454-F459 WeakPolarHBondContact O-CG 3.49Å; K456-F459 PolarHBondContact O-N 2.93Å; E457-F459 PolarHBondContact O-N 3.28Å; F459-K461 PolarHBondContact O-N 3.01Å; F459-T462 PolarHBondContact O-N 2.77Å; F459-L463 HydrophobicContact CD1-CD1 4.1Å; F459-L463 HydrophobicContact CE1-CD1 3.4Å; F459-L463 HydrophobicContact CE1-CG 4.41Å; F459-L463 HydrophobicContact CE2-CD1 4.08Å; F459-L463 HydrophobicContact CZ-CD1 3.41Å; F459-L463 VanDerWaalsContact CZ-CD1 3.41Å; F459-L463 HydrophobicContact CZ-CG 4.32Å; F459-M500 HydrophobicContact CD1-CE 3.56Å; F459-M500 HydrophobicContact CE1-CE 3.34Å; F459-M500 HydrophobicContact CZ-CE 4.43Å
460	S	52.9	Low	60.9	Low	46 Å²	46	49.9 Å²	49.9	32%	0.322	27%	0.27	S	S	.	.	H	α-helix	trans	-61.8	-24.2	175.3	73.9	0	0	0	0	112.5	E457 H458 R507	E457-S460 PolarHBondContact O-OG 3.4Å; H458-S460 PolarHBondContact O-N 3.48Å; S460-R507 PolarHBondContact O-NH1 3.41Å
461	K	59	Low	61.2	Low	117 Å²	117	49.3 Å²	49.3	51%	0.509	27%	0.268	S	S	.	.	H	α-helix	trans	-83.7	-31.1	-179.3	-75	174.4	-176	165.9	0	113	E457 H458 F459 R507	E457-K461 WeakPolarHBondContact O-CG 3.43Å; E457-K461 PolarHBondContact O-N 3.48Å; E457-K461 IonicContact OE2-NZ 3.97Å; H458-K461 WeakPolarHBondContact O-CB 3.42Å; H458-K461 PolarHBondContact O-N 3.18Å; H458-K461 VanDerWaalsContact O-N 3.13Å; F459-K461 PolarHBondContact O-N 3.01Å; K461-R507 PolarHBondContact O-NH1 3.27Å; K461-R507 PolarHBondContact O-NH2 2.97Å
462	T	57.3	Low	61.7	Low	62 Å²	62	48.9 Å²	48.9	38%	0.38	27%	0.266	S	S	.	.	H	α-helix	trans	-88.3	-33.2	-167.8	-50.5	0	0	0	0	114.1	T348 H458 F459	T348-T462 HydrophobicContact CG2-CG2 4.33Å; H458-T462 PolarHBondContact O-N 2.89Å; H458-T462 PolarHBondContact O-OG1 2.9Å; F459-T462 PolarHBondContact O-N 2.77Å
463	L	63.3	Low	62.2	Low	14 Å²	14	52.8 Å²	52.8	7%	0.073	28%	0.276	C	S	.	.			trans	-80.2	138.3	-171.1	-63.2	179.3	0	0	0	114.1	L351 F459 E467	L351-L463 HydrophobicContact CB-CD2 3.91Å; L351-L463 HydrophobicContact CD1-CD1 3.57Å; L351-L463 HydrophobicContact CD1-CD2 3.59Å; L351-L463 HydrophobicContact CD1-CG 4.2Å; L351-L463 HydrophobicContact CG-CD2 4.44Å; F459-L463 HydrophobicContact CD1-CD1 4.1Å; F459-L463 HydrophobicContact CE1-CD1 3.4Å; F459-L463 HydrophobicContact CE1-CG 4.41Å; F459-L463 HydrophobicContact CE2-CD1 4.08Å; F459-L463 HydrophobicContact CZ-CD1 3.41Å; F459-L463 VanDerWaalsContact CZ-CD1 3.41Å; F459-L463 HydrophobicContact CZ-CG 4.32Å; L463-E467 WeakPolarHBondContact CA-OE2 3.46Å; L463-E467 HydrophobicContact CB-CB 4.29Å; L463-E467 HydrophobicContact CD2-CB 4.07Å; L463-E467 VanDerWaalsContact CD2-OE2 3.29Å; L463-E467 WeakPolarHBondContact CD2-OE2 2.98Å
464	A	66.1	Low	62.8	Low	53 Å²	53	51.5 Å²	51.5	44%	0.438	27%	0.271	S	S	.	.			trans	-73.6	158.4	166.7	0	0	0	0	0	111.4	E466 E467 F468	A464-E466 VanDerWaalsContact C-N 3.27Å; A464-E466 PolarHBondContact O-N 3.44Å; A464-E467 HydrophobicContact CB-CG 4.29Å; A464-E467 PolarHBondContact N-OE2 2.94Å; A464-E467 WeakPolarHBondContact O-CB 3.43Å; A464-E467 PolarHBondContact O-N 3.35Å; A464-F468 PolarHBondContact O-N 2.85Å; A464-F468 VanDerWaalsContact O-N 3.13Å
465	T	71	Confident	63.5	Low	57 Å²	57	51.4 Å²	51.4	35%	0.35	27%	0.271	S	S	.	.	H	α-helix	trans	-52.2	-42.7	179.4	-52.6	0	0	0	0	112.7	E467 F468 V469 F504 L593	T465-E467 PolarHBondContact O-N 2.95Å; T465-F468 PolarHBondContact O-N 3.4Å; T465-V469 VanDerWaalsContact O-CG2 3.31Å; T465-V469 WeakPolarHBondContact O-CG2 3.47Å; T465-V469 PolarHBondContact O-N 3.3Å; T465-F504 HydrophobicContact CG2-CZ 4Å; T465-L593 HydrophobicContact CG2-CD1 3.88Å
466	E	70.5	Confident	64.6	Low	131 Å²	131	52.4 Å²	52.4	61%	0.612	27%	0.268	S	S	*	.	H	α-helix	trans	-63	-40.4	179.5	-64.3	-173.9	176.5	0	0	112.7	K354 A464 F468 V469 G470	K354-E466 IonicContact NZ-OE2 3.92Å; K354-E466 PolarHBondContact NZ-OE2 2.78Å; A464-E466 VanDerWaalsContact C-N 3.27Å; A464-E466 PolarHBondContact O-N 3.44Å; E466-F468 VanDerWaalsContact C-N 3.34Å; E466-V469 PolarHBondContact O-N 2.74Å; E466-G470 PolarHBondContact O-N 3.11Å
467	E	68.7	Low	65.5	Low	26 Å²	26	52.2 Å²	52.2	12%	0.121	27%	0.269	C	S	.	.	H	α-helix	trans	-67.6	-39.3	-179.1	-60	172.3	149.2	0	0	110.5	R352 L463 A464 T465 G470 F471	R352-E467 WeakPolarHBondContact CA-OE1 3.26Å; L463-E467 WeakPolarHBondContact CA-OE2 3.46Å; L463-E467 HydrophobicContact CB-CB 4.29Å; L463-E467 HydrophobicContact CD2-CB 4.07Å; L463-E467 VanDerWaalsContact CD2-OE2 3.29Å; L463-E467 WeakPolarHBondContact CD2-OE2 2.98Å; A464-E467 HydrophobicContact CB-CG 4.29Å; A464-E467 PolarHBondContact N-OE2 2.94Å; A464-E467 WeakPolarHBondContact O-CB 3.43Å; A464-E467 PolarHBondContact O-N 3.35Å; T465-E467 PolarHBondContact O-N 2.95Å; E467-G470 PolarHBondContact O-N 2.79Å; E467-F471 PolarHBondContact O-N 2.72Å
468	F	70.6	Confident	66.3	Low	9 Å²	9	46.8 Å²	46.8	4%	0.039	24%	0.244	C	C	.	.	H	α-helix	trans	-68.4	-38.8	177.5	-166.4	-98.3	0	0	0	112.8	A464 T465 E466 F471 T472 M500 V501 F504	A464-F468 PolarHBondContact O-N 2.85Å; A464-F468 VanDerWaalsContact O-N 3.13Å; T465-F468 PolarHBondContact O-N 3.4Å; E466-F468 VanDerWaalsContact C-N 3.34Å; F468-F471 WeakPolarHBondContact O-CB 3.39Å; F468-F471 PolarHBondContact O-N 2.84Å; F468-T472 PolarHBondContact O-N 3.43Å; F468-T472 PolarHBondContact O-OG1 2.84Å; F468-M500 HydrophobicContact CE2-CB 4.3Å; F468-M500 HydrophobicContact CZ-CB 4.24Å; F468-V501 HydrophobicContact CE1-CB 3.9Å; F468-V501 HydrophobicContact CE1-CG1 4.1Å; F468-V501 HydrophobicContact CE1-CG2 3.47Å; F468-V501 VanDerWaalsContact CE1-CG2 3.47Å; F468-V501 VanDerWaalsContact CZ-CA 3.41Å; F468-V501 HydrophobicContact CZ-CB 3.99Å; F468-V501 HydrophobicContact CZ-CG2 3.52Å; F468-F504 HydrophobicContact CB-CD2 4.29Å; F468-F504 HydrophobicContact CB-CE2 4.28Å; F468-F504 HydrophobicContact CD1-CB 4.07Å; F468-F504 AromaticContact CD1-CD1 3.71Å; F468-F504 HydrophobicContact CD1-CD1 3.71Å; F468-F504 HydrophobicContact CD1-CD2 4.12Å; F468-F504 HydrophobicContact CD1-CE1 4.23Å; F468-F504 AromaticContact CD1-CG 3.67Å; F468-F504 HydrophobicContact CD1-CG 3.67Å; F468-F504 HydrophobicContact CD2-CB 4.35Å; F468-F504 HydrophobicContact CD2-CD2 4.32Å; F468-F504 HydrophobicContact CD2-CG 4.35Å; F468-F504 HydrophobicContact CE1-CB 3.75Å; F468-F504 AromaticContact CE1-CD1 3.95Å; F468-F504 HydrophobicContact CE1-CD1 3.95Å; F468-F504 AromaticContact CE1-CG 3.86Å; F468-F504 HydrophobicContact CE1-CG 3.86Å; F468-F504 HydrophobicContact CE2-CB 4.08Å; F468-F504 HydrophobicContact CG-CB 4.37Å; F468-F504 HydrophobicContact CG-CD1 4.37Å; F468-F504 AromaticContact CG-CD2 3.95Å; F468-F504 HydrophobicContact CG-CD2 3.95Å; F468-F504 HydrophobicContact CG-CE2 4.39Å; F468-F504 AromaticContact CG-CG 3.95Å; F468-F504 HydrophobicContact CG-CG 3.95Å; F468-F504 HydrophobicContact CZ-CB 3.79Å; F468-F504 HydrophobicContact CZ-CG 4.32Å
469	V	71.9	Confident	67.3	Low	4 Å²	4	40.9 Å²	40.9	2%	0.024	22%	0.216	C	C	.	.	H	α-helix	trans	-64.6	-43.1	172.3	172.2	0	0	0	0	110.9	T465 E466 F471 T472 K473 M596 L597	T465-V469 VanDerWaalsContact O-CG2 3.31Å; T465-V469 WeakPolarHBondContact O-CG2 3.47Å; T465-V469 PolarHBondContact O-N 3.3Å; E466-V469 PolarHBondContact O-N 2.74Å; V469-F471 VanDerWaalsContact C-N 3.3Å; V469-F471 PolarHBondContact O-N 3.3Å; V469-T472 PolarHBondContact O-N 2.86Å; V469-K473 HydrophobicContact CG1-CD 4.26Å; V469-K473 HydrophobicContact CG1-CG 4.44Å; V469-K473 WeakPolarHBondContact O-CG 3.16Å; V469-K473 PolarHBondContact O-N 3.28Å; V469-M596 HydrophobicContact CB-CB 4.49Å; V469-M596 HydrophobicContact CB-CE 4.47Å; V469-M596 HydrophobicContact CG1-CB 3.91Å; V469-M596 HydrophobicContact CG1-CE 3.64Å; V469-M596 HydrophobicContact CG2-CB 3.72Å; V469-M596 HydrophobicContact CG2-CG 4.49Å; V469-L597 HydrophobicContact CG2-CD2 4.2Å; V469-L597 HydrophobicContact CG2-CG 4.17Å
470	G	69.7	Low	68.3	Low	12 Å²	12	44.7 Å²	44.7	12%	0.124	24%	0.237	C	C	.	.	H	α-helix	trans	-57.4	-44.3	174.4	0	0	0	0	0	112	E466 E467 T472 M474	E466-G470 PolarHBondContact O-N 3.11Å; E467-G470 PolarHBondContact O-N 2.79Å; G470-T472 PolarHBondContact O-N 3.32Å; G470-M474 WeakPolarHBondContact O-CB 3.31Å; G470-M474 PolarHBondContact O-N 3.34Å
471	F	70.4	Confident	69	Low	1 Å²	1	43.9 Å²	43.9	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-60.1	-43.2	173.9	175.5	-97.6	0	0	0	112.8	I451 E467 F468 V469 M474 V475 V497 M500	I451-F471 HydrophobicContact CG2-CZ 3.76Å; E467-F471 PolarHBondContact O-N 2.72Å; F468-F471 WeakPolarHBondContact O-CB 3.39Å; F468-F471 PolarHBondContact O-N 2.84Å; V469-F471 VanDerWaalsContact C-N 3.3Å; V469-F471 PolarHBondContact O-N 3.3Å; F471-M474 HydrophobicContact CB-CE 4.45Å; F471-M474 HydrophobicContact CD2-CE 3.26Å; F471-M474 HydrophobicContact CE2-CE 3.63Å; F471-M474 HydrophobicContact CG-CE 4.1Å; F471-M474 WeakPolarHBondContact O-CB 3.48Å; F471-M474 PolarHBondContact O-N 2.88Å; F471-V475 HydrophobicContact CD1-CG2 4.45Å; F471-V475 HydrophobicContact CE1-CG2 3.98Å; F471-V475 HydrophobicContact CE2-CG2 4.22Å; F471-V475 HydrophobicContact CZ-CG2 3.82Å; F471-V475 WeakPolarHBondContact O-CG2 3.11Å; F471-V475 PolarHBondContact O-N 3.47Å; F471-V497 HydrophobicContact CE1-CG1 4.23Å; F471-V497 HydrophobicContact CE1-CG2 3.98Å; F471-V497 HydrophobicContact CZ-CG2 4.12Å; F471-M500 HydrophobicContact CE1-CE 4.2Å; F471-M500 HydrophobicContact CE1-SD 3.95Å; F471-M500 HydrophobicContact CZ-CE 4.41Å; F471-M500 HydrophobicContact CZ-SD 4.09Å
472	T	71.8	Confident	69.4	Low	3 Å²	3	39.1 Å²	39.1	2%	0.018	21%	0.208	C	C	.	.	H	α-helix	trans	-68	-44.5	-179.6	-53.4	0	0	0	0	112.1	F468 V469 G470 M474 V475 N476 V501 L597 Y600	F468-T472 PolarHBondContact O-N 3.43Å; F468-T472 PolarHBondContact O-OG1 2.84Å; V469-T472 PolarHBondContact O-N 2.86Å; G470-T472 PolarHBondContact O-N 3.32Å; T472-M474 PolarHBondContact O-N 3.43Å; T472-V475 PolarHBondContact O-N 3.35Å; T472-N476 PolarHBondContact O-N 3.41Å; T472-N476 VanDerWaalsContact O-N 3.12Å; T472-V501 HydrophobicContact CG2-CG2 4.47Å; T472-L597 HydrophobicContact CG2-CD2 3.84Å; T472-Y600 HydrophobicContact CG2-CE2 3.83Å
473	K	73.8	Confident	70	Confident	117 Å²	117	39.3 Å²	39.3	51%	0.509	21%	0.205	S	C	.	.	H	α-helix	trans	-59.4	-39.2	175.4	-72	-178.4	178.9	-177.4	0	111.7	V469 N476 Q477	V469-K473 HydrophobicContact CG1-CD 4.26Å; V469-K473 HydrophobicContact CG1-CG 4.44Å; V469-K473 WeakPolarHBondContact O-CG 3.16Å; V469-K473 PolarHBondContact O-N 3.28Å; K473-N476 PolarHBondContact O-N 2.88Å; K473-Q477 PolarHBondContact O-N 2.86Å
474	M	68.3	Low	70.2	Confident	18 Å²	18	42.5 Å²	42.5	9%	0.089	23%	0.229	C	C	.	.	H	α-helix	trans	-66.6	-41.3	178.1	175.4	-163.8	81.3	0	0	112.7	F358 C359 G470 F471 T472 N476 Q477 I478	F358-M474 HydrophobicContact CZ-CE 4.49Å; F358-M474 HydrophobicContact CZ-SD 4.05Å; C359-M474 HydrophobicContact CB-CG 3.65Å; C359-M474 HydrophobicContact CB-SD 3.94Å; C359-M474 VanDerWaalsContact SG-CE 3.59Å; C359-M474 VanDerWaalsContact SG-CG 3.52Å; C359-M474 PolarHBondContact SG-SD 3.36Å; G470-M474 WeakPolarHBondContact O-CB 3.31Å; G470-M474 PolarHBondContact O-N 3.34Å; F471-M474 HydrophobicContact CB-CE 4.45Å; F471-M474 HydrophobicContact CD2-CE 3.26Å; F471-M474 HydrophobicContact CE2-CE 3.63Å; F471-M474 HydrophobicContact CG-CE 4.1Å; F471-M474 WeakPolarHBondContact O-CB 3.48Å; F471-M474 PolarHBondContact O-N 2.88Å; T472-M474 PolarHBondContact O-N 3.43Å; M474-N476 VanDerWaalsContact C-N 3.34Å; M474-Q477 PolarHBondContact O-N 2.65Å; M474-I478 WeakPolarHBondContact O-CG1 3.29Å; M474-I478 PolarHBondContact O-N 3.48Å; M474-I478 VanDerWaalsContact O-N 3.08Å
475	V	70.4	Confident	70	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.018	21%	0.214	C	C	.	.	H	α-helix	trans	-61.5	-44.2	173.5	167.7	0	0	0	0	110.9	F471 T472 Q477 I478 D479 V493 V497	F471-V475 HydrophobicContact CD1-CG2 4.45Å; F471-V475 HydrophobicContact CE1-CG2 3.98Å; F471-V475 HydrophobicContact CE2-CG2 4.22Å; F471-V475 HydrophobicContact CZ-CG2 3.82Å; F471-V475 WeakPolarHBondContact O-CG2 3.11Å; F471-V475 PolarHBondContact O-N 3.47Å; T472-V475 PolarHBondContact O-N 3.35Å; V475-Q477 VanDerWaalsContact C-N 3.26Å; V475-Q477 PolarHBondContact O-N 2.85Å; V475-I478 PolarHBondContact O-N 3.44Å; V475-D479 WeakPolarHBondContact O-CB 3.02Å; V475-D479 PolarHBondContact O-N 2.86Å; V475-V493 HydrophobicContact CG1-CG1 3.99Å; V475-V497 HydrophobicContact CB-CG1 4.25Å; V475-V497 HydrophobicContact CB-CG2 4.15Å; V475-V497 HydrophobicContact CG1-CB 4.08Å; V475-V497 HydrophobicContact CG1-CG1 4.06Å; V475-V497 HydrophobicContact CG1-CG2 3.69Å; V475-V497 HydrophobicContact CG2-CB 4.45Å; V475-V497 HydrophobicContact CG2-CG1 4.18Å; V475-V497 HydrophobicContact CG2-CG2 3.56Å
476	N	74.1	Confident	69.7	Low	56 Å²	56	39.1 Å²	39.1	30%	0.299	20%	0.202	S	C	.	.	H	α-helix	trans	-61.4	-37.3	177.9	-65.7	-18.4	0	0	0	111.3	T472 K473 M474 D479 D480	T472-N476 PolarHBondContact O-N 3.41Å; T472-N476 VanDerWaalsContact O-N 3.12Å; K473-N476 PolarHBondContact O-N 2.88Å; M474-N476 VanDerWaalsContact C-N 3.34Å; N476-D479 WeakPolarHBondContact O-CB 3.32Å; N476-D479 PolarHBondContact O-N 3.43Å; N476-D480 PolarHBondContact O-N 3.48Å
477	Q	72.4	Confident	69.4	Low	98 Å²	98	39.1 Å²	39.1	46%	0.458	21%	0.21	S	C	.	.	H	α-helix	trans	-65.4	-42.6	175.3	-173.9	61.5	56.6	0	0	112.9	K473 M474 V475 D479 D480 D481	K473-Q477 PolarHBondContact O-N 2.86Å; M474-Q477 PolarHBondContact O-N 2.65Å; V475-Q477 VanDerWaalsContact C-N 3.26Å; V475-Q477 PolarHBondContact O-N 2.85Å; Q477-D479 PolarHBondContact O-N 3.32Å; Q477-D480 PolarHBondContact O-N 3.06Å; Q477-D481 PolarHBondContact O-N 2.66Å; Q477-D481 VanDerWaalsContact O-N 3.09Å
478	I	67.8	Low	69.3	Low	21 Å²	21	41.2 Å²	41.2	11%	0.108	22%	0.22	C	C	.	.	H	α-helix	trans	-60.1	-40.5	175.1	-68.8	170	0	0	0	109.9	C359 L447 M474 V475 D481 F482 I490	C359-I478 HydrophobicContact CB-CD1 4.07Å; L447-I478 HydrophobicContact CD1-CG2 4.39Å; M474-I478 WeakPolarHBondContact O-CG1 3.29Å; M474-I478 PolarHBondContact O-N 3.48Å; M474-I478 VanDerWaalsContact O-N 3.08Å; V475-I478 PolarHBondContact O-N 3.44Å; I478-D481 WeakPolarHBondContact O-CB 3.43Å; I478-D481 PolarHBondContact O-N 3.11Å; I478-F482 HydrophobicContact CG2-CD2 3.66Å; I478-F482 HydrophobicContact CG2-CE2 3.7Å; I478-F482 VanDerWaalsContact O-CD2 3.3Å; I478-F482 WeakPolarHBondContact O-CD2 3.43Å; I478-F482 PolarHBondContact O-N 3.45Å; I478-I490 HydrophobicContact CG2-CD1 3.93Å
479	D	71.1	Confident	69.2	Low	4 Å²	4	43.5 Å²	43.5	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-67.3	-42.6	-179.4	173.7	43.9	0	0	0	113.3	V475 N476 Q477 D481 F482 Q483 I490 R494	V475-D479 WeakPolarHBondContact O-CB 3.02Å; V475-D479 PolarHBondContact O-N 2.86Å; N476-D479 WeakPolarHBondContact O-CB 3.32Å; N476-D479 PolarHBondContact O-N 3.43Å; Q477-D479 PolarHBondContact O-N 3.32Å; D479-D481 PolarHBondContact O-N 3.19Å; D479-F482 PolarHBondContact O-N 3.09Å; D479-Q483 VanDerWaalsContact CG-NE2 3.3Å; D479-Q483 WeakPolarHBondContact O-CB 3.34Å; D479-Q483 WeakPolarHBondContact O-CG 3.2Å; D479-Q483 PolarHBondContact O-N 3.33Å; D479-Q483 PolarHBondContact OD1-NE2 2.95Å; D479-Q483 PolarHBondContact OD2-NE2 3.28Å; D479-I490 HydrophobicContact CB-CD1 3.66Å; D479-I490 HydrophobicContact CB-CG1 3.55Å; D479-I490 WeakPolarHBondContact OD1-CG1 3.48Å; D479-I490 PolarHBondContact OD1-N 3.17Å; D479-R494 VanDerWaalsContact CG-CZ 3.45Å; D479-R494 VanDerWaalsContact CG-NE 3.31Å; D479-R494 IonicContact OD1-CZ 2.75Å; D479-R494 IonicContact OD1-NE 3.39Å; D479-R494 PolarHBondContact OD1-NE 3.14Å; D479-R494 IonicContact OD1-NH1 3.4Å; D479-R494 IonicContact OD1-NH2 3.56Å; D479-R494 IonicContact OD2-CZ 3.97Å; D479-R494 IonicContact OD2-NE 3.74Å; D479-R494 PolarHBondContact OD2-NE 3.16Å; D479-R494 IonicContact OD2-NH1 3.3Å; D479-R494 IonicContact OD2-NH2 2.74Å; D479-R494 PolarHBondContact OD2-NH2 3.38Å
480	D	72.7	Confident	69.2	Low	86 Å²	86	43.4 Å²	43.4	46%	0.46	24%	0.235	S	C	.	.	H	α-helix	trans	-58.5	-39.9	171.6	-68.7	-24.1	0	0	0	111.1	N476 Q477 S484	N476-D480 PolarHBondContact O-N 3.48Å; Q477-D480 PolarHBondContact O-N 3.06Å; D480-S484 PolarHBondContact O-N 2.85Å
481	D	68.1	Low	69.5	Low	29 Å²	29	47.1 Å²	47.1	16%	0.155	26%	0.256	C	S	.	.	H	α-helix	trans	-66.5	-45.2	176.9	-72.8	-32.4	0	0	0	112.5	K363 Q477 I478 D479 Q483 S484 L485	K363-D481 VanDerWaalsContact CD-OD2 3.31Å; K363-D481 WeakPolarHBondContact CD-OD2 3.29Å; K363-D481 WeakPolarHBondContact CE-OD2 3.43Å; K363-D481 IonicContact NZ-OD1 2.82Å; K363-D481 PolarHBondContact NZ-OD1 3.07Å; K363-D481 IonicContact NZ-OD2 3.2Å; K363-D481 PolarHBondContact NZ-OD2 3.39Å; Q477-D481 PolarHBondContact O-N 2.66Å; Q477-D481 VanDerWaalsContact O-N 3.09Å; I478-D481 WeakPolarHBondContact O-CB 3.43Å; I478-D481 PolarHBondContact O-N 3.11Å; D479-D481 PolarHBondContact O-N 3.19Å; D481-Q483 VanDerWaalsContact C-N 3.35Å; D481-Q483 PolarHBondContact O-N 3.12Å; D481-S484 PolarHBondContact O-N 3.45Å; D481-S484 PolarHBondContact O-OG 2.97Å; D481-L485 PolarHBondContact O-N 2.78Å; D481-L485 VanDerWaalsContact O-N 3.1Å
482	F	67.2	Low	69.8	Low	17 Å²	17	51.4 Å²	51.4	8%	0.075	27%	0.274	C	S	.	.	H	α-helix	trans	-64.6	-38.2	176.9	-93.2	-103.4	0	0	0	112.3	V366 C440 A443 L447 I478 D479 S484 L485 C486 I490	V366-F482 HydrophobicContact CG1-CZ 4.17Å; C440-F482 HydrophobicContact CB-CD1 4.35Å; C440-F482 HydrophobicContact CB-CE1 4.4Å; A443-F482 HydrophobicContact CB-CE1 4.15Å; A443-F482 HydrophobicContact CB-CZ 4.07Å; L447-F482 HydrophobicContact CD1-CE2 3.89Å; L447-F482 HydrophobicContact CD1-CZ 3.79Å; I478-F482 HydrophobicContact CG2-CD2 3.66Å; I478-F482 HydrophobicContact CG2-CE2 3.7Å; I478-F482 VanDerWaalsContact O-CD2 3.3Å; I478-F482 WeakPolarHBondContact O-CD2 3.43Å; I478-F482 PolarHBondContact O-N 3.45Å; D479-F482 PolarHBondContact O-N 3.09Å; F482-S484 VanDerWaalsContact C-N 3.32Å; F482-S484 PolarHBondContact O-N 2.98Å; F482-L485 PolarHBondContact O-N 2.94Å; F482-C486 PolarHBondContact O-N 3.21Å; F482-I490 HydrophobicContact CB-CG2 3.73Å; F482-I490 HydrophobicContact CD1-CG2 3.51Å; F482-I490 HydrophobicContact CD2-CG2 4.17Å; F482-I490 HydrophobicContact CE1-CG2 4.09Å; F482-I490 HydrophobicContact CG-CG2 3.54Å
483	Q	70.3	Confident	69.8	Low	67 Å²	67	51.4 Å²	51.4	31%	0.313	27%	0.274	S	S	.	.	H	α-helix	trans	-64.8	-37.4	174.2	-74.2	174.9	41.9	0	0	111.8	D479 D481 L485 V487 P489	D479-Q483 VanDerWaalsContact CG-NE2 3.3Å; D479-Q483 WeakPolarHBondContact O-CB 3.34Å; D479-Q483 WeakPolarHBondContact O-CG 3.2Å; D479-Q483 PolarHBondContact O-N 3.33Å; D479-Q483 PolarHBondContact OD1-NE2 2.95Å; D479-Q483 PolarHBondContact OD2-NE2 3.28Å; D481-Q483 VanDerWaalsContact C-N 3.35Å; D481-Q483 PolarHBondContact O-N 3.12Å; Q483-L485 VanDerWaalsContact C-N 3.27Å; Q483-L485 PolarHBondContact O-N 3.44Å; Q483-V487 VanDerWaalsContact O-CA 3.26Å; Q483-V487 WeakPolarHBondContact O-CA 3.38Å; Q483-V487 PolarHBondContact O-N 3.01Å; Q483-P489 HydrophobicContact CG-CB 4.23Å
484	S	68.2	Low	69.9	Low	81 Å²	81	50.5 Å²	50.5	57%	0.566	27%	0.268	S	S	*	.	H	α-helix	trans	-66.2	-30.4	174.7	79.2	0	0	0	0	113	D480 D481 F482	D480-S484 PolarHBondContact O-N 2.85Å; D481-S484 PolarHBondContact O-N 3.45Å; D481-S484 PolarHBondContact O-OG 2.97Å; F482-S484 VanDerWaalsContact C-N 3.32Å; F482-S484 PolarHBondContact O-N 2.98Å
485	L	61.5	Low	70.3	Confident	26 Å²	26	56.9 Å²	56.9	14%	0.136	30%	0.295	C	S	.	.	H	α-helix	trans	-82.7	-53.7	-175.8	-165.7	75.8	0	0	0	112.3	L367 L370 M402 L436 D481 F482 Q483	L367-L485 HydrophobicContact CD2-CD1 4.15Å; L367-L485 HydrophobicContact CD2-CD2 4.06Å; L370-L485 HydrophobicContact CD1-CD2 4.18Å; M402-L485 HydrophobicContact CB-CD1 3.99Å; M402-L485 HydrophobicContact CG-CD1 4.4Å; M402-L485 WeakPolarHBondContact O-CD1 3.31Å; L436-L485 VanDerWaalsContact CD2-O 3.25Å; L436-L485 WeakPolarHBondContact CD2-O 3.23Å; D481-L485 PolarHBondContact O-N 2.78Å; D481-L485 VanDerWaalsContact O-N 3.1Å; F482-L485 PolarHBondContact O-N 2.94Å; Q483-L485 VanDerWaalsContact C-N 3.27Å; Q483-L485 PolarHBondContact O-N 3.44Å
486	C	63.7	Low	70.5	Confident	12 Å²	12	59.4 Å²	59.4	8%	0.081	31%	0.305	C	S	.	.	H	α-helix	trans	-113.1	-1.1	-166.6	-70.1	0	0	0	0	113.5	L436 C440 F482 Q488	L436-C486 HydrophobicContact CD2-CB 4.04Å; L436-C486 WeakPolarHBondContact CD2-SG 3.29Å; L436-C486 VanDerWaalsContact CG-SG 3.5Å; C440-C486 HydrophobicContact CB-CB 3.92Å; C440-C486 WeakPolarHBondContact CB-SG 3.31Å; C440-C486 WeakPolarHBondContact SG-CB 3.35Å; C440-C486 CovalentContact SG-SG 2.05Å; C440-C486 PolarHBondContact SG-SG 3.1Å; F482-C486 PolarHBondContact O-N 3.21Å; C486-Q488 HydrophobicContact CB-CB 4.32Å; C486-Q488 PolarHBondContact O-N 3.5Å
487	V	64.5	Low	70.6	Confident	131 Å²	131	56.8 Å²	56.8	79%	0.794	29%	0.291	S	S	*	.	S	Bend	trans	53.1	21.2	-170	-160.7	0	0	0	0	111.7	Q483	Q483-V487 VanDerWaalsContact O-CA 3.26Å; Q483-V487 WeakPolarHBondContact O-CA 3.38Å; Q483-V487 PolarHBondContact O-N 3.01Å
488	Q	67.6	Low	71	Confident	70 Å²	70	55.5 Å²	55.5	33%	0.327	28%	0.284	S	S	.	.			trans	-121.7	129.4	179.6	-73.5	-162.7	-7.8	0	0	110.3	C486	C486-Q488 HydrophobicContact CB-CB 4.32Å; C486-Q488 PolarHBondContact O-N 3.5Å
489	P	68.4	Low	71.6	Confident	57 Å²	57	57.2 Å²	57.2	37%	0.37	30%	0.298	S	S	.	.			trans	-75.9	144.5	174.9	29.3	-32.4	0	0	0	112.2	Q483 T491	Q483-P489 HydrophobicContact CG-CB 4.23Å; P489-T491 VanDerWaalsContact C-N 3.29Å; P489-T491 PolarHBondContact O-N 2.9Å; P489-T491 PolarHBondContact O-OG1 3.27Å
490	I	71	Confident	71.9	Confident	3 Å²	3	57.8 Å²	57.8	2%	0.015	30%	0.3	C	S	.	.			trans	-78.3	76.8	174.4	51.1	163.3	0	0	0	111.8	E444 I478 D479 F482 V493 R494	E444-I490 HydrophobicContact CB-CG2 4.28Å; E444-I490 HydrophobicContact CG-CB 3.99Å; E444-I490 HydrophobicContact CG-CG2 3.92Å; E444-I490 WeakPolarHBondContact OE1-CA 3.42Å; I478-I490 HydrophobicContact CG2-CD1 3.93Å; D479-I490 HydrophobicContact CB-CD1 3.66Å; D479-I490 HydrophobicContact CB-CG1 3.55Å; D479-I490 WeakPolarHBondContact OD1-CG1 3.48Å; D479-I490 PolarHBondContact OD1-N 3.17Å; F482-I490 HydrophobicContact CB-CG2 3.73Å; F482-I490 HydrophobicContact CD1-CG2 3.51Å; F482-I490 HydrophobicContact CD2-CG2 4.17Å; F482-I490 HydrophobicContact CE1-CG2 4.09Å; F482-I490 HydrophobicContact CG-CG2 3.54Å; I490-V493 HydrophobicContact CB-CB 4.19Å; I490-V493 HydrophobicContact CB-CG2 4.47Å; I490-V493 HydrophobicContact CD1-CB 3.83Å; I490-V493 HydrophobicContact CD1-CG1 3.82Å; I490-V493 HydrophobicContact CD1-CG2 4.31Å; I490-V493 HydrophobicContact CG1-CB 4.33Å; I490-R494 WeakPolarHBondContact O-CB 3.3Å; I490-R494 VanDerWaalsContact O-CG 3.29Å; I490-R494 WeakPolarHBondContact O-CG 3.47Å; I490-R494 PolarHBondContact O-N 3.23Å
491	T	77	Confident	72.2	Confident	90 Å²	90	53.7 Å²	53.7	55%	0.552	28%	0.278	S	S	*	.	H	α-helix	trans	-67.5	-41.6	-172.7	-51.4	0	0	0	0	113.8	E444 P489 R494 F495	E444-T491 PolarHBondContact OE1-N 3.5Å; P489-T491 VanDerWaalsContact C-N 3.29Å; P489-T491 PolarHBondContact O-N 2.9Å; P489-T491 PolarHBondContact O-OG1 3.27Å; T491-R494 PolarHBondContact O-N 2.67Å; T491-F495 WeakPolarHBondContact O-CB 3.3Å; T491-F495 PolarHBondContact O-N 3.4Å
492	K	75.3	Confident	73	Confident	90 Å²	90	55.8 Å²	55.8	39%	0.391	29%	0.287	S	S	.	.	H	α-helix	trans	-65.2	-43.8	177.1	-61.5	176.7	178.6	164.8	0	110.8	E444 E445 C448 F495 Y496	E444-K492 HydrophobicContact CG-CB 4.33Å; E444-K492 WeakPolarHBondContact OE1-CA 3.31Å; E444-K492 VanDerWaalsContact OE1-CB 3.31Å; E444-K492 WeakPolarHBondContact OE1-CB 3.35Å; E444-K492 PolarHBondContact OE1-N 2.97Å; E445-K492 HydrophobicContact CG-CD 4.07Å; E445-K492 IonicContact OE1-NZ 2.8Å; E445-K492 PolarHBondContact OE1-NZ 3.34Å; C448-K492 WeakPolarHBondContact SG-CB 3.39Å; K492-F495 PolarHBondContact O-N 3.41Å; K492-Y496 PolarHBondContact O-N 2.94Å
493	V	72.1	Confident	73.8	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.024	30%	0.304	C	S	.	.	H	α-helix	trans	-65	-45.1	177.4	171.1	0	0	0	0	110.3	E444 L447 C448 I451 V475 I490 F495 Y496 V497	E444-V493 HydrophobicContact CG-CG2 3.68Å; E444-V493 PolarHBondContact OE1-N 3.29Å; E444-V493 VanDerWaalsContact OE1-N 3.11Å; L447-V493 HydrophobicContact CB-CG2 3.97Å; C448-V493 WeakPolarHBondContact SG-CG2 3.5Å; C448-V493 PolarHBondContact SG-N 2.86Å; I451-V493 HydrophobicContact CD1-CG1 3.64Å; I451-V493 HydrophobicContact CD1-CG2 4.43Å; V475-V493 HydrophobicContact CG1-CG1 3.99Å; I490-V493 HydrophobicContact CB-CB 4.19Å; I490-V493 HydrophobicContact CB-CG2 4.47Å; I490-V493 HydrophobicContact CD1-CB 3.83Å; I490-V493 HydrophobicContact CD1-CG1 3.82Å; I490-V493 HydrophobicContact CD1-CG2 4.31Å; I490-V493 HydrophobicContact CG1-CB 4.33Å; V493-F495 VanDerWaalsContact C-N 3.35Å; V493-F495 PolarHBondContact O-N 3.42Å; V493-Y496 PolarHBondContact O-N 3.02Å; V493-Y496 VanDerWaalsContact O-N 3.16Å; V493-V497 HydrophobicContact CG1-CG2 4.16Å; V493-V497 WeakPolarHBondContact O-CB 3.15Å; V493-V497 VanDerWaalsContact O-CG2 3.31Å; V493-V497 WeakPolarHBondContact O-CG2 3.18Å; V493-V497 PolarHBondContact O-N 3.09Å
494	R	76.5	Confident	74.4	Confident	98 Å²	98	55 Å²	55	37%	0.37	29%	0.293	S	S	.	.	H	α-helix	trans	-56.9	-46.3	175.6	-81.9	173.6	162.1	169.1	-5.9	112.2	D479 I490 T491 Y496 V497 F498	D479-R494 VanDerWaalsContact CG-CZ 3.45Å; D479-R494 VanDerWaalsContact CG-NE 3.31Å; D479-R494 IonicContact OD1-CZ 2.75Å; D479-R494 IonicContact OD1-NE 3.39Å; D479-R494 PolarHBondContact OD1-NE 3.14Å; D479-R494 IonicContact OD1-NH1 3.4Å; D479-R494 IonicContact OD1-NH2 3.56Å; D479-R494 IonicContact OD2-CZ 3.97Å; D479-R494 IonicContact OD2-NE 3.74Å; D479-R494 PolarHBondContact OD2-NE 3.16Å; D479-R494 IonicContact OD2-NH1 3.3Å; D479-R494 IonicContact OD2-NH2 2.74Å; D479-R494 PolarHBondContact OD2-NH2 3.38Å; I490-R494 WeakPolarHBondContact O-CB 3.3Å; I490-R494 VanDerWaalsContact O-CG 3.29Å; I490-R494 WeakPolarHBondContact O-CG 3.47Å; I490-R494 PolarHBondContact O-N 3.23Å; T491-R494 PolarHBondContact O-N 2.67Å; R494-Y496 VanDerWaalsContact C-N 3.3Å; R494-Y496 PolarHBondContact O-N 2.98Å; R494-V497 PolarHBondContact O-N 2.83Å; R494-F498 VanDerWaalsContact O-CB 3.25Å; R494-F498 WeakPolarHBondContact O-CB 3.4Å; R494-F498 PolarHBondContact O-N 3.07Å
495	F	77.3	Confident	75.4	Confident	152 Å²	152	51.2 Å²	51.2	67%	0.667	27%	0.266	S	S	*	.	H	α-helix	trans	-59.7	-42.8	176.6	179.2	-96.9	0	0	0	111.6	T491 K492 V493 F498 S499	T491-F495 WeakPolarHBondContact O-CB 3.3Å; T491-F495 PolarHBondContact O-N 3.4Å; K492-F495 PolarHBondContact O-N 3.41Å; V493-F495 VanDerWaalsContact C-N 3.35Å; V493-F495 PolarHBondContact O-N 3.42Å; F495-F498 WeakPolarHBondContact O-CB 3.1Å; F495-F498 PolarHBondContact O-N 3.47Å; F495-S499 PolarHBondContact O-N 3.2Å
496	Y	73.6	Confident	76.8	Confident	56 Å²	56	54.6 Å²	54.6	22%	0.22	28%	0.281	C	S	.	.	H	α-helix	trans	-66.1	-44.7	179.3	-162	-86.5	0	0	0	112.4	I451 A452 G455 K492 V493 R494 F498 S499 M500	I451-Y496 HydrophobicContact CB-CD1 4.05Å; I451-Y496 HydrophobicContact CB-CE1 4.38Å; I451-Y496 HydrophobicContact CG2-CD1 3.37Å; I451-Y496 HydrophobicContact CG2-CE1 3.68Å; I451-Y496 HydrophobicContact CG2-CG 4.47Å; I451-Y496 VanDerWaalsContact O-CE1 3.23Å; I451-Y496 WeakPolarHBondContact O-CE1 3.25Å; A452-Y496 VanDerWaalsContact CA-OH 3.24Å; A452-Y496 WeakPolarHBondContact CA-OH 3.49Å; A452-Y496 HydrophobicContact CB-CD2 4.42Å; A452-Y496 HydrophobicContact CB-CE2 3.79Å; A452-Y496 PolarHBondContact O-OH 3.28Å; A452-Y496 VanDerWaalsContact O-OH 3.09Å; G455-Y496 WeakPolarHBondContact CA-OH 3.41Å; G455-Y496 PolarHBondContact N-OH 2.99Å; K492-Y496 PolarHBondContact O-N 2.94Å; V493-Y496 PolarHBondContact O-N 3.02Å; V493-Y496 VanDerWaalsContact O-N 3.16Å; R494-Y496 VanDerWaalsContact C-N 3.3Å; R494-Y496 PolarHBondContact O-N 2.98Å; Y496-F498 VanDerWaalsContact C-N 3.32Å; Y496-F498 PolarHBondContact O-N 3.03Å; Y496-S499 WeakPolarHBondContact O-CB 3.48Å; Y496-S499 PolarHBondContact O-N 3.35Å; Y496-S499 VanDerWaalsContact O-N 3.15Å; Y496-M500 HydrophobicContact CD1-CG 3.93Å; Y496-M500 HydrophobicContact CD1-SD 3.77Å; Y496-M500 HydrophobicContact CE1-CG 3.63Å; Y496-M500 HydrophobicContact CE1-SD 3.53Å; Y496-M500 VanDerWaalsContact CE1-SD 3.53Å; Y496-M500 WeakPolarHBondContact O-CG 3.14Å; Y496-M500 PolarHBondContact O-N 2.96Å
497	V	75.3	Confident	77.8	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-66.1	-39.3	178.5	171	0	0	0	0	110.4	I451 F471 V475 V493 R494 S499 M500 V501	I451-V497 HydrophobicContact CD1-CG2 4.44Å; I451-V497 HydrophobicContact CG2-CG2 4.47Å; F471-V497 HydrophobicContact CE1-CG1 4.23Å; F471-V497 HydrophobicContact CE1-CG2 3.98Å; F471-V497 HydrophobicContact CZ-CG2 4.12Å; V475-V497 HydrophobicContact CB-CG1 4.25Å; V475-V497 HydrophobicContact CB-CG2 4.15Å; V475-V497 HydrophobicContact CG1-CB 4.08Å; V475-V497 HydrophobicContact CG1-CG1 4.06Å; V475-V497 HydrophobicContact CG1-CG2 3.69Å; V475-V497 HydrophobicContact CG2-CB 4.45Å; V475-V497 HydrophobicContact CG2-CG1 4.18Å; V475-V497 HydrophobicContact CG2-CG2 3.56Å; V493-V497 HydrophobicContact CG1-CG2 4.16Å; V493-V497 WeakPolarHBondContact O-CB 3.15Å; V493-V497 VanDerWaalsContact O-CG2 3.31Å; V493-V497 WeakPolarHBondContact O-CG2 3.18Å; V493-V497 PolarHBondContact O-N 3.09Å; R494-V497 PolarHBondContact O-N 2.83Å; V497-S499 VanDerWaalsContact C-N 3.34Å; V497-S499 PolarHBondContact O-N 3.02Å; V497-M500 PolarHBondContact O-N 3.2Å; V497-V501 HydrophobicContact CG1-CG2 4.2Å; V497-V501 WeakPolarHBondContact O-CB 3.42Å; V497-V501 WeakPolarHBondContact O-CG2 3.12Å; V497-V501 PolarHBondContact O-N 3.44Å
498	F	80.8	Confident	79.1	Confident	71 Å²	71	53 Å²	53	31%	0.311	26%	0.259	S	S	.	.	H	α-helix	trans	-55.9	-47.9	170.1	175.9	-86.5	0	0	0	111.5	R494 F495 Y496 M500 V501 E502 Y600	R494-F498 VanDerWaalsContact O-CB 3.25Å; R494-F498 WeakPolarHBondContact O-CB 3.4Å; R494-F498 PolarHBondContact O-N 3.07Å; F495-F498 WeakPolarHBondContact O-CB 3.1Å; F495-F498 PolarHBondContact O-N 3.47Å; Y496-F498 VanDerWaalsContact C-N 3.32Å; Y496-F498 PolarHBondContact O-N 3.03Å; F498-M500 VanDerWaalsContact C-N 3.33Å; F498-M500 PolarHBondContact O-N 2.84Å; F498-V501 PolarHBondContact O-N 3.24Å; F498-V501 VanDerWaalsContact O-N 3.17Å; F498-E502 HydrophobicContact CD1-CG 4.4Å; F498-E502 HydrophobicContact CE1-CG 3.83Å; F498-E502 WeakPolarHBondContact CE1-OE2 3.3Å; F498-E502 HydrophobicContact CZ-CG 3.87Å; F498-E502 WeakPolarHBondContact CZ-OE1 3.36Å; F498-E502 PolarHBondContact O-N 3.45Å; F498-Y600 HydrophobicContact CB-CE1 4.31Å; F498-Y600 HydrophobicContact CD2-CD1 4.03Å; F498-Y600 AromaticContact CD2-CE1 3.58Å; F498-Y600 HydrophobicContact CD2-CE1 3.58Å; F498-Y600 HydrophobicContact CE2-CD1 4.28Å; F498-Y600 HydrophobicContact CE2-CE1 4.28Å; F498-Y600 HydrophobicContact CG-CE1 4.3Å
499	S	81.2	Confident	80.4	Confident	57 Å²	57	50.1 Å²	50.1	40%	0.399	25%	0.246	S	C	.	.	H	α-helix	trans	-61.2	-39.3	176.8	179	0	0	0	0	112.7	F495 Y496 V497 A503	F495-S499 PolarHBondContact O-N 3.2Å; Y496-S499 WeakPolarHBondContact O-CB 3.48Å; Y496-S499 PolarHBondContact O-N 3.35Å; Y496-S499 VanDerWaalsContact O-N 3.15Å; V497-S499 VanDerWaalsContact C-N 3.34Å; V497-S499 PolarHBondContact O-N 3.02Å; S499-A503 WeakPolarHBondContact O-CB 3.49Å; S499-A503 PolarHBondContact O-N 3.32Å
500	M	76.9	Confident	81.7	Confident	15 Å²	15	51.8 Å²	51.8	7%	0.074	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-41.3	174.2	-68	-178.2	73	0	0	112.3	I451 R454 F459 F468 F471 Y496 V497 F498 A503 F504	I451-M500 HydrophobicContact CG2-SD 3.48Å; I451-M500 WeakPolarHBondContact CG2-SD 3.17Å; R454-M500 HydrophobicContact CB-CE 4.04Å; F459-M500 HydrophobicContact CD1-CE 3.56Å; F459-M500 HydrophobicContact CE1-CE 3.34Å; F459-M500 HydrophobicContact CZ-CE 4.43Å; F468-M500 HydrophobicContact CE2-CB 4.3Å; F468-M500 HydrophobicContact CZ-CB 4.24Å; F471-M500 HydrophobicContact CE1-CE 4.2Å; F471-M500 HydrophobicContact CE1-SD 3.95Å; F471-M500 HydrophobicContact CZ-CE 4.41Å; F471-M500 HydrophobicContact CZ-SD 4.09Å; Y496-M500 HydrophobicContact CD1-CG 3.93Å; Y496-M500 HydrophobicContact CD1-SD 3.77Å; Y496-M500 HydrophobicContact CE1-CG 3.63Å; Y496-M500 HydrophobicContact CE1-SD 3.53Å; Y496-M500 VanDerWaalsContact CE1-SD 3.53Å; Y496-M500 WeakPolarHBondContact O-CG 3.14Å; Y496-M500 PolarHBondContact O-N 2.96Å; V497-M500 PolarHBondContact O-N 3.2Å; F498-M500 VanDerWaalsContact C-N 3.33Å; F498-M500 PolarHBondContact O-N 2.84Å; M500-A503 PolarHBondContact O-N 3.09Å; M500-F504 WeakPolarHBondContact O-CB 3.42Å; M500-F504 PolarHBondContact O-N 2.74Å
501	V	80.4	Confident	82.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.8	-42.7	179.6	175.9	0	0	0	0	110.3	F468 T472 V497 F498 A503 F504 I505 L597 Y600	F468-V501 HydrophobicContact CE1-CB 3.9Å; F468-V501 HydrophobicContact CE1-CG1 4.1Å; F468-V501 HydrophobicContact CE1-CG2 3.47Å; F468-V501 VanDerWaalsContact CE1-CG2 3.47Å; F468-V501 VanDerWaalsContact CZ-CA 3.41Å; F468-V501 HydrophobicContact CZ-CB 3.99Å; F468-V501 HydrophobicContact CZ-CG2 3.52Å; T472-V501 HydrophobicContact CG2-CG2 4.47Å; V497-V501 HydrophobicContact CG1-CG2 4.2Å; V497-V501 WeakPolarHBondContact O-CB 3.42Å; V497-V501 WeakPolarHBondContact O-CG2 3.12Å; V497-V501 PolarHBondContact O-N 3.44Å; F498-V501 PolarHBondContact O-N 3.24Å; F498-V501 VanDerWaalsContact O-N 3.17Å; V501-A503 PolarHBondContact O-N 2.81Å; V501-F504 PolarHBondContact O-N 3.1Å; V501-I505 HydrophobicContact CG1-CD1 3.76Å; V501-I505 HydrophobicContact CG1-CG1 4.3Å; V501-I505 WeakPolarHBondContact O-CB 3.34Å; V501-I505 VanDerWaalsContact O-CG1 3.25Å; V501-I505 WeakPolarHBondContact O-CG1 3.46Å; V501-I505 PolarHBondContact O-N 3.39Å; V501-L597 HydrophobicContact CG1-CD1 4.27Å; V501-Y600 HydrophobicContact CB-CD1 4.05Å; V501-Y600 HydrophobicContact CB-CE1 3.73Å; V501-Y600 HydrophobicContact CB-CE2 4.44Å; V501-Y600 HydrophobicContact CG1-CD1 3.49Å; V501-Y600 VanDerWaalsContact CG1-CD1 3.49Å; V501-Y600 HydrophobicContact CG1-CD2 3.83Å; V501-Y600 HydrophobicContact CG1-CE1 3.68Å; V501-Y600 HydrophobicContact CG1-CE2 4.03Å; V501-Y600 HydrophobicContact CG1-CG 3.56Å; V501-Y600 HydrophobicContact CG2-CE1 4Å; V501-Y600 HydrophobicContact CG2-CE2 4.05Å
502	E	84.5	Confident	83.6	Confident	73 Å²	73	52.9 Å²	52.9	34%	0.341	25%	0.248	S	C	.	.	H	α-helix	trans	-59.3	-46.5	172	-82	-161.3	141.3	0	0	111.8	F498 F504 I505 Q506 N603	F498-E502 HydrophobicContact CD1-CG 4.4Å; F498-E502 HydrophobicContact CE1-CG 3.83Å; F498-E502 WeakPolarHBondContact CE1-OE2 3.3Å; F498-E502 HydrophobicContact CZ-CG 3.87Å; F498-E502 WeakPolarHBondContact CZ-OE1 3.36Å; F498-E502 PolarHBondContact O-N 3.45Å; E502-F504 VanDerWaalsContact C-N 3.31Å; E502-F504 PolarHBondContact O-N 2.9Å; E502-I505 PolarHBondContact O-N 2.88Å; E502-Q506 VanDerWaalsContact O-CG 3.31Å; E502-Q506 WeakPolarHBondContact O-CG 3.36Å; E502-Q506 PolarHBondContact O-N 3.37Å; E502-N603 PolarHBondContact OE1-ND2 3.37Å
503	A	82.9	Confident	84.7	Confident	52 Å²	52	51.4 Å²	51.4	43%	0.43	24%	0.241	S	C	.	.	H	α-helix	trans	-60.2	-41	177.7	0	0	0	0	0	112.2	S499 M500 V501 R507	S499-A503 WeakPolarHBondContact O-CB 3.49Å; S499-A503 PolarHBondContact O-N 3.32Å; M500-A503 PolarHBondContact O-N 3.09Å; V501-A503 PolarHBondContact O-N 2.81Å; A503-R507 PolarHBondContact O-N 3.39Å
504	F	84.1	Confident	85.9	Confident	16 Å²	16	54.8 Å²	54.8	7%	0.07	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-48.6	173.7	170.8	-93.9	0	0	0	111.8	T465 F468 M500 V501 E502 Q506 R507 F508 L593	T465-F504 HydrophobicContact CG2-CZ 4Å; F468-F504 HydrophobicContact CB-CD2 4.29Å; F468-F504 HydrophobicContact CB-CE2 4.28Å; F468-F504 HydrophobicContact CD1-CB 4.07Å; F468-F504 AromaticContact CD1-CD1 3.71Å; F468-F504 HydrophobicContact CD1-CD1 3.71Å; F468-F504 HydrophobicContact CD1-CD2 4.12Å; F468-F504 HydrophobicContact CD1-CE1 4.23Å; F468-F504 AromaticContact CD1-CG 3.67Å; F468-F504 HydrophobicContact CD1-CG 3.67Å; F468-F504 HydrophobicContact CD2-CB 4.35Å; F468-F504 HydrophobicContact CD2-CD2 4.32Å; F468-F504 HydrophobicContact CD2-CG 4.35Å; F468-F504 HydrophobicContact CE1-CB 3.75Å; F468-F504 AromaticContact CE1-CD1 3.95Å; F468-F504 HydrophobicContact CE1-CD1 3.95Å; F468-F504 AromaticContact CE1-CG 3.86Å; F468-F504 HydrophobicContact CE1-CG 3.86Å; F468-F504 HydrophobicContact CE2-CB 4.08Å; F468-F504 HydrophobicContact CG-CB 4.37Å; F468-F504 HydrophobicContact CG-CD1 4.37Å; F468-F504 AromaticContact CG-CD2 3.95Å; F468-F504 HydrophobicContact CG-CD2 3.95Å; F468-F504 HydrophobicContact CG-CE2 4.39Å; F468-F504 AromaticContact CG-CG 3.95Å; F468-F504 HydrophobicContact CG-CG 3.95Å; F468-F504 HydrophobicContact CZ-CB 3.79Å; F468-F504 HydrophobicContact CZ-CG 4.32Å; M500-F504 WeakPolarHBondContact O-CB 3.42Å; M500-F504 PolarHBondContact O-N 2.74Å; V501-F504 PolarHBondContact O-N 3.1Å; E502-F504 VanDerWaalsContact C-N 3.31Å; E502-F504 PolarHBondContact O-N 2.9Å; F504-Q506 VanDerWaalsContact C-N 3.33Å; F504-Q506 PolarHBondContact O-N 3.28Å; F504-R507 PolarHBondContact O-N 2.76Å; F504-F508 HydrophobicContact CE1-CB 4.46Å; F504-F508 WeakPolarHBondContact O-CB 3.43Å; F504-F508 PolarHBondContact O-N 2.94Å; F504-L593 HydrophobicContact CE1-CD1 3.97Å; F504-L593 HydrophobicContact CE1-CD2 4.09Å
505	I	89.3	Confident	86.8	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-59.8	-44.2	179.5	-70.8	169.5	0	0	0	110.6	V501 E502 F508 H509 N603 L604 P607	V501-I505 HydrophobicContact CG1-CD1 3.76Å; V501-I505 HydrophobicContact CG1-CG1 4.3Å; V501-I505 WeakPolarHBondContact O-CB 3.34Å; V501-I505 VanDerWaalsContact O-CG1 3.25Å; V501-I505 WeakPolarHBondContact O-CG1 3.46Å; V501-I505 PolarHBondContact O-N 3.39Å; E502-I505 PolarHBondContact O-N 2.88Å; I505-F508 PolarHBondContact O-N 3.27Å; I505-H509 VanDerWaalsContact O-CB 3.32Å; I505-H509 WeakPolarHBondContact O-CB 3.31Å; I505-H509 PolarHBondContact O-N 2.94Å; I505-N603 HydrophobicContact CD1-CB 4Å; I505-L604 HydrophobicContact CB-CD2 4.45Å; I505-L604 HydrophobicContact CD1-CD2 3.88Å; I505-L604 HydrophobicContact CD1-CG 3.96Å; I505-L604 HydrophobicContact CG1-CD2 3.78Å; I505-L604 HydrophobicContact CG1-CG 4.42Å; I505-L604 HydrophobicContact CG2-CD2 3.88Å; I505-P607 HydrophobicContact CG2-CG 4.27Å
506	Q	89.7	Confident	87.8	Confident	97 Å²	97	46.6 Å²	46.6	45%	0.453	23%	0.229	S	C	.	.	H	α-helix	trans	-62.7	-44.9	178	-68.5	-57.8	-24.9	0	0	111.5	E502 F504 H509 E510	E502-Q506 VanDerWaalsContact O-CG 3.31Å; E502-Q506 WeakPolarHBondContact O-CG 3.36Å; E502-Q506 PolarHBondContact O-N 3.37Å; F504-Q506 VanDerWaalsContact C-N 3.33Å; F504-Q506 PolarHBondContact O-N 3.28Å; Q506-H509 PolarHBondContact O-N 2.97Å; Q506-E510 WeakPolarHBondContact O-CB 3.41Å; Q506-E510 WeakPolarHBondContact O-CG 3.16Å; Q506-E510 PolarHBondContact O-N 3.31Å
507	R	86.4	Confident	88.9	Confident	95 Å²	95	46 Å²	46	36%	0.358	23%	0.23	S	C	.	.	H	α-helix	trans	-62.2	-47.8	175.7	-178.8	-172.8	174.9	-149.7	0.9	111.8	S460 K461 A503 F504 H509 E510 E511	S460-R507 PolarHBondContact O-NH1 3.41Å; K461-R507 PolarHBondContact O-NH1 3.27Å; K461-R507 PolarHBondContact O-NH2 2.97Å; A503-R507 PolarHBondContact O-N 3.39Å; F504-R507 PolarHBondContact O-N 2.76Å; R507-H509 VanDerWaalsContact C-N 3.25Å; R507-H509 PolarHBondContact O-N 3.35Å; R507-E510 PolarHBondContact O-N 3.42Å; R507-E511 WeakPolarHBondContact O-CB 3.41Å; R507-E511 PolarHBondContact O-N 2.77Å
508	F	90.8	Very high	89.9	Confident	14 Å²	14	50.6 Å²	50.6	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-55.5	-46.6	177.2	175.7	-95.9	0	0	0	109.9	F504 I505 E511 K512 Q589 Y590 L593	F504-F508 HydrophobicContact CE1-CB 4.46Å; F504-F508 WeakPolarHBondContact O-CB 3.43Å; F504-F508 PolarHBondContact O-N 2.94Å; I505-F508 PolarHBondContact O-N 3.27Å; F508-E511 PolarHBondContact O-N 2.55Å; F508-K512 HydrophobicContact CD1-CG 4.5Å; F508-K512 HydrophobicContact CE1-CG 4.19Å; F508-K512 HydrophobicContact CE2-CG 4.43Å; F508-K512 HydrophobicContact CZ-CG 4.15Å; F508-K512 WeakPolarHBondContact O-CG 3.23Å; F508-K512 PolarHBondContact O-N 3.08Å; F508-K512 VanDerWaalsContact O-N 3.09Å; F508-Q589 HydrophobicContact CZ-CB 4.01Å; F508-Y590 HydrophobicContact CD1-CE1 4.26Å; F508-Y590 HydrophobicContact CD1-CE2 4.17Å; F508-Y590 AromaticContact CD1-CZ 3.91Å; F508-Y590 HydrophobicContact CE1-CD1 4.19Å; F508-Y590 AromaticContact CE1-CD2 3.73Å; F508-Y590 HydrophobicContact CE1-CD2 3.73Å; F508-Y590 AromaticContact CE1-CE1 3.98Å; F508-Y590 HydrophobicContact CE1-CE1 3.98Å; F508-Y590 AromaticContact CE1-CE2 3.47Å; F508-Y590 HydrophobicContact CE1-CE2 3.47Å; F508-Y590 VanDerWaalsContact CE1-CE2 3.47Å; F508-Y590 HydrophobicContact CE1-CG 4.08Å; F508-Y590 AromaticContact CE1-CZ 3.63Å; F508-Y590 HydrophobicContact CZ-CD2 4.36Å; F508-Y590 HydrophobicContact CZ-CE2 4.36Å; F508-L593 HydrophobicContact CD1-CD2 3.92Å; F508-L593 HydrophobicContact CE1-CD2 3.96Å; F508-L593 HydrophobicContact CG-CD2 4.28Å; F508-L593 HydrophobicContact CZ-CD2 4.38Å
509	H	95.1	Very high	90.6	Very high	10 Å²	10	49.7 Å²	49.7	5%	0.046	25%	0.253	C	S	.	.	H	α-helix	trans	-60.5	-51.1	176.2	176.9	70.4	0	0	0	112.8	I505 Q506 R507 E511 K512 K513 Y590 P607 D610	I505-H509 VanDerWaalsContact O-CB 3.32Å; I505-H509 WeakPolarHBondContact O-CB 3.31Å; I505-H509 PolarHBondContact O-N 2.94Å; Q506-H509 PolarHBondContact O-N 2.97Å; R507-H509 VanDerWaalsContact C-N 3.25Å; R507-H509 PolarHBondContact O-N 3.35Å; H509-E511 VanDerWaalsContact C-N 3.3Å; H509-E511 PolarHBondContact O-N 3.26Å; H509-K512 PolarHBondContact O-N 2.88Å; H509-K512 VanDerWaalsContact O-N 3.15Å; H509-K513 VanDerWaalsContact O-CB 3.26Å; H509-K513 WeakPolarHBondContact O-CB 3.25Å; H509-K513 PolarHBondContact O-N 2.84Å; H509-Y590 WeakPolarHBondContact CA-OH 3.44Å; H509-Y590 WeakPolarHBondContact CB-OH 3.5Å; H509-Y590 PolarHBondContact ND1-OH 3.32Å; H509-P607 HydrophobicContact CB-CB 4.01Å; H509-P607 PolarHBondContact CE1-O 2.8Å; H509-P607 WeakPolarHBondContact ND1-CB 3.5Å; H509-P607 PolarHBondContact ND1-O 3.42Å; H509-D610 IonicContact CE1-OD2 2.55Å; H509-D610 PolarHBondContact CE1-OD2 2.83Å; H509-D610 IonicContact NE2-OD2 3.02Å; H509-D610 PolarHBondContact NE2-OD2 2.86Å
510	E	94.7	Very high	91.3	Very high	93 Å²	93	47 Å²	47	44%	0.435	23%	0.234	S	C	.	.	H	α-helix	trans	-60.6	-37.9	-179.6	-74.5	-57.2	145.5	0	0	112.6	Q506 R507 T514	Q506-E510 WeakPolarHBondContact O-CB 3.41Å; Q506-E510 WeakPolarHBondContact O-CG 3.16Å; Q506-E510 PolarHBondContact O-N 3.31Å; R507-E510 PolarHBondContact O-N 3.42Å; E510-T514 VanDerWaalsContact O-CB 3.26Å; E510-T514 WeakPolarHBondContact O-CB 3.41Å; E510-T514 PolarHBondContact O-N 2.69Å; E510-T514 PolarHBondContact O-OG1 3.47Å
511	E	93.2	Very high	92.2	Very high	97 Å²	97	48 Å²	48	45%	0.453	24%	0.24	S	C	.	.	H	α-helix	trans	-62.6	-49.5	173.8	-172.2	-161.7	119.7	0	0	111.2	R507 F508 H509 T514 K515	R507-E511 WeakPolarHBondContact O-CB 3.41Å; R507-E511 PolarHBondContact O-N 2.77Å; F508-E511 PolarHBondContact O-N 2.55Å; H509-E511 VanDerWaalsContact C-N 3.3Å; H509-E511 PolarHBondContact O-N 3.26Å; E511-T514 PolarHBondContact O-N 3.36Å; E511-K515 WeakPolarHBondContact O-CB 3.17Å; E511-K515 PolarHBondContact O-N 3.47Å
512	K	95.2	Very high	92.8	Very high	19 Å²	19	51.7 Å²	51.7	8%	0.083	27%	0.265	C	S	.	.	H	α-helix	trans	-67.1	-37.3	179.3	-59.1	-42.2	167.7	-165.1	0	112	F508 H509 K515 L516 I586 Q589 Y590 L611	F508-K512 HydrophobicContact CD1-CG 4.5Å; F508-K512 HydrophobicContact CE1-CG 4.19Å; F508-K512 HydrophobicContact CE2-CG 4.43Å; F508-K512 HydrophobicContact CZ-CG 4.15Å; F508-K512 WeakPolarHBondContact O-CG 3.23Å; F508-K512 PolarHBondContact O-N 3.08Å; F508-K512 VanDerWaalsContact O-N 3.09Å; H509-K512 PolarHBondContact O-N 2.88Å; H509-K512 VanDerWaalsContact O-N 3.15Å; K512-K515 PolarHBondContact O-N 2.85Å; K512-L516 WeakPolarHBondContact O-CB 3.38Å; K512-L516 PolarHBondContact O-N 3.12Å; K512-I586 HydrophobicContact CB-CD1 4.41Å; K512-I586 HydrophobicContact CB-CG2 3.83Å; K512-I586 HydrophobicContact CD-CG1 4.38Å; K512-I586 HydrophobicContact CD-CG2 4.5Å; K512-I586 HydrophobicContact CG-CG2 3.95Å; K512-Q589 VanDerWaalsContact NZ-OE1 3.14Å; K512-Y590 HydrophobicContact CG-CE2 4.37Å; K512-L611 HydrophobicContact CB-CD1 4Å
513	K	97.8	Very high	93.3	Very high	59 Å²	59	49 Å²	49	26%	0.257	25%	0.253	S	S	.	.	H	α-helix	trans	-64.1	-48.2	176.5	-172.8	170.6	-174.5	155.8	0	111.5	H509 L516 T517 D610 L611	H509-K513 VanDerWaalsContact O-CB 3.26Å; H509-K513 WeakPolarHBondContact O-CB 3.25Å; H509-K513 PolarHBondContact O-N 2.84Å; K513-L516 PolarHBondContact O-N 3.29Å; K513-T517 VanDerWaalsContact O-CB 3.28Å; K513-T517 WeakPolarHBondContact O-CB 3.37Å; K513-T517 PolarHBondContact O-N 3.31Å; K513-T517 PolarHBondContact O-OG1 3.44Å; K513-D610 IonicContact NZ-OD1 3.74Å; K513-D610 IonicContact NZ-OD2 2.6Å; K513-D610 PolarHBondContact NZ-OD2 3.36Å; K513-L611 HydrophobicContact CB-CD2 3.69Å; K513-L611 HydrophobicContact CG-CD2 4.06Å
514	T	97.6	Very high	93.8	Very high	74 Å²	74	50.3 Å²	50.3	45%	0.454	25%	0.253	S	S	.	.	H	α-helix	trans	-61.2	-47.9	176.5	-59.4	0	0	0	0	110.6	E510 E511 L516 T517 N518	E510-T514 VanDerWaalsContact O-CB 3.26Å; E510-T514 WeakPolarHBondContact O-CB 3.41Å; E510-T514 PolarHBondContact O-N 2.69Å; E510-T514 PolarHBondContact O-OG1 3.47Å; E511-T514 PolarHBondContact O-N 3.36Å; T514-L516 PolarHBondContact O-N 3.03Å; T514-T517 PolarHBondContact O-N 3.47Å; T514-N518 WeakPolarHBondContact O-CB 3.33Å; T514-N518 PolarHBondContact O-N 3.08Å; T514-N518 PolarHBondContact O-ND2 3.41Å
515	K	96.5	Very high	94.3	Very high	79 Å²	79	49.6 Å²	49.6	34%	0.343	25%	0.25	S	C	.	.	H	α-helix	trans	-57.9	-50.4	176.6	-178.8	177.7	178.4	-177.3	0	111.5	E511 K512 T517 N518 I519	E511-K515 WeakPolarHBondContact O-CB 3.17Å; E511-K515 PolarHBondContact O-N 3.47Å; K512-K515 PolarHBondContact O-N 2.85Å; K515-T517 PolarHBondContact O-N 2.69Å; K515-N518 PolarHBondContact O-N 3.19Å; K515-I519 HydrophobicContact CG-CD1 3.73Å; K515-I519 WeakPolarHBondContact O-CD1 3.48Å; K515-I519 WeakPolarHBondContact O-CG1 3.48Å; K515-I519 PolarHBondContact O-N 3.06Å; K515-I519 VanDerWaalsContact O-N 3.13Å
516	L	98	Very high	94.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.1	-43.5	-178.8	-177.1	62.3	0	0	0	111.9	K512 K513 T514 I519 I520 L583 I586 L611 M614 Y615	K512-L516 WeakPolarHBondContact O-CB 3.38Å; K512-L516 PolarHBondContact O-N 3.12Å; K513-L516 PolarHBondContact O-N 3.29Å; T514-L516 PolarHBondContact O-N 3.03Å; L516-I519 PolarHBondContact O-N 2.81Å; L516-I520 WeakPolarHBondContact O-CB 2.98Å; L516-I520 WeakPolarHBondContact O-CG2 3.14Å; L516-I520 PolarHBondContact O-N 2.91Å; L516-L583 HydrophobicContact CD1-CB 4.22Å; L516-L583 HydrophobicContact CD1-CD1 4.34Å; L516-L583 HydrophobicContact CD2-CD1 3.86Å; L516-I586 HydrophobicContact CB-CD1 4.21Å; L516-L611 HydrophobicContact CD2-CB 4.37Å; L516-L611 HydrophobicContact CD2-CD2 4.28Å; L516-M614 HydrophobicContact CD2-CE 3.92Å; L516-M614 HydrophobicContact CG-CE 3.85Å; L516-Y615 HydrophobicContact CD1-CD2 4.22Å
517	T	96.8	Very high	94.9	Very high	42 Å²	42	56.7 Å²	56.7	26%	0.258	28%	0.276	S	S	.	.	H	α-helix	trans	-61.2	-45.8	178.5	-56	0	0	0	0	111.1	K513 T514 K515 I519 I520 D521	K513-T517 VanDerWaalsContact O-CB 3.28Å; K513-T517 WeakPolarHBondContact O-CB 3.37Å; K513-T517 PolarHBondContact O-N 3.31Å; K513-T517 PolarHBondContact O-OG1 3.44Å; T514-T517 PolarHBondContact O-N 3.47Å; K515-T517 PolarHBondContact O-N 2.69Å; T517-I519 PolarHBondContact O-N 3.26Å; T517-I520 VanDerWaalsContact O-CG2 3.32Å; T517-I520 WeakPolarHBondContact O-CG2 3.43Å; T517-I520 PolarHBondContact O-N 2.74Å; T517-D521 WeakPolarHBondContact O-CB 3.3Å; T517-D521 PolarHBondContact O-N 2.83Å
518	N	95.7	Very high	95.2	Very high	98 Å²	98	52.6 Å²	52.6	52%	0.524	26%	0.263	S	S	.	.	H	α-helix	trans	-63.6	-40.2	179.1	-69.2	-19.9	0	0	0	112.5	T514 K515 S522	T514-N518 WeakPolarHBondContact O-CB 3.33Å; T514-N518 PolarHBondContact O-N 3.08Å; T514-N518 PolarHBondContact O-ND2 3.41Å; K515-N518 PolarHBondContact O-N 3.19Å; N518-S522 PolarHBondContact O-N 3.24Å; N518-S522 PolarHBondContact O-OG 2.96Å
519	I	95.5	Very high	95.4	Very high	52 Å²	52	58.8 Å²	58.8	27%	0.267	29%	0.292	S	S	.	.	H	α-helix	trans	-76.4	-37.1	-177.8	-56.2	166.9	0	0	0	110.4	K515 L516 T517 S522 E523 T579 I582	K515-I519 HydrophobicContact CG-CD1 3.73Å; K515-I519 WeakPolarHBondContact O-CD1 3.48Å; K515-I519 WeakPolarHBondContact O-CG1 3.48Å; K515-I519 PolarHBondContact O-N 3.06Å; K515-I519 VanDerWaalsContact O-N 3.13Å; L516-I519 PolarHBondContact O-N 2.81Å; T517-I519 PolarHBondContact O-N 3.26Å; I519-S522 CarbonylContact O-C 3.56Å; I519-S522 PolarHBondContact O-N 3.26Å; I519-S522 PolarHBondContact O-OG 3.14Å; I519-E523 PolarHBondContact O-N 3.29Å; I519-E523 VanDerWaalsContact O-N 3.09Å; I519-T579 VanDerWaalsContact C-CG2 3.5Å; I519-T579 HydrophobicContact CB-CG2 4.11Å; I519-T579 HydrophobicContact CG2-CG2 3.42Å; I519-T579 VanDerWaalsContact CG2-CG2 3.42Å; I519-T579 VanDerWaalsContact O-CG2 3.31Å; I519-T579 WeakPolarHBondContact O-CG2 3.38Å; I519-I582 HydrophobicContact CD1-CG1 4.4Å; I519-I582 HydrophobicContact CD1-CG2 3.88Å
520	I	96.5	Very high	95.3	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-69	-38.3	177.2	-160.1	172.9	0	0	0	112.7	L516 T517 S522 E523 T579 M614 Y615 R618 L622	L516-I520 WeakPolarHBondContact O-CB 2.98Å; L516-I520 WeakPolarHBondContact O-CG2 3.14Å; L516-I520 PolarHBondContact O-N 2.91Å; T517-I520 VanDerWaalsContact O-CG2 3.32Å; T517-I520 WeakPolarHBondContact O-CG2 3.43Å; T517-I520 PolarHBondContact O-N 2.74Å; I520-S522 PolarHBondContact O-N 3.34Å; I520-E523 WeakPolarHBondContact O-CB 3.27Å; I520-E523 PolarHBondContact O-N 3.42Å; I520-T579 HydrophobicContact CB-CG2 4.31Å; I520-M614 HydrophobicContact CG2-CE 3.95Å; I520-Y615 HydrophobicContact CD1-CD2 3.61Å; I520-Y615 HydrophobicContact CD1-CE2 3.87Å; I520-Y615 HydrophobicContact CD1-CG 4.32Å; I520-Y615 HydrophobicContact CG1-CE2 4.49Å; I520-R618 HydrophobicContact CD1-CB 3.92Å; I520-R618 HydrophobicContact CD1-CG 3.94Å; I520-R618 HydrophobicContact CG1-CG 4.33Å; I520-R618 HydrophobicContact CG2-CG 3.77Å; I520-L622 HydrophobicContact CG1-CD1 3.97Å; I520-L622 WeakPolarHBondContact O-CD1 3.47Å
521	D	94.7	Very high	95.1	Very high	38 Å²	38	55.5 Å²	55.5	20%	0.203	28%	0.279	C	S	.	.	H	α-helix	trans	-69.4	-22.3	178.9	-78.3	-11.7	0	0	0	113	T517 R618 M631 V632	T517-D521 WeakPolarHBondContact O-CB 3.3Å; T517-D521 PolarHBondContact O-N 2.83Å; D521-R618 IonicContact OD1-CZ 3.28Å; D521-R618 IonicContact OD1-NE 2.91Å; D521-R618 PolarHBondContact OD1-NE 2.77Å; D521-R618 IonicContact OD1-NH2 3.88Å; D521-R618 PolarHBondContact OD1-NH2 3.47Å; D521-R618 IonicContact OD2-NH2 2.71Å; D521-M631 HydrophobicContact CB-CE 3.76Å; D521-V632 WeakPolarHBondContact O-CG2 3.44Å
522	S	93.5	Very high	94.9	Very high	76 Å²	76	56.5 Å²	56.5	53%	0.531	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	8.6	176.5	58.6	0	0	0	0	113.8	N518 I519 I520 N524	N518-S522 PolarHBondContact O-N 3.24Å; N518-S522 PolarHBondContact O-OG 2.96Å; I519-S522 CarbonylContact O-C 3.56Å; I519-S522 PolarHBondContact O-N 3.26Å; I519-S522 PolarHBondContact O-OG 3.14Å; I520-S522 PolarHBondContact O-N 3.34Å; S522-N524 PolarHBondContact O-N 3.31Å; S522-N524 PolarHBondContact O-OD1 2.78Å
523	E	95.3	Very high	94.6	Very high	18 Å²	18	57.1 Å²	57.1	8%	0.084	29%	0.286	C	S	.	.			trans	-71.8	125.9	-178.5	-179.6	58.3	-91.1	0	0	111.5	I519 I520 W525 V577 G578 T579 V632	I519-E523 PolarHBondContact O-N 3.29Å; I519-E523 VanDerWaalsContact O-N 3.09Å; I520-E523 WeakPolarHBondContact O-CB 3.27Å; I520-E523 PolarHBondContact O-N 3.42Å; E523-W525 VanDerWaalsContact C-N 3.27Å; E523-W525 HydrophobicContact CG-CD2 4.19Å; E523-W525 HydrophobicContact CG-CG 4.31Å; E523-W525 PolarHBondContact O-N 3.41Å; E523-W525 PolarHBondContact O-NE1 3.43Å; E523-W525 PolarHBondContact OE1-N 2.91Å; E523-V577 HydrophobicContact CG-CB 4.29Å; E523-V577 HydrophobicContact CG-CG2 4.38Å; E523-G578 PolarHBondContact OE2-N 3.42Å; E523-G578 VanDerWaalsContact OE2-N 3.15Å; E523-T579 HydrophobicContact CB-CG2 3.79Å; E523-T579 HydrophobicContact CG-CG2 3.95Å; E523-T579 WeakPolarHBondContact OE2-CB 3.35Å; E523-T579 WeakPolarHBondContact OE2-CG2 3.35Å; E523-T579 PolarHBondContact OE2-N 3.48Å; E523-T579 PolarHBondContact OE2-OG1 3.29Å; E523-V632 WeakPolarHBondContact O-CG2 3.1Å
524	N	92.6	Very high	94.3	Very high	79 Å²	79	55.2 Å²	55.2	42%	0.422	28%	0.278	S	S	.	.			trans	-85.1	-1.1	-178.7	-69.3	-15.1	0	0	0	113.3	S522 K526 V632	S522-N524 PolarHBondContact O-N 3.31Å; S522-N524 PolarHBondContact O-OD1 2.78Å; N524-K526 HydrophobicContact CB-CG 4.41Å; N524-K526 PolarHBondContact O-N 3.35Å; N524-V632 WeakPolarHBondContact OD1-CG1 3.29Å
525	W	95.2	Very high	94.1	Very high	1 Å²	1	52.7 Å²	52.7	0%	0.004	26%	0.261	C	S	.	.			trans	55.8	37.5	179.6	-57	88	0	0	0	112.7	E523 V577 L622 I623 H641 L644	E523-W525 VanDerWaalsContact C-N 3.27Å; E523-W525 HydrophobicContact CG-CD2 4.19Å; E523-W525 HydrophobicContact CG-CG 4.31Å; E523-W525 PolarHBondContact O-N 3.41Å; E523-W525 PolarHBondContact O-NE1 3.43Å; E523-W525 PolarHBondContact OE1-N 2.91Å; W525-V577 HydrophobicContact CE3-CG1 4.07Å; W525-L622 HydrophobicContact CZ2-CB 3.76Å; W525-L622 HydrophobicContact CZ2-CD1 3.9Å; W525-I623 HydrophobicContact CB-CD1 4.45Å; W525-I623 HydrophobicContact CD2-CD1 3.27Å; W525-I623 HydrophobicContact CD2-CG1 3.82Å; W525-I623 VanDerWaalsContact CE2-CD1 3.48Å; W525-I623 HydrophobicContact CE3-CD1 3.53Å; W525-I623 HydrophobicContact CE3-CG1 3.68Å; W525-I623 HydrophobicContact CG-CD1 3.68Å; W525-I623 HydrophobicContact CH2-CD1 4.15Å; W525-I623 HydrophobicContact CH2-CG1 3.54Å; W525-I623 HydrophobicContact CZ2-CD1 3.93Å; W525-I623 HydrophobicContact CZ2-CG1 3.67Å; W525-I623 HydrophobicContact CZ3-CD1 3.97Å; W525-I623 HydrophobicContact CZ3-CG1 3.55Å; W525-H641 HydrophobicContact CB-CB 4.24Å; W525-H641 PolarHBondContact O-CD2 3.43Å; W525-L644 WeakPolarHBondContact O-CD1 3.34Å
526	K	94.8	Very high	93.9	Very high	141 Å²	141	52.4 Å²	52.4	61%	0.613	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-99.6	159.3	174.5	65.8	176.3	-177.8	172.6	0	110.5	N524 A528	N524-K526 HydrophobicContact CB-CG 4.41Å; N524-K526 PolarHBondContact O-N 3.35Å; K526-A528 PolarHBondContact O-N 3.5Å
527	R	96.3	Very high	93.7	Very high	105 Å²	105	52.4 Å²	52.4	40%	0.396	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-57.2	123.6	173.7	179.7	178.3	-77.2	169	-10.4	109.5	V575 L644 D738	R527-V575 HydrophobicContact CG-CG1 3.85Å; R527-L644 HydrophobicContact CB-CD2 4.35Å; R527-D738 PolarHBondContact NH2-O 2.97Å
528	A	94.5	Very high	93.6	Very high	10 Å²	10	50.4 Å²	50.4	8%	0.083	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-72.6	141.3	176.6	0	0	0	0	0	111.1	K526 I576 L581	K526-A528 PolarHBondContact O-N 3.5Å; A528-I576 VanDerWaalsContact CB-O 3.27Å; A528-I576 WeakPolarHBondContact CB-O 3.4Å; A528-I576 PolarHBondContact N-O 2.86Å; A528-L581 HydrophobicContact CB-CD1 4.02Å
529	E	94.1	Very high	93.5	Very high	144 Å²	144	49 Å²	49	67%	0.673	24%	0.243	S	C	*	.	P	Polyproline II helix	trans	-81.8	126.7	158.6	-66.3	177.6	170.7	0	0	106.9	P531 Y563	E529-P531 WeakPolarHBondContact O-CD 3.33Å; E529-Y563 HydrophobicContact CB-CD1 4.07Å
530	V	92.9	Very high	93.3	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.024	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-100.4	106.1	-174.7	-175.5	0	0	0	0	108.6	F534 R564 L567 L581	V530-F534 HydrophobicContact CG1-CB 4.07Å; V530-R564 PolarHBondContact N-O 3.45Å; V530-R564 PolarHBondContact O-N 2.8Å; V530-L567 HydrophobicContact CG1-CB 4.33Å; V530-L567 HydrophobicContact CG1-CD1 3.8Å; V530-L567 HydrophobicContact CG2-CB 4.47Å; V530-L581 HydrophobicContact CG1-CD2 4.29Å; V530-L581 HydrophobicContact CG2-CD1 4.21Å; V530-L581 HydrophobicContact CG2-CD2 4.4Å
531	P	91.1	Very high	93.2	Very high	29 Å²	29	50 Å²	50	19%	0.188	25%	0.248	C	C	.	.			trans	-59	149.9	168.1	-21.7	27.2	0	0	0	112	E529 L533 F534 V561 Y563	E529-P531 WeakPolarHBondContact O-CD 3.33Å; P531-L533 PolarHBondContact O-N 3.28Å; P531-L533 VanDerWaalsContact O-N 3.14Å; P531-F534 HydrophobicContact CB-CD2 4Å; P531-F534 HydrophobicContact CB-CE2 4.4Å; P531-F534 HydrophobicContact CG-CD2 3.79Å; P531-F534 HydrophobicContact CG-CE2 3.85Å; P531-F534 PolarHBondContact O-N 2.82Å; P531-F534 VanDerWaalsContact O-N 3.1Å; P531-V561 HydrophobicContact CB-CG1 4.12Å; P531-Y563 HydrophobicContact CB-CE1 4.28Å; P531-Y563 HydrophobicContact CG-CD1 4.17Å; P531-Y563 HydrophobicContact CG-CE1 3.85Å
532	K	88.4	Confident	93.1	Very high	119 Å²	119	52.3 Å²	52.3	52%	0.517	26%	0.257	S	S	.	.	H	α-helix	trans	-51.5	-37.9	175.3	-67.2	-174.2	177.6	178	0	113	F534 Q535 D536 V561 G562	K532-F534 VanDerWaalsContact C-N 3.25Å; K532-F534 PolarHBondContact O-N 3.39Å; K532-Q535 CarbonylContact O-C 3.52Å; K532-Q535 WeakPolarHBondContact O-CA 2.95Å; K532-Q535 VanDerWaalsContact O-CB 3.32Å; K532-Q535 WeakPolarHBondContact O-CB 3.1Å; K532-Q535 PolarHBondContact O-N 3.46Å; K532-D536 VanDerWaalsContact O-CG 3.23Å; K532-D536 PolarHBondContact O-N 3.25Å; K532-V561 HydrophobicContact CB-CG1 3.86Å; K532-V561 HydrophobicContact CD-CG1 4.44Å; K532-V561 HydrophobicContact CG-CG1 3.83Å; K532-V561 VanDerWaalsContact N-CG1 3.32Å; K532-G562 WeakPolarHBondContact CG-O 3.44Å
533	L	88.7	Confident	93.1	Very high	31 Å²	31	53.1 Å²	53.1	16%	0.162	26%	0.263	C	S	.	.	H	α-helix	trans	-51.1	-42.7	178.9	-165.9	93.4	0	0	0	113	P531 D536 I537 V550 M553	P531-L533 PolarHBondContact O-N 3.28Å; P531-L533 VanDerWaalsContact O-N 3.14Å; L533-D536 PolarHBondContact O-N 2.73Å; L533-I537 WeakPolarHBondContact O-CG1 3.39Å; L533-I537 PolarHBondContact O-N 3.25Å; L533-V550 HydrophobicContact CD1-CB 3.74Å; L533-V550 HydrophobicContact CD1-CG1 3.47Å; L533-V550 VanDerWaalsContact CD1-CG1 3.47Å; L533-V550 HydrophobicContact CG-CB 4.02Å; L533-V550 HydrophobicContact CG-CG1 4.26Å; L533-M553 HydrophobicContact CD1-CG 4.43Å
534	F	92.9	Very high	92.9	Very high	19 Å²	19	55.1 Å²	55.1	8%	0.083	28%	0.277	C	S	.	.	H	α-helix	trans	-71.9	-33.3	178.5	-68.3	-80.3	0	0	0	112.2	V530 P531 K532 D536 I537 V538 L567 L581 I582 Q585	V530-F534 HydrophobicContact CG1-CB 4.07Å; P531-F534 HydrophobicContact CB-CD2 4Å; P531-F534 HydrophobicContact CB-CE2 4.4Å; P531-F534 HydrophobicContact CG-CD2 3.79Å; P531-F534 HydrophobicContact CG-CE2 3.85Å; P531-F534 PolarHBondContact O-N 2.82Å; P531-F534 VanDerWaalsContact O-N 3.1Å; K532-F534 VanDerWaalsContact C-N 3.25Å; K532-F534 PolarHBondContact O-N 3.39Å; F534-D536 VanDerWaalsContact C-N 3.31Å; F534-I537 HydrophobicContact CD1-CD1 4.3Å; F534-V538 PolarHBondContact O-N 2.78Å; F534-L567 HydrophobicContact CB-CD1 4.28Å; F534-L581 HydrophobicContact CB-CD2 4.1Å; F534-L581 HydrophobicContact CD1-CB 3.77Å; F534-L581 HydrophobicContact CD1-CD2 4.26Å; F534-L581 HydrophobicContact CD2-CB 4.49Å; F534-L581 HydrophobicContact CD2-CD1 4.31Å; F534-L581 HydrophobicContact CE1-CB 3.68Å; F534-L581 VanDerWaalsContact CE1-O 3.27Å; F534-L581 WeakPolarHBondContact CE1-O 3.49Å; F534-L581 HydrophobicContact CE2-CB 4.41Å; F534-L581 HydrophobicContact CE2-CD1 4.5Å; F534-L581 HydrophobicContact CG-CB 4.19Å; F534-L581 HydrophobicContact CG-CD1 4.48Å; F534-L581 HydrophobicContact CG-CD2 4.13Å; F534-L581 HydrophobicContact CZ-CB 4.01Å; F534-I582 HydrophobicContact CZ-CD1 4.03Å; F534-Q585 HydrophobicContact CE1-CB 4.04Å
535	Q	93.3	Very high	92.8	Very high	22 Å²	22	53.3 Å²	53.3	10%	0.103	28%	0.276	C	S	.	.	H	α-helix	trans	-66.8	-36.9	171.7	-172	60.2	61	0	0	110.9	K532 V538 N539 L567 S568	K532-Q535 CarbonylContact O-C 3.52Å; K532-Q535 WeakPolarHBondContact O-CA 2.95Å; K532-Q535 VanDerWaalsContact O-CB 3.32Å; K532-Q535 WeakPolarHBondContact O-CB 3.1Å; K532-Q535 PolarHBondContact O-N 3.46Å; Q535-V538 PolarHBondContact O-N 3.46Å; Q535-N539 PolarHBondContact NE2-OD1 2.72Å; Q535-N539 WeakPolarHBondContact O-CB 3.13Å; Q535-N539 PolarHBondContact O-N 3.43Å; Q535-N539 PolarHBondContact O-ND2 2.88Å; Q535-N539 PolarHBondContact O-OD1 3.44Å; Q535-L567 HydrophobicContact CB-CD1 4.38Å; Q535-S568 PolarHBondContact NE2-O 2.77Å
536	D	91.6	Very high	92.7	Very high	72 Å²	72	57.4 Å²	57.4	39%	0.385	29%	0.294	S	S	.	.	H	α-helix	trans	-66.3	-37.3	177.9	-61.2	-29.6	0	0	0	111.6	K532 L533 F534 V538 N539 D540 V550	K532-D536 VanDerWaalsContact O-CG 3.23Å; K532-D536 PolarHBondContact O-N 3.25Å; L533-D536 PolarHBondContact O-N 2.73Å; F534-D536 VanDerWaalsContact C-N 3.31Å; D536-V538 VanDerWaalsContact C-N 3.31Å; D536-V538 PolarHBondContact O-N 2.79Å; D536-N539 PolarHBondContact O-N 3.44Å; D536-D540 WeakPolarHBondContact O-CB 3.24Å; D536-D540 PolarHBondContact O-N 2.71Å; D536-V550 HydrophobicContact CB-CG2 4.25Å
537	I	93.2	Very high	92.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-55.6	-46.2	170.9	-68.3	170.6	0	0	0	110.9	L533 F534 F541 L547 V550 Q585 A588	L533-I537 WeakPolarHBondContact O-CG1 3.39Å; L533-I537 PolarHBondContact O-N 3.25Å; F534-I537 HydrophobicContact CD1-CD1 4.3Å; I537-F541 WeakPolarHBondContact O-CB 3.15Å; I537-F541 PolarHBondContact O-N 2.86Å; I537-L547 HydrophobicContact CG2-CD1 3.66Å; I537-V550 HydrophobicContact CG1-CB 4.38Å; I537-V550 HydrophobicContact CG1-CG2 3.75Å; I537-Q585 HydrophobicContact CD1-CG 4.47Å; I537-A588 HydrophobicContact CG2-CB 4.43Å
538	V	95	Very high	92.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-71.3	-39.4	-179.9	-179.2	0	0	0	0	111.5	F534 Q535 D536 F541 E542 L567 S568 K569 L584 F655	F534-V538 PolarHBondContact O-N 2.78Å; Q535-V538 PolarHBondContact O-N 3.46Å; D536-V538 VanDerWaalsContact C-N 3.31Å; D536-V538 PolarHBondContact O-N 2.79Å; V538-F541 WeakPolarHBondContact O-CB 3.36Å; V538-F541 PolarHBondContact O-N 3.45Å; V538-E542 HydrophobicContact CG1-CG 4.49Å; V538-E542 WeakPolarHBondContact O-CG 2.87Å; V538-E542 PolarHBondContact O-N 2.91Å; V538-L567 HydrophobicContact CG2-CD1 4Å; V538-L567 HydrophobicContact CG2-CD2 3.85Å; V538-L567 HydrophobicContact CG2-CG 4.09Å; V538-S568 WeakPolarHBondContact CG1-O 3.43Å; V538-K569 HydrophobicContact CG1-CB 3.94Å; V538-K569 HydrophobicContact CG1-CG 4.09Å; V538-L584 HydrophobicContact CG2-CD2 4.11Å; V538-F655 HydrophobicContact CG2-CZ 4.27Å
539	N	93	Very high	92	Very high	68 Å²	68	50.2 Å²	50.2	36%	0.364	26%	0.263	S	S	.	.	H	α-helix	trans	-66.5	-40.3	178	-63.7	-14.8	0	0	0	111.8	Q535 D536 F541 E542 S543	Q535-N539 PolarHBondContact NE2-OD1 2.72Å; Q535-N539 WeakPolarHBondContact O-CB 3.13Å; Q535-N539 PolarHBondContact O-N 3.43Å; Q535-N539 PolarHBondContact O-ND2 2.88Å; Q535-N539 PolarHBondContact O-OD1 3.44Å; D536-N539 PolarHBondContact O-N 3.44Å; N539-F541 VanDerWaalsContact C-N 3.32Å; N539-E542 PolarHBondContact O-N 3.39Å; N539-S543 WeakPolarHBondContact O-CB 3.42Å; N539-S543 PolarHBondContact O-N 3.44Å; N539-S543 PolarHBondContact O-OG 2.88Å
540	D	92.5	Very high	90.9	Very high	48 Å²	48	45.3 Å²	45.3	26%	0.257	24%	0.243	S	C	.	.	H	α-helix	trans	-62.9	-42.2	173.5	-174.8	63.3	0	0	0	110.5	D536 E542 S543 T544 R548	D536-D540 WeakPolarHBondContact O-CB 3.24Å; D536-D540 PolarHBondContact O-N 2.71Å; D540-E542 PolarHBondContact O-N 2.88Å; D540-S543 WeakPolarHBondContact CA-OG 3.38Å; D540-S543 PolarHBondContact O-N 3.48Å; D540-S543 PolarHBondContact O-OG 3.41Å; D540-S543 VanDerWaalsContact O-OG 3.09Å; D540-T544 WeakPolarHBondContact O-CB 3.31Å; D540-T544 WeakPolarHBondContact O-CG2 3.45Å; D540-T544 PolarHBondContact O-N 3.43Å; D540-T544 PolarHBondContact O-OG1 2.6Å; D540-R548 IonicContact OD2-CZ 2.83Å; D540-R548 IonicContact OD2-NE 2.7Å; D540-R548 PolarHBondContact OD2-NE 3.2Å; D540-R548 IonicContact OD2-NH2 3.43Å
541	F	94.7	Very high	89.3	Confident	26 Å²	26	50.1 Å²	50.1	11%	0.114	27%	0.274	C	S	.	.	H	α-helix	trans	-61.6	-42.6	173.9	172.6	-107.6	0	0	0	112.5	I537 V538 N539 S543 G545 L547 F655 H658	I537-F541 WeakPolarHBondContact O-CB 3.15Å; I537-F541 PolarHBondContact O-N 2.86Å; V538-F541 WeakPolarHBondContact O-CB 3.36Å; V538-F541 PolarHBondContact O-N 3.45Å; N539-F541 VanDerWaalsContact C-N 3.32Å; F541-S543 VanDerWaalsContact C-N 3.33Å; F541-S543 PolarHBondContact O-N 3.49Å; F541-G545 WeakPolarHBondContact O-CA 3.41Å; F541-G545 PolarHBondContact O-N 3.43Å; F541-L547 HydrophobicContact CB-CD1 3.93Å; F541-L547 HydrophobicContact CD2-CB 4.02Å; F541-L547 HydrophobicContact CD2-CD1 4.38Å; F541-L547 HydrophobicContact CG-CD1 4.17Å; F541-F655 HydrophobicContact CD1-CD1 4.3Å; F541-F655 AromaticContact CD1-CE1 3.56Å; F541-F655 HydrophobicContact CD1-CE1 3.56Å; F541-F655 HydrophobicContact CD1-CZ 4.45Å; F541-F655 HydrophobicContact CE1-CD1 4.07Å; F541-F655 AromaticContact CE1-CE1 3.72Å; F541-F655 HydrophobicContact CE1-CE1 3.72Å; F541-F655 HydrophobicContact CG-CE1 4.05Å; F541-F655 HydrophobicContact CZ-CD1 4.31Å; F541-F655 HydrophobicContact CZ-CE1 4.36Å; F541-H658 HydrophobicContact CE2-CB 4.15Å; F541-H658 AromaticContact CE2-CD2 3.52Å; F541-H658 AromaticContact CE2-CE1 3.74Å; F541-H658 AromaticContact CE2-CG 3.48Å; F541-H658 VanDerWaalsContact CE2-CG 3.48Å; F541-H658 AromaticContact CE2-ND1 3.62Å; F541-H658 AromaticContact CE2-NE2 3.67Å; F541-H658 HydrophobicContact CZ-CB 4.04Å; F541-H658 AromaticContact CZ-CG 3.88Å
542	E	91.9	Very high	87.6	Confident	86 Å²	86	53.8 Å²	53.8	40%	0.402	30%	0.296	S	S	.	.	H	α-helix	trans	-68.1	-31.8	179	-76.1	179.5	-174.3	0	0	113.4	V538 N539 D540 K569 K570	V538-E542 HydrophobicContact CG1-CG 4.49Å; V538-E542 WeakPolarHBondContact O-CG 2.87Å; V538-E542 PolarHBondContact O-N 2.91Å; N539-E542 PolarHBondContact O-N 3.39Å; D540-E542 PolarHBondContact O-N 2.88Å; E542-K569 VanDerWaalsContact OE1-CA 3.26Å; E542-K569 WeakPolarHBondContact OE1-CA 3.35Å; E542-K570 PolarHBondContact OE1-N 3.24Å
543	S	92.3	Very high	85.9	Confident	93 Å²	93	53.3 Å²	53.3	65%	0.65	30%	0.297	S	S	*	.	H	α-helix	trans	-84.9	-36	179.4	56.1	0	0	0	0	113.3	N539 D540 F541	N539-S543 WeakPolarHBondContact O-CB 3.42Å; N539-S543 PolarHBondContact O-N 3.44Å; N539-S543 PolarHBondContact O-OG 2.88Å; D540-S543 WeakPolarHBondContact CA-OG 3.38Å; D540-S543 PolarHBondContact O-N 3.48Å; D540-S543 PolarHBondContact O-OG 3.41Å; D540-S543 VanDerWaalsContact O-OG 3.09Å; F541-S543 VanDerWaalsContact C-N 3.33Å; F541-S543 PolarHBondContact O-N 3.49Å
544	T	91.7	Very high	84.2	Confident	61 Å²	61	57.9 Å²	57.9	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-108.1	-14.3	-172.6	70.9	0	0	0	0	114.2	D540 K546 R548	D540-T544 WeakPolarHBondContact O-CB 3.31Å; D540-T544 WeakPolarHBondContact O-CG2 3.45Å; D540-T544 PolarHBondContact O-N 3.43Å; D540-T544 PolarHBondContact O-OG1 2.6Å; T544-K546 PolarHBondContact O-N 3.35Å; T544-K546 PolarHBondContact OG1-N 2.87Å; T544-K546 PolarHBondContact OG1-O 3.27Å; T544-R548 VanDerWaalsContact CG2-NH2 3.35Å; T544-R548 PolarHBondContact OG1-NH2 3.38Å
545	G	91.1	Very high	82.2	Confident	40 Å²	40	64 Å²	64	41%	0.412	35%	0.35	S	S	.	.	S	Bend	trans	70.8	6.6	-173	0	0	0	0	0	114.1	F541 H658	F541-G545 WeakPolarHBondContact O-CA 3.41Å; F541-G545 PolarHBondContact O-N 3.43Å; G545-H658 PolarHBondContact O-CE1 3.1Å
546	K	91.9	Very high	80	Confident	88 Å²	88	66.5 Å²	66.5	38%	0.383	38%	0.375	S	S	.	.			trans	-119.7	122.5	-176.9	-67.8	-178.2	160.5	-151	0	110.6	T544 R548 E595	T544-K546 PolarHBondContact O-N 3.35Å; T544-K546 PolarHBondContact OG1-N 2.87Å; T544-K546 PolarHBondContact OG1-O 3.27Å; K546-R548 PolarHBondContact O-N 2.85Å; K546-E595 VanDerWaalsContact CD-OE1 3.23Å; K546-E595 WeakPolarHBondContact CD-OE1 3.47Å; K546-E595 WeakPolarHBondContact CE-OE1 3.23Å; K546-E595 WeakPolarHBondContact CG-OE1 3.29Å; K546-E595 VanDerWaalsContact NZ-CD 3.34Å; K546-E595 IonicContact NZ-OE1 3.84Å; K546-E595 PolarHBondContact NZ-OE1 3.31Å; K546-E595 IonicContact NZ-OE2 3.15Å; K546-E595 PolarHBondContact NZ-OE2 3.3Å
547	L	94.6	Very high	78.1	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	37%	0.366	C	S	.	.			trans	-80.5	112.7	179.3	-170.4	70.8	0	0	0	110.2	I537 F541 L584 M587 A588 C591 F655 F659	I537-L547 HydrophobicContact CG2-CD1 3.66Å; F541-L547 HydrophobicContact CB-CD1 3.93Å; F541-L547 HydrophobicContact CD2-CB 4.02Å; F541-L547 HydrophobicContact CD2-CD1 4.38Å; F541-L547 HydrophobicContact CG-CD1 4.17Å; L547-L584 HydrophobicContact CD1-CD1 4.36Å; L547-L584 HydrophobicContact CD2-CD1 4.03Å; L547-M587 HydrophobicContact CD2-CB 4.41Å; L547-A588 HydrophobicContact CD2-CB 4.09Å; L547-A588 HydrophobicContact CG-CB 3.79Å; L547-C591 HydrophobicContact CB-CB 4.41Å; L547-C591 VanDerWaalsContact O-CB 3.25Å; L547-C591 WeakPolarHBondContact O-CB 3.49Å; L547-F655 HydrophobicContact CD1-CD1 4.23Å; L547-F655 HydrophobicContact CD1-CE1 3.83Å; L547-F655 HydrophobicContact CD2-CD1 4.26Å; L547-F659 HydrophobicContact CD2-CE1 3.65Å; L547-F659 HydrophobicContact CD2-CZ 4.11Å
548	R	91	Very high	76.2	Confident	81 Å²	81	70.5 Å²	70.5	31%	0.306	39%	0.39	S	S	.	.			trans	-128.2	142	-175.8	-72.8	-178.6	-83.9	-169	-12.6	111.4	D540 T544 K546 Q592	D540-R548 IonicContact OD2-CZ 2.83Å; D540-R548 IonicContact OD2-NE 2.7Å; D540-R548 PolarHBondContact OD2-NE 3.2Å; D540-R548 IonicContact OD2-NH2 3.43Å; T544-R548 VanDerWaalsContact CG2-NH2 3.35Å; T544-R548 PolarHBondContact OG1-NH2 3.38Å; K546-R548 PolarHBondContact O-N 2.85Å; R548-Q592 HydrophobicContact CB-CG 4.15Å; R548-Q592 HydrophobicContact CG-CG 3.84Å
549	D	87	Confident	74.2	Confident	24 Å²	24	79.1 Å²	79.1	13%	0.128	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-73.8	139.6	171.4	-165.9	11.7	0	0	0	109.5	Q585 A588 Q589 Q592	D549-Q585 VanDerWaalsContact OD1-CG 3.31Å; D549-Q585 WeakPolarHBondContact OD1-CG 3.5Å; D549-Q585 PolarHBondContact OD1-NE2 3.44Å; D549-Q585 PolarHBondContact OD2-NE2 2.67Å; D549-A588 HydrophobicContact CB-CB 4.27Å; D549-Q589 HydrophobicContact CB-CG 3.83Å; D549-Q589 VanDerWaalsContact OD2-CG 3.26Å; D549-Q589 WeakPolarHBondContact OD2-CG 3.36Å; D549-Q589 PolarHBondContact OD2-NE2 2.9Å; D549-Q592 PolarHBondContact O-NE2 3Å
550	V	70	Confident	72.3	Confident	40 Å²	40	82.7 Å²	82.7	24%	0.242	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-93.8	134.7	177.4	-179.3	0	0	0	0	107.5	L533 D536 I537 T552	L533-V550 HydrophobicContact CD1-CB 3.74Å; L533-V550 HydrophobicContact CD1-CG1 3.47Å; L533-V550 VanDerWaalsContact CD1-CG1 3.47Å; L533-V550 HydrophobicContact CG-CB 4.02Å; L533-V550 HydrophobicContact CG-CG1 4.26Å; D536-V550 HydrophobicContact CB-CG2 4.25Å; I537-V550 HydrophobicContact CG1-CB 4.38Å; I537-V550 HydrophobicContact CG1-CG2 3.75Å; V550-T552 PolarHBondContact O-N 2.81Å
551	P	59.9	Low	70.8	Confident	106 Å²	106	81.8 Å²	81.8	69%	0.688	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-49.7	131.3	-175.2	-9.6	3.6	0	0	0	112.1	M553	P551-M553 PolarHBondContact O-N 3.31Å
552	T	55.5	Low	69.7	Low	106 Å²	106	82.3 Å²	82.3	65%	0.65	46%	0.455	S	S	*	.			trans	-52.2	109.6	171.6	-9	0	0	0	0	108.8	V550	V550-T552 PolarHBondContact O-N 2.81Å
553	M	52.6	Low	69.3	Low	109 Å²	109	84 Å²	84	54%	0.537	46%	0.459	S	S	.	.			trans	-67.6	152.8	177	-66.1	-163.3	83.4	0	0	111.8	L533 P551 A557	L533-M553 HydrophobicContact CD1-CG 4.43Å; P551-M553 PolarHBondContact O-N 3.31Å; M553-A557 HydrophobicContact CB-CB 3.95Å; M553-A557 HydrophobicContact CE-CB 3.13Å; M553-A557 HydrophobicContact CG-CB 4.37Å; M553-A557 HydrophobicContact SD-CB 3.52Å; M553-A557 VanDerWaalsContact SD-CB 3.52Å
554	D	52.5	Low	69.2	Low	126 Å²	126	86.5 Å²	86.5	67%	0.674	45%	0.454	S	S	*	.			trans	-51	147.8	165.6	-65.1	-28.7	0	0	0	111.9	A556 A557 R558	D554-A556 PolarHBondContact O-N 2.81Å; D554-A556 VanDerWaalsContact O-N 3.09Å; D554-A557 PolarHBondContact O-N 2.77Å; D554-R558 PolarHBondContact O-N 3.27Å
555	E	50.3	Low	69.2	Low	147 Å²	147	86.4 Å²	86.4	69%	0.687	46%	0.456	S	S	*	.	H	α-helix	trans	-55.1	-31.1	179	-66.6	-164	145.6	0	0	113.2	A557 R558	E555-A557 VanDerWaalsContact C-N 3.27Å; E555-A557 PolarHBondContact O-N 3.22Å; E555-R558 WeakPolarHBondContact O-CB 3.42Å; E555-R558 PolarHBondContact O-N 2.05Å
556	A	48.2	Very low	69.4	Low	76 Å²	76	87 Å²	87	63%	0.628	45%	0.446	S	S	*	.	H	α-helix	trans	-60.5	-36.3	176.9	0	0	0	0	0	112.4	D554	D554-A556 PolarHBondContact O-N 2.81Å; D554-A556 VanDerWaalsContact O-N 3.09Å
557	A	51.8	Low	69.6	Low	23 Å²	23	82.8 Å²	82.8	19%	0.19	43%	0.428	C	S	.	.	H	α-helix	trans	-78.6	-29.7	177.9	0	0	0	0	0	112.6	M553 D554 E555 K559 N560 V561	M553-A557 HydrophobicContact CB-CB 3.95Å; M553-A557 HydrophobicContact CE-CB 3.13Å; M553-A557 HydrophobicContact CG-CB 4.37Å; M553-A557 HydrophobicContact SD-CB 3.52Å; M553-A557 VanDerWaalsContact SD-CB 3.52Å; D554-A557 PolarHBondContact O-N 2.77Å; E555-A557 VanDerWaalsContact C-N 3.27Å; E555-A557 PolarHBondContact O-N 3.22Å; A557-K559 PolarHBondContact O-N 2.97Å; A557-N560 PolarHBondContact O-N 2.9Å; A557-V561 VanDerWaalsContact O-CG2 3.23Å; A557-V561 WeakPolarHBondContact O-CG2 3.47Å; A557-V561 PolarHBondContact O-N 2.84Å
558	R	53	Low	69.7	Low	132 Å²	132	84.3 Å²	84.3	50%	0.498	44%	0.439	S	S	.	.	H	α-helix	trans	-54.5	-33.9	174	-68.6	-177	179.8	167.6	-0.2	112.3	D554 E555 N560 Y563	D554-R558 PolarHBondContact O-N 3.27Å; E555-R558 WeakPolarHBondContact O-CB 3.42Å; E555-R558 PolarHBondContact O-N 2.05Å; R558-N560 VanDerWaalsContact C-N 3.3Å; R558-N560 PolarHBondContact O-N 2.92Å; R558-Y563 PolarHBondContact O-OH 3.28Å
559	K	53.9	Low	69.8	Low	182 Å²	182	81.5 Å²	81.5	79%	0.791	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-25.8	178	-70.1	-176.8	179.4	174.5	0	113.6	A557	A557-K559 PolarHBondContact O-N 2.97Å
560	N	51.9	Low	69.9	Low	143 Å²	143	88.5 Å²	88.5	77%	0.765	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	8.6	-177.4	-74.5	-21.8	0	0	0	113.8	A557 R558 G562	A557-N560 PolarHBondContact O-N 2.9Å; R558-N560 VanDerWaalsContact C-N 3.3Å; R558-N560 PolarHBondContact O-N 2.92Å; N560-G562 PolarHBondContact O-N 2.92Å
561	V	61.4	Low	70.8	Confident	29 Å²	29	89.6 Å²	89.6	18%	0.176	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-78.7	118.6	-179.5	-172.6	0	0	0	0	109.8	P531 K532 A557 Y563	P531-V561 HydrophobicContact CB-CG1 4.12Å; K532-V561 HydrophobicContact CB-CG1 3.86Å; K532-V561 HydrophobicContact CD-CG1 4.44Å; K532-V561 HydrophobicContact CG-CG1 3.83Å; K532-V561 VanDerWaalsContact N-CG1 3.32Å; A557-V561 VanDerWaalsContact O-CG2 3.23Å; A557-V561 WeakPolarHBondContact O-CG2 3.47Å; A557-V561 PolarHBondContact O-N 2.84Å; V561-Y563 HydrophobicContact CB-CE2 4.41Å; V561-Y563 WeakPolarHBondContact O-CD2 3.27Å; V561-Y563 WeakPolarHBondContact O-CE2 3.4Å; V561-Y563 PolarHBondContact O-N 3.28Å
562	G	71.6	Confident	72.4	Confident	37 Å²	37	88.4 Å²	88.4	38%	0.381	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-66.6	121.1	166.5	0	0	0	0	0	110.1	K532 N560	K532-G562 WeakPolarHBondContact CG-O 3.44Å; N560-G562 PolarHBondContact O-N 2.92Å
563	Y	84	Confident	74.3	Confident	122 Å²	122	89.3 Å²	89.3	48%	0.478	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-88.9	143.2	177.2	-63.8	-94.3	0	0	0	110.6	E529 P531 R558 V561	E529-Y563 HydrophobicContact CB-CD1 4.07Å; P531-Y563 HydrophobicContact CB-CE1 4.28Å; P531-Y563 HydrophobicContact CG-CD1 4.17Å; P531-Y563 HydrophobicContact CG-CE1 3.85Å; R558-Y563 PolarHBondContact O-OH 3.28Å; V561-Y563 HydrophobicContact CB-CE2 4.41Å; V561-Y563 WeakPolarHBondContact O-CD2 3.27Å; V561-Y563 WeakPolarHBondContact O-CE2 3.4Å; V561-Y563 PolarHBondContact O-N 3.28Å
564	R	90.3	Very high	76.5	Confident	144 Å²	144	84.3 Å²	84.3	54%	0.543	43%	0.433	S	S	.	.	B	Isolated β-bridge	trans	-113.1	159.8	168.9	-66.6	-172.1	179.4	-143.4	2.7	110.3	V530 Y566	V530-R564 PolarHBondContact N-O 3.45Å; V530-R564 PolarHBondContact O-N 2.8Å; R564-Y566 VanDerWaalsContact C-N 3.31Å
565	S	91.4	Very high	78.7	Confident	60 Å²	60	78.8 Å²	78.8	42%	0.42	40%	0.404	S	S	.	.	S	Bend	trans	-88.9	2.7	178	56.6	0	0	0	0	113.9
566	Y	95.6	Very high	80.9	Confident	51 Å²	51	71.9 Å²	71.9	20%	0.2	37%	0.372	C	S	.	.	S	Bend	trans	-155.4	156.7	-177.6	65.2	-91.4	0	0	0	110.7	R564 K573 F574	R564-Y566 VanDerWaalsContact C-N 3.31Å; Y566-K573 HydrophobicContact CD1-CD 4.42Å; Y566-K573 HydrophobicContact CD2-CB 3.81Å; Y566-K573 HydrophobicContact CD2-CD 4.08Å; Y566-K573 HydrophobicContact CD2-CG 3.71Å; Y566-K573 HydrophobicContact CE1-CD 4.22Å; Y566-K573 HydrophobicContact CE2-CB 4.3Å; Y566-K573 HydrophobicContact CE2-CD 3.88Å; Y566-K573 HydrophobicContact CE2-CG 3.66Å; Y566-K573 HydrophobicContact CG-CB 4.19Å; Y566-K573 HydrophobicContact CG-CD 4.35Å; Y566-K573 HydrophobicContact CG-CG 4.33Å; Y566-F574 WeakPolarHBondContact CA-O 3.39Å
567	L	96.2	Very high	83.3	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	137.5	169.8	-173.2	72.7	0	0	0	108.8	V530 F534 Q535 V538 F574 L581 L584 L651	V530-L567 HydrophobicContact CG1-CB 4.33Å; V530-L567 HydrophobicContact CG1-CD1 3.8Å; V530-L567 HydrophobicContact CG2-CB 4.47Å; F534-L567 HydrophobicContact CB-CD1 4.28Å; Q535-L567 HydrophobicContact CB-CD1 4.38Å; V538-L567 HydrophobicContact CG2-CD1 4Å; V538-L567 HydrophobicContact CG2-CD2 3.85Å; V538-L567 HydrophobicContact CG2-CG 4.09Å; L567-F574 HydrophobicContact CB-CB 4.37Å; L567-F574 PolarHBondContact N-O 2.96Å; L567-F574 PolarHBondContact O-N 3.31Å; L567-L581 HydrophobicContact CD2-CD2 4.31Å; L567-L584 HydrophobicContact CD2-CD2 4.12Å; L567-L651 HydrophobicContact CD2-CD1 3.98Å; L567-L651 HydrophobicContact CD2-CD2 3.64Å; L567-L651 HydrophobicContact CD2-CG 4.47Å
568	S	95	Very high	85.4	Confident	33 Å²	33	68.5 Å²	68.5	23%	0.231	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127	-179.8	-175	0	0	0	0	110.5	Q535 V538 E572	Q535-S568 PolarHBondContact NE2-O 2.77Å; V538-S568 WeakPolarHBondContact CG1-O 3.43Å; S568-E572 CarbonylContact C-O 3.6Å; S568-E572 WeakPolarHBondContact CA-O 3.39Å
569	K	94.4	Very high	87.5	Confident	21 Å²	21	62.2 Å²	62.2	9%	0.091	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	120.5	174	178.2	172	-179.3	-98.7	0	109.7	V538 E542 G571 E572 F574 L651 S654 F655	V538-K569 HydrophobicContact CG1-CB 3.94Å; V538-K569 HydrophobicContact CG1-CG 4.09Å; E542-K569 VanDerWaalsContact OE1-CA 3.26Å; E542-K569 WeakPolarHBondContact OE1-CA 3.35Å; K569-G571 PolarHBondContact O-N 3.35Å; K569-E572 PolarHBondContact N-O 2.82Å; K569-E572 WeakPolarHBondContact O-CB 3.34Å; K569-E572 PolarHBondContact O-N 3.35Å; K569-F574 HydrophobicContact CB-CD2 4.11Å; K569-F574 HydrophobicContact CB-CE2 3.9Å; K569-L651 HydrophobicContact CD-CD1 4.44Å; K569-S654 WeakPolarHBondContact CE-OG 3.46Å; K569-S654 VanDerWaalsContact NZ-CB 3.27Å; K569-S654 PolarHBondContact NZ-O 3.48Å; K569-S654 PolarHBondContact NZ-OG 2.83Å; K569-F655 HydrophobicContact CD-CE2 3.92Å; K569-F655 HydrophobicContact CD-CZ 3.77Å
570	K	89.2	Confident	89.6	Confident	171 Å²	171	53.5 Å²	53.5	74%	0.743	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	37.9	-176.2	-61.6	-174.7	175.3	-175.8	0	113	E542 E572	E542-K570 PolarHBondContact OE1-N 3.24Å; K570-E572 PolarHBondContact O-N 2.91Å
571	G	88.1	Confident	91.8	Very high	64 Å²	64	47 Å²	47	66%	0.66	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.4	-12.1	-175.6	0	0	0	0	0	115.5	K569	K569-G571 PolarHBondContact O-N 3.35Å
572	E	94.2	Very high	93.4	Very high	81 Å²	81	47.3 Å²	47.3	38%	0.379	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	137	176	-170.2	-172.1	157.9	0	0	111.1	S568 K569 K570 F574 R647 T741	S568-E572 CarbonylContact C-O 3.6Å; S568-E572 WeakPolarHBondContact CA-O 3.39Å; K569-E572 PolarHBondContact N-O 2.82Å; K569-E572 WeakPolarHBondContact O-CB 3.34Å; K569-E572 PolarHBondContact O-N 3.35Å; K570-E572 PolarHBondContact O-N 2.91Å; E572-F574 HydrophobicContact CB-CE2 3.91Å; E572-F574 VanDerWaalsContact CD-CZ 3.42Å; E572-F574 HydrophobicContact CG-CD2 4.43Å; E572-F574 HydrophobicContact CG-CE2 3.86Å; E572-F574 HydrophobicContact CG-CZ 4.23Å; E572-F574 VanDerWaalsContact OE1-CZ 3.31Å; E572-F574 WeakPolarHBondContact OE1-CZ 3.38Å; E572-F574 WeakPolarHBondContact OE2-CZ 3.39Å; E572-R647 IonicContact OE1-CZ 2.86Å; E572-R647 VanDerWaalsContact OE1-CZ 3.28Å; E572-R647 IonicContact OE1-NH1 3.47Å; E572-R647 PolarHBondContact OE1-NH1 3.03Å; E572-R647 IonicContact OE1-NH2 2.83Å; E572-R647 PolarHBondContact OE1-NH2 3.46Å; E572-T741 WeakPolarHBondContact OE1-CG2 3.32Å
573	K	95.2	Very high	94.7	Very high	124 Å²	124	45.5 Å²	45.5	54%	0.539	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	118.4	179	-59.1	-177.5	-177.2	171.8	0	111	Y566 R647	Y566-K573 HydrophobicContact CD1-CD 4.42Å; Y566-K573 HydrophobicContact CD2-CB 3.81Å; Y566-K573 HydrophobicContact CD2-CD 4.08Å; Y566-K573 HydrophobicContact CD2-CG 3.71Å; Y566-K573 HydrophobicContact CE1-CD 4.22Å; Y566-K573 HydrophobicContact CE2-CB 4.3Å; Y566-K573 HydrophobicContact CE2-CD 3.88Å; Y566-K573 HydrophobicContact CE2-CG 3.66Å; Y566-K573 HydrophobicContact CG-CB 4.19Å; Y566-K573 HydrophobicContact CG-CD 4.35Å; Y566-K573 HydrophobicContact CG-CG 4.33Å; K573-R647 PolarHBondContact O-NH2 3.4Å
574	F	98.2	Very high	95.3	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.018	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	108.5	174.9	-72.7	-90.9	0	0	0	110.4	Y566 L567 K569 E572 I576 Q650 L651	Y566-F574 WeakPolarHBondContact CA-O 3.39Å; L567-F574 HydrophobicContact CB-CB 4.37Å; L567-F574 PolarHBondContact N-O 2.96Å; L567-F574 PolarHBondContact O-N 3.31Å; K569-F574 HydrophobicContact CB-CD2 4.11Å; K569-F574 HydrophobicContact CB-CE2 3.9Å; E572-F574 HydrophobicContact CB-CE2 3.91Å; E572-F574 VanDerWaalsContact CD-CZ 3.42Å; E572-F574 HydrophobicContact CG-CD2 4.43Å; E572-F574 HydrophobicContact CG-CE2 3.86Å; E572-F574 HydrophobicContact CG-CZ 4.23Å; E572-F574 VanDerWaalsContact OE1-CZ 3.31Å; E572-F574 WeakPolarHBondContact OE1-CZ 3.38Å; E572-F574 WeakPolarHBondContact OE2-CZ 3.39Å; F574-I576 HydrophobicContact CB-CG2 4.06Å; F574-Q650 HydrophobicContact CE1-CB 4.35Å; F574-L651 HydrophobicContact CB-CD1 4.21Å; F574-L651 HydrophobicContact CD1-CB 3.61Å; F574-L651 HydrophobicContact CD1-CD1 3.92Å; F574-L651 HydrophobicContact CD1-CG 4.34Å; F574-L651 HydrophobicContact CD2-CD1 3.99Å; F574-L651 HydrophobicContact CE1-CB 4.04Å; F574-L651 HydrophobicContact CE1-CD1 4.28Å; F574-L651 HydrophobicContact CE2-CD1 4.36Å; F574-L651 HydrophobicContact CG-CB 4.22Å; F574-L651 HydrophobicContact CG-CD1 3.76Å; F574-L651 HydrophobicContact CG-CG 4.5Å; F574-L651 HydrophobicContact CZ-CD1 4.5Å
575	V	98.1	Very high	95.6	Very high	11 Å²	11	33.7 Å²	33.7	7%	0.067	19%	0.187	C	C	.	.			trans	-96.6	104.4	174.9	-178.7	0	0	0	0	108	R527 L644 R647 I739	R527-V575 HydrophobicContact CG-CG1 3.85Å; V575-L644 HydrophobicContact CG1-CD2 3.83Å; V575-R647 WeakPolarHBondContact O-CB 3.49Å; V575-I739 HydrophobicContact CB-CG2 4.17Å; V575-I739 HydrophobicContact CG1-CB 4.42Å; V575-I739 HydrophobicContact CG1-CG1 4.14Å; V575-I739 HydrophobicContact CG1-CG2 4.18Å
576	I	98.4	Very high	95.8	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.01	17%	0.167	C	C	.	.			trans	-130	176.1	-164.5	58.5	162.5	0	0	0	112.5	A528 F574 A580 L581 R647 S648 L651	A528-I576 VanDerWaalsContact CB-O 3.27Å; A528-I576 WeakPolarHBondContact CB-O 3.4Å; A528-I576 PolarHBondContact N-O 2.86Å; F574-I576 HydrophobicContact CB-CG2 4.06Å; I576-A580 HydrophobicContact CB-CB 4.31Å; I576-A580 HydrophobicContact CD1-CB 3.88Å; I576-L581 HydrophobicContact CD1-CD2 3.41Å; I576-L581 VanDerWaalsContact CD1-CD2 3.41Å; I576-L581 HydrophobicContact CD1-CG 3.75Å; I576-L581 HydrophobicContact CG1-CD2 4.31Å; I576-L581 HydrophobicContact CG1-CG 4.49Å; I576-R647 HydrophobicContact CG2-CB 4.21Å; I576-S648 WeakPolarHBondContact CA-OG 3.45Å; I576-S648 WeakPolarHBondContact CB-OG 3.44Å; I576-L651 HydrophobicContact CD1-CD2 3.43Å; I576-L651 VanDerWaalsContact CD1-CD2 3.43Å; I576-L651 HydrophobicContact CG2-CB 4.39Å; I576-L651 HydrophobicContact CG2-CD2 4.31Å
577	V	98	Very high	95.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.158	C	C	.	.			trans	-91.4	161.3	173.8	-58.3	0	0	0	0	111.8	E523 W525 T579 A580 L644 S648	E523-V577 HydrophobicContact CG-CB 4.29Å; E523-V577 HydrophobicContact CG-CG2 4.38Å; W525-V577 HydrophobicContact CE3-CG1 4.07Å; V577-T579 VanDerWaalsContact C-N 3.34Å; V577-T579 WeakPolarHBondContact CG2-OG1 3.36Å; V577-T579 PolarHBondContact O-N 3.4Å; V577-A580 HydrophobicContact CG2-CB 4.2Å; V577-A580 WeakPolarHBondContact O-CB 3.31Å; V577-A580 PolarHBondContact O-N 3.49Å; V577-L644 HydrophobicContact CG1-CB 3.89Å; V577-S648 PolarHBondContact N-OG 3.43Å; V577-S648 VanDerWaalsContact N-OG 3.16Å
578	G	95.9	Very high	95.9	Very high	27 Å²	27	28.5 Å²	28.5	28%	0.278	16%	0.158	S	C	.	.	H	α-helix	trans	-64.7	-38.7	-173.1	0	0	0	0	0	112.6	E523 A580 L581 I582	E523-G578 PolarHBondContact OE2-N 3.42Å; E523-G578 VanDerWaalsContact OE2-N 3.15Å; G578-A580 PolarHBondContact O-N 2.84Å; G578-L581 WeakPolarHBondContact O-CB 3.35Å; G578-L581 PolarHBondContact O-N 2.98Å; G578-L581 VanDerWaalsContact O-N 3.11Å; G578-I582 PolarHBondContact O-N 3.41Å
579	T	97	Very high	95.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-57	-33.3	174.7	45.3	0	0	0	0	114.1	I519 I520 E523 V577 L581 I582 L583	I519-T579 VanDerWaalsContact C-CG2 3.5Å; I519-T579 HydrophobicContact CB-CG2 4.11Å; I519-T579 HydrophobicContact CG2-CG2 3.42Å; I519-T579 VanDerWaalsContact CG2-CG2 3.42Å; I519-T579 VanDerWaalsContact O-CG2 3.31Å; I519-T579 WeakPolarHBondContact O-CG2 3.38Å; I520-T579 HydrophobicContact CB-CG2 4.31Å; E523-T579 HydrophobicContact CB-CG2 3.79Å; E523-T579 HydrophobicContact CG-CG2 3.95Å; E523-T579 WeakPolarHBondContact OE2-CB 3.35Å; E523-T579 WeakPolarHBondContact OE2-CG2 3.35Å; E523-T579 PolarHBondContact OE2-N 3.48Å; E523-T579 PolarHBondContact OE2-OG1 3.29Å; V577-T579 VanDerWaalsContact C-N 3.34Å; V577-T579 WeakPolarHBondContact CG2-OG1 3.36Å; V577-T579 PolarHBondContact O-N 3.4Å; T579-L581 VanDerWaalsContact C-N 3.35Å; T579-I582 PolarHBondContact O-N 3.27Å; T579-L583 WeakPolarHBondContact O-CB 3.36Å; T579-L583 PolarHBondContact O-N 2.95Å
580	A	98.2	Very high	96	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-68	-36.2	178	0	0	0	0	0	111.7	I576 V577 G578 L583 L584	I576-A580 HydrophobicContact CB-CB 4.31Å; I576-A580 HydrophobicContact CD1-CB 3.88Å; V577-A580 HydrophobicContact CG2-CB 4.2Å; V577-A580 WeakPolarHBondContact O-CB 3.31Å; V577-A580 PolarHBondContact O-N 3.49Å; G578-A580 PolarHBondContact O-N 2.84Å; A580-L583 PolarHBondContact O-N 2.77Å; A580-L584 WeakPolarHBondContact O-CB 3.16Å; A580-L584 PolarHBondContact O-N 3.36Å
581	L	96.6	Very high	96.3	Very high	6 Å²	6	19.3 Å²	19.3	3%	0.031	11%	0.114	C	C	.	.	H	α-helix	trans	-63.4	-45.9	172.7	-62.5	174.2	0	0	0	110.9	A528 V530 F534 L567 I576 G578 T579 L583 L584 Q585	A528-L581 HydrophobicContact CB-CD1 4.02Å; V530-L581 HydrophobicContact CG1-CD2 4.29Å; V530-L581 HydrophobicContact CG2-CD1 4.21Å; V530-L581 HydrophobicContact CG2-CD2 4.4Å; F534-L581 HydrophobicContact CB-CD2 4.1Å; F534-L581 HydrophobicContact CD1-CB 3.77Å; F534-L581 HydrophobicContact CD1-CD2 4.26Å; F534-L581 HydrophobicContact CD2-CB 4.49Å; F534-L581 HydrophobicContact CD2-CD1 4.31Å; F534-L581 HydrophobicContact CE1-CB 3.68Å; F534-L581 VanDerWaalsContact CE1-O 3.27Å; F534-L581 WeakPolarHBondContact CE1-O 3.49Å; F534-L581 HydrophobicContact CE2-CB 4.41Å; F534-L581 HydrophobicContact CE2-CD1 4.5Å; F534-L581 HydrophobicContact CG-CB 4.19Å; F534-L581 HydrophobicContact CG-CD1 4.48Å; F534-L581 HydrophobicContact CG-CD2 4.13Å; F534-L581 HydrophobicContact CZ-CB 4.01Å; L567-L581 HydrophobicContact CD2-CD2 4.31Å; I576-L581 HydrophobicContact CD1-CD2 3.41Å; I576-L581 VanDerWaalsContact CD1-CD2 3.41Å; I576-L581 HydrophobicContact CD1-CG 3.75Å; I576-L581 HydrophobicContact CG1-CD2 4.31Å; I576-L581 HydrophobicContact CG1-CG 4.49Å; G578-L581 WeakPolarHBondContact O-CB 3.35Å; G578-L581 PolarHBondContact O-N 2.98Å; G578-L581 VanDerWaalsContact O-N 3.11Å; T579-L581 VanDerWaalsContact C-N 3.35Å; L581-L583 VanDerWaalsContact C-N 3.34Å; L581-L583 PolarHBondContact O-N 2.85Å; L581-L584 PolarHBondContact O-N 3.01Å; L581-Q585 PolarHBondContact O-N 3.1Å
582	I	96.1	Very high	96.5	Very high	35 Å²	35	19.1 Å²	19.1	18%	0.179	10%	0.096	C	C	.	.	H	α-helix	trans	-64.8	-40	178.7	-57.7	-59.6	0	0	0	111.1	I519 F534 G578 T579 Q585 I586	I519-I582 HydrophobicContact CD1-CG1 4.4Å; I519-I582 HydrophobicContact CD1-CG2 3.88Å; F534-I582 HydrophobicContact CZ-CD1 4.03Å; G578-I582 PolarHBondContact O-N 3.41Å; T579-I582 PolarHBondContact O-N 3.27Å; I582-Q585 WeakPolarHBondContact O-CB 3.05Å; I582-Q585 PolarHBondContact O-N 2.76Å; I582-I586 HydrophobicContact CG2-CD1 4.04Å; I582-I586 HydrophobicContact CG2-CG1 4.48Å; I582-I586 VanDerWaalsContact O-CG1 3.3Å; I582-I586 WeakPolarHBondContact O-CG1 3.27Å; I582-I586 PolarHBondContact O-N 2.82Å
583	L	98.1	Very high	96.5	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-60.9	-46.8	174.1	177.3	60.8	0	0	0	111.1	L516 T579 A580 L581 Q585 I586 M587 L612 Y615 I652	L516-L583 HydrophobicContact CD1-CB 4.22Å; L516-L583 HydrophobicContact CD1-CD1 4.34Å; L516-L583 HydrophobicContact CD2-CD1 3.86Å; T579-L583 WeakPolarHBondContact O-CB 3.36Å; T579-L583 PolarHBondContact O-N 2.95Å; A580-L583 PolarHBondContact O-N 2.77Å; L581-L583 VanDerWaalsContact C-N 3.34Å; L581-L583 PolarHBondContact O-N 2.85Å; L583-Q585 VanDerWaalsContact C-N 3.28Å; L583-Q585 PolarHBondContact O-N 3.27Å; L583-I586 PolarHBondContact O-N 3.46Å; L583-I586 VanDerWaalsContact O-N 3.13Å; L583-M587 HydrophobicContact CD1-CE 3.94Å; L583-M587 HydrophobicContact CD1-CG 4.27Å; L583-M587 HydrophobicContact CD1-SD 4.49Å; L583-M587 HydrophobicContact CG-CG 4.44Å; L583-M587 WeakPolarHBondContact O-CG 3.31Å; L583-M587 PolarHBondContact O-N 3.35Å; L583-L612 HydrophobicContact CD2-CD2 4.44Å; L583-Y615 HydrophobicContact CD2-CD1 3.55Å; L583-Y615 HydrophobicContact CD2-CD2 3.74Å; L583-Y615 HydrophobicContact CD2-CE1 4.06Å; L583-Y615 HydrophobicContact CD2-CE2 4.24Å; L583-Y615 HydrophobicContact CD2-CG 3.38Å; L583-I652 HydrophobicContact CB-CD1 4.24Å; L583-I652 HydrophobicContact CD2-CD1 3.8Å; L583-I652 HydrophobicContact CD2-CG1 3.91Å; L583-I652 HydrophobicContact CD2-CG2 4.1Å; L583-I652 HydrophobicContact CG-CD1 3.95Å
584	L	97.6	Very high	96.4	Very high	1 Å²	1	9.6 Å²	9.6	1%	0.005	5%	0.054	C	C	.	.	H	α-helix	trans	-57	-43	176.7	179.9	62.9	0	0	0	111.6	V538 L547 L567 A580 L581 M587 A588 I652 F655	V538-L584 HydrophobicContact CG2-CD2 4.11Å; L547-L584 HydrophobicContact CD1-CD1 4.36Å; L547-L584 HydrophobicContact CD2-CD1 4.03Å; L567-L584 HydrophobicContact CD2-CD2 4.12Å; A580-L584 WeakPolarHBondContact O-CB 3.16Å; A580-L584 PolarHBondContact O-N 3.36Å; L581-L584 PolarHBondContact O-N 3.01Å; L584-M587 PolarHBondContact O-N 3.46Å; L584-A588 PolarHBondContact O-N 3.39Å; L584-I652 HydrophobicContact CB-CD1 4.36Å; L584-F655 HydrophobicContact CD1-CD1 4.37Å; L584-F655 HydrophobicContact CD1-CD2 3.71Å; L584-F655 HydrophobicContact CD1-CE1 4.26Å; L584-F655 HydrophobicContact CD1-CE2 3.6Å; L584-F655 HydrophobicContact CD1-CG 4.11Å; L584-F655 HydrophobicContact CD1-CZ 3.89Å; L584-F655 HydrophobicContact CD2-CE2 4.23Å; L584-F655 HydrophobicContact CD2-CZ 4.39Å
585	Q	95.9	Very high	96	Very high	17 Å²	17	11.8 Å²	11.8	8%	0.079	6%	0.064	C	C	.	.	H	α-helix	trans	-61.5	-45.7	175	-174.4	179.9	30.4	0	0	112.2	F534 I537 D549 L581 I582 L583 M587 A588 Q589	F534-Q585 HydrophobicContact CE1-CB 4.04Å; I537-Q585 HydrophobicContact CD1-CG 4.47Å; D549-Q585 VanDerWaalsContact OD1-CG 3.31Å; D549-Q585 WeakPolarHBondContact OD1-CG 3.5Å; D549-Q585 PolarHBondContact OD1-NE2 3.44Å; D549-Q585 PolarHBondContact OD2-NE2 2.67Å; L581-Q585 PolarHBondContact O-N 3.1Å; I582-Q585 WeakPolarHBondContact O-CB 3.05Å; I582-Q585 PolarHBondContact O-N 2.76Å; L583-Q585 VanDerWaalsContact C-N 3.28Å; L583-Q585 PolarHBondContact O-N 3.27Å; Q585-M587 VanDerWaalsContact C-N 3.29Å; Q585-M587 PolarHBondContact O-N 2.98Å; Q585-A588 WeakPolarHBondContact O-CB 3.4Å; Q585-A588 PolarHBondContact O-N 2.99Å; Q585-A588 VanDerWaalsContact O-N 3.15Å; Q585-Q589 WeakPolarHBondContact O-CG 3.39Å; Q585-Q589 PolarHBondContact O-N 2.83Å
586	I	96.9	Very high	95.5	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59.6	-43.3	176.4	-68	168.3	0	0	0	110	K512 L516 I582 L583 A588 Q589 Y590 L611	K512-I586 HydrophobicContact CB-CD1 4.41Å; K512-I586 HydrophobicContact CB-CG2 3.83Å; K512-I586 HydrophobicContact CD-CG1 4.38Å; K512-I586 HydrophobicContact CD-CG2 4.5Å; K512-I586 HydrophobicContact CG-CG2 3.95Å; L516-I586 HydrophobicContact CB-CD1 4.21Å; I582-I586 HydrophobicContact CG2-CD1 4.04Å; I582-I586 HydrophobicContact CG2-CG1 4.48Å; I582-I586 VanDerWaalsContact O-CG1 3.3Å; I582-I586 WeakPolarHBondContact O-CG1 3.27Å; I582-I586 PolarHBondContact O-N 2.82Å; L583-I586 PolarHBondContact O-N 3.46Å; L583-I586 VanDerWaalsContact O-N 3.13Å; I586-A588 VanDerWaalsContact C-N 3.3Å; I586-A588 PolarHBondContact O-N 2.94Å; I586-Q589 WeakPolarHBondContact O-CB 3.44Å; I586-Q589 PolarHBondContact O-N 3.07Å; I586-Y590 HydrophobicContact CG2-CD2 3.97Å; I586-Y590 HydrophobicContact CG2-CE2 3.96Å; I586-Y590 WeakPolarHBondContact O-CD2 3.49Å; I586-Y590 PolarHBondContact O-N 3.29Å; I586-L611 HydrophobicContact CG2-CD1 3.83Å
587	M	97.6	Very high	94.9	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-62.2	-37.5	176.3	-64.4	-58.8	93.2	0	0	112.3	L547 L583 L584 Q585 Y590 C591 M608 L611 L612 F659	L547-M587 HydrophobicContact CD2-CB 4.41Å; L583-M587 HydrophobicContact CD1-CE 3.94Å; L583-M587 HydrophobicContact CD1-CG 4.27Å; L583-M587 HydrophobicContact CD1-SD 4.49Å; L583-M587 HydrophobicContact CG-CG 4.44Å; L583-M587 WeakPolarHBondContact O-CG 3.31Å; L583-M587 PolarHBondContact O-N 3.35Å; L584-M587 PolarHBondContact O-N 3.46Å; Q585-M587 VanDerWaalsContact C-N 3.29Å; Q585-M587 PolarHBondContact O-N 2.98Å; M587-Y590 HydrophobicContact CE-CD2 4.16Å; M587-Y590 PolarHBondContact O-N 3.16Å; M587-C591 PolarHBondContact O-N 3.07Å; M587-C591 PolarHBondContact O-SG 3.35Å; M587-M608 HydrophobicContact CB-CE 4.11Å; M587-M608 HydrophobicContact CE-CG 4.22Å; M587-M608 HydrophobicContact CG-CE 4.33Å; M587-M608 HydrophobicContact SD-CE 3.51Å; M587-M608 VanDerWaalsContact SD-CE 3.51Å; M587-M608 HydrophobicContact SD-CG 3.84Å; M587-L611 HydrophobicContact CE-CB 4.13Å; M587-L611 HydrophobicContact CE-CD1 4.13Å; M587-L612 HydrophobicContact CG-CD2 4.14Å; M587-L612 HydrophobicContact SD-CD1 3.93Å; M587-L612 HydrophobicContact SD-CD2 3.59Å; M587-L612 VanDerWaalsContact SD-CD2 3.59Å; M587-L612 HydrophobicContact SD-CG 3.61Å; M587-F659 HydrophobicContact CB-CE1 4.11Å; M587-F659 HydrophobicContact CB-CE2 4.25Å; M587-F659 HydrophobicContact CB-CZ 3.58Å; M587-F659 HydrophobicContact CG-CE2 4.06Å; M587-F659 HydrophobicContact CG-CZ 3.88Å; M587-F659 HydrophobicContact SD-CE2 4.29Å
588	A	96.3	Very high	94.4	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-63.5	-39.9	174.3	0	0	0	0	0	112.3	I537 L547 D549 L584 Q585 I586 C591 Q592	I537-A588 HydrophobicContact CG2-CB 4.43Å; L547-A588 HydrophobicContact CD2-CB 4.09Å; L547-A588 HydrophobicContact CG-CB 3.79Å; D549-A588 HydrophobicContact CB-CB 4.27Å; L584-A588 PolarHBondContact O-N 3.39Å; Q585-A588 WeakPolarHBondContact O-CB 3.4Å; Q585-A588 PolarHBondContact O-N 2.99Å; Q585-A588 VanDerWaalsContact O-N 3.15Å; I586-A588 VanDerWaalsContact C-N 3.3Å; I586-A588 PolarHBondContact O-N 2.94Å; A588-C591 PolarHBondContact O-N 3.31Å; A588-Q592 WeakPolarHBondContact O-CG 3.36Å; A588-Q592 PolarHBondContact O-N 3.41Å
589	Q	94.4	Very high	94	Very high	32 Å²	32	21.4 Å²	21.4	15%	0.15	11%	0.114	C	C	.	.	H	α-helix	trans	-64.1	-38.5	173.7	-65	174	15.1	0	0	111.9	F508 K512 D549 Q585 I586 L593	F508-Q589 HydrophobicContact CZ-CB 4.01Å; K512-Q589 VanDerWaalsContact NZ-OE1 3.14Å; D549-Q589 HydrophobicContact CB-CG 3.83Å; D549-Q589 VanDerWaalsContact OD2-CG 3.26Å; D549-Q589 WeakPolarHBondContact OD2-CG 3.36Å; D549-Q589 PolarHBondContact OD2-NE2 2.9Å; Q585-Q589 WeakPolarHBondContact O-CG 3.39Å; Q585-Q589 PolarHBondContact O-N 2.83Å; I586-Q589 WeakPolarHBondContact O-CB 3.44Å; I586-Q589 PolarHBondContact O-N 3.07Å; Q589-L593 WeakPolarHBondContact O-CB 3.27Å; Q589-L593 PolarHBondContact O-N 3.36Å
590	Y	96.4	Very high	93.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.5	-43.5	172.9	-91.2	-89.4	0	0	0	112.1	F508 H509 K512 I586 M587 Q592 L593 V594 L604 P607 M608 L611	F508-Y590 HydrophobicContact CD1-CE1 4.26Å; F508-Y590 HydrophobicContact CD1-CE2 4.17Å; F508-Y590 AromaticContact CD1-CZ 3.91Å; F508-Y590 HydrophobicContact CE1-CD1 4.19Å; F508-Y590 AromaticContact CE1-CD2 3.73Å; F508-Y590 HydrophobicContact CE1-CD2 3.73Å; F508-Y590 AromaticContact CE1-CE1 3.98Å; F508-Y590 HydrophobicContact CE1-CE1 3.98Å; F508-Y590 AromaticContact CE1-CE2 3.47Å; F508-Y590 HydrophobicContact CE1-CE2 3.47Å; F508-Y590 VanDerWaalsContact CE1-CE2 3.47Å; F508-Y590 HydrophobicContact CE1-CG 4.08Å; F508-Y590 AromaticContact CE1-CZ 3.63Å; F508-Y590 HydrophobicContact CZ-CD2 4.36Å; F508-Y590 HydrophobicContact CZ-CE2 4.36Å; H509-Y590 WeakPolarHBondContact CA-OH 3.44Å; H509-Y590 WeakPolarHBondContact CB-OH 3.5Å; H509-Y590 PolarHBondContact ND1-OH 3.32Å; K512-Y590 HydrophobicContact CG-CE2 4.37Å; I586-Y590 HydrophobicContact CG2-CD2 3.97Å; I586-Y590 HydrophobicContact CG2-CE2 3.96Å; I586-Y590 WeakPolarHBondContact O-CD2 3.49Å; I586-Y590 PolarHBondContact O-N 3.29Å; M587-Y590 HydrophobicContact CE-CD2 4.16Å; M587-Y590 PolarHBondContact O-N 3.16Å; Y590-Q592 PolarHBondContact O-N 2.97Å; Y590-L593 PolarHBondContact O-N 2.96Å; Y590-L593 VanDerWaalsContact O-N 3.12Å; Y590-V594 WeakPolarHBondContact O-CG2 3.42Å; Y590-V594 PolarHBondContact O-N 3.45Å; Y590-L604 HydrophobicContact CD1-CD2 4.5Å; Y590-P607 HydrophobicContact CE1-CB 4.26Å; Y590-M608 HydrophobicContact CD1-CB 3.77Å; Y590-M608 HydrophobicContact CD1-CG 4.16Å; Y590-M608 HydrophobicContact CE1-CB 4.05Å; Y590-M608 HydrophobicContact CG-CB 4.22Å; Y590-M608 HydrophobicContact CG-CG 4.1Å; Y590-M608 HydrophobicContact CG-SD 4.38Å; Y590-L611 HydrophobicContact CD2-CD1 4.36Å; Y590-L611 HydrophobicContact CE2-CD1 3.42Å; Y590-L611 VanDerWaalsContact CE2-CD1 3.42Å
591	C	96	Very high	93.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.4	-45.5	178	-65.9	0	0	0	0	111.2	L547 M587 A588 L593 V594 E595 L662	L547-C591 HydrophobicContact CB-CB 4.41Å; L547-C591 VanDerWaalsContact O-CB 3.25Å; L547-C591 WeakPolarHBondContact O-CB 3.49Å; M587-C591 PolarHBondContact O-N 3.07Å; M587-C591 PolarHBondContact O-SG 3.35Å; A588-C591 PolarHBondContact O-N 3.31Å; C591-L593 VanDerWaalsContact C-N 3.32Å; C591-L593 PolarHBondContact O-N 3.15Å; C591-V594 PolarHBondContact O-N 3.46Å; C591-E595 PolarHBondContact O-N 2.81Å; C591-E595 VanDerWaalsContact O-N 3.12Å; C591-L662 HydrophobicContact CB-CD1 4.27Å
592	Q	92.5	Very high	93.1	Very high	61 Å²	61	22.7 Å²	22.7	29%	0.285	12%	0.123	S	C	.	.	H	α-helix	trans	-57.1	-45.3	172	-75.7	174.1	-25.9	0	0	111.8	R548 D549 A588 Y590 V594 E595 M596	R548-Q592 HydrophobicContact CB-CG 4.15Å; R548-Q592 HydrophobicContact CG-CG 3.84Å; D549-Q592 PolarHBondContact O-NE2 3Å; A588-Q592 WeakPolarHBondContact O-CG 3.36Å; A588-Q592 PolarHBondContact O-N 3.41Å; Y590-Q592 PolarHBondContact O-N 2.97Å; Q592-V594 VanDerWaalsContact C-N 3.32Å; Q592-V594 PolarHBondContact O-N 2.91Å; Q592-E595 PolarHBondContact O-N 3.2Å; Q592-M596 WeakPolarHBondContact O-CB 3.42Å; Q592-M596 WeakPolarHBondContact O-CG 3.4Å; Q592-M596 PolarHBondContact O-N 3.42Å
593	L	92.1	Very high	92.9	Very high	4 Å²	4	23 Å²	23	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-63.5	-37.6	-178.5	-171.6	57.2	0	0	0	112.4	T465 F504 F508 Q589 Y590 C591 M596 L597 L604	T465-L593 HydrophobicContact CG2-CD1 3.88Å; F504-L593 HydrophobicContact CE1-CD1 3.97Å; F504-L593 HydrophobicContact CE1-CD2 4.09Å; F508-L593 HydrophobicContact CD1-CD2 3.92Å; F508-L593 HydrophobicContact CE1-CD2 3.96Å; F508-L593 HydrophobicContact CG-CD2 4.28Å; F508-L593 HydrophobicContact CZ-CD2 4.38Å; Q589-L593 WeakPolarHBondContact O-CB 3.27Å; Q589-L593 PolarHBondContact O-N 3.36Å; Y590-L593 PolarHBondContact O-N 2.96Å; Y590-L593 VanDerWaalsContact O-N 3.12Å; C591-L593 VanDerWaalsContact C-N 3.32Å; C591-L593 PolarHBondContact O-N 3.15Å; L593-M596 PolarHBondContact O-N 3.46Å; L593-L597 HydrophobicContact CD1-CD1 3.65Å; L593-L597 HydrophobicContact CD1-CG 4.23Å; L593-L597 HydrophobicContact CG-CD1 4.35Å; L593-L597 WeakPolarHBondContact O-CB 3.25Å; L593-L597 PolarHBondContact O-N 3.16Å; L593-L604 HydrophobicContact CD2-CD2 3.55Å; L593-L604 HydrophobicContact CG-CD1 4.08Å; L593-L604 HydrophobicContact CG-CD2 3.97Å
594	V	93.4	Very high	92.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.7	-43.5	175.4	175.2	0	0	0	0	111.6	Y590 C591 Q592 M596 L597 P598 L604 L662 F663 H666	Y590-V594 WeakPolarHBondContact O-CG2 3.42Å; Y590-V594 PolarHBondContact O-N 3.45Å; C591-V594 PolarHBondContact O-N 3.46Å; Q592-V594 VanDerWaalsContact C-N 3.32Å; Q592-V594 PolarHBondContact O-N 2.91Å; V594-M596 PolarHBondContact O-N 3.31Å; V594-L597 CarbonylContact O-C 3.52Å; V594-L597 PolarHBondContact O-N 3.5Å; V594-P598 WeakPolarHBondContact O-CA 3.4Å; V594-L604 HydrophobicContact CB-CD1 4.29Å; V594-L604 HydrophobicContact CG2-CB 3.96Å; V594-L604 HydrophobicContact CG2-CD1 3.65Å; V594-L604 HydrophobicContact CG2-CG 4.42Å; V594-L662 HydrophobicContact CB-CD2 3.8Å; V594-L662 HydrophobicContact CG1-CD2 3.57Å; V594-L662 HydrophobicContact CG1-CG 4.44Å; V594-L662 HydrophobicContact CG2-CD2 4.15Å; V594-F663 HydrophobicContact CG1-CE1 4.34Å; V594-F663 HydrophobicContact CG2-CE1 3.68Å; V594-F663 HydrophobicContact CG2-CE2 4.22Å; V594-F663 HydrophobicContact CG2-CZ 3.45Å; V594-F663 VanDerWaalsContact CG2-CZ 3.45Å; V594-H666 HydrophobicContact CG1-CB 4.29Å
595	E	90.8	Very high	92.7	Very high	50 Å²	50	22.9 Å²	22.9	23%	0.234	12%	0.124	C	C	.	.	H	α-helix	trans	-62.6	-33.5	176	-69.7	-168.4	-170.4	0	0	112.2	K546 C591 Q592 L662	K546-E595 VanDerWaalsContact CD-OE1 3.23Å; K546-E595 WeakPolarHBondContact CD-OE1 3.47Å; K546-E595 WeakPolarHBondContact CE-OE1 3.23Å; K546-E595 WeakPolarHBondContact CG-OE1 3.29Å; K546-E595 VanDerWaalsContact NZ-CD 3.34Å; K546-E595 IonicContact NZ-OE1 3.84Å; K546-E595 PolarHBondContact NZ-OE1 3.31Å; K546-E595 IonicContact NZ-OE2 3.15Å; K546-E595 PolarHBondContact NZ-OE2 3.3Å; C591-E595 PolarHBondContact O-N 2.81Å; C591-E595 VanDerWaalsContact O-N 3.12Å; Q592-E595 PolarHBondContact O-N 3.2Å; E595-L662 HydrophobicContact CG-CD1 4.3Å
596	M	86.6	Confident	92.6	Very high	84 Å²	84	26 Å²	26	41%	0.414	14%	0.144	S	C	.	.	H	α-helix	trans	-81.9	-25.7	-179.6	-65.5	-57.2	-85.9	0	0	113.4	V469 Q592 L593 V594 P598	V469-M596 HydrophobicContact CB-CB 4.49Å; V469-M596 HydrophobicContact CB-CE 4.47Å; V469-M596 HydrophobicContact CG1-CB 3.91Å; V469-M596 HydrophobicContact CG1-CE 3.64Å; V469-M596 HydrophobicContact CG2-CB 3.72Å; V469-M596 HydrophobicContact CG2-CG 4.49Å; Q592-M596 WeakPolarHBondContact O-CB 3.42Å; Q592-M596 WeakPolarHBondContact O-CG 3.4Å; Q592-M596 PolarHBondContact O-N 3.42Å; L593-M596 PolarHBondContact O-N 3.46Å; V594-M596 PolarHBondContact O-N 3.31Å; M596-P598 VanDerWaalsContact C-CD 3.49Å
597	L	87	Confident	92.6	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.021	15%	0.147	C	C	.	.			trans	-130.1	60.1	-177.5	-63.3	179.4	0	0	0	111.8	V469 T472 V501 L593 V594 T599 Y600	V469-L597 HydrophobicContact CG2-CD2 4.2Å; V469-L597 HydrophobicContact CG2-CG 4.17Å; T472-L597 HydrophobicContact CG2-CD2 3.84Å; V501-L597 HydrophobicContact CG1-CD1 4.27Å; L593-L597 HydrophobicContact CD1-CD1 3.65Å; L593-L597 HydrophobicContact CD1-CG 4.23Å; L593-L597 HydrophobicContact CG-CD1 4.35Å; L593-L597 WeakPolarHBondContact O-CB 3.25Å; L593-L597 PolarHBondContact O-N 3.16Å; V594-L597 CarbonylContact O-C 3.52Å; V594-L597 PolarHBondContact O-N 3.5Å; L597-T599 VanDerWaalsContact C-N 3.28Å; L597-T599 PolarHBondContact O-N 3.01Å; L597-Y600 HydrophobicContact CB-CD2 4.03Å; L597-Y600 HydrophobicContact CD2-CD2 4.45Å; L597-Y600 PolarHBondContact O-N 3.48Å
598	P	87.9	Confident	92.6	Very high	55 Å²	55	26.4 Å²	26.4	36%	0.357	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-62.1	-33.4	-171.4	25.8	-36.4	0	0	0	113.4	V594 M596 Y600 S601	V594-P598 WeakPolarHBondContact O-CA 3.4Å; M596-P598 VanDerWaalsContact C-CD 3.49Å; P598-Y600 PolarHBondContact O-N 3.36Å; P598-Y600 VanDerWaalsContact O-N 3.15Å; P598-S601 VanDerWaalsContact O-CB 3.31Å; P598-S601 WeakPolarHBondContact O-CB 3.36Å; P598-S601 PolarHBondContact O-N 2.92Å; P598-S601 PolarHBondContact O-OG 3.45Å
599	T	85.7	Confident	92.7	Very high	99 Å²	99	26.9 Å²	26.9	61%	0.607	15%	0.15	S	C	*	.	G	3₁₀ helix	trans	-58.4	-26.3	176.2	-46.6	0	0	0	0	113	L597	L597-T599 VanDerWaalsContact C-N 3.28Å; L597-T599 PolarHBondContact O-N 3.01Å
600	Y	88.9	Confident	92.9	Very high	15 Å²	15	28 Å²	28	6%	0.059	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-106.1	15.1	-174.9	-55.3	-87	0	0	0	112.5	T472 F498 V501 L597 P598 A602 N603 L604	T472-Y600 HydrophobicContact CG2-CE2 3.83Å; F498-Y600 HydrophobicContact CB-CE1 4.31Å; F498-Y600 HydrophobicContact CD2-CD1 4.03Å; F498-Y600 AromaticContact CD2-CE1 3.58Å; F498-Y600 HydrophobicContact CD2-CE1 3.58Å; F498-Y600 HydrophobicContact CE2-CD1 4.28Å; F498-Y600 HydrophobicContact CE2-CE1 4.28Å; F498-Y600 HydrophobicContact CG-CE1 4.3Å; V501-Y600 HydrophobicContact CB-CD1 4.05Å; V501-Y600 HydrophobicContact CB-CE1 3.73Å; V501-Y600 HydrophobicContact CB-CE2 4.44Å; V501-Y600 HydrophobicContact CG1-CD1 3.49Å; V501-Y600 VanDerWaalsContact CG1-CD1 3.49Å; V501-Y600 HydrophobicContact CG1-CD2 3.83Å; V501-Y600 HydrophobicContact CG1-CE1 3.68Å; V501-Y600 HydrophobicContact CG1-CE2 4.03Å; V501-Y600 HydrophobicContact CG1-CG 3.56Å; V501-Y600 HydrophobicContact CG2-CE1 4Å; V501-Y600 HydrophobicContact CG2-CE2 4.05Å; L597-Y600 HydrophobicContact CB-CD2 4.03Å; L597-Y600 HydrophobicContact CD2-CD2 4.45Å; L597-Y600 PolarHBondContact O-N 3.48Å; P598-Y600 PolarHBondContact O-N 3.36Å; P598-Y600 VanDerWaalsContact O-N 3.15Å; Y600-A602 PolarHBondContact O-N 2.93Å; Y600-N603 WeakPolarHBondContact O-CB 3.24Å; Y600-N603 PolarHBondContact O-N 3.03Å; Y600-L604 PolarHBondContact O-N 3.36Å; Y600-L604 VanDerWaalsContact O-N 3.1Å
601	S	92.5	Very high	93	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-52.4	-41.6	179.5	59.3	0	0	0	0	112.3	P598 N603 L604 L605 F663 H666	P598-S601 VanDerWaalsContact O-CB 3.31Å; P598-S601 WeakPolarHBondContact O-CB 3.36Å; P598-S601 PolarHBondContact O-N 2.92Å; P598-S601 PolarHBondContact O-OG 3.45Å; S601-N603 VanDerWaalsContact C-N 3.32Å; S601-N603 PolarHBondContact O-N 3.36Å; S601-L604 PolarHBondContact O-N 2.94Å; S601-L604 VanDerWaalsContact O-N 3.14Å; S601-L605 PolarHBondContact O-N 2.9Å; S601-F663 WeakPolarHBondContact O-CE1 3.5Å; S601-H666 PolarHBondContact OG-O 3.3Å
602	A	92	Very high	93.1	Very high	19 Å²	19	28 Å²	28	16%	0.157	16%	0.157	C	C	.	.	H	α-helix	trans	-61.7	-38.8	176.7	0	0	0	0	0	112.8	Y600 L604 L667 L674	Y600-A602 PolarHBondContact O-N 2.93Å; A602-L604 VanDerWaalsContact C-N 3.3Å; A602-L604 PolarHBondContact O-N 3.43Å; A602-L667 HydrophobicContact CB-CD2 3.95Å; A602-L674 HydrophobicContact CB-CD1 4.48Å
603	N	91.7	Very high	93.4	Very high	40 Å²	40	29.3 Å²	29.3	21%	0.214	16%	0.161	C	C	.	.	H	α-helix	trans	-72.1	-23.2	177.8	-54.3	83.3	0	0	0	112.3	E502 I505 Y600 S601 P607	E502-N603 PolarHBondContact OE1-ND2 3.37Å; I505-N603 HydrophobicContact CD1-CB 4Å; Y600-N603 WeakPolarHBondContact O-CB 3.24Å; Y600-N603 PolarHBondContact O-N 3.03Å; S601-N603 VanDerWaalsContact C-N 3.32Å; S601-N603 PolarHBondContact O-N 3.36Å; N603-P607 WeakPolarHBondContact O-CD 3.45Å; N603-P607 VanDerWaalsContact O-CG 3.25Å; N603-P607 WeakPolarHBondContact O-CG 3.4Å
604	L	95.6	Very high	93.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-87.9	-28.5	177.6	-71.6	168.5	0	0	0	113.6	I505 Y590 L593 V594 Y600 S601 A602 P607 M608 F663	I505-L604 HydrophobicContact CB-CD2 4.45Å; I505-L604 HydrophobicContact CD1-CD2 3.88Å; I505-L604 HydrophobicContact CD1-CG 3.96Å; I505-L604 HydrophobicContact CG1-CD2 3.78Å; I505-L604 HydrophobicContact CG1-CG 4.42Å; I505-L604 HydrophobicContact CG2-CD2 3.88Å; Y590-L604 HydrophobicContact CD1-CD2 4.5Å; L593-L604 HydrophobicContact CD2-CD2 3.55Å; L593-L604 HydrophobicContact CG-CD1 4.08Å; L593-L604 HydrophobicContact CG-CD2 3.97Å; V594-L604 HydrophobicContact CB-CD1 4.29Å; V594-L604 HydrophobicContact CG2-CB 3.96Å; V594-L604 HydrophobicContact CG2-CD1 3.65Å; V594-L604 HydrophobicContact CG2-CG 4.42Å; Y600-L604 PolarHBondContact O-N 3.36Å; Y600-L604 VanDerWaalsContact O-N 3.1Å; S601-L604 PolarHBondContact O-N 2.94Å; S601-L604 VanDerWaalsContact O-N 3.14Å; A602-L604 VanDerWaalsContact C-N 3.3Å; A602-L604 PolarHBondContact O-N 3.43Å; L604-P607 WeakPolarHBondContact O-CD 3.37Å; L604-M608 WeakPolarHBondContact O-CB 3.38Å; L604-M608 PolarHBondContact O-N 3.34Å; L604-M608 VanDerWaalsContact O-N 3.13Å; L604-F663 HydrophobicContact CB-CE1 4.17Å; L604-F663 HydrophobicContact CB-CZ 4.29Å
605	L	97.1	Very high	93.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.7	-52.9	-177.4	-175.7	153.7	0	0	0	111.7	S601 M608 V609 F663 L667 L674 H677 F678	S601-L605 PolarHBondContact O-N 2.9Å; L605-M608 PolarHBondContact O-N 2.76Å; L605-V609 HydrophobicContact CD2-CG2 3.86Å; L605-V609 HydrophobicContact CG-CG2 4.4Å; L605-V609 WeakPolarHBondContact O-CB 3.23Å; L605-V609 VanDerWaalsContact O-CG2 3.28Å; L605-V609 WeakPolarHBondContact O-CG2 3.3Å; L605-V609 PolarHBondContact O-N 2.9Å; L605-F663 HydrophobicContact CB-CD1 3.8Å; L605-F663 HydrophobicContact CB-CE1 3.62Å; L605-F663 HydrophobicContact CB-CG 4.44Å; L605-F663 HydrophobicContact CB-CZ 4.12Å; L605-F663 HydrophobicContact CD1-CB 4.15Å; L605-F663 HydrophobicContact CD1-CD1 3.97Å; L605-F663 HydrophobicContact CD1-CG 4Å; L605-F663 HydrophobicContact CG-CD1 4.23Å; L605-F663 HydrophobicContact CG-CE1 4.39Å; L605-F663 HydrophobicContact CG-CG 4.4Å; L605-L667 HydrophobicContact CD1-CD1 3.76Å; L605-L667 HydrophobicContact CD1-CD2 4.3Å; L605-L667 HydrophobicContact CD1-CG 4.5Å; L605-L674 HydrophobicContact CD1-CB 3.88Å; L605-L674 HydrophobicContact CD2-CB 4.02Å; L605-H677 HydrophobicContact CD2-CB 4.45Å; L605-F678 HydrophobicContact CD1-CE2 3.81Å; L605-F678 HydrophobicContact CG-CE2 3.88Å; L605-F678 HydrophobicContact CG-CZ 4.22Å
606	T	93.6	Very high	94.3	Very high	82 Å²	82	29.1 Å²	29.1	50%	0.503	16%	0.161	S	C	.	.	H	α-helix	trans	-62.8	-47.4	-174.8	-54.1	0	0	0	0	112.3	M608 V609 D610	T606-M608 PolarHBondContact O-N 2.86Å; T606-V609 PolarHBondContact O-N 3.32Å; T606-D610 PolarHBondContact O-N 2.72Å
607	P	96.3	Very high	94.9	Very high	10 Å²	10	28 Å²	28	7%	0.065	16%	0.162	C	C	.	.	H	α-helix	trans	-60.3	-37.9	173.4	-26.3	36.6	0	0	0	114.2	I505 H509 Y590 N603 L604 D610 L611	I505-P607 HydrophobicContact CG2-CG 4.27Å; H509-P607 HydrophobicContact CB-CB 4.01Å; H509-P607 PolarHBondContact CE1-O 2.8Å; H509-P607 WeakPolarHBondContact ND1-CB 3.5Å; H509-P607 PolarHBondContact ND1-O 3.42Å; Y590-P607 HydrophobicContact CE1-CB 4.26Å; N603-P607 WeakPolarHBondContact O-CD 3.45Å; N603-P607 VanDerWaalsContact O-CG 3.25Å; N603-P607 WeakPolarHBondContact O-CG 3.4Å; L604-P607 WeakPolarHBondContact O-CD 3.37Å; P607-D610 PolarHBondContact O-N 2.65Å; P607-L611 PolarHBondContact O-N 3.4Å
608	M	98	Very high	95.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.6	-43.9	176.5	-172.7	178.8	-178.8	0	0	111.5	M587 Y590 L604 L605 T606 D610 L611 L612 F659 F663	M587-M608 HydrophobicContact CB-CE 4.11Å; M587-M608 HydrophobicContact CE-CG 4.22Å; M587-M608 HydrophobicContact CG-CE 4.33Å; M587-M608 HydrophobicContact SD-CE 3.51Å; M587-M608 VanDerWaalsContact SD-CE 3.51Å; M587-M608 HydrophobicContact SD-CG 3.84Å; Y590-M608 HydrophobicContact CD1-CB 3.77Å; Y590-M608 HydrophobicContact CD1-CG 4.16Å; Y590-M608 HydrophobicContact CE1-CB 4.05Å; Y590-M608 HydrophobicContact CG-CB 4.22Å; Y590-M608 HydrophobicContact CG-CG 4.1Å; Y590-M608 HydrophobicContact CG-SD 4.38Å; L604-M608 WeakPolarHBondContact O-CB 3.38Å; L604-M608 PolarHBondContact O-N 3.34Å; L604-M608 VanDerWaalsContact O-N 3.13Å; L605-M608 PolarHBondContact O-N 2.76Å; T606-M608 PolarHBondContact O-N 2.86Å; M608-D610 VanDerWaalsContact C-N 3.31Å; M608-D610 PolarHBondContact O-N 2.66Å; M608-L611 PolarHBondContact O-N 2.87Å; M608-L612 PolarHBondContact O-N 3.08Å; M608-F659 HydrophobicContact CE-CB 4.06Å; M608-F659 HydrophobicContact CE-CD1 3.56Å; M608-F659 HydrophobicContact CE-CD2 3.68Å; M608-F659 HydrophobicContact CE-CE1 3.86Å; M608-F659 HydrophobicContact CE-CE2 3.98Å; M608-F659 HydrophobicContact CE-CG 3.48Å; M608-F659 VanDerWaalsContact CE-CG 3.48Å; M608-F659 HydrophobicContact CE-CZ 4.06Å; M608-F663 HydrophobicContact SD-CE2 3.57Å; M608-F663 VanDerWaalsContact SD-CE2 3.57Å; M608-F663 HydrophobicContact SD-CZ 4.06Å
609	V	98	Very high	95.9	Very high	9 Å²	9	27.7 Å²	27.7	6%	0.055	15%	0.153	C	C	.	.	H	α-helix	trans	-60.1	-41.3	174.8	165.1	0	0	0	0	111	L605 T606 L611 L612 K613 H677 F678 L681	L605-V609 HydrophobicContact CD2-CG2 3.86Å; L605-V609 HydrophobicContact CG-CG2 4.4Å; L605-V609 WeakPolarHBondContact O-CB 3.23Å; L605-V609 VanDerWaalsContact O-CG2 3.28Å; L605-V609 WeakPolarHBondContact O-CG2 3.3Å; L605-V609 PolarHBondContact O-N 2.9Å; T606-V609 PolarHBondContact O-N 3.32Å; V609-L611 PolarHBondContact O-N 3.45Å; V609-L612 PolarHBondContact O-N 3.08Å; V609-K613 HydrophobicContact CG1-CD 4.48Å; V609-K613 WeakPolarHBondContact O-CB 3.39Å; V609-K613 PolarHBondContact O-N 3.16Å; V609-H677 HydrophobicContact CG1-CB 4.18Å; V609-H677 HydrophobicContact CG2-CB 4.06Å; V609-F678 HydrophobicContact CG2-CD1 4.33Å; V609-F678 HydrophobicContact CG2-CE1 3.93Å; V609-F678 HydrophobicContact CG2-CZ 4.11Å; V609-L681 HydrophobicContact CB-CD1 4.04Å; V609-L681 HydrophobicContact CG1-CD1 3.8Å; V609-L681 HydrophobicContact CG1-CG 4.24Å; V609-L681 HydrophobicContact CG2-CD1 3.8Å
610	D	97.9	Very high	96.4	Very high	56 Å²	56	24.8 Å²	24.8	30%	0.299	14%	0.137	S	C	.	.	H	α-helix	trans	-58.3	-45.7	177	-176.8	66.3	0	0	0	111.9	H509 K513 T606 P607 M608 L612 K613 M614	H509-D610 IonicContact CE1-OD2 2.55Å; H509-D610 PolarHBondContact CE1-OD2 2.83Å; H509-D610 IonicContact NE2-OD2 3.02Å; H509-D610 PolarHBondContact NE2-OD2 2.86Å; K513-D610 IonicContact NZ-OD1 3.74Å; K513-D610 IonicContact NZ-OD2 2.6Å; K513-D610 PolarHBondContact NZ-OD2 3.36Å; T606-D610 PolarHBondContact O-N 2.72Å; P607-D610 PolarHBondContact O-N 2.65Å; M608-D610 VanDerWaalsContact C-N 3.31Å; M608-D610 PolarHBondContact O-N 2.66Å; D610-L612 PolarHBondContact O-N 3.03Å; D610-K613 PolarHBondContact O-N 3.31Å; D610-M614 WeakPolarHBondContact O-CB 3.4Å; D610-M614 PolarHBondContact O-N 3.45Å
611	L	98.7	Very high	96.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.4	-42.4	177.9	-68.1	-178.5	0	0	0	112.9	K512 K513 L516 I586 M587 Y590 P607 M608 V609 K613 M614 Y615	K512-L611 HydrophobicContact CB-CD1 4Å; K513-L611 HydrophobicContact CB-CD2 3.69Å; K513-L611 HydrophobicContact CG-CD2 4.06Å; L516-L611 HydrophobicContact CD2-CB 4.37Å; L516-L611 HydrophobicContact CD2-CD2 4.28Å; I586-L611 HydrophobicContact CG2-CD1 3.83Å; M587-L611 HydrophobicContact CE-CB 4.13Å; M587-L611 HydrophobicContact CE-CD1 4.13Å; Y590-L611 HydrophobicContact CD2-CD1 4.36Å; Y590-L611 HydrophobicContact CE2-CD1 3.42Å; Y590-L611 VanDerWaalsContact CE2-CD1 3.42Å; P607-L611 PolarHBondContact O-N 3.4Å; M608-L611 PolarHBondContact O-N 2.87Å; V609-L611 PolarHBondContact O-N 3.45Å; L611-K613 VanDerWaalsContact C-N 3.35Å; L611-M614 PolarHBondContact O-N 3.17Å; L611-Y615 PolarHBondContact O-N 3.42Å
612	L	98.8	Very high	97	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.4	-40.8	176.7	-72.3	169	0	0	0	111.4	L583 M587 M608 V609 D610 N616 I652 F659 F678 L681 Y685	L583-L612 HydrophobicContact CD2-CD2 4.44Å; M587-L612 HydrophobicContact CG-CD2 4.14Å; M587-L612 HydrophobicContact SD-CD1 3.93Å; M587-L612 HydrophobicContact SD-CD2 3.59Å; M587-L612 VanDerWaalsContact SD-CD2 3.59Å; M587-L612 HydrophobicContact SD-CG 3.61Å; M608-L612 PolarHBondContact O-N 3.08Å; V609-L612 PolarHBondContact O-N 3.08Å; D610-L612 PolarHBondContact O-N 3.03Å; L612-N616 PolarHBondContact O-N 3.45Å; L612-N616 VanDerWaalsContact O-N 3.16Å; L612-I652 HydrophobicContact CD2-CG2 3.68Å; L612-F659 HydrophobicContact CD1-CD2 4.01Å; L612-F659 HydrophobicContact CD1-CE2 4.21Å; L612-F659 HydrophobicContact CD2-CE2 4.47Å; L612-F678 HydrophobicContact CD1-CE1 4.44Å; L612-L681 HydrophobicContact CB-CD1 4.03Å; L612-L681 HydrophobicContact CB-CD2 3.92Å; L612-L681 HydrophobicContact CD1-CD1 3.94Å; L612-Y685 WeakPolarHBondContact O-CE2 3.45Å; L612-Y685 PolarHBondContact O-OH 3.42Å
613	K	98.4	Very high	97.3	Very high	88 Å²	88	27.6 Å²	27.6	38%	0.383	15%	0.147	S	C	.	.	H	α-helix	trans	-65.1	-44.1	174.7	-110.4	171.7	-175.7	-172	0	112.1	V609 D610 L611 N616 S617 L681	V609-K613 HydrophobicContact CG1-CD 4.48Å; V609-K613 WeakPolarHBondContact O-CB 3.39Å; V609-K613 PolarHBondContact O-N 3.16Å; D610-K613 PolarHBondContact O-N 3.31Å; L611-K613 VanDerWaalsContact C-N 3.35Å; K613-N616 PolarHBondContact O-N 2.85Å; K613-S617 WeakPolarHBondContact O-CB 3.13Å; K613-S617 PolarHBondContact O-N 3.4Å; K613-L681 HydrophobicContact CB-CD2 4.25Å; K613-L681 HydrophobicContact CD-CD2 4.48Å; K613-L681 HydrophobicContact CG-CD2 3.68Å
614	M	98.4	Very high	97.5	Very high	35 Å²	35	26.8 Å²	26.8	17%	0.172	14%	0.142	C	C	.	.	H	α-helix	trans	-57.6	-52.5	177.3	-166.4	-55	-70.3	0	0	109.6	L516 I520 D610 L611 N616 S617 R618	L516-M614 HydrophobicContact CD2-CE 3.92Å; L516-M614 HydrophobicContact CG-CE 3.85Å; I520-M614 HydrophobicContact CG2-CE 3.95Å; D610-M614 WeakPolarHBondContact O-CB 3.4Å; D610-M614 PolarHBondContact O-N 3.45Å; L611-M614 PolarHBondContact O-N 3.17Å; M614-N616 VanDerWaalsContact C-N 3.31Å; M614-N616 PolarHBondContact O-N 3.13Å; M614-S617 PolarHBondContact O-N 3.15Å; M614-R618 HydrophobicContact CE-CB 4.43Å; M614-R618 WeakPolarHBondContact O-CB 3.46Å; M614-R618 PolarHBondContact O-N 2.95Å; M614-R618 HydrophobicContact SD-CB 3.49Å; M614-R618 WeakPolarHBondContact SD-CB 3.39Å; M614-R618 HydrophobicContact SD-CG 4.07Å
615	Y	98.7	Very high	97.4	Very high	1 Å²	1	29.5 Å²	29.5	0%	0.004	17%	0.17	C	C	.	.	H	α-helix	trans	-57	-44.6	180	-175.7	-96.2	0	0	0	112.2	L516 I520 L583 L611 S619 L649	L516-Y615 HydrophobicContact CD1-CD2 4.22Å; I520-Y615 HydrophobicContact CD1-CD2 3.61Å; I520-Y615 HydrophobicContact CD1-CE2 3.87Å; I520-Y615 HydrophobicContact CD1-CG 4.32Å; I520-Y615 HydrophobicContact CG1-CE2 4.49Å; L583-Y615 HydrophobicContact CD2-CD1 3.55Å; L583-Y615 HydrophobicContact CD2-CD2 3.74Å; L583-Y615 HydrophobicContact CD2-CE1 4.06Å; L583-Y615 HydrophobicContact CD2-CE2 4.24Å; L583-Y615 HydrophobicContact CD2-CG 3.38Å; L611-Y615 PolarHBondContact O-N 3.42Å; Y615-S619 VanDerWaalsContact O-CB 3.22Å; Y615-S619 WeakPolarHBondContact O-CB 3.07Å; Y615-S619 PolarHBondContact O-N 2.93Å; Y615-S619 PolarHBondContact O-OG 3.46Å; Y615-L649 HydrophobicContact CD1-CD2 4.49Å; Y615-L649 HydrophobicContact CE1-CD2 4.27Å
616	N	98.6	Very high	97.1	Very high	15 Å²	15	31.1 Å²	31.1	8%	0.08	18%	0.184	C	C	.	.	H	α-helix	trans	-62.7	-52.8	177.6	-166.4	34.7	0	0	0	112	L612 K613 M614 R618 S619 C620 D684 Y685 H688	L612-N616 PolarHBondContact O-N 3.45Å; L612-N616 VanDerWaalsContact O-N 3.16Å; K613-N616 PolarHBondContact O-N 2.85Å; M614-N616 VanDerWaalsContact C-N 3.31Å; M614-N616 PolarHBondContact O-N 3.13Å; N616-R618 VanDerWaalsContact C-N 3.31Å; N616-R618 PolarHBondContact O-N 3.4Å; N616-S619 PolarHBondContact O-N 2.99Å; N616-S619 PolarHBondContact O-OG 3.28Å; N616-C620 WeakPolarHBondContact O-CB 3.41Å; N616-C620 PolarHBondContact O-N 3.03Å; N616-D684 PolarHBondContact ND2-O 3.26Å; N616-D684 VanDerWaalsContact ND2-O 3.08Å; N616-Y685 HydrophobicContact CB-CD2 4.05Å; N616-Y685 HydrophobicContact CB-CE2 3.55Å; N616-H688 PolarHBondContact OD1-ND1 3.11Å
617	S	98.4	Very high	97.1	Very high	61 Å²	61	28.1 Å²	28.1	43%	0.427	17%	0.17	S	C	.	.	H	α-helix	trans	-58.9	-44.5	-179.8	178.4	0	0	0	0	111.5	K613 M614 C620 Q621	K613-S617 WeakPolarHBondContact O-CB 3.13Å; K613-S617 PolarHBondContact O-N 3.4Å; M614-S617 PolarHBondContact O-N 3.15Å; S617-C620 PolarHBondContact O-N 2.96Å; S617-Q621 WeakPolarHBondContact O-CG 3.43Å; S617-Q621 PolarHBondContact O-N 3.02Å
618	R	97.6	Very high	96.9	Very high	52 Å²	52	27.7 Å²	27.7	20%	0.196	17%	0.167	C	C	.	.	H	α-helix	trans	-75.8	-37.2	-175.4	-173.1	57.8	172.6	174.2	-1.2	112.3	I520 D521 M614 N616 C620 Q621 L622	I520-R618 HydrophobicContact CD1-CB 3.92Å; I520-R618 HydrophobicContact CD1-CG 3.94Å; I520-R618 HydrophobicContact CG1-CG 4.33Å; I520-R618 HydrophobicContact CG2-CG 3.77Å; D521-R618 IonicContact OD1-CZ 3.28Å; D521-R618 IonicContact OD1-NE 2.91Å; D521-R618 PolarHBondContact OD1-NE 2.77Å; D521-R618 IonicContact OD1-NH2 3.88Å; D521-R618 PolarHBondContact OD1-NH2 3.47Å; D521-R618 IonicContact OD2-NH2 2.71Å; M614-R618 HydrophobicContact CE-CB 4.43Å; M614-R618 WeakPolarHBondContact O-CB 3.46Å; M614-R618 PolarHBondContact O-N 2.95Å; M614-R618 HydrophobicContact SD-CB 3.49Å; M614-R618 WeakPolarHBondContact SD-CB 3.39Å; M614-R618 HydrophobicContact SD-CG 4.07Å; N616-R618 VanDerWaalsContact C-N 3.31Å; N616-R618 PolarHBondContact O-N 3.4Å; R618-C620 VanDerWaalsContact C-N 3.33Å; R618-C620 PolarHBondContact O-N 3.44Å; R618-Q621 PolarHBondContact O-N 3.07Å; R618-L622 HydrophobicContact CG-CD1 4Å; R618-L622 HydrophobicContact CG-CG 4.44Å; R618-L622 WeakPolarHBondContact O-CB 3.29Å; R618-L622 VanDerWaalsContact O-CG 3.24Å; R618-L622 WeakPolarHBondContact O-CG 3.42Å; R618-L622 PolarHBondContact O-N 3.17Å
619	S	97.9	Very high	96.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.5	-40	171.1	56.7	0	0	0	0	112.1	Y615 N616 L622 I623 H688	Y615-S619 VanDerWaalsContact O-CB 3.22Å; Y615-S619 WeakPolarHBondContact O-CB 3.07Å; Y615-S619 PolarHBondContact O-N 2.93Å; Y615-S619 PolarHBondContact O-OG 3.46Å; N616-S619 PolarHBondContact O-N 2.99Å; N616-S619 PolarHBondContact O-OG 3.28Å; S619-L622 PolarHBondContact O-N 3.13Å; S619-I623 WeakPolarHBondContact O-CB 3.43Å; S619-I623 PolarHBondContact O-N 3.3Å; S619-H688 PolarHBondContact OG-CE1 2.96Å
620	C	97.9	Very high	96.3	Very high	38 Å²	38	38.9 Å²	38.9	26%	0.257	22%	0.22	S	C	.	.	H	α-helix	trans	-59.4	-49.9	173	177.5	0	0	0	0	111.4	N616 S617 R618 L622 I623 L624 G625 H688	N616-C620 WeakPolarHBondContact O-CB 3.41Å; N616-C620 PolarHBondContact O-N 3.03Å; S617-C620 PolarHBondContact O-N 2.96Å; R618-C620 VanDerWaalsContact C-N 3.33Å; R618-C620 PolarHBondContact O-N 3.44Å; C620-L622 PolarHBondContact O-N 3.02Å; C620-I623 PolarHBondContact O-N 3.19Å; C620-L624 WeakPolarHBondContact O-CA 3.31Å; C620-L624 WeakPolarHBondContact O-CB 3.26Å; C620-L624 PolarHBondContact O-N 2.92Å; C620-G625 PolarHBondContact O-N 2.55Å; C620-H688 VanDerWaalsContact CA-CE1 3.47Å; C620-H688 WeakPolarHBondContact CA-CE1 3.29Å; C620-H688 WeakPolarHBondContact CA-NE2 3.15Å; C620-H688 PolarHBondContact N-CE1 2.88Å; C620-H688 VanDerWaalsContact N-CE1 3.33Å
621	Q	97.1	Very high	95.8	Very high	92 Å²	92	40.8 Å²	40.8	43%	0.43	23%	0.228	S	C	.	.	H	α-helix	trans	-59.7	-42.9	177.2	-71	169.9	13.4	0	0	113.1	S617 R618 G625 A626 G627	S617-Q621 WeakPolarHBondContact O-CG 3.43Å; S617-Q621 PolarHBondContact O-N 3.02Å; R618-Q621 PolarHBondContact O-N 3.07Å; Q621-G625 CarbonylContact O-C 3.51Å; Q621-G625 WeakPolarHBondContact O-CA 3.32Å; Q621-G625 PolarHBondContact O-N 3.2Å; Q621-A626 PolarHBondContact O-N 3.44Å; Q621-G627 PolarHBondContact O-N 2.83Å
622	L	97.3	Very high	95.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-71.1	-38.9	-176.8	-72.3	171.9	0	0	0	112.2	I520 W525 R618 S619 C620 A626 G627 A628 M631	I520-L622 HydrophobicContact CG1-CD1 3.97Å; I520-L622 WeakPolarHBondContact O-CD1 3.47Å; W525-L622 HydrophobicContact CZ2-CB 3.76Å; W525-L622 HydrophobicContact CZ2-CD1 3.9Å; R618-L622 HydrophobicContact CG-CD1 4Å; R618-L622 HydrophobicContact CG-CG 4.44Å; R618-L622 WeakPolarHBondContact O-CB 3.29Å; R618-L622 VanDerWaalsContact O-CG 3.24Å; R618-L622 WeakPolarHBondContact O-CG 3.42Å; R618-L622 PolarHBondContact O-N 3.17Å; S619-L622 PolarHBondContact O-N 3.13Å; C620-L622 PolarHBondContact O-N 3.02Å; L622-A626 CarbonylContact O-C 3.55Å; L622-G627 PolarHBondContact O-N 2.85Å; L622-A628 HydrophobicContact CB-CB 4.2Å; L622-A628 HydrophobicContact CD2-CB 4.34Å; L622-A628 VanDerWaalsContact O-CB 3.28Å; L622-A628 WeakPolarHBondContact O-CB 3.34Å; L622-A628 PolarHBondContact O-N 3.2Å; L622-M631 HydrophobicContact CD2-CB 4.16Å; L622-M631 HydrophobicContact CD2-CG 3.94Å
623	I	97.1	Very high	94.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-97.7	-55.7	-174.4	-65	-57	0	0	0	112.7	W525 S619 C620 I637 H641 L642 K695	W525-I623 HydrophobicContact CB-CD1 4.45Å; W525-I623 HydrophobicContact CD2-CD1 3.27Å; W525-I623 HydrophobicContact CD2-CG1 3.82Å; W525-I623 VanDerWaalsContact CE2-CD1 3.48Å; W525-I623 HydrophobicContact CE3-CD1 3.53Å; W525-I623 HydrophobicContact CE3-CG1 3.68Å; W525-I623 HydrophobicContact CG-CD1 3.68Å; W525-I623 HydrophobicContact CH2-CD1 4.15Å; W525-I623 HydrophobicContact CH2-CG1 3.54Å; W525-I623 HydrophobicContact CZ2-CD1 3.93Å; W525-I623 HydrophobicContact CZ2-CG1 3.67Å; W525-I623 HydrophobicContact CZ3-CD1 3.97Å; W525-I623 HydrophobicContact CZ3-CG1 3.55Å; S619-I623 WeakPolarHBondContact O-CB 3.43Å; S619-I623 PolarHBondContact O-N 3.3Å; C620-I623 PolarHBondContact O-N 3.19Å; I623-I637 HydrophobicContact CG2-CG2 4.35Å; I623-H641 HydrophobicContact CD1-CB 4.23Å; I623-L642 HydrophobicContact CG2-CD2 3.49Å; I623-L642 VanDerWaalsContact CG2-CD2 3.49Å; I623-L642 HydrophobicContact CG2-CG 4.42Å; I623-K695 PolarHBondContact O-NZ 3.3Å
624	L	95.4	Very high	94	Very high	23 Å²	23	42.7 Å²	42.7	12%	0.12	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-45.3	-179.8	-65.3	-177.8	0	0	0	111.2	C620 A626 L642 E691 I692 K695	C620-L624 WeakPolarHBondContact O-CA 3.31Å; C620-L624 WeakPolarHBondContact O-CB 3.26Å; C620-L624 PolarHBondContact O-N 2.92Å; L624-A626 PolarHBondContact O-N 2.73Å; L624-L642 HydrophobicContact CD2-CD2 4.19Å; L624-E691 HydrophobicContact CD1-CB 4.07Å; L624-E691 VanDerWaalsContact CD1-CD 3.49Å; L624-E691 HydrophobicContact CD1-CG 3.75Å; L624-I692 HydrophobicContact CD1-CG1 4.25Å; L624-I692 HydrophobicContact CD2-CG1 3.95Å; L624-I692 HydrophobicContact CG-CG1 4.21Å; L624-K695 HydrophobicContact CD2-CB 4.33Å; L624-K695 HydrophobicContact CD2-CD 3.42Å; L624-K695 VanDerWaalsContact CD2-CD 3.42Å; L624-K695 PolarHBondContact O-NZ 3.36Å
625	G	93.9	Very high	93.7	Very high	57 Å²	57	50.6 Å²	50.6	59%	0.588	29%	0.29	S	S	*	.	S	Bend	trans	-76.5	2.1	175.2	0	0	0	0	0	115.1	C620 Q621 G627	C620-G625 PolarHBondContact O-N 2.55Å; Q621-G625 CarbonylContact O-C 3.51Å; Q621-G625 WeakPolarHBondContact O-CA 3.32Å; Q621-G625 PolarHBondContact O-N 3.2Å; G625-G627 PolarHBondContact O-N 2.88Å; G625-G627 VanDerWaalsContact O-N 3.08Å
626	A	92	Very high	93.4	Very high	34 Å²	34	55 Å²	55	28%	0.281	32%	0.317	S	S	.	.			trans	56	20.8	-179.7	0	0	0	0	0	115.2	Q621 L622 L624 A628 L629 I637	Q621-A626 PolarHBondContact O-N 3.44Å; L622-A626 CarbonylContact O-C 3.55Å; L624-A626 PolarHBondContact O-N 2.73Å; A626-A628 PolarHBondContact O-N 2.85Å; A626-L629 HydrophobicContact CB-CD1 3.92Å; A626-L629 HydrophobicContact CB-CG 4.26Å; A626-L629 WeakPolarHBondContact O-CB 3.46Å; A626-L629 WeakPolarHBondContact O-CG 3.49Å; A626-L629 PolarHBondContact O-N 3.43Å; A626-L629 VanDerWaalsContact O-N 3.15Å; A626-I637 HydrophobicContact CB-CG1 4.3Å
627	G	92.8	Very high	93.2	Very high	20 Å²	20	55.9 Å²	55.9	21%	0.206	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-26.4	177.8	0	0	0	0	0	113.6	Q621 L622 G625 L629 Q630 M631	Q621-G627 PolarHBondContact O-N 2.83Å; L622-G627 PolarHBondContact O-N 2.85Å; G625-G627 PolarHBondContact O-N 2.88Å; G625-G627 VanDerWaalsContact O-N 3.08Å; G627-L629 PolarHBondContact O-N 3.44Å; G627-Q630 PolarHBondContact O-N 3.48Å; G627-M631 WeakPolarHBondContact O-CG 3.47Å; G627-M631 PolarHBondContact O-N 2.89Å
628	A	93.1	Very high	93	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.4	-19.4	178.2	0	0	0	0	0	113.6	L622 A626 Q630 V632 L634 I637	L622-A628 HydrophobicContact CB-CB 4.2Å; L622-A628 HydrophobicContact CD2-CB 4.34Å; L622-A628 VanDerWaalsContact O-CB 3.28Å; L622-A628 WeakPolarHBondContact O-CB 3.34Å; L622-A628 PolarHBondContact O-N 3.2Å; A626-A628 PolarHBondContact O-N 2.85Å; A628-Q630 VanDerWaalsContact C-N 3.31Å; A628-Q630 PolarHBondContact O-N 3.29Å; A628-V632 PolarHBondContact O-N 3.44Å; A628-L634 HydrophobicContact CB-CD1 3.96Å; A628-I637 HydrophobicContact CB-CD1 3.97Å
629	L	93.2	Very high	92.8	Very high	63 Å²	63	52.8 Å²	52.8	33%	0.33	31%	0.308	S	S	.	.	H	α-helix	trans	-62.9	-40.4	174.2	-59.5	179.8	0	0	0	111.5	A626 G627 G633 L634 I637	A626-L629 HydrophobicContact CB-CD1 3.92Å; A626-L629 HydrophobicContact CB-CG 4.26Å; A626-L629 WeakPolarHBondContact O-CB 3.46Å; A626-L629 WeakPolarHBondContact O-CG 3.49Å; A626-L629 PolarHBondContact O-N 3.43Å; A626-L629 VanDerWaalsContact O-N 3.15Å; G627-L629 PolarHBondContact O-N 3.44Å; L629-G633 VanDerWaalsContact O-CA 3.29Å; L629-G633 WeakPolarHBondContact O-CA 3.49Å; L629-G633 PolarHBondContact O-N 2.95Å; L629-L634 WeakPolarHBondContact CA-O 3.14Å; L629-L634 HydrophobicContact CD2-CB 4.21Å; L629-L634 WeakPolarHBondContact CD2-O 3.49Å; L629-I637 HydrophobicContact CD2-CD1 3.96Å; L629-I637 HydrophobicContact CD2-CG1 4.02Å; L629-I637 HydrophobicContact CG-CD1 4.28Å; L629-I637 HydrophobicContact CG-CG1 4.24Å
630	Q	88.9	Confident	92.7	Very high	181 Å²	181	54.8 Å²	54.8	85%	0.846	32%	0.32	S	S	*	.	H	α-helix	trans	-88.3	-43.4	-178.9	-64.3	178.2	6.6	0	0	111.9	G627 A628	G627-Q630 PolarHBondContact O-N 3.48Å; A628-Q630 VanDerWaalsContact C-N 3.31Å; A628-Q630 PolarHBondContact O-N 3.29Å
631	M	86.9	Confident	92.7	Very high	96 Å²	96	54.3 Å²	54.3	47%	0.473	31%	0.314	S	S	.	.	H	α-helix	trans	-68.4	-42.7	-174.6	-69.5	-65.1	-60.1	0	0	112.7	D521 L622 G627	D521-M631 HydrophobicContact CB-CE 3.76Å; L622-M631 HydrophobicContact CD2-CB 4.16Å; L622-M631 HydrophobicContact CD2-CG 3.94Å; G627-M631 WeakPolarHBondContact O-CG 3.47Å; G627-M631 PolarHBondContact O-N 2.89Å
632	V	87.4	Confident	92.7	Very high	37 Å²	37	50 Å²	50	22%	0.224	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-14.6	-172	-179.8	0	0	0	0	111.7	D521 E523 N524 A628 L634	D521-V632 WeakPolarHBondContact O-CG2 3.44Å; E523-V632 WeakPolarHBondContact O-CG2 3.1Å; N524-V632 WeakPolarHBondContact OD1-CG1 3.29Å; A628-V632 PolarHBondContact O-N 3.44Å; V632-L634 HydrophobicContact CB-CG 4.46Å; V632-L634 HydrophobicContact CG1-CG 4.31Å
633	G	84.2	Confident	92.7	Very high	56 Å²	56	50 Å²	50	58%	0.577	29%	0.294	S	S	*	.			trans	78.6	22.7	-176.4	0	0	0	0	0	113.3	L629 K635	L629-G633 VanDerWaalsContact O-CA 3.29Å; L629-G633 WeakPolarHBondContact O-CA 3.49Å; L629-G633 PolarHBondContact O-N 2.95Å; G633-K635 PolarHBondContact O-N 3.27Å
634	L	87.9	Confident	92.8	Very high	35 Å²	35	50 Å²	50	18%	0.183	29%	0.294	C	S	.	.			trans	-61.3	134.4	170.7	-70.3	179.5	0	0	0	109.5	A628 L629 V632 I637	A628-L634 HydrophobicContact CB-CD1 3.96Å; L629-L634 WeakPolarHBondContact CA-O 3.14Å; L629-L634 HydrophobicContact CD2-CB 4.21Å; L629-L634 WeakPolarHBondContact CD2-O 3.49Å; V632-L634 HydrophobicContact CB-CG 4.46Å; V632-L634 HydrophobicContact CG1-CG 4.31Å; L634-I637 HydrophobicContact CD1-CD1 4.22Å
635	K	91.5	Very high	92.9	Very high	201 Å²	201	49 Å²	49	87%	0.874	29%	0.289	S	S	*	.	S	Bend	trans	-71	-35.4	177.3	-66.1	-177	179.4	-179.8	0	112.4	G633	G633-K635 PolarHBondContact O-N 3.27Å
636	T	92.6	Very high	93.1	Very high	93 Å²	93	46.2 Å²	46.2	57%	0.571	26%	0.261	S	S	*	.			trans	-150.5	150.7	-177.8	59.7	0	0	0	0	110.5	S638 H641	T636-S638 PolarHBondContact O-N 2.83Å; T636-H641 PolarHBondContact O-CE1 3.18Å; T636-H641 VanDerWaalsContact O-CE1 3.24Å; T636-H641 PolarHBondContact O-ND1 3.44Å
637	I	93.6	Very high	93.4	Very high	35 Å²	35	44.7 Å²	44.7	18%	0.179	25%	0.248	C	C	.	.			trans	-87.9	102.9	166.4	-54.1	-56.8	0	0	0	108	I623 A626 A628 L629 L634 H641 L642	I623-I637 HydrophobicContact CG2-CG2 4.35Å; A626-I637 HydrophobicContact CB-CG1 4.3Å; A628-I637 HydrophobicContact CB-CD1 3.97Å; L629-I637 HydrophobicContact CD2-CD1 3.96Å; L629-I637 HydrophobicContact CD2-CG1 4.02Å; L629-I637 HydrophobicContact CG-CD1 4.28Å; L629-I637 HydrophobicContact CG-CG1 4.24Å; L634-I637 HydrophobicContact CD1-CD1 4.22Å; I637-H641 HydrophobicContact CG2-CB 4.23Å; I637-L642 HydrophobicContact CG2-CG 4.43Å
638	S	93.9	Very high	93.7	Very high	35 Å²	35	43.8 Å²	43.8	25%	0.245	24%	0.238	C	C	.	.			trans	-85.3	168.2	-177.3	74.6	0	0	0	0	112.5	T636 V640 H641 L642	T636-S638 PolarHBondContact O-N 2.83Å; S638-V640 PolarHBondContact O-N 2.83Å; S638-V640 PolarHBondContact OG-N 3.41Å; S638-H641 PolarHBondContact N-ND1 3.39Å; S638-H641 PolarHBondContact O-N 2.85Å; S638-H641 VanDerWaalsContact O-N 3.13Å; S638-H641 PolarHBondContact OG-N 3.38Å; S638-H641 PolarHBondContact OG-ND1 2.93Å; S638-L642 PolarHBondContact O-N 2.81Å
639	S	94.3	Very high	94	Very high	13 Å²	13	43.8 Å²	43.8	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-26.9	172.6	61.3	0	0	0	0	113.2	A643 N735	S639-A643 WeakPolarHBondContact O-CB 3.35Å; S639-A643 PolarHBondContact O-N 3.41Å; S639-N735 WeakPolarHBondContact OG-CB 3.46Å; S639-N735 PolarHBondContact OG-ND2 3.28Å
640	V	96.4	Very high	94.2	Very high	42 Å²	42	42.6 Å²	42.6	26%	0.255	23%	0.231	S	C	.	.	H	α-helix	trans	-66.2	-44.3	174.6	177.7	0	0	0	0	110.4	S638 L642 A643 L644 N735 I739	S638-V640 PolarHBondContact O-N 2.83Å; S638-V640 PolarHBondContact OG-N 3.41Å; V640-L642 VanDerWaalsContact C-N 3.34Å; V640-L642 PolarHBondContact O-N 3.37Å; V640-A643 PolarHBondContact O-N 3.38Å; V640-L644 HydrophobicContact CG1-CD1 3.85Å; V640-L644 HydrophobicContact CG1-CG 4.36Å; V640-L644 WeakPolarHBondContact O-CB 3.25Å; V640-L644 VanDerWaalsContact O-CG 3.32Å; V640-L644 WeakPolarHBondContact O-CG 3.4Å; V640-L644 PolarHBondContact O-N 2.81Å; V640-N735 HydrophobicContact CG2-CB 3.81Å; V640-I739 HydrophobicContact CG1-CD1 3.87Å
641	H	97	Very high	94.6	Very high	28 Å²	28	34 Å²	34	13%	0.13	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-42.7	178.6	-52.6	151.8	0	0	0	111	W525 I623 T636 I637 S638 L644 S645	W525-H641 HydrophobicContact CB-CB 4.24Å; W525-H641 PolarHBondContact O-CD2 3.43Å; I623-H641 HydrophobicContact CD1-CB 4.23Å; T636-H641 PolarHBondContact O-CE1 3.18Å; T636-H641 VanDerWaalsContact O-CE1 3.24Å; T636-H641 PolarHBondContact O-ND1 3.44Å; I637-H641 HydrophobicContact CG2-CB 4.23Å; S638-H641 PolarHBondContact N-ND1 3.39Å; S638-H641 PolarHBondContact O-N 2.85Å; S638-H641 VanDerWaalsContact O-N 3.13Å; S638-H641 PolarHBondContact OG-N 3.38Å; S638-H641 PolarHBondContact OG-ND1 2.93Å; H641-L644 PolarHBondContact O-N 3.26Å; H641-S645 WeakPolarHBondContact O-CB 3.28Å; H641-S645 PolarHBondContact O-N 3.17Å
642	L	97.2	Very high	95.2	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-60	-48.7	174.5	-70.5	170.1	0	0	0	111.4	I623 L624 I637 S638 V640 L644 S645 C646 I692 K695 L696 I699	I623-L642 HydrophobicContact CG2-CD2 3.49Å; I623-L642 VanDerWaalsContact CG2-CD2 3.49Å; I623-L642 HydrophobicContact CG2-CG 4.42Å; L624-L642 HydrophobicContact CD2-CD2 4.19Å; I637-L642 HydrophobicContact CG2-CG 4.43Å; S638-L642 PolarHBondContact O-N 2.81Å; V640-L642 VanDerWaalsContact C-N 3.34Å; V640-L642 PolarHBondContact O-N 3.37Å; L642-L644 PolarHBondContact O-N 2.87Å; L642-S645 PolarHBondContact O-N 3.36Å; L642-C646 WeakPolarHBondContact O-CB 3.22Å; L642-C646 PolarHBondContact O-N 2.78Å; L642-I692 HydrophobicContact CB-CG2 3.95Å; L642-I692 HydrophobicContact CD2-CG2 4.06Å; L642-I692 WeakPolarHBondContact O-CG2 3.43Å; L642-K695 HydrophobicContact CD1-CD 4.43Å; L642-K695 HydrophobicContact CD1-CG 4.25Å; L642-K695 HydrophobicContact CD2-CD 3.99Å; L642-L696 HydrophobicContact CB-CD2 3.8Å; L642-L696 HydrophobicContact CB-CG 4.1Å; L642-L696 HydrophobicContact CD1-CD2 3.78Å; L642-L696 HydrophobicContact CD1-CG 4.17Å; L642-L696 HydrophobicContact CG-CD2 4.45Å; L642-I699 HydrophobicContact CD1-CD1 3.58Å
643	A	97.9	Very high	95.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.3	-42.4	179.7	0	0	0	0	0	112.7	S639 V640 C646 R647 T736 I739 L740	S639-A643 WeakPolarHBondContact O-CB 3.35Å; S639-A643 PolarHBondContact O-N 3.41Å; V640-A643 PolarHBondContact O-N 3.38Å; A643-C646 WeakPolarHBondContact O-CB 3.06Å; A643-C646 PolarHBondContact O-N 2.71Å; A643-R647 WeakPolarHBondContact O-CG 3.29Å; A643-R647 PolarHBondContact O-N 2.82Å; A643-T736 HydrophobicContact CB-CG2 4.01Å; A643-I739 HydrophobicContact CB-CB 4.13Å; A643-I739 HydrophobicContact CB-CD1 4.17Å; A643-I739 HydrophobicContact CB-CG2 3.77Å; A643-L740 HydrophobicContact CB-CD2 3.97Å; A643-L740 HydrophobicContact CB-CG 4.03Å
644	L	98.5	Very high	96.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.5	-41.4	177.3	-72.6	170.6	0	0	0	111.9	W525 R527 V575 V577 V640 H641 L642 S648 I739	W525-L644 WeakPolarHBondContact O-CD1 3.34Å; R527-L644 HydrophobicContact CB-CD2 4.35Å; V575-L644 HydrophobicContact CG1-CD2 3.83Å; V577-L644 HydrophobicContact CG1-CB 3.89Å; V640-L644 HydrophobicContact CG1-CD1 3.85Å; V640-L644 HydrophobicContact CG1-CG 4.36Å; V640-L644 WeakPolarHBondContact O-CB 3.25Å; V640-L644 VanDerWaalsContact O-CG 3.32Å; V640-L644 WeakPolarHBondContact O-CG 3.4Å; V640-L644 PolarHBondContact O-N 2.81Å; H641-L644 PolarHBondContact O-N 3.26Å; L642-L644 PolarHBondContact O-N 2.87Å; L644-S648 VanDerWaalsContact O-CB 3.31Å; L644-S648 WeakPolarHBondContact O-CB 3.29Å; L644-S648 PolarHBondContact O-N 3.3Å; L644-S648 PolarHBondContact O-OG 3.5Å; L644-I739 HydrophobicContact CD2-CD1 4.28Å; L644-I739 HydrophobicContact CD2-CG1 4.49Å; L644-I739 HydrophobicContact CD2-CG2 3.94Å; L644-I739 HydrophobicContact CG-CD1 4.17Å; L644-I739 HydrophobicContact CG-CG2 4.3Å
645	S	98.3	Very high	96.7	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.007	14%	0.139	C	C	.	.	H	α-helix	trans	-61.7	-47.6	174.1	-179.6	0	0	0	0	110.9	H641 L642 R647 S648 L649	H641-S645 WeakPolarHBondContact O-CB 3.28Å; H641-S645 PolarHBondContact O-N 3.17Å; L642-S645 PolarHBondContact O-N 3.36Å; S645-R647 PolarHBondContact O-N 3.46Å; S645-S648 WeakPolarHBondContact O-CB 3.15Å; S645-S648 PolarHBondContact O-N 3.09Å; S645-S648 VanDerWaalsContact O-N 3.15Å; S645-L649 WeakPolarHBondContact O-CG 3.3Å; S645-L649 PolarHBondContact O-N 2.98Å
646	C	98.2	Very high	97	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-53.7	-52.2	176.3	-177.4	0	0	0	0	112.2	L642 A643 S648 L649 Q650 I692 L740	L642-C646 WeakPolarHBondContact O-CB 3.22Å; L642-C646 PolarHBondContact O-N 2.78Å; A643-C646 WeakPolarHBondContact O-CB 3.06Å; A643-C646 PolarHBondContact O-N 2.71Å; C646-S648 VanDerWaalsContact C-N 3.31Å; C646-S648 PolarHBondContact O-N 3.35Å; C646-L649 PolarHBondContact O-N 3.1Å; C646-Q650 WeakPolarHBondContact O-CG 3.16Å; C646-Q650 PolarHBondContact O-N 3.31Å; C646-I692 HydrophobicContact CB-CG2 3.94Å; C646-L740 HydrophobicContact CB-CD2 4.39Å
647	R	98.2	Very high	97.1	Very high	2 Å²	2	17 Å²	17	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-65.7	-33.5	179.4	-67.8	-60.6	-70.7	146.1	-3.8	113.1	E572 K573 V575 I576 A643 S645 Q650 L651 I739 L740	E572-R647 IonicContact OE1-CZ 2.86Å; E572-R647 VanDerWaalsContact OE1-CZ 3.28Å; E572-R647 IonicContact OE1-NH1 3.47Å; E572-R647 PolarHBondContact OE1-NH1 3.03Å; E572-R647 IonicContact OE1-NH2 2.83Å; E572-R647 PolarHBondContact OE1-NH2 3.46Å; K573-R647 PolarHBondContact O-NH2 3.4Å; V575-R647 WeakPolarHBondContact O-CB 3.49Å; I576-R647 HydrophobicContact CG2-CB 4.21Å; A643-R647 WeakPolarHBondContact O-CG 3.29Å; A643-R647 PolarHBondContact O-N 2.82Å; S645-R647 PolarHBondContact O-N 3.46Å; R647-Q650 VanDerWaalsContact CD-OE1 3.26Å; R647-L651 PolarHBondContact O-N 3Å; R647-I739 WeakPolarHBondContact CD-O 3.33Å; R647-I739 HydrophobicContact CG-CG2 3.82Å; R647-I739 VanDerWaalsContact CG-O 3.24Å; R647-I739 WeakPolarHBondContact CG-O 3.44Å; R647-I739 PolarHBondContact NE-O 3.39Å; R647-L740 HydrophobicContact CG-CD2 4.14Å
648	S	98.6	Very high	97.2	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-66.1	-44	176.9	-59.4	0	0	0	0	111.1	I576 V577 L644 S645 C646 L651 I652	I576-S648 WeakPolarHBondContact CA-OG 3.45Å; I576-S648 WeakPolarHBondContact CB-OG 3.44Å; V577-S648 PolarHBondContact N-OG 3.43Å; V577-S648 VanDerWaalsContact N-OG 3.16Å; L644-S648 VanDerWaalsContact O-CB 3.31Å; L644-S648 WeakPolarHBondContact O-CB 3.29Å; L644-S648 PolarHBondContact O-N 3.3Å; L644-S648 PolarHBondContact O-OG 3.5Å; S645-S648 WeakPolarHBondContact O-CB 3.15Å; S645-S648 PolarHBondContact O-N 3.09Å; S645-S648 VanDerWaalsContact O-N 3.15Å; C646-S648 VanDerWaalsContact C-N 3.31Å; C646-S648 PolarHBondContact O-N 3.35Å; S648-L651 PolarHBondContact O-N 2.82Å; S648-I652 WeakPolarHBondContact O-CG1 3.48Å; S648-I652 PolarHBondContact O-N 3.47Å
649	L	98.7	Very high	97.4	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-64.6	-44.1	175.3	-65.9	164.7	0	0	0	111.8	Y615 S645 C646 L651 I652 S653 Y685 H688 V689 I692	Y615-L649 HydrophobicContact CD1-CD2 4.49Å; Y615-L649 HydrophobicContact CE1-CD2 4.27Å; S645-L649 WeakPolarHBondContact O-CG 3.3Å; S645-L649 PolarHBondContact O-N 2.98Å; C646-L649 PolarHBondContact O-N 3.1Å; L649-L651 VanDerWaalsContact C-N 3.33Å; L649-L651 PolarHBondContact O-N 3.22Å; L649-I652 PolarHBondContact O-N 3.38Å; L649-S653 VanDerWaalsContact O-CB 3.27Å; L649-S653 WeakPolarHBondContact O-CB 3.28Å; L649-S653 PolarHBondContact O-N 3.13Å; L649-Y685 HydrophobicContact CB-CD1 4.09Å; L649-Y685 HydrophobicContact CD2-CD1 3.73Å; L649-Y685 HydrophobicContact CD2-CE1 3.64Å; L649-H688 HydrophobicContact CD1-CB 4.43Å; L649-H688 VanDerWaalsContact CD1-CE1 3.48Å; L649-H688 WeakPolarHBondContact CD1-CE1 3.44Å; L649-H688 VanDerWaalsContact CD1-ND1 3.3Å; L649-H688 WeakPolarHBondContact CD1-ND1 3.29Å; L649-V689 HydrophobicContact CB-CG2 3.7Å; L649-V689 HydrophobicContact CD1-CG2 4.21Å; L649-I692 HydrophobicContact CD1-CD1 3.58Å
650	Q	98.4	Very high	97.5	Very high	37 Å²	37	19.2 Å²	19.2	17%	0.173	9%	0.094	C	C	.	.	H	α-helix	trans	-60.6	-40.7	176.7	-74.5	174.1	-26.3	0	0	112.1	F574 C646 R647 S654 V689 D744	F574-Q650 HydrophobicContact CE1-CB 4.35Å; C646-Q650 WeakPolarHBondContact O-CG 3.16Å; C646-Q650 PolarHBondContact O-N 3.31Å; R647-Q650 VanDerWaalsContact CD-OE1 3.26Å; Q650-S654 WeakPolarHBondContact O-CB 3.35Å; Q650-S654 PolarHBondContact O-N 3.03Å; Q650-V689 HydrophobicContact CG-CG1 4.14Å; Q650-V689 HydrophobicContact CG-CG2 4Å; Q650-D744 PolarHBondContact NE2-OD2 2.83Å
651	L	98.2	Very high	97.4	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-58.3	-53.9	175	178	67.9	0	0	0	110.8	L567 K569 F574 I576 R647 S648 L649 S654 F655	L567-L651 HydrophobicContact CD2-CD1 3.98Å; L567-L651 HydrophobicContact CD2-CD2 3.64Å; L567-L651 HydrophobicContact CD2-CG 4.47Å; K569-L651 HydrophobicContact CD-CD1 4.44Å; F574-L651 HydrophobicContact CB-CD1 4.21Å; F574-L651 HydrophobicContact CD1-CB 3.61Å; F574-L651 HydrophobicContact CD1-CD1 3.92Å; F574-L651 HydrophobicContact CD1-CG 4.34Å; F574-L651 HydrophobicContact CD2-CD1 3.99Å; F574-L651 HydrophobicContact CE1-CB 4.04Å; F574-L651 HydrophobicContact CE1-CD1 4.28Å; F574-L651 HydrophobicContact CE2-CD1 4.36Å; F574-L651 HydrophobicContact CG-CB 4.22Å; F574-L651 HydrophobicContact CG-CD1 3.76Å; F574-L651 HydrophobicContact CG-CG 4.5Å; F574-L651 HydrophobicContact CZ-CD1 4.5Å; I576-L651 HydrophobicContact CD1-CD2 3.43Å; I576-L651 VanDerWaalsContact CD1-CD2 3.43Å; I576-L651 HydrophobicContact CG2-CB 4.39Å; I576-L651 HydrophobicContact CG2-CD2 4.31Å; R647-L651 PolarHBondContact O-N 3Å; S648-L651 PolarHBondContact O-N 2.82Å; L649-L651 VanDerWaalsContact C-N 3.33Å; L649-L651 PolarHBondContact O-N 3.22Å; L651-S654 WeakPolarHBondContact O-CB 3.48Å; L651-S654 PolarHBondContact O-N 3.42Å; L651-S654 PolarHBondContact O-OG 3.38Å; L651-F655 HydrophobicContact CD1-CE2 3.88Å; L651-F655 HydrophobicContact CG-CE2 4.31Å; L651-F655 VanDerWaalsContact O-CD2 3.3Å; L651-F655 WeakPolarHBondContact O-CD2 3.26Å
652	I	98.3	Very high	97.4	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-63	-44.8	-177.4	-61.7	-62.7	0	0	0	110.7	L583 L584 L612 S648 L649 S654 F655 I656 Y685	L583-I652 HydrophobicContact CB-CD1 4.24Å; L583-I652 HydrophobicContact CD2-CD1 3.8Å; L583-I652 HydrophobicContact CD2-CG1 3.91Å; L583-I652 HydrophobicContact CD2-CG2 4.1Å; L583-I652 HydrophobicContact CG-CD1 3.95Å; L584-I652 HydrophobicContact CB-CD1 4.36Å; L612-I652 HydrophobicContact CD2-CG2 3.68Å; S648-I652 WeakPolarHBondContact O-CG1 3.48Å; S648-I652 PolarHBondContact O-N 3.47Å; L649-I652 PolarHBondContact O-N 3.38Å; I652-S654 PolarHBondContact O-N 2.85Å; I652-F655 PolarHBondContact O-N 2.87Å; I652-I656 PolarHBondContact O-N 3.44Å; I652-Y685 HydrophobicContact CB-CE1 3.91Å; I652-Y685 HydrophobicContact CG2-CE1 3.68Å
653	S	97.9	Very high	97.4	Very high	16 Å²	16	21.1 Å²	21.1	11%	0.112	10%	0.104	C	C	.	.	H	α-helix	trans	-54	-39.1	175.8	-176.9	0	0	0	0	111.8	L649 F655 I656	L649-S653 VanDerWaalsContact O-CB 3.27Å; L649-S653 WeakPolarHBondContact O-CB 3.28Å; L649-S653 PolarHBondContact O-N 3.13Å; S653-F655 PolarHBondContact O-N 3.3Å; S653-I656 WeakPolarHBondContact O-CB 3.4Å; S653-I656 PolarHBondContact O-N 2.84Å
654	S	96.2	Very high	97.2	Very high	37 Å²	37	24 Å²	24	26%	0.259	12%	0.119	S	C	.	.	H	α-helix	trans	-65.8	-10.3	179.7	87	0	0	0	0	115.5	K569 Q650 L651 I652	K569-S654 WeakPolarHBondContact CE-OG 3.46Å; K569-S654 VanDerWaalsContact NZ-CB 3.27Å; K569-S654 PolarHBondContact NZ-O 3.48Å; K569-S654 PolarHBondContact NZ-OG 2.83Å; Q650-S654 WeakPolarHBondContact O-CB 3.35Å; Q650-S654 PolarHBondContact O-N 3.03Å; L651-S654 WeakPolarHBondContact O-CB 3.48Å; L651-S654 PolarHBondContact O-N 3.42Å; L651-S654 PolarHBondContact O-OG 3.38Å; I652-S654 PolarHBondContact O-N 2.85Å
655	F	97.7	Very high	97	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-103.7	-13.8	172.4	-70	-85	0	0	0	113.3	V538 F541 L547 K569 L584 L651 I652 S653 H657 H658 F659	V538-F655 HydrophobicContact CG2-CZ 4.27Å; F541-F655 HydrophobicContact CD1-CD1 4.3Å; F541-F655 AromaticContact CD1-CE1 3.56Å; F541-F655 HydrophobicContact CD1-CE1 3.56Å; F541-F655 HydrophobicContact CD1-CZ 4.45Å; F541-F655 HydrophobicContact CE1-CD1 4.07Å; F541-F655 AromaticContact CE1-CE1 3.72Å; F541-F655 HydrophobicContact CE1-CE1 3.72Å; F541-F655 HydrophobicContact CG-CE1 4.05Å; F541-F655 HydrophobicContact CZ-CD1 4.31Å; F541-F655 HydrophobicContact CZ-CE1 4.36Å; L547-F655 HydrophobicContact CD1-CD1 4.23Å; L547-F655 HydrophobicContact CD1-CE1 3.83Å; L547-F655 HydrophobicContact CD2-CD1 4.26Å; K569-F655 HydrophobicContact CD-CE2 3.92Å; K569-F655 HydrophobicContact CD-CZ 3.77Å; L584-F655 HydrophobicContact CD1-CD1 4.37Å; L584-F655 HydrophobicContact CD1-CD2 3.71Å; L584-F655 HydrophobicContact CD1-CE1 4.26Å; L584-F655 HydrophobicContact CD1-CE2 3.6Å; L584-F655 HydrophobicContact CD1-CG 4.11Å; L584-F655 HydrophobicContact CD1-CZ 3.89Å; L584-F655 HydrophobicContact CD2-CE2 4.23Å; L584-F655 HydrophobicContact CD2-CZ 4.39Å; L651-F655 HydrophobicContact CD1-CE2 3.88Å; L651-F655 HydrophobicContact CG-CE2 4.31Å; L651-F655 VanDerWaalsContact O-CD2 3.3Å; L651-F655 WeakPolarHBondContact O-CD2 3.26Å; I652-F655 PolarHBondContact O-N 2.87Å; S653-F655 PolarHBondContact O-N 3.3Å; F655-H657 VanDerWaalsContact C-N 3.26Å; F655-H657 PolarHBondContact O-N 2.97Å; F655-H658 WeakPolarHBondContact O-CB 3.46Å; F655-H658 PolarHBondContact O-N 2.87Å; F655-F659 HydrophobicContact CB-CE1 3.96Å; F655-F659 HydrophobicContact CB-CE2 3.9Å; F655-F659 HydrophobicContact CB-CZ 3.46Å; F655-F659 VanDerWaalsContact CB-CZ 3.46Å; F655-F659 HydrophobicContact CG-CZ 4.44Å; F655-F659 WeakPolarHBondContact O-CG 3.23Å; F655-F659 PolarHBondContact O-N 3.21Å; F655-F659 VanDerWaalsContact O-N 3.08Å
656	I	97.9	Very high	96.7	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-60.3	-36.8	-177.1	-65.5	178.4	0	0	0	111.7	I652 S653 H658 F659 R660 F678 L681 L682 Y685	I652-I656 PolarHBondContact O-N 3.44Å; S653-I656 WeakPolarHBondContact O-CB 3.4Å; S653-I656 PolarHBondContact O-N 2.84Å; I656-H658 VanDerWaalsContact C-N 3.34Å; I656-H658 PolarHBondContact O-N 3.34Å; I656-F659 HydrophobicContact CG1-CD2 4.42Å; I656-F659 PolarHBondContact O-N 3.36Å; I656-R660 PolarHBondContact O-N 2.96Å; I656-F678 HydrophobicContact CG2-CB 4.2Å; I656-F678 HydrophobicContact CG2-CD1 4.23Å; I656-F678 WeakPolarHBondContact CG2-O 3.38Å; I656-L681 HydrophobicContact CD1-CB 4.4Å; I656-L682 HydrophobicContact CB-CD1 4.42Å; I656-L682 HydrophobicContact CG2-CB 4.06Å; I656-L682 HydrophobicContact CG2-CD1 4.36Å; I656-Y685 HydrophobicContact CD1-CD2 4.02Å; I656-Y685 HydrophobicContact CD1-CE2 4.29Å; I656-Y685 HydrophobicContact CD1-CG 4.21Å
657	H	94.4	Very high	96.5	Very high	105 Å²	105	31.3 Å²	31.3	49%	0.486	17%	0.166	S	C	.	.	H	α-helix	trans	-58.9	-44.2	173.1	-68	-67.9	0	0	0	112.4	F655 F659 R660 D661 L682	F655-H657 VanDerWaalsContact C-N 3.26Å; F655-H657 PolarHBondContact O-N 2.97Å; H657-F659 VanDerWaalsContact C-N 3.34Å; H657-F659 PolarHBondContact O-N 3.29Å; H657-R660 WeakPolarHBondContact O-CB 3.2Å; H657-R660 PolarHBondContact O-N 3.06Å; H657-D661 VanDerWaalsContact O-CG 3.28Å; H657-D661 PolarHBondContact O-N 2.88Å; H657-L682 WeakPolarHBondContact CE1-CD1 3.3Å; H657-L682 WeakPolarHBondContact NE2-CD1 3.36Å
658	H	96	Very high	96.1	Very high	31 Å²	31	33.8 Å²	33.8	14%	0.144	18%	0.183	C	C	.	.	H	α-helix	trans	-64.5	-39.9	178.2	175	61.1	0	0	0	111.8	F541 G545 F655 I656 R660 D661 L662	F541-H658 HydrophobicContact CE2-CB 4.15Å; F541-H658 AromaticContact CE2-CD2 3.52Å; F541-H658 AromaticContact CE2-CE1 3.74Å; F541-H658 AromaticContact CE2-CG 3.48Å; F541-H658 VanDerWaalsContact CE2-CG 3.48Å; F541-H658 AromaticContact CE2-ND1 3.62Å; F541-H658 AromaticContact CE2-NE2 3.67Å; F541-H658 HydrophobicContact CZ-CB 4.04Å; F541-H658 AromaticContact CZ-CG 3.88Å; G545-H658 PolarHBondContact O-CE1 3.1Å; F655-H658 WeakPolarHBondContact O-CB 3.46Å; F655-H658 PolarHBondContact O-N 2.87Å; I656-H658 VanDerWaalsContact C-N 3.34Å; I656-H658 PolarHBondContact O-N 3.34Å; H658-R660 VanDerWaalsContact C-N 3.32Å; H658-R660 PolarHBondContact O-N 2.87Å; H658-D661 PolarHBondContact O-N 2.85Å; H658-L662 WeakPolarHBondContact O-CB 3.49Å; H658-L662 PolarHBondContact O-N 3.14Å
659	F	97.4	Very high	95.8	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.009	21%	0.213	C	C	.	.	H	α-helix	trans	-60.2	-46	175.7	-52.9	-29.7	0	0	0	110.7	L547 M587 M608 L612 F655 I656 H657 D661 L662 F663 F678	L547-F659 HydrophobicContact CD2-CE1 3.65Å; L547-F659 HydrophobicContact CD2-CZ 4.11Å; M587-F659 HydrophobicContact CB-CE1 4.11Å; M587-F659 HydrophobicContact CB-CE2 4.25Å; M587-F659 HydrophobicContact CB-CZ 3.58Å; M587-F659 HydrophobicContact CG-CE2 4.06Å; M587-F659 HydrophobicContact CG-CZ 3.88Å; M587-F659 HydrophobicContact SD-CE2 4.29Å; M608-F659 HydrophobicContact CE-CB 4.06Å; M608-F659 HydrophobicContact CE-CD1 3.56Å; M608-F659 HydrophobicContact CE-CD2 3.68Å; M608-F659 HydrophobicContact CE-CE1 3.86Å; M608-F659 HydrophobicContact CE-CE2 3.98Å; M608-F659 HydrophobicContact CE-CG 3.48Å; M608-F659 VanDerWaalsContact CE-CG 3.48Å; M608-F659 HydrophobicContact CE-CZ 4.06Å; L612-F659 HydrophobicContact CD1-CD2 4.01Å; L612-F659 HydrophobicContact CD1-CE2 4.21Å; L612-F659 HydrophobicContact CD2-CE2 4.47Å; F655-F659 HydrophobicContact CB-CE1 3.96Å; F655-F659 HydrophobicContact CB-CE2 3.9Å; F655-F659 HydrophobicContact CB-CZ 3.46Å; F655-F659 VanDerWaalsContact CB-CZ 3.46Å; F655-F659 HydrophobicContact CG-CZ 4.44Å; F655-F659 WeakPolarHBondContact O-CG 3.23Å; F655-F659 PolarHBondContact O-N 3.21Å; F655-F659 VanDerWaalsContact O-N 3.08Å; I656-F659 HydrophobicContact CG1-CD2 4.42Å; I656-F659 PolarHBondContact O-N 3.36Å; H657-F659 VanDerWaalsContact C-N 3.34Å; H657-F659 PolarHBondContact O-N 3.29Å; F659-D661 PolarHBondContact O-N 2.9Å; F659-L662 PolarHBondContact O-N 3.4Å; F659-F663 VanDerWaalsContact O-CD2 3.26Å; F659-F663 WeakPolarHBondContact O-CD2 3.49Å; F659-F663 PolarHBondContact O-N 3.33Å; F659-F678 HydrophobicContact CB-CD1 4.18Å; F659-F678 HydrophobicContact CB-CE1 3.73Å; F659-F678 HydrophobicContact CB-CZ 4.06Å
660	R	96.4	Very high	95.4	Very high	98 Å²	98	43.2 Å²	43.2	37%	0.37	24%	0.244	S	C	.	.	H	α-helix	trans	-55.6	-51	175.4	178.9	-177.8	167.6	-179.1	-4	111.8	I656 H657 H658 L662 F663 D664 F678 S679	I656-R660 PolarHBondContact O-N 2.96Å; H657-R660 WeakPolarHBondContact O-CB 3.2Å; H657-R660 PolarHBondContact O-N 3.06Å; H658-R660 VanDerWaalsContact C-N 3.32Å; H658-R660 PolarHBondContact O-N 2.87Å; R660-L662 VanDerWaalsContact C-N 3.3Å; R660-L662 PolarHBondContact O-N 3.49Å; R660-F663 PolarHBondContact O-N 2.8Å; R660-D664 WeakPolarHBondContact CG-OD2 3.3Å; R660-D664 IonicContact NE-OD2 3.95Å; R660-D664 PolarHBondContact NE-OD2 3.2Å; R660-D664 WeakPolarHBondContact O-CB 3.07Å; R660-D664 PolarHBondContact O-N 3.18Å; R660-F678 HydrophobicContact CB-CB 3.84Å; R660-F678 HydrophobicContact CB-CD2 4.04Å; R660-F678 HydrophobicContact CB-CG 4.07Å; R660-F678 HydrophobicContact CG-CB 4.3Å; R660-F678 HydrophobicContact CG-CD2 4.47Å; R660-S679 PolarHBondContact NH1-OG 2.97Å
661	D	95.4	Very high	95.2	Very high	99 Å²	99	42.4 Å²	42.4	53%	0.529	24%	0.243	S	C	.	.	H	α-helix	trans	-61.8	-39.9	-177.9	-62.7	-22.1	0	0	0	111.8	H657 H658 F659 D664 A665	H657-D661 VanDerWaalsContact O-CG 3.28Å; H657-D661 PolarHBondContact O-N 2.88Å; H658-D661 PolarHBondContact O-N 2.85Å; F659-D661 PolarHBondContact O-N 2.9Å; D661-D664 PolarHBondContact O-N 2.97Å; D661-A665 PolarHBondContact O-N 3.4Å; D661-A665 VanDerWaalsContact O-N 3.1Å
662	L	96	Very high	94.9	Very high	12 Å²	12	49.8 Å²	49.8	6%	0.063	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-41.5	176.5	176.5	135.3	0	0	0	112	C591 V594 E595 H658 F659 R660 H666	C591-L662 HydrophobicContact CB-CD1 4.27Å; V594-L662 HydrophobicContact CB-CD2 3.8Å; V594-L662 HydrophobicContact CG1-CD2 3.57Å; V594-L662 HydrophobicContact CG1-CG 4.44Å; V594-L662 HydrophobicContact CG2-CD2 4.15Å; E595-L662 HydrophobicContact CG-CD1 4.3Å; H658-L662 WeakPolarHBondContact O-CB 3.49Å; H658-L662 PolarHBondContact O-N 3.14Å; F659-L662 PolarHBondContact O-N 3.4Å; R660-L662 VanDerWaalsContact C-N 3.3Å; R660-L662 PolarHBondContact O-N 3.49Å; L662-H666 PolarHBondContact O-N 2.9Å; L662-H666 PolarHBondContact O-ND1 2.95Å
663	F	96.4	Very high	94.6	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-72.8	-38.8	174.4	-81.5	-79.7	0	0	0	112.3	V594 S601 L604 L605 M608 F659 R660 A665 H666 L667 F678	V594-F663 HydrophobicContact CG1-CE1 4.34Å; V594-F663 HydrophobicContact CG2-CE1 3.68Å; V594-F663 HydrophobicContact CG2-CE2 4.22Å; V594-F663 HydrophobicContact CG2-CZ 3.45Å; V594-F663 VanDerWaalsContact CG2-CZ 3.45Å; S601-F663 WeakPolarHBondContact O-CE1 3.5Å; L604-F663 HydrophobicContact CB-CE1 4.17Å; L604-F663 HydrophobicContact CB-CZ 4.29Å; L605-F663 HydrophobicContact CB-CD1 3.8Å; L605-F663 HydrophobicContact CB-CE1 3.62Å; L605-F663 HydrophobicContact CB-CG 4.44Å; L605-F663 HydrophobicContact CB-CZ 4.12Å; L605-F663 HydrophobicContact CD1-CB 4.15Å; L605-F663 HydrophobicContact CD1-CD1 3.97Å; L605-F663 HydrophobicContact CD1-CG 4Å; L605-F663 HydrophobicContact CG-CD1 4.23Å; L605-F663 HydrophobicContact CG-CE1 4.39Å; L605-F663 HydrophobicContact CG-CG 4.4Å; M608-F663 HydrophobicContact SD-CE2 3.57Å; M608-F663 VanDerWaalsContact SD-CE2 3.57Å; M608-F663 HydrophobicContact SD-CZ 4.06Å; F659-F663 VanDerWaalsContact O-CD2 3.26Å; F659-F663 WeakPolarHBondContact O-CD2 3.49Å; F659-F663 PolarHBondContact O-N 3.33Å; R660-F663 PolarHBondContact O-N 2.8Å; F663-A665 PolarHBondContact O-N 3.3Å; F663-H666 PolarHBondContact O-N 3.33Å; F663-L667 HydrophobicContact CB-CD1 3.99Å; F663-L667 HydrophobicContact CB-CG 4.19Å; F663-L667 HydrophobicContact CD1-CG 4.42Å; F663-L667 VanDerWaalsContact O-CB 3.25Å; F663-L667 WeakPolarHBondContact O-CB 3.43Å; F663-L667 WeakPolarHBondContact O-CG 3.44Å; F663-L667 PolarHBondContact O-N 2.9Å; F663-F678 HydrophobicContact CB-CE2 4.02Å; F663-F678 AromaticContact CD2-CE2 3.42Å; F663-F678 HydrophobicContact CD2-CE2 3.42Å; F663-F678 VanDerWaalsContact CD2-CE2 3.42Å; F663-F678 AromaticContact CD2-CZ 3.41Å; F663-F678 HydrophobicContact CD2-CZ 3.41Å; F663-F678 VanDerWaalsContact CD2-CZ 3.41Å; F663-F678 HydrophobicContact CE2-CE2 4.12Å; F663-F678 AromaticContact CE2-CZ 3.65Å; F663-F678 HydrophobicContact CE2-CZ 3.65Å; F663-F678 AromaticContact CG-CE2 3.89Å; F663-F678 HydrophobicContact CG-CE2 3.89Å; F663-F678 HydrophobicContact CG-CZ 4.28Å
664	D	94.8	Very high	94.4	Very high	60 Å²	60	55.2 Å²	55.2	32%	0.321	29%	0.294	S	S	.	.	H	α-helix	trans	-58.4	-32.1	176.7	-79.8	-22.6	0	0	0	111.7	R660 D661 S675	R660-D664 WeakPolarHBondContact CG-OD2 3.3Å; R660-D664 IonicContact NE-OD2 3.95Å; R660-D664 PolarHBondContact NE-OD2 3.2Å; R660-D664 WeakPolarHBondContact O-CB 3.07Å; R660-D664 PolarHBondContact O-N 3.18Å; D661-D664 PolarHBondContact O-N 2.97Å; D664-S675 WeakPolarHBondContact OD1-CB 3.33Å; D664-S675 PolarHBondContact OD1-OG 3.44Å
665	A	93.8	Very high	94.3	Very high	78 Å²	78	53.8 Å²	53.8	65%	0.645	28%	0.284	S	S	*	.	H	α-helix	trans	-73.7	-29.6	174.9	0	0	0	0	0	114.6	D661 F663	D661-A665 PolarHBondContact O-N 3.4Å; D661-A665 VanDerWaalsContact O-N 3.1Å; F663-A665 PolarHBondContact O-N 3.3Å
666	H	93	Very high	94.2	Very high	67 Å²	67	61.4 Å²	61.4	31%	0.31	31%	0.313	S	S	.	.	H	α-helix	trans	-111.3	-10.5	-172.8	-63.5	96.5	0	0	0	114.4	V594 S601 L662 F663	V594-H666 HydrophobicContact CG1-CB 4.29Å; S601-H666 PolarHBondContact OG-O 3.3Å; L662-H666 PolarHBondContact O-N 2.9Å; L662-H666 PolarHBondContact O-ND1 2.95Å; F663-H666 PolarHBondContact O-N 3.33Å
667	L	93.9	Very high	94.1	Very high	9 Å²	9	64 Å²	64	5%	0.047	33%	0.325	C	S	.	.			trans	-74.5	133.7	-178.9	-81.2	171.4	0	0	0	111.7	A602 L605 F663 S675	A602-L667 HydrophobicContact CB-CD2 3.95Å; L605-L667 HydrophobicContact CD1-CD1 3.76Å; L605-L667 HydrophobicContact CD1-CD2 4.3Å; L605-L667 HydrophobicContact CD1-CG 4.5Å; F663-L667 HydrophobicContact CB-CD1 3.99Å; F663-L667 HydrophobicContact CB-CG 4.19Å; F663-L667 HydrophobicContact CD1-CG 4.42Å; F663-L667 VanDerWaalsContact O-CB 3.25Å; F663-L667 WeakPolarHBondContact O-CB 3.43Å; F663-L667 WeakPolarHBondContact O-CG 3.44Å; F663-L667 PolarHBondContact O-N 2.9Å; L667-S675 WeakPolarHBondContact CD1-OG 3.28Å
668	P	89.8	Confident	94.3	Very high	55 Å²	55	59 Å²	59	36%	0.357	30%	0.302	S	S	.	.			trans	-67.5	156.3	171.8	29.7	-34.7	0	0	0	111.1	N670 S671 R672	P668-N670 VanDerWaalsContact C-N 3.25Å; P668-N670 VanDerWaalsContact CB-OD1 3.29Å; P668-N670 WeakPolarHBondContact CB-OD1 3.35Å; P668-N670 VanDerWaalsContact CG-OD1 3.26Å; P668-N670 WeakPolarHBondContact CG-OD1 3.38Å; P668-N670 PolarHBondContact O-N 2.85Å; P668-N670 VanDerWaalsContact O-N 3.15Å; P668-S671 PolarHBondContact O-N 3.45Å; P668-R672 PolarHBondContact O-N 2.88Å
669	A	90.4	Very high	94.3	Very high	77 Å²	77	60 Å²	60	64%	0.636	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-55.8	-36.4	-172.2	0	0	0	0	0	113.9	S671	A669-S671 VanDerWaalsContact C-N 3.29Å; A669-S671 PolarHBondContact O-N 3.3Å
670	N	92.1	Very high	94.3	Very high	122 Å²	122	64.1 Å²	64.1	65%	0.652	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-65.6	-27.3	177.3	59.2	-16.1	0	0	0	113.5	P668 H673	P668-N670 VanDerWaalsContact C-N 3.25Å; P668-N670 VanDerWaalsContact CB-OD1 3.29Å; P668-N670 WeakPolarHBondContact CB-OD1 3.35Å; P668-N670 VanDerWaalsContact CG-OD1 3.26Å; P668-N670 WeakPolarHBondContact CG-OD1 3.38Å; P668-N670 PolarHBondContact O-N 2.85Å; P668-N670 VanDerWaalsContact O-N 3.15Å; N670-H673 PolarHBondContact O-CE1 3.42Å; N670-H673 PolarHBondContact O-ND1 2.82Å
671	S	93.1	Very high	94.4	Very high	20 Å²	20	59.4 Å²	59.4	14%	0.14	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-106.5	0.1	-174.3	-62.1	0	0	0	0	114.2	P668 A669 H673 L674	P668-S671 PolarHBondContact O-N 3.45Å; A669-S671 VanDerWaalsContact C-N 3.29Å; A669-S671 PolarHBondContact O-N 3.3Å; S671-H673 PolarHBondContact O-N 2.81Å; S671-H673 VanDerWaalsContact O-N 3.08Å; S671-L674 VanDerWaalsContact O-CB 3.23Å; S671-L674 WeakPolarHBondContact O-CB 3.27Å; S671-L674 VanDerWaalsContact O-CG 3.29Å; S671-L674 WeakPolarHBondContact O-CG 3.18Å; S671-L674 PolarHBondContact O-N 3.4Å
672	R	91.4	Very high	94.5	Very high	155 Å²	155	55.8 Å²	55.8	59%	0.585	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-56.2	-27.6	179.5	-74.4	-176.7	-178.7	170.8	-0.1	114.3	P668 L674 S675	P668-R672 PolarHBondContact O-N 2.88Å; R672-L674 PolarHBondContact O-N 2.92Å; R672-S675 PolarHBondContact O-N 3.21Å; R672-S675 PolarHBondContact O-OG 2.87Å
673	H	92.9	Very high	94.6	Very high	104 Å²	104	60.4 Å²	60.4	48%	0.481	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-62.8	-21	176.2	66.4	-86	0	0	0	112.9	N670 S671 S675 R676	N670-H673 PolarHBondContact O-CE1 3.42Å; N670-H673 PolarHBondContact O-ND1 2.82Å; S671-H673 PolarHBondContact O-N 2.81Å; S671-H673 VanDerWaalsContact O-N 3.08Å; H673-S675 PolarHBondContact O-N 3.14Å; H673-R676 WeakPolarHBondContact O-CB 3.45Å; H673-R676 VanDerWaalsContact O-CD 3.26Å; H673-R676 WeakPolarHBondContact O-CD 3.34Å; H673-R676 WeakPolarHBondContact O-CG 3.47Å; H673-R676 PolarHBondContact O-N 3.29Å
674	L	94	Very high	94.7	Very high	27 Å²	27	62.4 Å²	62.4	14%	0.141	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-66.8	-23	178.3	-63.4	178.5	0	0	0	112.9	A602 L605 S671 R672 R676 H677	A602-L674 HydrophobicContact CB-CD1 4.48Å; L605-L674 HydrophobicContact CD1-CB 3.88Å; L605-L674 HydrophobicContact CD2-CB 4.02Å; S671-L674 VanDerWaalsContact O-CB 3.23Å; S671-L674 WeakPolarHBondContact O-CB 3.27Å; S671-L674 VanDerWaalsContact O-CG 3.29Å; S671-L674 WeakPolarHBondContact O-CG 3.18Å; S671-L674 PolarHBondContact O-N 3.4Å; R672-L674 PolarHBondContact O-N 2.92Å; L674-R676 PolarHBondContact O-N 2.76Å; L674-H677 VanDerWaalsContact O-CB 3.28Å; L674-H677 WeakPolarHBondContact O-CB 3.46Å; L674-H677 PolarHBondContact O-CD2 3.26Å; L674-H677 PolarHBondContact O-N 3.25Å
675	S	93.4	Very high	94.9	Very high	7 Å²	7	59.5 Å²	59.5	5%	0.049	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-59.8	-19.6	177	-56.2	0	0	0	0	113.6	D664 L667 R672 H673 H677 F678	D664-S675 WeakPolarHBondContact OD1-CB 3.33Å; D664-S675 PolarHBondContact OD1-OG 3.44Å; L667-S675 WeakPolarHBondContact CD1-OG 3.28Å; R672-S675 PolarHBondContact O-N 3.21Å; R672-S675 PolarHBondContact O-OG 2.87Å; H673-S675 PolarHBondContact O-N 3.14Å; S675-H677 PolarHBondContact O-N 2.83Å; S675-F678 PolarHBondContact O-N 2.79Å; S675-F678 VanDerWaalsContact O-N 3.16Å
676	R	95.6	Very high	95.1	Very high	160 Å²	160	60.5 Å²	60.5	60%	0.604	30%	0.301	S	S	*	.	H	α-helix	trans	-57.7	-26.9	170.3	78.1	-170.1	173.1	171.6	-3.9	112.9	H673 L674 F678 S679 Q680	H673-R676 WeakPolarHBondContact O-CB 3.45Å; H673-R676 VanDerWaalsContact O-CD 3.26Å; H673-R676 WeakPolarHBondContact O-CD 3.34Å; H673-R676 WeakPolarHBondContact O-CG 3.47Å; H673-R676 PolarHBondContact O-N 3.29Å; L674-R676 PolarHBondContact O-N 2.76Å; R676-F678 VanDerWaalsContact C-N 3.31Å; R676-F678 PolarHBondContact O-N 3.49Å; R676-S679 WeakPolarHBondContact O-CB 3.49Å; R676-S679 PolarHBondContact O-N 2.88Å; R676-S679 VanDerWaalsContact O-N 3.14Å; R676-Q680 PolarHBondContact O-N 3.47Å
677	H	96.5	Very high	95.4	Very high	55 Å²	55	61.5 Å²	61.5	26%	0.255	31%	0.308	S	S	.	.	H	α-helix	trans	-63.9	-35	178	-69.1	-57.9	0	0	0	112.3	L605 V609 L674 S675 Q680 L681	L605-H677 HydrophobicContact CD2-CB 4.45Å; V609-H677 HydrophobicContact CG1-CB 4.18Å; V609-H677 HydrophobicContact CG2-CB 4.06Å; L674-H677 VanDerWaalsContact O-CB 3.28Å; L674-H677 WeakPolarHBondContact O-CB 3.46Å; L674-H677 PolarHBondContact O-CD2 3.26Å; L674-H677 PolarHBondContact O-N 3.25Å; S675-H677 PolarHBondContact O-N 2.83Å; H677-Q680 PolarHBondContact O-N 3.3Å; H677-L681 WeakPolarHBondContact O-CB 3.13Å; H677-L681 WeakPolarHBondContact O-CG 3.33Å; H677-L681 PolarHBondContact O-N 2.86Å
678	F	97.9	Very high	95.6	Very high	1 Å²	1	61.5 Å²	61.5	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-69.1	-35.1	172.9	-70.2	-63.6	0	0	0	112.4	L605 V609 L612 I656 F659 R660 F663 S675 R676 L681 L682	L605-F678 HydrophobicContact CD1-CE2 3.81Å; L605-F678 HydrophobicContact CG-CE2 3.88Å; L605-F678 HydrophobicContact CG-CZ 4.22Å; V609-F678 HydrophobicContact CG2-CD1 4.33Å; V609-F678 HydrophobicContact CG2-CE1 3.93Å; V609-F678 HydrophobicContact CG2-CZ 4.11Å; L612-F678 HydrophobicContact CD1-CE1 4.44Å; I656-F678 HydrophobicContact CG2-CB 4.2Å; I656-F678 HydrophobicContact CG2-CD1 4.23Å; I656-F678 WeakPolarHBondContact CG2-O 3.38Å; F659-F678 HydrophobicContact CB-CD1 4.18Å; F659-F678 HydrophobicContact CB-CE1 3.73Å; F659-F678 HydrophobicContact CB-CZ 4.06Å; R660-F678 HydrophobicContact CB-CB 3.84Å; R660-F678 HydrophobicContact CB-CD2 4.04Å; R660-F678 HydrophobicContact CB-CG 4.07Å; R660-F678 HydrophobicContact CG-CB 4.3Å; R660-F678 HydrophobicContact CG-CD2 4.47Å; F663-F678 HydrophobicContact CB-CE2 4.02Å; F663-F678 AromaticContact CD2-CE2 3.42Å; F663-F678 HydrophobicContact CD2-CE2 3.42Å; F663-F678 VanDerWaalsContact CD2-CE2 3.42Å; F663-F678 AromaticContact CD2-CZ 3.41Å; F663-F678 HydrophobicContact CD2-CZ 3.41Å; F663-F678 VanDerWaalsContact CD2-CZ 3.41Å; F663-F678 HydrophobicContact CE2-CE2 4.12Å; F663-F678 AromaticContact CE2-CZ 3.65Å; F663-F678 HydrophobicContact CE2-CZ 3.65Å; F663-F678 AromaticContact CG-CE2 3.89Å; F663-F678 HydrophobicContact CG-CE2 3.89Å; F663-F678 HydrophobicContact CG-CZ 4.28Å; S675-F678 PolarHBondContact O-N 2.79Å; S675-F678 VanDerWaalsContact O-N 3.16Å; R676-F678 VanDerWaalsContact C-N 3.31Å; R676-F678 PolarHBondContact O-N 3.49Å; F678-L681 HydrophobicContact CD1-CD1 4.04Å; F678-L681 HydrophobicContact CE1-CD1 4.46Å; F678-L681 PolarHBondContact O-N 2.9Å; F678-L682 WeakPolarHBondContact O-CB 3.41Å; F678-L682 PolarHBondContact O-N 3.32Å
679	S	95.8	Very high	96	Very high	52 Å²	52	59.6 Å²	59.6	36%	0.364	30%	0.295	S	S	.	.	H	α-helix	trans	-66.8	-40.6	176.1	-55.6	0	0	0	0	111.4	R660 R676 K683	R660-S679 PolarHBondContact NH1-OG 2.97Å; R676-S679 WeakPolarHBondContact O-CB 3.49Å; R676-S679 PolarHBondContact O-N 2.88Å; R676-S679 VanDerWaalsContact O-N 3.14Å; S679-K683 PolarHBondContact O-N 3.23Å
680	Q	97.5	Very high	96.4	Very high	88 Å²	88	58.3 Å²	58.3	41%	0.411	29%	0.285	S	S	.	.	H	α-helix	trans	-65.6	-45	173.1	-174.6	61.7	48.4	0	0	111.6	R676 H677 L682 K683 D684	R676-Q680 PolarHBondContact O-N 3.47Å; H677-Q680 PolarHBondContact O-N 3.3Å; Q680-L682 VanDerWaalsContact C-N 3.31Å; Q680-L682 PolarHBondContact O-N 3.37Å; Q680-K683 PolarHBondContact O-N 3.39Å; Q680-D684 PolarHBondContact NE2-OD1 2.94Å; Q680-D684 PolarHBondContact O-N 2.86Å
681	L	98	Very high	96.6	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-56	-46	176.1	-88.8	172.5	0	0	0	112.1	V609 L612 K613 I656 H677 F678 K683 D684 Y685	V609-L681 HydrophobicContact CB-CD1 4.04Å; V609-L681 HydrophobicContact CG1-CD1 3.8Å; V609-L681 HydrophobicContact CG1-CG 4.24Å; V609-L681 HydrophobicContact CG2-CD1 3.8Å; L612-L681 HydrophobicContact CB-CD1 4.03Å; L612-L681 HydrophobicContact CB-CD2 3.92Å; L612-L681 HydrophobicContact CD1-CD1 3.94Å; K613-L681 HydrophobicContact CB-CD2 4.25Å; K613-L681 HydrophobicContact CD-CD2 4.48Å; K613-L681 HydrophobicContact CG-CD2 3.68Å; I656-L681 HydrophobicContact CD1-CB 4.4Å; H677-L681 WeakPolarHBondContact O-CB 3.13Å; H677-L681 WeakPolarHBondContact O-CG 3.33Å; H677-L681 PolarHBondContact O-N 2.86Å; F678-L681 HydrophobicContact CD1-CD1 4.04Å; F678-L681 HydrophobicContact CE1-CD1 4.46Å; F678-L681 PolarHBondContact O-N 2.9Å; L681-K683 VanDerWaalsContact C-N 3.32Å; L681-K683 PolarHBondContact O-N 3.2Å; L681-D684 PolarHBondContact O-N 2.91Å; L681-Y685 HydrophobicContact CD2-CE2 4.35Å; L681-Y685 VanDerWaalsContact O-CD2 3.28Å; L681-Y685 WeakPolarHBondContact O-CD2 3.36Å; L681-Y685 PolarHBondContact O-N 2.88Å
682	L	98.2	Very high	96.8	Very high	22 Å²	22	56.9 Å²	56.9	12%	0.115	27%	0.272	C	S	.	.	H	α-helix	trans	-58.7	-47	179	-175.6	135.2	0	0	0	111	I656 H657 F678 Q680 D684 Y685 E686	I656-L682 HydrophobicContact CB-CD1 4.42Å; I656-L682 HydrophobicContact CG2-CB 4.06Å; I656-L682 HydrophobicContact CG2-CD1 4.36Å; H657-L682 WeakPolarHBondContact CE1-CD1 3.3Å; H657-L682 WeakPolarHBondContact NE2-CD1 3.36Å; F678-L682 WeakPolarHBondContact O-CB 3.41Å; F678-L682 PolarHBondContact O-N 3.32Å; Q680-L682 VanDerWaalsContact C-N 3.31Å; Q680-L682 PolarHBondContact O-N 3.37Å; L682-D684 PolarHBondContact O-N 3.43Å; L682-Y685 PolarHBondContact O-N 3.06Å; L682-E686 VanDerWaalsContact CD2-CD 3.48Å; L682-E686 HydrophobicContact CD2-CG 4.38Å; L682-E686 VanDerWaalsContact CD2-OE1 3.28Å; L682-E686 WeakPolarHBondContact CD2-OE1 3.33Å; L682-E686 WeakPolarHBondContact O-CG 3.29Å; L682-E686 PolarHBondContact O-N 3.26Å
683	K	98.3	Very high	97	Very high	109 Å²	109	52.4 Å²	52.4	47%	0.474	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-44.7	174.7	-174.4	174.8	179.9	178.8	0	112.3	S679 Q680 L681 Y685 E686 D687	S679-K683 PolarHBondContact O-N 3.23Å; Q680-K683 PolarHBondContact O-N 3.39Å; L681-K683 VanDerWaalsContact C-N 3.32Å; L681-K683 PolarHBondContact O-N 3.2Å; K683-Y685 PolarHBondContact O-N 2.85Å; K683-E686 PolarHBondContact O-N 2.84Å; K683-D687 WeakPolarHBondContact O-CB 3.46Å; K683-D687 PolarHBondContact O-N 3.48Å
684	D	98.6	Very high	97	Very high	42 Å²	42	50.6 Å²	50.6	23%	0.225	25%	0.249	C	C	.	.	H	α-helix	trans	-61.1	-33.6	178.9	-63.3	-19.5	0	0	0	112.1	N616 Q680 L681 L682 H688	N616-D684 PolarHBondContact ND2-O 3.26Å; N616-D684 VanDerWaalsContact ND2-O 3.08Å; Q680-D684 PolarHBondContact NE2-OD1 2.94Å; Q680-D684 PolarHBondContact O-N 2.86Å; L681-D684 PolarHBondContact O-N 2.91Å; L682-D684 PolarHBondContact O-N 3.43Å; D684-H688 WeakPolarHBondContact O-CB 3.42Å; D684-H688 PolarHBondContact O-N 2.86Å
685	Y	98.7	Very high	97	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-74.9	-41.3	174.8	-89.3	-110.3	0	0	0	111.8	L612 N616 L649 I652 I656 L681 L682 K683 H688 V689	L612-Y685 WeakPolarHBondContact O-CE2 3.45Å; L612-Y685 PolarHBondContact O-OH 3.42Å; N616-Y685 HydrophobicContact CB-CD2 4.05Å; N616-Y685 HydrophobicContact CB-CE2 3.55Å; L649-Y685 HydrophobicContact CB-CD1 4.09Å; L649-Y685 HydrophobicContact CD2-CD1 3.73Å; L649-Y685 HydrophobicContact CD2-CE1 3.64Å; I652-Y685 HydrophobicContact CB-CE1 3.91Å; I652-Y685 HydrophobicContact CG2-CE1 3.68Å; I656-Y685 HydrophobicContact CD1-CD2 4.02Å; I656-Y685 HydrophobicContact CD1-CE2 4.29Å; I656-Y685 HydrophobicContact CD1-CG 4.21Å; L681-Y685 HydrophobicContact CD2-CE2 4.35Å; L681-Y685 VanDerWaalsContact O-CD2 3.28Å; L681-Y685 WeakPolarHBondContact O-CD2 3.36Å; L681-Y685 PolarHBondContact O-N 2.88Å; L682-Y685 PolarHBondContact O-N 3.06Å; K683-Y685 PolarHBondContact O-N 2.85Å; Y685-H688 PolarHBondContact O-N 3.34Å; Y685-V689 VanDerWaalsContact O-CG2 3.29Å; Y685-V689 WeakPolarHBondContact O-CG2 3.32Å; Y685-V689 PolarHBondContact O-N 3.02Å
686	E	98.3	Very high	97	Very high	99 Å²	99	52 Å²	52	46%	0.463	25%	0.253	S	S	.	.	H	α-helix	trans	-63.5	-45.2	176.6	-72.7	176.4	163.9	0	0	111.9	L682 K683 H688 V689 A690	L682-E686 VanDerWaalsContact CD2-CD 3.48Å; L682-E686 HydrophobicContact CD2-CG 4.38Å; L682-E686 VanDerWaalsContact CD2-OE1 3.28Å; L682-E686 WeakPolarHBondContact CD2-OE1 3.33Å; L682-E686 WeakPolarHBondContact O-CG 3.29Å; L682-E686 PolarHBondContact O-N 3.26Å; K683-E686 PolarHBondContact O-N 2.84Å; E686-H688 VanDerWaalsContact C-N 3.33Å; E686-H688 PolarHBondContact O-N 3.17Å; E686-V689 PolarHBondContact O-N 3.36Å; E686-A690 WeakPolarHBondContact O-CB 3.49Å; E686-A690 PolarHBondContact O-N 3Å
687	D	98.7	Very high	96.7	Very high	87 Å²	87	45.1 Å²	45.1	47%	0.465	23%	0.228	S	C	.	.	H	α-helix	trans	-61.2	-42.6	176.8	-72.4	-19.5	0	0	0	110.6	K683 A690 E691	K683-D687 WeakPolarHBondContact O-CB 3.46Å; K683-D687 PolarHBondContact O-N 3.48Å; D687-A690 PolarHBondContact O-N 3.21Å; D687-E691 PolarHBondContact O-N 2.88Å
688	H	98.6	Very high	96.4	Very high	9 Å²	9	45.5 Å²	45.5	4%	0.042	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-41.9	176	-175.3	-167.8	0	0	0	112.4	N616 S619 C620 L649 D684 Y685 E686 A690 E691 I692	N616-H688 PolarHBondContact OD1-ND1 3.11Å; S619-H688 PolarHBondContact OG-CE1 2.96Å; C620-H688 VanDerWaalsContact CA-CE1 3.47Å; C620-H688 WeakPolarHBondContact CA-CE1 3.29Å; C620-H688 WeakPolarHBondContact CA-NE2 3.15Å; C620-H688 PolarHBondContact N-CE1 2.88Å; C620-H688 VanDerWaalsContact N-CE1 3.33Å; L649-H688 HydrophobicContact CD1-CB 4.43Å; L649-H688 VanDerWaalsContact CD1-CE1 3.48Å; L649-H688 WeakPolarHBondContact CD1-CE1 3.44Å; L649-H688 VanDerWaalsContact CD1-ND1 3.3Å; L649-H688 WeakPolarHBondContact CD1-ND1 3.29Å; D684-H688 WeakPolarHBondContact O-CB 3.42Å; D684-H688 PolarHBondContact O-N 2.86Å; Y685-H688 PolarHBondContact O-N 3.34Å; E686-H688 VanDerWaalsContact C-N 3.33Å; E686-H688 PolarHBondContact O-N 3.17Å; H688-A690 VanDerWaalsContact C-N 3.33Å; H688-A690 PolarHBondContact O-N 3.07Å; H688-E691 PolarHBondContact O-N 3.39Å; H688-I692 WeakPolarHBondContact O-CG1 3.42Å; H688-I692 PolarHBondContact O-N 3.41Å
689	V	98.3	Very high	95.9	Very high	15 Å²	15	48.6 Å²	48.6	9%	0.091	25%	0.247	C	C	.	.	H	α-helix	trans	-59.8	-45.3	173.6	166	0	0	0	0	110.6	L649 Q650 Y685 E686 E691 I692 Q693	L649-V689 HydrophobicContact CB-CG2 3.7Å; L649-V689 HydrophobicContact CD1-CG2 4.21Å; Q650-V689 HydrophobicContact CG-CG1 4.14Å; Q650-V689 HydrophobicContact CG-CG2 4Å; Y685-V689 VanDerWaalsContact O-CG2 3.29Å; Y685-V689 WeakPolarHBondContact O-CG2 3.32Å; Y685-V689 PolarHBondContact O-N 3.02Å; E686-V689 PolarHBondContact O-N 3.36Å; V689-E691 VanDerWaalsContact C-N 3.33Å; V689-E691 PolarHBondContact O-N 2.82Å; V689-I692 PolarHBondContact O-N 3.1Å; V689-Q693 WeakPolarHBondContact O-CG 3.48Å; V689-Q693 PolarHBondContact O-N 3.31Å
690	A	97.5	Very high	95.4	Very high	51 Å²	51	46.3 Å²	46.3	42%	0.421	23%	0.231	S	C	.	.	H	α-helix	trans	-62.1	-39.6	177.7	0	0	0	0	0	112.1	E686 D687 H688 Q693 Q694	E686-A690 WeakPolarHBondContact O-CB 3.49Å; E686-A690 PolarHBondContact O-N 3Å; D687-A690 PolarHBondContact O-N 3.21Å; H688-A690 VanDerWaalsContact C-N 3.33Å; H688-A690 PolarHBondContact O-N 3.07Å; A690-Q693 PolarHBondContact O-N 2.87Å; A690-Q694 WeakPolarHBondContact O-CB 3.14Å; A690-Q694 PolarHBondContact O-N 3.49Å
691	E	97.8	Very high	94.9	Very high	111 Å²	111	45.9 Å²	45.9	52%	0.519	23%	0.229	S	C	.	.	H	α-helix	trans	-65.9	-40.4	176.5	-166.7	177.5	173.8	0	0	112.2	L624 D687 H688 V689 Q694 K695	L624-E691 HydrophobicContact CD1-CB 4.07Å; L624-E691 VanDerWaalsContact CD1-CD 3.49Å; L624-E691 HydrophobicContact CD1-CG 3.75Å; D687-E691 PolarHBondContact O-N 2.88Å; H688-E691 PolarHBondContact O-N 3.39Å; V689-E691 VanDerWaalsContact C-N 3.33Å; V689-E691 PolarHBondContact O-N 2.82Å; E691-Q694 PolarHBondContact O-N 3.46Å; E691-K695 WeakPolarHBondContact O-CB 3.44Å; E691-K695 PolarHBondContact O-N 3.28Å
692	I	97.4	Very high	94.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.3	-45.7	173.6	-68.6	169	0	0	0	110.9	L624 L642 C646 L649 H688 V689 Q694 K695 L696	L624-I692 HydrophobicContact CD1-CG1 4.25Å; L624-I692 HydrophobicContact CD2-CG1 3.95Å; L624-I692 HydrophobicContact CG-CG1 4.21Å; L642-I692 HydrophobicContact CB-CG2 3.95Å; L642-I692 HydrophobicContact CD2-CG2 4.06Å; L642-I692 WeakPolarHBondContact O-CG2 3.43Å; C646-I692 HydrophobicContact CB-CG2 3.94Å; L649-I692 HydrophobicContact CD1-CD1 3.58Å; H688-I692 WeakPolarHBondContact O-CG1 3.42Å; H688-I692 PolarHBondContact O-N 3.41Å; V689-I692 PolarHBondContact O-N 3.1Å; I692-Q694 VanDerWaalsContact C-N 3.3Å; I692-Q694 PolarHBondContact O-N 2.93Å; I692-K695 PolarHBondContact O-N 3.12Å; I692-L696 PolarHBondContact O-N 2.89Å
693	Q	94.3	Very high	93.9	Very high	61 Å²	61	51.1 Å²	51.1	29%	0.285	26%	0.259	S	S	.	.	H	α-helix	trans	-62.2	-38.5	177	-71.4	-177.5	-13.1	0	0	111.6	V689 A690 L696 F697 D744	V689-Q693 WeakPolarHBondContact O-CG 3.48Å; V689-Q693 PolarHBondContact O-N 3.31Å; A690-Q693 PolarHBondContact O-N 2.87Å; Q693-L696 PolarHBondContact O-N 2.91Å; Q693-F697 PolarHBondContact O-N 3.39Å; Q693-D744 PolarHBondContact NE2-OD1 3.18Å
694	Q	94.4	Very high	93.3	Very high	66 Å²	66	46.2 Å²	46.2	31%	0.308	24%	0.238	S	C	.	.	H	α-helix	trans	-64.9	-41.5	173	-178.7	60.3	24.5	0	0	111.8	A690 E691 I692 L696 F697 I698	A690-Q694 WeakPolarHBondContact O-CB 3.14Å; A690-Q694 PolarHBondContact O-N 3.49Å; E691-Q694 PolarHBondContact O-N 3.46Å; I692-Q694 VanDerWaalsContact C-N 3.3Å; I692-Q694 PolarHBondContact O-N 2.93Å; Q694-L696 VanDerWaalsContact C-N 3.34Å; Q694-L696 PolarHBondContact O-N 2.9Å; Q694-F697 WeakPolarHBondContact O-CB 3.49Å; Q694-F697 PolarHBondContact O-N 2.77Å; Q694-F697 VanDerWaalsContact O-N 3.13Å; Q694-I698 HydrophobicContact CG-CD1 3.91Å; Q694-I698 HydrophobicContact CG-CG1 4.41Å; Q694-I698 WeakPolarHBondContact O-CG1 3.21Å; Q694-I698 PolarHBondContact O-N 3.29Å
695	K	93.6	Very high	92.8	Very high	62 Å²	62	48.1 Å²	48.1	27%	0.27	25%	0.249	S	C	.	.	H	α-helix	trans	-63.7	-38.9	176.4	-171.5	169.9	-176.8	175.2	0	112.1	I623 L624 L642 E691 I692 F697 I698 I699	I623-K695 PolarHBondContact O-NZ 3.3Å; L624-K695 HydrophobicContact CD2-CB 4.33Å; L624-K695 HydrophobicContact CD2-CD 3.42Å; L624-K695 VanDerWaalsContact CD2-CD 3.42Å; L624-K695 PolarHBondContact O-NZ 3.36Å; L642-K695 HydrophobicContact CD1-CD 4.43Å; L642-K695 HydrophobicContact CD1-CG 4.25Å; L642-K695 HydrophobicContact CD2-CD 3.99Å; E691-K695 WeakPolarHBondContact O-CB 3.44Å; E691-K695 PolarHBondContact O-N 3.28Å; I692-K695 PolarHBondContact O-N 3.12Å; K695-F697 VanDerWaalsContact C-N 3.27Å; K695-F697 PolarHBondContact O-N 3.1Å; K695-I698 PolarHBondContact O-N 3.09Å; K695-I699 VanDerWaalsContact O-CG1 3.28Å; K695-I699 WeakPolarHBondContact O-CG1 3.28Å; K695-I699 PolarHBondContact O-N 2.98Å
696	L	92.1	Very high	92.3	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-59	-39.6	172.4	-75.7	170.8	0	0	0	112	L642 I692 Q693 Q694 L732 L740 L748	L642-L696 HydrophobicContact CB-CD2 3.8Å; L642-L696 HydrophobicContact CB-CG 4.1Å; L642-L696 HydrophobicContact CD1-CD2 3.78Å; L642-L696 HydrophobicContact CD1-CG 4.17Å; L642-L696 HydrophobicContact CG-CD2 4.45Å; I692-L696 PolarHBondContact O-N 2.89Å; Q693-L696 PolarHBondContact O-N 2.91Å; Q694-L696 VanDerWaalsContact C-N 3.34Å; Q694-L696 PolarHBondContact O-N 2.9Å; L696-L732 HydrophobicContact CD2-CD1 4.15Å; L696-L740 HydrophobicContact CD1-CD1 4.27Å; L696-L748 HydrophobicContact CB-CD1 4.22Å
697	F	89.6	Confident	91.8	Very high	16 Å²	16	46.5 Å²	46.5	7%	0.07	25%	0.251	C	S	.	.	H	α-helix	trans	-66.9	-49	174.3	172.2	-95.2	0	0	0	112.1	Q693 Q694 K695 I699 L700 E701 L748 K751 L752	Q693-F697 PolarHBondContact O-N 3.39Å; Q694-F697 WeakPolarHBondContact O-CB 3.49Å; Q694-F697 PolarHBondContact O-N 2.77Å; Q694-F697 VanDerWaalsContact O-N 3.13Å; K695-F697 VanDerWaalsContact C-N 3.27Å; K695-F697 PolarHBondContact O-N 3.1Å; F697-I699 VanDerWaalsContact C-N 3.25Å; F697-I699 PolarHBondContact O-N 3.3Å; F697-L700 PolarHBondContact O-N 2.73Å; F697-E701 HydrophobicContact CE1-CB 4.24Å; F697-E701 HydrophobicContact CE1-CG 4.39Å; F697-E701 WeakPolarHBondContact CE1-OE2 3.11Å; F697-E701 PolarHBondContact O-N 3.46Å; F697-L748 HydrophobicContact CB-CD1 4.34Å; F697-K751 HydrophobicContact CB-CD 4.45Å; F697-K751 HydrophobicContact CD2-CB 4.2Å; F697-K751 HydrophobicContact CD2-CD 3.98Å; F697-K751 HydrophobicContact CD2-CG 3.67Å; F697-K751 HydrophobicContact CE2-CB 4.42Å; F697-K751 HydrophobicContact CE2-CD 4.48Å; F697-K751 HydrophobicContact CE2-CG 3.78Å; F697-K751 WeakPolarHBondContact CE2-O 3.45Å; F697-K751 HydrophobicContact CG-CD 4.13Å; F697-K751 HydrophobicContact CG-CG 4.29Å; F697-K751 HydrophobicContact CZ-CG 4.45Å; F697-L752 HydrophobicContact CD2-CD2 3.59Å; F697-L752 HydrophobicContact CD2-CG 4.07Å; F697-L752 HydrophobicContact CE2-CD2 4.05Å; F697-L752 HydrophobicContact CG-CD2 4.48Å
698	I	90.4	Very high	91.2	Very high	64 Å²	64	42.8 Å²	42.8	33%	0.328	23%	0.231	S	C	.	.	H	α-helix	trans	-58.1	-36.5	-179.2	-69.7	167.2	0	0	0	111.8	Q694 K695 L700 E701 N702	Q694-I698 HydrophobicContact CG-CD1 3.91Å; Q694-I698 HydrophobicContact CG-CG1 4.41Å; Q694-I698 WeakPolarHBondContact O-CG1 3.21Å; Q694-I698 PolarHBondContact O-N 3.29Å; K695-I698 PolarHBondContact O-N 3.09Å; I698-L700 PolarHBondContact O-N 3.43Å; I698-E701 PolarHBondContact O-N 3.22Å; I698-N702 PolarHBondContact O-N 2.83Å; I698-N702 PolarHBondContact O-ND2 3.26Å
699	I	87.2	Confident	90.6	Very high	65 Å²	65	50.1 Å²	50.1	33%	0.333	27%	0.265	S	S	.	.	H	α-helix	trans	-55.7	-40.3	176.9	-72.6	164.9	0	0	0	111.3	L642 K695 F697 C703	L642-I699 HydrophobicContact CD1-CD1 3.58Å; K695-I699 VanDerWaalsContact O-CG1 3.28Å; K695-I699 WeakPolarHBondContact O-CG1 3.28Å; K695-I699 PolarHBondContact O-N 2.98Å; F697-I699 VanDerWaalsContact C-N 3.25Å; F697-I699 PolarHBondContact O-N 3.3Å; I699-C703 PolarHBondContact O-SG 2.95Å
700	L	85.1	Confident	89.9	Confident	5 Å²	5	57.3 Å²	57.3	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-84.1	-34.1	177.7	-79.4	-179.8	0	0	0	112.9	F697 I698 N702 C703 V704 Q728 V729 L732 L752	F697-L700 PolarHBondContact O-N 2.73Å; I698-L700 PolarHBondContact O-N 3.43Å; L700-N702 VanDerWaalsContact C-N 3.28Å; L700-N702 PolarHBondContact O-N 2.81Å; L700-C703 CarbonylContact O-C 2.99Å; L700-C703 WeakPolarHBondContact O-CA 3.39Å; L700-C703 VanDerWaalsContact O-CB 3.31Å; L700-C703 WeakPolarHBondContact O-CB 3.12Å; L700-C703 PolarHBondContact O-N 3.26Å; L700-V704 WeakPolarHBondContact O-CG2 3.11Å; L700-V704 PolarHBondContact O-N 2.92Å; L700-Q728 HydrophobicContact CD2-CB 4.03Å; L700-V729 HydrophobicContact CD1-CG2 4.24Å; L700-V729 HydrophobicContact CD2-CG2 4.32Å; L700-L732 HydrophobicContact CD1-CB 4.04Å; L700-L732 HydrophobicContact CD1-CD2 3.18Å; L700-L732 HydrophobicContact CD1-CG 4.2Å; L700-L732 HydrophobicContact CG-CB 4.48Å; L700-L732 HydrophobicContact CG-CD2 3.79Å; L700-L752 HydrophobicContact CB-CD2 3.47Å; L700-L752 VanDerWaalsContact CB-CD2 3.47Å; L700-L752 HydrophobicContact CD1-CD1 3.36Å; L700-L752 HydrophobicContact CD1-CD2 3.41Å; L700-L752 VanDerWaalsContact CD1-CD2 3.41Å; L700-L752 HydrophobicContact CD1-CG 3.99Å; L700-L752 HydrophobicContact CG-CD2 4.08Å
701	E	87.2	Confident	89.2	Confident	79 Å²	79	56.5 Å²	56.5	37%	0.369	28%	0.281	S	S	.	.	H	α-helix	trans	-53.7	-47.8	173.4	-171.6	169.9	-137.4	0	0	110.9	F697 I698 C703 V704 D705	F697-E701 HydrophobicContact CE1-CB 4.24Å; F697-E701 HydrophobicContact CE1-CG 4.39Å; F697-E701 WeakPolarHBondContact CE1-OE2 3.11Å; F697-E701 PolarHBondContact O-N 3.46Å; I698-E701 PolarHBondContact O-N 3.22Å; E701-C703 PolarHBondContact O-N 3.45Å; E701-V704 WeakPolarHBondContact O-CA 3.04Å; E701-V704 WeakPolarHBondContact O-CB 3.37Å; E701-V704 PolarHBondContact O-N 3.23Å; E701-D705 PolarHBondContact O-N 2.92Å
702	N	88.2	Confident	88.2	Confident	98 Å²	98	55.5 Å²	55.5	52%	0.524	28%	0.283	S	S	.	.	H	α-helix	trans	-60.8	-32.4	174.6	-67	-22.9	0	0	0	113.1	I698 L700 A706	I698-N702 PolarHBondContact O-N 2.83Å; I698-N702 PolarHBondContact O-ND2 3.26Å; L700-N702 VanDerWaalsContact C-N 3.28Å; L700-N702 PolarHBondContact O-N 2.81Å; N702-A706 WeakPolarHBondContact O-CB 3.26Å; N702-A706 PolarHBondContact O-N 2.8Å
703	C	86.7	Confident	86.9	Confident	34 Å²	34	58.8 Å²	58.8	23%	0.23	30%	0.3	C	S	.	.	H	α-helix	trans	-72.8	-34.8	174.5	-73.8	0	0	0	0	112.2	I699 L700 E701 C707	I699-C703 PolarHBondContact O-SG 2.95Å; L700-C703 CarbonylContact O-C 2.99Å; L700-C703 WeakPolarHBondContact O-CA 3.39Å; L700-C703 VanDerWaalsContact O-CB 3.31Å; L700-C703 WeakPolarHBondContact O-CB 3.12Å; L700-C703 PolarHBondContact O-N 3.26Å; E701-C703 PolarHBondContact O-N 3.45Å; C703-C707 WeakPolarHBondContact O-CB 3.42Å; C703-C707 PolarHBondContact O-N 3.1Å; C703-C707 PolarHBondContact O-SG 2.88Å
704	V	87.4	Confident	85.6	Confident	5 Å²	5	61.3 Å²	61.3	3%	0.03	32%	0.324	C	S	.	.	H	α-helix	trans	-62.7	-51.4	174.8	174.3	0	0	0	0	109.5	L700 E701 A706 C707 L708 L725 I756 A759	L700-V704 WeakPolarHBondContact O-CG2 3.11Å; L700-V704 PolarHBondContact O-N 2.92Å; E701-V704 WeakPolarHBondContact O-CA 3.04Å; E701-V704 WeakPolarHBondContact O-CB 3.37Å; E701-V704 PolarHBondContact O-N 3.23Å; V704-A706 VanDerWaalsContact C-N 3.34Å; V704-A706 PolarHBondContact O-N 2.96Å; V704-C707 PolarHBondContact O-N 3Å; V704-L708 HydrophobicContact CG1-CD1 3.65Å; V704-L708 HydrophobicContact CG1-CG 4.16Å; V704-L708 WeakPolarHBondContact O-CG 3.45Å; V704-L708 PolarHBondContact O-N 2.98Å; V704-L725 HydrophobicContact CB-CD1 4.39Å; V704-L725 HydrophobicContact CG2-CD1 3.51Å; V704-L725 HydrophobicContact CG2-CD2 4.13Å; V704-L725 HydrophobicContact CG2-CG 4.47Å; V704-I756 HydrophobicContact CG1-CG1 4.48Å; V704-I756 HydrophobicContact CG2-CD1 4.38Å; V704-I756 HydrophobicContact CG2-CG1 3.55Å; V704-A759 HydrophobicContact CG1-CB 3.75Å
705	D	87.4	Confident	84.2	Confident	83 Å²	83	59.9 Å²	59.9	44%	0.444	33%	0.328	S	S	.	.	H	α-helix	trans	-58.8	-46.7	-179.5	-65.2	-25.3	0	0	0	111.3	E701 C707 L708 E709	E701-D705 PolarHBondContact O-N 2.92Å; D705-C707 VanDerWaalsContact C-N 3.27Å; D705-C707 PolarHBondContact O-N 2.9Å; D705-L708 PolarHBondContact O-N 3.44Å; D705-E709 WeakPolarHBondContact O-CB 3.4Å; D705-E709 PolarHBondContact O-N 2.77Å
706	A	88.1	Confident	83.2	Confident	47 Å²	47	61 Å²	61	39%	0.388	34%	0.343	S	S	.	.	H	α-helix	trans	-63.5	-29.4	176.7	0	0	0	0	0	113.7	N702 V704	N702-A706 WeakPolarHBondContact O-CB 3.26Å; N702-A706 PolarHBondContact O-N 2.8Å; V704-A706 VanDerWaalsContact C-N 3.34Å; V704-A706 PolarHBondContact O-N 2.96Å
707	C	87.9	Confident	82.3	Confident	18 Å²	18	67.6 Å²	67.6	12%	0.122	38%	0.377	C	S	.	.	H	α-helix	trans	-77.3	-41.1	174.8	-70.5	0	0	0	0	111.4	C703 V704 D705 K710 W711 A721 L725	C703-C707 WeakPolarHBondContact O-CB 3.42Å; C703-C707 PolarHBondContact O-N 3.1Å; C703-C707 PolarHBondContact O-SG 2.88Å; V704-C707 PolarHBondContact O-N 3Å; D705-C707 VanDerWaalsContact C-N 3.27Å; D705-C707 PolarHBondContact O-N 2.9Å; C707-K710 CarbonylContact O-C 3.34Å; C707-K710 PolarHBondContact O-N 3.33Å; C707-W711 PolarHBondContact O-N 3.4Å; C707-W711 VanDerWaalsContact O-N 3.11Å; C707-A721 HydrophobicContact CB-CB 4.38Å; C707-A721 WeakPolarHBondContact O-CB 3.13Å; C707-L725 HydrophobicContact CB-CB 4.42Å
708	L	85.9	Confident	81.5	Confident	8 Å²	8	70.5 Å²	70.5	4%	0.042	40%	0.398	C	S	.	.	H	α-helix	trans	-70.7	-33.4	-178.7	-67.5	177.7	0	0	0	112.7	V704 D705 K710 W711 F722 A759 V760 R767	V704-L708 HydrophobicContact CG1-CD1 3.65Å; V704-L708 HydrophobicContact CG1-CG 4.16Å; V704-L708 WeakPolarHBondContact O-CG 3.45Å; V704-L708 PolarHBondContact O-N 2.98Å; D705-L708 PolarHBondContact O-N 3.44Å; L708-K710 PolarHBondContact O-N 2.79Å; L708-W711 HydrophobicContact CD2-CE3 3.9Å; L708-W711 WeakPolarHBondContact O-CB 3.39Å; L708-W711 PolarHBondContact O-N 2.81Å; L708-W711 VanDerWaalsContact O-N 3.11Å; L708-F722 HydrophobicContact CD2-CZ 4.18Å; L708-A759 HydrophobicContact CD1-CB 3.63Å; L708-V760 HydrophobicContact CD1-CG2 4.26Å; L708-V760 HydrophobicContact CD2-CG2 3.89Å; L708-R767 PolarHBondContact O-NH2 2.75Å
709	E	85.9	Confident	81.2	Confident	164 Å²	164	68 Å²	68	77%	0.766	39%	0.386	S	S	*	.	H	α-helix	trans	-58.1	-37.1	172.4	-169.6	-177.7	-174.4	0	0	111.6	D705	D705-E709 WeakPolarHBondContact O-CB 3.4Å; D705-E709 PolarHBondContact O-N 2.77Å
710	K	83	Confident	81.1	Confident	165 Å²	165	70.3 Å²	70.3	72%	0.717	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-0.6	179.3	-62.4	179.8	-176	177.2	0	113.7	C707 L708 V712	C707-K710 CarbonylContact O-C 3.34Å; C707-K710 PolarHBondContact O-N 3.33Å; L708-K710 PolarHBondContact O-N 2.79Å; K710-V712 PolarHBondContact O-N 2.99Å
711	W	83.4	Confident	81.2	Confident	34 Å²	34	70.8 Å²	70.8	13%	0.129	40%	0.403	C	S	.	.			trans	-78.5	122.6	-174.5	178.4	37.8	0	0	0	110.9	C707 L708 L713 S719 A721 F722 V760 T763 L764 R767	C707-W711 PolarHBondContact O-N 3.4Å; C707-W711 VanDerWaalsContact O-N 3.11Å; L708-W711 HydrophobicContact CD2-CE3 3.9Å; L708-W711 WeakPolarHBondContact O-CB 3.39Å; L708-W711 PolarHBondContact O-N 2.81Å; L708-W711 VanDerWaalsContact O-N 3.11Å; W711-L713 HydrophobicContact CH2-CD2 3.98Å; W711-L713 HydrophobicContact CZ2-CD2 4.02Å; W711-S719 VanDerWaalsContact CD1-OG 3.23Å; W711-S719 PolarHBondContact NE1-OG 3.18Å; W711-A721 HydrophobicContact CB-CB 3.87Å; W711-A721 HydrophobicContact CG-CB 4.29Å; W711-F722 AromaticContact CD2-CE2 3.83Å; W711-F722 HydrophobicContact CD2-CE2 3.83Å; W711-F722 AromaticContact CE2-CE2 3.59Å; W711-F722 HydrophobicContact CE3-CE2 4.29Å; W711-F722 HydrophobicContact CG-CE2 4.26Å; W711-F722 HydrophobicContact CH2-CE2 4.27Å; W711-F722 AromaticContact CZ2-CE2 3.84Å; W711-F722 HydrophobicContact CZ2-CE2 3.84Å; W711-F722 HydrophobicContact CZ3-CE2 4.49Å; W711-F722 AromaticContact NE1-CE2 3.89Å; W711-V760 HydrophobicContact CZ3-CG1 4.46Å; W711-T763 HydrophobicContact CE3-CG2 4.42Å; W711-L764 HydrophobicContact CH2-CD2 3.93Å; W711-L764 HydrophobicContact CZ3-CD2 4.09Å; W711-L764 HydrophobicContact CZ3-CG 4.46Å; W711-R767 VanDerWaalsContact O-CZ 3.24Å; W711-R767 PolarHBondContact O-NH1 2.99Å; W711-R767 PolarHBondContact O-NH2 3.24Å
712	V	77	Confident	81.2	Confident	91 Å²	91	70.1 Å²	70.1	55%	0.552	40%	0.399	S	S	*	.			trans	-107	133.2	173.2	-175.9	0	0	0	0	108.8	K710 S714	K710-V712 PolarHBondContact O-N 2.99Å; V712-S714 WeakPolarHBondContact CG1-OG 3.23Å
713	L	70.9	Confident	81.2	Confident	68 Å²	68	68.9 Å²	68.9	36%	0.356	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-35	-176.2	-71.2	140.5	0	0	0	112.6	W711 G715 L764 I769	W711-L713 HydrophobicContact CH2-CD2 3.98Å; W711-L713 HydrophobicContact CZ2-CD2 4.02Å; L713-G715 PolarHBondContact O-N 2.84Å; L713-L764 HydrophobicContact CD2-CD2 4.08Å; L713-I769 HydrophobicContact CD1-CD1 3.2Å; L713-I769 HydrophobicContact CD2-CD1 3.63Å; L713-I769 HydrophobicContact CG-CD1 4.03Å
714	S	66.7	Low	81.3	Confident	114 Å²	114	71.6 Å²	71.6	80%	0.797	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	32.1	-178.6	65.2	0	0	0	0	114	V712	V712-S714 WeakPolarHBondContact CG1-OG 3.23Å
715	G	65.6	Low	81.4	Confident	37 Å²	37	71.7 Å²	71.7	38%	0.381	40%	0.399	S	S	.	.	S	Bend	trans	-94.9	166.5	-175.8	0	0	0	0	0	113.8	L713	L713-G715 PolarHBondContact O-N 2.84Å
716	S	72.5	Confident	81.5	Confident	86 Å²	86	70.6 Å²	70.6	60%	0.601	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-58.4	150.1	163.8	51.9	0	0	0	0	110.7	P718 S719	S716-P718 CarbonylContact O-C 3.54Å; S716-S719 WeakPolarHBondContact O-CA 3.26Å; S716-S719 PolarHBondContact O-N 3.21Å
717	I	72.4	Confident	81.7	Confident	138 Å²	138	74.8 Å²	74.8	71%	0.708	41%	0.411	S	S	*	.	S	Bend	trans	-101.2	121.6	173.9	-56.7	169.6	0	0	0	107.8
718	P	73.4	Confident	81.8	Confident	78 Å²	78	77.1 Å²	77.1	51%	0.506	42%	0.42	S	S	.	.	S	Bend	cis	-76.3	145.1	-3.9	30.4	-32.9	0	0	0	112.3	S716 Q723	S716-P718 CarbonylContact O-C 3.54Å; P718-Q723 HydrophobicContact CB-CG 4.21Å; P718-Q723 HydrophobicContact CG-CG 3.84Å; P718-Q723 PolarHBondContact O-NE2 3.46Å
719	S	84.4	Confident	82.1	Confident	12 Å²	12	78.4 Å²	78.4	8%	0.084	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-66.7	154.9	-179	84.3	0	0	0	0	111.4	W711 S716 A721 F722 Q723	W711-S719 VanDerWaalsContact CD1-OG 3.23Å; W711-S719 PolarHBondContact NE1-OG 3.18Å; S716-S719 WeakPolarHBondContact O-CA 3.26Å; S716-S719 PolarHBondContact O-N 3.21Å; S719-A721 PolarHBondContact O-N 3.07Å; S719-F722 PolarHBondContact O-N 3.11Å; S719-F722 WeakPolarHBondContact OG-CD2 3.32Å; S719-F722 PolarHBondContact OG-N 3.16Å; S719-Q723 WeakPolarHBondContact O-CG 3.24Å; S719-Q723 PolarHBondContact O-N 3.03Å
720	L	84.7	Confident	82.4	Confident	113 Å²	113	76.9 Å²	76.9	59%	0.592	42%	0.416	S	S	*	.	H	α-helix	trans	-55.3	-38.8	179.8	-171.1	67	0	0	0	111.6	Q723 H724	L720-Q723 PolarHBondContact O-N 3.16Å; L720-H724 PolarHBondContact O-CD2 3.02Å; L720-H724 PolarHBondContact O-N 3.14Å
721	A	86.4	Confident	82.8	Confident	14 Å²	14	76.5 Å²	76.5	12%	0.116	41%	0.41	C	S	.	.	H	α-helix	trans	-58.4	-49.3	175	0	0	0	0	0	112.3	C707 W711 S719 H724 L725	C707-A721 HydrophobicContact CB-CB 4.38Å; C707-A721 WeakPolarHBondContact O-CB 3.13Å; W711-A721 HydrophobicContact CB-CB 3.87Å; W711-A721 HydrophobicContact CG-CB 4.29Å; S719-A721 PolarHBondContact O-N 3.07Å; A721-H724 PolarHBondContact O-N 2.89Å; A721-L725 PolarHBondContact O-N 3.49Å
722	F	87.2	Confident	83.2	Confident	66 Å²	66	75.3 Å²	75.3	29%	0.289	41%	0.406	S	S	.	.	H	α-helix	trans	-70.4	-31.9	177.8	-80.1	-77.3	0	0	0	112.8	L708 W711 S719 H724 L725 A726 V760	L708-F722 HydrophobicContact CD2-CZ 4.18Å; W711-F722 AromaticContact CD2-CE2 3.83Å; W711-F722 HydrophobicContact CD2-CE2 3.83Å; W711-F722 AromaticContact CE2-CE2 3.59Å; W711-F722 HydrophobicContact CE3-CE2 4.29Å; W711-F722 HydrophobicContact CG-CE2 4.26Å; W711-F722 HydrophobicContact CH2-CE2 4.27Å; W711-F722 AromaticContact CZ2-CE2 3.84Å; W711-F722 HydrophobicContact CZ2-CE2 3.84Å; W711-F722 HydrophobicContact CZ3-CE2 4.49Å; W711-F722 AromaticContact NE1-CE2 3.89Å; S719-F722 PolarHBondContact O-N 3.11Å; S719-F722 WeakPolarHBondContact OG-CD2 3.32Å; S719-F722 PolarHBondContact OG-N 3.16Å; F722-H724 VanDerWaalsContact C-N 3.34Å; F722-L725 HydrophobicContact CD1-CD2 4.23Å; F722-L725 HydrophobicContact CE1-CD2 4.4Å; F722-L725 PolarHBondContact O-N 2.99Å; F722-A726 VanDerWaalsContact O-CB 3.3Å; F722-A726 WeakPolarHBondContact O-CB 3.25Å; F722-A726 PolarHBondContact O-N 2.61Å; F722-V760 HydrophobicContact CE1-CG2 4.09Å; F722-V760 HydrophobicContact CZ-CG2 3.79Å
723	Q	88.4	Confident	84	Confident	72 Å²	72	75 Å²	75	34%	0.336	40%	0.395	S	S	.	.	H	α-helix	trans	-62.4	-41.9	170.9	-68.4	179.7	27.9	0	0	111.5	P718 S719 L720 K727	P718-Q723 HydrophobicContact CB-CG 4.21Å; P718-Q723 HydrophobicContact CG-CG 3.84Å; P718-Q723 PolarHBondContact O-NE2 3.46Å; S719-Q723 WeakPolarHBondContact O-CG 3.24Å; S719-Q723 PolarHBondContact O-N 3.03Å; L720-Q723 PolarHBondContact O-N 3.16Å; Q723-K727 WeakPolarHBondContact O-CG 3.42Å; Q723-K727 PolarHBondContact O-N 3.37Å; Q723-K727 VanDerWaalsContact O-N 3.08Å
724	H	89.1	Confident	85.1	Confident	90 Å²	90	74.4 Å²	74.4	42%	0.417	39%	0.392	S	S	.	.	H	α-helix	trans	-65.6	-44.9	174.6	-83	-74.3	0	0	0	111.8	L720 A721 F722 A726 K727 Q728	L720-H724 PolarHBondContact O-CD2 3.02Å; L720-H724 PolarHBondContact O-N 3.14Å; A721-H724 PolarHBondContact O-N 2.89Å; F722-H724 VanDerWaalsContact C-N 3.34Å; H724-A726 PolarHBondContact O-N 2.83Å; H724-K727 WeakPolarHBondContact O-CB 3.34Å; H724-K727 PolarHBondContact O-N 3.42Å; H724-Q728 WeakPolarHBondContact O-CG 3.46Å; H724-Q728 PolarHBondContact O-N 2.96Å
725	L	89.6	Confident	86.4	Confident	8 Å²	8	71.7 Å²	71.7	4%	0.042	37%	0.369	C	S	.	.	H	α-helix	trans	-59.3	-47.9	176.6	179.9	59.8	0	0	0	111.5	V704 C707 A721 F722 K727 Q728 V729 I756	V704-L725 HydrophobicContact CB-CD1 4.39Å; V704-L725 HydrophobicContact CG2-CD1 3.51Å; V704-L725 HydrophobicContact CG2-CD2 4.13Å; V704-L725 HydrophobicContact CG2-CG 4.47Å; C707-L725 HydrophobicContact CB-CB 4.42Å; A721-L725 PolarHBondContact O-N 3.49Å; F722-L725 HydrophobicContact CD1-CD2 4.23Å; F722-L725 HydrophobicContact CE1-CD2 4.4Å; F722-L725 PolarHBondContact O-N 2.99Å; L725-K727 VanDerWaalsContact C-N 3.29Å; L725-K727 PolarHBondContact O-N 3.22Å; L725-Q728 PolarHBondContact O-N 3.49Å; L725-V729 HydrophobicContact CD1-CG2 4.22Å; L725-V729 HydrophobicContact CG-CG2 4.44Å; L725-V729 WeakPolarHBondContact O-CG2 3.48Å; L725-V729 PolarHBondContact O-N 3.37Å; L725-I756 HydrophobicContact CD2-CD1 4.2Å; L725-I756 HydrophobicContact CD2-CG1 4.26Å; L725-I756 HydrophobicContact CD2-CG2 4.13Å
726	A	89.2	Confident	87.8	Confident	60 Å²	60	70 Å²	70	50%	0.496	35%	0.351	S	S	.	.	H	α-helix	trans	-58.3	-41	177.1	0	0	0	0	0	112	F722 H724 R730	F722-A726 VanDerWaalsContact O-CB 3.3Å; F722-A726 WeakPolarHBondContact O-CB 3.25Å; F722-A726 PolarHBondContact O-N 2.61Å; H724-A726 PolarHBondContact O-N 2.83Å; A726-R730 VanDerWaalsContact O-CB 3.25Å; A726-R730 WeakPolarHBondContact O-CB 3.38Å; A726-R730 PolarHBondContact O-N 3.05Å
727	K	91.9	Very high	88.9	Confident	134 Å²	134	70.5 Å²	70.5	58%	0.583	34%	0.34	S	S	*	.	H	α-helix	trans	-62.2	-41	173.9	-75.7	174.3	-178.8	175.2	0	112.3	Q723 H724 L725 R731	Q723-K727 WeakPolarHBondContact O-CG 3.42Å; Q723-K727 PolarHBondContact O-N 3.37Å; Q723-K727 VanDerWaalsContact O-N 3.08Å; H724-K727 WeakPolarHBondContact O-CB 3.34Å; H724-K727 PolarHBondContact O-N 3.42Å; L725-K727 VanDerWaalsContact C-N 3.29Å; L725-K727 PolarHBondContact O-N 3.22Å; K727-R731 WeakPolarHBondContact O-CB 3.38Å; K727-R731 PolarHBondContact O-N 3.03Å
728	Q	90.5	Very high	89.9	Confident	68 Å²	68	68.4 Å²	68.4	32%	0.318	33%	0.33	S	S	.	.	H	α-helix	trans	-69.7	-43.7	178.2	-64.8	-55.8	-22.7	0	0	112.5	L700 H724 L725 R730 R731 L732	L700-Q728 HydrophobicContact CD2-CB 4.03Å; H724-Q728 WeakPolarHBondContact O-CG 3.46Å; H724-Q728 PolarHBondContact O-N 2.96Å; L725-Q728 PolarHBondContact O-N 3.49Å; Q728-R730 VanDerWaalsContact C-N 3.29Å; Q728-R730 PolarHBondContact O-N 3.37Å; Q728-R731 PolarHBondContact O-N 3.42Å; Q728-L732 PolarHBondContact O-N 2.79Å
729	V	91.4	Very high	91	Very high	34 Å²	34	65.1 Å²	65.1	21%	0.206	31%	0.308	C	S	.	.	H	α-helix	trans	-59.3	-44.1	174.3	174.3	0	0	0	0	110.2	L700 L725 R731 L732 Y733 M749 I756	L700-V729 HydrophobicContact CD1-CG2 4.24Å; L700-V729 HydrophobicContact CD2-CG2 4.32Å; L725-V729 HydrophobicContact CD1-CG2 4.22Å; L725-V729 HydrophobicContact CG-CG2 4.44Å; L725-V729 WeakPolarHBondContact O-CG2 3.48Å; L725-V729 PolarHBondContact O-N 3.37Å; V729-R731 PolarHBondContact O-N 3.5Å; V729-L732 PolarHBondContact O-N 3.46Å; V729-Y733 PolarHBondContact O-N 3.47Å; V729-M749 HydrophobicContact CG1-SD 4.27Å; V729-I756 HydrophobicContact CG2-CD1 4.38Å
730	R	92.5	Very high	91.5	Very high	133 Å²	133	65.2 Å²	65.2	50%	0.502	31%	0.307	S	S	.	.	H	α-helix	trans	-62.9	-42	177.1	-177.2	60.1	-172.4	-155.4	-1.3	112.2	A726 Q728 Y733 D734	A726-R730 VanDerWaalsContact O-CB 3.25Å; A726-R730 WeakPolarHBondContact O-CB 3.38Å; A726-R730 PolarHBondContact O-N 3.05Å; Q728-R730 VanDerWaalsContact C-N 3.29Å; Q728-R730 PolarHBondContact O-N 3.37Å; R730-Y733 WeakPolarHBondContact O-CB 3.46Å; R730-Y733 PolarHBondContact O-N 3.31Å; R730-D734 WeakPolarHBondContact CG-OD2 3.09Å; R730-D734 IonicContact CZ-OD1 3.4Å; R730-D734 IonicContact CZ-OD2 3.83Å; R730-D734 IonicContact NE-OD1 3.14Å; R730-D734 PolarHBondContact NE-OD1 3Å; R730-D734 VanDerWaalsContact NE-OD1 3.14Å; R730-D734 IonicContact NE-OD2 2.9Å; R730-D734 PolarHBondContact NE-OD2 3.26Å; R730-D734 IonicContact NH2-OD1 2.69Å; R730-D734 PolarHBondContact NH2-OD1 2.91Å; R730-D734 IonicContact NH2-OD2 3.84Å; R730-D734 WeakPolarHBondContact O-CB 3.32Å; R730-D734 PolarHBondContact O-N 3.35Å
731	R	92.2	Very high	92	Very high	157 Å²	157	61.1 Å²	61.1	59%	0.592	29%	0.287	S	S	*	.	H	α-helix	trans	-62.6	-42	176.2	-173.5	-179.6	-176.6	-170.9	1.2	111.9	K727 Q728 V729 N735	K727-R731 WeakPolarHBondContact O-CB 3.38Å; K727-R731 PolarHBondContact O-N 3.03Å; Q728-R731 PolarHBondContact O-N 3.42Å; V729-R731 PolarHBondContact O-N 3.5Å; R731-N735 VanDerWaalsContact O-CB 3.32Å; R731-N735 WeakPolarHBondContact O-CB 3.32Å; R731-N735 PolarHBondContact O-N 3.37Å; R731-N735 VanDerWaalsContact O-N 3.08Å; R731-N735 PolarHBondContact O-ND2 3.38Å
732	L	91.5	Very high	92.3	Very high	8 Å²	8	67.6 Å²	67.6	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-60.6	-50	174.2	-177	67.3	0	0	0	110.3	L696 L700 Q728 V729 D734 N735 T736 L748 L752	L696-L732 HydrophobicContact CD2-CD1 4.15Å; L700-L732 HydrophobicContact CD1-CB 4.04Å; L700-L732 HydrophobicContact CD1-CD2 3.18Å; L700-L732 HydrophobicContact CD1-CG 4.2Å; L700-L732 HydrophobicContact CG-CB 4.48Å; L700-L732 HydrophobicContact CG-CD2 3.79Å; Q728-L732 PolarHBondContact O-N 2.79Å; V729-L732 PolarHBondContact O-N 3.46Å; L732-D734 PolarHBondContact O-N 3.31Å; L732-N735 PolarHBondContact O-N 2.94Å; L732-T736 HydrophobicContact CD1-CG2 4Å; L732-T736 PolarHBondContact O-N 2.91Å; L732-T736 PolarHBondContact O-OG1 3.39Å; L732-L748 HydrophobicContact CD2-CD2 4.12Å; L732-L752 HydrophobicContact CD2-CD1 4.14Å
733	Y	93.6	Very high	92.6	Very high	86 Å²	86	68.7 Å²	68.7	34%	0.337	33%	0.327	S	S	.	.	H	α-helix	trans	-54.4	-53	178.1	178.8	-105.5	0	0	0	112.3	V729 R730 N735 T736 R737 M745 M749	V729-Y733 PolarHBondContact O-N 3.47Å; R730-Y733 WeakPolarHBondContact O-CB 3.46Å; R730-Y733 PolarHBondContact O-N 3.31Å; Y733-N735 PolarHBondContact O-N 2.88Å; Y733-T736 PolarHBondContact O-N 2.94Å; Y733-R737 HydrophobicContact CD2-CB 4.22Å; Y733-R737 HydrophobicContact CE1-CB 4.35Å; Y733-R737 HydrophobicContact CE1-CG 4.47Å; Y733-R737 HydrophobicContact CE2-CB 3.93Å; Y733-R737 WeakPolarHBondContact O-CB 3.32Å; Y733-R737 WeakPolarHBondContact O-CG 3.29Å; Y733-R737 PolarHBondContact O-N 3.42Å; Y733-M745 HydrophobicContact CD2-CE 3.44Å; Y733-M745 VanDerWaalsContact CD2-CE 3.44Å; Y733-M745 HydrophobicContact CE2-CE 3.97Å; Y733-M745 HydrophobicContact CG-CE 4.42Å; Y733-M749 HydrophobicContact CD2-CE 3.63Å; Y733-M749 HydrophobicContact CG-CE 4.06Å
734	D	95.2	Very high	92.8	Very high	55 Å²	55	66.3 Å²	66.3	29%	0.294	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-32.5	-177.9	-72.1	-33.8	0	0	0	111.7	R730 L732 R737	R730-D734 WeakPolarHBondContact CG-OD2 3.09Å; R730-D734 IonicContact CZ-OD1 3.4Å; R730-D734 IonicContact CZ-OD2 3.83Å; R730-D734 IonicContact NE-OD1 3.14Å; R730-D734 PolarHBondContact NE-OD1 3Å; R730-D734 VanDerWaalsContact NE-OD1 3.14Å; R730-D734 IonicContact NE-OD2 2.9Å; R730-D734 PolarHBondContact NE-OD2 3.26Å; R730-D734 IonicContact NH2-OD1 2.69Å; R730-D734 PolarHBondContact NH2-OD1 2.91Å; R730-D734 IonicContact NH2-OD2 3.84Å; R730-D734 WeakPolarHBondContact O-CB 3.32Å; R730-D734 PolarHBondContact O-N 3.35Å; L732-D734 PolarHBondContact O-N 3.31Å; D734-R737 IonicContact OD1-CZ 2.83Å; D734-R737 IonicContact OD1-NH1 3.42Å; D734-R737 PolarHBondContact OD1-NH1 3.32Å
735	N	93.8	Very high	93	Very high	57 Å²	57	62.6 Å²	62.6	31%	0.305	30%	0.3	S	S	.	.	H	α-helix	trans	-74.4	-29.1	177.2	-74.3	-9.9	0	0	0	113.9	S639 V640 R731 L732 Y733 I739	S639-N735 WeakPolarHBondContact OG-CB 3.46Å; S639-N735 PolarHBondContact OG-ND2 3.28Å; V640-N735 HydrophobicContact CG2-CB 3.81Å; R731-N735 VanDerWaalsContact O-CB 3.32Å; R731-N735 WeakPolarHBondContact O-CB 3.32Å; R731-N735 PolarHBondContact O-N 3.37Å; R731-N735 VanDerWaalsContact O-N 3.08Å; R731-N735 PolarHBondContact O-ND2 3.38Å; L732-N735 PolarHBondContact O-N 2.94Å; Y733-N735 PolarHBondContact O-N 2.88Å; N735-I739 WeakPolarHBondContact O-CD1 3.19Å
736	T	94.6	Very high	93.2	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-112	-22	-170.6	62.5	0	0	0	0	114.5	A643 L732 Y733 D738 I739 L740 M745	A643-T736 HydrophobicContact CB-CG2 4.01Å; L732-T736 HydrophobicContact CD1-CG2 4Å; L732-T736 PolarHBondContact O-N 2.91Å; L732-T736 PolarHBondContact O-OG1 3.39Å; Y733-T736 PolarHBondContact O-N 2.94Å; T736-D738 VanDerWaalsContact C-N 3.26Å; T736-D738 PolarHBondContact O-N 3.19Å; T736-I739 PolarHBondContact O-N 2.91Å; T736-L740 PolarHBondContact O-N 2.89Å; T736-M745 WeakPolarHBondContact OG1-CE 3.2Å; T736-M745 PolarHBondContact OG1-SD 2.75Å
737	R	94.4	Very high	93.4	Very high	98 Å²	98	69 Å²	69	37%	0.37	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-33.2	-174.3	69.5	176.3	-166.9	-148.5	-9.3	114.3	Y733 D734 I739 M745	Y733-R737 HydrophobicContact CD2-CB 4.22Å; Y733-R737 HydrophobicContact CE1-CB 4.35Å; Y733-R737 HydrophobicContact CE1-CG 4.47Å; Y733-R737 HydrophobicContact CE2-CB 3.93Å; Y733-R737 WeakPolarHBondContact O-CB 3.32Å; Y733-R737 WeakPolarHBondContact O-CG 3.29Å; Y733-R737 PolarHBondContact O-N 3.42Å; D734-R737 IonicContact OD1-CZ 2.83Å; D734-R737 IonicContact OD1-NH1 3.42Å; D734-R737 PolarHBondContact OD1-NH1 3.32Å; R737-I739 PolarHBondContact O-N 2.9Å; R737-M745 HydrophobicContact CB-CE 4.49Å
738	D	93.5	Very high	93.3	Very high	94 Å²	94	63.2 Å²	63.2	50%	0.503	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	5.9	-177.7	-61	-24	0	0	0	111.5	R527 T736	R527-D738 PolarHBondContact NH2-O 2.97Å; T736-D738 VanDerWaalsContact C-N 3.26Å; T736-D738 PolarHBondContact O-N 3.19Å
739	I	97.1	Very high	93.3	Very high	9 Å²	9	62.2 Å²	62.2	5%	0.046	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-54.7	-175	-56.2	170.6	0	0	0	109.5	V575 V640 A643 L644 R647 N735 T736 R737	V575-I739 HydrophobicContact CB-CG2 4.17Å; V575-I739 HydrophobicContact CG1-CB 4.42Å; V575-I739 HydrophobicContact CG1-CG1 4.14Å; V575-I739 HydrophobicContact CG1-CG2 4.18Å; V640-I739 HydrophobicContact CG1-CD1 3.87Å; A643-I739 HydrophobicContact CB-CB 4.13Å; A643-I739 HydrophobicContact CB-CD1 4.17Å; A643-I739 HydrophobicContact CB-CG2 3.77Å; L644-I739 HydrophobicContact CD2-CD1 4.28Å; L644-I739 HydrophobicContact CD2-CG1 4.49Å; L644-I739 HydrophobicContact CD2-CG2 3.94Å; L644-I739 HydrophobicContact CG-CD1 4.17Å; L644-I739 HydrophobicContact CG-CG2 4.3Å; R647-I739 WeakPolarHBondContact CD-O 3.33Å; R647-I739 HydrophobicContact CG-CG2 3.82Å; R647-I739 VanDerWaalsContact CG-O 3.24Å; R647-I739 WeakPolarHBondContact CG-O 3.44Å; R647-I739 PolarHBondContact NE-O 3.39Å; N735-I739 WeakPolarHBondContact O-CD1 3.19Å; T736-I739 PolarHBondContact O-N 2.91Å; R737-I739 PolarHBondContact O-N 2.9Å
740	L	95.8	Very high	93.4	Very high	13 Å²	13	64.6 Å²	64.6	7%	0.068	31%	0.308	C	S	.	.	S	Bend	trans	-73.7	156.6	179.7	-63.4	-175.9	0	0	0	111.7	A643 C646 R647 L696 T736 D744 M745 L748	A643-L740 HydrophobicContact CB-CD2 3.97Å; A643-L740 HydrophobicContact CB-CG 4.03Å; C646-L740 HydrophobicContact CB-CD2 4.39Å; R647-L740 HydrophobicContact CG-CD2 4.14Å; L696-L740 HydrophobicContact CD1-CD1 4.27Å; T736-L740 PolarHBondContact O-N 2.89Å; L740-D744 HydrophobicContact CB-CB 4.3Å; L740-M745 HydrophobicContact CB-CG 3.79Å; L740-M745 HydrophobicContact CB-SD 3.82Å; L740-M745 HydrophobicContact CD1-SD 3.72Å; L740-M745 HydrophobicContact CG-SD 4.25Å; L740-L748 HydrophobicContact CD1-CD2 4.46Å
741	T	94.7	Very high	93.3	Very high	27 Å²	27	62.5 Å²	62.5	17%	0.166	30%	0.303	C	S	.	.			trans	-68.7	158.8	173.1	66.1	0	0	0	0	110.5	E572 T743 D744 M745	E572-T741 WeakPolarHBondContact OE1-CG2 3.32Å; T741-T743 PolarHBondContact O-N 2.85Å; T741-D744 PolarHBondContact O-N 3.31Å; T741-D744 VanDerWaalsContact OG1-CB 3.3Å; T741-D744 WeakPolarHBondContact OG1-CB 3.45Å; T741-D744 PolarHBondContact OG1-N 2.95Å; T741-D744 PolarHBondContact OG1-OD2 2.82Å; T741-M745 WeakPolarHBondContact O-CB 3.45Å; T741-M745 WeakPolarHBondContact O-CG 3.46Å; T741-M745 PolarHBondContact O-N 3.11Å
742	E	92.4	Very high	93	Very high	151 Å²	151	55.4 Å²	55.4	71%	0.706	28%	0.276	S	S	*	.	H	α-helix	trans	-59.2	-40.8	175.3	-170	175.8	175	0	0	111.1	M745 Q746	E742-M745 PolarHBondContact O-N 3.49Å; E742-Q746 HydrophobicContact CG-CG 4.48Å; E742-Q746 WeakPolarHBondContact O-CB 3.44Å; E742-Q746 VanDerWaalsContact O-CG 3.27Å; E742-Q746 WeakPolarHBondContact O-CG 3.45Å; E742-Q746 PolarHBondContact O-N 2.86Å; E742-Q746 PolarHBondContact OE1-NE2 3.19Å
743	T	93.3	Very high	92.9	Very high	88 Å²	88	62 Å²	62	54%	0.54	30%	0.301	S	S	.	.	H	α-helix	trans	-61.6	-47.3	176.2	-45.4	0	0	0	0	112.2	T741 M745 Q746 N747	T741-T743 PolarHBondContact O-N 2.85Å; T743-M745 VanDerWaalsContact C-N 3.32Å; T743-M745 PolarHBondContact O-N 3.21Å; T743-Q746 PolarHBondContact O-N 2.8Å; T743-N747 WeakPolarHBondContact O-CB 3.46Å; T743-N747 VanDerWaalsContact O-CG 3.26Å; T743-N747 PolarHBondContact O-N 3.17Å; T743-N747 PolarHBondContact O-ND2 3.4Å
744	D	93.4	Very high	92.8	Very high	22 Å²	22	61.2 Å²	61.2	12%	0.118	30%	0.303	C	S	.	.	H	α-helix	trans	-63.5	-39.9	177.5	-70.7	-38.4	0	0	0	111.3	Q650 Q693 L740 T741 N747 L748	Q650-D744 PolarHBondContact NE2-OD2 2.83Å; Q693-D744 PolarHBondContact NE2-OD1 3.18Å; L740-D744 HydrophobicContact CB-CB 4.3Å; T741-D744 PolarHBondContact O-N 3.31Å; T741-D744 VanDerWaalsContact OG1-CB 3.3Å; T741-D744 WeakPolarHBondContact OG1-CB 3.45Å; T741-D744 PolarHBondContact OG1-N 2.95Å; T741-D744 PolarHBondContact OG1-OD2 2.82Å; D744-N747 PolarHBondContact O-N 3.27Å; D744-L748 VanDerWaalsContact O-CB 3.3Å; D744-L748 WeakPolarHBondContact O-CB 3.43Å; D744-L748 PolarHBondContact O-N 3.18Å
745	M	93.4	Very high	92.4	Very high	12 Å²	12	59.5 Å²	59.5	6%	0.059	30%	0.299	C	S	.	.	H	α-helix	trans	-65.3	-42.8	176.2	-76.6	-57.3	-56.7	0	0	112.2	Y733 T736 R737 L740 T741 E742 T743 L748 M749	Y733-M745 HydrophobicContact CD2-CE 3.44Å; Y733-M745 VanDerWaalsContact CD2-CE 3.44Å; Y733-M745 HydrophobicContact CE2-CE 3.97Å; Y733-M745 HydrophobicContact CG-CE 4.42Å; T736-M745 WeakPolarHBondContact OG1-CE 3.2Å; T736-M745 PolarHBondContact OG1-SD 2.75Å; R737-M745 HydrophobicContact CB-CE 4.49Å; L740-M745 HydrophobicContact CB-CG 3.79Å; L740-M745 HydrophobicContact CB-SD 3.82Å; L740-M745 HydrophobicContact CD1-SD 3.72Å; L740-M745 HydrophobicContact CG-SD 4.25Å; T741-M745 WeakPolarHBondContact O-CB 3.45Å; T741-M745 WeakPolarHBondContact O-CG 3.46Å; T741-M745 PolarHBondContact O-N 3.11Å; E742-M745 PolarHBondContact O-N 3.49Å; T743-M745 VanDerWaalsContact C-N 3.32Å; T743-M745 PolarHBondContact O-N 3.21Å; M745-L748 PolarHBondContact O-N 3.2Å; M745-M749 HydrophobicContact CE-CE 3.76Å; M745-M749 WeakPolarHBondContact O-CB 3.36Å; M745-M749 VanDerWaalsContact O-CG 3.24Å; M745-M749 WeakPolarHBondContact O-CG 3.44Å; M745-M749 PolarHBondContact O-N 2.95Å
746	Q	93.5	Very high	92.1	Very high	104 Å²	104	58.5 Å²	58.5	49%	0.486	29%	0.293	S	S	.	.	H	α-helix	trans	-62.3	-47.2	175.5	-74.6	176.3	8.2	0	0	110.8	E742 T743 L748 M749 V750	E742-Q746 HydrophobicContact CG-CG 4.48Å; E742-Q746 WeakPolarHBondContact O-CB 3.44Å; E742-Q746 VanDerWaalsContact O-CG 3.27Å; E742-Q746 WeakPolarHBondContact O-CG 3.45Å; E742-Q746 PolarHBondContact O-N 2.86Å; E742-Q746 PolarHBondContact OE1-NE2 3.19Å; T743-Q746 PolarHBondContact O-N 2.8Å; Q746-L748 VanDerWaalsContact C-N 3.34Å; Q746-L748 PolarHBondContact O-N 3.44Å; Q746-M749 PolarHBondContact O-N 2.8Å; Q746-V750 WeakPolarHBondContact O-CB 3.32Å; Q746-V750 VanDerWaalsContact O-CG2 3.31Å; Q746-V750 WeakPolarHBondContact O-CG2 3.15Å; Q746-V750 PolarHBondContact O-N 3.41Å
747	N	92.4	Very high	91.8	Very high	98 Å²	98	66.3 Å²	66.3	52%	0.524	32%	0.322	S	S	.	.	H	α-helix	trans	-59.2	-45.2	177.4	-73.5	-23.3	0	0	0	111.8	T743 D744 K751	T743-N747 WeakPolarHBondContact O-CB 3.46Å; T743-N747 VanDerWaalsContact O-CG 3.26Å; T743-N747 PolarHBondContact O-N 3.17Å; T743-N747 PolarHBondContact O-ND2 3.4Å; D744-N747 PolarHBondContact O-N 3.27Å; N747-K751 VanDerWaalsContact O-CB 3.26Å; N747-K751 WeakPolarHBondContact O-CB 3.34Å; N747-K751 PolarHBondContact O-N 3.32Å
748	L	90.5	Very high	91.6	Very high	14 Å²	14	69.2 Å²	69.2	7%	0.073	34%	0.338	C	S	.	.	H	α-helix	trans	-60.5	-47.8	175.5	-178.3	62.1	0	0	0	110.9	L696 F697 L732 L740 D744 M745 Q746 K751 L752	L696-L748 HydrophobicContact CB-CD1 4.22Å; F697-L748 HydrophobicContact CB-CD1 4.34Å; L732-L748 HydrophobicContact CD2-CD2 4.12Å; L740-L748 HydrophobicContact CD1-CD2 4.46Å; D744-L748 VanDerWaalsContact O-CB 3.3Å; D744-L748 WeakPolarHBondContact O-CB 3.43Å; D744-L748 PolarHBondContact O-N 3.18Å; M745-L748 PolarHBondContact O-N 3.2Å; Q746-L748 VanDerWaalsContact C-N 3.34Å; Q746-L748 PolarHBondContact O-N 3.44Å; L748-K751 PolarHBondContact O-N 2.74Å; L748-L752 HydrophobicContact CD1-CD1 4.17Å; L748-L752 HydrophobicContact CD1-CG 4.37Å; L748-L752 HydrophobicContact CG-CD1 3.88Å; L748-L752 WeakPolarHBondContact O-CB 3.44Å; L748-L752 WeakPolarHBondContact O-CD1 3.38Å; L748-L752 WeakPolarHBondContact O-CG 3.31Å; L748-L752 PolarHBondContact O-N 3.04Å
749	M	90.9	Very high	91.3	Very high	47 Å²	47	65.7 Å²	65.7	23%	0.232	32%	0.321	C	S	.	.	H	α-helix	trans	-67.2	-39.1	-178.6	-71.5	-57.3	171.3	0	0	113.6	V729 Y733 M745 Q746 L752 Y753	V729-M749 HydrophobicContact CG1-SD 4.27Å; Y733-M749 HydrophobicContact CD2-CE 3.63Å; Y733-M749 HydrophobicContact CG-CE 4.06Å; M745-M749 HydrophobicContact CE-CE 3.76Å; M745-M749 WeakPolarHBondContact O-CB 3.36Å; M745-M749 VanDerWaalsContact O-CG 3.24Å; M745-M749 WeakPolarHBondContact O-CG 3.44Å; M745-M749 PolarHBondContact O-N 2.95Å; Q746-M749 PolarHBondContact O-N 2.8Å; M749-L752 PolarHBondContact O-N 3.49Å; M749-L752 HydrophobicContact SD-CD1 3.88Å; M749-Y753 WeakPolarHBondContact O-CB 3.16Å; M749-Y753 PolarHBondContact O-N 3.32Å
750	V	92.1	Very high	90.8	Very high	84 Å²	84	66.5 Å²	66.5	51%	0.509	33%	0.327	S	S	.	.	H	α-helix	trans	-65	-43.6	174.8	170.7	0	0	0	0	110.3	Q746 L752 Y753 N754	Q746-V750 WeakPolarHBondContact O-CB 3.32Å; Q746-V750 VanDerWaalsContact O-CG2 3.31Å; Q746-V750 WeakPolarHBondContact O-CG2 3.15Å; Q746-V750 PolarHBondContact O-N 3.41Å; V750-L752 VanDerWaalsContact C-N 3.34Å; V750-L752 PolarHBondContact O-N 3Å; V750-Y753 PolarHBondContact O-N 3.46Å; V750-N754 WeakPolarHBondContact O-CB 3.34Å; V750-N754 VanDerWaalsContact O-CG 3.29Å; V750-N754 PolarHBondContact O-N 3.49Å; V750-N754 PolarHBondContact O-ND2 3.39Å
751	K	90.5	Very high	90.3	Very high	89 Å²	89	68 Å²	68	39%	0.387	34%	0.341	S	S	.	.	H	α-helix	trans	-61.3	-44.5	176.7	-166.2	175.9	179.1	170.8	0	111.2	F697 N747 L748 N754 G755	F697-K751 HydrophobicContact CB-CD 4.45Å; F697-K751 HydrophobicContact CD2-CB 4.2Å; F697-K751 HydrophobicContact CD2-CD 3.98Å; F697-K751 HydrophobicContact CD2-CG 3.67Å; F697-K751 HydrophobicContact CE2-CB 4.42Å; F697-K751 HydrophobicContact CE2-CD 4.48Å; F697-K751 HydrophobicContact CE2-CG 3.78Å; F697-K751 WeakPolarHBondContact CE2-O 3.45Å; F697-K751 HydrophobicContact CG-CD 4.13Å; F697-K751 HydrophobicContact CG-CG 4.29Å; F697-K751 HydrophobicContact CZ-CG 4.45Å; N747-K751 VanDerWaalsContact O-CB 3.26Å; N747-K751 WeakPolarHBondContact O-CB 3.34Å; N747-K751 PolarHBondContact O-N 3.32Å; L748-K751 PolarHBondContact O-N 2.74Å; K751-N754 PolarHBondContact O-N 3.12Å; K751-G755 PolarHBondContact O-N 3.33Å
752	L	87.2	Confident	90	Very high	7 Å²	7	69.1 Å²	69.1	4%	0.037	35%	0.353	C	S	.	.	H	α-helix	trans	-61.1	-48.6	175.3	-71.5	167.1	0	0	0	112.5	F697 L700 L732 L748 M749 V750 N754 G755 I756	F697-L752 HydrophobicContact CD2-CD2 3.59Å; F697-L752 HydrophobicContact CD2-CG 4.07Å; F697-L752 HydrophobicContact CE2-CD2 4.05Å; F697-L752 HydrophobicContact CG-CD2 4.48Å; L700-L752 HydrophobicContact CB-CD2 3.47Å; L700-L752 VanDerWaalsContact CB-CD2 3.47Å; L700-L752 HydrophobicContact CD1-CD1 3.36Å; L700-L752 HydrophobicContact CD1-CD2 3.41Å; L700-L752 VanDerWaalsContact CD1-CD2 3.41Å; L700-L752 HydrophobicContact CD1-CG 3.99Å; L700-L752 HydrophobicContact CG-CD2 4.08Å; L732-L752 HydrophobicContact CD2-CD1 4.14Å; L748-L752 HydrophobicContact CD1-CD1 4.17Å; L748-L752 HydrophobicContact CD1-CG 4.37Å; L748-L752 HydrophobicContact CG-CD1 3.88Å; L748-L752 WeakPolarHBondContact O-CB 3.44Å; L748-L752 WeakPolarHBondContact O-CD1 3.38Å; L748-L752 WeakPolarHBondContact O-CG 3.31Å; L748-L752 PolarHBondContact O-N 3.04Å; M749-L752 PolarHBondContact O-N 3.49Å; M749-L752 HydrophobicContact SD-CD1 3.88Å; V750-L752 VanDerWaalsContact C-N 3.34Å; V750-L752 PolarHBondContact O-N 3Å; L752-N754 VanDerWaalsContact C-N 3.33Å; L752-N754 PolarHBondContact O-N 3.33Å; L752-G755 PolarHBondContact O-N 3.36Å; L752-I756 VanDerWaalsContact O-CG1 3.28Å; L752-I756 WeakPolarHBondContact O-CG1 3.22Å; L752-I756 PolarHBondContact O-N 3.4Å
753	Y	89.4	Confident	89.7	Confident	146 Å²	146	63.2 Å²	63.2	57%	0.573	33%	0.328	S	S	*	.	H	α-helix	trans	-57.8	-46.2	177	174.2	-98.9	0	0	0	111.7	M749 V750 G755 I756 R757	M749-Y753 WeakPolarHBondContact O-CB 3.16Å; M749-Y753 PolarHBondContact O-N 3.32Å; V750-Y753 PolarHBondContact O-N 3.46Å; Y753-G755 VanDerWaalsContact C-N 3.34Å; Y753-G755 PolarHBondContact O-N 3.49Å; Y753-I756 PolarHBondContact O-N 2.84Å; Y753-R757 WeakPolarHBondContact O-CB 3.42Å; Y753-R757 PolarHBondContact O-N 3.06Å
754	N	90	Very high	89.2	Confident	70 Å²	70	61 Å²	61	37%	0.374	31%	0.312	S	S	.	.	H	α-helix	trans	-64.8	-38	177.3	-72.1	-28.7	0	0	0	112.3	V750 K751 L752 K758	V750-N754 WeakPolarHBondContact O-CB 3.34Å; V750-N754 VanDerWaalsContact O-CG 3.29Å; V750-N754 PolarHBondContact O-N 3.49Å; V750-N754 PolarHBondContact O-ND2 3.39Å; K751-N754 PolarHBondContact O-N 3.12Å; L752-N754 VanDerWaalsContact C-N 3.33Å; L752-N754 PolarHBondContact O-N 3.33Å; N754-K758 WeakPolarHBondContact O-CB 3.38Å; N754-K758 VanDerWaalsContact O-CG 3.31Å; N754-K758 WeakPolarHBondContact O-CG 3.1Å; N754-K758 PolarHBondContact O-N 3.12Å
755	G	88.2	Confident	88.8	Confident	19 Å²	19	66.9 Å²	66.9	20%	0.196	34%	0.339	C	S	.	.	H	α-helix	trans	-61.6	-51	173.7	0	0	0	0	0	112	K751 L752 Y753 R757 K758 A759	K751-G755 PolarHBondContact O-N 3.33Å; L752-G755 PolarHBondContact O-N 3.36Å; Y753-G755 VanDerWaalsContact C-N 3.34Å; Y753-G755 PolarHBondContact O-N 3.49Å; G755-R757 VanDerWaalsContact C-N 3.35Å; G755-R757 PolarHBondContact O-N 3.34Å; G755-K758 PolarHBondContact O-N 3.37Å; G755-A759 WeakPolarHBondContact O-CB 3.36Å; G755-A759 PolarHBondContact O-N 3.34Å
756	I	87.5	Confident	88.3	Confident	36 Å²	36	70.3 Å²	70.3	19%	0.185	37%	0.369	C	S	.	.	H	α-helix	trans	-56.9	-49.1	176.4	-66.5	164.1	0	0	0	110.4	V704 L725 V729 L752 Y753 K758 A759 V760	V704-I756 HydrophobicContact CG1-CG1 4.48Å; V704-I756 HydrophobicContact CG2-CD1 4.38Å; V704-I756 HydrophobicContact CG2-CG1 3.55Å; L725-I756 HydrophobicContact CD2-CD1 4.2Å; L725-I756 HydrophobicContact CD2-CG1 4.26Å; L725-I756 HydrophobicContact CD2-CG2 4.13Å; V729-I756 HydrophobicContact CG2-CD1 4.38Å; L752-I756 VanDerWaalsContact O-CG1 3.28Å; L752-I756 WeakPolarHBondContact O-CG1 3.22Å; L752-I756 PolarHBondContact O-N 3.4Å; Y753-I756 PolarHBondContact O-N 2.84Å; I756-K758 VanDerWaalsContact C-N 3.33Å; I756-K758 PolarHBondContact O-N 2.98Å; I756-A759 PolarHBondContact O-N 3.02Å; I756-V760 HydrophobicContact CG2-CG2 4.2Å; I756-V760 WeakPolarHBondContact O-CB 3.3Å; I756-V760 VanDerWaalsContact O-CG2 3.25Å; I756-V760 WeakPolarHBondContact O-CG2 3.44Å; I756-V760 PolarHBondContact O-N 3.43Å
757	R	88.4	Confident	87.7	Confident	164 Å²	164	69.6 Å²	69.6	62%	0.619	36%	0.362	S	S	*	.	H	α-helix	trans	-58.9	-43.9	-179.8	-176.7	179.2	174	-177.4	-0.5	111.9	Y753 G755 A761	Y753-R757 WeakPolarHBondContact O-CB 3.42Å; Y753-R757 PolarHBondContact O-N 3.06Å; G755-R757 VanDerWaalsContact C-N 3.35Å; G755-R757 PolarHBondContact O-N 3.34Å; R757-A761 WeakPolarHBondContact O-CB 3.28Å; R757-A761 PolarHBondContact O-N 2.83Å
758	K	88.9	Confident	86.9	Confident	160 Å²	160	72.1 Å²	72.1	70%	0.696	38%	0.375	S	S	*	.	H	α-helix	trans	-64.9	-45.3	177.1	-76	177.9	178.8	-175.2	0	111.9	N754 G755 I756 A761 A762	N754-K758 WeakPolarHBondContact O-CB 3.38Å; N754-K758 VanDerWaalsContact O-CG 3.31Å; N754-K758 WeakPolarHBondContact O-CG 3.1Å; N754-K758 PolarHBondContact O-N 3.12Å; G755-K758 PolarHBondContact O-N 3.37Å; I756-K758 VanDerWaalsContact C-N 3.33Å; I756-K758 PolarHBondContact O-N 2.98Å; K758-A761 PolarHBondContact O-N 3.45Å; K758-A762 WeakPolarHBondContact O-CB 3.42Å; K758-A762 PolarHBondContact O-N 3.12Å
759	A	88.1	Confident	85.9	Confident	19 Å²	19	73.2 Å²	73.2	16%	0.157	38%	0.381	C	S	.	.	H	α-helix	trans	-63.7	-42.1	179.6	0	0	0	0	0	112	V704 L708 G755 I756 A762 T763	V704-A759 HydrophobicContact CG1-CB 3.75Å; L708-A759 HydrophobicContact CD1-CB 3.63Å; G755-A759 WeakPolarHBondContact O-CB 3.36Å; G755-A759 PolarHBondContact O-N 3.34Å; I756-A759 PolarHBondContact O-N 3.02Å; A759-A762 PolarHBondContact O-N 3.48Å; A759-T763 WeakPolarHBondContact O-CB 3.48Å; A759-T763 PolarHBondContact O-N 3.43Å; A759-T763 PolarHBondContact O-OG1 2.88Å
760	V	85.9	Confident	84.3	Confident	26 Å²	26	76.8 Å²	76.8	16%	0.158	40%	0.401	C	S	.	.	H	α-helix	trans	-64.1	-46.6	175.5	173.3	0	0	0	0	111.1	L708 W711 F722 I756 A762 T763 L764	L708-V760 HydrophobicContact CD1-CG2 4.26Å; L708-V760 HydrophobicContact CD2-CG2 3.89Å; W711-V760 HydrophobicContact CZ3-CG1 4.46Å; F722-V760 HydrophobicContact CE1-CG2 4.09Å; F722-V760 HydrophobicContact CZ-CG2 3.79Å; I756-V760 HydrophobicContact CG2-CG2 4.2Å; I756-V760 WeakPolarHBondContact O-CB 3.3Å; I756-V760 VanDerWaalsContact O-CG2 3.25Å; I756-V760 WeakPolarHBondContact O-CG2 3.44Å; I756-V760 PolarHBondContact O-N 3.43Å; V760-A762 VanDerWaalsContact C-N 3.34Å; V760-A762 PolarHBondContact O-N 3.3Å; V760-T763 PolarHBondContact O-N 3.33Å; V760-T763 VanDerWaalsContact O-N 3.17Å; V760-L764 HydrophobicContact CG1-CD1 4.11Å; V760-L764 HydrophobicContact CG1-CG 4.45Å; V760-L764 WeakPolarHBondContact O-CG 3.49Å; V760-L764 PolarHBondContact O-N 3.39Å
761	A	86.5	Confident	82.4	Confident	44 Å²	44	75.7 Å²	75.7	36%	0.364	40%	0.4	S	S	.	.	H	α-helix	trans	-60	-44.2	177.9	0	0	0	0	0	111.9	R757 K758 T763 L764 Q765	R757-A761 WeakPolarHBondContact O-CB 3.28Å; R757-A761 PolarHBondContact O-N 2.83Å; K758-A761 PolarHBondContact O-N 3.45Å; A761-T763 VanDerWaalsContact C-N 3.33Å; A761-T763 PolarHBondContact O-N 3.45Å; A761-L764 PolarHBondContact O-N 3.39Å; A761-Q765 WeakPolarHBondContact O-CG 2.97Å; A761-Q765 PolarHBondContact O-N 3.2Å
762	A	87.1	Confident	80.5	Confident	51 Å²	51	80.6 Å²	80.6	42%	0.421	43%	0.425	S	S	.	.	H	α-helix	trans	-62.6	-39.7	175.4	0	0	0	0	0	112	K758 A759 V760 Q765 A766	K758-A762 WeakPolarHBondContact O-CB 3.42Å; K758-A762 PolarHBondContact O-N 3.12Å; A759-A762 PolarHBondContact O-N 3.48Å; V760-A762 VanDerWaalsContact C-N 3.34Å; V760-A762 PolarHBondContact O-N 3.3Å; A762-Q765 PolarHBondContact O-N 3Å; A762-A766 WeakPolarHBondContact O-CB 3.41Å; A762-A766 PolarHBondContact O-N 3.21Å
763	T	85.8	Confident	78.6	Confident	28 Å²	28	85 Å²	85	17%	0.172	46%	0.457	C	S	.	.	H	α-helix	trans	-65.8	-40.5	177.4	-56.2	0	0	0	0	112	W711 A759 V760 A761 A766 R767	W711-T763 HydrophobicContact CE3-CG2 4.42Å; A759-T763 WeakPolarHBondContact O-CB 3.48Å; A759-T763 PolarHBondContact O-N 3.43Å; A759-T763 PolarHBondContact O-OG1 2.88Å; V760-T763 PolarHBondContact O-N 3.33Å; V760-T763 VanDerWaalsContact O-N 3.17Å; A761-T763 VanDerWaalsContact C-N 3.33Å; A761-T763 PolarHBondContact O-N 3.45Å; T763-A766 PolarHBondContact O-N 3.25Å; T763-R767 VanDerWaalsContact O-CG 3.31Å; T763-R767 WeakPolarHBondContact O-CG 3.35Å; T763-R767 PolarHBondContact O-N 2.86Å; T763-R767 VanDerWaalsContact O-N 3.14Å
764	L	83.4	Confident	76.4	Confident	40 Å²	40	78.8 Å²	78.8	21%	0.209	43%	0.434	C	S	.	.	H	α-helix	trans	-66.5	-42.9	176.5	-71.8	173.3	0	0	0	111.8	W711 L713 V760 A761 R767 N768 I769	W711-L764 HydrophobicContact CH2-CD2 3.93Å; W711-L764 HydrophobicContact CZ3-CD2 4.09Å; W711-L764 HydrophobicContact CZ3-CG 4.46Å; L713-L764 HydrophobicContact CD2-CD2 4.08Å; V760-L764 HydrophobicContact CG1-CD1 4.11Å; V760-L764 HydrophobicContact CG1-CG 4.45Å; V760-L764 WeakPolarHBondContact O-CG 3.49Å; V760-L764 PolarHBondContact O-N 3.39Å; A761-L764 PolarHBondContact O-N 3.39Å; L764-R767 CarbonylContact O-C 3.49Å; L764-R767 PolarHBondContact O-N 3.13Å; L764-R767 VanDerWaalsContact O-N 3.15Å; L764-N768 PolarHBondContact O-N 3.22Å; L764-I769 HydrophobicContact CD2-CB 4.34Å; L764-I769 HydrophobicContact CD2-CD1 4.05Å; L764-I769 HydrophobicContact CD2-CG2 4.42Å; L764-I769 PolarHBondContact O-N 3.47Å; L764-I769 VanDerWaalsContact O-N 3.08Å
765	Q	84.7	Confident	74.1	Confident	146 Å²	146	79.3 Å²	79.3	68%	0.682	45%	0.448	S	S	*	.	H	α-helix	trans	-60.8	-44.8	174.2	-74.3	176.4	-10.1	0	0	111.7	A761 A762 R767 N768	A761-Q765 WeakPolarHBondContact O-CG 2.97Å; A761-Q765 PolarHBondContact O-N 3.2Å; A762-Q765 PolarHBondContact O-N 3Å; Q765-R767 PolarHBondContact O-N 3.45Å; Q765-N768 PolarHBondContact O-N 3.09Å
766	A	83.4	Confident	72.1	Confident	84 Å²	84	83.2 Å²	83.2	69%	0.694	47%	0.472	S	S	*	.	H	α-helix	trans	-63.3	-24.2	176.9	0	0	0	0	0	113.3	A762 T763	A762-A766 WeakPolarHBondContact O-CB 3.41Å; A762-A766 PolarHBondContact O-N 3.21Å; T763-A766 PolarHBondContact O-N 3.25Å
767	R	81.3	Confident	69.7	Low	89 Å²	89	87.2 Å²	87.2	34%	0.336	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	6.2	175.2	-67.6	178.3	-175.1	-164.5	0.5	113.3	L708 W711 T763 L764 Q765 I769	L708-R767 PolarHBondContact O-NH2 2.75Å; W711-R767 VanDerWaalsContact O-CZ 3.24Å; W711-R767 PolarHBondContact O-NH1 2.99Å; W711-R767 PolarHBondContact O-NH2 3.24Å; T763-R767 VanDerWaalsContact O-CG 3.31Å; T763-R767 WeakPolarHBondContact O-CG 3.35Å; T763-R767 PolarHBondContact O-N 2.86Å; T763-R767 VanDerWaalsContact O-N 3.14Å; L764-R767 CarbonylContact O-C 3.49Å; L764-R767 PolarHBondContact O-N 3.13Å; L764-R767 VanDerWaalsContact O-N 3.15Å; Q765-R767 PolarHBondContact O-N 3.45Å; R767-I769 HydrophobicContact CB-CD1 3.88Å; R767-I769 HydrophobicContact CB-CG1 4.11Å; R767-I769 PolarHBondContact O-N 2.76Å
768	N	75.6	Confident	67.3	Low	151 Å²	151	84.9 Å²	84.9	81%	0.807	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	35.7	-176.1	-66.2	-33.6	0	0	0	113.7	L764 Q765	L764-N768 PolarHBondContact O-N 3.22Å; Q765-N768 PolarHBondContact O-N 3.09Å
769	I	68.7	Low	64.6	Low	38 Å²	38	86.7 Å²	86.7	20%	0.195	50%	0.497	C	S	.	.			trans	-96.1	100.1	176.3	-59.8	167.5	0	0	0	107.2	L713 L764 R767 A771	L713-I769 HydrophobicContact CD1-CD1 3.2Å; L713-I769 HydrophobicContact CD2-CD1 3.63Å; L713-I769 HydrophobicContact CG-CD1 4.03Å; L764-I769 HydrophobicContact CD2-CB 4.34Å; L764-I769 HydrophobicContact CD2-CD1 4.05Å; L764-I769 HydrophobicContact CD2-CG2 4.42Å; L764-I769 PolarHBondContact O-N 3.47Å; L764-I769 VanDerWaalsContact O-N 3.08Å; R767-I769 HydrophobicContact CB-CD1 3.88Å; R767-I769 HydrophobicContact CB-CG1 4.11Å; R767-I769 PolarHBondContact O-N 2.76Å; I769-A771 PolarHBondContact O-N 3.48Å
770	D	57.4	Low	63.5	Low	122 Å²	122	90.1 Å²	90.1	65%	0.652	51%	0.514	S	S	*	.			trans	-67.4	123.4	175.5	-96.3	-25.5	0	0	0	110.2	Q772 S773	D770-Q772 PolarHBondContact O-N 3.14Å; D770-S773 PolarHBondContact O-N 3.37Å; D770-S773 VanDerWaalsContact O-N 3.1Å; D770-S773 PolarHBondContact O-OG 3.07Å
771	A	52.8	Low	62.3	Low	60 Å²	60	93.5 Å²	93.5	50%	0.496	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-14.8	176.4	0	0	0	0	0	113.8	I769 Q778	I769-A771 PolarHBondContact O-N 3.48Å; A771-Q778 PolarHBondContact O-NE2 2.91Å
772	Q	50.3	Low	60.9	Low	193 Å²	193	96.2 Å²	96.2	90%	0.902	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-22.3	178.5	-68	-166.6	-8.5	0	0	113.9	D770	D770-Q772 PolarHBondContact O-N 3.14Å
773	S	47.5	Very low	59.4	Low	100 Å²	100	98.9 Å²	98.9	70%	0.699	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-16.1	-177.2	50.8	0	0	0	0	114.5	D770	D770-S773 PolarHBondContact O-N 3.37Å; D770-S773 VanDerWaalsContact O-N 3.1Å; D770-S773 PolarHBondContact O-OG 3.07Å
774	S	43.3	Very low	57.7	Low	14 Å²	14	103.3 Å²	103.3	10%	0.098	57%	0.573	C	S	.	*			trans	-130.5	66.2	-178.2	59.4	0	0	0	0	112.8	S776 E777 Q778	S774-S776 PolarHBondContact O-N 2.7Å; S774-E777 WeakPolarHBondContact CB-OE2 3.47Å; S774-E777 PolarHBondContact O-N 3.07Å; S774-E777 PolarHBondContact OG-OE2 3.07Å; S774-Q778 PolarHBondContact O-N 3.25Å
775	A	42.2	Very low	56	Low	81 Å²	81	107.5 Å²	107.5	67%	0.669	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	-20.6	168.3	0	0	0	0	0	113
776	S	44.4	Very low	54	Low	101 Å²	101	104.8 Å²	104.8	71%	0.706	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-19.2	175.5	53	0	0	0	0	115.1	S774	S774-S776 PolarHBondContact O-N 2.7Å
777	E	38.5	Very low	51.7	Low	121 Å²	121	106.4 Å²	106.4	57%	0.565	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-8.8	179.2	-68.3	-179.1	151.2	0	0	112.9	S774	S774-E777 WeakPolarHBondContact CB-OE2 3.47Å; S774-E777 PolarHBondContact O-N 3.07Å; S774-E777 PolarHBondContact OG-OE2 3.07Å
778	Q	37.8	Very low	49.3	Very low	114 Å²	114	107.8 Å²	107.8	53%	0.533	60%	0.604	S	S	.	*			trans	-82.5	-18.7	178.3	-76	-175.4	-11.6	0	0	114.9	A771 S774	A771-Q778 PolarHBondContact O-NE2 2.91Å; S774-Q778 PolarHBondContact O-N 3.25Å
779	Q	32.6	Very low	46.9	Very low	199 Å²	199	103.9 Å²	103.9	93%	0.93	59%	0.586	S	S	*	*			trans	-77	0	172.7	-75.8	-173.7	-15.5	0	0	110.4

Retrieved 779 of 779 residues in 2258.3 ms (Link to these results)

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