A0A077Z256_TRITR Loading...

Conserved oligomeric Golgi complex subunit 2

AlphaFold DB , UniProt , Accession A0A077Z256, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 794 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	32.9	Very low	64.5	Low	233 Å²	233	140.5 Å²	140.5	100%	1.148	70%	0.703	S	S	*	*				0	108.1	0	-136.4	177.3	-82.4	0	0	106.7
2	E	43.8	Very low	66.4	Low	186 Å²	186	135.1 Å²	135.1	87%	0.869	68%	0.677	S	S	*	*			trans	38.3	100.1	153.8	-61.3	174.8	179.6	0	0	119.6	G4	E2-G4 VanDerWaalsContact C-N 3.34Å; E2-G4 PolarHBondContact O-N 3.34Å
3	L	47.4	Very low	68	Low	180 Å²	180	131.1 Å²	131.1	94%	0.942	66%	0.66	S	S	*	*			trans	-91.3	79	155.2	-83.9	145.6	0	0	0	107.7	F5	L3-F5 PolarHBondContact O-N 3.38Å
4	G	50.8	Low	69.4	Low	69 Å²	69	129.7 Å²	129.7	71%	0.711	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-57.3	120.7	177.5	0	0	0	0	0	111.1	E2 S6	E2-G4 VanDerWaalsContact C-N 3.34Å; E2-G4 PolarHBondContact O-N 3.34Å; G4-S6 PolarHBondContact O-N 3.44Å
5	F	62	Low	70.7	Confident	168 Å²	168	132.5 Å²	132.5	74%	0.737	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-56.9	122.4	160.1	-64.9	-85	0	0	0	107.3	L3 L7 I10	L3-F5 PolarHBondContact O-N 3.38Å; F5-L7 PolarHBondContact O-N 3.09Å; F5-I10 HydrophobicContact CB-CD1 4.17Å; F5-I10 HydrophobicContact CB-CG1 4.39Å
6	S	72.1	Confident	71.9	Confident	61 Å²	61	129.6 Å²	129.6	43%	0.427	65%	0.645	S	S	.	*	P	Polyproline II helix	trans	-62.2	136.5	176.7	69.3	0	0	0	0	109.3	G4 E8 R9 I10	G4-S6 PolarHBondContact O-N 3.44Å; S6-E8 PolarHBondContact O-N 3.38Å; S6-R9 PolarHBondContact O-N 3.48Å; S6-I10 PolarHBondContact O-N 2.8Å
7	L	73.8	Confident	72.9	Confident	152 Å²	152	130.8 Å²	130.8	80%	0.796	64%	0.642	S	S	*	*	H	α-helix	trans	-51.3	-29.4	175.8	-90.9	151	0	0	0	112.6	F5 R11	F5-L7 PolarHBondContact O-N 3.09Å; L7-R11 WeakPolarHBondContact O-CB 3.38Å; L7-R11 PolarHBondContact O-N 2.97Å
8	E	79.6	Confident	73.8	Confident	128 Å²	128	129.3 Å²	129.3	60%	0.598	64%	0.636	S	S	*	*	H	α-helix	trans	-65.4	-42.4	177.4	-65.8	170.8	163.1	0	0	112.2	S6 R11 D12	S6-E8 PolarHBondContact O-N 3.38Å; E8-R11 PolarHBondContact O-N 3.39Å; E8-D12 WeakPolarHBondContact O-CB 3.46Å; E8-D12 PolarHBondContact O-N 3.23Å
9	R	82.9	Confident	74.7	Confident	166 Å²	166	129.7 Å²	129.7	63%	0.626	64%	0.635	S	S	*	*	H	α-helix	trans	-67.8	-41.3	179.3	-163.6	172.5	-178.5	174.1	1	111.5	S6 R11 D12 D13	S6-R9 PolarHBondContact O-N 3.48Å; R9-R11 VanDerWaalsContact C-N 3.35Å; R9-R11 PolarHBondContact O-N 2.94Å; R9-D12 PolarHBondContact O-N 3.42Å; R9-D13 WeakPolarHBondContact O-CB 3.45Å; R9-D13 VanDerWaalsContact O-CG 3.31Å; R9-D13 PolarHBondContact O-N 3.36Å
10	I	81.4	Confident	75.5	Confident	80 Å²	80	128.3 Å²	128.3	41%	0.41	63%	0.628	S	S	.	*	H	α-helix	trans	-61.8	-43.2	174	-64.3	172.9	0	0	0	110.7	F5 S6 D12 L14	F5-I10 HydrophobicContact CB-CD1 4.17Å; F5-I10 HydrophobicContact CB-CG1 4.39Å; S6-I10 PolarHBondContact O-N 2.8Å; I10-D12 PolarHBondContact O-N 3.36Å; I10-L14 HydrophobicContact CG2-CD1 3.88Å; I10-L14 HydrophobicContact CG2-CG 4.31Å; I10-L14 WeakPolarHBondContact O-CB 3.44Å; I10-L14 WeakPolarHBondContact O-CG 3.35Å; I10-L14 PolarHBondContact O-N 3.43Å
11	R	82.8	Confident	76.1	Confident	123 Å²	123	127 Å²	127	46%	0.464	62%	0.623	S	S	.	*	H	α-helix	trans	-62.7	-41.9	177.9	-176	-163.3	67.7	-160.9	-7.2	112.1	L7 E8 R9 L14 R15	L7-R11 WeakPolarHBondContact O-CB 3.38Å; L7-R11 PolarHBondContact O-N 2.97Å; E8-R11 PolarHBondContact O-N 3.39Å; R9-R11 VanDerWaalsContact C-N 3.35Å; R9-R11 PolarHBondContact O-N 2.94Å; R11-L14 PolarHBondContact O-N 3.28Å; R11-R15 PolarHBondContact O-N 3.33Å
12	D	87.1	Confident	78.8	Confident	75 Å²	75	120.5 Å²	120.5	40%	0.401	59%	0.59	S	S	.	*	H	α-helix	trans	-72.4	-40	-178.5	-65.8	-9.2	0	0	0	110.8	E8 R9 I10 R15 V16	E8-D12 WeakPolarHBondContact O-CB 3.46Å; E8-D12 PolarHBondContact O-N 3.23Å; R9-D12 PolarHBondContact O-N 3.42Å; I10-D12 PolarHBondContact O-N 3.36Å; D12-R15 PolarHBondContact O-N 2.97Å; D12-V16 WeakPolarHBondContact O-CG2 3.32Å; D12-V16 PolarHBondContact O-N 2.81Å
13	D	87.9	Confident	81.1	Confident	83 Å²	83	116 Å²	116	44%	0.444	57%	0.572	S	S	.	*	H	α-helix	trans	-60.5	-45.4	171.3	-73.2	-17.5	0	0	0	111.1	R9 R15 V16 Y17	R9-D13 WeakPolarHBondContact O-CB 3.45Å; R9-D13 VanDerWaalsContact O-CG 3.31Å; R9-D13 PolarHBondContact O-N 3.36Å; D13-R15 VanDerWaalsContact C-N 3.3Å; D13-R15 PolarHBondContact O-N 3.11Å; D13-V16 PolarHBondContact O-N 2.98Å; D13-V16 VanDerWaalsContact O-N 3.15Å; D13-Y17 VanDerWaalsContact O-CD2 3.22Å; D13-Y17 WeakPolarHBondContact O-CD2 3.36Å; D13-Y17 PolarHBondContact O-N 3.36Å
14	L	86.9	Confident	83.1	Confident	112 Å²	112	110.4 Å²	110.4	59%	0.586	55%	0.548	S	S	*	.	H	α-helix	trans	-60.5	-36.1	176.3	-75.7	171.6	0	0	0	112.5	I10 R11 L18	I10-L14 HydrophobicContact CG2-CD1 3.88Å; I10-L14 HydrophobicContact CG2-CG 4.31Å; I10-L14 WeakPolarHBondContact O-CB 3.44Å; I10-L14 WeakPolarHBondContact O-CG 3.35Å; I10-L14 PolarHBondContact O-N 3.43Å; R11-L14 PolarHBondContact O-N 3.28Å; L14-L18 WeakPolarHBondContact O-CB 3.12Å; L14-L18 PolarHBondContact O-N 3.37Å
15	R	88.9	Confident	84.9	Confident	172 Å²	172	111.5 Å²	111.5	65%	0.649	54%	0.536	S	S	*	.	H	α-helix	trans	-68.8	-39	174.6	-79.9	-177.6	178.7	-176.8	0.5	112.4	R11 D12 D13 L18 K19	R11-R15 PolarHBondContact O-N 3.33Å; D12-R15 PolarHBondContact O-N 2.97Å; D13-R15 VanDerWaalsContact C-N 3.3Å; D13-R15 PolarHBondContact O-N 3.11Å; R15-L18 PolarHBondContact O-N 3.39Å; R15-K19 WeakPolarHBondContact O-CB 3.37Å; R15-K19 PolarHBondContact O-N 2.97Å
16	V	89.9	Confident	86.2	Confident	85 Å²	85	107.7 Å²	107.7	52%	0.515	52%	0.522	S	S	.	.	H	α-helix	trans	-64.4	-46.9	174.6	173.3	0	0	0	0	109.9	D12 D13 L18 K19 I20	D12-V16 WeakPolarHBondContact O-CG2 3.32Å; D12-V16 PolarHBondContact O-N 2.81Å; D13-V16 PolarHBondContact O-N 2.98Å; D13-V16 VanDerWaalsContact O-N 3.15Å; V16-L18 PolarHBondContact O-N 2.76Å; V16-K19 PolarHBondContact O-N 3.24Å; V16-I20 HydrophobicContact CG1-CD1 3.78Å; V16-I20 HydrophobicContact CG1-CG1 4.41Å; V16-I20 VanDerWaalsContact O-CG1 3.32Å; V16-I20 WeakPolarHBondContact O-CG1 3.49Å; V16-I20 PolarHBondContact O-N 2.76Å
17	Y	88.5	Confident	87.1	Confident	151 Å²	151	111 Å²	111	59%	0.592	53%	0.531	S	S	*	.	H	α-helix	trans	-59	-44.6	174.9	-86	-69.9	0	0	0	112.3	D13 K19 I20 I21	D13-Y17 VanDerWaalsContact O-CD2 3.22Å; D13-Y17 WeakPolarHBondContact O-CD2 3.36Å; D13-Y17 PolarHBondContact O-N 3.36Å; Y17-K19 VanDerWaalsContact C-N 3.29Å; Y17-K19 PolarHBondContact O-N 2.95Å; Y17-I20 PolarHBondContact O-N 3.21Å; Y17-I21 WeakPolarHBondContact O-CB 3.32Å; Y17-I21 VanDerWaalsContact O-CG1 3.24Å; Y17-I21 WeakPolarHBondContact O-CG1 3.18Å; Y17-I21 PolarHBondContact O-N 3.39Å
18	L	89.3	Confident	87.9	Confident	103 Å²	103	108.7 Å²	108.7	54%	0.539	52%	0.517	S	S	.	.	H	α-helix	trans	-59.1	-41.4	176.6	-169.8	108.8	0	0	0	111.6	L14 R15 V16 I21 Q22	L14-L18 WeakPolarHBondContact O-CB 3.12Å; L14-L18 PolarHBondContact O-N 3.37Å; R15-L18 PolarHBondContact O-N 3.39Å; V16-L18 PolarHBondContact O-N 2.76Å; L18-I21 PolarHBondContact O-N 2.72Å; L18-Q22 WeakPolarHBondContact O-CB 3.28Å; L18-Q22 VanDerWaalsContact O-CG 3.29Å; L18-Q22 WeakPolarHBondContact O-CG 3.48Å; L18-Q22 PolarHBondContact O-N 3.2Å
19	K	90.8	Very high	88.2	Confident	138 Å²	138	106.8 Å²	106.8	60%	0.6	51%	0.51	S	S	*	.	H	α-helix	trans	-71	-37.7	179.6	-162.4	173.2	-175	179.8	0	112.4	R15 V16 Y17 Q22 N23	R15-K19 WeakPolarHBondContact O-CB 3.37Å; R15-K19 PolarHBondContact O-N 2.97Å; V16-K19 PolarHBondContact O-N 3.24Å; Y17-K19 VanDerWaalsContact C-N 3.29Å; Y17-K19 PolarHBondContact O-N 2.95Å; K19-Q22 PolarHBondContact O-N 3.5Å; K19-N23 PolarHBondContact O-N 2.96Å
20	I	90.4	Very high	88.5	Confident	100 Å²	100	103.8 Å²	103.8	51%	0.513	51%	0.506	S	S	.	.	H	α-helix	trans	-62.3	-46.7	173.1	-68.7	167.8	0	0	0	109.9	V16 Y17 Q22 N23 S24	V16-I20 HydrophobicContact CG1-CD1 3.78Å; V16-I20 HydrophobicContact CG1-CG1 4.41Å; V16-I20 VanDerWaalsContact O-CG1 3.32Å; V16-I20 WeakPolarHBondContact O-CG1 3.49Å; V16-I20 PolarHBondContact O-N 2.76Å; Y17-I20 PolarHBondContact O-N 3.21Å; I20-Q22 VanDerWaalsContact C-N 3.35Å; I20-Q22 PolarHBondContact O-N 2.83Å; I20-N23 PolarHBondContact O-N 2.88Å; I20-S24 WeakPolarHBondContact O-CB 3.25Å; I20-S24 PolarHBondContact O-N 2.84Å; I20-S24 PolarHBondContact O-OG 3.44Å
21	I	87.9	Confident	88.9	Confident	102 Å²	102	106 Å²	106	52%	0.523	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-41.7	178.1	-69.1	167.2	0	0	0	111.2	Y17 L18 S24 M25	Y17-I21 WeakPolarHBondContact O-CB 3.32Å; Y17-I21 VanDerWaalsContact O-CG1 3.24Å; Y17-I21 WeakPolarHBondContact O-CG1 3.18Å; Y17-I21 PolarHBondContact O-N 3.39Å; L18-I21 PolarHBondContact O-N 2.72Å; I21-S24 WeakPolarHBondContact CA-OG 3.4Å; I21-S24 PolarHBondContact O-N 3.46Å; I21-S24 PolarHBondContact O-OG 2.88Å; I21-M25 WeakPolarHBondContact O-CB 3.25Å; I21-M25 PolarHBondContact O-N 3.14Å
22	Q	90.6	Very high	89.1	Confident	96 Å²	96	104.7 Å²	104.7	45%	0.449	52%	0.517	S	S	.	.	H	α-helix	trans	-63.1	-43.5	176.9	-77.8	175.5	-16.3	0	0	112.1	L18 K19 I20 M25 I26	L18-Q22 WeakPolarHBondContact O-CB 3.28Å; L18-Q22 VanDerWaalsContact O-CG 3.29Å; L18-Q22 WeakPolarHBondContact O-CG 3.48Å; L18-Q22 PolarHBondContact O-N 3.2Å; K19-Q22 PolarHBondContact O-N 3.5Å; I20-Q22 VanDerWaalsContact C-N 3.35Å; I20-Q22 PolarHBondContact O-N 2.83Å; Q22-M25 PolarHBondContact O-N 2.83Å; Q22-I26 WeakPolarHBondContact O-CG1 3.14Å; Q22-I26 PolarHBondContact O-N 3.35Å
23	N	91.1	Very high	89.2	Confident	93 Å²	93	108.8 Å²	108.8	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-68	-43.1	177.3	-78.9	-2.8	0	0	0	112.2	K19 I20 M25 I26 E27	K19-N23 PolarHBondContact O-N 2.96Å; I20-N23 PolarHBondContact O-N 2.88Å; N23-M25 VanDerWaalsContact C-N 3.26Å; N23-M25 PolarHBondContact O-N 3.4Å; N23-I26 PolarHBondContact O-N 2.84Å; N23-E27 PolarHBondContact O-N 3.29Å
24	S	89.4	Confident	89.2	Confident	61 Å²	61	107.3 Å²	107.3	43%	0.427	53%	0.528	S	S	.	.	H	α-helix	trans	-63.7	-35	176.2	67.6	0	0	0	0	111.6	I20 I21 M28	I20-S24 WeakPolarHBondContact O-CB 3.25Å; I20-S24 PolarHBondContact O-N 2.84Å; I20-S24 PolarHBondContact O-OG 3.44Å; I21-S24 WeakPolarHBondContact CA-OG 3.4Å; I21-S24 PolarHBondContact O-N 3.46Å; I21-S24 PolarHBondContact O-OG 2.88Å; S24-M28 VanDerWaalsContact O-CB 3.23Å; S24-M28 WeakPolarHBondContact O-CB 3.22Å; S24-M28 PolarHBondContact O-N 3.46Å
25	M	89.2	Confident	89.2	Confident	93 Å²	93	108 Å²	108	46%	0.458	53%	0.528	S	S	.	.	H	α-helix	trans	-65.5	-42.2	174.6	-172.5	-177.5	73.4	0	0	111.4	I21 Q22 N23 M28 I29	I21-M25 WeakPolarHBondContact O-CB 3.25Å; I21-M25 PolarHBondContact O-N 3.14Å; Q22-M25 PolarHBondContact O-N 2.83Å; N23-M25 VanDerWaalsContact C-N 3.26Å; N23-M25 PolarHBondContact O-N 3.4Å; M25-M28 PolarHBondContact O-N 2.79Å; M25-I29 HydrophobicContact CG-CD1 3.98Å; M25-I29 WeakPolarHBondContact O-CB 3.45Å; M25-I29 WeakPolarHBondContact O-CD1 3.28Å; M25-I29 WeakPolarHBondContact O-CG1 3.21Å; M25-I29 PolarHBondContact O-N 3.37Å
26	I	89.7	Confident	89.1	Confident	87 Å²	87	106.6 Å²	106.6	45%	0.446	53%	0.526	S	S	.	.	H	α-helix	trans	-65.3	-43.5	176.3	-67.7	165.2	0	0	0	111.2	Q22 N23 I29 N30	Q22-I26 WeakPolarHBondContact O-CG1 3.14Å; Q22-I26 PolarHBondContact O-N 3.35Å; N23-I26 PolarHBondContact O-N 2.84Å; I26-I29 PolarHBondContact O-N 3.26Å; I26-N30 WeakPolarHBondContact O-CB 3.31Å; I26-N30 VanDerWaalsContact O-CG 3.32Å; I26-N30 PolarHBondContact O-N 3.38Å; I26-N30 PolarHBondContact O-ND2 3.48Å
27	E	91.1	Very high	89	Confident	131 Å²	131	106.3 Å²	106.3	61%	0.612	53%	0.525	S	S	*	.	H	α-helix	trans	-62.8	-42.8	176.5	-78	-177	171.6	0	0	112.1	N23 N30 Q31	N23-E27 PolarHBondContact O-N 3.29Å; E27-N30 PolarHBondContact O-N 3.17Å; E27-Q31 WeakPolarHBondContact O-CB 3.2Å; E27-Q31 PolarHBondContact O-N 3.01Å
28	M	89.8	Confident	88.7	Confident	104 Å²	104	104.5 Å²	104.5	51%	0.512	53%	0.525	S	S	.	.	H	α-helix	trans	-61.8	-45	175	-173.5	176.9	63	0	0	111.1	S24 M25 N30 Q31 D32	S24-M28 VanDerWaalsContact O-CB 3.23Å; S24-M28 WeakPolarHBondContact O-CB 3.22Å; S24-M28 PolarHBondContact O-N 3.46Å; M25-M28 PolarHBondContact O-N 2.79Å; M28-N30 VanDerWaalsContact C-N 3.34Å; M28-N30 PolarHBondContact O-N 2.89Å; M28-Q31 PolarHBondContact O-N 3.45Å; M28-D32 WeakPolarHBondContact O-CB 3.11Å; M28-D32 VanDerWaalsContact O-CG 3.28Å; M28-D32 PolarHBondContact O-N 3.02Å
29	I	86.5	Confident	88.3	Confident	88 Å²	88	104.3 Å²	104.3	45%	0.451	52%	0.524	S	S	.	.	H	α-helix	trans	-61.2	-42	176.2	-70.7	164.4	0	0	0	111.3	M25 I26 D32 Y33	M25-I29 HydrophobicContact CG-CD1 3.98Å; M25-I29 WeakPolarHBondContact O-CB 3.45Å; M25-I29 WeakPolarHBondContact O-CD1 3.28Å; M25-I29 WeakPolarHBondContact O-CG1 3.21Å; M25-I29 PolarHBondContact O-N 3.37Å; I26-I29 PolarHBondContact O-N 3.26Å; I29-D32 PolarHBondContact O-N 3.16Å; I29-Y33 WeakPolarHBondContact O-CB 3.3Å; I29-Y33 PolarHBondContact O-N 3.49Å
30	N	89.2	Confident	87.9	Confident	102 Å²	102	100.1 Å²	100.1	55%	0.545	51%	0.512	S	S	.	.	H	α-helix	trans	-69.3	-39.3	179.5	-73.7	-26.4	0	0	0	112.3	I26 E27 M28 Y33 A34	I26-N30 WeakPolarHBondContact O-CB 3.31Å; I26-N30 VanDerWaalsContact O-CG 3.32Å; I26-N30 PolarHBondContact O-N 3.38Å; I26-N30 PolarHBondContact O-ND2 3.48Å; E27-N30 PolarHBondContact O-N 3.17Å; M28-N30 VanDerWaalsContact C-N 3.34Å; M28-N30 PolarHBondContact O-N 2.89Å; N30-Y33 PolarHBondContact O-N 3.41Å; N30-A34 WeakPolarHBondContact O-CB 3.29Å; N30-A34 PolarHBondContact O-N 2.85Å
31	Q	89.2	Confident	87.5	Confident	126 Å²	126	96.9 Å²	96.9	59%	0.589	50%	0.503	S	S	*	.	H	α-helix	trans	-63.5	-45.9	172.4	-79.9	-178.3	-6.7	0	0	111	E27 M28 Y33 A34 H35	E27-Q31 WeakPolarHBondContact O-CB 3.2Å; E27-Q31 PolarHBondContact O-N 3.01Å; M28-Q31 PolarHBondContact O-N 3.45Å; Q31-Y33 VanDerWaalsContact C-N 3.31Å; Q31-Y33 PolarHBondContact O-N 3.48Å; Q31-A34 PolarHBondContact O-N 3.37Å; Q31-H35 WeakPolarHBondContact O-CB 3.5Å; Q31-H35 PolarHBondContact O-CD2 3.18Å; Q31-H35 PolarHBondContact O-N 2.65Å
32	D	88.1	Confident	87.2	Confident	96 Å²	96	96.6 Å²	96.6	51%	0.513	50%	0.503	S	S	.	.	H	α-helix	trans	-61.2	-40.8	176.5	-76	-16.7	0	0	0	111.4	M28 I29 H35 F36	M28-D32 WeakPolarHBondContact O-CB 3.11Å; M28-D32 VanDerWaalsContact O-CG 3.28Å; M28-D32 PolarHBondContact O-N 3.02Å; I29-D32 PolarHBondContact O-N 3.16Å; D32-H35 PolarHBondContact O-N 2.97Å; D32-F36 VanDerWaalsContact O-CB 3.27Å; D32-F36 WeakPolarHBondContact O-CB 3.39Å; D32-F36 PolarHBondContact O-N 2.65Å
33	Y	88.6	Confident	86.7	Confident	162 Å²	162	96.8 Å²	96.8	64%	0.635	51%	0.506	S	S	*	.	H	α-helix	trans	-63.5	-43.8	175.7	-162.6	-90.3	0	0	0	111.7	I29 N30 Q31 F36 V37	I29-Y33 WeakPolarHBondContact O-CB 3.3Å; I29-Y33 PolarHBondContact O-N 3.49Å; N30-Y33 PolarHBondContact O-N 3.41Å; Q31-Y33 VanDerWaalsContact C-N 3.31Å; Q31-Y33 PolarHBondContact O-N 3.48Å; Y33-F36 PolarHBondContact O-N 2.86Å; Y33-V37 HydrophobicContact CD1-CG2 4.11Å; Y33-V37 HydrophobicContact CE1-CG2 3.95Å; Y33-V37 WeakPolarHBondContact O-CG2 3.17Å; Y33-V37 PolarHBondContact O-N 3.42Å
34	A	87.7	Confident	86.2	Confident	52 Å²	52	97.2 Å²	97.2	43%	0.43	51%	0.511	S	S	.	.	H	α-helix	trans	-64.4	-42.2	175.8	0	0	0	0	0	112.2	N30 Q31 F36 V37 L38	N30-A34 WeakPolarHBondContact O-CB 3.29Å; N30-A34 PolarHBondContact O-N 2.85Å; Q31-A34 PolarHBondContact O-N 3.37Å; A34-F36 VanDerWaalsContact C-N 3.32Å; A34-F36 PolarHBondContact O-N 2.8Å; A34-V37 PolarHBondContact O-N 3.24Å; A34-L38 PolarHBondContact O-N 2.96Å
35	H	86.4	Confident	85.7	Confident	127 Å²	127	99.9 Å²	99.9	59%	0.588	52%	0.521	S	S	*	.	H	α-helix	trans	-62.2	-39.7	173.3	-83	-66.4	0	0	0	111.8	Q31 D32 L38 L39	Q31-H35 WeakPolarHBondContact O-CB 3.5Å; Q31-H35 PolarHBondContact O-CD2 3.18Å; Q31-H35 PolarHBondContact O-N 2.65Å; D32-H35 PolarHBondContact O-N 2.97Å; H35-L38 PolarHBondContact O-N 3.45Å; H35-L39 WeakPolarHBondContact O-CB 3.35Å; H35-L39 PolarHBondContact O-N 3.35Å
36	F	87.9	Confident	85.3	Confident	141 Å²	141	100 Å²	100	62%	0.618	52%	0.523	S	S	*	.	H	α-helix	trans	-65.4	-40	176.8	-167.4	-90.3	0	0	0	112.2	D32 Y33 A34 L39 S40	D32-F36 VanDerWaalsContact O-CB 3.27Å; D32-F36 WeakPolarHBondContact O-CB 3.39Å; D32-F36 PolarHBondContact O-N 2.65Å; Y33-F36 PolarHBondContact O-N 2.86Å; A34-F36 VanDerWaalsContact C-N 3.32Å; A34-F36 PolarHBondContact O-N 2.8Å; F36-L39 PolarHBondContact O-N 2.85Å; F36-S40 WeakPolarHBondContact O-CB 3.2Å; F36-S40 PolarHBondContact O-N 2.77Å; F36-S40 PolarHBondContact O-OG 3.19Å
37	V	86.5	Confident	84.9	Confident	79 Å²	79	104.2 Å²	104.2	48%	0.479	53%	0.533	S	S	.	.	H	α-helix	trans	-67.1	-43.5	175.7	173.3	0	0	0	0	111.6	Y33 A34 S40 G41	Y33-V37 HydrophobicContact CD1-CG2 4.11Å; Y33-V37 HydrophobicContact CE1-CG2 3.95Å; Y33-V37 WeakPolarHBondContact O-CG2 3.17Å; Y33-V37 PolarHBondContact O-N 3.42Å; A34-V37 PolarHBondContact O-N 3.24Å; V37-S40 WeakPolarHBondContact CA-OG 3.48Å; V37-S40 PolarHBondContact O-N 3.23Å; V37-S40 PolarHBondContact O-OG 2.98Å; V37-G41 PolarHBondContact O-N 3.28Å
38	L	83	Confident	84.4	Confident	113 Å²	113	101 Å²	101	59%	0.592	53%	0.525	S	S	*	.	H	α-helix	trans	-63.8	-42.1	174.9	-81.4	164.9	0	0	0	112	A34 H35 G41 N42	A34-L38 PolarHBondContact O-N 2.96Å; H35-L38 PolarHBondContact O-N 3.45Å; L38-G41 PolarHBondContact O-N 2.99Å; L38-N42 WeakPolarHBondContact O-CB 3.19Å; L38-N42 PolarHBondContact O-N 2.87Å; L38-N42 PolarHBondContact O-ND2 3Å
39	L	82.1	Confident	84.1	Confident	100 Å²	100	99 Å²	99	52%	0.524	52%	0.52	S	S	.	.	H	α-helix	trans	-64.4	-46.2	178	-172.3	72.3	0	0	0	111.1	H35 F36 G41 N42 I43	H35-L39 WeakPolarHBondContact O-CB 3.35Å; H35-L39 PolarHBondContact O-N 3.35Å; F36-L39 PolarHBondContact O-N 2.85Å; L39-G41 VanDerWaalsContact C-N 3.34Å; L39-G41 PolarHBondContact O-N 3.38Å; L39-N42 PolarHBondContact O-N 3.16Å; L39-I43 HydrophobicContact CD1-CD1 4.46Å; L39-I43 HydrophobicContact CD2-CD1 4.3Å; L39-I43 HydrophobicContact CG-CD1 3.83Å; L39-I43 HydrophobicContact CG-CG1 4.46Å; L39-I43 WeakPolarHBondContact O-CB 3.35Å; L39-I43 VanDerWaalsContact O-CG1 3.22Å; L39-I43 WeakPolarHBondContact O-CG1 3.34Å; L39-I43 PolarHBondContact O-N 3.44Å
40	S	81.5	Confident	84	Confident	50 Å²	50	98.1 Å²	98.1	35%	0.35	52%	0.519	S	S	.	.	H	α-helix	trans	-62.1	-40	177	52.4	0	0	0	0	112.1	F36 V37 I43 V44	F36-S40 WeakPolarHBondContact O-CB 3.2Å; F36-S40 PolarHBondContact O-N 2.77Å; F36-S40 PolarHBondContact O-OG 3.19Å; V37-S40 WeakPolarHBondContact CA-OG 3.48Å; V37-S40 PolarHBondContact O-N 3.23Å; V37-S40 PolarHBondContact O-OG 2.98Å; S40-I43 PolarHBondContact O-N 2.82Å; S40-V44 VanDerWaalsContact O-CG2 3.31Å; S40-V44 WeakPolarHBondContact O-CG2 3.37Å; S40-V44 PolarHBondContact O-N 2.88Å
41	G	82.3	Confident	83.8	Confident	32 Å²	32	96.9 Å²	96.9	33%	0.33	51%	0.512	S	S	.	.	H	α-helix	trans	-60.8	-45.2	172.3	0	0	0	0	0	113.2	V37 L38 L39 V44 N45	V37-G41 PolarHBondContact O-N 3.28Å; L38-G41 PolarHBondContact O-N 2.99Å; L39-G41 VanDerWaalsContact C-N 3.34Å; L39-G41 PolarHBondContact O-N 3.38Å; G41-V44 PolarHBondContact O-N 2.85Å; G41-N45 PolarHBondContact O-N 3.49Å; G41-N45 VanDerWaalsContact O-N 3.11Å; G41-N45 PolarHBondContact O-ND2 3.34Å
42	N	81.7	Confident	83.7	Confident	95 Å²	95	97.7 Å²	97.7	51%	0.508	51%	0.514	S	S	.	.	H	α-helix	trans	-65.8	-37.9	176.8	-73.8	-23.4	0	0	0	112.5	L38 L39 N45 L46	L38-N42 WeakPolarHBondContact O-CB 3.19Å; L38-N42 PolarHBondContact O-N 2.87Å; L38-N42 PolarHBondContact O-ND2 3Å; L39-N42 PolarHBondContact O-N 3.16Å; N42-N45 PolarHBondContact O-N 3.23Å; N42-L46 WeakPolarHBondContact O-CG 3.22Å; N42-L46 PolarHBondContact O-N 3.35Å
43	I	79	Confident	83.6	Confident	100 Å²	100	98.4 Å²	98.4	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-64.6	-40	175.9	-70.7	167.6	0	0	0	111.2	L39 S40 N45 L46 R47	L39-I43 HydrophobicContact CD1-CD1 4.46Å; L39-I43 HydrophobicContact CD2-CD1 4.3Å; L39-I43 HydrophobicContact CG-CD1 3.83Å; L39-I43 HydrophobicContact CG-CG1 4.46Å; L39-I43 WeakPolarHBondContact O-CB 3.35Å; L39-I43 VanDerWaalsContact O-CG1 3.22Å; L39-I43 WeakPolarHBondContact O-CG1 3.34Å; L39-I43 PolarHBondContact O-N 3.44Å; S40-I43 PolarHBondContact O-N 2.82Å; I43-N45 VanDerWaalsContact C-N 3.35Å; I43-L46 WeakPolarHBondContact O-CB 3.15Å; I43-L46 PolarHBondContact O-N 3.3Å; I43-R47 PolarHBondContact O-N 3.41Å
44	V	81	Confident	83.5	Confident	102 Å²	102	95.3 Å²	95.3	62%	0.618	51%	0.511	S	S	*	.	H	α-helix	trans	-65.5	-40.5	176.4	173.7	0	0	0	0	110.9	S40 G41 L46 R47	S40-V44 VanDerWaalsContact O-CG2 3.31Å; S40-V44 WeakPolarHBondContact O-CG2 3.37Å; S40-V44 PolarHBondContact O-N 2.88Å; G41-V44 PolarHBondContact O-N 2.85Å; V44-L46 VanDerWaalsContact C-N 3.3Å; V44-L46 PolarHBondContact O-N 2.93Å; V44-R47 WeakPolarHBondContact O-CB 3.45Å; V44-R47 PolarHBondContact O-N 2.85Å; V44-R47 VanDerWaalsContact O-N 3.16Å
45	N	79.3	Confident	83.4	Confident	117 Å²	117	98.4 Å²	98.4	63%	0.626	52%	0.516	S	S	*	.	H	α-helix	trans	-69.1	-26.2	176.6	-70.3	-28.3	0	0	0	113.3	G41 N42 I43 R47 P49	G41-N45 PolarHBondContact O-N 3.49Å; G41-N45 VanDerWaalsContact O-N 3.11Å; G41-N45 PolarHBondContact O-ND2 3.34Å; N42-N45 PolarHBondContact O-N 3.23Å; I43-N45 VanDerWaalsContact C-N 3.35Å; N45-R47 PolarHBondContact O-N 2.9Å; N45-P49 WeakPolarHBondContact O-CD 3.36Å
46	L	81.6	Confident	83.4	Confident	97 Å²	97	95.9 Å²	95.9	51%	0.508	51%	0.513	S	S	.	.	H	α-helix	trans	-69.6	-16.9	172.7	-77.8	165.8	0	0	0	113.1	N42 I43 V44 S48 P49 V50	N42-L46 WeakPolarHBondContact O-CG 3.22Å; N42-L46 PolarHBondContact O-N 3.35Å; I43-L46 WeakPolarHBondContact O-CB 3.15Å; I43-L46 PolarHBondContact O-N 3.3Å; V44-L46 VanDerWaalsContact C-N 3.3Å; V44-L46 PolarHBondContact O-N 2.93Å; L46-S48 PolarHBondContact O-N 3.34Å; L46-P49 VanDerWaalsContact O-CD 3.32Å; L46-P49 WeakPolarHBondContact O-CD 3.05Å; L46-V50 VanDerWaalsContact O-CB 3.28Å; L46-V50 WeakPolarHBondContact O-CB 3.27Å; L46-V50 WeakPolarHBondContact O-CG2 3.49Å; L46-V50 PolarHBondContact O-N 3.42Å
47	R	81	Confident	83.3	Confident	174 Å²	174	93.5 Å²	93.5	66%	0.657	51%	0.51	S	S	*	.	H	α-helix	trans	-60.4	-42	-179.3	-165.9	171.5	-177	-138.4	-1.3	112.6	I43 V44 N45 V50 D51	I43-R47 PolarHBondContact O-N 3.41Å; V44-R47 WeakPolarHBondContact O-CB 3.45Å; V44-R47 PolarHBondContact O-N 2.85Å; V44-R47 VanDerWaalsContact O-N 3.16Å; N45-R47 PolarHBondContact O-N 2.9Å; R47-V50 PolarHBondContact O-N 3.45Å; R47-D51 WeakPolarHBondContact O-CB 3.46Å; R47-D51 PolarHBondContact O-N 3.38Å
48	S	80.5	Confident	83.3	Confident	64 Å²	64	94.7 Å²	94.7	45%	0.448	51%	0.51	S	S	.	.	H	α-helix	trans	-67.8	-46.9	179.9	173.2	0	0	0	0	113.8	L46 V50 D51 K52	L46-S48 PolarHBondContact O-N 3.34Å; S48-V50 VanDerWaalsContact C-N 3.31Å; S48-V50 PolarHBondContact O-N 3.42Å; S48-D51 PolarHBondContact O-N 3.44Å; S48-K52 WeakPolarHBondContact O-CG 3.33Å; S48-K52 PolarHBondContact O-N 3.42Å; S48-K52 VanDerWaalsContact O-N 3.09Å
49	P	84	Confident	83.4	Confident	62 Å²	62	93.8 Å²	93.8	40%	0.403	51%	0.506	S	S	.	.	H	α-helix	trans	-58.9	-40.1	170.5	-25.3	31.9	0	0	0	113.3	N45 L46 K52 L53	N45-P49 WeakPolarHBondContact O-CD 3.36Å; L46-P49 VanDerWaalsContact O-CD 3.32Å; L46-P49 WeakPolarHBondContact O-CD 3.05Å; P49-K52 PolarHBondContact O-N 2.73Å; P49-L53 WeakPolarHBondContact O-CB 3.46Å; P49-L53 PolarHBondContact O-N 2.84Å
50	V	83.6	Confident	83.2	Confident	70 Å²	70	91.1 Å²	91.1	42%	0.424	50%	0.498	S	S	.	.	H	α-helix	trans	-65.8	-42	177.6	170.1	0	0	0	0	111	L46 R47 S48 K52 L53 L54	L46-V50 VanDerWaalsContact O-CB 3.28Å; L46-V50 WeakPolarHBondContact O-CB 3.27Å; L46-V50 WeakPolarHBondContact O-CG2 3.49Å; L46-V50 PolarHBondContact O-N 3.42Å; R47-V50 PolarHBondContact O-N 3.45Å; S48-V50 VanDerWaalsContact C-N 3.31Å; S48-V50 PolarHBondContact O-N 3.42Å; V50-K52 VanDerWaalsContact C-N 3.33Å; V50-K52 PolarHBondContact O-N 3.06Å; V50-L53 PolarHBondContact O-N 2.84Å; V50-L54 HydrophobicContact CG1-CD1 4.07Å; V50-L54 WeakPolarHBondContact O-CB 3.37Å; V50-L54 PolarHBondContact O-N 2.82Å
51	D	85.5	Confident	83.2	Confident	75 Å²	75	91 Å²	91	40%	0.401	50%	0.501	S	S	.	.	H	α-helix	trans	-63.6	-38.1	176.5	-70.9	-23.2	0	0	0	111.5	R47 S48 L54 H55	R47-D51 WeakPolarHBondContact O-CB 3.46Å; R47-D51 PolarHBondContact O-N 3.38Å; S48-D51 PolarHBondContact O-N 3.44Å; D51-L54 WeakPolarHBondContact O-CB 3.48Å; D51-L54 PolarHBondContact O-N 3.34Å; D51-H55 PolarHBondContact O-N 2.86Å
52	K	86.5	Confident	83.1	Confident	143 Å²	143	93.4 Å²	93.4	62%	0.622	51%	0.506	S	S	*	.	H	α-helix	trans	-67.2	-40.5	174.1	-72.6	176.8	-179	177.7	0	112.5	S48 P49 V50 H55 S56	S48-K52 WeakPolarHBondContact O-CG 3.33Å; S48-K52 PolarHBondContact O-N 3.42Å; S48-K52 VanDerWaalsContact O-N 3.09Å; P49-K52 PolarHBondContact O-N 2.73Å; V50-K52 VanDerWaalsContact C-N 3.33Å; V50-K52 PolarHBondContact O-N 3.06Å; K52-H55 PolarHBondContact O-N 2.91Å; K52-S56 WeakPolarHBondContact O-CB 3.35Å; K52-S56 PolarHBondContact O-N 3.47Å; K52-S56 PolarHBondContact O-OG 3.19Å
53	L	85.4	Confident	82.9	Confident	112 Å²	112	95.7 Å²	95.7	59%	0.586	51%	0.513	S	S	*	.	H	α-helix	trans	-65.6	-42.3	173.9	-82.1	164.5	0	0	0	110.8	P49 V50 S56 V57	P49-L53 WeakPolarHBondContact O-CB 3.46Å; P49-L53 PolarHBondContact O-N 2.84Å; V50-L53 PolarHBondContact O-N 2.84Å; L53-S56 PolarHBondContact O-N 3.49Å; L53-V57 WeakPolarHBondContact O-CB 3.27Å; L53-V57 VanDerWaalsContact O-CG2 3.25Å; L53-V57 WeakPolarHBondContact O-CG2 3.36Å; L53-V57 PolarHBondContact O-N 3.2Å
54	L	86.9	Confident	82.5	Confident	97 Å²	97	96.1 Å²	96.1	51%	0.508	52%	0.516	S	S	.	.	H	α-helix	trans	-55.3	-52.1	173.1	-98.7	158.2	0	0	0	110.6	V50 D51 S56 V57 E58	V50-L54 HydrophobicContact CG1-CD1 4.07Å; V50-L54 WeakPolarHBondContact O-CB 3.37Å; V50-L54 PolarHBondContact O-N 2.82Å; D51-L54 WeakPolarHBondContact O-CB 3.48Å; D51-L54 PolarHBondContact O-N 3.34Å; L54-S56 VanDerWaalsContact C-N 3.32Å; L54-S56 PolarHBondContact O-N 2.87Å; L54-V57 CarbonylContact O-C 3.59Å; L54-V57 PolarHBondContact O-N 2.85Å; L54-E58 VanDerWaalsContact O-CB 3.25Å; L54-E58 WeakPolarHBondContact O-CB 3.41Å; L54-E58 PolarHBondContact O-N 2.86Å
55	H	85.6	Confident	82.1	Confident	116 Å²	116	97.5 Å²	97.5	54%	0.537	52%	0.52	S	S	.	.	H	α-helix	trans	-60.4	-39.9	176.5	-110.5	55.3	0	0	0	113.2	D51 K52 V57 E58 N59	D51-H55 PolarHBondContact O-N 2.86Å; K52-H55 PolarHBondContact O-N 2.91Å; H55-V57 VanDerWaalsContact C-N 3.35Å; H55-E58 IonicContact ND1-OE2 3.88Å; H55-E58 PolarHBondContact O-N 2.91Å; H55-N59 WeakPolarHBondContact O-CB 3.46Å; H55-N59 PolarHBondContact O-N 3.03Å; H55-N59 PolarHBondContact O-ND2 3.05Å
56	S	86.7	Confident	81.6	Confident	74 Å²	74	99.5 Å²	99.5	52%	0.517	53%	0.525	S	S	.	.	H	α-helix	trans	-67	-38.7	178.3	-56.5	0	0	0	0	111.6	K52 L53 L54 A60	K52-S56 WeakPolarHBondContact O-CB 3.35Å; K52-S56 PolarHBondContact O-N 3.47Å; K52-S56 PolarHBondContact O-OG 3.19Å; L53-S56 PolarHBondContact O-N 3.49Å; L54-S56 VanDerWaalsContact C-N 3.32Å; L54-S56 PolarHBondContact O-N 2.87Å; S56-A60 WeakPolarHBondContact O-CB 3.44Å; S56-A60 PolarHBondContact O-N 3.38Å
57	V	84.8	Confident	80.7	Confident	92 Å²	92	96.8 Å²	96.8	56%	0.558	51%	0.514	S	S	*	.	H	α-helix	trans	-69.7	-39.2	174.6	170	0	0	0	0	110.9	L53 L54 H55 A60 A61	L53-V57 WeakPolarHBondContact O-CB 3.27Å; L53-V57 VanDerWaalsContact O-CG2 3.25Å; L53-V57 WeakPolarHBondContact O-CG2 3.36Å; L53-V57 PolarHBondContact O-N 3.2Å; L54-V57 CarbonylContact O-C 3.59Å; L54-V57 PolarHBondContact O-N 2.85Å; H55-V57 VanDerWaalsContact C-N 3.35Å; V57-A60 PolarHBondContact O-N 2.94Å; V57-A61 WeakPolarHBondContact O-CB 3.21Å; V57-A61 PolarHBondContact O-N 2.91Å
58	E	86.6	Confident	79.9	Confident	104 Å²	104	92.7 Å²	92.7	49%	0.486	51%	0.505	S	S	.	.	H	α-helix	trans	-67.2	-40.2	178.6	-153.8	164.7	-148.8	0	0	110.4	L54 H55 A61 N62	L54-E58 VanDerWaalsContact O-CB 3.25Å; L54-E58 WeakPolarHBondContact O-CB 3.41Å; L54-E58 PolarHBondContact O-N 2.86Å; H55-E58 IonicContact ND1-OE2 3.88Å; H55-E58 PolarHBondContact O-N 2.91Å; E58-A61 PolarHBondContact O-N 2.85Å; E58-N62 VanDerWaalsContact O-CB 3.3Å; E58-N62 WeakPolarHBondContact O-CB 3.31Å; E58-N62 PolarHBondContact O-N 3.45Å; E58-N62 PolarHBondContact O-ND2 3.46Å; E58-N62 VanDerWaalsContact O-ND2 3.14Å
59	N	85.4	Confident	79.2	Confident	93 Å²	93	93.3 Å²	93.3	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-64.2	-47	171.1	-71.6	-17.9	0	0	0	112	H55 A61 N62 E63	H55-N59 WeakPolarHBondContact O-CB 3.46Å; H55-N59 PolarHBondContact O-N 3.03Å; H55-N59 PolarHBondContact O-ND2 3.05Å; N59-A61 VanDerWaalsContact C-N 3.33Å; N59-A61 PolarHBondContact O-N 2.92Å; N59-N62 PolarHBondContact O-N 3.26Å; N59-E63 PolarHBondContact O-N 3.5Å
60	A	78.7	Confident	78.3	Confident	45 Å²	45	100 Å²	100	37%	0.372	52%	0.524	S	S	.	.	H	α-helix	trans	-64.3	-37.3	176.5	0	0	0	0	0	112.2	S56 V57 E63 I64	S56-A60 WeakPolarHBondContact O-CB 3.44Å; S56-A60 PolarHBondContact O-N 3.38Å; V57-A60 PolarHBondContact O-N 2.94Å; A60-E63 PolarHBondContact O-N 2.79Å; A60-I64 WeakPolarHBondContact O-CB 3.23Å; A60-I64 WeakPolarHBondContact O-CG1 3.33Å; A60-I64 PolarHBondContact O-N 3.28Å
61	A	81.5	Confident	77.7	Confident	48 Å²	48	101.4 Å²	101.4	40%	0.397	53%	0.528	S	S	.	.	H	α-helix	trans	-66.6	-41.6	175.2	0	0	0	0	0	111	V57 E58 N59 I64 D65	V57-A61 WeakPolarHBondContact O-CB 3.21Å; V57-A61 PolarHBondContact O-N 2.91Å; E58-A61 PolarHBondContact O-N 2.85Å; N59-A61 VanDerWaalsContact C-N 3.33Å; N59-A61 PolarHBondContact O-N 2.92Å; A61-I64 CarbonylContact O-C 3.6Å; A61-I64 PolarHBondContact O-N 2.8Å; A61-D65 WeakPolarHBondContact O-CB 3.33Å; A61-D65 PolarHBondContact O-N 3.49Å
62	N	79.6	Confident	77.2	Confident	81 Å²	81	104.1 Å²	104.1	43%	0.433	54%	0.537	S	S	.	.	H	α-helix	trans	-65.7	-38.7	173.9	-73.5	-27.8	0	0	0	111.9	E58 N59 I64 D65 Q66	E58-N62 VanDerWaalsContact O-CB 3.3Å; E58-N62 WeakPolarHBondContact O-CB 3.31Å; E58-N62 PolarHBondContact O-N 3.45Å; E58-N62 PolarHBondContact O-ND2 3.46Å; E58-N62 VanDerWaalsContact O-ND2 3.14Å; N59-N62 PolarHBondContact O-N 3.26Å; N62-I64 VanDerWaalsContact C-N 3.34Å; N62-D65 PolarHBondContact O-N 2.82Å; N62-Q66 VanDerWaalsContact O-CB 3.28Å; N62-Q66 WeakPolarHBondContact O-CB 3.43Å; N62-Q66 WeakPolarHBondContact O-CG 3.17Å; N62-Q66 PolarHBondContact O-N 3.29Å
63	E	77.1	Confident	76.7	Confident	143 Å²	143	99.8 Å²	99.8	67%	0.668	53%	0.527	S	S	*	.	H	α-helix	trans	-64.4	-38.7	172	-77.1	-172.7	-178.6	0	0	111.7	N59 A60 S67	N59-E63 PolarHBondContact O-N 3.5Å; A60-E63 PolarHBondContact O-N 2.79Å; E63-S67 WeakPolarHBondContact O-CB 3.44Å; E63-S67 PolarHBondContact O-N 3.16Å; E63-S67 PolarHBondContact O-OG 3.41Å
64	I	71	Confident	76.5	Confident	110 Å²	110	99.8 Å²	99.8	56%	0.564	53%	0.528	S	S	*	.	H	α-helix	trans	-67.7	-38.9	174.5	-70.8	165.4	0	0	0	111.2	A60 A61 N62 S67	A60-I64 WeakPolarHBondContact O-CB 3.23Å; A60-I64 WeakPolarHBondContact O-CG1 3.33Å; A60-I64 PolarHBondContact O-N 3.28Å; A61-I64 CarbonylContact O-C 3.6Å; A61-I64 PolarHBondContact O-N 2.8Å; N62-I64 VanDerWaalsContact C-N 3.34Å; I64-S67 WeakPolarHBondContact CA-OG 3.3Å; I64-S67 PolarHBondContact O-N 2.89Å; I64-S67 PolarHBondContact O-OG 3.42Å
65	D	72.2	Confident	76.3	Confident	131 Å²	131	100.3 Å²	100.3	70%	0.701	53%	0.528	S	S	*	.	H	α-helix	trans	-71.3	-39	178.5	-164.1	63.8	0	0	0	112	A61 N62 S67	A61-D65 WeakPolarHBondContact O-CB 3.33Å; A61-D65 PolarHBondContact O-N 3.49Å; N62-D65 PolarHBondContact O-N 2.82Å; D65-S67 VanDerWaalsContact C-N 3.33Å
66	Q	69.3	Low	76.1	Confident	159 Å²	159	99.9 Å²	99.9	74%	0.743	53%	0.528	S	S	*	.	H	α-helix	trans	-72.6	-27.7	172	-71.5	175.5	22.1	0	0	112.5	N62 D68	N62-Q66 VanDerWaalsContact O-CB 3.28Å; N62-Q66 WeakPolarHBondContact O-CB 3.43Å; N62-Q66 WeakPolarHBondContact O-CG 3.17Å; N62-Q66 PolarHBondContact O-N 3.29Å; Q66-D68 PolarHBondContact O-N 2.91Å
67	S	63.4	Low	76	Confident	40 Å²	40	99.6 Å²	99.6	28%	0.28	52%	0.524	S	S	.	.	S	Bend	trans	-67.2	118.2	171.4	78.4	0	0	0	0	107.6	E63 I64 D65 T69	E63-S67 WeakPolarHBondContact O-CB 3.44Å; E63-S67 PolarHBondContact O-N 3.16Å; E63-S67 PolarHBondContact O-OG 3.41Å; I64-S67 WeakPolarHBondContact CA-OG 3.3Å; I64-S67 PolarHBondContact O-N 2.89Å; I64-S67 PolarHBondContact O-OG 3.42Å; D65-S67 VanDerWaalsContact C-N 3.33Å; S67-T69 PolarHBondContact O-N 3.46Å; S67-T69 PolarHBondContact O-OG1 3.43Å; S67-T69 WeakPolarHBondContact OG-CG2 3.38Å; S67-T69 PolarHBondContact OG-OG1 2.97Å
68	D	62.9	Low	76.1	Confident	88 Å²	88	101.6 Å²	101.6	47%	0.471	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	15.5	169.3	-101.9	-27.6	0	0	0	114.3	Q66 R70 L71 K72	Q66-D68 PolarHBondContact O-N 2.91Å; D68-R70 PolarHBondContact O-N 3.3Å; D68-L71 PolarHBondContact O-N 2.9Å; D68-L71 WeakPolarHBondContact OD1-CD1 3.48Å; D68-K72 HydrophobicContact CB-CD 4.14Å; D68-K72 HydrophobicContact CB-CG 4.29Å; D68-K72 VanDerWaalsContact O-CB 3.27Å; D68-K72 WeakPolarHBondContact O-CB 3.36Å; D68-K72 VanDerWaalsContact O-CG 3.29Å; D68-K72 WeakPolarHBondContact O-CG 3.43Å; D68-K72 PolarHBondContact O-N 3.45Å
69	T	66.1	Low	76.2	Confident	77 Å²	77	103.3 Å²	103.3	47%	0.472	53%	0.533	S	S	.	.	H	α-helix	trans	-53.9	-37.2	179	52.4	0	0	0	0	112.1	S67 A73	S67-T69 PolarHBondContact O-N 3.46Å; S67-T69 PolarHBondContact O-OG1 3.43Å; S67-T69 WeakPolarHBondContact OG-CG2 3.38Å; S67-T69 PolarHBondContact OG-OG1 2.97Å; T69-A73 WeakPolarHBondContact O-CB 3.26Å; T69-A73 PolarHBondContact O-N 3.3Å
70	R	66.2	Low	76.2	Confident	201 Å²	201	102.3 Å²	102.3	76%	0.758	53%	0.527	S	S	*	.	H	α-helix	trans	-69.2	-46.1	176.5	-121.7	179.8	171.1	178.3	-2.7	112.6	D68 A73 L74	D68-R70 PolarHBondContact O-N 3.3Å; R70-A73 PolarHBondContact O-N 3.06Å; R70-L74 WeakPolarHBondContact O-CG 3.3Å; R70-L74 PolarHBondContact O-N 2.92Å
71	L	70	Confident	76.7	Confident	100 Å²	100	105.7 Å²	105.7	52%	0.524	54%	0.535	S	S	.	.	H	α-helix	trans	-65.4	-46.2	176.3	-85.1	162.7	0	0	0	111.1	D68 A73 L74 E75	D68-L71 PolarHBondContact O-N 2.9Å; D68-L71 WeakPolarHBondContact OD1-CD1 3.48Å; L71-A73 VanDerWaalsContact C-N 3.34Å; L71-A73 PolarHBondContact O-N 3.5Å; L71-L74 PolarHBondContact O-N 3.24Å; L71-E75 WeakPolarHBondContact O-CB 3.39Å; L71-E75 WeakPolarHBondContact O-CG 3.47Å; L71-E75 PolarHBondContact O-N 3.43Å
72	K	75	Confident	77.2	Confident	132 Å²	132	108.8 Å²	108.8	57%	0.574	54%	0.541	S	S	*	.	H	α-helix	trans	-63.4	-36.2	175.6	-71	171.5	-177.8	171.2	0	112.7	D68 L76	D68-K72 HydrophobicContact CB-CD 4.14Å; D68-K72 HydrophobicContact CB-CG 4.29Å; D68-K72 VanDerWaalsContact O-CB 3.27Å; D68-K72 WeakPolarHBondContact O-CB 3.36Å; D68-K72 VanDerWaalsContact O-CG 3.29Å; D68-K72 WeakPolarHBondContact O-CG 3.43Å; D68-K72 PolarHBondContact O-N 3.45Å; K72-L76 WeakPolarHBondContact O-CB 3.32Å; K72-L76 PolarHBondContact O-N 2.84Å
73	A	76.2	Confident	77.6	Confident	52 Å²	52	111.1 Å²	111.1	43%	0.43	55%	0.55	S	S	.	.	H	α-helix	trans	-67.8	-42.8	175	0	0	0	0	0	111.3	T69 R70 L71 L76 T77	T69-A73 WeakPolarHBondContact O-CB 3.26Å; T69-A73 PolarHBondContact O-N 3.3Å; R70-A73 PolarHBondContact O-N 3.06Å; L71-A73 VanDerWaalsContact C-N 3.34Å; L71-A73 PolarHBondContact O-N 3.5Å; A73-L76 PolarHBondContact O-N 2.86Å; A73-T77 WeakPolarHBondContact O-CG2 3.49Å; A73-T77 PolarHBondContact O-N 3.25Å; A73-T77 PolarHBondContact O-OG1 2.85Å; A73-T77 VanDerWaalsContact O-OG1 3.06Å
74	L	80.5	Confident	78	Confident	113 Å²	113	112.9 Å²	112.9	59%	0.592	55%	0.55	S	S	*	*	H	α-helix	trans	-62.7	-48.8	175	-74.7	169.7	0	0	0	111.6	R70 L71 L76 T77 E78	R70-L74 WeakPolarHBondContact O-CG 3.3Å; R70-L74 PolarHBondContact O-N 2.92Å; L71-L74 PolarHBondContact O-N 3.24Å; L74-L76 VanDerWaalsContact C-N 3.3Å; L74-L76 PolarHBondContact O-N 2.84Å; L74-T77 VanDerWaalsContact CA-OG1 3.31Å; L74-T77 WeakPolarHBondContact CA-OG1 3.46Å; L74-T77 PolarHBondContact O-N 3.36Å; L74-T77 PolarHBondContact O-OG1 3.45Å; L74-E78 WeakPolarHBondContact O-CB 3.21Å; L74-E78 PolarHBondContact O-N 3.45Å
75	E	83.4	Confident	79	Confident	108 Å²	108	117 Å²	117	51%	0.505	56%	0.559	S	S	.	*	H	α-helix	trans	-58.7	-40.4	174.2	-74.4	179.6	-177.2	0	0	111.9	L71 E78 K79	L71-E75 WeakPolarHBondContact O-CB 3.39Å; L71-E75 WeakPolarHBondContact O-CG 3.47Å; L71-E75 PolarHBondContact O-N 3.43Å; E75-E78 PolarHBondContact O-N 3.19Å; E75-K79 WeakPolarHBondContact O-CB 3.32Å; E75-K79 WeakPolarHBondContact O-CG 3.37Å; E75-K79 PolarHBondContact O-N 3.04Å
76	L	81.6	Confident	79.8	Confident	106 Å²	106	115.9 Å²	115.9	56%	0.555	55%	0.552	S	S	*	*	H	α-helix	trans	-67.1	-42.2	176.8	-175.8	66.9	0	0	0	111.3	K72 A73 L74 K79 L80	K72-L76 WeakPolarHBondContact O-CB 3.32Å; K72-L76 PolarHBondContact O-N 2.84Å; A73-L76 PolarHBondContact O-N 2.86Å; L74-L76 VanDerWaalsContact C-N 3.3Å; L74-L76 PolarHBondContact O-N 2.84Å; L76-K79 PolarHBondContact O-N 2.91Å; L76-L80 HydrophobicContact CG-CD1 4.11Å; L76-L80 HydrophobicContact CG-CG 4.47Å; L76-L80 WeakPolarHBondContact O-CB 3.49Å; L76-L80 WeakPolarHBondContact O-CG 3.29Å; L76-L80 PolarHBondContact O-N 2.79Å
77	T	84.8	Confident	80.7	Confident	69 Å²	69	111.9 Å²	111.9	42%	0.423	54%	0.542	S	S	.	.	H	α-helix	trans	-64	-41.7	175.4	46.8	0	0	0	0	111.8	A73 L74 L80 E81	A73-T77 WeakPolarHBondContact O-CG2 3.49Å; A73-T77 PolarHBondContact O-N 3.25Å; A73-T77 PolarHBondContact O-OG1 2.85Å; A73-T77 VanDerWaalsContact O-OG1 3.06Å; L74-T77 VanDerWaalsContact CA-OG1 3.31Å; L74-T77 WeakPolarHBondContact CA-OG1 3.46Å; L74-T77 PolarHBondContact O-N 3.36Å; L74-T77 PolarHBondContact O-OG1 3.45Å; T77-L80 PolarHBondContact O-N 3.22Å; T77-E81 WeakPolarHBondContact O-CB 3.43Å; T77-E81 WeakPolarHBondContact O-CG 3.45Å; T77-E81 PolarHBondContact O-N 2.93Å
78	E	87.7	Confident	81.7	Confident	134 Å²	134	112.5 Å²	112.5	63%	0.626	55%	0.546	S	S	*	.	H	α-helix	trans	-62.3	-45.6	175.9	-173.6	177.7	-169.4	0	0	110.9	L74 E75 L80 E81 E82	L74-E78 WeakPolarHBondContact O-CB 3.21Å; L74-E78 PolarHBondContact O-N 3.45Å; E75-E78 PolarHBondContact O-N 3.19Å; E78-L80 PolarHBondContact O-N 3.06Å; E78-E81 PolarHBondContact O-N 3.48Å; E78-E82 WeakPolarHBondContact O-CB 3.26Å; E78-E82 PolarHBondContact O-N 3.49Å
79	K	87.4	Confident	82.8	Confident	139 Å²	139	110.8 Å²	110.8	60%	0.604	54%	0.54	S	S	*	.	H	α-helix	trans	-64.8	-35.9	175.1	-75.1	-170.9	178.6	-178.9	0	113.2	E75 L76 Q83	E75-K79 WeakPolarHBondContact O-CB 3.32Å; E75-K79 WeakPolarHBondContact O-CG 3.37Å; E75-K79 PolarHBondContact O-N 3.04Å; L76-K79 PolarHBondContact O-N 2.91Å; K79-Q83 VanDerWaalsContact O-CB 3.26Å; K79-Q83 WeakPolarHBondContact O-CB 3.28Å; K79-Q83 PolarHBondContact O-N 3.48Å
80	L	86.6	Confident	83.8	Confident	73 Å²	73	109.7 Å²	109.7	38%	0.382	54%	0.539	S	S	.	.	H	α-helix	trans	-69.5	-38.1	175.1	-75.2	171.8	0	0	0	111.7	L76 T77 E78 Q83 R84	L76-L80 HydrophobicContact CG-CD1 4.11Å; L76-L80 HydrophobicContact CG-CG 4.47Å; L76-L80 WeakPolarHBondContact O-CB 3.49Å; L76-L80 WeakPolarHBondContact O-CG 3.29Å; L76-L80 PolarHBondContact O-N 2.79Å; T77-L80 PolarHBondContact O-N 3.22Å; E78-L80 PolarHBondContact O-N 3.06Å; L80-Q83 PolarHBondContact O-N 2.89Å; L80-R84 WeakPolarHBondContact O-CB 3.49Å; L80-R84 VanDerWaalsContact O-CG 3.3Å; L80-R84 WeakPolarHBondContact O-CG 3.32Å; L80-R84 PolarHBondContact O-N 3.36Å
81	E	89.3	Confident	84.7	Confident	116 Å²	116	106.7 Å²	106.7	54%	0.542	53%	0.534	S	S	.	.	H	α-helix	trans	-66.1	-44.1	172.4	-76.1	-176.8	-177.5	0	0	111.4	T77 E78 Q83 R84 R85	T77-E81 WeakPolarHBondContact O-CB 3.43Å; T77-E81 WeakPolarHBondContact O-CG 3.45Å; T77-E81 PolarHBondContact O-N 2.93Å; E78-E81 PolarHBondContact O-N 3.48Å; E81-Q83 PolarHBondContact O-N 3.49Å; E81-R84 PolarHBondContact O-N 3.08Å; E81-R85 WeakPolarHBondContact O-CG 3.24Å; E81-R85 PolarHBondContact O-N 2.86Å
82	E	90.3	Very high	85.3	Confident	112 Å²	112	107.3 Å²	107.3	52%	0.523	53%	0.529	S	S	.	.	H	α-helix	trans	-59.5	-46.1	173.5	-170.4	177.3	-168.1	0	0	110.8	E78 R84 R85 L86	E78-E82 WeakPolarHBondContact O-CB 3.26Å; E78-E82 PolarHBondContact O-N 3.49Å; E82-R84 VanDerWaalsContact C-N 3.35Å; E82-R84 PolarHBondContact O-N 3.34Å; E82-R85 PolarHBondContact O-N 2.82Å; E82-R85 VanDerWaalsContact O-N 3.16Å; E82-L86 HydrophobicContact CG-CD1 4.07Å; E82-L86 HydrophobicContact CG-CG 4.38Å; E82-L86 WeakPolarHBondContact O-CB 3.36Å; E82-L86 VanDerWaalsContact O-CG 3.3Å; E82-L86 WeakPolarHBondContact O-CG 3.49Å; E82-L86 PolarHBondContact O-N 3.41Å
83	Q	88.9	Confident	85.7	Confident	130 Å²	130	106.1 Å²	106.1	61%	0.607	53%	0.528	S	S	*	.	H	α-helix	trans	-61	-40.7	175.6	-173.8	180	-4.2	0	0	112	K79 L80 E81 L86 S87	K79-Q83 VanDerWaalsContact O-CB 3.26Å; K79-Q83 WeakPolarHBondContact O-CB 3.28Å; K79-Q83 PolarHBondContact O-N 3.48Å; L80-Q83 PolarHBondContact O-N 2.89Å; E81-Q83 PolarHBondContact O-N 3.49Å; Q83-L86 PolarHBondContact O-N 3.48Å; Q83-S87 VanDerWaalsContact O-CB 3.26Å; Q83-S87 WeakPolarHBondContact O-CB 3.37Å; Q83-S87 PolarHBondContact O-N 3.34Å
84	R	86.4	Confident	86.2	Confident	181 Å²	181	109.3 Å²	109.3	68%	0.683	53%	0.534	S	S	*	.	H	α-helix	trans	-64.5	-42.4	173.9	-76.3	174.3	-174.8	166.8	2.8	111.6	L80 E81 E82 S87 S88	L80-R84 WeakPolarHBondContact O-CB 3.49Å; L80-R84 VanDerWaalsContact O-CG 3.3Å; L80-R84 WeakPolarHBondContact O-CG 3.32Å; L80-R84 PolarHBondContact O-N 3.36Å; E81-R84 PolarHBondContact O-N 3.08Å; E82-R84 VanDerWaalsContact C-N 3.35Å; E82-R84 PolarHBondContact O-N 3.34Å; R84-S87 PolarHBondContact O-N 2.96Å; R84-S88 WeakPolarHBondContact O-CB 3.3Å; R84-S88 PolarHBondContact O-N 3.26Å
85	R	90.1	Very high	86.2	Confident	196 Å²	196	105.9 Å²	105.9	74%	0.74	52%	0.52	S	S	*	.	H	α-helix	trans	-64.8	-43.5	177	-72	-177.8	94.3	135.7	4.6	111.4	E81 E82 S88 C89	E81-R85 WeakPolarHBondContact O-CG 3.24Å; E81-R85 PolarHBondContact O-N 2.86Å; E82-R85 PolarHBondContact O-N 2.82Å; E82-R85 VanDerWaalsContact O-N 3.16Å; R85-S88 PolarHBondContact O-N 3.09Å; R85-C89 VanDerWaalsContact O-CB 3.28Å; R85-C89 WeakPolarHBondContact O-CB 3.49Å; R85-C89 PolarHBondContact O-N 3.34Å
86	L	89.8	Confident	86.2	Confident	108 Å²	108	104.3 Å²	104.3	57%	0.565	51%	0.512	S	S	*	.	H	α-helix	trans	-64.1	-44.2	175.5	-72.4	172.9	0	0	0	111.3	E82 Q83 C89 A90	E82-L86 HydrophobicContact CG-CD1 4.07Å; E82-L86 HydrophobicContact CG-CG 4.38Å; E82-L86 WeakPolarHBondContact O-CB 3.36Å; E82-L86 VanDerWaalsContact O-CG 3.3Å; E82-L86 WeakPolarHBondContact O-CG 3.49Å; E82-L86 PolarHBondContact O-N 3.41Å; Q83-L86 PolarHBondContact O-N 3.48Å; L86-C89 WeakPolarHBondContact O-CB 3.42Å; L86-C89 PolarHBondContact O-N 2.91Å; L86-A90 WeakPolarHBondContact O-CB 3.2Å; L86-A90 PolarHBondContact O-N 3.15Å
87	S	87.3	Confident	86.4	Confident	75 Å²	75	103.9 Å²	103.9	52%	0.524	51%	0.509	S	S	.	.	H	α-helix	trans	-62.1	-43.9	175.9	-172.4	0	0	0	0	112.1	Q83 R84 A90 Q91	Q83-S87 VanDerWaalsContact O-CB 3.26Å; Q83-S87 WeakPolarHBondContact O-CB 3.37Å; Q83-S87 PolarHBondContact O-N 3.34Å; R84-S87 PolarHBondContact O-N 2.96Å; S87-A90 PolarHBondContact O-N 3.49Å; S87-Q91 WeakPolarHBondContact O-CB 3.42Å; S87-Q91 PolarHBondContact O-N 3.3Å
88	S	85.5	Confident	86.5	Confident	53 Å²	53	104.3 Å²	104.3	37%	0.371	51%	0.508	S	S	.	.	H	α-helix	trans	-65.1	-38.8	174.9	171.1	0	0	0	0	112.1	R84 R85 R92	R84-S88 WeakPolarHBondContact O-CB 3.3Å; R84-S88 PolarHBondContact O-N 3.26Å; R85-S88 PolarHBondContact O-N 3.09Å; S88-R92 WeakPolarHBondContact O-CG 3.22Å; S88-R92 PolarHBondContact O-N 3.49Å; S88-R92 VanDerWaalsContact O-N 3.09Å; S88-R92 PolarHBondContact O-NE 3.33Å; S88-R92 VanDerWaalsContact O-NE 3.08Å; S88-R92 PolarHBondContact OG-NE 2.89Å
89	C	85.9	Confident	86.3	Confident	51 Å²	51	98.6 Å²	98.6	35%	0.345	48%	0.482	S	S	.	.	H	α-helix	trans	-64	-45.4	174.3	-166.1	0	0	0	0	111	R85 L86 Q91 R92 L93	R85-C89 VanDerWaalsContact O-CB 3.28Å; R85-C89 WeakPolarHBondContact O-CB 3.49Å; R85-C89 PolarHBondContact O-N 3.34Å; L86-C89 WeakPolarHBondContact O-CB 3.42Å; L86-C89 PolarHBondContact O-N 2.91Å; C89-Q91 PolarHBondContact O-N 2.86Å; C89-R92 PolarHBondContact O-N 3.01Å; C89-L93 WeakPolarHBondContact O-CB 3.49Å; C89-L93 WeakPolarHBondContact O-CG 3.4Å; C89-L93 PolarHBondContact O-N 2.95Å
90	A	86.9	Confident	86.2	Confident	54 Å²	54	97.2 Å²	97.2	45%	0.446	48%	0.479	S	S	.	.	H	α-helix	trans	-60.8	-43.5	176.9	0	0	0	0	0	112	L86 S87 R92 L93 Q94	L86-A90 WeakPolarHBondContact O-CB 3.2Å; L86-A90 PolarHBondContact O-N 3.15Å; S87-A90 PolarHBondContact O-N 3.49Å; A90-R92 PolarHBondContact O-N 2.94Å; A90-L93 PolarHBondContact O-N 3.43Å; A90-Q94 VanDerWaalsContact O-CB 3.3Å; A90-Q94 WeakPolarHBondContact O-CB 3.33Å; A90-Q94 PolarHBondContact O-N 3.27Å
91	Q	84.3	Confident	86.3	Confident	138 Å²	138	98.9 Å²	98.9	65%	0.645	49%	0.485	S	S	*	.	H	α-helix	trans	-63.1	-41.4	176	-172.8	179.3	-6	0	0	112.1	S87 C89 Q94 S95	S87-Q91 WeakPolarHBondContact O-CB 3.42Å; S87-Q91 PolarHBondContact O-N 3.3Å; C89-Q91 PolarHBondContact O-N 2.86Å; Q91-Q94 PolarHBondContact O-N 3.01Å; Q91-S95 PolarHBondContact O-N 3.46Å
92	R	82.7	Confident	86.2	Confident	113 Å²	113	94.6 Å²	94.6	43%	0.426	47%	0.466	S	S	.	.	H	α-helix	trans	-64.7	-44.5	174.7	-75.4	177.5	-73.8	159.8	-4.4	112.1	S88 C89 A90 Q94 S95 K96	S88-R92 WeakPolarHBondContact O-CG 3.22Å; S88-R92 PolarHBondContact O-N 3.49Å; S88-R92 VanDerWaalsContact O-N 3.09Å; S88-R92 PolarHBondContact O-NE 3.33Å; S88-R92 VanDerWaalsContact O-NE 3.08Å; S88-R92 PolarHBondContact OG-NE 2.89Å; C89-R92 PolarHBondContact O-N 3.01Å; A90-R92 PolarHBondContact O-N 2.94Å; R92-Q94 VanDerWaalsContact C-N 3.34Å; R92-S95 PolarHBondContact O-N 3.36Å; R92-K96 WeakPolarHBondContact O-CG 3.34Å; R92-K96 PolarHBondContact O-N 3.31Å
93	L	84.7	Confident	86	Confident	107 Å²	107	91.6 Å²	91.6	56%	0.56	45%	0.453	S	S	*	.	H	α-helix	trans	-61	-42.5	174.9	-83.1	156	0	0	0	111.5	C89 A90 K96 L97	C89-L93 WeakPolarHBondContact O-CB 3.49Å; C89-L93 WeakPolarHBondContact O-CG 3.4Å; C89-L93 PolarHBondContact O-N 2.95Å; A90-L93 PolarHBondContact O-N 3.43Å; L93-K96 PolarHBondContact O-N 3.48Å; L93-L97 WeakPolarHBondContact O-CB 3.3Å; L93-L97 PolarHBondContact O-N 2.79Å
94	Q	85.2	Confident	85.9	Confident	119 Å²	119	91.4 Å²	91.4	56%	0.556	45%	0.452	S	S	*	.	H	α-helix	trans	-63.2	-44.5	176.7	-174.7	179.4	2	0	0	111.7	A90 Q91 R92 K96 L97 I98	A90-Q94 VanDerWaalsContact O-CB 3.3Å; A90-Q94 WeakPolarHBondContact O-CB 3.33Å; A90-Q94 PolarHBondContact O-N 3.27Å; Q91-Q94 PolarHBondContact O-N 3.01Å; R92-Q94 VanDerWaalsContact C-N 3.34Å; Q94-K96 VanDerWaalsContact C-N 3.35Å; Q94-K96 PolarHBondContact O-N 2.86Å; Q94-L97 PolarHBondContact O-N 2.69Å; Q94-I98 HydrophobicContact CG-CD1 4.04Å; Q94-I98 VanDerWaalsContact O-CG1 3.3Å; Q94-I98 WeakPolarHBondContact O-CG1 3.39Å; Q94-I98 PolarHBondContact O-N 3.05Å
95	S	82.4	Confident	85.9	Confident	41 Å²	41	89.4 Å²	89.4	29%	0.287	45%	0.445	S	S	.	.	H	α-helix	trans	-59.6	-44	174.9	-176.8	0	0	0	0	112	Q91 R92 I98 T99	Q91-S95 PolarHBondContact O-N 3.46Å; R92-S95 PolarHBondContact O-N 3.36Å; S95-I98 PolarHBondContact O-N 2.91Å; S95-T99 WeakPolarHBondContact O-CB 3.29Å; S95-T99 PolarHBondContact O-N 3.49Å; S95-T99 PolarHBondContact O-OG1 3.49Å
96	K	83.1	Confident	85.7	Confident	76 Å²	76	80.1 Å²	80.1	33%	0.33	41%	0.41	S	S	.	.	H	α-helix	trans	-62	-44.9	175.1	-72.5	177.9	-178.3	-174.9	0	111.7	R92 L93 Q94 T99 M100 E139 N142	R92-K96 WeakPolarHBondContact O-CG 3.34Å; R92-K96 PolarHBondContact O-N 3.31Å; L93-K96 PolarHBondContact O-N 3.48Å; Q94-K96 VanDerWaalsContact C-N 3.35Å; Q94-K96 PolarHBondContact O-N 2.86Å; K96-T99 PolarHBondContact O-N 3.28Å; K96-M100 WeakPolarHBondContact O-CB 3.33Å; K96-M100 WeakPolarHBondContact O-CG 3.41Å; K96-M100 PolarHBondContact O-N 3.16Å; K96-E139 WeakPolarHBondContact CE-OE2 3.5Å; K96-E139 IonicContact NZ-OE1 2.73Å; K96-E139 PolarHBondContact NZ-OE1 3.28Å; K96-E139 VanDerWaalsContact NZ-OE1 3.16Å; K96-E139 IonicContact NZ-OE2 3.85Å; K96-E139 PolarHBondContact NZ-OE2 2.92Å; K96-N142 VanDerWaalsContact CE-ND2 3.3Å; K96-N142 WeakPolarHBondContact CE-ND2 3.3Å
97	L	85.8	Confident	85.5	Confident	96 Å²	96	81.3 Å²	81.3	50%	0.503	41%	0.41	S	S	.	.	H	α-helix	trans	-61.3	-45.9	178.4	-175.3	68.7	0	0	0	111.6	L93 Q94 T99 M100 Q101	L93-L97 WeakPolarHBondContact O-CB 3.3Å; L93-L97 PolarHBondContact O-N 2.79Å; Q94-L97 PolarHBondContact O-N 2.69Å; L97-T99 VanDerWaalsContact C-N 3.34Å; L97-T99 PolarHBondContact O-N 3.4Å; L97-M100 PolarHBondContact O-N 2.99Å; L97-Q101 WeakPolarHBondContact O-CG 3.44Å; L97-Q101 PolarHBondContact O-N 3.46Å
98	I	86.1	Confident	85.4	Confident	79 Å²	79	81.2 Å²	81.2	41%	0.405	41%	0.409	S	S	.	.	H	α-helix	trans	-61	-45.4	176.5	-68.4	166.6	0	0	0	110.1	Q94 S95 M100 Q101 L102	Q94-I98 HydrophobicContact CG-CD1 4.04Å; Q94-I98 VanDerWaalsContact O-CG1 3.3Å; Q94-I98 WeakPolarHBondContact O-CG1 3.39Å; Q94-I98 PolarHBondContact O-N 3.05Å; S95-I98 PolarHBondContact O-N 2.91Å; I98-M100 PolarHBondContact O-N 3.27Å; I98-Q101 PolarHBondContact O-N 2.92Å; I98-L102 HydrophobicContact CG2-CD1 4.05Å; I98-L102 HydrophobicContact CG2-CG 4.42Å; I98-L102 VanDerWaalsContact O-CG 3.29Å; I98-L102 WeakPolarHBondContact O-CG 3.36Å; I98-L102 PolarHBondContact O-N 2.98Å
99	T	84.4	Confident	85.3	Confident	13 Å²	13	80.1 Å²	80.1	8%	0.08	40%	0.4	C	S	.	.	H	α-helix	trans	-61.2	-43.6	177.8	-55.6	0	0	0	0	111.7	S95 K96 L97 Q101 L102 L103 L146	S95-T99 WeakPolarHBondContact O-CB 3.29Å; S95-T99 PolarHBondContact O-N 3.49Å; S95-T99 PolarHBondContact O-OG1 3.49Å; K96-T99 PolarHBondContact O-N 3.28Å; L97-T99 VanDerWaalsContact C-N 3.34Å; L97-T99 PolarHBondContact O-N 3.4Å; T99-Q101 PolarHBondContact O-N 3.44Å; T99-L102 WeakPolarHBondContact O-CB 3.43Å; T99-L102 PolarHBondContact O-N 2.9Å; T99-L103 WeakPolarHBondContact O-CG 3.43Å; T99-L103 PolarHBondContact O-N 3.26Å; T99-L146 HydrophobicContact CG2-CD1 3.81Å; T99-L146 HydrophobicContact CG2-CD2 3.55Å; T99-L146 HydrophobicContact CG2-CG 4.32Å
100	M	84.7	Confident	85	Confident	110 Å²	110	79.6 Å²	79.6	54%	0.542	39%	0.393	S	S	.	.	H	α-helix	trans	-61.8	-43.3	175.6	-74.6	177.6	66.1	0	0	112	K96 L97 I98 L102 L103 Q104	K96-M100 WeakPolarHBondContact O-CB 3.33Å; K96-M100 WeakPolarHBondContact O-CG 3.41Å; K96-M100 PolarHBondContact O-N 3.16Å; L97-M100 PolarHBondContact O-N 2.99Å; I98-M100 PolarHBondContact O-N 3.27Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 3.37Å; M100-L103 PolarHBondContact O-N 2.94Å; M100-Q104 WeakPolarHBondContact O-CB 3.48Å; M100-Q104 VanDerWaalsContact O-CG 3.3Å; M100-Q104 WeakPolarHBondContact O-CG 3.41Å; M100-Q104 PolarHBondContact O-N 3.22Å
101	Q	88.4	Confident	84.7	Confident	109 Å²	109	84.3 Å²	84.3	51%	0.509	40%	0.403	S	S	.	.	H	α-helix	trans	-63.2	-39.6	176	-72.8	175.2	-5	0	0	111.9	L97 I98 T99 Q104 R105	L97-Q101 WeakPolarHBondContact O-CG 3.44Å; L97-Q101 PolarHBondContact O-N 3.46Å; I98-Q101 PolarHBondContact O-N 2.92Å; T99-Q101 PolarHBondContact O-N 3.44Å; Q101-Q104 PolarHBondContact O-N 2.83Å; Q101-R105 WeakPolarHBondContact O-CB 3.38Å; Q101-R105 PolarHBondContact O-N 2.96Å
102	L	87.1	Confident	84.3	Confident	25 Å²	25	79.9 Å²	79.9	13%	0.131	39%	0.388	C	S	.	.	H	α-helix	trans	-61.8	-47.5	175	-71.6	169.8	0	0	0	111.5	I98 T99 M100 R105 I106 Q126 K129	I98-L102 HydrophobicContact CG2-CD1 4.05Å; I98-L102 HydrophobicContact CG2-CG 4.42Å; I98-L102 VanDerWaalsContact O-CG 3.29Å; I98-L102 WeakPolarHBondContact O-CG 3.36Å; I98-L102 PolarHBondContact O-N 2.98Å; T99-L102 WeakPolarHBondContact O-CB 3.43Å; T99-L102 PolarHBondContact O-N 2.9Å; M100-L102 VanDerWaalsContact C-N 3.34Å; M100-L102 PolarHBondContact O-N 3.37Å; L102-R105 WeakPolarHBondContact O-CB 3.3Å; L102-R105 PolarHBondContact O-N 3.31Å; L102-I106 WeakPolarHBondContact O-CG1 3.38Å; L102-I106 PolarHBondContact O-N 3.15Å; L102-Q126 VanDerWaalsContact CD2-OE1 3.28Å; L102-K129 HydrophobicContact CD2-CB 4.33Å; L102-K129 HydrophobicContact CD2-CD 4.36Å
103	L	85.7	Confident	83.1	Confident	50 Å²	50	80.5 Å²	80.5	26%	0.262	41%	0.41	S	S	.	.	H	α-helix	trans	-65	-39.1	177.3	-68.8	176.7	0	0	0	112.6	T99 M100 R105 I106 K107 L146	T99-L103 WeakPolarHBondContact O-CG 3.43Å; T99-L103 PolarHBondContact O-N 3.26Å; M100-L103 PolarHBondContact O-N 2.94Å; L103-R105 VanDerWaalsContact C-N 3.29Å; L103-R105 PolarHBondContact O-N 3.34Å; L103-I106 PolarHBondContact O-N 2.67Å; L103-K107 WeakPolarHBondContact O-CB 3.37Å; L103-K107 PolarHBondContact O-N 3.43Å; L103-L146 HydrophobicContact CD1-CD2 3.66Å; L103-L146 HydrophobicContact CD2-CD2 4.43Å; L103-L146 HydrophobicContact CG-CD2 4.36Å
104	Q	87.2	Confident	82.2	Confident	125 Å²	125	82 Å²	82	58%	0.584	42%	0.418	S	S	*	.	H	α-helix	trans	-61.8	-40	173.5	-77	177.4	-7.3	0	0	111.3	M100 Q101 K107 S108	M100-Q104 WeakPolarHBondContact O-CB 3.48Å; M100-Q104 VanDerWaalsContact O-CG 3.3Å; M100-Q104 WeakPolarHBondContact O-CG 3.41Å; M100-Q104 PolarHBondContact O-N 3.22Å; Q101-Q104 PolarHBondContact O-N 2.83Å; Q104-K107 PolarHBondContact O-N 2.94Å; Q104-S108 PolarHBondContact O-N 3.07Å
105	R	86.8	Confident	81.3	Confident	139 Å²	139	77.6 Å²	77.6	53%	0.525	40%	0.4	S	S	.	.	H	α-helix	trans	-65.3	-45.4	175.8	-167.8	171.7	-175.3	159.8	3.9	111.5	Q101 L102 L103 K107 S108 L109 Q126	Q101-R105 WeakPolarHBondContact O-CB 3.38Å; Q101-R105 PolarHBondContact O-N 2.96Å; L102-R105 WeakPolarHBondContact O-CB 3.3Å; L102-R105 PolarHBondContact O-N 3.31Å; L103-R105 VanDerWaalsContact C-N 3.29Å; L103-R105 PolarHBondContact O-N 3.34Å; R105-K107 VanDerWaalsContact C-N 3.33Å; R105-K107 PolarHBondContact O-N 2.91Å; R105-S108 PolarHBondContact O-N 3.24Å; R105-S108 VanDerWaalsContact O-N 3.15Å; R105-S108 PolarHBondContact O-OG 2.87Å; R105-L109 HydrophobicContact CG-CD1 4.33Å; R105-L109 WeakPolarHBondContact O-CG 3.41Å; R105-L109 PolarHBondContact O-N 3.4Å; R105-Q126 HydrophobicContact CG-CG 4.43Å
106	I	86.1	Confident	80.9	Confident	2 Å²	2	81.4 Å²	81.4	1%	0.01	42%	0.417	C	S	.	.	H	α-helix	trans	-56.9	-48.1	173.3	-69.1	167.5	0	0	0	110.2	L102 L103 S108 L109 L110 L123 Q126 I127 A130 I153	L102-I106 WeakPolarHBondContact O-CG1 3.38Å; L102-I106 PolarHBondContact O-N 3.15Å; L103-I106 PolarHBondContact O-N 2.67Å; I106-S108 VanDerWaalsContact C-N 3.28Å; I106-S108 PolarHBondContact O-N 3.45Å; I106-L109 PolarHBondContact O-N 3.35Å; I106-L109 VanDerWaalsContact O-N 3.13Å; I106-L110 HydrophobicContact CG2-CD1 3.82Å; I106-L110 HydrophobicContact CG2-CG 4.27Å; I106-L110 WeakPolarHBondContact O-CG 3.44Å; I106-L110 PolarHBondContact O-N 3.41Å; I106-L123 HydrophobicContact CG2-CD1 3.99Å; I106-Q126 HydrophobicContact CD1-CB 4.19Å; I106-Q126 HydrophobicContact CG1-CB 3.65Å; I106-I127 HydrophobicContact CD1-CG1 4.25Å; I106-A130 HydrophobicContact CD1-CB 4.05Å; I106-I153 HydrophobicContact CG2-CD1 3.9Å
107	K	85.4	Confident	80.3	Confident	133 Å²	133	80.3 Å²	80.3	58%	0.578	42%	0.419	S	S	*	.	H	α-helix	trans	-58.8	-37.6	176.6	-176.5	177.4	-177.7	175.1	0	112.8	L103 Q104 R105 K111	L103-K107 WeakPolarHBondContact O-CB 3.37Å; L103-K107 PolarHBondContact O-N 3.43Å; Q104-K107 PolarHBondContact O-N 2.94Å; R105-K107 VanDerWaalsContact C-N 3.33Å; R105-K107 PolarHBondContact O-N 2.91Å; K107-K111 WeakPolarHBondContact O-CG 3.49Å; K107-K111 PolarHBondContact O-N 3.2Å
108	S	84.6	Confident	80.1	Confident	72 Å²	72	83.1 Å²	83.1	50%	0.503	43%	0.427	S	S	.	.	H	α-helix	trans	-68.7	-38	176.8	72.1	0	0	0	0	112.4	Q104 R105 I106 K111	Q104-S108 PolarHBondContact O-N 3.07Å; R105-S108 PolarHBondContact O-N 3.24Å; R105-S108 VanDerWaalsContact O-N 3.15Å; R105-S108 PolarHBondContact O-OG 2.87Å; I106-S108 VanDerWaalsContact C-N 3.28Å; I106-S108 PolarHBondContact O-N 3.45Å; S108-K111 PolarHBondContact O-N 3.36Å
109	L	83.1	Confident	80	Confident	31 Å²	31	80.6 Å²	80.6	16%	0.162	42%	0.415	C	S	.	.	H	α-helix	trans	-71.7	-37.3	178.3	-66.5	166.7	0	0	0	111.6	R105 I106 K111 S112 V119 V122 L123 Q126	R105-L109 HydrophobicContact CG-CD1 4.33Å; R105-L109 WeakPolarHBondContact O-CG 3.41Å; R105-L109 PolarHBondContact O-N 3.4Å; I106-L109 PolarHBondContact O-N 3.35Å; I106-L109 VanDerWaalsContact O-N 3.13Å; L109-K111 PolarHBondContact O-N 3.01Å; L109-S112 PolarHBondContact O-N 3.15Å; L109-S112 PolarHBondContact O-OG 3.46Å; L109-V119 HydrophobicContact CD2-CG1 4.13Å; L109-V122 HydrophobicContact CD1-CG1 3.85Å; L109-V122 HydrophobicContact CD2-CG1 4.36Å; L109-L123 HydrophobicContact CB-CD1 4.16Å; L109-L123 HydrophobicContact CD1-CD1 4.38Å; L109-Q126 HydrophobicContact CD1-CG 4.03Å
110	L	81.2	Confident	79.9	Confident	40 Å²	40	80.1 Å²	80.1	21%	0.209	41%	0.412	C	S	.	.	H	α-helix	trans	-67.5	-19.4	176.1	-69	172.3	0	0	0	113.5	I106 L123 I153 Y156 L157	I106-L110 HydrophobicContact CG2-CD1 3.82Å; I106-L110 HydrophobicContact CG2-CG 4.27Å; I106-L110 WeakPolarHBondContact O-CG 3.44Å; I106-L110 PolarHBondContact O-N 3.41Å; L110-L123 HydrophobicContact CD2-CD1 4.32Å; L110-L123 HydrophobicContact CD2-CD2 3.84Å; L110-L123 HydrophobicContact CG-CD1 4.4Å; L110-I153 HydrophobicContact CD1-CG1 4.28Å; L110-I153 HydrophobicContact CD1-CG2 4.35Å; L110-Y156 HydrophobicContact CD2-CD1 4.15Å; L110-Y156 HydrophobicContact CD2-CE1 4.06Å; L110-L157 HydrophobicContact CD2-CD2 3.72Å; L110-L157 HydrophobicContact CD2-CG 4.47Å
111	K	79.7	Confident	79.9	Confident	152 Å²	152	75.4 Å²	75.4	66%	0.661	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-9	178.1	-77.2	-179	175	-165.5	0	114	K107 S108 L109 S113	K107-K111 WeakPolarHBondContact O-CG 3.49Å; K107-K111 PolarHBondContact O-N 3.2Å; S108-K111 PolarHBondContact O-N 3.36Å; L109-K111 PolarHBondContact O-N 3.01Å; K111-S113 PolarHBondContact O-N 2.89Å
112	S	75.5	Confident	79.8	Confident	45 Å²	45	71.1 Å²	71.1	32%	0.315	37%	0.371	S	S	.	.			trans	-69.4	117.6	177.1	62	0	0	0	0	109.4	L109 N114	L109-S112 PolarHBondContact O-N 3.15Å; L109-S112 PolarHBondContact O-OG 3.46Å; S112-N114 PolarHBondContact O-N 3.13Å
113	S	58.1	Low	79.9	Confident	127 Å²	127	70 Å²	70	89%	0.888	37%	0.366	S	S	*	.	S	Bend	trans	-62.9	-11.7	-174.2	-52.9	0	0	0	0	115.2	K111	K111-S113 PolarHBondContact O-N 2.89Å
114	N	65.1	Low	80	Confident	138 Å²	138	67.8 Å²	67.8	74%	0.738	35%	0.354	S	S	*	.	S	Bend	trans	-153.4	95.7	172.6	-133	-11.3	0	0	0	107.9	S112 D116	S112-N114 PolarHBondContact O-N 3.13Å; N114-D116 PolarHBondContact O-N 3.3Å; N114-D116 VanDerWaalsContact O-N 3.17Å
115	P	67.5	Low	80.1	Confident	27 Å²	27	68.5 Å²	68.5	18%	0.175	35%	0.352	C	S	.	.			trans	-74.2	110.6	-179.3	26.4	-28.5	0	0	0	109.6	V119 L120 F161	P115-V119 HydrophobicContact CB-CB 3.76Å; P115-V119 HydrophobicContact CB-CG1 3.63Å; P115-L120 HydrophobicContact CB-CD2 4.07Å; P115-L120 HydrophobicContact CB-CG 4.41Å; P115-L120 HydrophobicContact CG-CD2 4.01Å; P115-F161 HydrophobicContact CG-CE1 3.43Å; P115-F161 VanDerWaalsContact CG-CE1 3.43Å; P115-F161 HydrophobicContact CG-CZ 3.43Å; P115-F161 VanDerWaalsContact CG-CZ 3.43Å
116	D	73.7	Confident	80.1	Confident	120 Å²	120	62.3 Å²	62.3	64%	0.642	33%	0.329	S	S	*	.			trans	-56.5	160.9	168.4	-65.6	-31.8	0	0	0	111	N114 F118 V119 L120	N114-D116 PolarHBondContact O-N 3.3Å; N114-D116 VanDerWaalsContact O-N 3.17Å; D116-F118 PolarHBondContact O-N 3.49Å; D116-V119 HydrophobicContact CB-CG2 4.45Å; D116-V119 WeakPolarHBondContact O-CA 3.39Å; D116-V119 WeakPolarHBondContact O-CB 3.4Å; D116-V119 PolarHBondContact O-N 3.17Å; D116-L120 PolarHBondContact O-N 3.44Å
117	S	71.3	Confident	80.2	Confident	53 Å²	53	62.3 Å²	62.3	37%	0.371	33%	0.329	S	S	.	.	H	α-helix	trans	-47.4	-33.9	175.6	-178.2	0	0	0	0	113.7	S121	S117-S121 PolarHBondContact O-N 3.08Å; S117-S121 PolarHBondContact O-OG 3.36Å; S117-S121 VanDerWaalsContact O-OG 3.14Å
118	F	80.3	Confident	80.3	Confident	156 Å²	156	60.6 Å²	60.6	68%	0.684	33%	0.325	S	S	*	.	H	α-helix	trans	-66.9	-42.3	174.5	-179.1	-102.3	0	0	0	113	D116 L120 S121 V122	D116-F118 PolarHBondContact O-N 3.49Å; F118-L120 PolarHBondContact O-N 3.35Å; F118-S121 PolarHBondContact O-N 2.75Å; F118-V122 HydrophobicContact CD1-CG2 4.15Å; F118-V122 HydrophobicContact CE1-CG2 3.73Å; F118-V122 HydrophobicContact CE2-CG2 4.2Å; F118-V122 HydrophobicContact CZ-CG2 3.76Å; F118-V122 WeakPolarHBondContact O-CG2 3.42Å; F118-V122 PolarHBondContact O-N 3.42Å
119	V	83.8	Confident	80.6	Confident	25 Å²	25	62.2 Å²	62.2	15%	0.152	32%	0.323	C	S	.	.	H	α-helix	trans	-64.2	-41.8	-179.3	-179.6	0	0	0	0	110.5	L109 P115 D116 S121 V122 L123	L109-V119 HydrophobicContact CD2-CG1 4.13Å; P115-V119 HydrophobicContact CB-CB 3.76Å; P115-V119 HydrophobicContact CB-CG1 3.63Å; D116-V119 HydrophobicContact CB-CG2 4.45Å; D116-V119 WeakPolarHBondContact O-CA 3.39Å; D116-V119 WeakPolarHBondContact O-CB 3.4Å; D116-V119 PolarHBondContact O-N 3.17Å; V119-S121 PolarHBondContact O-N 3.23Å; V119-V122 PolarHBondContact O-N 3.09Å; V119-L123 VanDerWaalsContact O-CB 3.3Å; V119-L123 WeakPolarHBondContact O-CB 3.27Å; V119-L123 PolarHBondContact O-N 2.75Å
120	L	83.4	Confident	80.7	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-59.6	-44.6	176.5	-62.6	176.7	0	0	0	111.9	P115 D116 F118 V122 L123 A124 F161 K179 L180 L183	P115-L120 HydrophobicContact CB-CD2 4.07Å; P115-L120 HydrophobicContact CB-CG 4.41Å; P115-L120 HydrophobicContact CG-CD2 4.01Å; D116-L120 PolarHBondContact O-N 3.44Å; F118-L120 PolarHBondContact O-N 3.35Å; L120-V122 PolarHBondContact O-N 3.38Å; L120-L123 PolarHBondContact O-N 3.33Å; L120-A124 WeakPolarHBondContact O-CB 3.32Å; L120-A124 PolarHBondContact O-N 3.29Å; L120-F161 HydrophobicContact CD2-CD1 4.23Å; L120-F161 HydrophobicContact CD2-CE1 3.97Å; L120-F161 HydrophobicContact CD2-CZ 4.24Å; L120-K179 HydrophobicContact CB-CB 4.33Å; L120-K179 HydrophobicContact CD1-CB 4.45Å; L120-L180 HydrophobicContact CD1-CD2 4.07Å; L120-L183 HydrophobicContact CD2-CD2 3.85Å
121	S	83.9	Confident	81	Confident	12 Å²	12	62.2 Å²	62.2	8%	0.084	32%	0.322	C	S	.	.	H	α-helix	trans	-63.7	-41.6	177	-57	0	0	0	0	112.4	S117 F118 V119 R125 K179	S117-S121 PolarHBondContact O-N 3.08Å; S117-S121 PolarHBondContact O-OG 3.36Å; S117-S121 VanDerWaalsContact O-OG 3.14Å; F118-S121 PolarHBondContact O-N 2.75Å; V119-S121 PolarHBondContact O-N 3.23Å; S121-R125 PolarHBondContact O-N 3.44Å; S121-K179 WeakPolarHBondContact OG-CD 3.4Å; S121-K179 WeakPolarHBondContact OG-CE 3.37Å; S121-K179 PolarHBondContact OG-NZ 2.96Å
122	V	87.5	Confident	81.3	Confident	18 Å²	18	58.3 Å²	58.3	11%	0.109	31%	0.31	C	S	.	.	H	α-helix	trans	-67	-41.8	177.8	174.6	0	0	0	0	110.2	L109 F118 V119 L120 R125 Q126	L109-V122 HydrophobicContact CD1-CG1 3.85Å; L109-V122 HydrophobicContact CD2-CG1 4.36Å; F118-V122 HydrophobicContact CD1-CG2 4.15Å; F118-V122 HydrophobicContact CE1-CG2 3.73Å; F118-V122 HydrophobicContact CE2-CG2 4.2Å; F118-V122 HydrophobicContact CZ-CG2 3.76Å; F118-V122 WeakPolarHBondContact O-CG2 3.42Å; F118-V122 PolarHBondContact O-N 3.42Å; V119-V122 PolarHBondContact O-N 3.09Å; L120-V122 PolarHBondContact O-N 3.38Å; V122-R125 PolarHBondContact O-N 2.86Å; V122-Q126 HydrophobicContact CG1-CG 4.45Å; V122-Q126 WeakPolarHBondContact O-CG 3.36Å; V122-Q126 PolarHBondContact O-N 3.42Å
123	L	87.7	Confident	81.7	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.016	30%	0.301	C	S	.	.	H	α-helix	trans	-61.1	-49	177.7	-177.9	62.7	0	0	0	111.2	I106 L109 L110 V119 L120 R125 Q126 I127 L157 L183	I106-L123 HydrophobicContact CG2-CD1 3.99Å; L109-L123 HydrophobicContact CB-CD1 4.16Å; L109-L123 HydrophobicContact CD1-CD1 4.38Å; L110-L123 HydrophobicContact CD2-CD1 4.32Å; L110-L123 HydrophobicContact CD2-CD2 3.84Å; L110-L123 HydrophobicContact CG-CD1 4.4Å; V119-L123 VanDerWaalsContact O-CB 3.3Å; V119-L123 WeakPolarHBondContact O-CB 3.27Å; V119-L123 PolarHBondContact O-N 2.75Å; L120-L123 PolarHBondContact O-N 3.33Å; L123-R125 VanDerWaalsContact C-N 3.28Å; L123-R125 PolarHBondContact O-N 3.43Å; L123-Q126 PolarHBondContact O-N 2.95Å; L123-I127 HydrophobicContact CD1-CD1 4.14Å; L123-I127 HydrophobicContact CD1-CG1 4.38Å; L123-I127 HydrophobicContact CG-CD1 3.96Å; L123-I127 WeakPolarHBondContact O-CG1 3.3Å; L123-I127 PolarHBondContact O-N 3.48Å; L123-L157 HydrophobicContact CD2-CD1 4.46Å; L123-L157 HydrophobicContact CD2-CD2 3.97Å; L123-L183 HydrophobicContact CB-CD1 4.2Å; L123-L183 HydrophobicContact CD2-CD1 3.92Å; L123-L183 HydrophobicContact CD2-CD2 4.36Å; L123-L183 HydrophobicContact CG-CD1 3.85Å
124	A	87.5	Confident	83	Confident	2 Å²	2	51.1 Å²	51.1	2%	0.017	26%	0.261	C	S	.	.	H	α-helix	trans	-52.8	-46.9	175.5	0	0	0	0	0	111.6	L120 Q126 I127 L128 E182 L183 A186	L120-A124 WeakPolarHBondContact O-CB 3.32Å; L120-A124 PolarHBondContact O-N 3.29Å; A124-Q126 PolarHBondContact O-N 3.31Å; A124-I127 PolarHBondContact O-N 3.18Å; A124-L128 PolarHBondContact O-N 2.84Å; A124-E182 HydrophobicContact CB-CG 4.25Å; A124-L183 HydrophobicContact CB-CB 4.29Å; A124-L183 HydrophobicContact CB-CD1 4Å; A124-A186 HydrophobicContact CB-CB 4Å; A124-A186 WeakPolarHBondContact O-CB 3.36Å
125	R	89.1	Confident	83.8	Confident	141 Å²	141	51.7 Å²	51.7	53%	0.532	26%	0.259	S	S	.	.	H	α-helix	trans	-64.2	-38.6	177.4	-169.8	-178.4	-60	149.8	5	113.1	S121 V122 L123 K129	S121-R125 PolarHBondContact O-N 3.44Å; V122-R125 PolarHBondContact O-N 2.86Å; L123-R125 VanDerWaalsContact C-N 3.28Å; L123-R125 PolarHBondContact O-N 3.43Å; R125-K129 WeakPolarHBondContact O-CG 3.32Å; R125-K129 PolarHBondContact O-N 3.28Å
126	Q	88.4	Confident	84.5	Confident	8 Å²	8	56.5 Å²	56.5	4%	0.037	28%	0.282	C	S	.	.	H	α-helix	trans	-68.4	-37.7	176.6	-64.3	-48.6	-47.3	0	0	111.6	L102 R105 I106 L109 V122 L123 A124 K129 A130	L102-Q126 VanDerWaalsContact CD2-OE1 3.28Å; R105-Q126 HydrophobicContact CG-CG 4.43Å; I106-Q126 HydrophobicContact CD1-CB 4.19Å; I106-Q126 HydrophobicContact CG1-CB 3.65Å; L109-Q126 HydrophobicContact CD1-CG 4.03Å; V122-Q126 HydrophobicContact CG1-CG 4.45Å; V122-Q126 WeakPolarHBondContact O-CG 3.36Å; V122-Q126 PolarHBondContact O-N 3.42Å; L123-Q126 PolarHBondContact O-N 2.95Å; A124-Q126 PolarHBondContact O-N 3.31Å; Q126-K129 PolarHBondContact O-N 3.37Å; Q126-A130 WeakPolarHBondContact O-CB 3.45Å; Q126-A130 PolarHBondContact O-N 3.05Å
127	I	87.9	Confident	84.7	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-43.6	177	-67.7	173.5	0	0	0	110.6	I106 L123 A124 K129 A130 K131 L150 I153 L157 L183 C187	I106-I127 HydrophobicContact CD1-CG1 4.25Å; L123-I127 HydrophobicContact CD1-CD1 4.14Å; L123-I127 HydrophobicContact CD1-CG1 4.38Å; L123-I127 HydrophobicContact CG-CD1 3.96Å; L123-I127 WeakPolarHBondContact O-CG1 3.3Å; L123-I127 PolarHBondContact O-N 3.48Å; A124-I127 PolarHBondContact O-N 3.18Å; I127-K129 VanDerWaalsContact C-N 3.34Å; I127-K129 PolarHBondContact O-N 3.07Å; I127-A130 WeakPolarHBondContact O-CB 3.33Å; I127-A130 PolarHBondContact O-N 3.33Å; I127-A130 VanDerWaalsContact O-N 3.12Å; I127-K131 PolarHBondContact O-N 3.21Å; I127-L150 HydrophobicContact CG2-CD2 4.31Å; I127-I153 HydrophobicContact CD1-CG2 4.06Å; I127-L157 HydrophobicContact CD1-CD1 3.8Å; I127-L183 HydrophobicContact CD1-CD1 4.06Å; I127-C187 WeakPolarHBondContact CD1-SG 3.34Å
128	L	88.1	Confident	85	Confident	98 Å²	98	55.9 Å²	55.9	51%	0.513	28%	0.275	S	S	.	.	H	α-helix	trans	-60.9	-43.2	174.4	-175	63	0	0	0	111.8	A124 A130 K131 V132	A124-L128 PolarHBondContact O-N 2.84Å; L128-A130 VanDerWaalsContact C-N 3.29Å; L128-A130 PolarHBondContact O-N 3.19Å; L128-K131 PolarHBondContact O-N 3.15Å; L128-V132 WeakPolarHBondContact O-CG2 3.38Å; L128-V132 PolarHBondContact O-N 3.3Å
129	K	89.1	Confident	84.9	Confident	106 Å²	106	51.8 Å²	51.8	46%	0.461	26%	0.258	S	S	.	.	H	α-helix	trans	-60.9	-38.7	173.4	-74.9	179.5	178.4	-166.1	0	112.4	L102 R125 Q126 I127 V132 A133	L102-K129 HydrophobicContact CD2-CB 4.33Å; L102-K129 HydrophobicContact CD2-CD 4.36Å; R125-K129 WeakPolarHBondContact O-CG 3.32Å; R125-K129 PolarHBondContact O-N 3.28Å; Q126-K129 PolarHBondContact O-N 3.37Å; I127-K129 VanDerWaalsContact C-N 3.34Å; I127-K129 PolarHBondContact O-N 3.07Å; K129-V132 PolarHBondContact O-N 2.98Å; K129-A133 WeakPolarHBondContact O-CB 3.46Å; K129-A133 PolarHBondContact O-N 3.45Å
130	A	86.9	Confident	84.9	Confident	7 Å²	7	58 Å²	58	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-65.5	-41.3	176	0	0	0	0	0	111.4	I106 Q126 I127 L128 A133 V134 L150	I106-A130 HydrophobicContact CD1-CB 4.05Å; Q126-A130 WeakPolarHBondContact O-CB 3.45Å; Q126-A130 PolarHBondContact O-N 3.05Å; I127-A130 WeakPolarHBondContact O-CB 3.33Å; I127-A130 PolarHBondContact O-N 3.33Å; I127-A130 VanDerWaalsContact O-N 3.12Å; L128-A130 VanDerWaalsContact C-N 3.29Å; L128-A130 PolarHBondContact O-N 3.19Å; A130-A133 WeakPolarHBondContact O-CB 3.3Å; A130-A133 PolarHBondContact O-N 2.84Å; A130-A133 VanDerWaalsContact O-N 3.17Å; A130-V134 WeakPolarHBondContact O-CG2 3.42Å; A130-V134 PolarHBondContact O-N 3.24Å; A130-L150 HydrophobicContact CB-CD2 4.02Å
131	K	86.4	Confident	84.8	Confident	64 Å²	64	61.9 Å²	61.9	28%	0.278	31%	0.31	S	S	.	.	H	α-helix	trans	-59.8	-44.3	172.9	-77.4	-174.6	171.4	-179.8	0	112.6	I127 L128 A133 V134 E135 L150 A186 C187 G188	I127-K131 PolarHBondContact O-N 3.21Å; L128-K131 PolarHBondContact O-N 3.15Å; K131-A133 VanDerWaalsContact C-N 3.3Å; K131-A133 PolarHBondContact O-N 2.88Å; K131-V134 VanDerWaalsContact O-CB 3.3Å; K131-V134 WeakPolarHBondContact O-CB 3.37Å; K131-V134 PolarHBondContact O-N 3.42Å; K131-V134 VanDerWaalsContact O-N 3.09Å; K131-E135 PolarHBondContact O-N 3.3Å; K131-L150 HydrophobicContact CG-CD1 3.87Å; K131-A186 WeakPolarHBondContact CD-O 3.38Å; K131-A186 WeakPolarHBondContact CE-O 3.48Å; K131-A186 PolarHBondContact NZ-O 3.47Å; K131-C187 WeakPolarHBondContact CE-O 3.45Å; K131-C187 PolarHBondContact NZ-O 3.49Å; K131-G188 VanDerWaalsContact NZ-N 3.18Å
132	V	86.8	Confident	84.6	Confident	69 Å²	69	63.3 Å²	63.3	42%	0.418	32%	0.317	S	S	.	.	H	α-helix	trans	-62.6	-39.4	174.5	175.5	0	0	0	0	111.2	L128 K129 V134 E135 L136	L128-V132 WeakPolarHBondContact O-CG2 3.38Å; L128-V132 PolarHBondContact O-N 3.3Å; K129-V132 PolarHBondContact O-N 2.98Å; V132-V134 VanDerWaalsContact C-N 3.26Å; V132-V134 PolarHBondContact O-N 3.25Å; V132-E135 PolarHBondContact O-N 3.33Å; V132-L136 HydrophobicContact CG1-CD1 3.88Å; V132-L136 HydrophobicContact CG1-CG 4.36Å; V132-L136 WeakPolarHBondContact O-CG 3.36Å; V132-L136 PolarHBondContact O-N 2.87Å; V132-L136 VanDerWaalsContact O-N 3.08Å
133	A	84	Confident	84.4	Confident	14 Å²	14	67 Å²	67	12%	0.116	33%	0.329	C	S	.	.	H	α-helix	trans	-63	-32.4	174.6	0	0	0	0	0	112.4	K129 A130 K131 N137	K129-A133 WeakPolarHBondContact O-CB 3.46Å; K129-A133 PolarHBondContact O-N 3.45Å; A130-A133 WeakPolarHBondContact O-CB 3.3Å; A130-A133 PolarHBondContact O-N 2.84Å; A130-A133 VanDerWaalsContact O-N 3.17Å; K131-A133 VanDerWaalsContact C-N 3.3Å; K131-A133 PolarHBondContact O-N 2.88Å; A133-N137 VanDerWaalsContact O-CG 3.32Å; A133-N137 PolarHBondContact O-N 3.29Å; A133-N137 PolarHBondContact O-ND2 3.31Å
134	V	84.2	Confident	84.4	Confident	8 Å²	8	70.4 Å²	70.4	5%	0.048	35%	0.347	C	S	.	.	H	α-helix	trans	-63.6	-46.4	172.8	172.2	0	0	0	0	111.3	A130 K131 V132 L136 N137 R143 L146 N147 L150	A130-V134 WeakPolarHBondContact O-CG2 3.42Å; A130-V134 PolarHBondContact O-N 3.24Å; K131-V134 VanDerWaalsContact O-CB 3.3Å; K131-V134 WeakPolarHBondContact O-CB 3.37Å; K131-V134 PolarHBondContact O-N 3.42Å; K131-V134 VanDerWaalsContact O-N 3.09Å; V132-V134 VanDerWaalsContact C-N 3.26Å; V132-V134 PolarHBondContact O-N 3.25Å; V134-L136 VanDerWaalsContact C-N 3.35Å; V134-L136 PolarHBondContact O-N 3.44Å; V134-N137 PolarHBondContact O-N 3.34Å; V134-R143 HydrophobicContact CG1-CG 3.38Å; V134-L146 HydrophobicContact CG2-CB 3.49Å; V134-L146 VanDerWaalsContact CG2-CB 3.49Å; V134-L146 HydrophobicContact CG2-CD1 3.92Å; V134-L146 HydrophobicContact CG2-CG 4.32Å; V134-N147 WeakPolarHBondContact CG1-OD1 3.17Å; V134-L150 HydrophobicContact CG2-CD1 3.95Å
135	E	82.8	Confident	84.3	Confident	150 Å²	150	73.1 Å²	73.1	70%	0.701	36%	0.364	S	S	*	.	H	α-helix	trans	-65.3	-37.5	-179.3	-68.7	-178.3	171.6	0	0	112.6	K131 V132 N137	K131-E135 PolarHBondContact O-N 3.3Å; V132-E135 PolarHBondContact O-N 3.33Å; E135-N137 VanDerWaalsContact C-N 3.26Å; E135-N137 PolarHBondContact O-N 3.12Å
136	L	82	Confident	84.1	Confident	127 Å²	127	67.3 Å²	67.3	67%	0.665	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-4.2	179	-65.2	174.3	0	0	0	114.1	V132 V134	V132-L136 HydrophobicContact CG1-CD1 3.88Å; V132-L136 HydrophobicContact CG1-CG 4.36Å; V132-L136 WeakPolarHBondContact O-CG 3.36Å; V132-L136 PolarHBondContact O-N 2.87Å; V132-L136 VanDerWaalsContact O-N 3.08Å; V134-L136 VanDerWaalsContact C-N 3.35Å; V134-L136 PolarHBondContact O-N 3.44Å
137	N	77.8	Confident	84	Confident	13 Å²	13	70.2 Å²	70.2	7%	0.07	36%	0.359	C	S	.	.			trans	-86.3	117.2	179.9	-91.7	-52.2	0	0	0	111.6	A133 V134 E135 R143 L146	A133-N137 VanDerWaalsContact O-CG 3.32Å; A133-N137 PolarHBondContact O-N 3.29Å; A133-N137 PolarHBondContact O-ND2 3.31Å; V134-N137 PolarHBondContact O-N 3.34Å; E135-N137 VanDerWaalsContact C-N 3.26Å; E135-N137 PolarHBondContact O-N 3.12Å; N137-R143 PolarHBondContact O-NE 3.24Å; N137-R143 PolarHBondContact O-NH2 3.02Å; N137-L146 WeakPolarHBondContact ND2-CD1 3.44Å
138	D	76.7	Confident	84	Confident	148 Å²	148	77.1 Å²	77.1	79%	0.791	39%	0.385	S	S	*	.			trans	-68.6	-30.5	176.6	-64.9	-36.8	0	0	0	113.3	K140	D138-K140 PolarHBondContact O-N 3.19Å
139	E	79.8	Confident	84	Confident	70 Å²	70	74.3 Å²	74.3	33%	0.327	37%	0.373	S	S	.	.			trans	-80.1	108.8	-177.1	-72.5	178.8	-165	0	0	111.6	K96 S141 N142 R143	K96-E139 WeakPolarHBondContact CE-OE2 3.5Å; K96-E139 IonicContact NZ-OE1 2.73Å; K96-E139 PolarHBondContact NZ-OE1 3.28Å; K96-E139 VanDerWaalsContact NZ-OE1 3.16Å; K96-E139 IonicContact NZ-OE2 3.85Å; K96-E139 PolarHBondContact NZ-OE2 2.92Å; E139-S141 VanDerWaalsContact C-N 3.29Å; E139-S141 PolarHBondContact O-N 2.96Å; E139-N142 HydrophobicContact CB-CB 4.34Å; E139-N142 PolarHBondContact O-N 2.89Å; E139-N142 PolarHBondContact OE2-ND2 3.17Å; E139-R143 PolarHBondContact O-N 2.92Å; E139-R143 VanDerWaalsContact O-N 3.15Å
140	K	83	Confident	83.8	Confident	155 Å²	155	70.2 Å²	70.2	67%	0.674	36%	0.356	S	S	*	.	H	α-helix	trans	-50.5	-43.9	178.8	-172	177.5	179.5	-179.7	0	113.4	D138 N142 R143 D144	D138-K140 PolarHBondContact O-N 3.19Å; K140-N142 VanDerWaalsContact C-N 3.32Å; K140-N142 PolarHBondContact O-N 3.18Å; K140-R143 WeakPolarHBondContact O-CB 3.26Å; K140-R143 PolarHBondContact O-N 2.87Å; K140-D144 VanDerWaalsContact O-CG 3.28Å; K140-D144 PolarHBondContact O-N 3.44Å
141	S	81.1	Confident	83.8	Confident	84 Å²	84	73.7 Å²	73.7	59%	0.587	38%	0.377	S	S	*	.	H	α-helix	trans	-62.5	-35.5	-179.6	-172.9	0	0	0	0	113.5	E139 T145	E139-S141 VanDerWaalsContact C-N 3.29Å; E139-S141 PolarHBondContact O-N 2.96Å; S141-T145 PolarHBondContact O-N 2.85Å; S141-T145 VanDerWaalsContact O-N 3.15Å; S141-T145 PolarHBondContact O-OG1 3.41Å
142	N	80	Confident	83.9	Confident	43 Å²	43	76 Å²	76	23%	0.23	39%	0.389	C	S	.	.	H	α-helix	trans	-72.7	-41.2	176.6	-65.8	-20.8	0	0	0	110.3	K96 E139 K140 D144 T145 L146	K96-N142 VanDerWaalsContact CE-ND2 3.3Å; K96-N142 WeakPolarHBondContact CE-ND2 3.3Å; E139-N142 HydrophobicContact CB-CB 4.34Å; E139-N142 PolarHBondContact O-N 2.89Å; E139-N142 PolarHBondContact OE2-ND2 3.17Å; K140-N142 VanDerWaalsContact C-N 3.32Å; K140-N142 PolarHBondContact O-N 3.18Å; N142-D144 VanDerWaalsContact C-N 3.3Å; N142-D144 PolarHBondContact O-N 2.93Å; N142-T145 PolarHBondContact O-N 2.98Å; N142-L146 WeakPolarHBondContact O-CB 3.38Å; N142-L146 VanDerWaalsContact O-CG 3.27Å; N142-L146 WeakPolarHBondContact O-CG 3.05Å; N142-L146 PolarHBondContact O-N 3.01Å
143	R	84.3	Confident	83.8	Confident	94 Å²	94	73.9 Å²	73.9	36%	0.355	38%	0.375	S	S	.	.	H	α-helix	trans	-55.2	-47.6	175.2	-157.9	-177	-63.1	168.1	1.8	111.1	V134 N137 E139 K140 T145 L146 N147	V134-R143 HydrophobicContact CG1-CG 3.38Å; N137-R143 PolarHBondContact O-NE 3.24Å; N137-R143 PolarHBondContact O-NH2 3.02Å; E139-R143 PolarHBondContact O-N 2.92Å; E139-R143 VanDerWaalsContact O-N 3.15Å; K140-R143 WeakPolarHBondContact O-CB 3.26Å; K140-R143 PolarHBondContact O-N 2.87Å; R143-T145 PolarHBondContact O-N 3.01Å; R143-L146 PolarHBondContact O-N 2.95Å; R143-N147 VanDerWaalsContact O-CB 3.32Å; R143-N147 WeakPolarHBondContact O-CB 3.37Å; R143-N147 PolarHBondContact O-N 2.79Å; R143-N147 PolarHBondContact O-ND2 2.9Å
144	D	86.3	Confident	83.9	Confident	75 Å²	75	73.6 Å²	73.6	40%	0.401	37%	0.373	S	S	.	.	H	α-helix	trans	-64.3	-39.9	178.6	-65.2	-19.9	0	0	0	112.2	K140 N142 R148	K140-D144 VanDerWaalsContact O-CG 3.28Å; K140-D144 PolarHBondContact O-N 3.44Å; N142-D144 VanDerWaalsContact C-N 3.3Å; N142-D144 PolarHBondContact O-N 2.93Å; D144-R148 WeakPolarHBondContact O-CB 3.45Å; D144-R148 PolarHBondContact O-N 3.03Å
145	T	84.7	Confident	84.1	Confident	60 Å²	60	79 Å²	79	37%	0.368	40%	0.398	S	S	.	.	H	α-helix	trans	-68	-45.3	178.3	-56.9	0	0	0	0	111.5	S141 N142 R143 R148 C149	S141-T145 PolarHBondContact O-N 2.85Å; S141-T145 VanDerWaalsContact O-N 3.15Å; S141-T145 PolarHBondContact O-OG1 3.41Å; N142-T145 PolarHBondContact O-N 2.98Å; R143-T145 PolarHBondContact O-N 3.01Å; T145-R148 WeakPolarHBondContact O-CB 3.38Å; T145-R148 PolarHBondContact O-N 3.34Å; T145-C149 PolarHBondContact O-N 2.97Å; T145-C149 PolarHBondContact O-SG 3.45Å
146	L	85.3	Confident	84.2	Confident	18 Å²	18	76.9 Å²	76.9	9%	0.094	38%	0.384	C	S	.	.	H	α-helix	trans	-65.5	-43	178	-69.9	170.4	0	0	0	111.6	T99 L103 V134 N137 N142 R143 R148 C149 L150	T99-L146 HydrophobicContact CG2-CD1 3.81Å; T99-L146 HydrophobicContact CG2-CD2 3.55Å; T99-L146 HydrophobicContact CG2-CG 4.32Å; L103-L146 HydrophobicContact CD1-CD2 3.66Å; L103-L146 HydrophobicContact CD2-CD2 4.43Å; L103-L146 HydrophobicContact CG-CD2 4.36Å; V134-L146 HydrophobicContact CG2-CB 3.49Å; V134-L146 VanDerWaalsContact CG2-CB 3.49Å; V134-L146 HydrophobicContact CG2-CD1 3.92Å; V134-L146 HydrophobicContact CG2-CG 4.32Å; N137-L146 WeakPolarHBondContact ND2-CD1 3.44Å; N142-L146 WeakPolarHBondContact O-CB 3.38Å; N142-L146 VanDerWaalsContact O-CG 3.27Å; N142-L146 WeakPolarHBondContact O-CG 3.05Å; N142-L146 PolarHBondContact O-N 3.01Å; R143-L146 PolarHBondContact O-N 2.95Å; L146-R148 VanDerWaalsContact C-N 3.31Å; L146-R148 PolarHBondContact O-N 3.14Å; L146-C149 PolarHBondContact O-N 3.37Å; L146-L150 WeakPolarHBondContact O-CG 3.39Å; L146-L150 PolarHBondContact O-N 3.04Å
147	N	87.8	Confident	84.3	Confident	70 Å²	70	70.8 Å²	70.8	37%	0.374	35%	0.353	S	S	.	.	H	α-helix	trans	-58.3	-44.8	173.9	-81.4	-28.2	0	0	0	111.1	V134 R143 C149 L150 T151	V134-N147 WeakPolarHBondContact CG1-OD1 3.17Å; R143-N147 VanDerWaalsContact O-CB 3.32Å; R143-N147 WeakPolarHBondContact O-CB 3.37Å; R143-N147 PolarHBondContact O-N 2.79Å; R143-N147 PolarHBondContact O-ND2 2.9Å; N147-C149 VanDerWaalsContact C-N 3.34Å; N147-C149 PolarHBondContact O-N 3.24Å; N147-L150 PolarHBondContact O-N 2.99Å; N147-T151 PolarHBondContact O-N 3.33Å; N147-T151 PolarHBondContact O-OG1 3.5Å
148	R	88.1	Confident	84.7	Confident	146 Å²	146	74.4 Å²	74.4	55%	0.551	37%	0.369	S	S	*	.	H	α-helix	trans	-59	-43.9	175.2	-165.9	-172.9	-51.5	139	8.9	112.2	D144 T145 L146 T151 Q152	D144-R148 WeakPolarHBondContact O-CB 3.45Å; D144-R148 PolarHBondContact O-N 3.03Å; T145-R148 WeakPolarHBondContact O-CB 3.38Å; T145-R148 PolarHBondContact O-N 3.34Å; L146-R148 VanDerWaalsContact C-N 3.31Å; L146-R148 PolarHBondContact O-N 3.14Å; R148-T151 PolarHBondContact O-N 3.33Å; R148-Q152 WeakPolarHBondContact O-CG 3.48Å; R148-Q152 PolarHBondContact O-N 2.86Å
149	C	86.4	Confident	85.1	Confident	40 Å²	40	70.9 Å²	70.9	27%	0.27	36%	0.361	S	S	.	.	H	α-helix	trans	-63.4	-42.5	175.3	-70.8	0	0	0	0	112.2	T145 L146 N147 Q152 I153	T145-C149 PolarHBondContact O-N 2.97Å; T145-C149 PolarHBondContact O-SG 3.45Å; L146-C149 PolarHBondContact O-N 3.37Å; N147-C149 VanDerWaalsContact C-N 3.34Å; N147-C149 PolarHBondContact O-N 3.24Å; C149-Q152 PolarHBondContact O-N 3.17Å; C149-I153 WeakPolarHBondContact O-CD1 3.46Å; C149-I153 VanDerWaalsContact O-CG1 3.26Å; C149-I153 WeakPolarHBondContact O-CG1 3.45Å; C149-I153 PolarHBondContact O-N 2.93Å
150	L	86.2	Confident	85.3	Confident	20 Å²	20	72.7 Å²	72.7	11%	0.105	37%	0.369	C	S	.	.	H	α-helix	trans	-64.8	-38.5	177.5	-71.3	174.2	0	0	0	111.9	I127 A130 K131 V134 L146 N147 I153 G154	I127-L150 HydrophobicContact CG2-CD2 4.31Å; A130-L150 HydrophobicContact CB-CD2 4.02Å; K131-L150 HydrophobicContact CG-CD1 3.87Å; V134-L150 HydrophobicContact CG2-CD1 3.95Å; L146-L150 WeakPolarHBondContact O-CG 3.39Å; L146-L150 PolarHBondContact O-N 3.04Å; N147-L150 PolarHBondContact O-N 2.99Å; L150-I153 HydrophobicContact CD2-CD1 4.48Å; L150-I153 PolarHBondContact O-N 3.19Å; L150-G154 PolarHBondContact O-N 3.33Å
151	T	86.9	Confident	85.4	Confident	80 Å²	80	66.5 Å²	66.5	49%	0.491	34%	0.342	S	S	.	.	H	α-helix	trans	-61.4	-47.4	172.7	-56.8	0	0	0	0	111.4	N147 R148 I153 G154 E155	N147-T151 PolarHBondContact O-N 3.33Å; N147-T151 PolarHBondContact O-OG1 3.5Å; R148-T151 PolarHBondContact O-N 3.33Å; T151-I153 VanDerWaalsContact C-N 3.32Å; T151-I153 PolarHBondContact O-N 2.89Å; T151-G154 WeakPolarHBondContact O-CA 3.39Å; T151-G154 PolarHBondContact O-N 3.43Å; T151-G154 VanDerWaalsContact O-N 3.08Å; T151-E155 WeakPolarHBondContact O-CG 3.48Å; T151-E155 PolarHBondContact O-N 2.83Å
152	Q	87.4	Confident	85.6	Confident	113 Å²	113	62.7 Å²	62.7	53%	0.528	32%	0.316	S	S	.	.	H	α-helix	trans	-61.9	-38.3	176.7	-72.8	177	-22.7	0	0	112.7	R148 C149 G154 Y156	R148-Q152 WeakPolarHBondContact O-CG 3.48Å; R148-Q152 PolarHBondContact O-N 2.86Å; C149-Q152 PolarHBondContact O-N 3.17Å; Q152-G154 VanDerWaalsContact C-N 3.34Å; Q152-Y156 WeakPolarHBondContact O-CB 3.12Å; Q152-Y156 PolarHBondContact O-N 3.08Å
153	I	85.7	Confident	85.8	Confident	23 Å²	23	64.4 Å²	64.4	12%	0.118	33%	0.329	C	S	.	.	H	α-helix	trans	-63.7	-43.6	173.2	-69	159.9	0	0	0	109.8	I106 L110 I127 C149 L150 T151 Y156 L157	I106-I153 HydrophobicContact CG2-CD1 3.9Å; L110-I153 HydrophobicContact CD1-CG1 4.28Å; L110-I153 HydrophobicContact CD1-CG2 4.35Å; I127-I153 HydrophobicContact CD1-CG2 4.06Å; C149-I153 WeakPolarHBondContact O-CD1 3.46Å; C149-I153 VanDerWaalsContact O-CG1 3.26Å; C149-I153 WeakPolarHBondContact O-CG1 3.45Å; C149-I153 PolarHBondContact O-N 2.93Å; L150-I153 HydrophobicContact CD2-CD1 4.48Å; L150-I153 PolarHBondContact O-N 3.19Å; T151-I153 VanDerWaalsContact C-N 3.32Å; T151-I153 PolarHBondContact O-N 2.89Å; I153-Y156 PolarHBondContact O-N 3.35Å; I153-L157 HydrophobicContact CG2-CD1 3.73Å; I153-L157 HydrophobicContact CG2-CG 4.14Å; I153-L157 WeakPolarHBondContact O-CB 3.3Å; I153-L157 WeakPolarHBondContact O-CG 3.42Å; I153-L157 PolarHBondContact O-N 2.88Å
154	G	86	Confident	85.9	Confident	9 Å²	9	61.7 Å²	61.7	9%	0.093	33%	0.325	C	S	.	.	H	α-helix	trans	-58.8	-46.9	176.2	0	0	0	0	0	113	L150 T151 Q152 Y156 L157 Q158	L150-G154 PolarHBondContact O-N 3.33Å; T151-G154 WeakPolarHBondContact O-CA 3.39Å; T151-G154 PolarHBondContact O-N 3.43Å; T151-G154 VanDerWaalsContact O-N 3.08Å; Q152-G154 VanDerWaalsContact C-N 3.34Å; G154-Y156 PolarHBondContact O-N 3.37Å; G154-L157 PolarHBondContact O-N 3.4Å; G154-Q158 WeakPolarHBondContact O-CB 3.4Å; G154-Q158 PolarHBondContact O-N 3.04Å
155	E	87.4	Confident	86	Confident	121 Å²	121	58.1 Å²	58.1	57%	0.565	31%	0.306	S	S	*	.	H	α-helix	trans	-60.7	-43.9	176.5	-71.1	171.9	179.3	0	0	111.9	T151 Q158 A159	T151-E155 WeakPolarHBondContact O-CG 3.48Å; T151-E155 PolarHBondContact O-N 2.83Å; E155-Q158 PolarHBondContact O-N 3.04Å; E155-A159 PolarHBondContact O-N 2.85Å; E155-A159 VanDerWaalsContact O-N 3.09Å
156	Y	86.1	Confident	86.2	Confident	105 Å²	105	57 Å²	57	41%	0.412	30%	0.297	S	S	.	.	H	α-helix	trans	-63	-46.8	175.6	175.5	-100.6	0	0	0	112	L110 Q152 I153 G154 Q158 A159 E160	L110-Y156 HydrophobicContact CD2-CD1 4.15Å; L110-Y156 HydrophobicContact CD2-CE1 4.06Å; Q152-Y156 WeakPolarHBondContact O-CB 3.12Å; Q152-Y156 PolarHBondContact O-N 3.08Å; I153-Y156 PolarHBondContact O-N 3.35Å; G154-Y156 PolarHBondContact O-N 3.37Å; Y156-Q158 VanDerWaalsContact C-N 3.3Å; Y156-Q158 PolarHBondContact O-N 2.91Å; Y156-A159 PolarHBondContact O-N 3.34Å; Y156-E160 WeakPolarHBondContact O-CB 3.49Å; Y156-E160 PolarHBondContact O-N 3.12Å
157	L	84.6	Confident	86.3	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.2	-36.4	179.5	-70.8	176.5	0	0	0	112.1	L110 L123 I127 I153 G154 F161 L183 C187	L110-L157 HydrophobicContact CD2-CD2 3.72Å; L110-L157 HydrophobicContact CD2-CG 4.47Å; L123-L157 HydrophobicContact CD2-CD1 4.46Å; L123-L157 HydrophobicContact CD2-CD2 3.97Å; I127-L157 HydrophobicContact CD1-CD1 3.8Å; I153-L157 HydrophobicContact CG2-CD1 3.73Å; I153-L157 HydrophobicContact CG2-CG 4.14Å; I153-L157 WeakPolarHBondContact O-CB 3.3Å; I153-L157 WeakPolarHBondContact O-CG 3.42Å; I153-L157 PolarHBondContact O-N 2.88Å; G154-L157 PolarHBondContact O-N 3.4Å; L157-F161 HydrophobicContact CB-CD2 4.35Å; L157-F161 HydrophobicContact CD2-CD2 3.51Å; L157-F161 HydrophobicContact CD2-CE2 3.42Å; L157-F161 VanDerWaalsContact CD2-CE2 3.42Å; L157-F161 WeakPolarHBondContact O-CB 3.22Å; L157-F161 PolarHBondContact O-N 3.22Å; L157-L183 HydrophobicContact CD1-CD1 4.15Å; L157-L183 HydrophobicContact CD1-CD2 4.46Å; L157-L183 HydrophobicContact CD1-CG 4.34Å; L157-L183 HydrophobicContact CD2-CD2 4.36Å; L157-C187 WeakPolarHBondContact CD1-SG 3.36Å
158	Q	85.8	Confident	86.3	Confident	88 Å²	88	57.5 Å²	57.5	41%	0.411	30%	0.3	S	S	.	.	H	α-helix	trans	-63	-44.8	173.9	-179.4	178.4	-6.4	0	0	111.8	G154 E155 Y156 G162 F184 A192	G154-Q158 WeakPolarHBondContact O-CB 3.4Å; G154-Q158 PolarHBondContact O-N 3.04Å; E155-Q158 PolarHBondContact O-N 3.04Å; Y156-Q158 VanDerWaalsContact C-N 3.3Å; Y156-Q158 PolarHBondContact O-N 2.91Å; Q158-G162 WeakPolarHBondContact O-CA 3.46Å; Q158-G162 PolarHBondContact O-N 2.94Å; Q158-G162 VanDerWaalsContact O-N 3.1Å; Q158-F184 HydrophobicContact CB-CE1 4.25Å; Q158-A192 VanDerWaalsContact CD-CB 3.42Å; Q158-A192 HydrophobicContact CG-CB 3.8Å
159	A	85.4	Confident	86.3	Confident	75 Å²	75	50.8 Å²	50.8	62%	0.62	28%	0.275	S	S	*	.	H	α-helix	trans	-65.9	-41.4	178.7	0	0	0	0	0	112.4	E155 Y156	E155-A159 PolarHBondContact O-N 2.85Å; E155-A159 VanDerWaalsContact O-N 3.09Å; Y156-A159 PolarHBondContact O-N 3.34Å
160	E	82.4	Confident	86.5	Confident	108 Å²	108	54.1 Å²	54.1	51%	0.505	29%	0.287	S	S	.	.	H	α-helix	trans	-81.8	-47	-174.4	-166.8	67.9	-162.1	0	0	112.8	Y156	Y156-E160 WeakPolarHBondContact O-CB 3.49Å; Y156-E160 PolarHBondContact O-N 3.12Å
161	F	84.8	Confident	86.6	Confident	25 Å²	25	59.1 Å²	59.1	11%	0.11	31%	0.313	C	S	.	.	H	α-helix	trans	-100.4	-11.6	-172.1	-62.5	-72.5	0	0	0	114.3	P115 L120 L157 S164 F165 L180 F184	P115-F161 HydrophobicContact CG-CE1 3.43Å; P115-F161 VanDerWaalsContact CG-CE1 3.43Å; P115-F161 HydrophobicContact CG-CZ 3.43Å; P115-F161 VanDerWaalsContact CG-CZ 3.43Å; L120-F161 HydrophobicContact CD2-CD1 4.23Å; L120-F161 HydrophobicContact CD2-CE1 3.97Å; L120-F161 HydrophobicContact CD2-CZ 4.24Å; L157-F161 HydrophobicContact CB-CD2 4.35Å; L157-F161 HydrophobicContact CD2-CD2 3.51Å; L157-F161 HydrophobicContact CD2-CE2 3.42Å; L157-F161 VanDerWaalsContact CD2-CE2 3.42Å; L157-F161 WeakPolarHBondContact O-CB 3.22Å; L157-F161 PolarHBondContact O-N 3.22Å; F161-S164 WeakPolarHBondContact O-CB 3.41Å; F161-S164 PolarHBondContact O-N 3.33Å; F161-F165 PolarHBondContact O-N 2.88Å; F161-L180 HydrophobicContact CB-CD2 3.87Å; F161-L180 HydrophobicContact CD1-CD2 4.26Å; F161-L180 HydrophobicContact CG-CD2 4.28Å; F161-F184 HydrophobicContact CB-CE2 3.95Å; F161-F184 HydrophobicContact CB-CZ 4.24Å
162	G	85.1	Confident	86.5	Confident	3 Å²	3	61.9 Å²	61.9	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-54.6	-51.3	174.9	0	0	0	0	0	113	Q158 S164 F165	Q158-G162 WeakPolarHBondContact O-CA 3.46Å; Q158-G162 PolarHBondContact O-N 2.94Å; Q158-G162 VanDerWaalsContact O-N 3.1Å; G162-S164 VanDerWaalsContact C-N 3.31Å; G162-S164 PolarHBondContact O-N 3.27Å; G162-F165 VanDerWaalsContact O-CB 3.32Å; G162-F165 WeakPolarHBondContact O-CB 3.46Å; G162-F165 PolarHBondContact O-N 3.34Å
163	P	86.1	Confident	86.5	Confident	79 Å²	79	59.8 Å²	59.8	51%	0.513	31%	0.313	S	S	.	.	H	α-helix	trans	-64.2	-32.9	175.9	-23.1	34.5	0	0	0	113.6	F165 L166 L167	P163-F165 VanDerWaalsContact C-N 3.27Å; P163-F165 PolarHBondContact O-N 3.28Å; P163-L166 WeakPolarHBondContact O-CB 3.48Å; P163-L166 PolarHBondContact O-N 3.02Å; P163-L167 PolarHBondContact O-N 3.39Å
164	S	86	Confident	86.6	Confident	38 Å²	38	60.8 Å²	60.8	27%	0.266	32%	0.318	S	S	.	.	H	α-helix	trans	-64.3	-33.6	176.5	-174.1	0	0	0	0	111.8	F161 G162 L167 S168	F161-S164 WeakPolarHBondContact O-CB 3.41Å; F161-S164 PolarHBondContact O-N 3.33Å; G162-S164 VanDerWaalsContact C-N 3.31Å; G162-S164 PolarHBondContact O-N 3.27Å; S164-L167 PolarHBondContact O-N 3.45Å; S164-S168 WeakPolarHBondContact O-CB 3.34Å; S164-S168 PolarHBondContact O-N 3Å; S164-S168 PolarHBondContact O-OG 2.87Å
165	F	88.6	Confident	86.6	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-60.9	-45.3	174.4	-176.9	-108.6	0	0	0	112.3	F161 G162 P163 S168 I169 V177 L180 L181 L193 I196 F197 F246	F161-F165 PolarHBondContact O-N 2.88Å; G162-F165 VanDerWaalsContact O-CB 3.32Å; G162-F165 WeakPolarHBondContact O-CB 3.46Å; G162-F165 PolarHBondContact O-N 3.34Å; P163-F165 VanDerWaalsContact C-N 3.27Å; P163-F165 PolarHBondContact O-N 3.28Å; F165-S168 PolarHBondContact O-N 3.02Å; F165-I169 HydrophobicContact CD1-CD1 3.94Å; F165-I169 HydrophobicContact CE1-CD1 3.44Å; F165-I169 VanDerWaalsContact CE1-CD1 3.44Å; F165-I169 HydrophobicContact CE2-CD1 4.18Å; F165-I169 HydrophobicContact CZ-CD1 3.58Å; F165-I169 HydrophobicContact CZ-CG1 4.47Å; F165-I169 WeakPolarHBondContact O-CG1 3.44Å; F165-I169 PolarHBondContact O-N 2.87Å; F165-V177 HydrophobicContact CE2-CG1 4.07Å; F165-L180 HydrophobicContact CB-CD1 3.95Å; F165-L180 HydrophobicContact CD2-CB 3.99Å; F165-L180 HydrophobicContact CD2-CD1 4.13Å; F165-L181 HydrophobicContact CE2-CD2 4.02Å; F165-L181 HydrophobicContact CE2-CG 4.1Å; F165-L181 HydrophobicContact CZ-CD2 4.17Å; F165-L193 HydrophobicContact CB-CD2 4.05Å; F165-L193 HydrophobicContact CD1-CD2 3.88Å; F165-L193 HydrophobicContact CD2-CD1 4.27Å; F165-L193 HydrophobicContact CD2-CD2 4.17Å; F165-L193 HydrophobicContact CE1-CB 4.3Å; F165-L193 HydrophobicContact CE1-CD2 4.31Å; F165-L193 HydrophobicContact CE2-CD1 4.13Å; F165-L193 HydrophobicContact CG-CD2 3.78Å; F165-L193 HydrophobicContact CZ-CB 4.43Å; F165-L193 HydrophobicContact CZ-CD1 4.39Å; F165-I196 HydrophobicContact CD1-CG2 4.33Å; F165-F197 HydrophobicContact CE1-CB 4.45Å; F165-F246 HydrophobicContact CE1-CZ 4.36Å; F165-F246 HydrophobicContact CZ-CE1 4.02Å; F165-F246 AromaticContact CZ-CZ 3.96Å; F165-F246 HydrophobicContact CZ-CZ 3.96Å
166	L	87.4	Confident	86.5	Confident	36 Å²	36	61.8 Å²	61.8	19%	0.188	32%	0.324	C	S	.	.	H	α-helix	trans	-57.7	-52	176.2	-174.6	91.7	0	0	0	111.5	P163 S168 I169 Q170 E200 F201	P163-L166 WeakPolarHBondContact O-CB 3.48Å; P163-L166 PolarHBondContact O-N 3.02Å; L166-S168 VanDerWaalsContact C-N 3.25Å; L166-S168 PolarHBondContact O-N 3.15Å; L166-I169 PolarHBondContact O-N 3.05Å; L166-Q170 WeakPolarHBondContact O-CG 3.49Å; L166-Q170 PolarHBondContact O-N 2.96Å; L166-E200 HydrophobicContact CD1-CB 3.52Å; L166-E200 HydrophobicContact CD1-CG 3.5Å; L166-E200 VanDerWaalsContact CD1-CG 3.5Å; L166-F201 HydrophobicContact CD1-CE2 3.89Å; L166-F201 HydrophobicContact CD1-CZ 3.87Å; L166-F201 HydrophobicContact CG-CZ 4.45Å
167	L	88.1	Confident	86.6	Confident	92 Å²	92	56.8 Å²	56.8	48%	0.482	31%	0.305	S	S	.	.	H	α-helix	trans	-61.6	-36.3	-180	-68.7	172.3	0	0	0	111.6	P163 S164 Q170 N171	P163-L167 PolarHBondContact O-N 3.39Å; S164-L167 PolarHBondContact O-N 3.45Å; L167-Q170 PolarHBondContact O-N 2.93Å; L167-N171 VanDerWaalsContact O-CB 3.31Å; L167-N171 WeakPolarHBondContact O-CB 3.34Å; L167-N171 PolarHBondContact O-N 3.46Å; L167-N171 PolarHBondContact O-ND2 3.5Å; L167-N171 VanDerWaalsContact O-ND2 3.11Å
168	S	87.9	Confident	86.8	Confident	7 Å²	7	57.1 Å²	57.1	5%	0.049	31%	0.309	C	S	.	.	H	α-helix	trans	-67.2	-36.8	178.3	-56.4	0	0	0	0	112.3	S164 F165 L166 E172 D173 N176	S164-S168 WeakPolarHBondContact O-CB 3.34Å; S164-S168 PolarHBondContact O-N 3Å; S164-S168 PolarHBondContact O-OG 2.87Å; F165-S168 PolarHBondContact O-N 3.02Å; L166-S168 VanDerWaalsContact C-N 3.25Å; L166-S168 PolarHBondContact O-N 3.15Å; S168-E172 PolarHBondContact O-N 2.96Å; S168-D173 PolarHBondContact O-N 3.09Å; S168-N176 PolarHBondContact OG-ND2 3.2Å
169	I	88.8	Confident	86.9	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-69.4	-46.3	174.3	-68.1	174.6	0	0	0	110.5	F165 L166 N171 E172 V177 F197 F201 Y231 L234 M235	F165-I169 HydrophobicContact CD1-CD1 3.94Å; F165-I169 HydrophobicContact CE1-CD1 3.44Å; F165-I169 VanDerWaalsContact CE1-CD1 3.44Å; F165-I169 HydrophobicContact CE2-CD1 4.18Å; F165-I169 HydrophobicContact CZ-CD1 3.58Å; F165-I169 HydrophobicContact CZ-CG1 4.47Å; F165-I169 WeakPolarHBondContact O-CG1 3.44Å; F165-I169 PolarHBondContact O-N 2.87Å; L166-I169 PolarHBondContact O-N 3.05Å; I169-N171 PolarHBondContact O-N 2.9Å; I169-E172 PolarHBondContact O-N 3.22Å; I169-V177 HydrophobicContact CG1-CG2 3.82Å; I169-F197 HydrophobicContact CD1-CD2 3.7Å; I169-F197 HydrophobicContact CD1-CE2 4.01Å; I169-F201 HydrophobicContact CB-CE2 4.15Å; I169-F201 HydrophobicContact CB-CZ 3.79Å; I169-F201 HydrophobicContact CD1-CE2 3.85Å; I169-F201 HydrophobicContact CD1-CZ 4.38Å; I169-F201 HydrophobicContact CG2-CD1 4.44Å; I169-F201 HydrophobicContact CG2-CE1 3.74Å; I169-F201 HydrophobicContact CG2-CE2 3.85Å; I169-F201 HydrophobicContact CG2-CZ 3.41Å; I169-F201 VanDerWaalsContact CG2-CZ 3.41Å; I169-Y231 HydrophobicContact CG2-CD1 4.17Å; I169-Y231 HydrophobicContact CG2-CE1 3.85Å; I169-L234 HydrophobicContact CB-CD2 4.5Å; I169-L234 HydrophobicContact CG2-CD2 3.94Å; I169-M235 HydrophobicContact CD1-CE 4.37Å
170	Q	89.1	Confident	87	Confident	111 Å²	111	52.2 Å²	52.2	52%	0.519	27%	0.272	S	S	.	.	H	α-helix	trans	-61.7	-32	179.2	-71.9	177.2	-9	0	0	112.8	L166 L167 F201	L166-Q170 WeakPolarHBondContact O-CG 3.49Å; L166-Q170 PolarHBondContact O-N 2.96Å; L167-Q170 PolarHBondContact O-N 2.93Å; Q170-F201 HydrophobicContact CG-CE1 4.29Å; Q170-F201 HydrophobicContact CG-CZ 4.29Å
171	N	89.4	Confident	87.3	Confident	124 Å²	124	47.5 Å²	47.5	66%	0.663	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	4.3	176.8	-66.6	-30	0	0	0	113.9	L167 I169 D173	L167-N171 VanDerWaalsContact O-CB 3.31Å; L167-N171 WeakPolarHBondContact O-CB 3.34Å; L167-N171 PolarHBondContact O-N 3.46Å; L167-N171 PolarHBondContact O-ND2 3.5Å; L167-N171 VanDerWaalsContact O-ND2 3.11Å; I169-N171 PolarHBondContact O-N 2.9Å; N171-D173 PolarHBondContact O-N 3.42Å; N171-D173 VanDerWaalsContact O-N 3.16Å
172	E	85.6	Confident	87.4	Confident	138 Å²	138	50 Å²	50	65%	0.645	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	30.2	-174.6	-59.8	-173.6	175.9	0	0	114.5	S168 I169 H174 L234	S168-E172 PolarHBondContact O-N 2.96Å; I169-E172 PolarHBondContact O-N 3.22Å; E172-H174 PolarHBondContact O-N 3.17Å; E172-L234 HydrophobicContact CB-CD1 4.28Å
173	D	87.2	Confident	87.5	Confident	69 Å²	69	49.9 Å²	49.9	37%	0.369	26%	0.261	S	S	.	.			trans	-77.7	84.5	178.6	-172.9	-11.5	0	0	0	110.9	S168 N171 N175 N176 V177	S168-D173 PolarHBondContact O-N 3.09Å; N171-D173 PolarHBondContact O-N 3.42Å; N171-D173 VanDerWaalsContact O-N 3.16Å; D173-N175 PolarHBondContact O-N 3.4Å; D173-N175 PolarHBondContact OD1-N 2.96Å; D173-N175 VanDerWaalsContact OD1-N 3.09Å; D173-N176 HydrophobicContact CB-CB 4.3Å; D173-N176 PolarHBondContact O-N 3.25Å; D173-N176 PolarHBondContact OD1-N 3.09Å; D173-N176 WeakPolarHBondContact OD2-CB 3.42Å; D173-V177 VanDerWaalsContact O-CG2 3.29Å; D173-V177 WeakPolarHBondContact O-CG2 3.33Å; D173-V177 PolarHBondContact O-N 3.05Å
174	H	86	Confident	87.7	Confident	45 Å²	45	46.2 Å²	46.2	21%	0.208	24%	0.237	C	C	.	.	H	α-helix	trans	-52.6	-37.2	178.1	-54.6	-61.9	0	0	0	112.9	E172 G178 L234 K237 A238	E172-H174 PolarHBondContact O-N 3.17Å; H174-G178 PolarHBondContact O-N 3.06Å; H174-L234 WeakPolarHBondContact CE1-CD1 3.44Å; H174-L234 WeakPolarHBondContact ND1-CA 3.24Å; H174-L234 WeakPolarHBondContact ND1-CD1 3.4Å; H174-L234 PolarHBondContact ND1-O 3.04Å; H174-K237 HydrophobicContact CB-CB 4.19Å; H174-K237 WeakPolarHBondContact NE2-CD 3.44Å; H174-A238 HydrophobicContact CB-CB 4.45Å; H174-A238 VanDerWaalsContact O-CA 3.3Å; H174-A238 WeakPolarHBondContact O-CA 3.3Å; H174-A238 WeakPolarHBondContact O-CB 3.21Å
175	N	86.2	Confident	87.8	Confident	123 Å²	123	48.4 Å²	48.4	66%	0.658	25%	0.249	S	C	*	.	H	α-helix	trans	-70.5	-48.8	-175.8	-74.8	-26.4	0	0	0	110.4	D173 G178 K179	D173-N175 PolarHBondContact O-N 3.4Å; D173-N175 PolarHBondContact OD1-N 2.96Å; D173-N175 VanDerWaalsContact OD1-N 3.09Å; N175-G178 PolarHBondContact O-N 3.43Å; N175-K179 WeakPolarHBondContact O-CG 3.49Å; N175-K179 PolarHBondContact O-N 3.02Å; N175-K179 VanDerWaalsContact O-N 3.12Å
176	N	86.9	Confident	87.6	Confident	27 Å²	27	49 Å²	49	14%	0.144	25%	0.253	C	S	.	.	H	α-helix	trans	-69	-39	-178.9	-158.4	42.5	0	0	0	111.9	S168 D173 G178 K179 L180	S168-N176 PolarHBondContact OG-ND2 3.2Å; D173-N176 HydrophobicContact CB-CB 4.3Å; D173-N176 PolarHBondContact O-N 3.25Å; D173-N176 PolarHBondContact OD1-N 3.09Å; D173-N176 WeakPolarHBondContact OD2-CB 3.42Å; N176-G178 PolarHBondContact O-N 3.4Å; N176-K179 PolarHBondContact O-N 3.3Å; N176-L180 WeakPolarHBondContact O-CB 3.38Å; N176-L180 VanDerWaalsContact O-CG 3.29Å; N176-L180 WeakPolarHBondContact O-CG 3.21Å; N176-L180 PolarHBondContact O-N 2.93Å
177	V	88.2	Confident	87.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.7	-49.1	173.2	172.3	0	0	0	0	110.9	F165 I169 D173 K179 L180 L181 M235 A238	F165-V177 HydrophobicContact CE2-CG1 4.07Å; I169-V177 HydrophobicContact CG1-CG2 3.82Å; D173-V177 VanDerWaalsContact O-CG2 3.29Å; D173-V177 WeakPolarHBondContact O-CG2 3.33Å; D173-V177 PolarHBondContact O-N 3.05Å; V177-K179 VanDerWaalsContact C-N 3.29Å; V177-K179 PolarHBondContact O-N 2.8Å; V177-L180 PolarHBondContact O-N 2.77Å; V177-L181 HydrophobicContact CG1-CD1 3.99Å; V177-L181 HydrophobicContact CG1-CG 4.45Å; V177-L181 WeakPolarHBondContact O-CB 3.33Å; V177-L181 VanDerWaalsContact O-CG 3.32Å; V177-L181 WeakPolarHBondContact O-CG 3.32Å; V177-L181 PolarHBondContact O-N 2.67Å; V177-M235 HydrophobicContact CG1-SD 4.17Å; V177-A238 HydrophobicContact CB-CB 4.12Å; V177-A238 HydrophobicContact CG1-CB 3.9Å
178	G	88.1	Confident	87.2	Confident	8 Å²	8	46 Å²	46	8%	0.082	25%	0.25	C	S	.	.	H	α-helix	trans	-60.4	-38.2	179.5	0	0	0	0	0	113	H174 N175 N176 E182 A238	H174-G178 PolarHBondContact O-N 3.06Å; N175-G178 PolarHBondContact O-N 3.43Å; N176-G178 PolarHBondContact O-N 3.4Å; G178-E182 WeakPolarHBondContact O-CB 3.5Å; G178-E182 PolarHBondContact O-N 2.92Å; G178-A238 WeakPolarHBondContact CA-O 3.36Å
179	K	86.7	Confident	87.1	Confident	59 Å²	59	46.7 Å²	46.7	26%	0.257	25%	0.254	S	S	.	.	H	α-helix	trans	-75.2	-36.1	178.9	-65.4	-40.4	-174.5	162.7	0	113.9	L120 S121 N175 N176 V177 E182 L183	L120-K179 HydrophobicContact CB-CB 4.33Å; L120-K179 HydrophobicContact CD1-CB 4.45Å; S121-K179 WeakPolarHBondContact OG-CD 3.4Å; S121-K179 WeakPolarHBondContact OG-CE 3.37Å; S121-K179 PolarHBondContact OG-NZ 2.96Å; N175-K179 WeakPolarHBondContact O-CG 3.49Å; N175-K179 PolarHBondContact O-N 3.02Å; N175-K179 VanDerWaalsContact O-N 3.12Å; N176-K179 PolarHBondContact O-N 3.3Å; V177-K179 VanDerWaalsContact C-N 3.29Å; V177-K179 PolarHBondContact O-N 2.8Å; K179-E182 WeakPolarHBondContact CD-OE2 3.29Å; K179-E182 IonicContact NZ-OE2 3.33Å; K179-E182 PolarHBondContact NZ-OE2 3.22Å; K179-E182 PolarHBondContact O-N 3.42Å; K179-L183 WeakPolarHBondContact O-CB 3.38Å; K179-L183 PolarHBondContact O-N 3.05Å
180	L	88	Confident	86.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.3	-42.2	172.5	-69.8	174.2	0	0	0	110.8	L120 F161 F165 N176 V177 L183 F184	L120-L180 HydrophobicContact CD1-CD2 4.07Å; F161-L180 HydrophobicContact CB-CD2 3.87Å; F161-L180 HydrophobicContact CD1-CD2 4.26Å; F161-L180 HydrophobicContact CG-CD2 4.28Å; F165-L180 HydrophobicContact CB-CD1 3.95Å; F165-L180 HydrophobicContact CD2-CB 3.99Å; F165-L180 HydrophobicContact CD2-CD1 4.13Å; N176-L180 WeakPolarHBondContact O-CB 3.38Å; N176-L180 VanDerWaalsContact O-CG 3.29Å; N176-L180 WeakPolarHBondContact O-CG 3.21Å; N176-L180 PolarHBondContact O-N 2.93Å; V177-L180 PolarHBondContact O-N 2.77Å; L180-L183 PolarHBondContact O-N 3.41Å; L180-F184 VanDerWaalsContact O-CD2 3.24Å; L180-F184 WeakPolarHBondContact O-CD2 3.3Å; L180-F184 PolarHBondContact O-N 3.1Å
181	L	88.6	Confident	86.8	Confident	9 Å²	9	48.9 Å²	48.9	5%	0.047	27%	0.27	C	S	.	.	H	α-helix	trans	-58.9	-48.9	172.4	-71.2	171.8	0	0	0	111.5	F165 V177 L183 F184 V185 L193 M235 A239 F246	F165-L181 HydrophobicContact CE2-CD2 4.02Å; F165-L181 HydrophobicContact CE2-CG 4.1Å; F165-L181 HydrophobicContact CZ-CD2 4.17Å; V177-L181 HydrophobicContact CG1-CD1 3.99Å; V177-L181 HydrophobicContact CG1-CG 4.45Å; V177-L181 WeakPolarHBondContact O-CB 3.33Å; V177-L181 VanDerWaalsContact O-CG 3.32Å; V177-L181 WeakPolarHBondContact O-CG 3.32Å; V177-L181 PolarHBondContact O-N 2.67Å; L181-L183 VanDerWaalsContact C-N 3.29Å; L181-L183 PolarHBondContact O-N 3.4Å; L181-F184 PolarHBondContact O-N 3.3Å; L181-V185 WeakPolarHBondContact O-CB 3.45Å; L181-V185 WeakPolarHBondContact O-CG2 3.29Å; L181-V185 PolarHBondContact O-N 2.96Å; L181-L193 HydrophobicContact CD2-CD1 3.85Å; L181-M235 HydrophobicContact CD1-SD 4.31Å; L181-A239 HydrophobicContact CD1-CB 4.27Å; L181-F246 HydrophobicContact CD2-CD1 3.93Å; L181-F246 HydrophobicContact CD2-CD2 3.63Å; L181-F246 HydrophobicContact CD2-CE1 4.02Å; L181-F246 HydrophobicContact CD2-CE2 3.71Å; L181-F246 HydrophobicContact CD2-CG 3.74Å; L181-F246 HydrophobicContact CD2-CZ 3.92Å
182	E	87.9	Confident	86.7	Confident	79 Å²	79	43.5 Å²	43.5	37%	0.369	24%	0.242	S	C	.	.	H	α-helix	trans	-57	-42	176.9	-171.5	-177.6	170.6	0	0	111.9	A124 G178 K179 A186	A124-E182 HydrophobicContact CB-CG 4.25Å; G178-E182 WeakPolarHBondContact O-CB 3.5Å; G178-E182 PolarHBondContact O-N 2.92Å; K179-E182 WeakPolarHBondContact CD-OE2 3.29Å; K179-E182 IonicContact NZ-OE2 3.33Å; K179-E182 PolarHBondContact NZ-OE2 3.22Å; K179-E182 PolarHBondContact O-N 3.42Å; E182-A186 VanDerWaalsContact O-CB 3.3Å; E182-A186 WeakPolarHBondContact O-CB 3.41Å; E182-A186 PolarHBondContact O-N 2.97Å
183	L	87.6	Confident	86.9	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.3	-48.7	179.4	179.4	63.1	0	0	0	112.8	L120 L123 A124 I127 L157 K179 L180 L181 A186 C187	L120-L183 HydrophobicContact CD2-CD2 3.85Å; L123-L183 HydrophobicContact CB-CD1 4.2Å; L123-L183 HydrophobicContact CD2-CD1 3.92Å; L123-L183 HydrophobicContact CD2-CD2 4.36Å; L123-L183 HydrophobicContact CG-CD1 3.85Å; A124-L183 HydrophobicContact CB-CB 4.29Å; A124-L183 HydrophobicContact CB-CD1 4Å; I127-L183 HydrophobicContact CD1-CD1 4.06Å; L157-L183 HydrophobicContact CD1-CD1 4.15Å; L157-L183 HydrophobicContact CD1-CD2 4.46Å; L157-L183 HydrophobicContact CD1-CG 4.34Å; L157-L183 HydrophobicContact CD2-CD2 4.36Å; K179-L183 WeakPolarHBondContact O-CB 3.38Å; K179-L183 PolarHBondContact O-N 3.05Å; L180-L183 PolarHBondContact O-N 3.41Å; L181-L183 VanDerWaalsContact C-N 3.29Å; L181-L183 PolarHBondContact O-N 3.4Å; L183-A186 WeakPolarHBondContact O-CB 3.32Å; L183-A186 PolarHBondContact O-N 3.23Å; L183-C187 PolarHBondContact O-N 2.86Å; L183-C187 PolarHBondContact O-SG 3.18Å
184	F	88.6	Confident	87.1	Confident	1 Å²	1	34.2 Å²	34.2	0%	0.004	20%	0.197	C	C	.	.	H	α-helix	trans	-70.2	-36.9	-177.7	-83.8	-110.7	0	0	0	111.9	Q158 F161 L180 L181 C187 G188 C189 A192 L193	Q158-F184 HydrophobicContact CB-CE1 4.25Å; F161-F184 HydrophobicContact CB-CE2 3.95Å; F161-F184 HydrophobicContact CB-CZ 4.24Å; L180-F184 VanDerWaalsContact O-CD2 3.24Å; L180-F184 WeakPolarHBondContact O-CD2 3.3Å; L180-F184 PolarHBondContact O-N 3.1Å; L181-F184 PolarHBondContact O-N 3.3Å; F184-C187 CarbonylContact O-C 3.59Å; F184-C187 WeakPolarHBondContact O-CB 3.49Å; F184-C187 PolarHBondContact O-N 3.1Å; F184-G188 PolarHBondContact O-N 3.42Å; F184-C189 WeakPolarHBondContact CD1-SG 3.4Å; F184-C189 PolarHBondContact O-N 2.88Å; F184-A192 HydrophobicContact CE1-CB 4.44Å; F184-L193 HydrophobicContact CB-CD1 3.49Å; F184-L193 VanDerWaalsContact CB-CD1 3.49Å; F184-L193 HydrophobicContact CB-CG 3.9Å; F184-L193 HydrophobicContact CD1-CD1 4.01Å; F184-L193 HydrophobicContact CD1-CD2 3.76Å; F184-L193 HydrophobicContact CD1-CG 3.51Å; F184-L193 HydrophobicContact CD2-CD1 3.89Å; F184-L193 HydrophobicContact CD2-CD2 4.16Å; F184-L193 HydrophobicContact CD2-CG 4.18Å; F184-L193 HydrophobicContact CE1-CD2 3.71Å; F184-L193 HydrophobicContact CE1-CG 4.01Å; F184-L193 HydrophobicContact CE2-CD2 4.11Å; F184-L193 HydrophobicContact CG-CD1 3.53Å; F184-L193 HydrophobicContact CG-CD2 3.98Å; F184-L193 HydrophobicContact CG-CG 3.6Å; F184-L193 HydrophobicContact CZ-CD2 3.88Å
185	V	87.9	Confident	87.4	Confident	85 Å²	85	34.9 Å²	34.9	52%	0.515	21%	0.21	S	C	.	.	H	α-helix	trans	-62.4	-43.2	171.1	172	0	0	0	0	110.6	L181 C187 G188 D190	L181-V185 WeakPolarHBondContact O-CB 3.45Å; L181-V185 WeakPolarHBondContact O-CG2 3.29Å; L181-V185 PolarHBondContact O-N 2.96Å; V185-C187 VanDerWaalsContact C-N 3.26Å; V185-C187 PolarHBondContact O-N 3.15Å; V185-G188 PolarHBondContact O-N 3.17Å; V185-D190 HydrophobicContact CG2-CB 4.12Å
186	A	86.2	Confident	87.6	Confident	12 Å²	12	31 Å²	31	10%	0.099	19%	0.189	C	C	.	.	H	α-helix	trans	-60.7	-36.9	175	0	0	0	0	0	112.1	A124 K131 E182 L183 G188	A124-A186 HydrophobicContact CB-CB 4Å; A124-A186 WeakPolarHBondContact O-CB 3.36Å; K131-A186 WeakPolarHBondContact CD-O 3.38Å; K131-A186 WeakPolarHBondContact CE-O 3.48Å; K131-A186 PolarHBondContact NZ-O 3.47Å; E182-A186 VanDerWaalsContact O-CB 3.3Å; E182-A186 WeakPolarHBondContact O-CB 3.41Å; E182-A186 PolarHBondContact O-N 2.97Å; L183-A186 WeakPolarHBondContact O-CB 3.32Å; L183-A186 PolarHBondContact O-N 3.23Å; A186-G188 VanDerWaalsContact C-N 3.33Å
187	C	84.4	Confident	87.9	Confident	22 Å²	22	29.7 Å²	29.7	15%	0.149	18%	0.182	C	C	.	.	H	α-helix	trans	-72.5	-24.5	174.2	-62.8	0	0	0	0	113	I127 K131 L157 L183 F184 V185 C189	I127-C187 WeakPolarHBondContact CD1-SG 3.34Å; K131-C187 WeakPolarHBondContact CE-O 3.45Å; K131-C187 PolarHBondContact NZ-O 3.49Å; L157-C187 WeakPolarHBondContact CD1-SG 3.36Å; L183-C187 PolarHBondContact O-N 2.86Å; L183-C187 PolarHBondContact O-SG 3.18Å; F184-C187 CarbonylContact O-C 3.59Å; F184-C187 WeakPolarHBondContact O-CB 3.49Å; F184-C187 PolarHBondContact O-N 3.1Å; V185-C187 VanDerWaalsContact C-N 3.26Å; V185-C187 PolarHBondContact O-N 3.15Å; C187-C189 WeakPolarHBondContact CB-SG 3.3Å
188	G	82.7	Confident	88.2	Confident	44 Å²	44	30.7 Å²	30.7	45%	0.454	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	33.7	-172.5	0	0	0	0	0	112	K131 F184 V185 A186	K131-G188 VanDerWaalsContact NZ-N 3.18Å; F184-G188 PolarHBondContact O-N 3.42Å; V185-G188 PolarHBondContact O-N 3.17Å; A186-G188 VanDerWaalsContact C-N 3.33Å
189	C	84.3	Confident	88.4	Confident	20 Å²	20	32.5 Å²	32.5	14%	0.135	20%	0.201	C	C	.	.			trans	-123.1	28.2	176.2	60	0	0	0	0	111.4	F184 C187 D191 A192	F184-C189 WeakPolarHBondContact CD1-SG 3.4Å; F184-C189 PolarHBondContact O-N 2.88Å; C187-C189 WeakPolarHBondContact CB-SG 3.3Å; C189-D191 PolarHBondContact O-N 3.37Å; C189-A192 VanDerWaalsContact O-CB 3.3Å; C189-A192 WeakPolarHBondContact O-CB 3.11Å; C189-A192 PolarHBondContact O-N 2.88Å
190	D	84.9	Confident	88.6	Confident	51 Å²	51	34.9 Å²	34.9	27%	0.273	21%	0.214	S	C	.	.	H	α-helix	trans	-56.2	-29.2	173.6	52.5	-54.6	0	0	0	112.5	V185 A192 L193 H194	V185-D190 HydrophobicContact CG2-CB 4.12Å; D190-A192 PolarHBondContact O-N 3.34Å; D190-L193 WeakPolarHBondContact O-CA 3.32Å; D190-L193 PolarHBondContact O-N 2.99Å; D190-H194 VanDerWaalsContact C-ND1 3.34Å; D190-H194 VanDerWaalsContact O-CG 3.31Å; D190-H194 PolarHBondContact O-N 3.29Å; D190-H194 PolarHBondContact O-ND1 2.92Å; D190-H194 VanDerWaalsContact O-ND1 3.1Å; D190-H194 IonicContact OD2-CE1 2.95Å; D190-H194 PolarHBondContact OD2-CE1 3.16Å; D190-H194 VanDerWaalsContact OD2-CE1 3.3Å
191	D	86.7	Confident	88.9	Confident	110 Å²	110	35.9 Å²	35.9	59%	0.588	22%	0.218	S	C	*	.	H	α-helix	trans	-51.1	-35.3	168.9	-71.1	-26.2	0	0	0	113.8	C189 H194 A195	C189-D191 PolarHBondContact O-N 3.37Å; D191-H194 WeakPolarHBondContact CA-ND1 3.38Å; D191-H194 PolarHBondContact N-ND1 3.46Å; D191-H194 PolarHBondContact O-N 3.05Å; D191-H194 IonicContact OD1-ND1 3.16Å; D191-A195 WeakPolarHBondContact O-CB 3.5Å; D191-A195 PolarHBondContact O-N 2.92Å
192	A	87.7	Confident	89.1	Confident	11 Å²	11	35.5 Å²	35.5	9%	0.091	22%	0.216	C	C	.	.	H	α-helix	trans	-68.5	-40.4	176.5	0	0	0	0	0	111.6	Q158 F184 C189 D190 A195 I196	Q158-A192 VanDerWaalsContact CD-CB 3.42Å; Q158-A192 HydrophobicContact CG-CB 3.8Å; F184-A192 HydrophobicContact CE1-CB 4.44Å; C189-A192 VanDerWaalsContact O-CB 3.3Å; C189-A192 WeakPolarHBondContact O-CB 3.11Å; C189-A192 PolarHBondContact O-N 2.88Å; D190-A192 PolarHBondContact O-N 3.34Å; A192-A195 PolarHBondContact O-N 3.16Å; A192-I196 VanDerWaalsContact O-CG1 3.26Å; A192-I196 WeakPolarHBondContact O-CG1 3.38Å; A192-I196 PolarHBondContact O-N 3.36Å
193	L	89.9	Confident	89.3	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-69.3	-38.6	175.2	-64.3	-171.4	0	0	0	111.2	F165 L181 F184 D190 A195 I196 F197 F246	F165-L193 HydrophobicContact CB-CD2 4.05Å; F165-L193 HydrophobicContact CD1-CD2 3.88Å; F165-L193 HydrophobicContact CD2-CD1 4.27Å; F165-L193 HydrophobicContact CD2-CD2 4.17Å; F165-L193 HydrophobicContact CE1-CB 4.3Å; F165-L193 HydrophobicContact CE1-CD2 4.31Å; F165-L193 HydrophobicContact CE2-CD1 4.13Å; F165-L193 HydrophobicContact CG-CD2 3.78Å; F165-L193 HydrophobicContact CZ-CB 4.43Å; F165-L193 HydrophobicContact CZ-CD1 4.39Å; L181-L193 HydrophobicContact CD2-CD1 3.85Å; F184-L193 HydrophobicContact CB-CD1 3.49Å; F184-L193 VanDerWaalsContact CB-CD1 3.49Å; F184-L193 HydrophobicContact CB-CG 3.9Å; F184-L193 HydrophobicContact CD1-CD1 4.01Å; F184-L193 HydrophobicContact CD1-CD2 3.76Å; F184-L193 HydrophobicContact CD1-CG 3.51Å; F184-L193 HydrophobicContact CD2-CD1 3.89Å; F184-L193 HydrophobicContact CD2-CD2 4.16Å; F184-L193 HydrophobicContact CD2-CG 4.18Å; F184-L193 HydrophobicContact CE1-CD2 3.71Å; F184-L193 HydrophobicContact CE1-CG 4.01Å; F184-L193 HydrophobicContact CE2-CD2 4.11Å; F184-L193 HydrophobicContact CG-CD1 3.53Å; F184-L193 HydrophobicContact CG-CD2 3.98Å; F184-L193 HydrophobicContact CG-CG 3.6Å; F184-L193 HydrophobicContact CZ-CD2 3.88Å; D190-L193 WeakPolarHBondContact O-CA 3.32Å; D190-L193 PolarHBondContact O-N 2.99Å; L193-A195 VanDerWaalsContact C-N 3.32Å; L193-A195 PolarHBondContact O-N 2.96Å; L193-I196 HydrophobicContact CD2-CD1 4.43Å; L193-I196 PolarHBondContact O-N 2.9Å; L193-F197 WeakPolarHBondContact O-CB 3.07Å; L193-F197 PolarHBondContact O-N 3.28Å; L193-F246 HydrophobicContact CB-CE2 3.78Å; L193-F246 HydrophobicContact CB-CZ 3.86Å
194	H	91.8	Very high	89.5	Confident	11 Å²	11	37 Å²	37	5%	0.051	23%	0.23	C	C	.	.	H	α-helix	trans	-56.7	-48.6	171.8	-60.7	133	0	0	0	110.3	D190 D191 I196 F197 I198 F246 C250 M253	D190-H194 VanDerWaalsContact C-ND1 3.34Å; D190-H194 VanDerWaalsContact O-CG 3.31Å; D190-H194 PolarHBondContact O-N 3.29Å; D190-H194 PolarHBondContact O-ND1 2.92Å; D190-H194 VanDerWaalsContact O-ND1 3.1Å; D190-H194 IonicContact OD2-CE1 2.95Å; D190-H194 PolarHBondContact OD2-CE1 3.16Å; D190-H194 VanDerWaalsContact OD2-CE1 3.3Å; D191-H194 WeakPolarHBondContact CA-ND1 3.38Å; D191-H194 PolarHBondContact N-ND1 3.46Å; D191-H194 PolarHBondContact O-N 3.05Å; D191-H194 IonicContact OD1-ND1 3.16Å; H194-I196 PolarHBondContact O-N 3.11Å; H194-F197 PolarHBondContact O-N 3.02Å; H194-I198 WeakPolarHBondContact O-CB 3.1Å; H194-I198 WeakPolarHBondContact O-CD1 3.32Å; H194-I198 WeakPolarHBondContact O-CG1 3.45Å; H194-I198 PolarHBondContact O-N 3.11Å; H194-F246 AromaticContact CD2-CD2 3.36Å; H194-F246 WeakPolarHBondContact CD2-CD2 3.44Å; H194-F246 AromaticContact CD2-CE2 3.15Å; H194-F246 WeakPolarHBondContact CD2-CE2 3.34Å; H194-F246 AromaticContact CD2-CZ 3.94Å; H194-F246 AromaticContact CG-CE2 3.95Å; H194-F246 AromaticContact NE2-CD2 3.24Å; H194-F246 WeakPolarHBondContact NE2-CD2 3.44Å; H194-F246 AromaticContact NE2-CE2 3.52Å; H194-C250 VanDerWaalsContact CD2-SG 3.52Å; H194-M253 HydrophobicContact CB-CE 3.71Å; H194-M253 HydrophobicContact CB-SD 4.32Å; H194-M253 VanDerWaalsContact CD2-CE 3.49Å; H194-M253 WeakPolarHBondContact CD2-CE 3.3Å
195	A	91.6	Very high	89.5	Confident	60 Å²	60	41.5 Å²	41.5	50%	0.496	25%	0.247	S	C	.	.	H	α-helix	trans	-62.1	-44.2	179.5	0	0	0	0	0	112.9	D191 A192 L193 A199	D191-A195 WeakPolarHBondContact O-CB 3.5Å; D191-A195 PolarHBondContact O-N 2.92Å; A192-A195 PolarHBondContact O-N 3.16Å; L193-A195 VanDerWaalsContact C-N 3.32Å; L193-A195 PolarHBondContact O-N 2.96Å; A195-A199 VanDerWaalsContact O-CB 3.22Å; A195-A199 WeakPolarHBondContact O-CB 3.5Å; A195-A199 PolarHBondContact O-N 3.26Å
196	I	91	Very high	89.6	Confident	40 Å²	40	37.5 Å²	37.5	21%	0.205	22%	0.223	C	C	.	.	H	α-helix	trans	-62.1	-49	176.6	-68.9	164.5	0	0	0	110.2	F165 A192 L193 H194 I198 A199 E200	F165-I196 HydrophobicContact CD1-CG2 4.33Å; A192-I196 VanDerWaalsContact O-CG1 3.26Å; A192-I196 WeakPolarHBondContact O-CG1 3.38Å; A192-I196 PolarHBondContact O-N 3.36Å; L193-I196 HydrophobicContact CD2-CD1 4.43Å; L193-I196 PolarHBondContact O-N 2.9Å; H194-I196 PolarHBondContact O-N 3.11Å; I196-I198 PolarHBondContact O-N 3.07Å; I196-A199 PolarHBondContact O-N 3.35Å; I196-E200 WeakPolarHBondContact O-CB 3.45Å; I196-E200 WeakPolarHBondContact O-CG 3.31Å; I196-E200 PolarHBondContact O-N 3.42Å; I196-E200 VanDerWaalsContact O-N 3.11Å
197	F	93.7	Very high	89.6	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.7	-45.4	-179	-172.8	-88.5	0	0	0	111.8	F165 I169 L193 H194 E200 F201 V202 Y231 M235 F246 L247 C250	F165-F197 HydrophobicContact CE1-CB 4.45Å; I169-F197 HydrophobicContact CD1-CD2 3.7Å; I169-F197 HydrophobicContact CD1-CE2 4.01Å; L193-F197 WeakPolarHBondContact O-CB 3.07Å; L193-F197 PolarHBondContact O-N 3.28Å; H194-F197 PolarHBondContact O-N 3.02Å; F197-E200 PolarHBondContact O-N 3.44Å; F197-F201 AromaticContact CD2-CD2 3.61Å; F197-F201 HydrophobicContact CD2-CD2 3.61Å; F197-F201 HydrophobicContact CD2-CE2 4.19Å; F197-F201 HydrophobicContact CD2-CG 4.4Å; F197-F201 HydrophobicContact CE1-CB 4.36Å; F197-F201 HydrophobicContact CE2-CB 4.31Å; F197-F201 AromaticContact CE2-CD2 3.83Å; F197-F201 HydrophobicContact CE2-CD2 3.83Å; F197-F201 HydrophobicContact CE2-CG 4.22Å; F197-F201 HydrophobicContact CG-CD2 4.12Å; F197-F201 HydrophobicContact CZ-CB 4.17Å; F197-F201 PolarHBondContact O-N 2.93Å; F197-V202 HydrophobicContact CD1-CG2 3.85Å; F197-V202 HydrophobicContact CE1-CG2 3.7Å; F197-Y231 HydrophobicContact CE2-CD1 4.46Å; F197-Y231 HydrophobicContact CE2-CG 4.43Å; F197-Y231 HydrophobicContact CZ-CD2 4.16Å; F197-Y231 HydrophobicContact CZ-CG 4.06Å; F197-M235 HydrophobicContact CD2-CE 3.93Å; F197-M235 HydrophobicContact CE2-CE 3.62Å; F197-M235 HydrophobicContact CZ-CE 4.3Å; F197-F246 HydrophobicContact CB-CE1 4.42Å; F197-F246 HydrophobicContact CB-CZ 4.34Å; F197-F246 HydrophobicContact CD2-CE1 4.44Å; F197-F246 HydrophobicContact CG-CE1 4.38Å; F197-L247 HydrophobicContact CE1-CD1 3.74Å; F197-L247 HydrophobicContact CZ-CD1 3.62Å; F197-C250 HydrophobicContact CD1-CB 3.8Å; F197-C250 HydrophobicContact CE1-CB 4.3Å
198	I	93.5	Very high	89.7	Confident	22 Å²	22	44 Å²	44	11%	0.113	25%	0.252	C	S	.	.	I	π-helix	trans	-63.5	-44	178.5	-67.9	166.8	0	0	0	110.8	H194 I196 E200 V202 N203 C250 M253 A254	H194-I198 WeakPolarHBondContact O-CB 3.1Å; H194-I198 WeakPolarHBondContact O-CD1 3.32Å; H194-I198 WeakPolarHBondContact O-CG1 3.45Å; H194-I198 PolarHBondContact O-N 3.11Å; I196-I198 PolarHBondContact O-N 3.07Å; I198-E200 VanDerWaalsContact C-N 3.34Å; I198-E200 PolarHBondContact O-N 3.25Å; I198-V202 PolarHBondContact O-N 3Å; I198-N203 WeakPolarHBondContact O-CB 3.35Å; I198-N203 VanDerWaalsContact O-CG 3.25Å; I198-N203 PolarHBondContact O-N 3.36Å; I198-N203 PolarHBondContact O-ND2 3.2Å; I198-C250 WeakPolarHBondContact CD1-O 3.45Å; I198-C250 HydrophobicContact CG1-CB 4.21Å; I198-C250 WeakPolarHBondContact CG1-O 3.28Å; I198-M253 HydrophobicContact CD1-CB 3.77Å; I198-A254 HydrophobicContact CD1-CB 4.44Å; I198-A254 HydrophobicContact CG1-CB 4.21Å; I198-A254 HydrophobicContact CG2-CB 3.89Å
199	A	92.8	Very high	89.8	Confident	46 Å²	46	43 Å²	43	38%	0.38	24%	0.237	S	C	.	.	I	π-helix	trans	-63.1	-39	-178.5	0	0	0	0	0	113	A195 I196 P204	A195-A199 VanDerWaalsContact O-CB 3.22Å; A195-A199 WeakPolarHBondContact O-CB 3.5Å; A195-A199 PolarHBondContact O-N 3.26Å; I196-A199 PolarHBondContact O-N 3.35Å; A199-P204 WeakPolarHBondContact O-CD 3.4Å
200	E	91.5	Very high	89.6	Confident	109 Å²	109	44.5 Å²	44.5	51%	0.509	24%	0.244	S	C	.	.	I	π-helix	trans	-100.4	-35.4	-167.1	-65.2	-72.2	151.3	0	0	113.4	L166 I196 F197 I198 P204	L166-E200 HydrophobicContact CD1-CB 3.52Å; L166-E200 HydrophobicContact CD1-CG 3.5Å; L166-E200 VanDerWaalsContact CD1-CG 3.5Å; I196-E200 WeakPolarHBondContact O-CB 3.45Å; I196-E200 WeakPolarHBondContact O-CG 3.31Å; I196-E200 PolarHBondContact O-N 3.42Å; I196-E200 VanDerWaalsContact O-N 3.11Å; F197-E200 PolarHBondContact O-N 3.44Å; I198-E200 VanDerWaalsContact C-N 3.34Å; I198-E200 PolarHBondContact O-N 3.25Å; E200-P204 WeakPolarHBondContact O-CG 3.47Å
201	F	92.8	Very high	89.4	Confident	21 Å²	21	46.4 Å²	46.4	9%	0.092	26%	0.261	C	S	.	.	I	π-helix	trans	-107.7	-28.6	-175.4	-57.7	-75.4	0	0	0	113.5	L166 I169 Q170 F197 Y231	L166-F201 HydrophobicContact CD1-CE2 3.89Å; L166-F201 HydrophobicContact CD1-CZ 3.87Å; L166-F201 HydrophobicContact CG-CZ 4.45Å; I169-F201 HydrophobicContact CB-CE2 4.15Å; I169-F201 HydrophobicContact CB-CZ 3.79Å; I169-F201 HydrophobicContact CD1-CE2 3.85Å; I169-F201 HydrophobicContact CD1-CZ 4.38Å; I169-F201 HydrophobicContact CG2-CD1 4.44Å; I169-F201 HydrophobicContact CG2-CE1 3.74Å; I169-F201 HydrophobicContact CG2-CE2 3.85Å; I169-F201 HydrophobicContact CG2-CZ 3.41Å; I169-F201 VanDerWaalsContact CG2-CZ 3.41Å; Q170-F201 HydrophobicContact CG-CE1 4.29Å; Q170-F201 HydrophobicContact CG-CZ 4.29Å; F197-F201 AromaticContact CD2-CD2 3.61Å; F197-F201 HydrophobicContact CD2-CD2 3.61Å; F197-F201 HydrophobicContact CD2-CE2 4.19Å; F197-F201 HydrophobicContact CD2-CG 4.4Å; F197-F201 HydrophobicContact CE1-CB 4.36Å; F197-F201 HydrophobicContact CE2-CB 4.31Å; F197-F201 AromaticContact CE2-CD2 3.83Å; F197-F201 HydrophobicContact CE2-CD2 3.83Å; F197-F201 HydrophobicContact CE2-CG 4.22Å; F197-F201 HydrophobicContact CG-CD2 4.12Å; F197-F201 HydrophobicContact CZ-CB 4.17Å; F197-F201 PolarHBondContact O-N 2.93Å; F201-Y231 HydrophobicContact CB-CE2 4.44Å; F201-Y231 HydrophobicContact CD1-CE1 4.18Å; F201-Y231 AromaticContact CD1-CZ 3.85Å
202	V	93.6	Very high	88.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-99.5	-56.4	-174.3	-171.1	0	0	0	0	111.9	F197 I198 P204 R205 L206 L224 V227 L251 A254	F197-V202 HydrophobicContact CD1-CG2 3.85Å; F197-V202 HydrophobicContact CE1-CG2 3.7Å; I198-V202 PolarHBondContact O-N 3Å; V202-P204 VanDerWaalsContact C-CD 3.48Å; V202-R205 WeakPolarHBondContact O-CB 3.24Å; V202-R205 PolarHBondContact O-N 2.62Å; V202-R205 VanDerWaalsContact O-N 3.14Å; V202-L206 HydrophobicContact CG1-CD1 3.85Å; V202-L206 HydrophobicContact CG1-CG 4.05Å; V202-L206 WeakPolarHBondContact O-CG 3.16Å; V202-L206 PolarHBondContact O-N 2.98Å; V202-L224 HydrophobicContact CG1-CD2 3.79Å; V202-V227 HydrophobicContact CG2-CG1 4.37Å; V202-L251 HydrophobicContact CG1-CD2 4.37Å; V202-L251 HydrophobicContact CG2-CD2 4.11Å; V202-A254 HydrophobicContact CB-CB 4.41Å; V202-A254 HydrophobicContact CG1-CB 3.65Å
203	N	92.2	Very high	87.2	Confident	46 Å²	46	57.3 Å²	57.3	25%	0.246	30%	0.295	C	S	.	.	H	α-helix	trans	-57.1	-39.4	-174.8	-76.8	-17.6	0	0	0	114.1	I198 R205 L206 N207	I198-N203 WeakPolarHBondContact O-CB 3.35Å; I198-N203 VanDerWaalsContact O-CG 3.25Å; I198-N203 PolarHBondContact O-N 3.36Å; I198-N203 PolarHBondContact O-ND2 3.2Å; N203-R205 VanDerWaalsContact C-N 3.33Å; N203-R205 PolarHBondContact O-N 3.17Å; N203-L206 PolarHBondContact O-N 3.38Å; N203-N207 WeakPolarHBondContact O-CB 3.45Å; N203-N207 PolarHBondContact O-N 3.45Å; N203-N207 PolarHBondContact O-ND2 3.32Å
204	P	91.4	Very high	85.4	Confident	66 Å²	66	65.8 Å²	65.8	43%	0.429	34%	0.335	S	S	.	.	H	α-helix	trans	-60.9	-42.3	177.3	-26	37.6	0	0	0	112.3	A199 E200 V202 N207 E208	A199-P204 WeakPolarHBondContact O-CD 3.4Å; E200-P204 WeakPolarHBondContact O-CG 3.47Å; V202-P204 VanDerWaalsContact C-CD 3.48Å; P204-N207 PolarHBondContact O-N 3.49Å; P204-E208 WeakPolarHBondContact O-CB 3.14Å; P204-E208 PolarHBondContact O-N 2.65Å
205	R	89.5	Confident	83.9	Confident	94 Å²	94	68.3 Å²	68.3	36%	0.355	36%	0.358	S	S	.	.	H	α-helix	trans	-64.9	-43.5	176.4	-60	-71.3	-165.4	137.5	11.5	111.5	V202 N203 E208 C209 V227 E230	V202-R205 WeakPolarHBondContact O-CB 3.24Å; V202-R205 PolarHBondContact O-N 2.62Å; V202-R205 VanDerWaalsContact O-N 3.14Å; N203-R205 VanDerWaalsContact C-N 3.33Å; N203-R205 PolarHBondContact O-N 3.17Å; R205-E208 PolarHBondContact O-N 2.84Å; R205-C209 WeakPolarHBondContact O-CB 3.36Å; R205-C209 PolarHBondContact O-N 3.15Å; R205-V227 HydrophobicContact CG-CG2 4.33Å; R205-E230 IonicContact CZ-OE2 4Å; R205-E230 IonicContact NH2-OE1 3.17Å; R205-E230 PolarHBondContact NH2-OE1 3.42Å; R205-E230 IonicContact NH2-OE2 2.77Å; R205-E230 PolarHBondContact NH2-OE2 3.42Å
206	L	89	Confident	83.3	Confident	2 Å²	2	70 Å²	70	1%	0.01	36%	0.355	C	S	.	.	H	α-helix	trans	-65.7	-38.1	177.6	-63.1	-173.1	0	0	0	112.5	V202 N203 C209 L210 V220 E223 L224 A254 F258	V202-L206 HydrophobicContact CG1-CD1 3.85Å; V202-L206 HydrophobicContact CG1-CG 4.05Å; V202-L206 WeakPolarHBondContact O-CG 3.16Å; V202-L206 PolarHBondContact O-N 2.98Å; N203-L206 PolarHBondContact O-N 3.38Å; L206-C209 WeakPolarHBondContact O-CB 3.33Å; L206-C209 PolarHBondContact O-N 2.94Å; L206-L210 PolarHBondContact O-N 3.42Å; L206-V220 HydrophobicContact CD2-CB 4.5Å; L206-V220 HydrophobicContact CD2-CG1 3.96Å; L206-V220 HydrophobicContact CD2-CG2 4.42Å; L206-E223 HydrophobicContact CD2-CB 4.37Å; L206-L224 HydrophobicContact CD1-CD2 4.42Å; L206-L224 HydrophobicContact CD2-CD2 4.13Å; L206-L224 HydrophobicContact CD2-CG 4.3Å; L206-A254 HydrophobicContact CD1-CB 4.34Å; L206-F258 HydrophobicContact CB-CD2 3.97Å; L206-F258 HydrophobicContact CB-CE2 3.56Å; L206-F258 HydrophobicContact CB-CZ 3.88Å; L206-F258 HydrophobicContact CD1-CB 4.22Å; L206-F258 HydrophobicContact CD1-CD2 3.86Å; L206-F258 HydrophobicContact CD1-CE2 4.32Å; L206-F258 HydrophobicContact CD1-CG 4.01Å
207	N	87.3	Confident	83	Confident	86 Å²	86	68.2 Å²	68.2	46%	0.46	35%	0.346	S	S	.	.	H	α-helix	trans	-69.5	-37.7	176.2	-71.2	-25.2	0	0	0	112	N203 P204 C209 L210 S211	N203-N207 WeakPolarHBondContact O-CB 3.45Å; N203-N207 PolarHBondContact O-N 3.45Å; N203-N207 PolarHBondContact O-ND2 3.32Å; P204-N207 PolarHBondContact O-N 3.49Å; N207-C209 VanDerWaalsContact C-N 3.33Å; N207-L210 PolarHBondContact O-N 3.37Å; N207-S211 PolarHBondContact O-N 3.47Å
208	E	86.4	Confident	82.7	Confident	85 Å²	85	74.4 Å²	74.4	40%	0.397	37%	0.373	S	S	.	.	H	α-helix	trans	-64.3	-39.3	172.5	-172.1	179	-176	0	0	111.6	P204 R205 L210 S211 K212	P204-E208 WeakPolarHBondContact O-CB 3.14Å; P204-E208 PolarHBondContact O-N 2.65Å; R205-E208 PolarHBondContact O-N 2.84Å; E208-L210 VanDerWaalsContact C-N 3.33Å; E208-L210 PolarHBondContact O-N 2.98Å; E208-S211 PolarHBondContact O-N 3.39Å; E208-S211 PolarHBondContact O-OG 2.89Å; E208-K212 HydrophobicContact CG-CD 4.11Å; E208-K212 PolarHBondContact O-N 3.37Å; E208-K212 WeakPolarHBondContact OE1-CE 3.15Å; E208-K212 IonicContact OE1-NZ 3.9Å; E208-K212 PolarHBondContact OE1-NZ 3.28Å
209	C	83.5	Confident	82.4	Confident	21 Å²	21	74.7 Å²	74.7	14%	0.142	38%	0.378	C	S	.	.	H	α-helix	trans	-57.5	-42.8	174.6	-166.5	0	0	0	0	112.2	R205 L206 N207 S211 K212 A219 E223	R205-C209 WeakPolarHBondContact O-CB 3.36Å; R205-C209 PolarHBondContact O-N 3.15Å; L206-C209 WeakPolarHBondContact O-CB 3.33Å; L206-C209 PolarHBondContact O-N 2.94Å; N207-C209 VanDerWaalsContact C-N 3.33Å; C209-S211 PolarHBondContact O-N 2.97Å; C209-K212 PolarHBondContact O-N 3.09Å; C209-A219 WeakPolarHBondContact SG-CB 3.43Å; C209-E223 HydrophobicContact CB-CG 4.12Å
210	L	81.3	Confident	82.3	Confident	53 Å²	53	72.5 Å²	72.5	28%	0.277	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-32.2	175.4	-75.7	171.5	0	0	0	113.3	L206 N207 E208 F258 H262	L206-L210 PolarHBondContact O-N 3.42Å; N207-L210 PolarHBondContact O-N 3.37Å; E208-L210 VanDerWaalsContact C-N 3.33Å; E208-L210 PolarHBondContact O-N 2.98Å; L210-F258 HydrophobicContact CD1-CE1 4.19Å; L210-F258 HydrophobicContact CD1-CE2 3.95Å; L210-F258 HydrophobicContact CD1-CZ 3.34Å; L210-F258 HydrophobicContact CD2-CE1 4.26Å; L210-F258 HydrophobicContact CD2-CZ 4.14Å; L210-F258 HydrophobicContact CG-CE1 4.2Å; L210-F258 HydrophobicContact CG-CZ 3.59Å; L210-H262 HydrophobicContact CD1-CB 4.42Å
211	S	80.4	Confident	82.3	Confident	91 Å²	91	67.5 Å²	67.5	64%	0.636	34%	0.337	S	S	*	.	H	α-helix	trans	-78.6	-23.3	-177.4	72.8	0	0	0	0	113.9	N207 E208 C209	N207-S211 PolarHBondContact O-N 3.47Å; E208-S211 PolarHBondContact O-N 3.39Å; E208-S211 PolarHBondContact O-OG 2.89Å; C209-S211 PolarHBondContact O-N 2.97Å
212	K	74.3	Confident	82.2	Confident	134 Å²	134	69.9 Å²	69.9	58%	0.583	36%	0.355	S	S	*	.	H	α-helix	trans	-103.1	-19.3	-162.8	-80	-175.5	177.5	176.9	0	118.1	E208 C209	E208-K212 HydrophobicContact CG-CD 4.11Å; E208-K212 PolarHBondContact O-N 3.37Å; E208-K212 WeakPolarHBondContact OE1-CE 3.15Å; E208-K212 IonicContact OE1-NZ 3.9Å; E208-K212 PolarHBondContact OE1-NZ 3.28Å; C209-K212 PolarHBondContact O-N 3.09Å
213	R	54.7	Low	82.1	Confident	215 Å²	215	73 Å²	73	81%	0.811	37%	0.37	S	S	*	.			trans	-176.5	174.4	-176.8	-110	158	-161.3	-154.3	6.3	118
214	E	52.3	Low	82.1	Confident	180 Å²	180	70.9 Å²	70.9	84%	0.841	36%	0.359	S	S	*	.	S	Bend	trans	-62.9	152	176.4	-67.9	174.9	145.7	0	0	115.5
215	A	60.3	Low	82.2	Confident	64 Å²	64	69.5 Å²	69.5	53%	0.529	35%	0.347	S	S	.	.			trans	66.2	61.7	-177.3	0	0	0	0	0	115.7	F217 K218 A219	A215-F217 VanDerWaalsContact C-N 3.27Å; A215-F217 PolarHBondContact O-N 2.9Å; A215-K218 PolarHBondContact O-N 3.37Å; A215-K218 VanDerWaalsContact O-N 3.13Å; A215-A219 PolarHBondContact O-N 3.49Å; A215-A219 VanDerWaalsContact O-N 3.15Å
216	H	77	Confident	82.3	Confident	94 Å²	94	67.2 Å²	67.2	44%	0.435	35%	0.348	S	S	.	.	H	α-helix	trans	-43.5	-38.2	-174.1	-60.1	-67	0	0	0	116.4	V220 L263	H216-V220 WeakPolarHBondContact O-CG2 3.48Å; H216-V220 PolarHBondContact O-N 3.05Å; H216-L263 HydrophobicContact CB-CD2 3.46Å; H216-L263 VanDerWaalsContact CB-CD2 3.46Å
217	F	86.6	Confident	82.5	Confident	3 Å²	3	67.2 Å²	67.2	1%	0.013	35%	0.349	C	S	.	.	H	α-helix	trans	-79.4	-45.1	-178.6	-175.1	-103.7	0	0	0	113.3	A215 A219 V220 L221 L255 T259 L263 F267 T278 F282 F311	A215-F217 VanDerWaalsContact C-N 3.27Å; A215-F217 PolarHBondContact O-N 2.9Å; F217-A219 VanDerWaalsContact C-N 3.33Å; F217-A219 PolarHBondContact O-N 3.46Å; F217-V220 PolarHBondContact O-N 2.83Å; F217-L221 HydrophobicContact CD1-CD1 3.88Å; F217-L221 HydrophobicContact CD1-CG 4.35Å; F217-L221 HydrophobicContact CE1-CD1 3.44Å; F217-L221 VanDerWaalsContact CE1-CD1 3.44Å; F217-L221 HydrophobicContact CE1-CD2 4.46Å; F217-L221 HydrophobicContact CE1-CG 4.09Å; F217-L221 HydrophobicContact CZ-CD1 3.97Å; F217-L221 HydrophobicContact CZ-CD2 4.16Å; F217-L221 HydrophobicContact CZ-CG 4.26Å; F217-L221 WeakPolarHBondContact O-CG 3.37Å; F217-L221 PolarHBondContact O-N 3.27Å; F217-L221 VanDerWaalsContact O-N 3.08Å; F217-L255 HydrophobicContact CE2-CD1 4.16Å; F217-T259 HydrophobicContact CD2-CG2 4.03Å; F217-T259 HydrophobicContact CE2-CG2 3.65Å; F217-L263 HydrophobicContact CB-CD1 4.27Å; F217-L263 HydrophobicContact CD2-CD1 3.85Å; F217-F267 HydrophobicContact CD2-CZ 4.13Å; F217-F267 HydrophobicContact CE2-CE1 4.19Å; F217-F267 AromaticContact CE2-CZ 3.68Å; F217-F267 HydrophobicContact CE2-CZ 3.68Å; F217-F267 HydrophobicContact CZ-CE1 4.34Å; F217-F267 HydrophobicContact CZ-CZ 4.28Å; F217-T278 HydrophobicContact CB-CG2 4Å; F217-T278 HydrophobicContact CD1-CG2 3.16Å; F217-T278 HydrophobicContact CD2-CG2 4.33Å; F217-T278 HydrophobicContact CE1-CG2 3.55Å; F217-T278 WeakPolarHBondContact CE1-O 3.47Å; F217-T278 HydrophobicContact CG-CG2 3.58Å; F217-T278 HydrophobicContact CZ-CG2 4.3Å; F217-F282 HydrophobicContact CE1-CB 3.88Å; F217-F282 HydrophobicContact CZ-CB 4.08Å; F217-F282 HydrophobicContact CZ-CD2 4.16Å; F217-F311 HydrophobicContact CE1-CZ 4.09Å; F217-F311 HydrophobicContact CZ-CZ 4.03Å
218	K	87.1	Confident	82.7	Confident	130 Å²	130	63.3 Å²	63.3	57%	0.565	33%	0.328	S	S	*	.	H	α-helix	trans	-64.5	-40.4	179.7	-175.8	178.1	178.8	-177.8	0	111.2	A215 L221 C222 A281	A215-K218 PolarHBondContact O-N 3.37Å; A215-K218 VanDerWaalsContact O-N 3.13Å; K218-L221 PolarHBondContact O-N 2.9Å; K218-C222 PolarHBondContact O-N 3.3Å; K218-C222 PolarHBondContact O-SG 3.25Å; K218-A281 HydrophobicContact CB-CB 4.22Å; K218-A281 HydrophobicContact CG-CB 4.13Å
219	A	87.4	Confident	83	Confident	28 Å²	28	65.2 Å²	65.2	23%	0.231	34%	0.336	C	S	.	.	H	α-helix	trans	-61.6	-44.4	176.7	0	0	0	0	0	111.5	C209 A215 F217 L221 C222 E223	C209-A219 WeakPolarHBondContact SG-CB 3.43Å; A215-A219 PolarHBondContact O-N 3.49Å; A215-A219 VanDerWaalsContact O-N 3.15Å; F217-A219 VanDerWaalsContact C-N 3.33Å; F217-A219 PolarHBondContact O-N 3.46Å; A219-L221 VanDerWaalsContact C-N 3.34Å; A219-L221 PolarHBondContact O-N 2.97Å; A219-C222 PolarHBondContact O-N 2.96Å; A219-E223 WeakPolarHBondContact O-CG 3.37Å; A219-E223 PolarHBondContact O-N 3.15Å
220	V	90.2	Very high	83.3	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.006	35%	0.349	C	S	.	.	H	α-helix	trans	-57.9	-44	174.1	164.1	0	0	0	0	112	L206 H216 F217 C222 E223 L224 L255 F258 L263	L206-V220 HydrophobicContact CD2-CB 4.5Å; L206-V220 HydrophobicContact CD2-CG1 3.96Å; L206-V220 HydrophobicContact CD2-CG2 4.42Å; H216-V220 WeakPolarHBondContact O-CG2 3.48Å; H216-V220 PolarHBondContact O-N 3.05Å; F217-V220 PolarHBondContact O-N 2.83Å; V220-C222 PolarHBondContact O-N 3.36Å; V220-E223 PolarHBondContact O-N 2.86Å; V220-L224 HydrophobicContact CG1-CD1 4.22Å; V220-L224 VanDerWaalsContact O-CG 3.32Å; V220-L224 WeakPolarHBondContact O-CG 3.49Å; V220-L224 PolarHBondContact O-N 2.73Å; V220-L255 HydrophobicContact CG1-CD1 4Å; V220-F258 HydrophobicContact CG1-CD1 4.29Å; V220-F258 HydrophobicContact CG2-CD1 4.01Å; V220-F258 HydrophobicContact CG2-CE1 3.52Å; V220-F258 HydrophobicContact CG2-CZ 4.32Å; V220-L263 HydrophobicContact CG2-CD1 4.3Å
221	L	91.6	Very high	83.8	Confident	4 Å²	4	67.4 Å²	67.4	2%	0.021	34%	0.342	C	S	.	.	H	α-helix	trans	-64	-40.2	177.7	-64.3	179.5	0	0	0	112.6	F217 K218 A219 L224 I225 L255 A281 F282 F285	F217-L221 HydrophobicContact CD1-CD1 3.88Å; F217-L221 HydrophobicContact CD1-CG 4.35Å; F217-L221 HydrophobicContact CE1-CD1 3.44Å; F217-L221 VanDerWaalsContact CE1-CD1 3.44Å; F217-L221 HydrophobicContact CE1-CD2 4.46Å; F217-L221 HydrophobicContact CE1-CG 4.09Å; F217-L221 HydrophobicContact CZ-CD1 3.97Å; F217-L221 HydrophobicContact CZ-CD2 4.16Å; F217-L221 HydrophobicContact CZ-CG 4.26Å; F217-L221 WeakPolarHBondContact O-CG 3.37Å; F217-L221 PolarHBondContact O-N 3.27Å; F217-L221 VanDerWaalsContact O-N 3.08Å; K218-L221 PolarHBondContact O-N 2.9Å; A219-L221 VanDerWaalsContact C-N 3.34Å; A219-L221 PolarHBondContact O-N 2.97Å; L221-L224 PolarHBondContact O-N 2.95Å; L221-I225 WeakPolarHBondContact O-CG1 3.39Å; L221-I225 PolarHBondContact O-N 3.39Å; L221-I225 VanDerWaalsContact O-N 3.12Å; L221-L255 HydrophobicContact CD2-CD1 3.78Å; L221-L255 HydrophobicContact CD2-CD2 3.85Å; L221-A281 VanDerWaalsContact CD1-C 3.47Å; L221-A281 HydrophobicContact CD1-CB 3.95Å; L221-A281 WeakPolarHBondContact CD1-O 3.23Å; L221-F282 HydrophobicContact CD1-CB 4.47Å; L221-F285 HydrophobicContact CB-CB 4.23Å; L221-F285 HydrophobicContact CB-CD2 4.04Å; L221-F285 HydrophobicContact CB-CG 4.24Å; L221-F285 HydrophobicContact CD1-CB 3.9Å; L221-F285 HydrophobicContact CD1-CG 4.36Å; L221-F285 HydrophobicContact CD2-CB 4.22Å; L221-F285 HydrophobicContact CD2-CD1 3.85Å; L221-F285 HydrophobicContact CD2-CD2 4.02Å; L221-F285 HydrophobicContact CD2-CE1 4.21Å; L221-F285 HydrophobicContact CD2-CE2 4.37Å; L221-F285 HydrophobicContact CD2-CG 3.75Å; L221-F285 HydrophobicContact CD2-CZ 4.46Å; L221-F285 HydrophobicContact CG-CB 4.35Å; L221-F285 HydrophobicContact CG-CG 4.33Å
222	C	90.4	Very high	84.2	Confident	70 Å²	70	64.5 Å²	64.5	47%	0.473	32%	0.321	S	S	.	.	H	α-helix	trans	-64.1	-42.5	175.6	-70.9	0	0	0	0	112	K218 A219 V220 L224 I225 A226	K218-C222 PolarHBondContact O-N 3.3Å; K218-C222 PolarHBondContact O-SG 3.25Å; A219-C222 PolarHBondContact O-N 2.96Å; V220-C222 PolarHBondContact O-N 3.36Å; C222-L224 PolarHBondContact O-N 3.32Å; C222-I225 WeakPolarHBondContact O-CB 3.26Å; C222-I225 PolarHBondContact O-N 2.96Å; C222-A226 PolarHBondContact O-N 3.29Å
223	E	90.3	Very high	84.8	Confident	66 Å²	66	61.4 Å²	61.4	31%	0.308	32%	0.317	S	S	.	.	H	α-helix	trans	-63	-40.6	175.5	-71.4	-58.9	144	0	0	111.8	L206 C209 A219 V220 I225 A226 V227	L206-E223 HydrophobicContact CD2-CB 4.37Å; C209-E223 HydrophobicContact CB-CG 4.12Å; A219-E223 WeakPolarHBondContact O-CG 3.37Å; A219-E223 PolarHBondContact O-N 3.15Å; V220-E223 PolarHBondContact O-N 2.86Å; E223-I225 VanDerWaalsContact C-N 3.29Å; E223-I225 PolarHBondContact O-N 2.98Å; E223-A226 WeakPolarHBondContact O-CB 3.12Å; E223-A226 PolarHBondContact O-N 3.06Å; E223-A226 VanDerWaalsContact O-N 3.12Å; E223-V227 WeakPolarHBondContact O-CG2 3.32Å; E223-V227 PolarHBondContact O-N 3.42Å
224	L	93.6	Very high	86.5	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-63	-35.8	175.3	-68.4	173.9	0	0	0	112.5	V202 L206 V220 L221 C222 H228 L251 L255 F285	V202-L224 HydrophobicContact CG1-CD2 3.79Å; L206-L224 HydrophobicContact CD1-CD2 4.42Å; L206-L224 HydrophobicContact CD2-CD2 4.13Å; L206-L224 HydrophobicContact CD2-CG 4.3Å; V220-L224 HydrophobicContact CG1-CD1 4.22Å; V220-L224 VanDerWaalsContact O-CG 3.32Å; V220-L224 WeakPolarHBondContact O-CG 3.49Å; V220-L224 PolarHBondContact O-N 2.73Å; L221-L224 PolarHBondContact O-N 2.95Å; C222-L224 PolarHBondContact O-N 3.32Å; L224-H228 WeakPolarHBondContact O-CB 3.38Å; L224-H228 PolarHBondContact O-N 3.38Å; L224-L251 HydrophobicContact CD2-CB 4.27Å; L224-L251 HydrophobicContact CD2-CD2 3.73Å; L224-L255 HydrophobicContact CD1-CB 3.78Å; L224-L255 HydrophobicContact CD1-CD1 3.89Å; L224-L255 HydrophobicContact CD1-CD2 4.38Å; L224-L255 HydrophobicContact CD1-CG 4.22Å; L224-F285 HydrophobicContact CB-CE2 4.03Å; L224-F285 HydrophobicContact CD1-CZ 4.43Å
225	I	92.3	Very high	88.3	Confident	38 Å²	38	43 Å²	43	20%	0.195	24%	0.241	C	C	.	.	H	α-helix	trans	-65.9	-41	173	-69.2	171.3	0	0	0	110.7	L221 C222 E223 H228 E229 F285 E288 R292	L221-I225 WeakPolarHBondContact O-CG1 3.39Å; L221-I225 PolarHBondContact O-N 3.39Å; L221-I225 VanDerWaalsContact O-N 3.12Å; C222-I225 WeakPolarHBondContact O-CB 3.26Å; C222-I225 PolarHBondContact O-N 2.96Å; E223-I225 VanDerWaalsContact C-N 3.29Å; E223-I225 PolarHBondContact O-N 2.98Å; I225-H228 WeakPolarHBondContact O-CB 3.26Å; I225-H228 PolarHBondContact O-N 2.95Å; I225-E229 PolarHBondContact O-N 3.02Å; I225-F285 HydrophobicContact CD1-CD2 3.89Å; I225-F285 HydrophobicContact CG1-CD2 3.74Å; I225-F285 HydrophobicContact CG1-CE2 3.99Å; I225-E288 HydrophobicContact CD1-CG 4.26Å; I225-R292 PolarHBondContact O-NH1 2.88Å
226	A	91.9	Very high	89.5	Confident	45 Å²	45	42.7 Å²	42.7	37%	0.372	23%	0.234	S	C	.	.	H	α-helix	trans	-63.4	-45.1	177.3	0	0	0	0	0	111.6	C222 E223 H228 E229 E230	C222-A226 PolarHBondContact O-N 3.29Å; E223-A226 WeakPolarHBondContact O-CB 3.12Å; E223-A226 PolarHBondContact O-N 3.06Å; E223-A226 VanDerWaalsContact O-N 3.12Å; A226-H228 VanDerWaalsContact C-N 3.33Å; A226-H228 PolarHBondContact O-N 3.49Å; A226-E229 WeakPolarHBondContact O-CB 2.89Å; A226-E229 PolarHBondContact O-N 3.4Å; A226-E229 VanDerWaalsContact O-N 3.13Å; A226-E230 PolarHBondContact O-N 2.94Å
227	V	93.1	Very high	90.1	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.018	24%	0.243	C	C	.	.	H	α-helix	trans	-62	-41.9	174.1	177.5	0	0	0	0	110.8	V202 R205 E223 E229 E230 Y231 L251	V202-V227 HydrophobicContact CG2-CG1 4.37Å; R205-V227 HydrophobicContact CG-CG2 4.33Å; E223-V227 WeakPolarHBondContact O-CG2 3.32Å; E223-V227 PolarHBondContact O-N 3.42Å; V227-E229 VanDerWaalsContact C-N 3.29Å; V227-E229 PolarHBondContact O-N 3.37Å; V227-E230 PolarHBondContact O-N 3.26Å; V227-Y231 HydrophobicContact CG1-CD2 3.74Å; V227-Y231 HydrophobicContact CG1-CE2 4.09Å; V227-Y231 WeakPolarHBondContact O-CD2 3.31Å; V227-Y231 PolarHBondContact O-N 2.8Å; V227-L251 HydrophobicContact CB-CD2 4.02Å; V227-L251 HydrophobicContact CG1-CD2 3.72Å
228	H	92.9	Very high	90	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.019	25%	0.25	C	C	.	.	H	α-helix	trans	-58	-44.4	173.8	-176.1	-71.8	0	0	0	111	L224 I225 A226 S232 L251	L224-H228 WeakPolarHBondContact O-CB 3.38Å; L224-H228 PolarHBondContact O-N 3.38Å; I225-H228 WeakPolarHBondContact O-CB 3.26Å; I225-H228 PolarHBondContact O-N 2.95Å; A226-H228 VanDerWaalsContact C-N 3.33Å; A226-H228 PolarHBondContact O-N 3.49Å; H228-S232 WeakPolarHBondContact O-CA 3.38Å; H228-S232 WeakPolarHBondContact O-CB 3.36Å; H228-S232 PolarHBondContact O-N 2.89Å; H228-L251 HydrophobicContact CB-CD1 3.62Å
229	E	91.1	Very high	89.8	Confident	124 Å²	124	40.5 Å²	40.5	58%	0.579	23%	0.231	S	C	*	.	H	α-helix	trans	-63.8	-42	-179.7	-159.3	156.7	150	0	0	112.8	I225 A226 V227 R292	I225-E229 PolarHBondContact O-N 3.02Å; A226-E229 WeakPolarHBondContact O-CB 2.89Å; A226-E229 PolarHBondContact O-N 3.4Å; A226-E229 VanDerWaalsContact O-N 3.13Å; V227-E229 VanDerWaalsContact C-N 3.29Å; V227-E229 PolarHBondContact O-N 3.37Å; E229-R292 IonicContact OE2-CZ 3.21Å; E229-R292 IonicContact OE2-NH1 3.46Å; E229-R292 PolarHBondContact OE2-NH1 3.23Å; E229-R292 VanDerWaalsContact OE2-NH1 3.08Å; E229-R292 IonicContact OE2-NH2 2.79Å; E229-R292 PolarHBondContact OE2-NH2 3.5Å
230	E	91	Very high	89.6	Confident	87 Å²	87	47.1 Å²	47.1	41%	0.407	26%	0.255	S	S	.	.	H	α-helix	trans	-62.2	-50.2	178.3	-169.2	176.3	138.8	0	0	111.4	R205 A226 V227	R205-E230 IonicContact CZ-OE2 4Å; R205-E230 IonicContact NH2-OE1 3.17Å; R205-E230 PolarHBondContact NH2-OE1 3.42Å; R205-E230 IonicContact NH2-OE2 2.77Å; R205-E230 PolarHBondContact NH2-OE2 3.42Å; A226-E230 PolarHBondContact O-N 2.94Å; V227-E230 PolarHBondContact O-N 3.26Å
231	Y	91.7	Very high	89.1	Confident	33 Å²	33	50.4 Å²	50.4	13%	0.129	28%	0.278	C	S	.	.	H	α-helix	trans	-97.3	-10.3	-172	-63.7	-79.2	0	0	0	115	I169 F197 F201 V227 S233 L234 M235	I169-Y231 HydrophobicContact CG2-CD1 4.17Å; I169-Y231 HydrophobicContact CG2-CE1 3.85Å; F197-Y231 HydrophobicContact CE2-CD1 4.46Å; F197-Y231 HydrophobicContact CE2-CG 4.43Å; F197-Y231 HydrophobicContact CZ-CD2 4.16Å; F197-Y231 HydrophobicContact CZ-CG 4.06Å; F201-Y231 HydrophobicContact CB-CE2 4.44Å; F201-Y231 HydrophobicContact CD1-CE1 4.18Å; F201-Y231 AromaticContact CD1-CZ 3.85Å; V227-Y231 HydrophobicContact CG1-CD2 3.74Å; V227-Y231 HydrophobicContact CG1-CE2 4.09Å; V227-Y231 WeakPolarHBondContact O-CD2 3.31Å; V227-Y231 PolarHBondContact O-N 2.8Å; Y231-S233 VanDerWaalsContact C-N 3.32Å; Y231-S233 PolarHBondContact O-N 3.36Å; Y231-L234 HydrophobicContact CD1-CD2 4.03Å; Y231-L234 PolarHBondContact O-N 3.44Å; Y231-M235 WeakPolarHBondContact O-CB 3.35Å; Y231-M235 VanDerWaalsContact O-CG 3.31Å; Y231-M235 WeakPolarHBondContact O-CG 3.39Å; Y231-M235 PolarHBondContact O-N 3.11Å
232	S	88.6	Confident	88.8	Confident	30 Å²	30	53.5 Å²	53.5	21%	0.21	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-38.4	-177.1	174	0	0	0	0	112.4	H228 S236	H228-S232 WeakPolarHBondContact O-CA 3.38Å; H228-S232 WeakPolarHBondContact O-CB 3.36Å; H228-S232 PolarHBondContact O-N 2.89Å; S232-S236 WeakPolarHBondContact O-CB 3.25Å; S232-S236 PolarHBondContact O-N 3.31Å
233	S	87.7	Confident	88.6	Confident	70 Å²	70	50.1 Å²	50.1	49%	0.49	28%	0.277	S	S	.	.	H	α-helix	trans	-66.3	-41	178.5	73.2	0	0	0	0	112.1	Y231 K237	Y231-S233 VanDerWaalsContact C-N 3.32Å; Y231-S233 PolarHBondContact O-N 3.36Å; S233-K237 WeakPolarHBondContact O-CG 3.26Å; S233-K237 PolarHBondContact O-N 3.11Å; S233-K237 VanDerWaalsContact O-N 3.15Å
234	L	89.6	Confident	88.4	Confident	9 Å²	9	47.9 Å²	47.9	5%	0.047	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-50	176.1	172	74.2	0	0	0	111	I169 E172 H174 Y231 K237 A238	I169-L234 HydrophobicContact CB-CD2 4.5Å; I169-L234 HydrophobicContact CG2-CD2 3.94Å; E172-L234 HydrophobicContact CB-CD1 4.28Å; H174-L234 WeakPolarHBondContact CE1-CD1 3.44Å; H174-L234 WeakPolarHBondContact ND1-CA 3.24Å; H174-L234 WeakPolarHBondContact ND1-CD1 3.4Å; H174-L234 PolarHBondContact ND1-O 3.04Å; Y231-L234 HydrophobicContact CD1-CD2 4.03Å; Y231-L234 PolarHBondContact O-N 3.44Å; L234-K237 PolarHBondContact O-N 2.93Å; L234-A238 VanDerWaalsContact O-CB 3.32Å; L234-A238 WeakPolarHBondContact O-CB 3.28Å; L234-A238 PolarHBondContact O-N 3.03Å
235	M	89	Confident	88.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-69	-38.5	-176.8	-69.2	-65.9	-163.2	0	0	112.6	I169 V177 L181 F197 Y231 A238 A239 F246 L247	I169-M235 HydrophobicContact CD1-CE 4.37Å; V177-M235 HydrophobicContact CG1-SD 4.17Å; L181-M235 HydrophobicContact CD1-SD 4.31Å; F197-M235 HydrophobicContact CD2-CE 3.93Å; F197-M235 HydrophobicContact CE2-CE 3.62Å; F197-M235 HydrophobicContact CZ-CE 4.3Å; Y231-M235 WeakPolarHBondContact O-CB 3.35Å; Y231-M235 VanDerWaalsContact O-CG 3.31Å; Y231-M235 WeakPolarHBondContact O-CG 3.39Å; Y231-M235 PolarHBondContact O-N 3.11Å; M235-A238 PolarHBondContact O-N 3.45Å; M235-A239 PolarHBondContact O-N 3.36Å; M235-F246 HydrophobicContact CE-CD1 3.7Å; M235-F246 HydrophobicContact CE-CE1 3.62Å; M235-F246 HydrophobicContact SD-CD1 4.2Å; M235-L247 HydrophobicContact CB-CB 4.45Å; M235-L247 HydrophobicContact CB-CD2 4.46Å; M235-L247 HydrophobicContact CG-CB 4.13Å; M235-L247 HydrophobicContact CG-CD2 4.24Å
236	S	87.5	Confident	88.1	Confident	56 Å²	56	47 Å²	47	39%	0.392	26%	0.263	S	S	.	.	H	α-helix	trans	-65.6	-39.3	175.9	-178.3	0	0	0	0	112.1	S232 K240	S232-S236 WeakPolarHBondContact O-CB 3.25Å; S232-S236 PolarHBondContact O-N 3.31Å; S236-K240 WeakPolarHBondContact O-CA 3.45Å; S236-K240 PolarHBondContact O-N 2.92Å
237	K	87.9	Confident	88.1	Confident	141 Å²	141	44.9 Å²	44.9	61%	0.613	25%	0.246	S	C	*	.	H	α-helix	trans	-68.6	-39.3	173.4	-73.8	172.3	-179.6	174.5	0	112.5	H174 S233 L234	H174-K237 HydrophobicContact CB-CB 4.19Å; H174-K237 WeakPolarHBondContact NE2-CD 3.44Å; S233-K237 WeakPolarHBondContact O-CG 3.26Å; S233-K237 PolarHBondContact O-N 3.11Å; S233-K237 VanDerWaalsContact O-N 3.15Å; L234-K237 PolarHBondContact O-N 2.93Å
238	A	85.1	Confident	88.1	Confident	20 Å²	20	44.8 Å²	44.8	17%	0.165	25%	0.245	C	C	.	.	H	α-helix	trans	-67.3	-46.1	-176.2	0	0	0	0	0	112.9	H174 V177 G178 L234 M235	H174-A238 HydrophobicContact CB-CB 4.45Å; H174-A238 VanDerWaalsContact O-CA 3.3Å; H174-A238 WeakPolarHBondContact O-CA 3.3Å; H174-A238 WeakPolarHBondContact O-CB 3.21Å; V177-A238 HydrophobicContact CB-CB 4.12Å; V177-A238 HydrophobicContact CG1-CB 3.9Å; G178-A238 WeakPolarHBondContact CA-O 3.36Å; L234-A238 VanDerWaalsContact O-CB 3.32Å; L234-A238 WeakPolarHBondContact O-CB 3.28Å; L234-A238 PolarHBondContact O-N 3.03Å; M235-A238 PolarHBondContact O-N 3.45Å
239	A	82.2	Confident	88	Confident	21 Å²	21	45.1 Å²	45.1	17%	0.174	25%	0.247	C	C	.	.	H	α-helix	trans	-143.2	22.1	-172.7	0	0	0	0	0	114.2	L181 M235 S241 S242 G243	L181-A239 HydrophobicContact CD1-CB 4.27Å; M235-A239 PolarHBondContact O-N 3.36Å; A239-S241 PolarHBondContact O-N 2.97Å; A239-S242 WeakPolarHBondContact CB-OG 3.4Å; A239-S242 PolarHBondContact O-N 3.32Å; A239-S242 PolarHBondContact O-OG 3.43Å; A239-G243 PolarHBondContact O-N 3.18Å
240	K	83.2	Confident	88.2	Confident	167 Å²	167	39.2 Å²	39.2	73%	0.726	22%	0.219	S	C	*	.	H	α-helix	trans	51.8	-125.3	179.2	-57.7	-179.6	-178.8	179.1	0	111.3	S236 G243 V244	S236-K240 WeakPolarHBondContact O-CA 3.45Å; S236-K240 PolarHBondContact O-N 2.92Å; K240-G243 PolarHBondContact O-N 2.98Å; K240-V244 PolarHBondContact O-N 3.07Å
241	S	81.1	Confident	88.3	Confident	70 Å²	70	35.1 Å²	35.1	49%	0.49	20%	0.2	S	C	.	.	H	α-helix	trans	-64.4	-40.4	-178.3	55.5	0	0	0	0	112.8	A239 G243 V244 T245	A239-S241 PolarHBondContact O-N 2.97Å; S241-G243 VanDerWaalsContact C-N 3.29Å; S241-G243 PolarHBondContact O-N 2.96Å; S241-V244 PolarHBondContact O-N 3.36Å; S241-V244 VanDerWaalsContact O-N 3.16Å; S241-T245 PolarHBondContact O-N 2.83Å; S241-T245 PolarHBondContact O-OG1 3.39Å; S241-T245 VanDerWaalsContact O-OG1 3.11Å
242	S	83.6	Confident	88.5	Confident	68 Å²	68	33.6 Å²	33.6	48%	0.476	19%	0.194	S	C	.	.	H	α-helix	trans	-69	-29.7	-177.5	63.4	0	0	0	0	112.5	A239 F246	A239-S242 WeakPolarHBondContact CB-OG 3.4Å; A239-S242 PolarHBondContact O-N 3.32Å; A239-S242 PolarHBondContact O-OG 3.43Å; S242-F246 WeakPolarHBondContact O-CB 3.48Å; S242-F246 PolarHBondContact O-N 3.44Å
243	G	86.3	Confident	88.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.5	-40	172.3	0	0	0	0	0	112.4	A239 K240 S241 F246 L247	A239-G243 PolarHBondContact O-N 3.18Å; K240-G243 PolarHBondContact O-N 2.98Å; S241-G243 VanDerWaalsContact C-N 3.29Å; S241-G243 PolarHBondContact O-N 2.96Å; G243-F246 PolarHBondContact O-N 3.38Å; G243-L247 PolarHBondContact O-N 2.94Å
244	V	87.3	Confident	89	Confident	18 Å²	18	31.5 Å²	31.5	11%	0.109	18%	0.175	C	C	.	.	H	α-helix	trans	-66.7	-41.9	175	178.8	0	0	0	0	110.8	K240 S241 L247 T248 C293	K240-V244 PolarHBondContact O-N 3.07Å; S241-V244 PolarHBondContact O-N 3.36Å; S241-V244 VanDerWaalsContact O-N 3.16Å; V244-L247 PolarHBondContact O-N 3.45Å; V244-T248 WeakPolarHBondContact O-CB 3.22Å; V244-T248 PolarHBondContact O-N 2.95Å; V244-T248 PolarHBondContact O-OG1 2.96Å; V244-C293 HydrophobicContact CG1-CB 4.49Å
245	T	88.6	Confident	89.2	Confident	11 Å²	11	31.1 Å²	31.1	7%	0.067	17%	0.173	C	C	.	.	H	α-helix	trans	-58.9	-49.2	173.2	-53.6	0	0	0	0	111	S241 L247 T248 D249 E297	S241-T245 PolarHBondContact O-N 2.83Å; S241-T245 PolarHBondContact O-OG1 3.39Å; S241-T245 VanDerWaalsContact O-OG1 3.11Å; T245-L247 PolarHBondContact O-N 3.41Å; T245-T248 PolarHBondContact O-N 2.92Å; T245-T248 VanDerWaalsContact O-N 3.15Å; T245-D249 WeakPolarHBondContact O-CB 3.47Å; T245-D249 PolarHBondContact O-N 3.13Å; T245-E297 HydrophobicContact CG2-CB 3.91Å; T245-E297 VanDerWaalsContact CG2-CD 3.47Å; T245-E297 HydrophobicContact CG2-CG 3.95Å; T245-E297 PolarHBondContact OG1-OE1 3.2Å
246	F	91.1	Very high	89.3	Confident	11 Å²	11	31.6 Å²	31.6	5%	0.048	18%	0.175	C	C	.	.	H	α-helix	trans	-55.2	-48.3	177.2	172.7	-91.7	0	0	0	112.2	F165 L181 L193 H194 F197 M235 S242 G243 T248 D249 C250	F165-F246 HydrophobicContact CE1-CZ 4.36Å; F165-F246 HydrophobicContact CZ-CE1 4.02Å; F165-F246 AromaticContact CZ-CZ 3.96Å; F165-F246 HydrophobicContact CZ-CZ 3.96Å; L181-F246 HydrophobicContact CD2-CD1 3.93Å; L181-F246 HydrophobicContact CD2-CD2 3.63Å; L181-F246 HydrophobicContact CD2-CE1 4.02Å; L181-F246 HydrophobicContact CD2-CE2 3.71Å; L181-F246 HydrophobicContact CD2-CG 3.74Å; L181-F246 HydrophobicContact CD2-CZ 3.92Å; L193-F246 HydrophobicContact CB-CE2 3.78Å; L193-F246 HydrophobicContact CB-CZ 3.86Å; H194-F246 AromaticContact CD2-CD2 3.36Å; H194-F246 WeakPolarHBondContact CD2-CD2 3.44Å; H194-F246 AromaticContact CD2-CE2 3.15Å; H194-F246 WeakPolarHBondContact CD2-CE2 3.34Å; H194-F246 AromaticContact CD2-CZ 3.94Å; H194-F246 AromaticContact CG-CE2 3.95Å; H194-F246 AromaticContact NE2-CD2 3.24Å; H194-F246 WeakPolarHBondContact NE2-CD2 3.44Å; H194-F246 AromaticContact NE2-CE2 3.52Å; F197-F246 HydrophobicContact CB-CE1 4.42Å; F197-F246 HydrophobicContact CB-CZ 4.34Å; F197-F246 HydrophobicContact CD2-CE1 4.44Å; F197-F246 HydrophobicContact CG-CE1 4.38Å; M235-F246 HydrophobicContact CE-CD1 3.7Å; M235-F246 HydrophobicContact CE-CE1 3.62Å; M235-F246 HydrophobicContact SD-CD1 4.2Å; S242-F246 WeakPolarHBondContact O-CB 3.48Å; S242-F246 PolarHBondContact O-N 3.44Å; G243-F246 PolarHBondContact O-N 3.38Å; F246-T248 VanDerWaalsContact C-N 3.33Å; F246-T248 PolarHBondContact O-N 3.29Å; F246-D249 PolarHBondContact O-N 2.93Å; F246-C250 WeakPolarHBondContact O-CB 3.44Å; F246-C250 PolarHBondContact O-N 3.46Å; F246-C250 PolarHBondContact O-SG 3.47Å
247	L	92.1	Very high	89.4	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.7	-45.1	177.6	179.1	59.6	0	0	0	111.4	F197 M235 G243 V244 T245 C250 L251	F197-L247 HydrophobicContact CE1-CD1 3.74Å; F197-L247 HydrophobicContact CZ-CD1 3.62Å; M235-L247 HydrophobicContact CB-CB 4.45Å; M235-L247 HydrophobicContact CB-CD2 4.46Å; M235-L247 HydrophobicContact CG-CB 4.13Å; M235-L247 HydrophobicContact CG-CD2 4.24Å; G243-L247 PolarHBondContact O-N 2.94Å; V244-L247 PolarHBondContact O-N 3.45Å; T245-L247 PolarHBondContact O-N 3.41Å; L247-C250 WeakPolarHBondContact O-CB 3.23Å; L247-C250 PolarHBondContact O-N 2.88Å; L247-L251 HydrophobicContact CD1-CD1 4.28Å; L247-L251 HydrophobicContact CD1-CG 4.38Å; L247-L251 HydrophobicContact CG-CD1 4.19Å; L247-L251 VanDerWaalsContact O-CG 3.25Å; L247-L251 WeakPolarHBondContact O-CG 3.49Å; L247-L251 PolarHBondContact O-N 3.47Å
248	T	91.7	Very high	89.4	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.006	14%	0.141	C	C	.	.	H	α-helix	trans	-64	-43.8	-178.7	-55.7	0	0	0	0	111.3	V244 T245 F246 L251 L252 L289 C293 T300	V244-T248 WeakPolarHBondContact O-CB 3.22Å; V244-T248 PolarHBondContact O-N 2.95Å; V244-T248 PolarHBondContact O-OG1 2.96Å; T245-T248 PolarHBondContact O-N 2.92Å; T245-T248 VanDerWaalsContact O-N 3.15Å; F246-T248 VanDerWaalsContact C-N 3.33Å; F246-T248 PolarHBondContact O-N 3.29Å; T248-L251 PolarHBondContact O-N 2.75Å; T248-L252 HydrophobicContact CG2-CD1 4.16Å; T248-L252 WeakPolarHBondContact O-CG 3.33Å; T248-L252 PolarHBondContact O-N 3.38Å; T248-L289 HydrophobicContact CG2-CD1 4.08Å; T248-L289 HydrophobicContact CG2-CD2 3.74Å; T248-L289 HydrophobicContact CG2-CG 3.94Å; T248-C293 PolarHBondContact OG1-SG 2.99Å; T248-T300 HydrophobicContact CG2-CG2 3.54Å
249	D	92.1	Very high	89.5	Confident	11 Å²	11	22.8 Å²	22.8	6%	0.059	13%	0.133	C	C	.	.	H	α-helix	trans	-65.6	-41.9	178.1	-74.5	-8.3	0	0	0	111	T245 F246 L251 L252 M253 S299 T300 L303	T245-D249 WeakPolarHBondContact O-CB 3.47Å; T245-D249 PolarHBondContact O-N 3.13Å; F246-D249 PolarHBondContact O-N 2.93Å; D249-L251 PolarHBondContact O-N 3.3Å; D249-L252 PolarHBondContact O-N 2.98Å; D249-M253 VanDerWaalsContact C-CE 3.4Å; D249-M253 HydrophobicContact CB-CE 3.85Å; D249-M253 VanDerWaalsContact O-CB 3.28Å; D249-M253 WeakPolarHBondContact O-CB 3.46Å; D249-M253 VanDerWaalsContact O-CE 3.26Å; D249-M253 WeakPolarHBondContact O-CE 3.38Å; D249-M253 VanDerWaalsContact O-CG 3.3Å; D249-M253 WeakPolarHBondContact O-CG 3.39Å; D249-M253 PolarHBondContact O-N 3.49Å; D249-S299 WeakPolarHBondContact OD2-CB 3.34Å; D249-S299 PolarHBondContact OD2-OG 2.92Å; D249-T300 WeakPolarHBondContact OD1-CA 3.44Å; D249-T300 WeakPolarHBondContact OD1-CB 3.44Å; D249-T300 PolarHBondContact OD1-N 3.44Å; D249-T300 VanDerWaalsContact OD1-N 3.17Å; D249-T300 PolarHBondContact OD1-OG1 3.29Å; D249-L303 HydrophobicContact CB-CD1 3.97Å
250	C	94.1	Very high	89.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-52.4	-51.1	170.4	-86.4	0	0	0	0	112.4	H194 F197 I198 F246 L247 M253 A254	H194-C250 VanDerWaalsContact CD2-SG 3.52Å; F197-C250 HydrophobicContact CD1-CB 3.8Å; F197-C250 HydrophobicContact CE1-CB 4.3Å; I198-C250 WeakPolarHBondContact CD1-O 3.45Å; I198-C250 HydrophobicContact CG1-CB 4.21Å; I198-C250 WeakPolarHBondContact CG1-O 3.28Å; F246-C250 WeakPolarHBondContact O-CB 3.44Å; F246-C250 PolarHBondContact O-N 3.46Å; F246-C250 PolarHBondContact O-SG 3.47Å; L247-C250 WeakPolarHBondContact O-CB 3.23Å; L247-C250 PolarHBondContact O-N 2.88Å; C250-M253 PolarHBondContact O-N 2.88Å; C250-A254 WeakPolarHBondContact O-CB 3.32Å; C250-A254 PolarHBondContact O-N 3.39Å
251	L	94.7	Very high	89.9	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-66.3	-40.1	-176.8	-65.4	171.6	0	0	0	111.7	V202 L224 V227 H228 L247 T248 D249 L255	V202-L251 HydrophobicContact CG1-CD2 4.37Å; V202-L251 HydrophobicContact CG2-CD2 4.11Å; L224-L251 HydrophobicContact CD2-CB 4.27Å; L224-L251 HydrophobicContact CD2-CD2 3.73Å; V227-L251 HydrophobicContact CB-CD2 4.02Å; V227-L251 HydrophobicContact CG1-CD2 3.72Å; H228-L251 HydrophobicContact CB-CD1 3.62Å; L247-L251 HydrophobicContact CD1-CD1 4.28Å; L247-L251 HydrophobicContact CD1-CG 4.38Å; L247-L251 HydrophobicContact CG-CD1 4.19Å; L247-L251 VanDerWaalsContact O-CG 3.25Å; L247-L251 WeakPolarHBondContact O-CG 3.49Å; L247-L251 PolarHBondContact O-N 3.47Å; T248-L251 PolarHBondContact O-N 2.75Å; D249-L251 PolarHBondContact O-N 3.3Å; L251-L255 WeakPolarHBondContact O-CB 3.46Å; L251-L255 PolarHBondContact O-N 3.49Å
252	L	94.1	Very high	90	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-72.3	-37	177.2	-68.1	174.8	0	0	0	112.4	T248 D249 L255 V256 F285 L289 T300 L303 L304	T248-L252 HydrophobicContact CG2-CD1 4.16Å; T248-L252 WeakPolarHBondContact O-CG 3.33Å; T248-L252 PolarHBondContact O-N 3.38Å; D249-L252 PolarHBondContact O-N 2.98Å; L252-L255 HydrophobicContact CD2-CD2 4.37Å; L252-L255 WeakPolarHBondContact O-CB 3.39Å; L252-L255 PolarHBondContact O-N 3.16Å; L252-V256 VanDerWaalsContact O-CG2 3.3Å; L252-V256 WeakPolarHBondContact O-CG2 3.21Å; L252-V256 PolarHBondContact O-N 2.89Å; L252-F285 HydrophobicContact CD2-CE1 3.9Å; L252-F285 HydrophobicContact CD2-CZ 4.26Å; L252-L289 HydrophobicContact CD1-CD2 4.14Å; L252-L289 HydrophobicContact CD2-CD2 3.85Å; L252-L289 HydrophobicContact CG-CD2 4.08Å; L252-T300 HydrophobicContact CD1-CG2 3.65Å; L252-L303 HydrophobicContact CB-CB 3.73Å; L252-L303 HydrophobicContact CB-CD1 3.92Å; L252-L303 HydrophobicContact CB-CG 4.38Å; L252-L303 HydrophobicContact CD1-CB 3.87Å; L252-L303 HydrophobicContact CG-CB 4.44Å; L252-L304 HydrophobicContact CD1-CD2 4.19Å; L252-L304 HydrophobicContact CD1-CG 3.87Å; L252-L304 HydrophobicContact CD2-CD2 3.74Å; L252-L304 HydrophobicContact CD2-CG 4.31Å
253	M	94.6	Very high	90	Very high	53 Å²	53	25.8 Å²	25.8	26%	0.261	12%	0.123	S	C	.	.	H	α-helix	trans	-62.2	-45	171.8	-80	-175	-86.8	0	0	111.2	H194 I198 D249 C250 L255 V256 G257 L303	H194-M253 HydrophobicContact CB-CE 3.71Å; H194-M253 HydrophobicContact CB-SD 4.32Å; H194-M253 VanDerWaalsContact CD2-CE 3.49Å; H194-M253 WeakPolarHBondContact CD2-CE 3.3Å; I198-M253 HydrophobicContact CD1-CB 3.77Å; D249-M253 VanDerWaalsContact C-CE 3.4Å; D249-M253 HydrophobicContact CB-CE 3.85Å; D249-M253 VanDerWaalsContact O-CB 3.28Å; D249-M253 WeakPolarHBondContact O-CB 3.46Å; D249-M253 VanDerWaalsContact O-CE 3.26Å; D249-M253 WeakPolarHBondContact O-CE 3.38Å; D249-M253 VanDerWaalsContact O-CG 3.3Å; D249-M253 WeakPolarHBondContact O-CG 3.39Å; D249-M253 PolarHBondContact O-N 3.49Å; C250-M253 PolarHBondContact O-N 2.88Å; M253-L255 VanDerWaalsContact C-N 3.35Å; M253-L255 PolarHBondContact O-N 3.48Å; M253-V256 PolarHBondContact O-N 2.8Å; M253-G257 PolarHBondContact O-N 3.05Å; M253-L303 HydrophobicContact CG-CD1 3.93Å; M253-L303 HydrophobicContact CG-CD2 3.82Å
254	A	93	Very high	89.8	Confident	4 Å²	4	32.9 Å²	32.9	3%	0.033	15%	0.154	C	C	.	.	H	α-helix	trans	-58.9	-46.5	173.1	0	0	0	0	0	110.9	I198 V202 L206 C250 V256 G257 F258	I198-A254 HydrophobicContact CD1-CB 4.44Å; I198-A254 HydrophobicContact CG1-CB 4.21Å; I198-A254 HydrophobicContact CG2-CB 3.89Å; V202-A254 HydrophobicContact CB-CB 4.41Å; V202-A254 HydrophobicContact CG1-CB 3.65Å; L206-A254 HydrophobicContact CD1-CB 4.34Å; C250-A254 WeakPolarHBondContact O-CB 3.32Å; C250-A254 PolarHBondContact O-N 3.39Å; A254-V256 PolarHBondContact O-N 3.31Å; A254-G257 PolarHBondContact O-N 3.49Å; A254-F258 WeakPolarHBondContact O-CB 3.33Å; A254-F258 PolarHBondContact O-N 2.85Å
255	L	93	Very high	89.5	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-57.7	-47.5	176.3	-178.9	61.4	0	0	0	112	F217 V220 L221 L224 L251 L252 M253 F258 T259 F282 F285 T307	F217-L255 HydrophobicContact CE2-CD1 4.16Å; V220-L255 HydrophobicContact CG1-CD1 4Å; L221-L255 HydrophobicContact CD2-CD1 3.78Å; L221-L255 HydrophobicContact CD2-CD2 3.85Å; L224-L255 HydrophobicContact CD1-CB 3.78Å; L224-L255 HydrophobicContact CD1-CD1 3.89Å; L224-L255 HydrophobicContact CD1-CD2 4.38Å; L224-L255 HydrophobicContact CD1-CG 4.22Å; L251-L255 WeakPolarHBondContact O-CB 3.46Å; L251-L255 PolarHBondContact O-N 3.49Å; L252-L255 HydrophobicContact CD2-CD2 4.37Å; L252-L255 WeakPolarHBondContact O-CB 3.39Å; L252-L255 PolarHBondContact O-N 3.16Å; M253-L255 VanDerWaalsContact C-N 3.35Å; M253-L255 PolarHBondContact O-N 3.48Å; L255-F258 PolarHBondContact O-N 3.09Å; L255-T259 HydrophobicContact CD1-CG2 3.79Å; L255-T259 HydrophobicContact CG-CG2 4.3Å; L255-T259 VanDerWaalsContact O-CB 3.26Å; L255-T259 WeakPolarHBondContact O-CB 3.33Å; L255-T259 WeakPolarHBondContact O-CG2 3.37Å; L255-T259 PolarHBondContact O-N 2.85Å; L255-T259 PolarHBondContact O-OG1 3.33Å; L255-F282 HydrophobicContact CD2-CE2 4.26Å; L255-F285 HydrophobicContact CD2-CE1 3.99Å; L255-F285 HydrophobicContact CD2-CZ 4.47Å; L255-T307 HydrophobicContact CD2-CG2 4.01Å; L255-T307 HydrophobicContact CG-CG2 4.31Å
256	V	91.4	Very high	89	Confident	10 Å²	10	36.1 Å²	36.1	6%	0.061	18%	0.177	C	C	.	.	H	α-helix	trans	-62.1	-49.7	179.8	172.7	0	0	0	0	110.9	L252 M253 A254 F258 T259 E260 M306 T307 K310	L252-V256 VanDerWaalsContact O-CG2 3.3Å; L252-V256 WeakPolarHBondContact O-CG2 3.21Å; L252-V256 PolarHBondContact O-N 2.89Å; M253-V256 PolarHBondContact O-N 2.8Å; A254-V256 PolarHBondContact O-N 3.31Å; V256-F258 PolarHBondContact O-N 2.98Å; V256-T259 WeakPolarHBondContact CA-OG1 3.49Å; V256-T259 PolarHBondContact O-OG1 2.94Å; V256-E260 WeakPolarHBondContact CG1-OE1 3.12Å; V256-E260 WeakPolarHBondContact O-CB 3.47Å; V256-E260 PolarHBondContact O-N 3.23Å; V256-E260 VanDerWaalsContact O-N 3.09Å; V256-M306 HydrophobicContact CB-CE 4.4Å; V256-M306 HydrophobicContact CG1-CE 3.82Å; V256-M306 HydrophobicContact CG1-CG 4.36Å; V256-M306 HydrophobicContact CG2-CE 4.09Å; V256-M306 HydrophobicContact CG2-CG 4.5Å; V256-T307 WeakPolarHBondContact CG2-OG1 3.21Å; V256-K310 PolarHBondContact O-NZ 3.49Å
257	G	89.6	Confident	88.6	Confident	24 Å²	24	36.4 Å²	36.4	25%	0.247	18%	0.178	C	C	.	.	H	α-helix	trans	-64.8	-40.4	179.5	0	0	0	0	0	112.7	M253 A254 E260 R261	M253-G257 PolarHBondContact O-N 3.05Å; A254-G257 PolarHBondContact O-N 3.49Å; G257-E260 PolarHBondContact O-N 2.81Å; G257-R261 WeakPolarHBondContact O-CG 3.26Å; G257-R261 PolarHBondContact O-N 3.4Å; G257-R261 VanDerWaalsContact O-N 3.17Å
258	F	88.8	Confident	88.1	Confident	9 Å²	9	39.4 Å²	39.4	4%	0.039	20%	0.197	C	C	.	.	H	α-helix	trans	-68.6	-43	179.9	-163.3	-95	0	0	0	112.1	L206 L210 V220 A254 L255 V256 E260 R261 H262 L263	L206-F258 HydrophobicContact CB-CD2 3.97Å; L206-F258 HydrophobicContact CB-CE2 3.56Å; L206-F258 HydrophobicContact CB-CZ 3.88Å; L206-F258 HydrophobicContact CD1-CB 4.22Å; L206-F258 HydrophobicContact CD1-CD2 3.86Å; L206-F258 HydrophobicContact CD1-CE2 4.32Å; L206-F258 HydrophobicContact CD1-CG 4.01Å; L210-F258 HydrophobicContact CD1-CE1 4.19Å; L210-F258 HydrophobicContact CD1-CE2 3.95Å; L210-F258 HydrophobicContact CD1-CZ 3.34Å; L210-F258 HydrophobicContact CD2-CE1 4.26Å; L210-F258 HydrophobicContact CD2-CZ 4.14Å; L210-F258 HydrophobicContact CG-CE1 4.2Å; L210-F258 HydrophobicContact CG-CZ 3.59Å; V220-F258 HydrophobicContact CG1-CD1 4.29Å; V220-F258 HydrophobicContact CG2-CD1 4.01Å; V220-F258 HydrophobicContact CG2-CE1 3.52Å; V220-F258 HydrophobicContact CG2-CZ 4.32Å; A254-F258 WeakPolarHBondContact O-CB 3.33Å; A254-F258 PolarHBondContact O-N 2.85Å; L255-F258 PolarHBondContact O-N 3.09Å; V256-F258 PolarHBondContact O-N 2.98Å; F258-E260 VanDerWaalsContact C-N 3.33Å; F258-E260 PolarHBondContact O-N 3.44Å; F258-R261 PolarHBondContact O-N 2.7Å; F258-H262 AromaticContact CD2-CD2 3.9Å; F258-H262 HydrophobicContact CE1-CB 4.4Å; F258-H262 AromaticContact CE2-CD2 3.8Å; F258-H262 PolarHBondContact O-N 2.89Å; F258-L263 HydrophobicContact CD1-CD1 3.98Å; F258-L263 HydrophobicContact CD1-CG 4.34Å; F258-L263 HydrophobicContact CE1-CD1 4.17Å; F258-L263 HydrophobicContact CE1-CG 4.42Å
259	T	86.7	Confident	87.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-39	177	50.3	0	0	0	0	112.3	F217 L255 V256 R261 L263 K264 F267 K310	F217-T259 HydrophobicContact CD2-CG2 4.03Å; F217-T259 HydrophobicContact CE2-CG2 3.65Å; L255-T259 HydrophobicContact CD1-CG2 3.79Å; L255-T259 HydrophobicContact CG-CG2 4.3Å; L255-T259 VanDerWaalsContact O-CB 3.26Å; L255-T259 WeakPolarHBondContact O-CB 3.33Å; L255-T259 WeakPolarHBondContact O-CG2 3.37Å; L255-T259 PolarHBondContact O-N 2.85Å; L255-T259 PolarHBondContact O-OG1 3.33Å; V256-T259 WeakPolarHBondContact CA-OG1 3.49Å; V256-T259 PolarHBondContact O-OG1 2.94Å; T259-R261 VanDerWaalsContact C-N 3.34Å; T259-R261 PolarHBondContact O-N 3.21Å; T259-L263 HydrophobicContact CG2-CD1 4.21Å; T259-L263 CarbonylContact O-C 3.53Å; T259-L263 PolarHBondContact O-N 2.76Å; T259-L263 VanDerWaalsContact O-N 3.15Å; T259-K264 PolarHBondContact O-N 3.17Å; T259-F267 HydrophobicContact CG2-CE2 3.99Å; T259-F267 HydrophobicContact CG2-CZ 3.69Å; T259-K310 PolarHBondContact OG1-NZ 3.49Å
260	E	86.9	Confident	86.4	Confident	95 Å²	95	45.2 Å²	45.2	44%	0.444	23%	0.233	S	C	.	.	H	α-helix	trans	-64.8	-33.4	174.2	-101	152.7	-125.3	0	0	113.7	V256 G257 F258 K264 K310	V256-E260 WeakPolarHBondContact CG1-OE1 3.12Å; V256-E260 WeakPolarHBondContact O-CB 3.47Å; V256-E260 PolarHBondContact O-N 3.23Å; V256-E260 VanDerWaalsContact O-N 3.09Å; G257-E260 PolarHBondContact O-N 2.81Å; F258-E260 VanDerWaalsContact C-N 3.33Å; F258-E260 PolarHBondContact O-N 3.44Å; E260-K264 WeakPolarHBondContact O-CE 3.33Å; E260-K264 WeakPolarHBondContact O-CG 3.07Å; E260-K310 VanDerWaalsContact CG-NZ 3.32Å; E260-K310 WeakPolarHBondContact OE1-CE 3.07Å; E260-K310 IonicContact OE1-NZ 2.79Å; E260-K310 PolarHBondContact OE1-NZ 3.43Å
261	R	86.4	Confident	85.4	Confident	193 Å²	193	48.7 Å²	48.7	73%	0.728	25%	0.252	S	S	*	.	H	α-helix	trans	-86.6	-44.3	-177.1	-69.9	177.2	-169.9	172.8	3.8	113	G257 F258 T259	G257-R261 WeakPolarHBondContact O-CG 3.26Å; G257-R261 PolarHBondContact O-N 3.4Å; G257-R261 VanDerWaalsContact O-N 3.17Å; F258-R261 PolarHBondContact O-N 2.7Å; T259-R261 VanDerWaalsContact C-N 3.34Å; T259-R261 PolarHBondContact O-N 3.21Å
262	H	84.2	Confident	84.3	Confident	97 Å²	97	50.3 Å²	50.3	45%	0.449	26%	0.262	S	S	.	.	H	α-helix	trans	-116.3	-22.6	-165.8	-59	-66.3	0	0	0	114.3	L210 F258	L210-H262 HydrophobicContact CD1-CB 4.42Å; F258-H262 AromaticContact CD2-CD2 3.9Å; F258-H262 HydrophobicContact CE1-CB 4.4Å; F258-H262 AromaticContact CE2-CD2 3.8Å; F258-H262 PolarHBondContact O-N 2.89Å
263	L	83.4	Confident	83.3	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.016	28%	0.282	C	S	.	.			trans	-119.7	20.6	-167.7	-50.9	177.4	0	0	0	114	H216 F217 V220 F258 T259 S265 S266 F267	H216-L263 HydrophobicContact CB-CD2 3.46Å; H216-L263 VanDerWaalsContact CB-CD2 3.46Å; F217-L263 HydrophobicContact CB-CD1 4.27Å; F217-L263 HydrophobicContact CD2-CD1 3.85Å; V220-L263 HydrophobicContact CG2-CD1 4.3Å; F258-L263 HydrophobicContact CD1-CD1 3.98Å; F258-L263 HydrophobicContact CD1-CG 4.34Å; F258-L263 HydrophobicContact CE1-CD1 4.17Å; F258-L263 HydrophobicContact CE1-CG 4.42Å; T259-L263 HydrophobicContact CG2-CD1 4.21Å; T259-L263 CarbonylContact O-C 3.53Å; T259-L263 PolarHBondContact O-N 2.76Å; T259-L263 VanDerWaalsContact O-N 3.15Å; L263-S265 PolarHBondContact O-N 2.67Å; L263-S265 VanDerWaalsContact O-N 3.13Å; L263-S266 WeakPolarHBondContact O-CB 3.37Å; L263-S266 PolarHBondContact O-N 2.79Å; L263-F267 HydrophobicContact CB-CE2 4.33Å; L263-F267 WeakPolarHBondContact O-CD2 3.37Å; L263-F267 VanDerWaalsContact O-CE2 3.25Å; L263-F267 WeakPolarHBondContact O-CE2 3.28Å
264	K	82	Confident	82.5	Confident	150 Å²	150	53.7 Å²	53.7	65%	0.652	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-53.8	-35.6	177.9	-66	-167.8	-173.5	-174.5	0	112.5	T259 E260 S266 F267	T259-K264 PolarHBondContact O-N 3.17Å; E260-K264 WeakPolarHBondContact O-CE 3.33Å; E260-K264 WeakPolarHBondContact O-CG 3.07Å; K264-S266 VanDerWaalsContact C-N 3.32Å; K264-S266 PolarHBondContact O-N 3.32Å; K264-F267 PolarHBondContact O-N 2.99Å
265	S	81.3	Confident	81.9	Confident	86 Å²	86	53.6 Å²	53.6	60%	0.601	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-67	-27.7	179.1	55.1	0	0	0	0	113.7	L263 F267 V268	L263-S265 PolarHBondContact O-N 2.67Å; L263-S265 VanDerWaalsContact O-N 3.13Å; S265-F267 PolarHBondContact O-N 2.76Å; S265-V268 PolarHBondContact O-N 3.08Å
266	S	78.2	Confident	81	Confident	10 Å²	10	55.2 Å²	55.2	7%	0.07	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-67.7	-20	179.1	-55.3	0	0	0	0	113.1	L263 K264	L263-S266 WeakPolarHBondContact O-CB 3.37Å; L263-S266 PolarHBondContact O-N 2.79Å; K264-S266 VanDerWaalsContact C-N 3.32Å; K264-S266 PolarHBondContact O-N 3.32Å
267	F	82.9	Confident	80.4	Confident	17 Å²	17	58.9 Å²	58.9	8%	0.075	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-96.7	-0	179.4	-55.3	-83.4	0	0	0	113.2	F217 T259 L263 K264 S265 P269 F275 K310 F311	F217-F267 HydrophobicContact CD2-CZ 4.13Å; F217-F267 HydrophobicContact CE2-CE1 4.19Å; F217-F267 AromaticContact CE2-CZ 3.68Å; F217-F267 HydrophobicContact CE2-CZ 3.68Å; F217-F267 HydrophobicContact CZ-CE1 4.34Å; F217-F267 HydrophobicContact CZ-CZ 4.28Å; T259-F267 HydrophobicContact CG2-CE2 3.99Å; T259-F267 HydrophobicContact CG2-CZ 3.69Å; L263-F267 HydrophobicContact CB-CE2 4.33Å; L263-F267 WeakPolarHBondContact O-CD2 3.37Å; L263-F267 VanDerWaalsContact O-CE2 3.25Å; L263-F267 WeakPolarHBondContact O-CE2 3.28Å; K264-F267 PolarHBondContact O-N 2.99Å; S265-F267 PolarHBondContact O-N 2.76Å; F267-P269 VanDerWaalsContact O-CD 3.31Å; F267-P269 WeakPolarHBondContact O-CD 3.43Å; F267-F275 WeakPolarHBondContact O-CD2 3.32Å; F267-F275 WeakPolarHBondContact O-CE2 3.45Å; F267-K310 HydrophobicContact CD1-CB 3.77Å; F267-K310 HydrophobicContact CE1-CB 3.99Å; F267-K310 HydrophobicContact CG-CB 4.12Å; F267-K310 HydrophobicContact CZ-CD 4.38Å; F267-F311 AromaticContact CD1-CD1 3.95Å; F267-F311 HydrophobicContact CD1-CD1 3.95Å; F267-F311 HydrophobicContact CD1-CD2 4.2Å; F267-F311 AromaticContact CD1-CE1 3.76Å; F267-F311 HydrophobicContact CD1-CE1 3.76Å; F267-F311 HydrophobicContact CD1-CE2 4.04Å; F267-F311 HydrophobicContact CD1-CG 4.17Å; F267-F311 AromaticContact CD1-CZ 3.82Å; F267-F311 HydrophobicContact CD1-CZ 3.82Å; F267-F311 HydrophobicContact CE1-CD1 4.44Å; F267-F311 HydrophobicContact CE1-CD2 4.17Å; F267-F311 AromaticContact CE1-CE1 3.91Å; F267-F311 HydrophobicContact CE1-CE1 3.91Å; F267-F311 AromaticContact CE1-CE2 3.62Å; F267-F311 HydrophobicContact CE1-CE2 3.62Å; F267-F311 AromaticContact CE1-CZ 3.47Å; F267-F311 HydrophobicContact CE1-CZ 3.47Å; F267-F311 VanDerWaalsContact CE1-CZ 3.47Å
268	V	80.4	Confident	80.1	Confident	64 Å²	64	58 Å²	58	39%	0.388	30%	0.3	S	S	.	.			trans	-77.1	122.5	-178.4	-174.8	0	0	0	0	109.4	S265 T270	S265-V268 PolarHBondContact O-N 3.08Å; V268-T270 HydrophobicContact CG1-CG2 3.85Å; V268-T270 VanDerWaalsContact CG1-OG1 3.23Å; V268-T270 WeakPolarHBondContact CG1-OG1 3.42Å; V268-T270 PolarHBondContact O-N 3.45Å; V268-T270 VanDerWaalsContact O-N 3.12Å
269	P	74.5	Confident	79.9	Confident	19 Å²	19	59.1 Å²	59.1	12%	0.123	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-7.9	-177.6	-24.8	37.1	0	0	0	115.8	F267 N271 F275 V315 L319	F267-P269 VanDerWaalsContact O-CD 3.31Å; F267-P269 WeakPolarHBondContact O-CD 3.43Å; P269-N271 PolarHBondContact O-N 3.32Å; P269-F275 HydrophobicContact CG-CD2 4.34Å; P269-F275 HydrophobicContact CG-CE2 4.14Å; P269-V315 HydrophobicContact CB-CG1 3.98Å; P269-V315 HydrophobicContact CG-CB 4.16Å; P269-V315 HydrophobicContact CG-CG1 3.88Å; P269-L319 HydrophobicContact CB-CD1 3.81Å; P269-L319 WeakPolarHBondContact O-CD1 3.32Å
270	T	73.3	Confident	79.6	Confident	114 Å²	114	62.5 Å²	62.5	70%	0.699	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-18	-175.7	55.7	0	0	0	0	114.2	V268 P272	V268-T270 HydrophobicContact CG1-CG2 3.85Å; V268-T270 VanDerWaalsContact CG1-OG1 3.23Å; V268-T270 WeakPolarHBondContact CG1-OG1 3.42Å; V268-T270 PolarHBondContact O-N 3.45Å; V268-T270 VanDerWaalsContact O-N 3.12Å; T270-P272 WeakPolarHBondContact O-CD 3.44Å
271	N	74.4	Confident	79.6	Confident	73 Å²	73	58.7 Å²	58.7	39%	0.39	30%	0.304	S	S	.	.	S	Bend	trans	-111.4	95.7	169.3	-175	-24.2	0	0	0	108.9	P269 S273 N274 F275	P269-N271 PolarHBondContact O-N 3.32Å; N271-S273 VanDerWaalsContact C-N 3.32Å; N271-S273 PolarHBondContact O-N 2.96Å; N271-S273 PolarHBondContact OD1-N 2.99Å; N271-S273 PolarHBondContact OD1-OG 3.12Å; N271-N274 HydrophobicContact CB-CB 4.09Å; N271-N274 PolarHBondContact O-N 2.88Å; N271-N274 PolarHBondContact OD1-N 2.86Å; N271-F275 WeakPolarHBondContact O-CB 3.39Å; N271-F275 PolarHBondContact O-N 3.48Å
272	P	71.2	Confident	79.7	Confident	36 Å²	36	49.7 Å²	49.7	23%	0.234	27%	0.27	C	S	.	.	H	α-helix	trans	-62.2	-35.8	-171.9	-27.7	35.9	0	0	0	114.5	T270 R276 Y316	T270-P272 WeakPolarHBondContact O-CD 3.44Å; P272-R276 VanDerWaalsContact O-CB 3.26Å; P272-R276 WeakPolarHBondContact O-CB 3.32Å; P272-R276 PolarHBondContact O-N 3.5Å; P272-R276 VanDerWaalsContact O-N 3.16Å; P272-Y316 HydrophobicContact CB-CE2 3.76Å; P272-Y316 VanDerWaalsContact O-CE2 3.31Å; P272-Y316 WeakPolarHBondContact O-CE2 3.5Å
273	S	73.7	Confident	79.8	Confident	58 Å²	58	47.6 Å²	47.6	41%	0.406	26%	0.262	S	S	.	.	H	α-helix	trans	-70.2	-46.5	-179.9	55.5	0	0	0	0	111	N271 R276 D277	N271-S273 VanDerWaalsContact C-N 3.32Å; N271-S273 PolarHBondContact O-N 2.96Å; N271-S273 PolarHBondContact OD1-N 2.99Å; N271-S273 PolarHBondContact OD1-OG 3.12Å; S273-R276 PolarHBondContact O-N 2.9Å; S273-D277 VanDerWaalsContact O-CG 3.26Å; S273-D277 PolarHBondContact O-N 2.95Å
274	N	77.4	Confident	80	Confident	65 Å²	65	53 Å²	53	35%	0.348	29%	0.291	S	S	.	.	H	α-helix	trans	-65.4	-43.8	178.8	-173.2	34.6	0	0	0	112.5	N271 R276 D277 T278	N271-N274 HydrophobicContact CB-CB 4.09Å; N271-N274 PolarHBondContact O-N 2.88Å; N271-N274 PolarHBondContact OD1-N 2.86Å; N274-R276 VanDerWaalsContact C-N 3.29Å; N274-R276 PolarHBondContact O-N 3.34Å; N274-D277 PolarHBondContact O-N 3.29Å; N274-T278 VanDerWaalsContact O-CB 3.24Å; N274-T278 WeakPolarHBondContact O-CB 3.38Å; N274-T278 PolarHBondContact O-N 3.12Å; N274-T278 PolarHBondContact O-OG1 3.04Å
275	F	81.3	Confident	80.4	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.009	26%	0.261	C	S	.	.	H	α-helix	trans	-58.5	-44	177.2	-178.2	-89.2	0	0	0	111	F267 P269 N271 Y279 F311 Y316	F267-F275 WeakPolarHBondContact O-CD2 3.32Å; F267-F275 WeakPolarHBondContact O-CE2 3.45Å; P269-F275 HydrophobicContact CG-CD2 4.34Å; P269-F275 HydrophobicContact CG-CE2 4.14Å; N271-F275 WeakPolarHBondContact O-CB 3.39Å; N271-F275 PolarHBondContact O-N 3.48Å; F275-Y279 VanDerWaalsContact O-CB 3.23Å; F275-Y279 WeakPolarHBondContact O-CB 3.4Å; F275-Y279 PolarHBondContact O-N 3.4Å; F275-F311 HydrophobicContact CE2-CB 4.37Å; F275-F311 AromaticContact CE2-CD1 3.97Å; F275-F311 HydrophobicContact CE2-CD1 3.97Å; F275-F311 HydrophobicContact CZ-CB 3.93Å; F275-F311 AromaticContact CZ-CD1 3.95Å; F275-F311 HydrophobicContact CZ-CD1 3.95Å; F275-F311 HydrophobicContact CZ-CG 4.47Å; F275-Y316 HydrophobicContact CB-CD2 4.11Å; F275-Y316 HydrophobicContact CB-CE2 4.34Å; F275-Y316 HydrophobicContact CD1-CD1 4.09Å; F275-Y316 AromaticContact CD1-CD2 3.32Å; F275-Y316 HydrophobicContact CD1-CD2 3.32Å; F275-Y316 AromaticContact CD1-CE2 3.87Å; F275-Y316 HydrophobicContact CD1-CE2 3.87Å; F275-Y316 AromaticContact CD1-CG 3.44Å; F275-Y316 HydrophobicContact CD1-CG 3.44Å; F275-Y316 VanDerWaalsContact CD1-CG 3.44Å; F275-Y316 VanDerWaalsContact CE1-CB 3.49Å; F275-Y316 HydrophobicContact CE1-CD1 4.05Å; F275-Y316 AromaticContact CE1-CD2 3.96Å; F275-Y316 HydrophobicContact CE1-CD2 3.96Å; F275-Y316 AromaticContact CE1-CG 3.55Å; F275-Y316 HydrophobicContact CE1-CG 3.55Å; F275-Y316 AromaticContact CG-CD2 3.9Å; F275-Y316 HydrophobicContact CG-CD2 3.9Å; F275-Y316 HydrophobicContact CG-CE2 4.48Å; F275-Y316 HydrophobicContact CG-CG 4.33Å
276	R	73.3	Confident	80.8	Confident	34 Å²	34	42.8 Å²	42.8	13%	0.128	24%	0.239	C	C	.	.	H	α-helix	trans	-63.5	-49.2	178.4	177.6	-177	65	-150.1	9.9	112.6	P272 S273 N274 T278 Y279 K280 T368 D369	P272-R276 VanDerWaalsContact O-CB 3.26Å; P272-R276 WeakPolarHBondContact O-CB 3.32Å; P272-R276 PolarHBondContact O-N 3.5Å; P272-R276 VanDerWaalsContact O-N 3.16Å; S273-R276 PolarHBondContact O-N 2.9Å; N274-R276 VanDerWaalsContact C-N 3.29Å; N274-R276 PolarHBondContact O-N 3.34Å; R276-T278 VanDerWaalsContact C-N 3.27Å; R276-T278 PolarHBondContact O-N 3.38Å; R276-Y279 PolarHBondContact O-N 2.81Å; R276-K280 HydrophobicContact CG-CD 4.23Å; R276-K280 WeakPolarHBondContact O-CB 3.33Å; R276-K280 WeakPolarHBondContact O-CG 3.41Å; R276-K280 PolarHBondContact O-N 3.49Å; R276-T368 PolarHBondContact NE-O 3.41Å; R276-T368 PolarHBondContact NH1-O 3.25Å; R276-T368 PolarHBondContact NH2-O 3.12Å; R276-D369 IonicContact CZ-OD1 2.74Å; R276-D369 IonicContact NH1-OD1 3.57Å; R276-D369 PolarHBondContact NH1-OD1 2.88Å; R276-D369 IonicContact NH2-OD1 2.57Å
277	D	78.5	Confident	81.2	Confident	87 Å²	87	45.4 Å²	45.4	47%	0.465	26%	0.261	S	S	.	.	H	α-helix	trans	-65.5	-37.8	-176.7	-66.9	-15	0	0	0	110.7	S273 N274 A281	S273-D277 VanDerWaalsContact O-CG 3.26Å; S273-D277 PolarHBondContact O-N 2.95Å; N274-D277 PolarHBondContact O-N 3.29Å; D277-A281 VanDerWaalsContact O-CB 3.26Å; D277-A281 WeakPolarHBondContact O-CB 3.44Å; D277-A281 PolarHBondContact O-N 3.45Å
278	T	84	Confident	81.5	Confident	7 Å²	7	46.9 Å²	46.9	4%	0.043	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-46.4	172.2	-59.5	0	0	0	0	111.2	F217 N274 R276 A281 F282 F311	F217-T278 HydrophobicContact CB-CG2 4Å; F217-T278 HydrophobicContact CD1-CG2 3.16Å; F217-T278 HydrophobicContact CD2-CG2 4.33Å; F217-T278 HydrophobicContact CE1-CG2 3.55Å; F217-T278 WeakPolarHBondContact CE1-O 3.47Å; F217-T278 HydrophobicContact CG-CG2 3.58Å; F217-T278 HydrophobicContact CZ-CG2 4.3Å; N274-T278 VanDerWaalsContact O-CB 3.24Å; N274-T278 WeakPolarHBondContact O-CB 3.38Å; N274-T278 PolarHBondContact O-N 3.12Å; N274-T278 PolarHBondContact O-OG1 3.04Å; R276-T278 VanDerWaalsContact C-N 3.27Å; R276-T278 PolarHBondContact O-N 3.38Å; T278-A281 PolarHBondContact O-N 3.26Å; T278-F282 PolarHBondContact O-N 2.77Å; T278-F311 HydrophobicContact CG2-CE1 3.71Å; T278-F311 HydrophobicContact CG2-CZ 3.98Å
279	Y	83.9	Confident	81.9	Confident	31 Å²	31	44 Å²	44	12%	0.122	25%	0.25	C	S	.	.	H	α-helix	trans	-66.2	-43.4	179.9	-180	-113.9	0	0	0	112.9	F275 R276 F282 N283 R308 F311 V313	F275-Y279 VanDerWaalsContact O-CB 3.23Å; F275-Y279 WeakPolarHBondContact O-CB 3.4Å; F275-Y279 PolarHBondContact O-N 3.4Å; R276-Y279 PolarHBondContact O-N 2.81Å; Y279-F282 PolarHBondContact O-N 3.02Å; Y279-N283 WeakPolarHBondContact CE1-ND2 3.49Å; Y279-N283 WeakPolarHBondContact CE2-ND2 3.38Å; Y279-N283 PolarHBondContact O-N 3.41Å; Y279-N283 PolarHBondContact O-ND2 2.86Å; Y279-N283 PolarHBondContact OH-ND2 2.99Å; Y279-R308 PolarHBondContact OH-NH2 3.35Å; Y279-F311 HydrophobicContact CD2-CB 4.09Å; Y279-F311 AromaticContact CD2-CD1 3.72Å; Y279-F311 HydrophobicContact CD2-CD1 3.72Å; Y279-F311 HydrophobicContact CD2-CD2 4.14Å; Y279-F311 HydrophobicContact CD2-CE1 4.12Å; Y279-F311 HydrophobicContact CD2-CE2 4.49Å; Y279-F311 AromaticContact CD2-CG 3.72Å; Y279-F311 HydrophobicContact CD2-CG 3.72Å; Y279-F311 HydrophobicContact CD2-CZ 4.48Å; Y279-F311 HydrophobicContact CE2-CB 4.47Å; Y279-F311 HydrophobicContact CE2-CG 4.43Å; Y279-F311 HydrophobicContact CG-CD1 4.26Å; Y279-V313 HydrophobicContact CE2-CG2 4.29Å
280	K	81.2	Confident	82.5	Confident	72 Å²	72	46 Å²	46	31%	0.313	26%	0.262	S	S	.	.	H	α-helix	trans	-61	-45.1	173.1	-75.7	180	177.2	180	0	111.3	R276 F282 N283 N284 C370	R276-K280 HydrophobicContact CG-CD 4.23Å; R276-K280 WeakPolarHBondContact O-CB 3.33Å; R276-K280 WeakPolarHBondContact O-CG 3.41Å; R276-K280 PolarHBondContact O-N 3.49Å; K280-F282 VanDerWaalsContact C-N 3.3Å; K280-F282 PolarHBondContact O-N 3.43Å; K280-N283 PolarHBondContact O-N 3.14Å; K280-N284 WeakPolarHBondContact O-CB 3.42Å; K280-N284 VanDerWaalsContact O-CG 3.31Å; K280-N284 PolarHBondContact O-N 3.3Å; K280-C370 WeakPolarHBondContact CE-SG 3.42Å; K280-C370 PolarHBondContact NZ-SG 3.2Å
281	A	85.9	Confident	83.2	Confident	14 Å²	14	48.3 Å²	48.3	12%	0.116	26%	0.258	C	S	.	.	H	α-helix	trans	-58.8	-43.1	176.8	0	0	0	0	0	111.5	K218 L221 D277 T278 N284 F285	K218-A281 HydrophobicContact CB-CB 4.22Å; K218-A281 HydrophobicContact CG-CB 4.13Å; L221-A281 VanDerWaalsContact CD1-C 3.47Å; L221-A281 HydrophobicContact CD1-CB 3.95Å; L221-A281 WeakPolarHBondContact CD1-O 3.23Å; D277-A281 VanDerWaalsContact O-CB 3.26Å; D277-A281 WeakPolarHBondContact O-CB 3.44Å; D277-A281 PolarHBondContact O-N 3.45Å; T278-A281 PolarHBondContact O-N 3.26Å; A281-N284 PolarHBondContact O-N 2.93Å; A281-F285 WeakPolarHBondContact O-CB 3.35Å; A281-F285 PolarHBondContact O-N 2.95Å
282	F	89.5	Confident	83.7	Confident	4 Å²	4	48.1 Å²	48.1	2%	0.018	25%	0.252	C	S	.	.	H	α-helix	trans	-62.7	-46.1	176.3	179.3	-106.3	0	0	0	112.9	F217 L221 L255 T278 Y279 K280 N284 F285 A286 L304 T307 R308 F311	F217-F282 HydrophobicContact CE1-CB 3.88Å; F217-F282 HydrophobicContact CZ-CB 4.08Å; F217-F282 HydrophobicContact CZ-CD2 4.16Å; L221-F282 HydrophobicContact CD1-CB 4.47Å; L255-F282 HydrophobicContact CD2-CE2 4.26Å; T278-F282 PolarHBondContact O-N 2.77Å; Y279-F282 PolarHBondContact O-N 3.02Å; K280-F282 VanDerWaalsContact C-N 3.3Å; K280-F282 PolarHBondContact O-N 3.43Å; F282-N284 PolarHBondContact O-N 3.37Å; F282-F285 HydrophobicContact CD2-CD1 4.37Å; F282-F285 HydrophobicContact CE2-CD1 4.44Å; F282-F285 WeakPolarHBondContact O-CB 3.34Å; F282-F285 PolarHBondContact O-N 3.22Å; F282-A286 WeakPolarHBondContact O-CB 3.25Å; F282-A286 PolarHBondContact O-N 3.01Å; F282-L304 HydrophobicContact CZ-CD2 4.29Å; F282-T307 HydrophobicContact CD2-CG2 3.9Å; F282-T307 HydrophobicContact CE2-CG2 3.39Å; F282-T307 HydrophobicContact CZ-CG2 3.93Å; F282-R308 HydrophobicContact CE1-CB 3.94Å; F282-R308 HydrophobicContact CZ-CB 4.4Å; F282-F311 HydrophobicContact CB-CE2 3.89Å; F282-F311 HydrophobicContact CB-CZ 3.79Å; F282-F311 HydrophobicContact CD1-CD2 4.45Å; F282-F311 AromaticContact CD1-CE2 3.84Å; F282-F311 HydrophobicContact CD1-CE2 3.84Å; F282-F311 HydrophobicContact CD2-CE2 4.4Å; F282-F311 AromaticContact CG-CE2 3.76Å; F282-F311 HydrophobicContact CG-CE2 3.76Å; F282-F311 HydrophobicContact CG-CZ 4.19Å
283	N	86.1	Confident	84.3	Confident	54 Å²	54	47.4 Å²	47.4	29%	0.289	25%	0.248	S	C	.	.	H	α-helix	trans	-65.8	-39.5	-179.7	-73	-32.4	0	0	0	112.1	Y279 K280 F285 A286 A287	Y279-N283 WeakPolarHBondContact CE1-ND2 3.49Å; Y279-N283 WeakPolarHBondContact CE2-ND2 3.38Å; Y279-N283 PolarHBondContact O-N 3.41Å; Y279-N283 PolarHBondContact O-ND2 2.86Å; Y279-N283 PolarHBondContact OH-ND2 2.99Å; K280-N283 PolarHBondContact O-N 3.14Å; N283-F285 VanDerWaalsContact C-N 3.35Å; N283-A286 PolarHBondContact O-N 3.16Å; N283-A287 WeakPolarHBondContact O-CB 3.13Å; N283-A287 PolarHBondContact O-N 3.47Å
284	N	86.8	Confident	84.4	Confident	116 Å²	116	48.1 Å²	48.1	62%	0.62	26%	0.264	S	S	*	.	H	α-helix	trans	-63.5	-43.1	174.6	-70.4	-10.3	0	0	0	111.2	K280 A281 F282 A287 E288	K280-N284 WeakPolarHBondContact O-CB 3.42Å; K280-N284 VanDerWaalsContact O-CG 3.31Å; K280-N284 PolarHBondContact O-N 3.3Å; A281-N284 PolarHBondContact O-N 2.93Å; F282-N284 PolarHBondContact O-N 3.37Å; N284-A287 PolarHBondContact O-N 3.41Å; N284-E288 VanDerWaalsContact O-CB 3.28Å; N284-E288 WeakPolarHBondContact O-CB 2.77Å; N284-E288 PolarHBondContact O-N 2.91Å
285	F	91.3	Very high	84.5	Confident	5 Å²	5	48.5 Å²	48.5	2%	0.022	27%	0.271	C	S	.	.	H	α-helix	trans	-59.6	-48.1	173.1	165.1	-94.7	0	0	0	111.9	L221 L224 I225 L252 L255 A281 F282 N283 A287 E288 L289	L221-F285 HydrophobicContact CB-CB 4.23Å; L221-F285 HydrophobicContact CB-CD2 4.04Å; L221-F285 HydrophobicContact CB-CG 4.24Å; L221-F285 HydrophobicContact CD1-CB 3.9Å; L221-F285 HydrophobicContact CD1-CG 4.36Å; L221-F285 HydrophobicContact CD2-CB 4.22Å; L221-F285 HydrophobicContact CD2-CD1 3.85Å; L221-F285 HydrophobicContact CD2-CD2 4.02Å; L221-F285 HydrophobicContact CD2-CE1 4.21Å; L221-F285 HydrophobicContact CD2-CE2 4.37Å; L221-F285 HydrophobicContact CD2-CG 3.75Å; L221-F285 HydrophobicContact CD2-CZ 4.46Å; L221-F285 HydrophobicContact CG-CB 4.35Å; L221-F285 HydrophobicContact CG-CG 4.33Å; L224-F285 HydrophobicContact CB-CE2 4.03Å; L224-F285 HydrophobicContact CD1-CZ 4.43Å; I225-F285 HydrophobicContact CD1-CD2 3.89Å; I225-F285 HydrophobicContact CG1-CD2 3.74Å; I225-F285 HydrophobicContact CG1-CE2 3.99Å; L252-F285 HydrophobicContact CD2-CE1 3.9Å; L252-F285 HydrophobicContact CD2-CZ 4.26Å; L255-F285 HydrophobicContact CD2-CE1 3.99Å; L255-F285 HydrophobicContact CD2-CZ 4.47Å; A281-F285 WeakPolarHBondContact O-CB 3.35Å; A281-F285 PolarHBondContact O-N 2.95Å; F282-F285 HydrophobicContact CD2-CD1 4.37Å; F282-F285 HydrophobicContact CE2-CD1 4.44Å; F282-F285 WeakPolarHBondContact O-CB 3.34Å; F282-F285 PolarHBondContact O-N 3.22Å; N283-F285 VanDerWaalsContact C-N 3.35Å; F285-A287 PolarHBondContact O-N 3.22Å; F285-E288 PolarHBondContact O-N 3.19Å; F285-L289 HydrophobicContact CE1-CD2 4.09Å; F285-L289 HydrophobicContact CZ-CD2 4.02Å; F285-L289 VanDerWaalsContact O-CB 3.28Å; F285-L289 WeakPolarHBondContact O-CB 3.36Å; F285-L289 PolarHBondContact O-N 3.19Å
286	A	88.7	Confident	84.6	Confident	17 Å²	17	51.3 Å²	51.3	14%	0.14	29%	0.288	C	S	.	.	H	α-helix	trans	-63	-43.3	-179.5	0	0	0	0	0	111.5	F282 N283 L289 V290 L304	F282-A286 WeakPolarHBondContact O-CB 3.25Å; F282-A286 PolarHBondContact O-N 3.01Å; N283-A286 PolarHBondContact O-N 3.16Å; A286-L289 PolarHBondContact O-N 3.15Å; A286-V290 WeakPolarHBondContact O-CB 3.44Å; A286-V290 VanDerWaalsContact O-CG2 3.23Å; A286-V290 WeakPolarHBondContact O-CG2 3.14Å; A286-V290 PolarHBondContact O-N 3.3Å; A286-L304 HydrophobicContact CB-CD2 4.04Å
287	A	87.2	Confident	85.2	Confident	64 Å²	64	53.9 Å²	53.9	53%	0.529	30%	0.302	S	S	.	.	H	α-helix	trans	-62.4	-45.3	176.1	0	0	0	0	0	111.8	N283 N284 F285 V290 R291	N283-A287 WeakPolarHBondContact O-CB 3.13Å; N283-A287 PolarHBondContact O-N 3.47Å; N284-A287 PolarHBondContact O-N 3.41Å; F285-A287 PolarHBondContact O-N 3.22Å; A287-V290 PolarHBondContact O-N 3.1Å; A287-R291 WeakPolarHBondContact O-CB 3.26Å; A287-R291 PolarHBondContact O-N 2.89Å
288	E	88.2	Confident	85.7	Confident	48 Å²	48	53.9 Å²	53.9	22%	0.224	31%	0.314	C	S	.	.	H	α-helix	trans	-64.2	-40.8	177.4	177.8	58	-167.1	0	0	112	I225 N284 F285 R291 R292	I225-E288 HydrophobicContact CD1-CG 4.26Å; N284-E288 VanDerWaalsContact O-CB 3.28Å; N284-E288 WeakPolarHBondContact O-CB 2.77Å; N284-E288 PolarHBondContact O-N 2.91Å; F285-E288 PolarHBondContact O-N 3.19Å; E288-R291 VanDerWaalsContact CD-NH2 3.31Å; E288-R291 WeakPolarHBondContact O-CB 3.48Å; E288-R291 PolarHBondContact O-N 3.21Å; E288-R291 IonicContact OE1-CZ 3.3Å; E288-R291 IonicContact OE1-NE 3.42Å; E288-R291 IonicContact OE1-NH2 3.47Å; E288-R291 PolarHBondContact OE1-NH2 3.14Å; E288-R291 IonicContact OE2-CZ 2.85Å; E288-R291 IonicContact OE2-NE 2.76Å; E288-R291 PolarHBondContact OE2-NE 2.94Å; E288-R291 IonicContact OE2-NH2 3.69Å; E288-R291 PolarHBondContact OE2-NH2 3.39Å; E288-R292 WeakPolarHBondContact O-CG 3.45Å; E288-R292 PolarHBondContact O-N 2.91Å; E288-R292 IonicContact OE1-CZ 3.6Å; E288-R292 IonicContact OE1-NE 3.76Å; E288-R292 PolarHBondContact OE1-NE 3.15Å; E288-R292 IonicContact OE1-NH2 2.67Å; E288-R292 PolarHBondContact OE1-NH2 3.43Å
289	L	88.9	Confident	85.8	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-64.1	-46.7	177	-170.5	71.3	0	0	0	111.5	T248 L252 F285 A286 R291 R292 C293 L304	T248-L289 HydrophobicContact CG2-CD1 4.08Å; T248-L289 HydrophobicContact CG2-CD2 3.74Å; T248-L289 HydrophobicContact CG2-CG 3.94Å; L252-L289 HydrophobicContact CD1-CD2 4.14Å; L252-L289 HydrophobicContact CD2-CD2 3.85Å; L252-L289 HydrophobicContact CG-CD2 4.08Å; F285-L289 HydrophobicContact CE1-CD2 4.09Å; F285-L289 HydrophobicContact CZ-CD2 4.02Å; F285-L289 VanDerWaalsContact O-CB 3.28Å; F285-L289 WeakPolarHBondContact O-CB 3.36Å; F285-L289 PolarHBondContact O-N 3.19Å; A286-L289 PolarHBondContact O-N 3.15Å; L289-R291 VanDerWaalsContact C-N 3.32Å; L289-R291 PolarHBondContact O-N 3.46Å; L289-R292 PolarHBondContact O-N 3.49Å; L289-C293 PolarHBondContact O-N 3.41Å; L289-C293 PolarHBondContact O-SG 3.49Å; L289-L304 HydrophobicContact CD2-CD2 4.43Å
290	V	88.3	Confident	86	Confident	62 Å²	62	54.4 Å²	54.4	38%	0.376	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-41.6	176.7	171.3	0	0	0	0	111	A286 A287 R292 C293 G294 V296 L304	A286-V290 WeakPolarHBondContact O-CB 3.44Å; A286-V290 VanDerWaalsContact O-CG2 3.23Å; A286-V290 WeakPolarHBondContact O-CG2 3.14Å; A286-V290 PolarHBondContact O-N 3.3Å; A287-V290 PolarHBondContact O-N 3.1Å; V290-R292 VanDerWaalsContact C-N 3.31Å; V290-R292 PolarHBondContact O-N 3.25Å; V290-C293 PolarHBondContact O-N 2.75Å; V290-G294 PolarHBondContact O-N 3.41Å; V290-V296 HydrophobicContact CB-CG2 4.34Å; V290-V296 HydrophobicContact CG1-CG2 3.93Å; V290-V296 HydrophobicContact CG2-CG2 3.86Å; V290-L304 HydrophobicContact CG2-CD1 4.3Å
291	R	87.9	Confident	86.5	Confident	161 Å²	161	52.9 Å²	52.9	61%	0.608	32%	0.321	S	S	*	.	H	α-helix	trans	-60.4	-39.8	175.3	-170.8	-166.3	67.9	73.1	-1.7	111.9	A287 E288 L289	A287-R291 WeakPolarHBondContact O-CB 3.26Å; A287-R291 PolarHBondContact O-N 2.89Å; E288-R291 VanDerWaalsContact CD-NH2 3.31Å; E288-R291 WeakPolarHBondContact O-CB 3.48Å; E288-R291 PolarHBondContact O-N 3.21Å; E288-R291 IonicContact OE1-CZ 3.3Å; E288-R291 IonicContact OE1-NE 3.42Å; E288-R291 IonicContact OE1-NH2 3.47Å; E288-R291 PolarHBondContact OE1-NH2 3.14Å; E288-R291 IonicContact OE2-CZ 2.85Å; E288-R291 IonicContact OE2-NE 2.76Å; E288-R291 PolarHBondContact OE2-NE 2.94Å; E288-R291 IonicContact OE2-NH2 3.69Å; E288-R291 PolarHBondContact OE2-NH2 3.39Å; L289-R291 VanDerWaalsContact C-N 3.32Å; L289-R291 PolarHBondContact O-N 3.46Å
292	R	85.1	Confident	86.8	Confident	69 Å²	69	59.4 Å²	59.4	26%	0.26	35%	0.346	S	S	.	.	H	α-helix	trans	-71.6	-35.8	177.9	-72.9	178.7	-179.1	-137.3	-7.2	112.9	I225 E229 E288 L289 V290	I225-R292 PolarHBondContact O-NH1 2.88Å; E229-R292 IonicContact OE2-CZ 3.21Å; E229-R292 IonicContact OE2-NH1 3.46Å; E229-R292 PolarHBondContact OE2-NH1 3.23Å; E229-R292 VanDerWaalsContact OE2-NH1 3.08Å; E229-R292 IonicContact OE2-NH2 2.79Å; E229-R292 PolarHBondContact OE2-NH2 3.5Å; E288-R292 WeakPolarHBondContact O-CG 3.45Å; E288-R292 PolarHBondContact O-N 2.91Å; E288-R292 IonicContact OE1-CZ 3.6Å; E288-R292 IonicContact OE1-NE 3.76Å; E288-R292 PolarHBondContact OE1-NE 3.15Å; E288-R292 IonicContact OE1-NH2 2.67Å; E288-R292 PolarHBondContact OE1-NH2 3.43Å; L289-R292 PolarHBondContact O-N 3.49Å; V290-R292 VanDerWaalsContact C-N 3.31Å; V290-R292 PolarHBondContact O-N 3.25Å
293	C	82.2	Confident	86.9	Confident	22 Å²	22	60.1 Å²	60.1	15%	0.149	35%	0.35	C	S	.	.	H	α-helix	trans	-78.1	-31.3	-178.5	-61.6	0	0	0	0	113.3	V244 T248 L289 V290 C295	V244-C293 HydrophobicContact CG1-CB 4.49Å; T248-C293 PolarHBondContact OG1-SG 2.99Å; L289-C293 PolarHBondContact O-N 3.41Å; L289-C293 PolarHBondContact O-SG 3.49Å; V290-C293 PolarHBondContact O-N 2.75Å; C293-C295 PolarHBondContact O-N 3.5Å
294	G	77.6	Confident	87.1	Confident	73 Å²	73	58.7 Å²	58.7	75%	0.753	34%	0.342	S	S	*	.	S	Bend	trans	72.1	-41.2	-176.8	0	0	0	0	0	114.2	V290	V290-G294 PolarHBondContact O-N 3.41Å
295	C	78.5	Confident	87.3	Confident	73 Å²	73	59.8 Å²	59.8	49%	0.493	34%	0.342	S	S	.	.	S	Bend	trans	-127	138	170.7	60.4	0	0	0	0	110.8	C293	C293-C295 PolarHBondContact O-N 3.5Å
296	V	83.1	Confident	87.2	Confident	61 Å²	61	63.2 Å²	63.2	37%	0.37	36%	0.359	S	S	.	.			trans	-111	117	179.8	-177	0	0	0	0	108.7	V290 T300	V290-V296 HydrophobicContact CB-CG2 4.34Å; V290-V296 HydrophobicContact CG1-CG2 3.93Å; V290-V296 HydrophobicContact CG2-CG2 3.86Å; V296-T300 HydrophobicContact CG1-CG2 3.86Å
297	E	86.1	Confident	87.1	Confident	87 Å²	87	62.4 Å²	62.4	41%	0.407	35%	0.352	S	S	.	.			trans	-76.1	166.8	174.5	-70.3	-171.3	-151.2	0	0	112	T245 S299 T300 S301	T245-E297 HydrophobicContact CG2-CB 3.91Å; T245-E297 VanDerWaalsContact CG2-CD 3.47Å; T245-E297 HydrophobicContact CG2-CG 3.95Å; T245-E297 PolarHBondContact OG1-OE1 3.2Å; E297-S299 VanDerWaalsContact C-N 3.26Å; E297-S299 PolarHBondContact O-N 3.3Å; E297-T300 PolarHBondContact O-N 2.96Å; E297-S301 WeakPolarHBondContact O-CB 3.48Å; E297-S301 PolarHBondContact O-N 3.44Å
298	A	88.2	Confident	87.1	Confident	87 Å²	87	62.5 Å²	62.5	72%	0.719	34%	0.339	S	S	*	.	H	α-helix	trans	-61.8	-34.1	-178.2	0	0	0	0	0	112.7	K302	A298-K302 WeakPolarHBondContact O-CB 3.35Å; A298-K302 PolarHBondContact O-N 3.04Å
299	S	86.5	Confident	87.1	Confident	44 Å²	44	64.6 Å²	64.6	31%	0.308	36%	0.359	S	S	.	.	H	α-helix	trans	-63.2	-53.4	176	52.2	0	0	0	0	111.4	D249 E297 S301 K302 L303	D249-S299 WeakPolarHBondContact OD2-CB 3.34Å; D249-S299 PolarHBondContact OD2-OG 2.92Å; E297-S299 VanDerWaalsContact C-N 3.26Å; E297-S299 PolarHBondContact O-N 3.3Å; S299-S301 VanDerWaalsContact C-N 3.32Å; S299-S301 PolarHBondContact O-N 3.4Å; S299-K302 WeakPolarHBondContact O-CB 3.06Å; S299-K302 PolarHBondContact O-N 3.27Å; S299-K302 VanDerWaalsContact O-N 3.09Å; S299-L303 WeakPolarHBondContact O-CG 3.42Å; S299-L303 PolarHBondContact O-N 2.6Å
300	T	89	Confident	87	Confident	6 Å²	6	66.6 Å²	66.6	4%	0.037	37%	0.367	C	S	.	.	H	α-helix	trans	-58.2	-44.2	177	-50.7	0	0	0	0	111.4	T248 D249 L252 V296 E297 K302 L303 L304	T248-T300 HydrophobicContact CG2-CG2 3.54Å; D249-T300 WeakPolarHBondContact OD1-CA 3.44Å; D249-T300 WeakPolarHBondContact OD1-CB 3.44Å; D249-T300 PolarHBondContact OD1-N 3.44Å; D249-T300 VanDerWaalsContact OD1-N 3.17Å; D249-T300 PolarHBondContact OD1-OG1 3.29Å; L252-T300 HydrophobicContact CD1-CG2 3.65Å; V296-T300 HydrophobicContact CG1-CG2 3.86Å; E297-T300 PolarHBondContact O-N 2.96Å; T300-K302 VanDerWaalsContact C-N 3.33Å; T300-K302 PolarHBondContact O-N 3.47Å; T300-L303 PolarHBondContact O-N 3.44Å; T300-L304 HydrophobicContact CG2-CD1 4.4Å; T300-L304 PolarHBondContact O-N 3.37Å
301	S	90.5	Very high	86.9	Confident	40 Å²	40	64 Å²	64	28%	0.28	35%	0.351	S	S	.	.	H	α-helix	trans	-60.2	-42.3	176.1	-171.7	0	0	0	0	111.9	E297 S299 K305	E297-S301 WeakPolarHBondContact O-CB 3.48Å; E297-S301 PolarHBondContact O-N 3.44Å; S299-S301 VanDerWaalsContact C-N 3.32Å; S299-S301 PolarHBondContact O-N 3.4Å; S301-K305 WeakPolarHBondContact O-CB 3.21Å; S301-K305 VanDerWaalsContact O-CG 3.26Å; S301-K305 WeakPolarHBondContact O-CG 3.48Å; S301-K305 PolarHBondContact O-N 3.3Å
302	K	93.5	Very high	86.6	Confident	150 Å²	150	59.9 Å²	59.9	65%	0.652	34%	0.341	S	S	*	.	H	α-helix	trans	-63.2	-43.2	176.7	-175.8	-175.4	177.4	-173.1	0	111.4	A298 S299 T300 K305 M306	A298-K302 WeakPolarHBondContact O-CB 3.35Å; A298-K302 PolarHBondContact O-N 3.04Å; S299-K302 WeakPolarHBondContact O-CB 3.06Å; S299-K302 PolarHBondContact O-N 3.27Å; S299-K302 VanDerWaalsContact O-N 3.09Å; T300-K302 VanDerWaalsContact C-N 3.33Å; T300-K302 PolarHBondContact O-N 3.47Å; K302-K305 PolarHBondContact O-N 3.39Å; K302-M306 WeakPolarHBondContact O-CB 3.11Å; K302-M306 PolarHBondContact O-N 3.13Å
303	L	91.8	Very high	86.3	Confident	20 Å²	20	57.4 Å²	57.4	11%	0.105	33%	0.333	C	S	.	.	H	α-helix	trans	-66.8	-44.2	179.3	-68.6	168.5	0	0	0	112.1	D249 L252 M253 S299 T300 K305 M306 T307	D249-L303 HydrophobicContact CB-CD1 3.97Å; L252-L303 HydrophobicContact CB-CB 3.73Å; L252-L303 HydrophobicContact CB-CD1 3.92Å; L252-L303 HydrophobicContact CB-CG 4.38Å; L252-L303 HydrophobicContact CD1-CB 3.87Å; L252-L303 HydrophobicContact CG-CB 4.44Å; M253-L303 HydrophobicContact CG-CD1 3.93Å; M253-L303 HydrophobicContact CG-CD2 3.82Å; S299-L303 WeakPolarHBondContact O-CG 3.42Å; S299-L303 PolarHBondContact O-N 2.6Å; T300-L303 PolarHBondContact O-N 3.44Å; L303-K305 VanDerWaalsContact C-N 3.31Å; L303-K305 PolarHBondContact O-N 3.45Å; L303-M306 HydrophobicContact CD2-CE 3.74Å; L303-M306 WeakPolarHBondContact O-CB 3.44Å; L303-M306 PolarHBondContact O-N 3.2Å; L303-M306 VanDerWaalsContact O-N 3.11Å; L303-T307 PolarHBondContact O-N 3.3Å; L303-T307 PolarHBondContact O-OG1 2.97Å
304	L	90.2	Very high	86	Confident	23 Å²	23	62.1 Å²	62.1	12%	0.12	35%	0.353	C	S	.	.	H	α-helix	trans	-58.2	-43.6	173.3	-77.4	171.7	0	0	0	111.6	L252 F282 A286 L289 V290 T300 M306 T307 R308	L252-L304 HydrophobicContact CD1-CD2 4.19Å; L252-L304 HydrophobicContact CD1-CG 3.87Å; L252-L304 HydrophobicContact CD2-CD2 3.74Å; L252-L304 HydrophobicContact CD2-CG 4.31Å; F282-L304 HydrophobicContact CZ-CD2 4.29Å; A286-L304 HydrophobicContact CB-CD2 4.04Å; L289-L304 HydrophobicContact CD2-CD2 4.43Å; V290-L304 HydrophobicContact CG2-CD1 4.3Å; T300-L304 HydrophobicContact CG2-CD1 4.4Å; T300-L304 PolarHBondContact O-N 3.37Å; L304-M306 VanDerWaalsContact C-N 3.32Å; L304-M306 PolarHBondContact O-N 2.96Å; L304-T307 PolarHBondContact O-N 2.85Å; L304-R308 WeakPolarHBondContact O-CB 3.33Å; L304-R308 PolarHBondContact O-N 3.08Å
305	K	89.6	Confident	86.2	Confident	140 Å²	140	61 Å²	61	61%	0.609	33%	0.332	S	S	*	.	H	α-helix	trans	-62.3	-39	175.3	-74.8	173.4	-176.1	177.4	0	112	S301 K302 L303 R308 S309	S301-K305 WeakPolarHBondContact O-CB 3.21Å; S301-K305 VanDerWaalsContact O-CG 3.26Å; S301-K305 WeakPolarHBondContact O-CG 3.48Å; S301-K305 PolarHBondContact O-N 3.3Å; K302-K305 PolarHBondContact O-N 3.39Å; L303-K305 VanDerWaalsContact C-N 3.31Å; L303-K305 PolarHBondContact O-N 3.45Å; K305-R308 PolarHBondContact O-N 3.36Å; K305-S309 WeakPolarHBondContact O-CB 3.26Å; K305-S309 PolarHBondContact O-N 3.07Å; K305-S309 PolarHBondContact O-OG 3.15Å
306	M	90.6	Very high	86.1	Confident	77 Å²	77	58 Å²	58	38%	0.379	31%	0.31	S	S	.	.	H	α-helix	trans	-67.2	-35.9	179.2	-170.9	154.2	69.3	0	0	112.8	V256 K302 L303 L304 S309	V256-M306 HydrophobicContact CB-CE 4.4Å; V256-M306 HydrophobicContact CG1-CE 3.82Å; V256-M306 HydrophobicContact CG1-CG 4.36Å; V256-M306 HydrophobicContact CG2-CE 4.09Å; V256-M306 HydrophobicContact CG2-CG 4.5Å; K302-M306 WeakPolarHBondContact O-CB 3.11Å; K302-M306 PolarHBondContact O-N 3.13Å; L303-M306 HydrophobicContact CD2-CE 3.74Å; L303-M306 WeakPolarHBondContact O-CB 3.44Å; L303-M306 PolarHBondContact O-N 3.2Å; L303-M306 VanDerWaalsContact O-N 3.11Å; L304-M306 VanDerWaalsContact C-N 3.32Å; L304-M306 PolarHBondContact O-N 2.96Å; M306-S309 PolarHBondContact O-OG 3.38Å
307	T	86.9	Confident	85.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-73.3	-42.7	170.7	-47.2	0	0	0	0	111.1	L255 V256 F282 L303 L304 S309 K310	L255-T307 HydrophobicContact CD2-CG2 4.01Å; L255-T307 HydrophobicContact CG-CG2 4.31Å; V256-T307 WeakPolarHBondContact CG2-OG1 3.21Å; F282-T307 HydrophobicContact CD2-CG2 3.9Å; F282-T307 HydrophobicContact CE2-CG2 3.39Å; F282-T307 HydrophobicContact CZ-CG2 3.93Å; L303-T307 PolarHBondContact O-N 3.3Å; L303-T307 PolarHBondContact O-OG1 2.97Å; L304-T307 PolarHBondContact O-N 2.85Å; T307-S309 VanDerWaalsContact C-N 3.28Å; T307-S309 PolarHBondContact O-N 3.42Å; T307-K310 WeakPolarHBondContact O-CB 3.33Å; T307-K310 PolarHBondContact O-N 3.4Å; T307-K310 VanDerWaalsContact O-N 3.1Å
308	R	87.5	Confident	85.2	Confident	66 Å²	66	55.8 Å²	55.8	25%	0.249	30%	0.296	C	S	.	.	H	α-helix	trans	-58.8	-38.2	178.7	-177.2	75.3	-178.7	76.5	6.9	112.1	Y279 F282 L304 K305 K310 F311 V313	Y279-R308 PolarHBondContact OH-NH2 3.35Å; F282-R308 HydrophobicContact CE1-CB 3.94Å; F282-R308 HydrophobicContact CZ-CB 4.4Å; L304-R308 WeakPolarHBondContact O-CB 3.33Å; L304-R308 PolarHBondContact O-N 3.08Å; K305-R308 PolarHBondContact O-N 3.36Å; R308-K310 PolarHBondContact O-N 3.32Å; R308-F311 PolarHBondContact O-N 2.67Å; R308-F311 VanDerWaalsContact O-N 3.15Å; R308-V313 VanDerWaalsContact NH1-CG2 3.32Å
309	S	88.2	Confident	84.7	Confident	92 Å²	92	54.7 Å²	54.7	64%	0.643	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-14	179.7	61.3	0	0	0	0	113.8	K305 M306 T307	K305-S309 WeakPolarHBondContact O-CB 3.26Å; K305-S309 PolarHBondContact O-N 3.07Å; K305-S309 PolarHBondContact O-OG 3.15Å; M306-S309 PolarHBondContact O-OG 3.38Å; T307-S309 VanDerWaalsContact C-N 3.28Å; T307-S309 PolarHBondContact O-N 3.42Å
310	K	86.1	Confident	84	Confident	46 Å²	46	53.1 Å²	53.1	20%	0.2	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-21.2	171.9	-59.6	-174.6	-179.6	-171.7	0	112.2	V256 T259 E260 F267 T307 R308 D312	V256-K310 PolarHBondContact O-NZ 3.49Å; T259-K310 PolarHBondContact OG1-NZ 3.49Å; E260-K310 VanDerWaalsContact CG-NZ 3.32Å; E260-K310 WeakPolarHBondContact OE1-CE 3.07Å; E260-K310 IonicContact OE1-NZ 2.79Å; E260-K310 PolarHBondContact OE1-NZ 3.43Å; F267-K310 HydrophobicContact CD1-CB 3.77Å; F267-K310 HydrophobicContact CE1-CB 3.99Å; F267-K310 HydrophobicContact CG-CB 4.12Å; F267-K310 HydrophobicContact CZ-CD 4.38Å; T307-K310 WeakPolarHBondContact O-CB 3.33Å; T307-K310 PolarHBondContact O-N 3.4Å; T307-K310 VanDerWaalsContact O-N 3.1Å; R308-K310 PolarHBondContact O-N 3.32Å; K310-D312 PolarHBondContact O-N 3.44Å
311	F	84.9	Confident	83.2	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.035	27%	0.268	C	S	.	.			trans	-85.4	101.2	174.5	-63.9	-87.1	0	0	0	109.9	F217 F267 F275 T278 Y279 F282 R308 V313	F217-F311 HydrophobicContact CE1-CZ 4.09Å; F217-F311 HydrophobicContact CZ-CZ 4.03Å; F267-F311 AromaticContact CD1-CD1 3.95Å; F267-F311 HydrophobicContact CD1-CD1 3.95Å; F267-F311 HydrophobicContact CD1-CD2 4.2Å; F267-F311 AromaticContact CD1-CE1 3.76Å; F267-F311 HydrophobicContact CD1-CE1 3.76Å; F267-F311 HydrophobicContact CD1-CE2 4.04Å; F267-F311 HydrophobicContact CD1-CG 4.17Å; F267-F311 AromaticContact CD1-CZ 3.82Å; F267-F311 HydrophobicContact CD1-CZ 3.82Å; F267-F311 HydrophobicContact CE1-CD1 4.44Å; F267-F311 HydrophobicContact CE1-CD2 4.17Å; F267-F311 AromaticContact CE1-CE1 3.91Å; F267-F311 HydrophobicContact CE1-CE1 3.91Å; F267-F311 AromaticContact CE1-CE2 3.62Å; F267-F311 HydrophobicContact CE1-CE2 3.62Å; F267-F311 AromaticContact CE1-CZ 3.47Å; F267-F311 HydrophobicContact CE1-CZ 3.47Å; F267-F311 VanDerWaalsContact CE1-CZ 3.47Å; F275-F311 HydrophobicContact CE2-CB 4.37Å; F275-F311 AromaticContact CE2-CD1 3.97Å; F275-F311 HydrophobicContact CE2-CD1 3.97Å; F275-F311 HydrophobicContact CZ-CB 3.93Å; F275-F311 AromaticContact CZ-CD1 3.95Å; F275-F311 HydrophobicContact CZ-CD1 3.95Å; F275-F311 HydrophobicContact CZ-CG 4.47Å; T278-F311 HydrophobicContact CG2-CE1 3.71Å; T278-F311 HydrophobicContact CG2-CZ 3.98Å; Y279-F311 HydrophobicContact CD2-CB 4.09Å; Y279-F311 AromaticContact CD2-CD1 3.72Å; Y279-F311 HydrophobicContact CD2-CD1 3.72Å; Y279-F311 HydrophobicContact CD2-CD2 4.14Å; Y279-F311 HydrophobicContact CD2-CE1 4.12Å; Y279-F311 HydrophobicContact CD2-CE2 4.49Å; Y279-F311 AromaticContact CD2-CG 3.72Å; Y279-F311 HydrophobicContact CD2-CG 3.72Å; Y279-F311 HydrophobicContact CD2-CZ 4.48Å; Y279-F311 HydrophobicContact CE2-CB 4.47Å; Y279-F311 HydrophobicContact CE2-CG 4.43Å; Y279-F311 HydrophobicContact CG-CD1 4.26Å; F282-F311 HydrophobicContact CB-CE2 3.89Å; F282-F311 HydrophobicContact CB-CZ 3.79Å; F282-F311 HydrophobicContact CD1-CD2 4.45Å; F282-F311 AromaticContact CD1-CE2 3.84Å; F282-F311 HydrophobicContact CD1-CE2 3.84Å; F282-F311 HydrophobicContact CD2-CE2 4.4Å; F282-F311 AromaticContact CG-CE2 3.76Å; F282-F311 HydrophobicContact CG-CE2 3.76Å; F282-F311 HydrophobicContact CG-CZ 4.19Å; R308-F311 PolarHBondContact O-N 2.67Å; R308-F311 VanDerWaalsContact O-N 3.15Å; F311-V313 HydrophobicContact CB-CG2 4.13Å; F311-V313 WeakPolarHBondContact O-CG2 3.38Å; F311-V313 PolarHBondContact O-N 2.92Å
312	D	82.9	Confident	82.7	Confident	74 Å²	74	56.2 Å²	56.2	40%	0.396	28%	0.28	S	S	.	.			trans	-76.3	79.9	168.3	-164.7	-26.9	0	0	0	110.1	K310 Q314 V315 Y316	K310-D312 PolarHBondContact O-N 3.44Å; D312-Q314 PolarHBondContact O-N 3.08Å; D312-Q314 WeakPolarHBondContact OD1-CB 3.42Å; D312-Q314 PolarHBondContact OD1-N 2.99Å; D312-Q314 VanDerWaalsContact OD1-N 3.16Å; D312-V315 HydrophobicContact CB-CB 4.25Å; D312-V315 HydrophobicContact CB-CG2 4.42Å; D312-V315 VanDerWaalsContact CG-CG2 3.41Å; D312-V315 PolarHBondContact O-N 3.4Å; D312-V315 PolarHBondContact OD1-N 2.97Å; D312-V315 WeakPolarHBondContact OD2-CG2 3.1Å; D312-Y316 PolarHBondContact O-N 3.28Å; D312-Y316 VanDerWaalsContact O-N 3.12Å
313	V	78.3	Confident	82.1	Confident	16 Å²	16	55.1 Å²	55.1	10%	0.097	28%	0.277	C	S	.	.	H	α-helix	trans	-66	-24.1	-179.9	-155.8	0	0	0	0	111.1	Y279 R308 F311 H317 L376	Y279-V313 HydrophobicContact CE2-CG2 4.29Å; R308-V313 VanDerWaalsContact NH1-CG2 3.32Å; F311-V313 HydrophobicContact CB-CG2 4.13Å; F311-V313 WeakPolarHBondContact O-CG2 3.38Å; F311-V313 PolarHBondContact O-N 2.92Å; V313-H317 WeakPolarHBondContact O-CB 3.41Å; V313-H317 PolarHBondContact O-N 3.4Å; V313-L376 HydrophobicContact CB-CD2 4.12Å; V313-L376 HydrophobicContact CG1-CD1 3.54Å; V313-L376 HydrophobicContact CG1-CD2 3.65Å; V313-L376 HydrophobicContact CG1-CG 3.82Å
314	Q	77	Confident	81.2	Confident	121 Å²	121	55.6 Å²	55.6	57%	0.565	28%	0.28	S	S	*	.	H	α-helix	trans	-70.3	-48.6	178.4	-177.9	177.2	-10.4	0	0	110.8	D312 H317 Q318	D312-Q314 PolarHBondContact O-N 3.08Å; D312-Q314 WeakPolarHBondContact OD1-CB 3.42Å; D312-Q314 PolarHBondContact OD1-N 2.99Å; D312-Q314 VanDerWaalsContact OD1-N 3.16Å; Q314-H317 PolarHBondContact O-N 2.87Å; Q314-Q318 WeakPolarHBondContact O-CG 3.34Å; Q314-Q318 PolarHBondContact O-N 3.44Å
315	V	80.1	Confident	80.7	Confident	50 Å²	50	55 Å²	55	30%	0.303	28%	0.277	S	S	.	.	H	α-helix	trans	-64.7	-41.6	176.6	172.5	0	0	0	0	111	P269 D312 H317 Q318 L319	P269-V315 HydrophobicContact CB-CG1 3.98Å; P269-V315 HydrophobicContact CG-CB 4.16Å; P269-V315 HydrophobicContact CG-CG1 3.88Å; D312-V315 HydrophobicContact CB-CB 4.25Å; D312-V315 HydrophobicContact CB-CG2 4.42Å; D312-V315 VanDerWaalsContact CG-CG2 3.41Å; D312-V315 PolarHBondContact O-N 3.4Å; D312-V315 PolarHBondContact OD1-N 2.97Å; D312-V315 WeakPolarHBondContact OD2-CG2 3.1Å; V315-H317 VanDerWaalsContact C-N 3.35Å; V315-H317 PolarHBondContact O-N 3.49Å; V315-Q318 PolarHBondContact O-N 3.36Å; V315-L319 HydrophobicContact CG1-CD1 4.19Å; V315-L319 HydrophobicContact CG1-CG 4.43Å; V315-L319 WeakPolarHBondContact O-CG 3.31Å; V315-L319 PolarHBondContact O-N 3.16Å
316	Y	76.7	Confident	80.3	Confident	11 Å²	11	51.4 Å²	51.4	4%	0.043	27%	0.27	C	S	.	.	H	α-helix	trans	-54.5	-51	173.2	170.4	-102.6	0	0	0	111.9	P272 F275 D312 Q318 L319 C320	P272-Y316 HydrophobicContact CB-CE2 3.76Å; P272-Y316 VanDerWaalsContact O-CE2 3.31Å; P272-Y316 WeakPolarHBondContact O-CE2 3.5Å; F275-Y316 HydrophobicContact CB-CD2 4.11Å; F275-Y316 HydrophobicContact CB-CE2 4.34Å; F275-Y316 HydrophobicContact CD1-CD1 4.09Å; F275-Y316 AromaticContact CD1-CD2 3.32Å; F275-Y316 HydrophobicContact CD1-CD2 3.32Å; F275-Y316 AromaticContact CD1-CE2 3.87Å; F275-Y316 HydrophobicContact CD1-CE2 3.87Å; F275-Y316 AromaticContact CD1-CG 3.44Å; F275-Y316 HydrophobicContact CD1-CG 3.44Å; F275-Y316 VanDerWaalsContact CD1-CG 3.44Å; F275-Y316 VanDerWaalsContact CE1-CB 3.49Å; F275-Y316 HydrophobicContact CE1-CD1 4.05Å; F275-Y316 AromaticContact CE1-CD2 3.96Å; F275-Y316 HydrophobicContact CE1-CD2 3.96Å; F275-Y316 AromaticContact CE1-CG 3.55Å; F275-Y316 HydrophobicContact CE1-CG 3.55Å; F275-Y316 AromaticContact CG-CD2 3.9Å; F275-Y316 HydrophobicContact CG-CD2 3.9Å; F275-Y316 HydrophobicContact CG-CE2 4.48Å; F275-Y316 HydrophobicContact CG-CG 4.33Å; D312-Y316 PolarHBondContact O-N 3.28Å; D312-Y316 VanDerWaalsContact O-N 3.12Å; Y316-Q318 VanDerWaalsContact C-N 3.32Å; Y316-Q318 PolarHBondContact O-N 3.4Å; Y316-L319 PolarHBondContact O-N 2.95Å; Y316-C320 PolarHBondContact O-N 2.85Å; Y316-C320 PolarHBondContact O-SG 2.76Å
317	H	73.2	Confident	79.7	Confident	4 Å²	4	49 Å²	49	2%	0.019	27%	0.265	C	S	.	.	H	α-helix	trans	-62.4	-40.8	178.8	-174.8	-77.4	0	0	0	111.4	V313 Q314 V315 L319 C320 C321 L376 S379 C380	V313-H317 WeakPolarHBondContact O-CB 3.41Å; V313-H317 PolarHBondContact O-N 3.4Å; Q314-H317 PolarHBondContact O-N 2.87Å; V315-H317 VanDerWaalsContact C-N 3.35Å; V315-H317 PolarHBondContact O-N 3.49Å; H317-L319 PolarHBondContact O-N 2.92Å; H317-C320 PolarHBondContact O-N 2.99Å; H317-C321 PolarHBondContact CE1-SG 3.28Å; H317-C321 PolarHBondContact ND1-SG 3.38Å; H317-C321 WeakPolarHBondContact O-CB 3.42Å; H317-C321 PolarHBondContact O-N 3.31Å; H317-C321 PolarHBondContact O-SG 3.25Å; H317-L376 HydrophobicContact CB-CD2 4.11Å; H317-S379 WeakPolarHBondContact CE1-CB 3.44Å; H317-S379 PolarHBondContact CE1-O 2.83Å; H317-S379 VanDerWaalsContact ND1-CB 3.3Å; H317-S379 WeakPolarHBondContact ND1-CB 3.31Å; H317-C380 PolarHBondContact NE2-N 3.32Å
318	Q	76.7	Confident	79.5	Confident	96 Å²	96	49.1 Å²	49.1	45%	0.449	27%	0.265	S	S	.	.	H	α-helix	trans	-61.8	-41.4	176.4	-74.9	175.5	-5.8	0	0	112.7	Q314 V315 Y316 C321 L322	Q314-Q318 WeakPolarHBondContact O-CG 3.34Å; Q314-Q318 PolarHBondContact O-N 3.44Å; V315-Q318 PolarHBondContact O-N 3.36Å; Y316-Q318 VanDerWaalsContact C-N 3.32Å; Y316-Q318 PolarHBondContact O-N 3.4Å; Q318-C321 WeakPolarHBondContact O-CB 3.23Å; Q318-C321 PolarHBondContact O-N 3.46Å; Q318-L322 WeakPolarHBondContact O-CB 3.4Å; Q318-L322 VanDerWaalsContact O-CG 3.27Å; Q318-L322 WeakPolarHBondContact O-CG 3.36Å; Q318-L322 PolarHBondContact O-N 3.46Å
319	L	77.9	Confident	79.3	Confident	64 Å²	64	50.6 Å²	50.6	34%	0.335	28%	0.275	S	S	.	.	H	α-helix	trans	-65.2	-47.2	176.5	-71.5	173.1	0	0	0	111.5	P269 V315 Y316 H317 C321 L322 E323	P269-L319 HydrophobicContact CB-CD1 3.81Å; P269-L319 WeakPolarHBondContact O-CD1 3.32Å; V315-L319 HydrophobicContact CG1-CD1 4.19Å; V315-L319 HydrophobicContact CG1-CG 4.43Å; V315-L319 WeakPolarHBondContact O-CG 3.31Å; V315-L319 PolarHBondContact O-N 3.16Å; Y316-L319 PolarHBondContact O-N 2.95Å; H317-L319 PolarHBondContact O-N 2.92Å; L319-C321 VanDerWaalsContact C-N 3.28Å; L319-C321 PolarHBondContact O-N 3.01Å; L319-L322 PolarHBondContact O-N 3.44Å; L319-E323 PolarHBondContact O-N 2.93Å
320	C	73.1	Confident	79	Confident	12 Å²	12	52.8 Å²	52.8	8%	0.081	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-37.4	175.2	-66.1	0	0	0	0	112.1	Y316 H317 T324 L371	Y316-C320 PolarHBondContact O-N 2.85Å; Y316-C320 PolarHBondContact O-SG 2.76Å; H317-C320 PolarHBondContact O-N 2.99Å; C320-T324 VanDerWaalsContact O-CB 3.3Å; C320-T324 WeakPolarHBondContact O-CB 3.39Å; C320-T324 PolarHBondContact O-N 3.3Å; C320-T324 PolarHBondContact O-OG1 3.01Å; C320-L371 HydrophobicContact CB-CD2 3.71Å
321	C	72.4	Confident	78.6	Confident	9 Å²	9	58.8 Å²	58.8	6%	0.061	30%	0.297	C	S	.	.	H	α-helix	trans	-62	-48.9	173.4	-72.9	0	0	0	0	111.7	H317 Q318 L319 E323 T324 L325 L383	H317-C321 PolarHBondContact CE1-SG 3.28Å; H317-C321 PolarHBondContact ND1-SG 3.38Å; H317-C321 WeakPolarHBondContact O-CB 3.42Å; H317-C321 PolarHBondContact O-N 3.31Å; H317-C321 PolarHBondContact O-SG 3.25Å; Q318-C321 WeakPolarHBondContact O-CB 3.23Å; Q318-C321 PolarHBondContact O-N 3.46Å; L319-C321 VanDerWaalsContact C-N 3.28Å; L319-C321 PolarHBondContact O-N 3.01Å; C321-E323 VanDerWaalsContact C-N 3.35Å; C321-T324 PolarHBondContact O-N 3.12Å; C321-L325 VanDerWaalsContact O-CB 3.25Å; C321-L325 WeakPolarHBondContact O-CB 3.36Å; C321-L325 VanDerWaalsContact O-CG 3.29Å; C321-L325 WeakPolarHBondContact O-CG 3.3Å; C321-L325 PolarHBondContact O-N 3.43Å; C321-L383 HydrophobicContact CB-CD1 3.97Å; C321-L383 HydrophobicContact CB-CD2 4.46Å
322	L	79.5	Confident	78.3	Confident	101 Å²	101	58.9 Å²	58.9	53%	0.529	30%	0.297	S	S	.	.	H	α-helix	trans	-62.8	-44	-177.3	-75.5	170.2	0	0	0	110.7	Q318 L319 S326	Q318-L322 WeakPolarHBondContact O-CB 3.4Å; Q318-L322 VanDerWaalsContact O-CG 3.27Å; Q318-L322 WeakPolarHBondContact O-CG 3.36Å; Q318-L322 PolarHBondContact O-N 3.46Å; L319-L322 PolarHBondContact O-N 3.44Å; L322-S326 WeakPolarHBondContact O-CB 3.24Å; L322-S326 PolarHBondContact O-N 2.99Å; L322-S326 PolarHBondContact O-OG 3.13Å
323	E	80	Confident	78	Confident	128 Å²	128	62.3 Å²	62.3	60%	0.598	31%	0.309	S	S	*	.	H	α-helix	trans	-62.1	-43.7	176.2	-175.8	-179.6	-173.7	0	0	112.1	L319 C321 S326 G327	L319-E323 PolarHBondContact O-N 2.93Å; C321-E323 VanDerWaalsContact C-N 3.35Å; E323-S326 PolarHBondContact O-OG 2.93Å; E323-S326 VanDerWaalsContact O-OG 3.07Å; E323-G327 PolarHBondContact O-N 3.46Å; E323-G327 VanDerWaalsContact O-N 3.08Å
324	T	74.5	Confident	77.4	Confident	29 Å²	29	64.3 Å²	64.3	18%	0.178	32%	0.319	C	S	.	.	H	α-helix	trans	-69	-44.9	180	-54.9	0	0	0	0	111.5	C320 C321 L328 T357	C320-T324 VanDerWaalsContact O-CB 3.3Å; C320-T324 WeakPolarHBondContact O-CB 3.39Å; C320-T324 PolarHBondContact O-N 3.3Å; C320-T324 PolarHBondContact O-OG1 3.01Å; C321-T324 PolarHBondContact O-N 3.12Å; T324-L328 WeakPolarHBondContact O-CB 3.39Å; T324-L328 PolarHBondContact O-N 3.29Å; T324-T357 HydrophobicContact CG2-CG2 3.42Å; T324-T357 VanDerWaalsContact CG2-CG2 3.42Å
325	L	79.3	Confident	76.8	Confident	11 Å²	11	62.5 Å²	62.5	6%	0.058	32%	0.32	C	S	.	.	H	α-helix	trans	-68.4	-42.6	178	-73.8	171.2	0	0	0	111.5	C321 G327 L328 E329 L383 R386 V387	C321-L325 VanDerWaalsContact O-CB 3.25Å; C321-L325 WeakPolarHBondContact O-CB 3.36Å; C321-L325 VanDerWaalsContact O-CG 3.29Å; C321-L325 WeakPolarHBondContact O-CG 3.3Å; C321-L325 PolarHBondContact O-N 3.43Å; L325-G327 VanDerWaalsContact C-N 3.3Å; L325-G327 PolarHBondContact O-N 3.11Å; L325-L328 PolarHBondContact O-N 3.36Å; L325-L328 VanDerWaalsContact O-N 3.12Å; L325-E329 WeakPolarHBondContact O-CB 3.38Å; L325-E329 WeakPolarHBondContact O-CG 3.33Å; L325-E329 PolarHBondContact O-N 3Å; L325-L383 HydrophobicContact CD1-CD1 3.69Å; L325-L383 HydrophobicContact CD2-CD1 3.88Å; L325-L383 HydrophobicContact CG-CD1 3.6Å; L325-R386 HydrophobicContact CD1-CB 4.04Å; L325-R386 HydrophobicContact CD2-CB 4.11Å; L325-V387 HydrophobicContact CD2-CG2 3.76Å
326	S	80.2	Confident	76	Confident	64 Å²	64	62.5 Å²	62.5	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-62.6	-40.6	177.7	64.8	0	0	0	0	111.2	L322 E323 L328 E330	L322-S326 WeakPolarHBondContact O-CB 3.24Å; L322-S326 PolarHBondContact O-N 2.99Å; L322-S326 PolarHBondContact O-OG 3.13Å; E323-S326 PolarHBondContact O-OG 2.93Å; E323-S326 VanDerWaalsContact O-OG 3.07Å; S326-L328 VanDerWaalsContact C-N 3.31Å; S326-L328 PolarHBondContact O-N 3Å; S326-E330 VanDerWaalsContact O-CB 3.24Å; S326-E330 WeakPolarHBondContact O-CB 3.35Å; S326-E330 PolarHBondContact O-N 3.42Å
327	G	78.4	Confident	75.9	Confident	27 Å²	27	66.5 Å²	66.5	28%	0.278	34%	0.344	S	S	.	.	H	α-helix	trans	-65.5	-33	174.7	0	0	0	0	0	113.2	E323 L325 R331	E323-G327 PolarHBondContact O-N 3.46Å; E323-G327 VanDerWaalsContact O-N 3.08Å; L325-G327 VanDerWaalsContact C-N 3.3Å; L325-G327 PolarHBondContact O-N 3.11Å; G327-R331 WeakPolarHBondContact O-CG 3.49Å; G327-R331 PolarHBondContact O-N 3.21Å
328	L	82.2	Confident	76.4	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-73.2	-49.2	175.1	-174.6	67.4	0	0	0	111.7	T324 L325 S326 E330 R331 M332 L353 L354 V387	T324-L328 WeakPolarHBondContact O-CB 3.39Å; T324-L328 PolarHBondContact O-N 3.29Å; L325-L328 PolarHBondContact O-N 3.36Å; L325-L328 VanDerWaalsContact O-N 3.12Å; S326-L328 VanDerWaalsContact C-N 3.31Å; S326-L328 PolarHBondContact O-N 3Å; L328-E330 VanDerWaalsContact C-N 3.33Å; L328-E330 PolarHBondContact O-N 3.05Å; L328-R331 PolarHBondContact O-N 3.43Å; L328-M332 HydrophobicContact CD1-CE 3.93Å; L328-M332 HydrophobicContact CD1-CG 4.47Å; L328-M332 HydrophobicContact CD1-SD 4.1Å; L328-M332 HydrophobicContact CD2-CE 4.37Å; L328-M332 HydrophobicContact CD2-SD 4.23Å; L328-M332 HydrophobicContact CG-CE 4.14Å; L328-M332 HydrophobicContact CG-CG 4.45Å; L328-M332 HydrophobicContact CG-SD 3.77Å; L328-M332 WeakPolarHBondContact O-CB 3.31Å; L328-M332 WeakPolarHBondContact O-CG 3.32Å; L328-M332 PolarHBondContact O-N 3.34Å; L328-L353 HydrophobicContact CD1-CD2 3.87Å; L328-L353 HydrophobicContact CD1-CG 4.24Å; L328-L354 HydrophobicContact CD1-CD2 3.9Å; L328-L354 HydrophobicContact CD1-CG 4.33Å; L328-L354 HydrophobicContact CD2-CD2 3.86Å; L328-L354 HydrophobicContact CG-CD2 4.48Å; L328-V387 HydrophobicContact CD2-CB 4.45Å; L328-V387 HydrophobicContact CD2-CG1 3.93Å; L328-V387 HydrophobicContact CD2-CG2 4.2Å
329	E	83.8	Confident	76.7	Confident	98 Å²	98	68.7 Å²	68.7	46%	0.458	36%	0.355	S	S	.	.	H	α-helix	trans	-60.9	-40.2	178.5	-74.2	175.4	179.3	0	0	111.8	L325 R331 M332 K333 V390	L325-E329 WeakPolarHBondContact O-CB 3.38Å; L325-E329 WeakPolarHBondContact O-CG 3.33Å; L325-E329 PolarHBondContact O-N 3Å; E329-R331 VanDerWaalsContact C-N 3.35Å; E329-R331 PolarHBondContact O-N 2.99Å; E329-M332 CarbonylContact O-C 3.56Å; E329-M332 PolarHBondContact O-N 3.3Å; E329-K333 PolarHBondContact O-N 2.84Å; E329-V390 HydrophobicContact CG-CG1 4.04Å; E329-V390 HydrophobicContact CG-CG2 4.28Å
330	E	82	Confident	77.1	Confident	138 Å²	138	69.4 Å²	69.4	65%	0.645	36%	0.364	S	S	*	.	H	α-helix	trans	-62	-42.5	175.9	-175.4	173.1	-158.6	0	0	111.8	S326 L328 M332	S326-E330 VanDerWaalsContact O-CB 3.24Å; S326-E330 WeakPolarHBondContact O-CB 3.35Å; S326-E330 PolarHBondContact O-N 3.42Å; L328-E330 VanDerWaalsContact C-N 3.33Å; L328-E330 PolarHBondContact O-N 3.05Å; E330-M332 VanDerWaalsContact C-N 3.33Å
331	R	77.3	Confident	77.6	Confident	172 Å²	172	70.3 Å²	70.3	65%	0.649	37%	0.37	S	S	*	.	H	α-helix	trans	-73.5	-24.3	176	-70.1	177.7	-178.9	-163.9	2.4	113.3	G327 L328 E329 L353	G327-R331 WeakPolarHBondContact O-CG 3.49Å; G327-R331 PolarHBondContact O-N 3.21Å; L328-R331 PolarHBondContact O-N 3.43Å; E329-R331 VanDerWaalsContact C-N 3.35Å; E329-R331 PolarHBondContact O-N 2.99Å; R331-L353 HydrophobicContact CB-CD2 4.46Å; R331-L353 VanDerWaalsContact CD-CD2 3.41Å
332	M	79.7	Confident	78	Confident	9 Å²	9	76.5 Å²	76.5	4%	0.044	41%	0.407	C	S	.	.	H	α-helix	trans	-88.7	-6.7	177.9	-78.1	-179.3	161.2	0	0	113.9	L328 E329 E330 L334 L350 L354 V390 Y391 F394	L328-M332 HydrophobicContact CD1-CE 3.93Å; L328-M332 HydrophobicContact CD1-CG 4.47Å; L328-M332 HydrophobicContact CD1-SD 4.1Å; L328-M332 HydrophobicContact CD2-CE 4.37Å; L328-M332 HydrophobicContact CD2-SD 4.23Å; L328-M332 HydrophobicContact CG-CE 4.14Å; L328-M332 HydrophobicContact CG-CG 4.45Å; L328-M332 HydrophobicContact CG-SD 3.77Å; L328-M332 WeakPolarHBondContact O-CB 3.31Å; L328-M332 WeakPolarHBondContact O-CG 3.32Å; L328-M332 PolarHBondContact O-N 3.34Å; E329-M332 CarbonylContact O-C 3.56Å; E329-M332 PolarHBondContact O-N 3.3Å; E330-M332 VanDerWaalsContact C-N 3.33Å; M332-L334 PolarHBondContact O-N 3.45Å; M332-L334 VanDerWaalsContact O-N 3.08Å; M332-L350 HydrophobicContact CE-CD1 3.63Å; M332-L350 HydrophobicContact CE-CG 4.37Å; M332-L350 HydrophobicContact CG-CD1 3.71Å; M332-L354 HydrophobicContact CE-CD1 3.71Å; M332-L354 HydrophobicContact CE-CD2 3.64Å; M332-L354 HydrophobicContact CE-CG 3.9Å; M332-V390 HydrophobicContact SD-CG1 3.48Å; M332-V390 WeakPolarHBondContact SD-CG1 3.44Å; M332-Y391 HydrophobicContact CE-CD2 3.91Å; M332-F394 HydrophobicContact CB-CD2 3.97Å; M332-F394 HydrophobicContact CB-CE2 4.45Å; M332-F394 HydrophobicContact CG-CD2 4.22Å; M332-F394 WeakPolarHBondContact O-CD2 3.12Å; M332-F394 WeakPolarHBondContact O-CE2 2.86Å; M332-F394 HydrophobicContact SD-CB 4.49Å
333	K	75.8	Confident	78	Confident	146 Å²	146	75.7 Å²	75.7	64%	0.635	42%	0.424	S	S	*	.	S	Bend	trans	-56.5	120.7	165.9	-76.5	179.6	-177.8	172.7	0	108.1	E329 S335	E329-K333 PolarHBondContact O-N 2.84Å; K333-S335 PolarHBondContact O-N 2.81Å; K333-S335 PolarHBondContact O-OG 3.39Å; K333-S335 VanDerWaalsContact O-OG 3.06Å
334	L	66.6	Low	77.9	Confident	58 Å²	58	71.3 Å²	71.3	30%	0.304	41%	0.413	S	S	.	.			trans	-43.7	102	-176	-93.1	174.4	0	0	0	111.5	M332 M336 E397	M332-L334 PolarHBondContact O-N 3.45Å; M332-L334 VanDerWaalsContact O-N 3.08Å; L334-M336 HydrophobicContact CD2-CG 4.16Å; L334-E397 HydrophobicContact CD1-CB 4.16Å; L334-E397 HydrophobicContact CD1-CG 3.49Å; L334-E397 VanDerWaalsContact CD1-CG 3.49Å; L334-E397 VanDerWaalsContact CD1-OE1 3.29Å; L334-E397 WeakPolarHBondContact CD1-OE1 3.48Å; L334-E397 HydrophobicContact CG-CG 4.31Å
335	S	63.9	Low	78.3	Confident	84 Å²	84	73.9 Å²	73.9	59%	0.587	44%	0.437	S	S	*	.			trans	-119.4	92	171	-60	0	0	0	0	104.7	K333 P337	K333-S335 PolarHBondContact O-N 2.81Å; K333-S335 PolarHBondContact O-OG 3.39Å; K333-S335 VanDerWaalsContact O-OG 3.06Å; S335-P337 CarbonylContact O-C 3.5Å; S335-P337 VanDerWaalsContact O-O 3.09Å
336	M	63.4	Low	78.8	Confident	49 Å²	49	74.6 Å²	74.6	24%	0.241	44%	0.44	C	S	.	.	S	Bend	trans	-91.7	133.2	172.1	-65.8	-134.5	72.6	0	0	108.7	L334 Y398 N401 Q419	L334-M336 HydrophobicContact CD2-CG 4.16Å; M336-Y398 HydrophobicContact CE-CD2 4.15Å; M336-Y398 HydrophobicContact CE-CE2 3.53Å; M336-Y398 HydrophobicContact SD-CD2 4.37Å; M336-Y398 HydrophobicContact SD-CE2 4.25Å; M336-N401 PolarHBondContact SD-ND2 3Å; M336-Q419 VanDerWaalsContact CE-CD 3.41Å; M336-Q419 HydrophobicContact CE-CG 4.24Å
337	P	74.9	Confident	79.1	Confident	95 Å²	95	74.7 Å²	74.7	62%	0.617	43%	0.433	S	S	*	.	S	Bend	cis	-79.2	156.5	3.6	32.2	-35.2	0	0	0	114.1	S335	S335-P337 CarbonylContact O-C 3.5Å; S335-P337 VanDerWaalsContact O-O 3.09Å
338	L	82.7	Confident	79.7	Confident	26 Å²	26	73.7 Å²	73.7	14%	0.136	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-68.4	145.2	175.5	-65.4	172.3	0	0	0	111.4	P340 Y348 F394 Y398 F427	L338-P340 WeakPolarHBondContact O-CD 3.23Å; L338-Y348 HydrophobicContact CB-CD1 3.45Å; L338-Y348 VanDerWaalsContact CB-CD1 3.45Å; L338-Y348 HydrophobicContact CB-CE1 3.52Å; L338-Y348 HydrophobicContact CB-CG 4.2Å; L338-Y348 HydrophobicContact CD1-CD1 4.21Å; L338-Y348 HydrophobicContact CD1-CD2 4.25Å; L338-Y348 HydrophobicContact CD1-CE1 4.22Å; L338-Y348 HydrophobicContact CD1-CE2 4.22Å; L338-Y348 HydrophobicContact CD1-CG 4.24Å; L338-Y348 HydrophobicContact CG-CD1 4.47Å; L338-Y348 HydrophobicContact CG-CE1 4.49Å; L338-F394 HydrophobicContact CD2-CZ 3.88Å; L338-Y398 HydrophobicContact CD1-CD2 4.4Å; L338-Y398 HydrophobicContact CD1-CE2 3.84Å; L338-F427 HydrophobicContact CD1-CD2 3.62Å; L338-F427 HydrophobicContact CD1-CE2 4Å
339	E	83.4	Confident	80	Confident	121 Å²	121	77.9 Å²	77.9	57%	0.565	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-75.5	123.2	179.2	-66.7	-167.2	179	0	0	112.2	K349	E339-K349 HydrophobicContact CB-CD 4.03Å; E339-K349 HydrophobicContact CB-CG 4.39Å; E339-K349 PolarHBondContact O-N 3.31Å; E339-K349 WeakPolarHBondContact OE2-CD 3.26Å; E339-K349 IonicContact OE2-NZ 3.46Å; E339-K349 PolarHBondContact OE2-NZ 3.11Å
340	P	85.4	Confident	80.3	Confident	79 Å²	79	74.1 Å²	74.1	51%	0.513	42%	0.421	S	S	.	.	B	Isolated β-bridge	trans	-70.5	145	173.4	29.8	-33.9	0	0	0	110.7	L338 H347 K349	L338-P340 WeakPolarHBondContact O-CD 3.23Å; P340-H347 CarbonylContact C-O 3.56Å; P340-H347 WeakPolarHBondContact CA-O 3.45Å; P340-K349 WeakPolarHBondContact O-CE 3.46Å
341	S	85	Confident	80.8	Confident	31 Å²	31	67.5 Å²	67.5	22%	0.217	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-82.1	140.2	176.4	-164.7	0	0	0	0	111.6	G344 Y346 H347 D352	S341-G344 PolarHBondContact OG-N 3.39Å; S341-Y346 WeakPolarHBondContact CB-O 3.43Å; S341-H347 PolarHBondContact N-O 2.97Å; S341-D352 WeakPolarHBondContact CB-OD2 3.2Å; S341-D352 PolarHBondContact OG-OD2 3.5Å
342	T	80.7	Confident	81.4	Confident	138 Å²	138	60.5 Å²	60.5	85%	0.847	37%	0.366	S	S	*	.	S	Bend	trans	-99.1	84.5	174.4	53.5	0	0	0	0	109.3
343	G	78.1	Confident	81.7	Confident	84 Å²	84	61.9 Å²	61.9	87%	0.866	37%	0.374	S	S	*	.	S	Bend	trans	88.3	19.5	175.6	0	0	0	0	0	115.8
344	G	78.2	Confident	82.4	Confident	37 Å²	37	55 Å²	55	38%	0.381	34%	0.343	S	S	.	.			trans	-75.4	173.2	169.4	0	0	0	0	0	113.6	S341 D352	S341-G344 PolarHBondContact OG-N 3.39Å; G344-D352 WeakPolarHBondContact CA-OD2 3.5Å
345	A	83.3	Confident	83.4	Confident	83 Å²	83	52.6 Å²	52.6	69%	0.686	33%	0.331	S	S	*	.	S	Bend	trans	-72.8	-23.6	172	0	0	0	0	0	111.5	D352	A345-D352 PolarHBondContact N-OD1 3.36Å
346	Y	90.2	Very high	84.4	Confident	26 Å²	26	53.1 Å²	53.1	10%	0.102	33%	0.328	C	S	.	.	S	Bend	trans	-107.1	157.2	-179.3	-61.6	-84.8	0	0	0	111.3	S341 H351 D352 C355 D430 Q433 F434	S341-Y346 WeakPolarHBondContact CB-O 3.43Å; Y346-H351 HydrophobicContact CD1-CB 3.58Å; Y346-H351 HydrophobicContact CD2-CB 4.06Å; Y346-H351 HydrophobicContact CE1-CB 4.18Å; Y346-H351 HydrophobicContact CG-CB 3.5Å; Y346-D352 WeakPolarHBondContact CD2-OD1 3.43Å; Y346-C355 HydrophobicContact CE2-CB 4.17Å; Y346-C355 WeakPolarHBondContact CE2-SG 3.37Å; Y346-C355 PolarHBondContact OH-SG 3.16Å; Y346-D430 HydrophobicContact CD1-CB 3.96Å; Y346-Q433 HydrophobicContact CD1-CB 4.35Å; Y346-Q433 HydrophobicContact CE1-CB 3.7Å; Y346-F434 HydrophobicContact CE1-CB 4.37Å
347	H	86.9	Confident	85.3	Confident	66 Å²	66	51.4 Å²	51.4	31%	0.306	32%	0.32	S	S	.	.	S	Bend	trans	-69.9	-38.8	174.2	-174.1	86.2	0	0	0	111.8	P340 S341 H426 D430	P340-H347 CarbonylContact C-O 3.56Å; P340-H347 WeakPolarHBondContact CA-O 3.45Å; S341-H347 PolarHBondContact N-O 2.97Å; H347-H426 HydrophobicContact CB-CB 4.12Å; H347-H426 AromaticContact CD2-CG 3.99Å; H347-H426 AromaticContact CE1-CD2 3.75Å; H347-H426 AromaticContact CE1-CG 3.99Å; H347-H426 AromaticContact CG-CD2 3.63Å; H347-H426 AromaticContact CG-CG 3.86Å; H347-H426 AromaticContact ND1-CD2 3.34Å; H347-H426 PolarHBondContact ND1-CD2 3.23Å; H347-H426 VanDerWaalsContact ND1-CD2 3.34Å; H347-H426 AromaticContact ND1-CG 3.88Å; H347-H426 AromaticContact ND1-NE2 3.93Å; H347-D430 WeakPolarHBondContact CA-OD2 3.17Å; H347-D430 WeakPolarHBondContact CB-OD2 3.17Å; H347-D430 VanDerWaalsContact N-CG 3.31Å; H347-D430 PolarHBondContact N-OD1 3.11Å; H347-D430 PolarHBondContact N-OD2 3.34Å
348	Y	90.7	Very high	85.8	Confident	5 Å²	5	47 Å²	47	2%	0.02	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-101.2	137.7	179.4	-65.4	-64.6	0	0	0	112.7	L338 L350 H351 D423 H426 F427 D430	L338-Y348 HydrophobicContact CB-CD1 3.45Å; L338-Y348 VanDerWaalsContact CB-CD1 3.45Å; L338-Y348 HydrophobicContact CB-CE1 3.52Å; L338-Y348 HydrophobicContact CB-CG 4.2Å; L338-Y348 HydrophobicContact CD1-CD1 4.21Å; L338-Y348 HydrophobicContact CD1-CD2 4.25Å; L338-Y348 HydrophobicContact CD1-CE1 4.22Å; L338-Y348 HydrophobicContact CD1-CE2 4.22Å; L338-Y348 HydrophobicContact CD1-CG 4.24Å; L338-Y348 HydrophobicContact CG-CD1 4.47Å; L338-Y348 HydrophobicContact CG-CE1 4.49Å; Y348-L350 PolarHBondContact O-N 2.77Å; Y348-H351 PolarHBondContact O-N 2.73Å; Y348-H351 VanDerWaalsContact O-N 3.15Å; Y348-D423 VanDerWaalsContact OH-CA 3.25Å; Y348-D423 WeakPolarHBondContact OH-CA 3.46Å; Y348-D423 VanDerWaalsContact OH-CB 3.31Å; Y348-D423 WeakPolarHBondContact OH-CB 3.48Å; Y348-D423 PolarHBondContact OH-O 3.41Å; Y348-H426 HydrophobicContact CE2-CB 4.06Å; Y348-F427 HydrophobicContact CD2-CB 4.4Å; Y348-F427 HydrophobicContact CD2-CD2 4.2Å; Y348-F427 HydrophobicContact CE2-CB 3.81Å; Y348-F427 HydrophobicContact CE2-CD2 4.27Å; Y348-D430 WeakPolarHBondContact CD2-OD2 3.31Å; Y348-D430 PolarHBondContact N-OD2 2.96Å
349	K	88.3	Confident	85.7	Confident	91 Å²	91	50.4 Å²	50.4	40%	0.396	31%	0.307	S	S	.	.	H	α-helix	trans	-57.8	-25.3	174.8	-67.2	-174.5	-168	165.9	0	112.9	E339 P340 L353	E339-K349 HydrophobicContact CB-CD 4.03Å; E339-K349 HydrophobicContact CB-CG 4.39Å; E339-K349 PolarHBondContact O-N 3.31Å; E339-K349 WeakPolarHBondContact OE2-CD 3.26Å; E339-K349 IonicContact OE2-NZ 3.46Å; E339-K349 PolarHBondContact OE2-NZ 3.11Å; P340-K349 WeakPolarHBondContact O-CE 3.46Å; K349-L353 VanDerWaalsContact O-CB 3.3Å; K349-L353 WeakPolarHBondContact O-CB 3.41Å; K349-L353 PolarHBondContact O-N 3.32Å
350	L	89.9	Confident	85.3	Confident	18 Å²	18	48 Å²	48	9%	0.094	29%	0.294	C	S	.	.	H	α-helix	trans	-57	-49.1	177.6	179	63.9	0	0	0	111.5	M332 Y348 L353 L354 F394 F427	M332-L350 HydrophobicContact CE-CD1 3.63Å; M332-L350 HydrophobicContact CE-CG 4.37Å; M332-L350 HydrophobicContact CG-CD1 3.71Å; Y348-L350 PolarHBondContact O-N 2.77Å; L350-L353 WeakPolarHBondContact O-CB 3.34Å; L350-L353 PolarHBondContact O-N 3.22Å; L350-L354 HydrophobicContact CG-CD1 4.29Å; L350-L354 WeakPolarHBondContact O-CG 3.4Å; L350-L354 PolarHBondContact O-N 3.42Å; L350-F394 HydrophobicContact CD2-CD1 3.93Å; L350-F394 HydrophobicContact CD2-CE1 3.33Å; L350-F394 HydrophobicContact CD2-CZ 3.7Å; L350-F427 HydrophobicContact CD2-CE2 4.48Å
351	H	92	Very high	84.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-74.5	-35.7	-176.6	-63.3	77.1	0	0	0	111.9	Y346 Y348 L353 L354 C355 Y391 F427 D430 G431	Y346-H351 HydrophobicContact CD1-CB 3.58Å; Y346-H351 HydrophobicContact CD2-CB 4.06Å; Y346-H351 HydrophobicContact CE1-CB 4.18Å; Y346-H351 HydrophobicContact CG-CB 3.5Å; Y348-H351 PolarHBondContact O-N 2.73Å; Y348-H351 VanDerWaalsContact O-N 3.15Å; H351-L353 VanDerWaalsContact C-N 3.32Å; H351-L353 PolarHBondContact O-N 3.01Å; H351-L354 PolarHBondContact O-N 2.66Å; H351-C355 PolarHBondContact O-N 3.27Å; H351-C355 PolarHBondContact O-SG 3.44Å; H351-Y391 PolarHBondContact NE2-OH 3.36Å; H351-Y391 VanDerWaalsContact NE2-OH 3.11Å; H351-F427 AromaticContact CE1-CD2 3.78Å; H351-F427 AromaticContact CE1-CE2 3.65Å; H351-D430 HydrophobicContact CB-CB 4.33Å; H351-D430 PolarHBondContact CD2-O 2.91Å; H351-D430 IonicContact ND1-OD2 3.7Å; H351-D430 WeakPolarHBondContact NE2-CB 3.28Å; H351-G431 PolarHBondContact NE2-N 3.31Å
352	D	89.6	Confident	84.4	Confident	24 Å²	24	43.2 Å²	43.2	13%	0.128	26%	0.261	C	S	.	.	H	α-helix	trans	-58.2	-45.8	168.5	-73.6	-49.9	0	0	0	110.9	S341 G344 A345 Y346 L354 C355 N356	S341-D352 WeakPolarHBondContact CB-OD2 3.2Å; S341-D352 PolarHBondContact OG-OD2 3.5Å; G344-D352 WeakPolarHBondContact CA-OD2 3.5Å; A345-D352 PolarHBondContact N-OD1 3.36Å; Y346-D352 WeakPolarHBondContact CD2-OD1 3.43Å; D352-L354 PolarHBondContact O-N 2.96Å; D352-C355 PolarHBondContact O-N 2.9Å; D352-N356 VanDerWaalsContact O-CB 3.32Å; D352-N356 WeakPolarHBondContact O-CB 3.49Å; D352-N356 PolarHBondContact O-N 3.39Å; D352-N356 PolarHBondContact O-ND2 3.33Å
353	L	87.5	Confident	83.6	Confident	39 Å²	39	38.2 Å²	38.2	20%	0.204	23%	0.232	C	C	.	.	H	α-helix	trans	-62.3	-43.6	178.6	177.7	66.7	0	0	0	112	L328 R331 K349 L350 H351 N356 T357	L328-L353 HydrophobicContact CD1-CD2 3.87Å; L328-L353 HydrophobicContact CD1-CG 4.24Å; R331-L353 HydrophobicContact CB-CD2 4.46Å; R331-L353 VanDerWaalsContact CD-CD2 3.41Å; K349-L353 VanDerWaalsContact O-CB 3.3Å; K349-L353 WeakPolarHBondContact O-CB 3.41Å; K349-L353 PolarHBondContact O-N 3.32Å; L350-L353 WeakPolarHBondContact O-CB 3.34Å; L350-L353 PolarHBondContact O-N 3.22Å; H351-L353 VanDerWaalsContact C-N 3.32Å; H351-L353 PolarHBondContact O-N 3.01Å; L353-N356 PolarHBondContact O-N 2.99Å; L353-T357 VanDerWaalsContact O-CB 3.26Å; L353-T357 WeakPolarHBondContact O-CB 3.43Å; L353-T357 PolarHBondContact O-N 3.19Å; L353-T357 PolarHBondContact O-OG1 2.95Å
354	L	89.9	Confident	82.6	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.8	-46.3	177.2	-79.7	166.5	0	0	0	111.6	L328 M332 L350 H351 D352 T357 L358 V387 Y391 F434	L328-L354 HydrophobicContact CD1-CD2 3.9Å; L328-L354 HydrophobicContact CD1-CG 4.33Å; L328-L354 HydrophobicContact CD2-CD2 3.86Å; L328-L354 HydrophobicContact CG-CD2 4.48Å; M332-L354 HydrophobicContact CE-CD1 3.71Å; M332-L354 HydrophobicContact CE-CD2 3.64Å; M332-L354 HydrophobicContact CE-CG 3.9Å; L350-L354 HydrophobicContact CG-CD1 4.29Å; L350-L354 WeakPolarHBondContact O-CG 3.4Å; L350-L354 PolarHBondContact O-N 3.42Å; H351-L354 PolarHBondContact O-N 2.66Å; D352-L354 PolarHBondContact O-N 2.96Å; L354-T357 PolarHBondContact O-N 2.94Å; L354-L358 WeakPolarHBondContact O-CG 3.27Å; L354-L358 PolarHBondContact O-N 3.39Å; L354-V387 HydrophobicContact CD2-CG1 3.64Å; L354-Y391 HydrophobicContact CD1-CD2 3.39Å; L354-Y391 HydrophobicContact CD1-CE2 3.7Å; L354-Y391 HydrophobicContact CD1-CG 4.02Å; L354-F434 HydrophobicContact CB-CD2 4.49Å; L354-F434 HydrophobicContact CB-CE2 3.77Å; L354-F434 HydrophobicContact CB-CZ 3.96Å; L354-F434 HydrophobicContact CD1-CE1 4.4Å; L354-F434 HydrophobicContact CD1-CZ 4.29Å
355	C	87.8	Confident	81.1	Confident	8 Å²	8	46.5 Å²	46.5	5%	0.054	24%	0.238	C	C	.	.	H	α-helix	trans	-62.4	-51.1	177.6	-66.4	0	0	0	0	111.3	Y346 H351 D352 T357 L358 E359 F437	Y346-C355 HydrophobicContact CE2-CB 4.17Å; Y346-C355 WeakPolarHBondContact CE2-SG 3.37Å; Y346-C355 PolarHBondContact OH-SG 3.16Å; H351-C355 PolarHBondContact O-N 3.27Å; H351-C355 PolarHBondContact O-SG 3.44Å; D352-C355 PolarHBondContact O-N 2.9Å; C355-T357 PolarHBondContact O-N 3.38Å; C355-L358 PolarHBondContact O-N 3Å; C355-L358 VanDerWaalsContact O-N 3.12Å; C355-E359 WeakPolarHBondContact O-CG 3.45Å; C355-E359 PolarHBondContact O-N 3.01Å; C355-F437 HydrophobicContact CB-CD1 4.44Å; C355-F437 HydrophobicContact CB-CE1 3.87Å; C355-F437 HydrophobicContact CB-CE2 4.22Å; C355-F437 HydrophobicContact CB-CZ 3.69Å
356	N	84.5	Confident	79	Confident	95 Å²	95	51.4 Å²	51.4	51%	0.508	25%	0.247	S	C	.	.	H	α-helix	trans	-57.6	-38.5	177.4	-72.2	-35.8	0	0	0	111.9	D352 L353 K360	D352-N356 VanDerWaalsContact O-CB 3.32Å; D352-N356 WeakPolarHBondContact O-CB 3.49Å; D352-N356 PolarHBondContact O-N 3.39Å; D352-N356 PolarHBondContact O-ND2 3.33Å; L353-N356 PolarHBondContact O-N 2.99Å; N356-K360 WeakPolarHBondContact O-CB 3.46Å; N356-K360 PolarHBondContact O-N 3.5Å
357	T	83.4	Confident	76.5	Confident	13 Å²	13	52.2 Å²	52.2	8%	0.08	26%	0.256	C	S	.	.	H	α-helix	trans	-63.9	-48	176.9	-62.5	0	0	0	0	111	T324 L353 L354 C355 K360 V361 V387	T324-T357 HydrophobicContact CG2-CG2 3.42Å; T324-T357 VanDerWaalsContact CG2-CG2 3.42Å; L353-T357 VanDerWaalsContact O-CB 3.26Å; L353-T357 WeakPolarHBondContact O-CB 3.43Å; L353-T357 PolarHBondContact O-N 3.19Å; L353-T357 PolarHBondContact O-OG1 2.95Å; L354-T357 PolarHBondContact O-N 2.94Å; C355-T357 PolarHBondContact O-N 3.38Å; T357-K360 WeakPolarHBondContact O-CB 3.38Å; T357-K360 PolarHBondContact O-N 3.33Å; T357-V361 VanDerWaalsContact O-CG2 3.29Å; T357-V361 WeakPolarHBondContact O-CG2 3.46Å; T357-V361 PolarHBondContact O-N 3.44Å; T357-V387 HydrophobicContact CG2-CG2 4.43Å
358	L	83.6	Confident	74.3	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-69.9	-39.6	-179.3	-69.9	174.1	0	0	0	112.8	L354 C355 K360 V361 W362 T384 V387 F434 F437 L438 I441	L354-L358 WeakPolarHBondContact O-CG 3.27Å; L354-L358 PolarHBondContact O-N 3.39Å; C355-L358 PolarHBondContact O-N 3Å; C355-L358 VanDerWaalsContact O-N 3.12Å; L358-K360 VanDerWaalsContact C-N 3.3Å; L358-K360 PolarHBondContact O-N 3.16Å; L358-V361 PolarHBondContact O-N 3.08Å; L358-W362 PolarHBondContact O-N 3.12Å; L358-T384 HydrophobicContact CD2-CG2 4.02Å; L358-V387 HydrophobicContact CD2-CB 4.23Å; L358-V387 HydrophobicContact CD2-CG1 4.08Å; L358-V387 HydrophobicContact CG-CG1 4.28Å; L358-F434 HydrophobicContact CD1-CE2 4Å; L358-F434 HydrophobicContact CD1-CZ 3.88Å; L358-F437 HydrophobicContact CB-CE1 4.37Å; L358-F437 HydrophobicContact CD1-CE1 4.35Å; L358-L438 HydrophobicContact CD1-CD2 3.3Å; L358-I441 HydrophobicContact CB-CD1 4.29Å
359	E	81.1	Confident	72.2	Confident	99 Å²	99	55.7 Å²	55.7	46%	0.463	28%	0.281	S	S	.	.	H	α-helix	trans	-62.2	-40.3	172	-69	-170.4	158.4	0	0	111.2	C355 V361 W362 S363 F437 I441	C355-E359 WeakPolarHBondContact O-CG 3.45Å; C355-E359 PolarHBondContact O-N 3.01Å; E359-V361 VanDerWaalsContact C-N 3.3Å; E359-V361 PolarHBondContact O-N 2.83Å; E359-W362 PolarHBondContact O-N 3.43Å; E359-S363 WeakPolarHBondContact O-CA 3.23Å; E359-S363 WeakPolarHBondContact O-CB 3.35Å; E359-S363 PolarHBondContact O-N 3.44Å; E359-S363 PolarHBondContact O-OG 3.02Å; E359-F437 HydrophobicContact CG-CE2 4.07Å; E359-F437 HydrophobicContact CG-CZ 3.8Å; E359-I441 HydrophobicContact CG-CD1 4.31Å
360	K	76	Confident	70.5	Confident	71 Å²	71	53.4 Å²	53.4	31%	0.309	28%	0.277	S	S	.	.	H	α-helix	trans	-61.8	-37	175.3	-178.4	179.1	176.8	166.8	0	112.4	N356 T357 L358 D369 L371	N356-K360 WeakPolarHBondContact O-CB 3.46Å; N356-K360 PolarHBondContact O-N 3.5Å; T357-K360 WeakPolarHBondContact O-CB 3.38Å; T357-K360 PolarHBondContact O-N 3.33Å; L358-K360 VanDerWaalsContact C-N 3.3Å; L358-K360 PolarHBondContact O-N 3.16Å; K360-D369 WeakPolarHBondContact CE-OD2 3.04Å; K360-D369 HydrophobicContact CG-CB 4.34Å; K360-D369 IonicContact NZ-OD2 2.75Å; K360-D369 PolarHBondContact NZ-OD2 3.36Å; K360-L371 HydrophobicContact CG-CD1 4.21Å
361	V	76.5	Confident	68.8	Low	1 Å²	1	52.9 Å²	52.9	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-66.7	-37.2	177.3	172.5	0	0	0	0	112.2	T357 L358 E359 L371 C380 L383	T357-V361 VanDerWaalsContact O-CG2 3.29Å; T357-V361 WeakPolarHBondContact O-CG2 3.46Å; T357-V361 PolarHBondContact O-N 3.44Å; L358-V361 PolarHBondContact O-N 3.08Å; E359-V361 VanDerWaalsContact C-N 3.3Å; E359-V361 PolarHBondContact O-N 2.83Å; V361-L371 HydrophobicContact CG2-CD1 4.31Å; V361-C380 HydrophobicContact CG1-CB 3.86Å; V361-L383 HydrophobicContact CB-CD2 4.36Å; V361-L383 HydrophobicContact CG1-CD2 4.07Å; V361-L383 HydrophobicContact CG2-CD2 3.29Å; V361-L383 HydrophobicContact CG2-CG 4.13Å
362	W	74	Confident	66.9	Low	8 Å²	8	53.9 Å²	53.9	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-107.3	-9.2	-172.6	-67.6	99.6	0	0	0	115.9	L358 E359 F372 C380 L381 T384 L445 L446	L358-W362 PolarHBondContact O-N 3.12Å; E359-W362 PolarHBondContact O-N 3.43Å; W362-F372 AromaticContact CE3-CD2 3.8Å; W362-F372 HydrophobicContact CE3-CD2 3.8Å; W362-F372 AromaticContact CE3-CE2 3.77Å; W362-F372 HydrophobicContact CE3-CE2 3.77Å; W362-F372 AromaticContact CZ3-CD2 3.9Å; W362-F372 HydrophobicContact CZ3-CD2 3.9Å; W362-F372 AromaticContact CZ3-CE2 3.49Å; W362-F372 HydrophobicContact CZ3-CE2 3.49Å; W362-F372 VanDerWaalsContact CZ3-CE2 3.49Å; W362-F372 HydrophobicContact CZ3-CZ 4.35Å; W362-C380 HydrophobicContact CH2-CB 3.82Å; W362-C380 HydrophobicContact CZ2-CB 3.85Å; W362-C380 HydrophobicContact CZ3-CB 4.22Å; W362-L381 HydrophobicContact CH2-CB 4.41Å; W362-L381 HydrophobicContact CZ2-CB 4.41Å; W362-T384 PolarHBondContact NE1-OG1 2.92Å; W362-L445 HydrophobicContact CB-CD1 3.58Å; W362-L445 HydrophobicContact CG-CD1 4.43Å; W362-L446 HydrophobicContact CE3-CD2 4.47Å; W362-L446 HydrophobicContact CH2-CD2 3.15Å; W362-L446 HydrophobicContact CH2-CG 3.99Å; W362-L446 HydrophobicContact CZ2-CD1 4.33Å; W362-L446 HydrophobicContact CZ2-CD2 3.62Å; W362-L446 HydrophobicContact CZ2-CG 4.14Å; W362-L446 HydrophobicContact CZ3-CD2 3.61Å; W362-L446 HydrophobicContact CZ3-CG 4.19Å
363	S	64.1	Low	65.5	Low	32 Å²	32	54 Å²	54	22%	0.224	28%	0.281	C	S	.	.			trans	-75.3	136.9	-176	56.8	0	0	0	0	113.3	E359 S367	E359-S363 WeakPolarHBondContact O-CA 3.23Å; E359-S363 WeakPolarHBondContact O-CB 3.35Å; E359-S363 PolarHBondContact O-N 3.44Å; E359-S363 PolarHBondContact O-OG 3.02Å; S363-S367 PolarHBondContact OG-OG 3.26Å
364	E	56.4	Low	64.2	Low	121 Å²	121	57.8 Å²	57.8	57%	0.565	30%	0.301	S	S	*	.	S	Bend	trans	-98.1	-33	178.8	-158	163.4	-154.6	0	0	111.5	K449	E364-K449 IonicContact OE1-NZ 3.52Å; E364-K449 PolarHBondContact OE1-NZ 2.77Å; E364-K449 IonicContact OE2-NZ 3.32Å; E364-K449 PolarHBondContact OE2-NZ 2.79Å
365	E	47	Very low	62.9	Low	174 Å²	174	62.4 Å²	62.4	81%	0.813	33%	0.331	S	S	*	.	S	Bend	trans	-108.2	-30.8	-157.7	-74.4	-177	152.2	0	0	117.5
366	Q	40.3	Very low	61.9	Low	186 Å²	186	62.6 Å²	62.6	87%	0.869	33%	0.331	S	S	*	.	S	Bend	trans	-133.4	2.1	-160.5	-69.7	-167	11.2	0	0	118.3
367	S	36.9	Very low	61.3	Low	43 Å²	43	58.2 Å²	58.2	30%	0.301	31%	0.308	S	S	.	.	S	Bend	trans	-118.7	140.8	169.2	74.4	0	0	0	0	109.6	S363 D369	S363-S367 PolarHBondContact OG-OG 3.26Å; S367-D369 PolarHBondContact O-N 3.01Å
368	T	41.1	Very low	60.8	Low	107 Å²	107	64.9 Å²	64.9	66%	0.656	33%	0.332	S	S	*	.	S	Bend	trans	-50.9	-13.4	-179.5	35.2	0	0	0	0	114.8	R276	R276-T368 PolarHBondContact NE-O 3.41Å; R276-T368 PolarHBondContact NH1-O 3.25Å; R276-T368 PolarHBondContact NH2-O 3.12Å
369	D	47.3	Very low	60.4	Low	37 Å²	37	66 Å²	66	20%	0.198	34%	0.341	C	S	.	.			trans	-110.3	73.9	-170.5	-60	-18.1	0	0	0	110.7	R276 K360 S367 L371	R276-D369 IonicContact CZ-OD1 2.74Å; R276-D369 IonicContact NH1-OD1 3.57Å; R276-D369 PolarHBondContact NH1-OD1 2.88Å; R276-D369 IonicContact NH2-OD1 2.57Å; K360-D369 WeakPolarHBondContact CE-OD2 3.04Å; K360-D369 HydrophobicContact CG-CB 4.34Å; K360-D369 IonicContact NZ-OD2 2.75Å; K360-D369 PolarHBondContact NZ-OD2 3.36Å; S367-D369 PolarHBondContact O-N 3.01Å; D369-L371 PolarHBondContact O-N 2.92Å
370	C	52.6	Low	60.2	Low	44 Å²	44	61.3 Å²	61.3	30%	0.297	32%	0.319	S	S	.	.			trans	-64.3	74.2	174.7	-58.6	0	0	0	0	112.1	K280 F372	K280-C370 WeakPolarHBondContact CE-SG 3.42Å; K280-C370 PolarHBondContact NZ-SG 3.2Å; C370-F372 VanDerWaalsContact C-N 3.33Å
371	L	52.5	Low	60.4	Low	6 Å²	6	58 Å²	58	3%	0.031	30%	0.304	C	S	.	.			trans	-71.2	-30.9	174.9	-73.6	169.7	0	0	0	111.5	C320 K360 V361 D369 S373 L376	C320-L371 HydrophobicContact CB-CD2 3.71Å; K360-L371 HydrophobicContact CG-CD1 4.21Å; V361-L371 HydrophobicContact CG2-CD1 4.31Å; D369-L371 PolarHBondContact O-N 2.92Å; L371-S373 PolarHBondContact O-N 3.45Å; L371-L376 VanDerWaalsContact O-CD1 3.31Å; L371-L376 WeakPolarHBondContact O-CD1 3.26Å
372	F	52.8	Low	60.5	Low	21 Å²	21	61.1 Å²	61.1	9%	0.092	32%	0.32	C	S	.	.			trans	-83.3	119.3	-178.3	-171.1	-108	0	0	0	112.1	W362 C370 A377 C380 K449	W362-F372 AromaticContact CE3-CD2 3.8Å; W362-F372 HydrophobicContact CE3-CD2 3.8Å; W362-F372 AromaticContact CE3-CE2 3.77Å; W362-F372 HydrophobicContact CE3-CE2 3.77Å; W362-F372 AromaticContact CZ3-CD2 3.9Å; W362-F372 HydrophobicContact CZ3-CD2 3.9Å; W362-F372 AromaticContact CZ3-CE2 3.49Å; W362-F372 HydrophobicContact CZ3-CE2 3.49Å; W362-F372 VanDerWaalsContact CZ3-CE2 3.49Å; W362-F372 HydrophobicContact CZ3-CZ 4.35Å; C370-F372 VanDerWaalsContact C-N 3.33Å; F372-A377 HydrophobicContact CE2-CB 3.94Å; F372-A377 HydrophobicContact CZ-CB 4.47Å; F372-C380 HydrophobicContact CD2-CB 4.47Å; F372-K449 HydrophobicContact CE1-CD 4.36Å; F372-K449 HydrophobicContact CE1-CG 4.46Å; F372-K449 HydrophobicContact CZ-CG 4.37Å
373	S	59.9	Low	60.8	Low	27 Å²	27	60.9 Å²	60.9	19%	0.189	32%	0.319	C	S	.	.			trans	-133.8	148.5	157.2	67.9	0	0	0	0	107.6	L371 P375 L376 A377	L371-S373 PolarHBondContact O-N 3.45Å; S373-P375 VanDerWaalsContact C-N 3.26Å; S373-P375 VanDerWaalsContact O-N 3.15Å; S373-L376 CarbonylContact O-C 3.59Å; S373-L376 WeakPolarHBondContact O-CA 3.31Å; S373-L376 WeakPolarHBondContact O-CB 3.44Å; S373-L376 PolarHBondContact O-N 3.46Å; S373-L376 WeakPolarHBondContact OG-CD1 3.39Å; S373-L376 WeakPolarHBondContact OG-CG 3.31Å; S373-A377 PolarHBondContact O-N 3.03Å
374	L	61.6	Low	61.8	Low	118 Å²	118	59.9 Å²	59.9	62%	0.618	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-50.7	-39.7	-179.2	-174.3	66.6	0	0	0	113.4	L376 A377	L374-L376 PolarHBondContact O-N 3.46Å; L374-A377 WeakPolarHBondContact O-CB 3.35Å; L374-A377 PolarHBondContact O-N 2.95Å
375	P	61.1	Low	63.2	Low	97 Å²	97	56.5 Å²	56.5	63%	0.63	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-62.5	-19.3	173.3	-24.2	35.8	0	0	0	115.5	S373	S373-P375 VanDerWaalsContact C-N 3.26Å; S373-P375 VanDerWaalsContact O-N 3.15Å
376	L	67.2	Low	65.1	Low	12 Å²	12	54.3 Å²	54.3	6%	0.063	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-100	-0.6	178.9	-66.4	173.7	0	0	0	113.5	V313 H317 L371 S373 L374 W378 S379 C380	V313-L376 HydrophobicContact CB-CD2 4.12Å; V313-L376 HydrophobicContact CG1-CD1 3.54Å; V313-L376 HydrophobicContact CG1-CD2 3.65Å; V313-L376 HydrophobicContact CG1-CG 3.82Å; H317-L376 HydrophobicContact CB-CD2 4.11Å; L371-L376 VanDerWaalsContact O-CD1 3.31Å; L371-L376 WeakPolarHBondContact O-CD1 3.26Å; S373-L376 CarbonylContact O-C 3.59Å; S373-L376 WeakPolarHBondContact O-CA 3.31Å; S373-L376 WeakPolarHBondContact O-CB 3.44Å; S373-L376 PolarHBondContact O-N 3.46Å; S373-L376 WeakPolarHBondContact OG-CD1 3.39Å; S373-L376 WeakPolarHBondContact OG-CG 3.31Å; L374-L376 PolarHBondContact O-N 3.46Å; L376-W378 PolarHBondContact O-N 2.92Å; L376-W378 VanDerWaalsContact O-N 3.08Å; L376-S379 WeakPolarHBondContact O-CA 3.29Å; L376-S379 WeakPolarHBondContact O-CB 3.46Å; L376-S379 PolarHBondContact O-N 3.06Å; L376-C380 PolarHBondContact O-N 3.21Å; L376-C380 PolarHBondContact O-SG 3.38Å; L376-C380 VanDerWaalsContact O-SG 3.4Å
377	A	71.4	Confident	67.3	Low	4 Å²	4	45.5 Å²	45.5	3%	0.033	24%	0.238	C	C	.	.	H	α-helix	trans	-53.4	-37.9	-174.2	0	0	0	0	0	112.8	F372 S373 L374 C380 L381 W450	F372-A377 HydrophobicContact CE2-CB 3.94Å; F372-A377 HydrophobicContact CZ-CB 4.47Å; S373-A377 PolarHBondContact O-N 3.03Å; L374-A377 WeakPolarHBondContact O-CB 3.35Å; L374-A377 PolarHBondContact O-N 2.95Å; A377-C380 PolarHBondContact O-N 3.44Å; A377-L381 WeakPolarHBondContact O-CB 3.47Å; A377-L381 PolarHBondContact O-N 3.35Å; A377-W450 HydrophobicContact CB-CZ2 4.03Å
378	W	73.9	Confident	69.8	Low	152 Å²	152	43.6 Å²	43.6	58%	0.576	23%	0.225	S	C	*	.	H	α-helix	trans	-63.7	-41.9	175	-170.8	-111.9	0	0	0	112.9	L376 L381 I382 W450 V459	L376-W378 PolarHBondContact O-N 2.92Å; L376-W378 VanDerWaalsContact O-N 3.08Å; W378-L381 HydrophobicContact CE3-CD2 3.97Å; W378-L381 HydrophobicContact CZ3-CD2 3.74Å; W378-L381 PolarHBondContact O-N 2.75Å; W378-I382 HydrophobicContact CG-CD1 4.47Å; W378-I382 WeakPolarHBondContact O-CG1 3.46Å; W378-I382 PolarHBondContact O-N 3.4Å; W378-W450 AromaticContact CE3-CH2 3.9Å; W378-W450 HydrophobicContact CE3-CH2 3.9Å; W378-W450 HydrophobicContact CZ3-CH2 4.16Å; W378-V459 HydrophobicContact CZ3-CG2 4.23Å
379	S	74.3	Confident	72	Confident	27 Å²	27	42.7 Å²	42.7	19%	0.189	22%	0.216	C	C	.	.	H	α-helix	trans	-67.6	-40.4	177.6	-52.2	0	0	0	0	111.6	H317 L376 L381 I382 L383	H317-S379 WeakPolarHBondContact CE1-CB 3.44Å; H317-S379 PolarHBondContact CE1-O 2.83Å; H317-S379 VanDerWaalsContact ND1-CB 3.3Å; H317-S379 WeakPolarHBondContact ND1-CB 3.31Å; L376-S379 WeakPolarHBondContact O-CA 3.29Å; L376-S379 WeakPolarHBondContact O-CB 3.46Å; L376-S379 PolarHBondContact O-N 3.06Å; S379-L381 VanDerWaalsContact C-N 3.3Å; S379-L381 PolarHBondContact O-N 3.27Å; S379-I382 PolarHBondContact O-N 2.73Å; S379-L383 PolarHBondContact O-N 2.84Å
380	C	77.4	Confident	74	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.1	-39.1	174.5	-59.6	0	0	0	0	111.6	H317 V361 W362 F372 L376 A377 L383 T384	H317-C380 PolarHBondContact NE2-N 3.32Å; V361-C380 HydrophobicContact CG1-CB 3.86Å; W362-C380 HydrophobicContact CH2-CB 3.82Å; W362-C380 HydrophobicContact CZ2-CB 3.85Å; W362-C380 HydrophobicContact CZ3-CB 4.22Å; F372-C380 HydrophobicContact CD2-CB 4.47Å; L376-C380 PolarHBondContact O-N 3.21Å; L376-C380 PolarHBondContact O-SG 3.38Å; L376-C380 VanDerWaalsContact O-SG 3.4Å; A377-C380 PolarHBondContact O-N 3.44Å; C380-L383 PolarHBondContact O-N 3.26Å; C380-T384 PolarHBondContact O-N 3.22Å; C380-T384 PolarHBondContact O-OG1 2.63Å
381	L	79.5	Confident	75.9	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-64.6	-46.1	175	-176.3	69.6	0	0	0	111.9	W362 A377 W378 S379 L383 T384 F385 L446 W450 V459 V463	W362-L381 HydrophobicContact CH2-CB 4.41Å; W362-L381 HydrophobicContact CZ2-CB 4.41Å; A377-L381 WeakPolarHBondContact O-CB 3.47Å; A377-L381 PolarHBondContact O-N 3.35Å; W378-L381 HydrophobicContact CE3-CD2 3.97Å; W378-L381 HydrophobicContact CZ3-CD2 3.74Å; W378-L381 PolarHBondContact O-N 2.75Å; S379-L381 VanDerWaalsContact C-N 3.3Å; S379-L381 PolarHBondContact O-N 3.27Å; L381-L383 VanDerWaalsContact C-N 3.29Å; L381-L383 PolarHBondContact O-N 3.47Å; L381-T384 WeakPolarHBondContact O-CB 3.3Å; L381-T384 PolarHBondContact O-N 3.46Å; L381-F385 HydrophobicContact CD1-CD2 4.17Å; L381-F385 HydrophobicContact CD1-CE2 3.59Å; L381-F385 HydrophobicContact CD1-CZ 4.15Å; L381-F385 HydrophobicContact CD2-CE2 3.93Å; L381-F385 HydrophobicContact CG-CD2 3.88Å; L381-F385 HydrophobicContact CG-CE2 3.49Å; L381-F385 VanDerWaalsContact CG-CE2 3.49Å; L381-F385 HydrophobicContact CG-CZ 4.48Å; L381-F385 WeakPolarHBondContact O-CD2 3.42Å; L381-F385 PolarHBondContact O-N 3.23Å; L381-L446 HydrophobicContact CD1-CD2 4.16Å; L381-W450 HydrophobicContact CD2-CH2 3.91Å; L381-V459 HydrophobicContact CD1-CG1 3.82Å; L381-V459 HydrophobicContact CD2-CB 4.37Å; L381-V459 HydrophobicContact CD2-CG1 3.63Å; L381-V459 HydrophobicContact CD2-CG2 3.74Å; L381-V459 HydrophobicContact CG-CG1 4.39Å; L381-V463 HydrophobicContact CD1-CG2 4.33Å
382	I	80	Confident	77.8	Confident	66 Å²	66	42.1 Å²	42.1	34%	0.338	21%	0.21	S	C	.	.	H	α-helix	trans	-57.7	-44.2	175.2	-70.2	166.8	0	0	0	110.8	W378 S379 F385 R386	W378-I382 HydrophobicContact CG-CD1 4.47Å; W378-I382 WeakPolarHBondContact O-CG1 3.46Å; W378-I382 PolarHBondContact O-N 3.4Å; S379-I382 PolarHBondContact O-N 2.73Å; I382-F385 PolarHBondContact O-N 3.36Å; I382-R386 WeakPolarHBondContact O-CG 3.35Å; I382-R386 PolarHBondContact O-N 3.42Å
383	L	80.2	Confident	79.6	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-63	-43.2	177.9	178	59.7	0	0	0	111.5	C321 L325 V361 S379 C380 L381 F385 R386 V387	C321-L383 HydrophobicContact CB-CD1 3.97Å; C321-L383 HydrophobicContact CB-CD2 4.46Å; L325-L383 HydrophobicContact CD1-CD1 3.69Å; L325-L383 HydrophobicContact CD2-CD1 3.88Å; L325-L383 HydrophobicContact CG-CD1 3.6Å; V361-L383 HydrophobicContact CB-CD2 4.36Å; V361-L383 HydrophobicContact CG1-CD2 4.07Å; V361-L383 HydrophobicContact CG2-CD2 3.29Å; V361-L383 HydrophobicContact CG2-CG 4.13Å; S379-L383 PolarHBondContact O-N 2.84Å; C380-L383 PolarHBondContact O-N 3.26Å; L381-L383 VanDerWaalsContact C-N 3.29Å; L381-L383 PolarHBondContact O-N 3.47Å; L383-F385 VanDerWaalsContact C-N 3.35Å; L383-F385 PolarHBondContact O-N 2.93Å; L383-R386 WeakPolarHBondContact O-CB 3.49Å; L383-R386 PolarHBondContact O-N 3.18Å; L383-R386 VanDerWaalsContact O-N 3.14Å; L383-V387 HydrophobicContact CD1-CG2 4.32Å; L383-V387 WeakPolarHBondContact O-CG2 3.41Å; L383-V387 PolarHBondContact O-N 3.18Å
384	T	83.7	Confident	81.1	Confident	11 Å²	11	44.8 Å²	44.8	7%	0.067	22%	0.222	C	C	.	.	H	α-helix	trans	-56.2	-50.3	176.2	-57.2	0	0	0	0	110.5	L358 W362 C380 L381 R386 V387 L388	L358-T384 HydrophobicContact CD2-CG2 4.02Å; W362-T384 PolarHBondContact NE1-OG1 2.92Å; C380-T384 PolarHBondContact O-N 3.22Å; C380-T384 PolarHBondContact O-OG1 2.63Å; L381-T384 WeakPolarHBondContact O-CB 3.3Å; L381-T384 PolarHBondContact O-N 3.46Å; T384-R386 VanDerWaalsContact C-N 3.3Å; T384-R386 PolarHBondContact O-N 3.04Å; T384-V387 PolarHBondContact O-N 3.32Å; T384-L388 HydrophobicContact CG2-CD1 4.31Å; T384-L388 VanDerWaalsContact O-CG 3.31Å; T384-L388 WeakPolarHBondContact O-CG 3.29Å; T384-L388 PolarHBondContact O-N 3.31Å
385	F	86.4	Confident	82.6	Confident	50 Å²	50	39.2 Å²	39.2	22%	0.219	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-36.6	177	-75.5	-59.2	0	0	0	113.6	L381 I382 L383 L388 N389 V462 V463	L381-F385 HydrophobicContact CD1-CD2 4.17Å; L381-F385 HydrophobicContact CD1-CE2 3.59Å; L381-F385 HydrophobicContact CD1-CZ 4.15Å; L381-F385 HydrophobicContact CD2-CE2 3.93Å; L381-F385 HydrophobicContact CG-CD2 3.88Å; L381-F385 HydrophobicContact CG-CE2 3.49Å; L381-F385 VanDerWaalsContact CG-CE2 3.49Å; L381-F385 HydrophobicContact CG-CZ 4.48Å; L381-F385 WeakPolarHBondContact O-CD2 3.42Å; L381-F385 PolarHBondContact O-N 3.23Å; I382-F385 PolarHBondContact O-N 3.36Å; L383-F385 VanDerWaalsContact C-N 3.35Å; L383-F385 PolarHBondContact O-N 2.93Å; F385-L388 PolarHBondContact O-N 2.92Å; F385-N389 WeakPolarHBondContact O-CB 3.25Å; F385-N389 PolarHBondContact O-N 3.28Å; F385-V462 HydrophobicContact CE1-CB 4.45Å; F385-V462 HydrophobicContact CE1-CG1 3.65Å; F385-V462 HydrophobicContact CE2-CG1 4.38Å; F385-V462 HydrophobicContact CZ-CB 4.07Å; F385-V462 HydrophobicContact CZ-CG1 3.55Å; F385-V463 HydrophobicContact CE1-CB 4.37Å; F385-V463 HydrophobicContact CE1-CG2 3.69Å; F385-V463 HydrophobicContact CE2-CG2 4.38Å; F385-V463 HydrophobicContact CZ-CB 4.42Å; F385-V463 HydrophobicContact CZ-CG2 3.41Å; F385-V463 VanDerWaalsContact CZ-CG2 3.41Å
386	R	86.5	Confident	84	Confident	129 Å²	129	35.8 Å²	35.8	49%	0.487	18%	0.176	S	C	.	.	H	α-helix	trans	-64.4	-46.4	175	-73.6	179.2	179.9	-171.3	-0.9	111.6	L325 I382 L383 T384 L388 N389 V390	L325-R386 HydrophobicContact CD1-CB 4.04Å; L325-R386 HydrophobicContact CD2-CB 4.11Å; I382-R386 WeakPolarHBondContact O-CG 3.35Å; I382-R386 PolarHBondContact O-N 3.42Å; L383-R386 WeakPolarHBondContact O-CB 3.49Å; L383-R386 PolarHBondContact O-N 3.18Å; L383-R386 VanDerWaalsContact O-N 3.14Å; T384-R386 VanDerWaalsContact C-N 3.3Å; T384-R386 PolarHBondContact O-N 3.04Å; R386-L388 VanDerWaalsContact C-N 3.32Å; R386-L388 PolarHBondContact O-N 3.33Å; R386-N389 PolarHBondContact O-N 3.03Å; R386-V390 VanDerWaalsContact O-CG2 3.3Å; R386-V390 WeakPolarHBondContact O-CG2 3.31Å; R386-V390 PolarHBondContact O-N 3.46Å
387	V	86.9	Confident	85.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-58.8	-45.3	176.3	171.7	0	0	0	0	110.8	L325 L328 L354 T357 L358 L383 T384 N389 V390 Y391	L325-V387 HydrophobicContact CD2-CG2 3.76Å; L328-V387 HydrophobicContact CD2-CB 4.45Å; L328-V387 HydrophobicContact CD2-CG1 3.93Å; L328-V387 HydrophobicContact CD2-CG2 4.2Å; L354-V387 HydrophobicContact CD2-CG1 3.64Å; T357-V387 HydrophobicContact CG2-CG2 4.43Å; L358-V387 HydrophobicContact CD2-CB 4.23Å; L358-V387 HydrophobicContact CD2-CG1 4.08Å; L358-V387 HydrophobicContact CG-CG1 4.28Å; L383-V387 HydrophobicContact CD1-CG2 4.32Å; L383-V387 WeakPolarHBondContact O-CG2 3.41Å; L383-V387 PolarHBondContact O-N 3.18Å; T384-V387 PolarHBondContact O-N 3.32Å; V387-N389 PolarHBondContact O-N 2.95Å; V387-V390 PolarHBondContact O-N 3.33Å; V387-Y391 PolarHBondContact O-N 3.14Å
388	L	89.3	Confident	86.1	Confident	3 Å²	3	39 Å²	39	2%	0.016	19%	0.19	C	C	.	.	H	α-helix	trans	-60.8	-45.1	177.2	-67.1	-177.8	0	0	0	112.2	T384 F385 R386 Y391 E392 L438 I470	T384-L388 HydrophobicContact CG2-CD1 4.31Å; T384-L388 VanDerWaalsContact O-CG 3.31Å; T384-L388 WeakPolarHBondContact O-CG 3.29Å; T384-L388 PolarHBondContact O-N 3.31Å; F385-L388 PolarHBondContact O-N 2.92Å; R386-L388 VanDerWaalsContact C-N 3.32Å; R386-L388 PolarHBondContact O-N 3.33Å; L388-Y391 PolarHBondContact O-N 3.23Å; L388-E392 WeakPolarHBondContact O-CB 3.3Å; L388-E392 PolarHBondContact O-N 2.89Å; L388-L438 HydrophobicContact CD2-CD1 3.39Å; L388-L438 HydrophobicContact CD2-CD2 3.78Å; L388-L438 HydrophobicContact CD2-CG 4.24Å; L388-I470 HydrophobicContact CB-CD1 4.05Å; L388-I470 HydrophobicContact CD2-CD1 3.9Å; L388-I470 HydrophobicContact CG-CD1 4.45Å
389	N	88.7	Confident	86.9	Confident	89 Å²	89	33.5 Å²	33.5	48%	0.476	17%	0.17	S	C	.	.	H	α-helix	trans	-65.3	-41.1	178.4	-175.1	27.1	0	0	0	112	F385 R386 V387 Y391 E392 N393	F385-N389 WeakPolarHBondContact O-CB 3.25Å; F385-N389 PolarHBondContact O-N 3.28Å; R386-N389 PolarHBondContact O-N 3.03Å; V387-N389 PolarHBondContact O-N 2.95Å; N389-Y391 VanDerWaalsContact C-N 3.31Å; N389-Y391 PolarHBondContact O-N 2.7Å; N389-E392 PolarHBondContact O-N 3.27Å; N389-N393 WeakPolarHBondContact O-CB 3.19Å; N389-N393 PolarHBondContact O-N 3.44Å; N389-N393 PolarHBondContact O-ND2 2.84Å; N389-N393 PolarHBondContact OD1-ND2 2.8Å
390	V	89	Confident	87.7	Confident	27 Å²	27	40.4 Å²	40.4	16%	0.164	19%	0.192	C	C	.	.	H	α-helix	trans	-62	-42.9	175.3	177.6	0	0	0	0	110.2	E329 M332 R386 V387 N393 F394	E329-V390 HydrophobicContact CG-CG1 4.04Å; E329-V390 HydrophobicContact CG-CG2 4.28Å; M332-V390 HydrophobicContact SD-CG1 3.48Å; M332-V390 WeakPolarHBondContact SD-CG1 3.44Å; R386-V390 VanDerWaalsContact O-CG2 3.3Å; R386-V390 WeakPolarHBondContact O-CG2 3.31Å; R386-V390 PolarHBondContact O-N 3.46Å; V387-V390 PolarHBondContact O-N 3.33Å; V390-N393 PolarHBondContact O-N 3.2Å; V390-F394 WeakPolarHBondContact O-CB 3.46Å; V390-F394 PolarHBondContact O-N 2.94Å
391	Y	92	Very high	88.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.3	-43.9	176.5	-179.9	-113.1	0	0	0	113.1	M332 H351 L354 V387 L388 N389 N393 F394 V395 F434 I470	M332-Y391 HydrophobicContact CE-CD2 3.91Å; H351-Y391 PolarHBondContact NE2-OH 3.36Å; H351-Y391 VanDerWaalsContact NE2-OH 3.11Å; L354-Y391 HydrophobicContact CD1-CD2 3.39Å; L354-Y391 HydrophobicContact CD1-CE2 3.7Å; L354-Y391 HydrophobicContact CD1-CG 4.02Å; V387-Y391 PolarHBondContact O-N 3.14Å; L388-Y391 PolarHBondContact O-N 3.23Å; N389-Y391 VanDerWaalsContact C-N 3.31Å; N389-Y391 PolarHBondContact O-N 2.7Å; Y391-N393 VanDerWaalsContact C-N 3.33Å; Y391-N393 PolarHBondContact O-N 3.03Å; Y391-F394 CarbonylContact O-C 3.38Å; Y391-F394 WeakPolarHBondContact O-CA 3.44Å; Y391-F394 WeakPolarHBondContact O-CB 3.46Å; Y391-F394 PolarHBondContact O-N 2.56Å; Y391-F394 VanDerWaalsContact O-N 3.13Å; Y391-V395 HydrophobicContact CD1-CG2 4.18Å; Y391-V395 HydrophobicContact CD2-CG2 4.28Å; Y391-V395 HydrophobicContact CE1-CG2 3.74Å; Y391-V395 HydrophobicContact CE2-CG2 3.87Å; Y391-V395 HydrophobicContact CG-CG2 4.45Å; Y391-V395 WeakPolarHBondContact O-CG2 3.12Å; Y391-V395 PolarHBondContact O-N 2.92Å; Y391-F434 HydrophobicContact CD1-CD1 4Å; Y391-F434 AromaticContact CD1-CE1 3.69Å; Y391-F434 HydrophobicContact CD1-CE1 3.69Å; Y391-F434 AromaticContact CE1-CD1 3.6Å; Y391-F434 HydrophobicContact CE1-CD1 3.6Å; Y391-F434 AromaticContact CE1-CE1 3.81Å; Y391-F434 HydrophobicContact CE1-CE1 3.81Å; Y391-F434 HydrophobicContact CG-CE1 4.2Å; Y391-I470 HydrophobicContact CD1-CD1 4.32Å; Y391-I470 HydrophobicContact CD1-CG2 3.95Å; Y391-I470 HydrophobicContact CE1-CG2 3.69Å
392	E	91.9	Very high	88.8	Confident	48 Å²	48	42.7 Å²	42.7	22%	0.224	20%	0.204	C	C	.	.	H	α-helix	trans	-58.9	-45.7	177.2	-173.7	178.5	176.3	0	0	111.5	L388 N389 F394 V395 G396 S469 I470	L388-E392 WeakPolarHBondContact O-CB 3.3Å; L388-E392 PolarHBondContact O-N 2.89Å; N389-E392 PolarHBondContact O-N 3.27Å; E392-F394 VanDerWaalsContact C-N 3.31Å; E392-F394 PolarHBondContact O-N 3.33Å; E392-V395 PolarHBondContact O-N 2.98Å; E392-G396 PolarHBondContact O-N 2.93Å; E392-S469 VanDerWaalsContact OE1-CB 3.31Å; E392-S469 WeakPolarHBondContact OE1-CB 3.17Å; E392-S469 PolarHBondContact OE1-OG 3.08Å; E392-I470 HydrophobicContact CB-CG1 3.92Å; E392-I470 HydrophobicContact CG-CG1 4.19Å
393	N	90.6	Very high	89.2	Confident	95 Å²	95	44.9 Å²	44.9	51%	0.508	21%	0.212	S	C	.	.	H	α-helix	trans	-61.7	-41.2	174.9	-72.2	-50.5	0	0	0	111.6	N389 V390 Y391 G396 E397	N389-N393 WeakPolarHBondContact O-CB 3.19Å; N389-N393 PolarHBondContact O-N 3.44Å; N389-N393 PolarHBondContact O-ND2 2.84Å; N389-N393 PolarHBondContact OD1-ND2 2.8Å; V390-N393 PolarHBondContact O-N 3.2Å; Y391-N393 VanDerWaalsContact C-N 3.33Å; Y391-N393 PolarHBondContact O-N 3.03Å; N393-G396 PolarHBondContact O-N 3.5Å; N393-E397 PolarHBondContact O-N 3.29Å
394	F	92	Very high	89.5	Confident	9 Å²	9	48.9 Å²	48.9	4%	0.039	24%	0.24	C	C	.	.	H	α-helix	trans	-61.3	-45.6	175.4	177.6	-91.1	0	0	0	112.1	M332 L338 L350 V390 Y391 E392 G396 E397 Y398 F427	M332-F394 HydrophobicContact CB-CD2 3.97Å; M332-F394 HydrophobicContact CB-CE2 4.45Å; M332-F394 HydrophobicContact CG-CD2 4.22Å; M332-F394 WeakPolarHBondContact O-CD2 3.12Å; M332-F394 WeakPolarHBondContact O-CE2 2.86Å; M332-F394 HydrophobicContact SD-CB 4.49Å; L338-F394 HydrophobicContact CD2-CZ 3.88Å; L350-F394 HydrophobicContact CD2-CD1 3.93Å; L350-F394 HydrophobicContact CD2-CE1 3.33Å; L350-F394 HydrophobicContact CD2-CZ 3.7Å; V390-F394 WeakPolarHBondContact O-CB 3.46Å; V390-F394 PolarHBondContact O-N 2.94Å; Y391-F394 CarbonylContact O-C 3.38Å; Y391-F394 WeakPolarHBondContact O-CA 3.44Å; Y391-F394 WeakPolarHBondContact O-CB 3.46Å; Y391-F394 PolarHBondContact O-N 2.56Å; Y391-F394 VanDerWaalsContact O-N 3.13Å; E392-F394 VanDerWaalsContact C-N 3.31Å; E392-F394 PolarHBondContact O-N 3.33Å; F394-G396 VanDerWaalsContact C-N 3.3Å; F394-G396 PolarHBondContact O-N 2.8Å; F394-E397 PolarHBondContact O-N 2.99Å; F394-Y398 VanDerWaalsContact O-CB 3.29Å; F394-Y398 WeakPolarHBondContact O-CB 3.44Å; F394-Y398 PolarHBondContact O-N 2.96Å; F394-F427 HydrophobicContact CD1-CZ 4.42Å; F394-F427 AromaticContact CE1-CE2 3.93Å; F394-F427 HydrophobicContact CE1-CE2 3.93Å; F394-F427 HydrophobicContact CE1-CZ 4.06Å
395	V	92.5	Very high	89.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.7	-43	175.2	174.1	0	0	0	0	110.5	Y391 E392 E397 Y398 H399 F427 A473 I474	Y391-V395 HydrophobicContact CD1-CG2 4.18Å; Y391-V395 HydrophobicContact CD2-CG2 4.28Å; Y391-V395 HydrophobicContact CE1-CG2 3.74Å; Y391-V395 HydrophobicContact CE2-CG2 3.87Å; Y391-V395 HydrophobicContact CG-CG2 4.45Å; Y391-V395 WeakPolarHBondContact O-CG2 3.12Å; Y391-V395 PolarHBondContact O-N 2.92Å; E392-V395 PolarHBondContact O-N 2.98Å; V395-E397 PolarHBondContact O-N 2.79Å; V395-Y398 PolarHBondContact O-N 3.2Å; V395-H399 WeakPolarHBondContact O-CB 3.3Å; V395-H399 PolarHBondContact O-N 2.96Å; V395-F427 HydrophobicContact CG2-CE1 4.32Å; V395-F427 HydrophobicContact CG2-CZ 4.12Å; V395-A473 HydrophobicContact CG1-CB 3.85Å; V395-I474 HydrophobicContact CG1-CG1 4.14Å; V395-I474 HydrophobicContact CG2-CG1 4.49Å
396	G	91.4	Very high	89.6	Confident	26 Å²	26	48.6 Å²	48.6	27%	0.268	24%	0.239	S	C	.	.	H	α-helix	trans	-65.2	-34.9	176.1	0	0	0	0	0	113.8	E392 N393 F394 R400	E392-G396 PolarHBondContact O-N 2.93Å; N393-G396 PolarHBondContact O-N 3.5Å; F394-G396 VanDerWaalsContact C-N 3.3Å; F394-G396 PolarHBondContact O-N 2.8Å; G396-R400 WeakPolarHBondContact O-CG 3.22Å; G396-R400 PolarHBondContact O-N 3.2Å; G396-R400 PolarHBondContact O-NE 3.37Å
397	E	90.3	Very high	89.5	Confident	83 Å²	83	48.4 Å²	48.4	39%	0.388	25%	0.248	S	C	.	.	H	α-helix	trans	-72	-43.5	173.8	-145	-176.4	171.3	0	0	111.9	L334 N393 F394 V395 H399 R400 N401	L334-E397 HydrophobicContact CD1-CB 4.16Å; L334-E397 HydrophobicContact CD1-CG 3.49Å; L334-E397 VanDerWaalsContact CD1-CG 3.49Å; L334-E397 VanDerWaalsContact CD1-OE1 3.29Å; L334-E397 WeakPolarHBondContact CD1-OE1 3.48Å; L334-E397 HydrophobicContact CG-CG 4.31Å; N393-E397 PolarHBondContact O-N 3.29Å; F394-E397 PolarHBondContact O-N 2.99Å; V395-E397 PolarHBondContact O-N 2.79Å; E397-H399 PolarHBondContact O-N 2.88Å; E397-R400 PolarHBondContact O-N 2.97Å; E397-N401 WeakPolarHBondContact O-CB 3.35Å; E397-N401 PolarHBondContact O-N 3.02Å
398	Y	91.3	Very high	89.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59	-45.1	175.1	179.9	-94.7	0	0	0	111.5	M336 L338 F394 V395 N401 C402 Q419 F427 L477	M336-Y398 HydrophobicContact CE-CD2 4.15Å; M336-Y398 HydrophobicContact CE-CE2 3.53Å; M336-Y398 HydrophobicContact SD-CD2 4.37Å; M336-Y398 HydrophobicContact SD-CE2 4.25Å; L338-Y398 HydrophobicContact CD1-CD2 4.4Å; L338-Y398 HydrophobicContact CD1-CE2 3.84Å; F394-Y398 VanDerWaalsContact O-CB 3.29Å; F394-Y398 WeakPolarHBondContact O-CB 3.44Å; F394-Y398 PolarHBondContact O-N 2.96Å; V395-Y398 PolarHBondContact O-N 3.2Å; Y398-N401 PolarHBondContact O-N 3.38Å; Y398-C402 VanDerWaalsContact CE1-SG 3.58Å; Y398-C402 VanDerWaalsContact CZ-SG 3.58Å; Y398-C402 WeakPolarHBondContact O-CB 3.48Å; Y398-C402 PolarHBondContact O-N 3.17Å; Y398-C402 PolarHBondContact O-SG 3.32Å; Y398-Q419 PolarHBondContact OH-NE2 3.13Å; Y398-F427 AromaticContact CD1-CD1 3.87Å; Y398-F427 HydrophobicContact CD1-CD1 3.87Å; Y398-F427 AromaticContact CD1-CE1 3.74Å; Y398-F427 HydrophobicContact CD1-CE1 3.74Å; Y398-F427 HydrophobicContact CD1-CG 4.36Å; Y398-F427 HydrophobicContact CD1-CZ 4.14Å; Y398-F427 HydrophobicContact CE1-CB 4.26Å; Y398-F427 AromaticContact CE1-CD1 3.56Å; Y398-F427 HydrophobicContact CE1-CD1 3.56Å; Y398-F427 HydrophobicContact CE1-CD2 4.36Å; Y398-F427 AromaticContact CE1-CE1 3.95Å; Y398-F427 HydrophobicContact CE1-CE1 3.95Å; Y398-F427 AromaticContact CE1-CG 3.79Å; Y398-F427 HydrophobicContact CE1-CG 3.79Å; Y398-F427 HydrophobicContact CE1-CZ 4.5Å; Y398-F427 HydrophobicContact CE2-CD2 4.47Å; Y398-F427 HydrophobicContact CG-CE1 4.35Å; Y398-F427 HydrophobicContact CG-CZ 4.29Å; Y398-F427 AromaticContact CZ-CG 3.92Å; Y398-L477 HydrophobicContact CD1-CD1 4.26Å; Y398-L477 HydrophobicContact CD1-CD2 4.1Å; Y398-L477 HydrophobicContact CE1-CD1 4.28Å; Y398-L477 HydrophobicContact CE1-CD2 4.25Å
399	H	91.6	Very high	89.1	Confident	37 Å²	37	53.4 Å²	53.4	17%	0.171	27%	0.272	C	S	.	.	H	α-helix	trans	-59.9	-48.1	174.9	-178.5	-170.3	0	0	0	111.6	V395 E397 N401 C402 K403 L477 S480	V395-H399 WeakPolarHBondContact O-CB 3.3Å; V395-H399 PolarHBondContact O-N 2.96Å; E397-H399 PolarHBondContact O-N 2.88Å; H399-N401 VanDerWaalsContact C-N 3.33Å; H399-N401 PolarHBondContact O-N 3.43Å; H399-C402 PolarHBondContact O-N 2.85Å; H399-K403 WeakPolarHBondContact O-CB 3.11Å; H399-K403 PolarHBondContact O-N 2.86Å; H399-L477 HydrophobicContact CB-CD2 3.72Å; H399-S480 PolarHBondContact CE1-OG 2.92Å; H399-S480 PolarHBondContact NE2-OG 2.96Å
400	R	90.8	Very high	88.9	Confident	172 Å²	172	52.7 Å²	52.7	65%	0.649	27%	0.268	S	S	*	.	H	α-helix	trans	-60.5	-41.9	177.3	-76.9	-178.8	-71.5	157.8	-2.3	112.2	G396 E397 K403 S404	G396-R400 WeakPolarHBondContact O-CG 3.22Å; G396-R400 PolarHBondContact O-N 3.2Å; G396-R400 PolarHBondContact O-NE 3.37Å; E397-R400 PolarHBondContact O-N 2.97Å; R400-K403 PolarHBondContact O-N 3.5Å; R400-S404 PolarHBondContact O-N 3Å; R400-S404 VanDerWaalsContact O-N 3.13Å
401	N	89.6	Confident	88.6	Confident	50 Å²	50	52.9 Å²	52.9	27%	0.267	27%	0.267	S	S	.	.	H	α-helix	trans	-66.2	-46.1	178.4	-167.3	51.6	0	0	0	111.7	M336 E397 Y398 H399 K403 S404 L405	M336-N401 PolarHBondContact SD-ND2 3Å; E397-N401 WeakPolarHBondContact O-CB 3.35Å; E397-N401 PolarHBondContact O-N 3.02Å; Y398-N401 PolarHBondContact O-N 3.38Å; H399-N401 VanDerWaalsContact C-N 3.33Å; H399-N401 PolarHBondContact O-N 3.43Å; N401-K403 VanDerWaalsContact C-N 3.29Å; N401-K403 PolarHBondContact O-N 2.91Å; N401-S404 WeakPolarHBondContact O-CB 3.48Å; N401-S404 PolarHBondContact O-N 2.99Å; N401-S404 VanDerWaalsContact O-N 3.08Å; N401-S404 PolarHBondContact O-OG 2.66Å; N401-L405 PolarHBondContact O-N 2.73Å
402	C	89.8	Confident	87.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.6	-36.5	176	-64.7	0	0	0	0	112.1	Y398 H399 S404 L405 L406 I424 L481	Y398-C402 VanDerWaalsContact CE1-SG 3.58Å; Y398-C402 VanDerWaalsContact CZ-SG 3.58Å; Y398-C402 WeakPolarHBondContact O-CB 3.48Å; Y398-C402 PolarHBondContact O-N 3.17Å; Y398-C402 PolarHBondContact O-SG 3.32Å; H399-C402 PolarHBondContact O-N 2.85Å; C402-S404 VanDerWaalsContact C-N 3.27Å; C402-S404 PolarHBondContact O-N 3.12Å; C402-L405 CarbonylContact O-C 3.46Å; C402-L405 PolarHBondContact O-N 2.99Å; C402-L406 PolarHBondContact O-N 3.25Å; C402-I424 HydrophobicContact CB-CD1 4.35Å; C402-L481 HydrophobicContact CB-CD1 4.18Å; C402-L481 HydrophobicContact CB-CD2 3.54Å
403	K	88.8	Confident	86.8	Confident	112 Å²	112	58.2 Å²	58.2	49%	0.487	31%	0.31	S	S	.	.	H	α-helix	trans	-63.5	-32.5	174.5	-171.6	170.2	-175.1	164.5	0	112.5	H399 R400 N401 L405 L406 L481	H399-K403 WeakPolarHBondContact O-CB 3.11Å; H399-K403 PolarHBondContact O-N 2.86Å; R400-K403 PolarHBondContact O-N 3.5Å; N401-K403 VanDerWaalsContact C-N 3.29Å; N401-K403 PolarHBondContact O-N 2.91Å; K403-L405 PolarHBondContact O-N 3.39Å; K403-L406 WeakPolarHBondContact O-CB 3.38Å; K403-L406 PolarHBondContact O-N 2.82Å; K403-L481 VanDerWaalsContact CA-CD1 3.48Å; K403-L481 HydrophobicContact CB-CD1 3.95Å
404	S	87.4	Confident	85.7	Confident	86 Å²	86	62.4 Å²	62.4	60%	0.601	33%	0.332	S	S	*	.	H	α-helix	trans	-71.3	-21.8	173.7	77.8	0	0	0	0	113.4	R400 N401 C402	R400-S404 PolarHBondContact O-N 3Å; R400-S404 VanDerWaalsContact O-N 3.13Å; N401-S404 WeakPolarHBondContact O-CB 3.48Å; N401-S404 PolarHBondContact O-N 2.99Å; N401-S404 VanDerWaalsContact O-N 3.08Å; N401-S404 PolarHBondContact O-OG 2.66Å; C402-S404 VanDerWaalsContact C-N 3.27Å; C402-S404 PolarHBondContact O-N 3.12Å
405	L	85.8	Confident	84.4	Confident	20 Å²	20	69.8 Å²	69.8	11%	0.105	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	11.4	178.8	-62.3	172.7	0	0	0	112.5	N401 C402 K403 D407 E408 L409 K418 Q419	N401-L405 PolarHBondContact O-N 2.73Å; C402-L405 CarbonylContact O-C 3.46Å; C402-L405 PolarHBondContact O-N 2.99Å; K403-L405 PolarHBondContact O-N 3.39Å; L405-D407 PolarHBondContact O-N 3.35Å; L405-D407 VanDerWaalsContact O-N 3.15Å; L405-E408 PolarHBondContact O-N 3.42Å; L405-L409 WeakPolarHBondContact O-CG 3.35Å; L405-L409 PolarHBondContact O-N 2.91Å; L405-K418 HydrophobicContact CD1-CB 4.36Å; L405-K418 HydrophobicContact CD2-CD 4.41Å; L405-Q419 HydrophobicContact CD1-CB 4.35Å
406	L	86	Confident	82.8	Confident	34 Å²	34	76.3 Å²	76.3	18%	0.178	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-40.1	-174.7	-163.6	67.9	0	0	0	112.9	C402 K403 E408 L409 L481 D484 W485	C402-L406 PolarHBondContact O-N 3.25Å; K403-L406 WeakPolarHBondContact O-CB 3.38Å; K403-L406 PolarHBondContact O-N 2.82Å; L406-E408 VanDerWaalsContact C-N 3.33Å; L406-E408 PolarHBondContact O-N 3.49Å; L406-L409 HydrophobicContact CD1-CD1 4.08Å; L406-L409 PolarHBondContact O-N 3.15Å; L406-L481 HydrophobicContact CD1-CD1 3.73Å; L406-L481 HydrophobicContact CD1-CG 4.45Å; L406-D484 HydrophobicContact CD2-CB 4.34Å; L406-W485 HydrophobicContact CD1-CB 3.6Å; L406-W485 HydrophobicContact CD1-CG 4.33Å; L406-W485 HydrophobicContact CG-CB 4.41Å
407	D	84.1	Confident	81.3	Confident	126 Å²	126	77.9 Å²	77.9	67%	0.674	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-25.5	-179.4	-64.3	-29.2	0	0	0	113.2	L405 R489	L405-D407 PolarHBondContact O-N 3.35Å; L405-D407 VanDerWaalsContact O-N 3.15Å; D407-R489 PolarHBondContact O-NH2 2.9Å
408	E	83.5	Confident	80.3	Confident	106 Å²	106	80.3 Å²	80.3	50%	0.495	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-20.9	178.9	-63.3	-177.1	-175.5	0	0	112.1	L405 L406 N410	L405-E408 PolarHBondContact O-N 3.42Å; L406-E408 VanDerWaalsContact C-N 3.33Å; L406-E408 PolarHBondContact O-N 3.49Å; E408-N410 PolarHBondContact O-N 3.27Å; E408-N410 PolarHBondContact O-ND2 2.67Å
409	L	83.2	Confident	79.7	Confident	2 Å²	2	80.5 Å²	80.5	1%	0.01	42%	0.423	C	S	.	.			trans	-59.7	122.3	-177.9	-82.1	162.9	0	0	0	111.7	L405 L406 Q419 I424 W485 R489	L405-L409 WeakPolarHBondContact O-CG 3.35Å; L405-L409 PolarHBondContact O-N 2.91Å; L406-L409 HydrophobicContact CD1-CD1 4.08Å; L406-L409 PolarHBondContact O-N 3.15Å; L409-Q419 HydrophobicContact CD2-CB 4.45Å; L409-Q419 HydrophobicContact CD2-CG 4.33Å; L409-Q419 WeakPolarHBondContact CD2-O 3.49Å; L409-I424 HydrophobicContact CD1-CD1 3.99Å; L409-I424 HydrophobicContact CD2-CD1 3.42Å; L409-I424 VanDerWaalsContact CD2-CD1 3.42Å; L409-I424 HydrophobicContact CG-CD1 4.37Å; L409-W485 PolarHBondContact O-NE1 2.91Å; L409-R489 PolarHBondContact O-NH2 3.23Å
410	N	84.6	Confident	79.5	Confident	73 Å²	73	79 Å²	79	39%	0.39	42%	0.416	S	S	.	.			trans	-148.2	170.4	174.4	-76.1	-65.4	0	0	0	109.4	E408 S420 V421	E408-N410 PolarHBondContact O-N 3.27Å; E408-N410 PolarHBondContact O-ND2 2.67Å; N410-S420 WeakPolarHBondContact O-CA 3.4Å; N410-V421 PolarHBondContact O-N 3.47Å
411	F	83.9	Confident	79.3	Confident	32 Å²	32	70.8 Å²	70.8	14%	0.14	39%	0.386	C	S	.	.	S	Bend	trans	-61.1	153.9	168.2	-64.6	-66.4	0	0	0	110.8	T413 V421 W485 L525 K528 L532	F411-T413 PolarHBondContact O-N 3.45Å; F411-V421 HydrophobicContact CD1-CB 4.08Å; F411-V421 HydrophobicContact CD1-CG1 4.28Å; F411-V421 HydrophobicContact CE1-CB 4.15Å; F411-V421 HydrophobicContact CE1-CG1 3.87Å; F411-W485 HydrophobicContact CE2-CH2 4.21Å; F411-W485 HydrophobicContact CZ-CH2 4.1Å; F411-L525 HydrophobicContact CE2-CD1 3.53Å; F411-L525 HydrophobicContact CZ-CD1 3.91Å; F411-K528 HydrophobicContact CD1-CD 4.22Å; F411-K528 HydrophobicContact CD2-CD 3.98Å; F411-K528 HydrophobicContact CE1-CD 3.96Å; F411-K528 HydrophobicContact CE1-CG 4.08Å; F411-K528 HydrophobicContact CE2-CD 3.67Å; F411-K528 HydrophobicContact CE2-CG 4.29Å; F411-K528 HydrophobicContact CG-CD 4.24Å; F411-K528 HydrophobicContact CZ-CB 4.31Å; F411-K528 HydrophobicContact CZ-CD 3.66Å; F411-K528 HydrophobicContact CZ-CG 3.81Å; F411-L532 HydrophobicContact CD1-CD1 3.98Å; F411-L532 HydrophobicContact CE1-CD1 3.4Å; F411-L532 VanDerWaalsContact CE1-CD1 3.4Å; F411-L532 HydrophobicContact CZ-CD1 4.38Å
412	A	75.3	Confident	79.3	Confident	71 Å²	71	70 Å²	70	59%	0.587	38%	0.381	S	S	*	.			trans	-50.4	126	176.6	0	0	0	0	0	111.1	D422	A412-D422 PolarHBondContact N-OD2 3.12Å
413	T	71.2	Confident	79.3	Confident	89 Å²	89	72.2 Å²	72.2	55%	0.546	39%	0.393	S	S	.	.			trans	-124.5	164.3	171.6	61.2	0	0	0	0	108.3	F411 K415	F411-T413 PolarHBondContact O-N 3.45Å; T413-K415 PolarHBondContact O-N 2.92Å
414	D	66.7	Low	79.4	Confident	182 Å²	182	66.9 Å²	66.9	97%	0.973	37%	0.37	S	S	*	.	S	Bend	trans	-61.7	-5.5	177	-66.6	-29.2	0	0	0	114.1
415	K	64.5	Low	79.7	Confident	165 Å²	165	63 Å²	63	72%	0.717	34%	0.343	S	S	*	.	S	Bend	trans	-82.4	142.9	174.3	-67.7	-176.3	-178.9	177.7	0	110.7	T413 C417	T413-K415 PolarHBondContact O-N 2.92Å; K415-C417 PolarHBondContact O-N 2.93Å
416	P	58.3	Low	80	Confident	137 Å²	137	65 Å²	65	89%	0.89	35%	0.352	S	S	*	.			trans	-64	100.7	172.4	26.9	-32.7	0	0	0	109.4
417	C	60.1	Low	80.3	Confident	58 Å²	58	63.4 Å²	63.4	39%	0.392	34%	0.343	S	S	.	.			trans	-94	143	168.5	-166.6	0	0	0	0	108.5	K415 Q419	K415-C417 PolarHBondContact O-N 2.93Å; C417-Q419 PolarHBondContact O-N 3.42Å; C417-Q419 PolarHBondContact SG-O 2.84Å
418	K	69.3	Low	80.8	Confident	134 Å²	134	57.4 Å²	57.4	58%	0.583	31%	0.311	S	S	*	.	S	Bend	trans	-67.2	-29.7	175.3	-70.7	178.5	-179.3	169.3	0	112.1	L405	L405-K418 HydrophobicContact CD1-CB 4.36Å; L405-K418 HydrophobicContact CD2-CD 4.41Å
419	Q	79.3	Confident	81.3	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.019	30%	0.302	C	S	.	.			trans	-160.1	128.6	179.5	-167	63.1	11.5	0	0	110.8	M336 Y398 L405 L409 C417 I424	M336-Q419 VanDerWaalsContact CE-CD 3.41Å; M336-Q419 HydrophobicContact CE-CG 4.24Å; Y398-Q419 PolarHBondContact OH-NE2 3.13Å; L405-Q419 HydrophobicContact CD1-CB 4.35Å; L409-Q419 HydrophobicContact CD2-CB 4.45Å; L409-Q419 HydrophobicContact CD2-CG 4.33Å; L409-Q419 WeakPolarHBondContact CD2-O 3.49Å; C417-Q419 PolarHBondContact O-N 3.42Å; C417-Q419 PolarHBondContact SG-O 2.84Å; Q419-I424 HydrophobicContact CG-CD1 4.31Å; Q419-I424 HydrophobicContact CG-CG1 4.06Å
420	S	86.6	Confident	81.8	Confident	6 Å²	6	55.7 Å²	55.7	4%	0.042	30%	0.302	C	S	.	.			trans	-99.8	164.5	173.3	72.5	0	0	0	0	112.6	N410 D422 D423 I424	N410-S420 WeakPolarHBondContact O-CA 3.4Å; S420-D422 VanDerWaalsContact C-N 3.25Å; S420-D422 PolarHBondContact O-N 3.5Å; S420-D422 PolarHBondContact OG-N 2.78Å; S420-D423 WeakPolarHBondContact CB-OD2 3.48Å; S420-D423 PolarHBondContact N-OD2 3.43Å; S420-D423 PolarHBondContact O-N 3.04Å; S420-D423 PolarHBondContact OG-N 3.47Å; S420-D423 VanDerWaalsContact OG-N 3.12Å; S420-D423 PolarHBondContact OG-OD2 2.98Å; S420-I424 PolarHBondContact O-N 3.08Å
421	V	88.2	Confident	82.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.6	-39.7	170.8	175.4	0	0	0	0	110.6	N410 F411 D423 I424 V425 L482 W485 I529	N410-V421 PolarHBondContact O-N 3.47Å; F411-V421 HydrophobicContact CD1-CB 4.08Å; F411-V421 HydrophobicContact CD1-CG1 4.28Å; F411-V421 HydrophobicContact CE1-CB 4.15Å; F411-V421 HydrophobicContact CE1-CG1 3.87Å; V421-D423 VanDerWaalsContact C-N 3.31Å; V421-D423 PolarHBondContact O-N 2.97Å; V421-I424 PolarHBondContact O-N 3.07Å; V421-V425 HydrophobicContact CG1-CG2 4.31Å; V421-V425 VanDerWaalsContact O-CG2 3.31Å; V421-V425 WeakPolarHBondContact O-CG2 3.37Å; V421-V425 PolarHBondContact O-N 3.44Å; V421-L482 HydrophobicContact CG1-CD2 4.4Å; V421-W485 HydrophobicContact CG1-CH2 4.47Å; V421-W485 HydrophobicContact CG1-CZ3 4.46Å; V421-W485 HydrophobicContact CG2-CD2 4.43Å; V421-W485 HydrophobicContact CG2-CH2 3.68Å; V421-W485 HydrophobicContact CG2-CZ2 3.56Å; V421-W485 HydrophobicContact CG2-CZ3 4.17Å; V421-I529 HydrophobicContact CG1-CD1 3.57Å
422	D	89.6	Confident	82.7	Confident	32 Å²	32	51.6 Å²	51.6	17%	0.171	28%	0.28	C	S	.	.	H	α-helix	trans	-58.4	-45.1	176.9	-56.7	-90.8	0	0	0	110.5	A412 S420 I424 V425 H426	A412-D422 PolarHBondContact N-OD2 3.12Å; S420-D422 VanDerWaalsContact C-N 3.25Å; S420-D422 PolarHBondContact O-N 3.5Å; S420-D422 PolarHBondContact OG-N 2.78Å; D422-I424 VanDerWaalsContact C-N 3.35Å; D422-I424 PolarHBondContact O-N 2.9Å; D422-V425 PolarHBondContact O-N 2.87Å; D422-H426 PolarHBondContact O-N 2.92Å; D422-H426 PolarHBondContact O-ND1 3.44Å
423	D	89.4	Confident	83.5	Confident	47 Å²	47	51.4 Å²	51.4	25%	0.251	27%	0.268	S	S	.	.	H	α-helix	trans	-60.4	-42.5	177.6	-61.9	-49.3	0	0	0	112.2	Y348 S420 V421 V425 H426 F427	Y348-D423 VanDerWaalsContact OH-CA 3.25Å; Y348-D423 WeakPolarHBondContact OH-CA 3.46Å; Y348-D423 VanDerWaalsContact OH-CB 3.31Å; Y348-D423 WeakPolarHBondContact OH-CB 3.48Å; Y348-D423 PolarHBondContact OH-O 3.41Å; S420-D423 WeakPolarHBondContact CB-OD2 3.48Å; S420-D423 PolarHBondContact N-OD2 3.43Å; S420-D423 PolarHBondContact O-N 3.04Å; S420-D423 PolarHBondContact OG-N 3.47Å; S420-D423 VanDerWaalsContact OG-N 3.12Å; S420-D423 PolarHBondContact OG-OD2 2.98Å; V421-D423 VanDerWaalsContact C-N 3.31Å; V421-D423 PolarHBondContact O-N 2.97Å; D423-V425 VanDerWaalsContact C-N 3.35Å; D423-V425 PolarHBondContact O-N 3.28Å; D423-H426 PolarHBondContact O-N 3.14Å; D423-F427 WeakPolarHBondContact O-CB 3.27Å; D423-F427 PolarHBondContact O-N 3.11Å
424	I	91.4	Very high	84.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-41.6	176.9	-65.8	167.8	0	0	0	110.7	C402 L409 Q419 S420 V421 D422 F427 I428 L481 L482	C402-I424 HydrophobicContact CB-CD1 4.35Å; L409-I424 HydrophobicContact CD1-CD1 3.99Å; L409-I424 HydrophobicContact CD2-CD1 3.42Å; L409-I424 VanDerWaalsContact CD2-CD1 3.42Å; L409-I424 HydrophobicContact CG-CD1 4.37Å; Q419-I424 HydrophobicContact CG-CD1 4.31Å; Q419-I424 HydrophobicContact CG-CG1 4.06Å; S420-I424 PolarHBondContact O-N 3.08Å; V421-I424 PolarHBondContact O-N 3.07Å; D422-I424 VanDerWaalsContact C-N 3.35Å; D422-I424 PolarHBondContact O-N 2.9Å; I424-F427 WeakPolarHBondContact O-CB 3.33Å; I424-F427 PolarHBondContact O-N 3.09Å; I424-F427 VanDerWaalsContact O-N 3.17Å; I424-I428 HydrophobicContact CG2-CD1 3.74Å; I424-I428 HydrophobicContact CG2-CG1 4.34Å; I424-I428 WeakPolarHBondContact O-CD1 3.35Å; I424-I428 VanDerWaalsContact O-CG1 3.26Å; I424-I428 WeakPolarHBondContact O-CG1 3.24Å; I424-I428 PolarHBondContact O-N 3.15Å; I424-L481 HydrophobicContact CD1-CD2 3.96Å; I424-L481 HydrophobicContact CG2-CD2 4.37Å; I424-L482 HydrophobicContact CG2-CD1 4.4Å; I424-L482 HydrophobicContact CG2-CD2 4.25Å; I424-L482 HydrophobicContact CG2-CG 4.39Å
425	V	92	Very high	85.7	Confident	6 Å²	6	38.9 Å²	38.9	4%	0.036	20%	0.198	C	C	.	.	H	α-helix	trans	-63.8	-42.3	178.3	171.3	0	0	0	0	111	V421 D422 D423 F427 I428 K429 L482 L532 L533 A536	V421-V425 HydrophobicContact CG1-CG2 4.31Å; V421-V425 VanDerWaalsContact O-CG2 3.31Å; V421-V425 WeakPolarHBondContact O-CG2 3.37Å; V421-V425 PolarHBondContact O-N 3.44Å; D422-V425 PolarHBondContact O-N 2.87Å; D423-V425 VanDerWaalsContact C-N 3.35Å; D423-V425 PolarHBondContact O-N 3.28Å; V425-F427 VanDerWaalsContact C-N 3.3Å; V425-F427 PolarHBondContact O-N 2.97Å; V425-I428 PolarHBondContact O-N 3.5Å; V425-K429 WeakPolarHBondContact O-CB 3.48Å; V425-K429 PolarHBondContact O-N 3.05Å; V425-L482 HydrophobicContact CG2-CD1 4.48Å; V425-L532 HydrophobicContact CG1-CB 4.36Å; V425-L532 WeakPolarHBondContact CG1-O 3.31Å; V425-L533 HydrophobicContact CG2-CD2 3.95Å; V425-A536 HydrophobicContact CG1-CB 3.52Å
426	H	91.9	Very high	86.9	Confident	62 Å²	62	35.6 Å²	35.6	29%	0.287	19%	0.188	S	C	.	.	H	α-helix	trans	-62.7	-38.4	173	-71	93.7	0	0	0	111.7	H347 Y348 D422 D423 K429 D430	H347-H426 HydrophobicContact CB-CB 4.12Å; H347-H426 AromaticContact CD2-CG 3.99Å; H347-H426 AromaticContact CE1-CD2 3.75Å; H347-H426 AromaticContact CE1-CG 3.99Å; H347-H426 AromaticContact CG-CD2 3.63Å; H347-H426 AromaticContact CG-CG 3.86Å; H347-H426 AromaticContact ND1-CD2 3.34Å; H347-H426 PolarHBondContact ND1-CD2 3.23Å; H347-H426 VanDerWaalsContact ND1-CD2 3.34Å; H347-H426 AromaticContact ND1-CG 3.88Å; H347-H426 AromaticContact ND1-NE2 3.93Å; Y348-H426 HydrophobicContact CE2-CB 4.06Å; D422-H426 PolarHBondContact O-N 2.92Å; D422-H426 PolarHBondContact O-ND1 3.44Å; D423-H426 PolarHBondContact O-N 3.14Å; H426-K429 WeakPolarHBondContact O-CB 3.28Å; H426-K429 PolarHBondContact O-N 3.11Å; H426-D430 PolarHBondContact O-N 3.1Å
427	F	93.3	Very high	88.3	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.6	-41.4	177.2	-175.3	-92.4	0	0	0	112	L338 Y348 L350 H351 F394 V395 Y398 D423 I424 V425 G431 L477	L338-F427 HydrophobicContact CD1-CD2 3.62Å; L338-F427 HydrophobicContact CD1-CE2 4Å; Y348-F427 HydrophobicContact CD2-CB 4.4Å; Y348-F427 HydrophobicContact CD2-CD2 4.2Å; Y348-F427 HydrophobicContact CE2-CB 3.81Å; Y348-F427 HydrophobicContact CE2-CD2 4.27Å; L350-F427 HydrophobicContact CD2-CE2 4.48Å; H351-F427 AromaticContact CE1-CD2 3.78Å; H351-F427 AromaticContact CE1-CE2 3.65Å; F394-F427 HydrophobicContact CD1-CZ 4.42Å; F394-F427 AromaticContact CE1-CE2 3.93Å; F394-F427 HydrophobicContact CE1-CE2 3.93Å; F394-F427 HydrophobicContact CE1-CZ 4.06Å; V395-F427 HydrophobicContact CG2-CE1 4.32Å; V395-F427 HydrophobicContact CG2-CZ 4.12Å; Y398-F427 AromaticContact CD1-CD1 3.87Å; Y398-F427 HydrophobicContact CD1-CD1 3.87Å; Y398-F427 AromaticContact CD1-CE1 3.74Å; Y398-F427 HydrophobicContact CD1-CE1 3.74Å; Y398-F427 HydrophobicContact CD1-CG 4.36Å; Y398-F427 HydrophobicContact CD1-CZ 4.14Å; Y398-F427 HydrophobicContact CE1-CB 4.26Å; Y398-F427 AromaticContact CE1-CD1 3.56Å; Y398-F427 HydrophobicContact CE1-CD1 3.56Å; Y398-F427 HydrophobicContact CE1-CD2 4.36Å; Y398-F427 AromaticContact CE1-CE1 3.95Å; Y398-F427 HydrophobicContact CE1-CE1 3.95Å; Y398-F427 AromaticContact CE1-CG 3.79Å; Y398-F427 HydrophobicContact CE1-CG 3.79Å; Y398-F427 HydrophobicContact CE1-CZ 4.5Å; Y398-F427 HydrophobicContact CE2-CD2 4.47Å; Y398-F427 HydrophobicContact CG-CE1 4.35Å; Y398-F427 HydrophobicContact CG-CZ 4.29Å; Y398-F427 AromaticContact CZ-CG 3.92Å; D423-F427 WeakPolarHBondContact O-CB 3.27Å; D423-F427 PolarHBondContact O-N 3.11Å; I424-F427 WeakPolarHBondContact O-CB 3.33Å; I424-F427 PolarHBondContact O-N 3.09Å; I424-F427 VanDerWaalsContact O-N 3.17Å; V425-F427 VanDerWaalsContact C-N 3.3Å; V425-F427 PolarHBondContact O-N 2.97Å; F427-G431 PolarHBondContact O-N 3.23Å; F427-L477 HydrophobicContact CD1-CD1 3.65Å; F427-L477 HydrophobicContact CE1-CD1 3.82Å
428	I	94.3	Very high	89.6	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.4	-46.4	175.4	-69.5	160.5	0	0	0	110.3	I424 V425 G431 F432 I474 L477 V478 L482 V538	I424-I428 HydrophobicContact CG2-CD1 3.74Å; I424-I428 HydrophobicContact CG2-CG1 4.34Å; I424-I428 WeakPolarHBondContact O-CD1 3.35Å; I424-I428 VanDerWaalsContact O-CG1 3.26Å; I424-I428 WeakPolarHBondContact O-CG1 3.24Å; I424-I428 PolarHBondContact O-N 3.15Å; V425-I428 PolarHBondContact O-N 3.5Å; I428-G431 PolarHBondContact O-N 3.14Å; I428-F432 HydrophobicContact CG2-CD2 3.66Å; I428-F432 HydrophobicContact CG2-CE2 3.54Å; I428-F432 WeakPolarHBondContact O-CD2 3.4Å; I428-F432 PolarHBondContact O-N 2.87Å; I428-I474 HydrophobicContact CG2-CG2 4.34Å; I428-L477 HydrophobicContact CD1-CB 4.01Å; I428-L477 HydrophobicContact CG1-CB 3.96Å; I428-L477 HydrophobicContact CG1-CD1 4.02Å; I428-V478 HydrophobicContact CD1-CG2 3.76Å; I428-V478 HydrophobicContact CG1-CG2 4.42Å; I428-V478 HydrophobicContact CG2-CG2 4.11Å; I428-L482 HydrophobicContact CD1-CD1 3.7Å; I428-V538 HydrophobicContact CG2-CG2 3.79Å
429	K	94.1	Very high	90.3	Very high	69 Å²	69	23.9 Å²	23.9	30%	0.3	12%	0.122	S	C	.	.	H	α-helix	trans	-55.6	-54.9	176.2	179.8	-177.8	-179.4	173.5	0	111.1	V425 H426 G431 F432 Q433 A536	V425-K429 WeakPolarHBondContact O-CB 3.48Å; V425-K429 PolarHBondContact O-N 3.05Å; H426-K429 WeakPolarHBondContact O-CB 3.28Å; H426-K429 PolarHBondContact O-N 3.11Å; K429-G431 PolarHBondContact O-N 3.25Å; K429-F432 PolarHBondContact O-N 3.5Å; K429-Q433 WeakPolarHBondContact O-CB 3.16Å; K429-Q433 WeakPolarHBondContact O-CG 3.39Å; K429-Q433 PolarHBondContact O-N 2.87Å; K429-A536 HydrophobicContact CB-CB 3.98Å
430	D	94.1	Very high	90.5	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.011	15%	0.151	C	C	.	.	H	α-helix	trans	-61.1	-36.7	179.9	-74.6	-3.1	0	0	0	111.2	Y346 H347 Y348 H351 H426 Q433 F434	Y346-D430 HydrophobicContact CD1-CB 3.96Å; H347-D430 WeakPolarHBondContact CA-OD2 3.17Å; H347-D430 WeakPolarHBondContact CB-OD2 3.17Å; H347-D430 VanDerWaalsContact N-CG 3.31Å; H347-D430 PolarHBondContact N-OD1 3.11Å; H347-D430 PolarHBondContact N-OD2 3.34Å; Y348-D430 WeakPolarHBondContact CD2-OD2 3.31Å; Y348-D430 PolarHBondContact N-OD2 2.96Å; H351-D430 HydrophobicContact CB-CB 4.33Å; H351-D430 PolarHBondContact CD2-O 2.91Å; H351-D430 IonicContact ND1-OD2 3.7Å; H351-D430 WeakPolarHBondContact NE2-CB 3.28Å; H426-D430 PolarHBondContact O-N 3.1Å; D430-Q433 PolarHBondContact O-N 3.45Å; D430-F434 VanDerWaalsContact O-CB 3.27Å; D430-F434 WeakPolarHBondContact O-CB 3.34Å; D430-F434 PolarHBondContact O-N 3.37Å
431	G	93.3	Very high	90	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.6	-51.1	175.6	0	0	0	0	0	113.1	H351 F427 I428 K429 F434 V435	H351-G431 PolarHBondContact NE2-N 3.31Å; F427-G431 PolarHBondContact O-N 3.23Å; I428-G431 PolarHBondContact O-N 3.14Å; K429-G431 PolarHBondContact O-N 3.25Å; G431-F434 WeakPolarHBondContact O-CB 3.47Å; G431-F434 PolarHBondContact O-N 3.22Å; G431-V435 WeakPolarHBondContact O-CG2 3.27Å; G431-V435 PolarHBondContact O-N 3.35Å
432	F	93.5	Very high	89.3	Confident	19 Å²	19	31.9 Å²	31.9	8%	0.083	16%	0.156	C	C	.	.	H	α-helix	trans	-66.2	-40.1	177.1	-77.5	-65	0	0	0	112.1	I428 K429 F434 V435 D436 E471 I474 V538 P539 L542	I428-F432 HydrophobicContact CG2-CD2 3.66Å; I428-F432 HydrophobicContact CG2-CE2 3.54Å; I428-F432 WeakPolarHBondContact O-CD2 3.4Å; I428-F432 PolarHBondContact O-N 2.87Å; K429-F432 PolarHBondContact O-N 3.5Å; F432-F434 PolarHBondContact O-N 2.97Å; F432-V435 PolarHBondContact O-N 3.47Å; F432-D436 PolarHBondContact O-N 2.71Å; F432-E471 HydrophobicContact CD1-CG 4.48Å; F432-E471 HydrophobicContact CE1-CG 3.94Å; F432-I474 HydrophobicContact CD2-CG2 4.08Å; F432-I474 HydrophobicContact CE1-CG2 4.49Å; F432-I474 HydrophobicContact CE2-CG2 3.84Å; F432-I474 HydrophobicContact CZ-CG2 4.05Å; F432-V538 HydrophobicContact CE2-CG1 4.34Å; F432-P539 HydrophobicContact CD1-CG 4.15Å; F432-P539 HydrophobicContact CE1-CG 3.74Å; F432-P539 HydrophobicContact CE2-CG 4.35Å; F432-P539 HydrophobicContact CZ-CG 3.86Å; F432-L542 HydrophobicContact CE2-CD2 4.35Å; F432-L542 HydrophobicContact CZ-CD2 3.91Å
433	Q	92.4	Very high	88.6	Confident	68 Å²	68	35.1 Å²	35.1	32%	0.318	17%	0.173	S	C	.	.	H	α-helix	trans	-59.9	-37	173.5	-73.4	-175.4	-14.9	0	0	112.2	Y346 K429 D430 D436 F437	Y346-Q433 HydrophobicContact CD1-CB 4.35Å; Y346-Q433 HydrophobicContact CE1-CB 3.7Å; K429-Q433 WeakPolarHBondContact O-CB 3.16Å; K429-Q433 WeakPolarHBondContact O-CG 3.39Å; K429-Q433 PolarHBondContact O-N 2.87Å; D430-Q433 PolarHBondContact O-N 3.45Å; Q433-D436 PolarHBondContact O-N 3.33Å; Q433-F437 WeakPolarHBondContact O-CB 3.4Å; Q433-F437 PolarHBondContact O-N 3.33Å
434	F	92.2	Very high	87.8	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-68	-41.3	175	-179.5	-116.6	0	0	0	112.2	Y346 L354 L358 Y391 D430 G431 F432 D436 F437 L438	Y346-F434 HydrophobicContact CE1-CB 4.37Å; L354-F434 HydrophobicContact CB-CD2 4.49Å; L354-F434 HydrophobicContact CB-CE2 3.77Å; L354-F434 HydrophobicContact CB-CZ 3.96Å; L354-F434 HydrophobicContact CD1-CE1 4.4Å; L354-F434 HydrophobicContact CD1-CZ 4.29Å; L358-F434 HydrophobicContact CD1-CE2 4Å; L358-F434 HydrophobicContact CD1-CZ 3.88Å; Y391-F434 HydrophobicContact CD1-CD1 4Å; Y391-F434 AromaticContact CD1-CE1 3.69Å; Y391-F434 HydrophobicContact CD1-CE1 3.69Å; Y391-F434 AromaticContact CE1-CD1 3.6Å; Y391-F434 HydrophobicContact CE1-CD1 3.6Å; Y391-F434 AromaticContact CE1-CE1 3.81Å; Y391-F434 HydrophobicContact CE1-CE1 3.81Å; Y391-F434 HydrophobicContact CG-CE1 4.2Å; D430-F434 VanDerWaalsContact O-CB 3.27Å; D430-F434 WeakPolarHBondContact O-CB 3.34Å; D430-F434 PolarHBondContact O-N 3.37Å; G431-F434 WeakPolarHBondContact O-CB 3.47Å; G431-F434 PolarHBondContact O-N 3.22Å; F432-F434 PolarHBondContact O-N 2.97Å; F434-D436 VanDerWaalsContact C-N 3.31Å; F434-D436 PolarHBondContact O-N 2.93Å; F434-F437 AromaticContact CD2-CD1 3.99Å; F434-F437 HydrophobicContact CD2-CD1 3.99Å; F434-F437 HydrophobicContact CE2-CD1 4.04Å; F434-F437 HydrophobicContact CE2-CE1 4.27Å; F434-F437 WeakPolarHBondContact O-CB 3.26Å; F434-F437 PolarHBondContact O-N 3.5Å; F434-L438 HydrophobicContact CD1-CD1 3.91Å; F434-L438 HydrophobicContact CD1-CG 4.4Å; F434-L438 HydrophobicContact CD2-CG 4.46Å; F434-L438 HydrophobicContact CE1-CD1 3.53Å; F434-L438 HydrophobicContact CE1-CD2 4.43Å; F434-L438 HydrophobicContact CE1-CG 4.09Å; F434-L438 HydrophobicContact CE2-CD1 4.48Å; F434-L438 HydrophobicContact CE2-CD2 4.12Å; F434-L438 HydrophobicContact CE2-CG 4.14Å; F434-L438 HydrophobicContact CZ-CD1 3.85Å; F434-L438 HydrophobicContact CZ-CD2 3.88Å; F434-L438 HydrophobicContact CZ-CG 3.95Å; F434-L438 VanDerWaalsContact O-CG 3.31Å; F434-L438 WeakPolarHBondContact O-CG 3.32Å; F434-L438 PolarHBondContact O-N 2.96Å
435	V	91.1	Very high	86.6	Confident	8 Å²	8	44.4 Å²	44.4	5%	0.048	21%	0.208	C	C	.	.	H	α-helix	trans	-59.6	-41.7	173.5	172.6	0	0	0	0	111.4	G431 F432 L438 S439 I470 E471 I474	G431-V435 WeakPolarHBondContact O-CG2 3.27Å; G431-V435 PolarHBondContact O-N 3.35Å; F432-V435 PolarHBondContact O-N 3.47Å; V435-L438 PolarHBondContact O-N 2.81Å; V435-S439 PolarHBondContact O-N 3.13Å; V435-S439 PolarHBondContact O-OG 3.18Å; V435-I470 HydrophobicContact CG2-CG2 3.98Å; V435-E471 HydrophobicContact CG1-CB 4.44Å; V435-I474 HydrophobicContact CG2-CD1 3.91Å
436	D	89.8	Confident	85.4	Confident	95 Å²	95	44.5 Å²	44.5	51%	0.508	21%	0.209	S	C	.	.	H	α-helix	trans	-63.5	-42.6	174.7	-78.6	-13.4	0	0	0	112.2	F432 Q433 F434 S439 K440	F432-D436 PolarHBondContact O-N 2.71Å; Q433-D436 PolarHBondContact O-N 3.33Å; F434-D436 VanDerWaalsContact C-N 3.31Å; F434-D436 PolarHBondContact O-N 2.93Å; D436-S439 PolarHBondContact O-N 3.08Å; D436-K440 WeakPolarHBondContact O-CG 3.36Å; D436-K440 PolarHBondContact O-N 2.77Å
437	F	89.2	Confident	84.1	Confident	30 Å²	30	46 Å²	46	13%	0.132	22%	0.218	C	C	.	.	H	α-helix	trans	-61.2	-44.9	175.8	164.4	-95.6	0	0	0	111.9	C355 L358 E359 Q433 F434 S439 K440 I441	C355-F437 HydrophobicContact CB-CD1 4.44Å; C355-F437 HydrophobicContact CB-CE1 3.87Å; C355-F437 HydrophobicContact CB-CE2 4.22Å; C355-F437 HydrophobicContact CB-CZ 3.69Å; L358-F437 HydrophobicContact CB-CE1 4.37Å; L358-F437 HydrophobicContact CD1-CE1 4.35Å; E359-F437 HydrophobicContact CG-CE2 4.07Å; E359-F437 HydrophobicContact CG-CZ 3.8Å; Q433-F437 WeakPolarHBondContact O-CB 3.4Å; Q433-F437 PolarHBondContact O-N 3.33Å; F434-F437 AromaticContact CD2-CD1 3.99Å; F434-F437 HydrophobicContact CD2-CD1 3.99Å; F434-F437 HydrophobicContact CE2-CD1 4.04Å; F434-F437 HydrophobicContact CE2-CE1 4.27Å; F434-F437 WeakPolarHBondContact O-CB 3.26Å; F434-F437 PolarHBondContact O-N 3.5Å; F437-S439 VanDerWaalsContact C-N 3.32Å; F437-S439 PolarHBondContact O-N 2.63Å; F437-K440 PolarHBondContact O-N 3.4Å; F437-I441 HydrophobicContact CD1-CD1 4.23Å; F437-I441 HydrophobicContact CD2-CD1 4.46Å; F437-I441 HydrophobicContact CD2-CG1 4.5Å; F437-I441 HydrophobicContact CE1-CD1 3.39Å; F437-I441 HydrophobicContact CE1-CG1 4.22Å; F437-I441 HydrophobicContact CE2-CD1 3.68Å; F437-I441 HydrophobicContact CE2-CG1 4.06Å; F437-I441 HydrophobicContact CZ-CD1 3.09Å; F437-I441 HydrophobicContact CZ-CG1 3.94Å; F437-I441 PolarHBondContact O-N 3.42Å
438	L	85.6	Confident	82.7	Confident	10 Å²	10	52 Å²	52	5%	0.052	25%	0.25	C	C	.	.	H	α-helix	trans	-61.5	-41.9	177.1	-71	174.7	0	0	0	112.1	L358 L388 F434 V435 K440 I441 Y442 L467	L358-L438 HydrophobicContact CD1-CD2 3.3Å; L388-L438 HydrophobicContact CD2-CD1 3.39Å; L388-L438 HydrophobicContact CD2-CD2 3.78Å; L388-L438 HydrophobicContact CD2-CG 4.24Å; F434-L438 HydrophobicContact CD1-CD1 3.91Å; F434-L438 HydrophobicContact CD1-CG 4.4Å; F434-L438 HydrophobicContact CD2-CG 4.46Å; F434-L438 HydrophobicContact CE1-CD1 3.53Å; F434-L438 HydrophobicContact CE1-CD2 4.43Å; F434-L438 HydrophobicContact CE1-CG 4.09Å; F434-L438 HydrophobicContact CE2-CD1 4.48Å; F434-L438 HydrophobicContact CE2-CD2 4.12Å; F434-L438 HydrophobicContact CE2-CG 4.14Å; F434-L438 HydrophobicContact CZ-CD1 3.85Å; F434-L438 HydrophobicContact CZ-CD2 3.88Å; F434-L438 HydrophobicContact CZ-CG 3.95Å; F434-L438 VanDerWaalsContact O-CG 3.31Å; F434-L438 WeakPolarHBondContact O-CG 3.32Å; F434-L438 PolarHBondContact O-N 2.96Å; V435-L438 PolarHBondContact O-N 2.81Å; L438-K440 VanDerWaalsContact C-N 3.32Å; L438-K440 PolarHBondContact O-N 3.22Å; L438-I441 PolarHBondContact O-N 3.25Å; L438-Y442 WeakPolarHBondContact O-CB 3.14Å; L438-Y442 PolarHBondContact O-N 2.85Å; L438-L467 HydrophobicContact CB-CD2 3.47Å; L438-L467 VanDerWaalsContact CB-CD2 3.47Å; L438-L467 HydrophobicContact CD1-CD2 3.47Å; L438-L467 VanDerWaalsContact CD1-CD2 3.47Å; L438-L467 HydrophobicContact CG-CD2 4.1Å
439	S	85	Confident	81.2	Confident	43 Å²	43	56.2 Å²	56.2	30%	0.301	27%	0.268	S	S	.	.	H	α-helix	trans	-60.1	-43	175.9	-59.1	0	0	0	0	111.1	V435 D436 F437 Y442 D443	V435-S439 PolarHBondContact O-N 3.13Å; V435-S439 PolarHBondContact O-OG 3.18Å; D436-S439 PolarHBondContact O-N 3.08Å; F437-S439 VanDerWaalsContact C-N 3.32Å; F437-S439 PolarHBondContact O-N 2.63Å; S439-Y442 WeakPolarHBondContact O-CB 3.36Å; S439-Y442 PolarHBondContact O-N 3.18Å; S439-D443 PolarHBondContact O-N 3.48Å; S439-D443 VanDerWaalsContact O-N 3.11Å
440	K	83.4	Confident	79.7	Confident	143 Å²	143	54.9 Å²	54.9	62%	0.622	26%	0.261	S	S	*	.	H	α-helix	trans	-66.3	-42.2	176.4	-70.1	167.9	-173.8	166.9	0	113.3	D436 F437 L438 Y442 D443 R444	D436-K440 WeakPolarHBondContact O-CG 3.36Å; D436-K440 PolarHBondContact O-N 2.77Å; F437-K440 PolarHBondContact O-N 3.4Å; L438-K440 VanDerWaalsContact C-N 3.32Å; L438-K440 PolarHBondContact O-N 3.22Å; K440-Y442 VanDerWaalsContact C-N 3.26Å; K440-Y442 PolarHBondContact O-N 3.44Å; K440-D443 PolarHBondContact O-N 2.52Å; K440-R444 VanDerWaalsContact O-CB 3.23Å; K440-R444 WeakPolarHBondContact O-CB 3.44Å; K440-R444 PolarHBondContact O-N 3.44Å
441	I	75.2	Confident	77.7	Confident	19 Å²	19	60 Å²	60	10%	0.097	30%	0.297	C	S	.	.	H	α-helix	trans	-59.3	-43.3	175.7	-81	-167.2	0	0	0	110.4	L358 E359 F437 L438 R444 L445	L358-I441 HydrophobicContact CB-CD1 4.29Å; E359-I441 HydrophobicContact CG-CD1 4.31Å; F437-I441 HydrophobicContact CD1-CD1 4.23Å; F437-I441 HydrophobicContact CD2-CD1 4.46Å; F437-I441 HydrophobicContact CD2-CG1 4.5Å; F437-I441 HydrophobicContact CE1-CD1 3.39Å; F437-I441 HydrophobicContact CE1-CG1 4.22Å; F437-I441 HydrophobicContact CE2-CD1 3.68Å; F437-I441 HydrophobicContact CE2-CG1 4.06Å; F437-I441 HydrophobicContact CZ-CD1 3.09Å; F437-I441 HydrophobicContact CZ-CG1 3.94Å; F437-I441 PolarHBondContact O-N 3.42Å; L438-I441 PolarHBondContact O-N 3.25Å; I441-R444 PolarHBondContact O-N 2.98Å; I441-L445 HydrophobicContact CG2-CD1 4.33Å; I441-L445 WeakPolarHBondContact O-CB 3.26Å; I441-L445 PolarHBondContact O-N 3.11Å
442	Y	74.8	Confident	75.9	Confident	17 Å²	17	63.3 Å²	63.3	7%	0.067	33%	0.332	C	S	.	.	I	π-helix	trans	-60.8	-51	179.7	180	-89	0	0	0	111.8	L438 S439 K440 R444 L446 L447 H460 V463	L438-Y442 WeakPolarHBondContact O-CB 3.14Å; L438-Y442 PolarHBondContact O-N 2.85Å; S439-Y442 WeakPolarHBondContact O-CB 3.36Å; S439-Y442 PolarHBondContact O-N 3.18Å; K440-Y442 VanDerWaalsContact C-N 3.26Å; K440-Y442 PolarHBondContact O-N 3.44Å; Y442-R444 VanDerWaalsContact C-N 3.34Å; Y442-R444 PolarHBondContact O-N 3.35Å; Y442-L446 HydrophobicContact CD2-CB 4.1Å; Y442-L446 HydrophobicContact CD2-CD1 3.47Å; Y442-L446 VanDerWaalsContact CD2-CD1 3.47Å; Y442-L446 HydrophobicContact CD2-CG 4.41Å; Y442-L446 HydrophobicContact CE2-CB 4.18Å; Y442-L446 HydrophobicContact CE2-CD1 4Å; Y442-L446 HydrophobicContact CG-CD1 4.37Å; Y442-L446 WeakPolarHBondContact O-CB 3.42Å; Y442-L446 PolarHBondContact O-N 2.97Å; Y442-L447 HydrophobicContact CE1-CD1 3.8Å; Y442-L447 PolarHBondContact O-N 3.1Å; Y442-H460 AromaticContact CE1-CE1 3.71Å; Y442-H460 AromaticContact CE1-ND1 3.06Å; Y442-H460 WeakPolarHBondContact CE1-ND1 3.34Å; Y442-H460 AromaticContact CZ-ND1 3.22Å; Y442-H460 WeakPolarHBondContact OH-CA 3.5Å; Y442-H460 WeakPolarHBondContact OH-CB 3.44Å; Y442-H460 PolarHBondContact OH-ND1 3.23Å; Y442-V463 HydrophobicContact CD2-CB 3.95Å; Y442-V463 HydrophobicContact CD2-CG1 3.63Å; Y442-V463 HydrophobicContact CD2-CG2 4.08Å; Y442-V463 HydrophobicContact CE2-CB 3.94Å; Y442-V463 HydrophobicContact CE2-CG1 4.15Å; Y442-V463 HydrophobicContact CE2-CG2 3.97Å; Y442-V463 HydrophobicContact CG-CG1 4.29Å
443	D	75.4	Confident	74.1	Confident	99 Å²	99	68.3 Å²	68.3	53%	0.529	36%	0.359	S	S	.	.	I	π-helix	trans	-64	-39.6	-179.6	-70.3	-20.8	0	0	0	112.3	S439 K440	S439-D443 PolarHBondContact O-N 3.48Å; S439-D443 VanDerWaalsContact O-N 3.11Å; K440-D443 PolarHBondContact O-N 2.52Å
444	R	72.2	Confident	72.2	Confident	194 Å²	194	74.4 Å²	74.4	73%	0.732	39%	0.385	S	S	*	.	I	π-helix	trans	-79.8	-43.7	-173.4	-171.5	178.9	-178.7	-166.4	-0.7	113.7	K440 I441 Y442	K440-R444 VanDerWaalsContact O-CB 3.23Å; K440-R444 WeakPolarHBondContact O-CB 3.44Å; K440-R444 PolarHBondContact O-N 3.44Å; I441-R444 PolarHBondContact O-N 2.98Å; Y442-R444 VanDerWaalsContact C-N 3.34Å; Y442-R444 PolarHBondContact O-N 3.35Å
445	L	65.3	Low	70.9	Confident	48 Å²	48	77.1 Å²	77.1	25%	0.251	40%	0.404	S	S	.	.	I	π-helix	trans	-105.4	-43.4	-166.5	-60.8	177.4	0	0	0	112.7	W362 I441 K449	W362-L445 HydrophobicContact CB-CD1 3.58Å; W362-L445 HydrophobicContact CG-CD1 4.43Å; I441-L445 HydrophobicContact CG2-CD1 4.33Å; I441-L445 WeakPolarHBondContact O-CB 3.26Å; I441-L445 PolarHBondContact O-N 3.11Å; L445-K449 VanDerWaalsContact O-CG 3.26Å; L445-K449 WeakPolarHBondContact O-CG 3.47Å
446	L	67.3	Low	69.7	Low	9 Å²	9	78.1 Å²	78.1	5%	0.047	41%	0.413	C	S	.	.	I	π-helix	trans	-77.5	-45.9	-176.2	-81	162.1	0	0	0	111.8	W362 L381 Y442 W450	W362-L446 HydrophobicContact CE3-CD2 4.47Å; W362-L446 HydrophobicContact CH2-CD2 3.15Å; W362-L446 HydrophobicContact CH2-CG 3.99Å; W362-L446 HydrophobicContact CZ2-CD1 4.33Å; W362-L446 HydrophobicContact CZ2-CD2 3.62Å; W362-L446 HydrophobicContact CZ2-CG 4.14Å; W362-L446 HydrophobicContact CZ3-CD2 3.61Å; W362-L446 HydrophobicContact CZ3-CG 4.19Å; L381-L446 HydrophobicContact CD1-CD2 4.16Å; Y442-L446 HydrophobicContact CD2-CB 4.1Å; Y442-L446 HydrophobicContact CD2-CD1 3.47Å; Y442-L446 VanDerWaalsContact CD2-CD1 3.47Å; Y442-L446 HydrophobicContact CD2-CG 4.41Å; Y442-L446 HydrophobicContact CE2-CB 4.18Å; Y442-L446 HydrophobicContact CE2-CD1 4Å; Y442-L446 HydrophobicContact CG-CD1 4.37Å; Y442-L446 WeakPolarHBondContact O-CB 3.42Å; Y442-L446 PolarHBondContact O-N 2.97Å; L446-W450 PolarHBondContact O-N 2.83Å
447	L	65.5	Low	68.9	Low	92 Å²	92	76.4 Å²	76.4	48%	0.482	41%	0.409	S	S	.	.	H	α-helix	trans	-70.6	-41.3	-173.4	-146.6	113.7	0	0	0	112.9	Y442 K449	Y442-L447 HydrophobicContact CE1-CD1 3.8Å; Y442-L447 PolarHBondContact O-N 3.1Å; L447-K449 VanDerWaalsContact C-N 3.35Å; L447-K449 PolarHBondContact O-N 2.79Å
448	L	63.8	Low	68.4	Low	127 Å²	127	83.9 Å²	83.9	67%	0.665	44%	0.436	S	S	*	.	H	α-helix	trans	-63.2	-39.4	-179.6	-113	116.1	0	0	0	112.4	S451	L448-S451 PolarHBondContact O-OG 2.75Å
449	K	63	Low	68	Low	89 Å²	89	84.1 Å²	84.1	39%	0.387	44%	0.438	S	S	.	.	H	α-helix	trans	-82.1	-19.6	-172.6	-62.3	-75.7	-173.8	171.5	0	113.3	E364 F372 L445 L447	E364-K449 IonicContact OE1-NZ 3.52Å; E364-K449 PolarHBondContact OE1-NZ 2.77Å; E364-K449 IonicContact OE2-NZ 3.32Å; E364-K449 PolarHBondContact OE2-NZ 2.79Å; F372-K449 HydrophobicContact CE1-CD 4.36Å; F372-K449 HydrophobicContact CE1-CG 4.46Å; F372-K449 HydrophobicContact CZ-CG 4.37Å; L445-K449 VanDerWaalsContact O-CG 3.26Å; L445-K449 WeakPolarHBondContact O-CG 3.47Å; L447-K449 VanDerWaalsContact C-N 3.35Å; L447-K449 PolarHBondContact O-N 2.79Å
450	W	61.2	Low	67.6	Low	41 Å²	41	85.3 Å²	85.3	16%	0.155	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	15	-175	-78.3	27.6	0	0	0	114.2	A377 W378 L381 L446 G452 D453 A456 V459	A377-W450 HydrophobicContact CB-CZ2 4.03Å; W378-W450 AromaticContact CE3-CH2 3.9Å; W378-W450 HydrophobicContact CE3-CH2 3.9Å; W378-W450 HydrophobicContact CZ3-CH2 4.16Å; L381-W450 HydrophobicContact CD2-CH2 3.91Å; L446-W450 PolarHBondContact O-N 2.83Å; W450-G452 PolarHBondContact O-N 3.12Å; W450-D453 PolarHBondContact O-N 2.92Å; W450-A456 HydrophobicContact CB-CB 4.31Å; W450-A456 HydrophobicContact CE3-CB 4.46Å; W450-V459 HydrophobicContact CH2-CG2 4.12Å; W450-V459 HydrophobicContact CZ3-CB 4.08Å; W450-V459 HydrophobicContact CZ3-CG1 4.32Å; W450-V459 HydrophobicContact CZ3-CG2 3.57Å
451	S	53.6	Low	67.6	Low	108 Å²	108	84.6 Å²	84.6	76%	0.755	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	13.3	-170.9	45.6	0	0	0	0	116.6	L448	L448-S451 PolarHBondContact O-OG 2.75Å
452	G	54.4	Low	68	Low	71 Å²	71	86.8 Å²	86.8	73%	0.732	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	-16.6	180	0	0	0	0	0	117.4	W450	W450-G452 PolarHBondContact O-N 3.12Å
453	D	55	Low	68.3	Low	123 Å²	123	86.4 Å²	86.4	66%	0.658	45%	0.451	S	S	*	.			trans	-119.5	143.3	-166.8	-77.9	-28.1	0	0	0	114.6	W450 S455 A456	W450-D453 PolarHBondContact O-N 2.92Å; D453-S455 PolarHBondContact O-N 2.73Å; D453-A456 WeakPolarHBondContact O-CB 3.3Å; D453-A456 PolarHBondContact O-N 3.25Å
454	F	52.4	Low	68.7	Low	197 Å²	197	88 Å²	88	86%	0.864	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-16.8	173.1	-158.7	-90.4	0	0	0	113.3	A456 S457	F454-A456 VanDerWaalsContact C-N 3.29Å; F454-A456 PolarHBondContact O-N 2.97Å; F454-S457 PolarHBondContact O-OG 3.16Å
455	S	64.9	Low	69.5	Low	57 Å²	57	81.7 Å²	81.7	40%	0.399	44%	0.439	S	S	.	.	H	α-helix	trans	-70.5	-21.9	174.5	67.4	0	0	0	0	113.3	D453 V459	D453-S455 PolarHBondContact O-N 2.73Å; S455-V459 WeakPolarHBondContact O-CG2 3.26Å; S455-V459 PolarHBondContact O-N 3.3Å
456	A	67.5	Low	70.6	Confident	29 Å²	29	80.6 Å²	80.6	24%	0.24	44%	0.435	C	S	.	.	H	α-helix	trans	-68	-37.6	-176.3	0	0	0	0	0	112.9	W450 D453 F454 V459 H460	W450-A456 HydrophobicContact CB-CB 4.31Å; W450-A456 HydrophobicContact CE3-CB 4.46Å; D453-A456 WeakPolarHBondContact O-CB 3.3Å; D453-A456 PolarHBondContact O-N 3.25Å; F454-A456 VanDerWaalsContact C-N 3.29Å; F454-A456 PolarHBondContact O-N 2.97Å; A456-V459 PolarHBondContact O-N 2.63Å; A456-H460 PolarHBondContact O-N 3.23Å
457	S	72.9	Confident	71.6	Confident	59 Å²	59	81 Å²	81	41%	0.413	44%	0.437	S	S	.	.	H	α-helix	trans	-65.5	-43.3	179.2	58.8	0	0	0	0	112.1	F454 V459 H460 E461	F454-S457 PolarHBondContact O-OG 3.16Å; S457-V459 VanDerWaalsContact C-N 3.34Å; S457-V459 PolarHBondContact O-N 2.86Å; S457-H460 VanDerWaalsContact O-CB 3.23Å; S457-H460 WeakPolarHBondContact O-CB 3.05Å; S457-H460 PolarHBondContact O-N 3.27Å; S457-H460 VanDerWaalsContact O-N 3.16Å; S457-E461 PolarHBondContact O-N 2.98Å
458	R	77.6	Confident	72.8	Confident	186 Å²	186	79.7 Å²	79.7	70%	0.702	44%	0.436	S	S	*	.	H	α-helix	trans	-67.4	-37.3	178.5	-166.4	172.5	-177.9	179.9	0.4	111.8	H460 E461 V462	R458-H460 VanDerWaalsContact C-N 3.31Å; R458-E461 PolarHBondContact O-N 3.44Å; R458-V462 WeakPolarHBondContact O-CG2 3.43Å; R458-V462 PolarHBondContact O-N 3.34Å; R458-V462 VanDerWaalsContact O-N 3.14Å
459	V	76.7	Confident	74.2	Confident	15 Å²	15	75.7 Å²	75.7	9%	0.091	42%	0.418	C	S	.	.	H	α-helix	trans	-65.7	-37.3	172.9	171	0	0	0	0	111.1	W378 L381 W450 S455 A456 S457 V462 V463	W378-V459 HydrophobicContact CZ3-CG2 4.23Å; L381-V459 HydrophobicContact CD1-CG1 3.82Å; L381-V459 HydrophobicContact CD2-CB 4.37Å; L381-V459 HydrophobicContact CD2-CG1 3.63Å; L381-V459 HydrophobicContact CD2-CG2 3.74Å; L381-V459 HydrophobicContact CG-CG1 4.39Å; W450-V459 HydrophobicContact CH2-CG2 4.12Å; W450-V459 HydrophobicContact CZ3-CB 4.08Å; W450-V459 HydrophobicContact CZ3-CG1 4.32Å; W450-V459 HydrophobicContact CZ3-CG2 3.57Å; S455-V459 WeakPolarHBondContact O-CG2 3.26Å; S455-V459 PolarHBondContact O-N 3.3Å; A456-V459 PolarHBondContact O-N 2.63Å; S457-V459 VanDerWaalsContact C-N 3.34Å; S457-V459 PolarHBondContact O-N 2.86Å; V459-V462 PolarHBondContact O-N 3.21Å; V459-V463 HydrophobicContact CG1-CG2 4.24Å; V459-V463 WeakPolarHBondContact O-CG2 3.33Å; V459-V463 PolarHBondContact O-N 3.32Å
460	H	77.8	Confident	75.6	Confident	68 Å²	68	71.4 Å²	71.4	32%	0.315	40%	0.399	S	S	.	.	H	α-helix	trans	-56.9	-50.9	172.4	-174.2	71.7	0	0	0	112.4	Y442 A456 S457 R458 V462 V463 K464	Y442-H460 AromaticContact CE1-CE1 3.71Å; Y442-H460 AromaticContact CE1-ND1 3.06Å; Y442-H460 WeakPolarHBondContact CE1-ND1 3.34Å; Y442-H460 AromaticContact CZ-ND1 3.22Å; Y442-H460 WeakPolarHBondContact OH-CA 3.5Å; Y442-H460 WeakPolarHBondContact OH-CB 3.44Å; Y442-H460 PolarHBondContact OH-ND1 3.23Å; A456-H460 PolarHBondContact O-N 3.23Å; S457-H460 VanDerWaalsContact O-CB 3.23Å; S457-H460 WeakPolarHBondContact O-CB 3.05Å; S457-H460 PolarHBondContact O-N 3.27Å; S457-H460 VanDerWaalsContact O-N 3.16Å; R458-H460 VanDerWaalsContact C-N 3.31Å; H460-V462 VanDerWaalsContact C-N 3.33Å; H460-V462 PolarHBondContact O-N 2.96Å; H460-V463 PolarHBondContact O-N 3.29Å; H460-K464 WeakPolarHBondContact O-CB 3.3Å; H460-K464 PolarHBondContact O-N 2.86Å
461	E	82.4	Confident	77.2	Confident	129 Å²	129	73.5 Å²	73.5	60%	0.603	41%	0.411	S	S	*	.	H	α-helix	trans	-58.6	-44.9	179.7	-71.6	172.5	-174	0	0	111.8	S457 R458 S465	S457-E461 PolarHBondContact O-N 2.98Å; R458-E461 PolarHBondContact O-N 3.44Å; E461-S465 WeakPolarHBondContact O-CB 3.32Å; E461-S465 PolarHBondContact O-N 3.21Å; E461-S465 PolarHBondContact O-OG 3.42Å
462	V	83.4	Confident	79.1	Confident	64 Å²	64	74.5 Å²	74.5	39%	0.388	41%	0.407	S	S	.	.	H	α-helix	trans	-68.4	-47.3	-178.6	179.8	0	0	0	0	111.2	F385 R458 V459 H460 K464 S465 S466	F385-V462 HydrophobicContact CE1-CB 4.45Å; F385-V462 HydrophobicContact CE1-CG1 3.65Å; F385-V462 HydrophobicContact CE2-CG1 4.38Å; F385-V462 HydrophobicContact CZ-CB 4.07Å; F385-V462 HydrophobicContact CZ-CG1 3.55Å; R458-V462 WeakPolarHBondContact O-CG2 3.43Å; R458-V462 PolarHBondContact O-N 3.34Å; R458-V462 VanDerWaalsContact O-N 3.14Å; V459-V462 PolarHBondContact O-N 3.21Å; H460-V462 VanDerWaalsContact C-N 3.33Å; H460-V462 PolarHBondContact O-N 2.96Å; V462-K464 VanDerWaalsContact C-N 3.35Å; V462-K464 PolarHBondContact O-N 3.44Å; V462-S465 PolarHBondContact O-N 3.1Å; V462-S465 PolarHBondContact O-OG 2.81Å; V462-S466 PolarHBondContact O-N 3.22Å; V462-S466 PolarHBondContact O-OG 3.22Å
463	V	81.9	Confident	81	Confident	9 Å²	9	72.4 Å²	72.4	6%	0.055	38%	0.383	C	S	.	.	H	α-helix	trans	-60.7	-46.7	177.5	176.6	0	0	0	0	110.6	L381 F385 Y442 V459 H460 S465 S466 L467	L381-V463 HydrophobicContact CD1-CG2 4.33Å; F385-V463 HydrophobicContact CE1-CB 4.37Å; F385-V463 HydrophobicContact CE1-CG2 3.69Å; F385-V463 HydrophobicContact CE2-CG2 4.38Å; F385-V463 HydrophobicContact CZ-CB 4.42Å; F385-V463 HydrophobicContact CZ-CG2 3.41Å; F385-V463 VanDerWaalsContact CZ-CG2 3.41Å; Y442-V463 HydrophobicContact CD2-CB 3.95Å; Y442-V463 HydrophobicContact CD2-CG1 3.63Å; Y442-V463 HydrophobicContact CD2-CG2 4.08Å; Y442-V463 HydrophobicContact CE2-CB 3.94Å; Y442-V463 HydrophobicContact CE2-CG1 4.15Å; Y442-V463 HydrophobicContact CE2-CG2 3.97Å; Y442-V463 HydrophobicContact CG-CG1 4.29Å; V459-V463 HydrophobicContact CG1-CG2 4.24Å; V459-V463 WeakPolarHBondContact O-CG2 3.33Å; V459-V463 PolarHBondContact O-N 3.32Å; H460-V463 PolarHBondContact O-N 3.29Å; V463-S465 VanDerWaalsContact C-N 3.27Å; V463-S465 PolarHBondContact O-N 2.88Å; V463-S466 PolarHBondContact O-N 3.24Å; V463-S466 VanDerWaalsContact O-N 3.11Å; V463-L467 HydrophobicContact CG1-CD1 4.05Å; V463-L467 HydrophobicContact CG1-CG 4.2Å; V463-L467 WeakPolarHBondContact O-CG 3.31Å; V463-L467 PolarHBondContact O-N 3.49Å
464	K	84.9	Confident	82.9	Confident	134 Å²	134	66.5 Å²	66.5	58%	0.583	35%	0.351	S	S	*	.	H	α-helix	trans	-59.8	-38.8	178.3	-170.1	172.9	-175.7	173.8	0	112	H460 V462 L467 S468	H460-K464 WeakPolarHBondContact O-CB 3.3Å; H460-K464 PolarHBondContact O-N 2.86Å; V462-K464 VanDerWaalsContact C-N 3.35Å; V462-K464 PolarHBondContact O-N 3.44Å; K464-L467 PolarHBondContact O-N 3.29Å; K464-S468 WeakPolarHBondContact O-CB 3.33Å; K464-S468 PolarHBondContact O-N 2.82Å; K464-S468 PolarHBondContact O-OG 3.49Å
465	S	88.4	Confident	84.9	Confident	61 Å²	61	58.2 Å²	58.2	43%	0.427	32%	0.317	S	S	.	.	H	α-helix	trans	-63.4	-43.8	174.6	76	0	0	0	0	112.2	E461 V462 V463 L467 S468 S469	E461-S465 WeakPolarHBondContact O-CB 3.32Å; E461-S465 PolarHBondContact O-N 3.21Å; E461-S465 PolarHBondContact O-OG 3.42Å; V462-S465 PolarHBondContact O-N 3.1Å; V462-S465 PolarHBondContact O-OG 2.81Å; V463-S465 VanDerWaalsContact C-N 3.27Å; V463-S465 PolarHBondContact O-N 2.88Å; S465-L467 PolarHBondContact O-N 2.9Å; S465-S468 WeakPolarHBondContact CA-OG 3.48Å; S465-S468 PolarHBondContact O-N 2.76Å; S465-S468 PolarHBondContact O-OG 3.19Å; S465-S469 PolarHBondContact O-N 2.84Å
466	S	87.3	Confident	86.3	Confident	25 Å²	25	56 Å²	56	18%	0.175	30%	0.304	C	S	.	.	H	α-helix	trans	-64.3	-40.8	176.2	-59.1	0	0	0	0	112.2	V462 V463 S469 I470	V462-S466 PolarHBondContact O-N 3.22Å; V462-S466 PolarHBondContact O-OG 3.22Å; V463-S466 PolarHBondContact O-N 3.24Å; V463-S466 VanDerWaalsContact O-N 3.11Å; S466-S469 WeakPolarHBondContact O-CB 3.36Å; S466-S469 PolarHBondContact O-N 3.42Å; S466-I470 WeakPolarHBondContact O-CG1 3.34Å; S466-I470 PolarHBondContact O-N 3.15Å
467	L	88.6	Confident	87.6	Confident	17 Å²	17	54.6 Å²	54.6	9%	0.089	29%	0.292	C	S	.	.	H	α-helix	trans	-61.7	-46.3	175.2	-66.3	177.7	0	0	0	111.5	L438 V463 K464 S465 S469 I470 E471	L438-L467 HydrophobicContact CB-CD2 3.47Å; L438-L467 VanDerWaalsContact CB-CD2 3.47Å; L438-L467 HydrophobicContact CD1-CD2 3.47Å; L438-L467 VanDerWaalsContact CD1-CD2 3.47Å; L438-L467 HydrophobicContact CG-CD2 4.1Å; V463-L467 HydrophobicContact CG1-CD1 4.05Å; V463-L467 HydrophobicContact CG1-CG 4.2Å; V463-L467 WeakPolarHBondContact O-CG 3.31Å; V463-L467 PolarHBondContact O-N 3.49Å; K464-L467 PolarHBondContact O-N 3.29Å; S465-L467 PolarHBondContact O-N 2.9Å; L467-S469 PolarHBondContact O-N 2.87Å; L467-I470 PolarHBondContact O-N 3.2Å; L467-E471 WeakPolarHBondContact O-CB 3.48Å; L467-E471 PolarHBondContact O-N 3.41Å
468	S	91.1	Very high	88.6	Confident	65 Å²	65	51.8 Å²	51.8	46%	0.455	27%	0.273	S	S	.	.	H	α-helix	trans	-63	-32.3	176.7	67.1	0	0	0	0	112.7	K464 S465 L472	K464-S468 WeakPolarHBondContact O-CB 3.33Å; K464-S468 PolarHBondContact O-N 2.82Å; K464-S468 PolarHBondContact O-OG 3.49Å; S465-S468 WeakPolarHBondContact CA-OG 3.48Å; S465-S468 PolarHBondContact O-N 2.76Å; S465-S468 PolarHBondContact O-OG 3.19Å; S468-L472 VanDerWaalsContact O-CB 3.26Å; S468-L472 WeakPolarHBondContact O-CB 3.47Å; S468-L472 PolarHBondContact O-N 2.8Å
469	S	93.3	Very high	89.4	Confident	42 Å²	42	44.9 Å²	44.9	29%	0.294	25%	0.253	S	S	.	.	H	α-helix	trans	-68.5	-44.7	176.7	-155.1	0	0	0	0	111.8	E392 S465 S466 L467 L472 A473	E392-S469 VanDerWaalsContact OE1-CB 3.31Å; E392-S469 WeakPolarHBondContact OE1-CB 3.17Å; E392-S469 PolarHBondContact OE1-OG 3.08Å; S465-S469 PolarHBondContact O-N 2.84Å; S466-S469 WeakPolarHBondContact O-CB 3.36Å; S466-S469 PolarHBondContact O-N 3.42Å; L467-S469 PolarHBondContact O-N 2.87Å; S469-L472 WeakPolarHBondContact O-CB 3.32Å; S469-L472 PolarHBondContact O-N 2.93Å; S469-A473 WeakPolarHBondContact O-CB 3.22Å; S469-A473 PolarHBondContact O-N 2.95Å
470	I	93.1	Very high	90.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.1	-45.3	175.2	-68.2	166.2	0	0	0	110.8	L388 Y391 E392 V435 S466 L467 L472 A473 I474	L388-I470 HydrophobicContact CB-CD1 4.05Å; L388-I470 HydrophobicContact CD2-CD1 3.9Å; L388-I470 HydrophobicContact CG-CD1 4.45Å; Y391-I470 HydrophobicContact CD1-CD1 4.32Å; Y391-I470 HydrophobicContact CD1-CG2 3.95Å; Y391-I470 HydrophobicContact CE1-CG2 3.69Å; E392-I470 HydrophobicContact CB-CG1 3.92Å; E392-I470 HydrophobicContact CG-CG1 4.19Å; V435-I470 HydrophobicContact CG2-CG2 3.98Å; S466-I470 WeakPolarHBondContact O-CG1 3.34Å; S466-I470 PolarHBondContact O-N 3.15Å; L467-I470 PolarHBondContact O-N 3.2Å; I470-L472 VanDerWaalsContact C-N 3.3Å; I470-L472 PolarHBondContact O-N 2.91Å; I470-A473 WeakPolarHBondContact O-CB 3.36Å; I470-A473 PolarHBondContact O-N 3Å; I470-A473 VanDerWaalsContact O-N 3.15Å; I470-I474 HydrophobicContact CG2-CD1 3.73Å; I470-I474 HydrophobicContact CG2-CG1 4.43Å; I470-I474 WeakPolarHBondContact O-CG1 3.38Å; I470-I474 PolarHBondContact O-N 2.96Å
471	E	93.5	Very high	91	Very high	84 Å²	84	42.4 Å²	42.4	39%	0.393	24%	0.244	S	C	.	.	H	α-helix	trans	-60.1	-41.3	177	-169.6	-175.3	169.2	0	0	111.4	F432 V435 L467 I474 S475	F432-E471 HydrophobicContact CD1-CG 4.48Å; F432-E471 HydrophobicContact CE1-CG 3.94Å; V435-E471 HydrophobicContact CG1-CB 4.44Å; L467-E471 WeakPolarHBondContact O-CB 3.48Å; L467-E471 PolarHBondContact O-N 3.41Å; E471-I474 PolarHBondContact O-N 2.9Å; E471-S475 WeakPolarHBondContact O-CB 3.29Å; E471-S475 PolarHBondContact O-N 2.94Å; E471-S475 PolarHBondContact O-OG 3.19Å
472	L	94.3	Very high	91.5	Very high	130 Å²	130	36.4 Å²	36.4	68%	0.681	22%	0.216	S	C	*	.	H	α-helix	trans	-63	-42.6	174.1	-169.2	88	0	0	0	111.5	S468 S469 I470 S475 G476	S468-L472 VanDerWaalsContact O-CB 3.26Å; S468-L472 WeakPolarHBondContact O-CB 3.47Å; S468-L472 PolarHBondContact O-N 2.8Å; S469-L472 WeakPolarHBondContact O-CB 3.32Å; S469-L472 PolarHBondContact O-N 2.93Å; I470-L472 VanDerWaalsContact C-N 3.3Å; I470-L472 PolarHBondContact O-N 2.91Å; L472-S475 PolarHBondContact O-N 3.4Å; L472-G476 PolarHBondContact O-N 3.5Å
473	A	93.9	Very high	92.1	Very high	26 Å²	26	33.6 Å²	33.6	22%	0.215	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-43.5	178.7	0	0	0	0	0	112.1	V395 S469 I470 G476	V395-A473 HydrophobicContact CG1-CB 3.85Å; S469-A473 WeakPolarHBondContact O-CB 3.22Å; S469-A473 PolarHBondContact O-N 2.95Å; I470-A473 WeakPolarHBondContact O-CB 3.36Å; I470-A473 PolarHBondContact O-N 3Å; I470-A473 VanDerWaalsContact O-N 3.15Å; A473-G476 PolarHBondContact O-N 2.95Å
474	I	94.7	Very high	92.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.5	-44.3	174.2	-64.3	161.5	0	0	0	110.1	V395 I428 F432 V435 I470 E471 G476 L477	V395-I474 HydrophobicContact CG1-CG1 4.14Å; V395-I474 HydrophobicContact CG2-CG1 4.49Å; I428-I474 HydrophobicContact CG2-CG2 4.34Å; F432-I474 HydrophobicContact CD2-CG2 4.08Å; F432-I474 HydrophobicContact CE1-CG2 4.49Å; F432-I474 HydrophobicContact CE2-CG2 3.84Å; F432-I474 HydrophobicContact CZ-CG2 4.05Å; V435-I474 HydrophobicContact CG2-CD1 3.91Å; I470-I474 HydrophobicContact CG2-CD1 3.73Å; I470-I474 HydrophobicContact CG2-CG1 4.43Å; I470-I474 WeakPolarHBondContact O-CG1 3.38Å; I470-I474 PolarHBondContact O-N 2.96Å; E471-I474 PolarHBondContact O-N 2.9Å; I474-G476 PolarHBondContact O-N 3.17Å; I474-L477 VanDerWaalsContact O-CB 3.3Å; I474-L477 WeakPolarHBondContact O-CB 3.47Å; I474-L477 PolarHBondContact O-N 2.83Å
475	S	94.8	Very high	93.2	Very high	22 Å²	22	30.5 Å²	30.5	15%	0.154	19%	0.188	C	C	.	.	H	α-helix	trans	-58.7	-32.9	177.2	-63.6	0	0	0	0	111.9	E471 L472 L477 V478 S479	E471-S475 WeakPolarHBondContact O-CB 3.29Å; E471-S475 PolarHBondContact O-N 2.94Å; E471-S475 PolarHBondContact O-OG 3.19Å; L472-S475 PolarHBondContact O-N 3.4Å; S475-L477 PolarHBondContact O-N 3.2Å; S475-V478 PolarHBondContact O-N 3.32Å; S475-S479 PolarHBondContact O-N 3.23Å; S475-S479 PolarHBondContact O-OG 2.95Å
476	G	94.3	Very high	93.5	Very high	11 Å²	11	27.6 Å²	27.6	11%	0.113	17%	0.168	C	C	.	.	H	α-helix	trans	-55.5	-33.9	173	0	0	0	0	0	114.1	L472 A473 I474 V478 S479 S480 L481	L472-G476 PolarHBondContact O-N 3.5Å; A473-G476 PolarHBondContact O-N 2.95Å; I474-G476 PolarHBondContact O-N 3.17Å; G476-V478 PolarHBondContact O-N 2.77Å; G476-S479 WeakPolarHBondContact CA-OG 2.94Å; G476-S480 PolarHBondContact O-N 3.36Å; G476-S480 PolarHBondContact O-OG 2.88Å; G476-L481 PolarHBondContact O-N 3.23Å
477	L	94.3	Very high	93.9	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.164	C	C	.	.	I	π-helix	trans	-63.3	-30.9	175	-66.3	167.2	0	0	0	111.7	Y398 H399 F427 I428 I474 S475 L481 L482	Y398-L477 HydrophobicContact CD1-CD1 4.26Å; Y398-L477 HydrophobicContact CD1-CD2 4.1Å; Y398-L477 HydrophobicContact CE1-CD1 4.28Å; Y398-L477 HydrophobicContact CE1-CD2 4.25Å; H399-L477 HydrophobicContact CB-CD2 3.72Å; F427-L477 HydrophobicContact CD1-CD1 3.65Å; F427-L477 HydrophobicContact CE1-CD1 3.82Å; I428-L477 HydrophobicContact CD1-CB 4.01Å; I428-L477 HydrophobicContact CG1-CB 3.96Å; I428-L477 HydrophobicContact CG1-CD1 4.02Å; I474-L477 VanDerWaalsContact O-CB 3.3Å; I474-L477 WeakPolarHBondContact O-CB 3.47Å; I474-L477 PolarHBondContact O-N 2.83Å; S475-L477 PolarHBondContact O-N 3.2Å; L477-L481 HydrophobicContact CD2-CD2 3.78Å; L477-L481 WeakPolarHBondContact O-CB 3.29Å; L477-L482 WeakPolarHBondContact O-CG 3.41Å; L477-L482 PolarHBondContact O-N 2.95Å
478	V	95	Very high	94.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.176	C	C	.	.	I	π-helix	trans	-85.5	-57.1	175.2	-174.2	0	0	0	0	110.3	I428 S475 G476 S480 T483 V538 L542 M546	I428-V478 HydrophobicContact CD1-CG2 3.76Å; I428-V478 HydrophobicContact CG1-CG2 4.42Å; I428-V478 HydrophobicContact CG2-CG2 4.11Å; S475-V478 PolarHBondContact O-N 3.32Å; G476-V478 PolarHBondContact O-N 2.77Å; V478-S480 VanDerWaalsContact C-N 3.27Å; V478-S480 PolarHBondContact O-N 2.82Å; V478-T483 PolarHBondContact O-N 3.15Å; V478-T483 PolarHBondContact O-OG1 2.8Å; V478-V538 HydrophobicContact CG2-CG1 4.27Å; V478-L542 HydrophobicContact CB-CD1 4.28Å; V478-L542 HydrophobicContact CB-CD2 3.76Å; V478-L542 HydrophobicContact CB-CG 3.88Å; V478-L542 HydrophobicContact CG1-CD1 4.43Å; V478-L542 HydrophobicContact CG1-CD2 4.2Å; V478-L542 HydrophobicContact CG1-CG 3.85Å; V478-L542 HydrophobicContact CG2-CD2 3.83Å; V478-L542 HydrophobicContact CG2-CG 4.4Å; V478-M546 HydrophobicContact CG1-CB 4.08Å; V478-M546 HydrophobicContact CG1-CG 4.18Å; V478-M546 HydrophobicContact CG1-SD 3.73Å
479	S	93.7	Very high	94.3	Very high	40 Å²	40	28.4 Å²	28.4	28%	0.28	16%	0.163	S	C	.	.	I	π-helix	trans	-70.1	-19.3	-169.5	64.3	0	0	0	0	114.9	S475 G476 T483	S475-S479 PolarHBondContact O-N 3.23Å; S475-S479 PolarHBondContact O-OG 2.95Å; G476-S479 WeakPolarHBondContact CA-OG 2.94Å; S479-T483 VanDerWaalsContact C-OG1 3.28Å; S479-T483 WeakPolarHBondContact CA-OG1 3.41Å; S479-T483 PolarHBondContact O-OG1 3.32Å
480	S	93.2	Very high	94.3	Very high	30 Å²	30	26.4 Å²	26.4	21%	0.21	15%	0.149	C	C	.	.	I	π-helix	trans	-117.9	-63.5	172.1	56.1	0	0	0	0	111.9	H399 G476 V478 T483 D484	H399-S480 PolarHBondContact CE1-OG 2.92Å; H399-S480 PolarHBondContact NE2-OG 2.96Å; G476-S480 PolarHBondContact O-N 3.36Å; G476-S480 PolarHBondContact O-OG 2.88Å; V478-S480 VanDerWaalsContact C-N 3.27Å; V478-S480 PolarHBondContact O-N 2.82Å; S480-T483 PolarHBondContact O-N 3.06Å; S480-D484 WeakPolarHBondContact O-CB 3.38Å; S480-D484 PolarHBondContact O-N 2.93Å
481	L	94	Very high	94.4	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.01	16%	0.159	C	C	.	.	I	π-helix	trans	-61.5	-57.2	-170.2	178.3	78.2	0	0	0	113.2	C402 K403 L406 I424 G476 L477 W485	C402-L481 HydrophobicContact CB-CD1 4.18Å; C402-L481 HydrophobicContact CB-CD2 3.54Å; K403-L481 VanDerWaalsContact CA-CD1 3.48Å; K403-L481 HydrophobicContact CB-CD1 3.95Å; L406-L481 HydrophobicContact CD1-CD1 3.73Å; L406-L481 HydrophobicContact CD1-CG 4.45Å; I424-L481 HydrophobicContact CD1-CD2 3.96Å; I424-L481 HydrophobicContact CG2-CD2 4.37Å; G476-L481 PolarHBondContact O-N 3.23Å; L477-L481 HydrophobicContact CD2-CD2 3.78Å; L477-L481 WeakPolarHBondContact O-CB 3.29Å; L481-W485 WeakPolarHBondContact O-CB 3.12Å; L481-W485 PolarHBondContact O-N 2.95Å
482	L	94.4	Very high	94.4	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.01	17%	0.165	C	C	.	.	I	π-helix	trans	-70.8	-32.6	179.6	-66.9	180	0	0	0	112.4	V421 I424 V425 I428 L477 L486 L533 M546	V421-L482 HydrophobicContact CG1-CD2 4.4Å; I424-L482 HydrophobicContact CG2-CD1 4.4Å; I424-L482 HydrophobicContact CG2-CD2 4.25Å; I424-L482 HydrophobicContact CG2-CG 4.39Å; V425-L482 HydrophobicContact CG2-CD1 4.48Å; I428-L482 HydrophobicContact CD1-CD1 3.7Å; L477-L482 WeakPolarHBondContact O-CG 3.41Å; L477-L482 PolarHBondContact O-N 2.95Å; L482-L486 WeakPolarHBondContact O-CB 3.48Å; L482-L486 PolarHBondContact O-N 3.19Å; L482-L533 HydrophobicContact CD1-CD2 3.9Å; L482-M546 HydrophobicContact CB-SD 4.32Å
483	T	95.3	Very high	94.3	Very high	6 Å²	6	26.2 Å²	26.2	4%	0.037	15%	0.149	C	C	.	.	H	α-helix	trans	-61.8	-49.6	174.5	-55.5	0	0	0	0	111.1	V478 S479 S480 S487 M546 R549	V478-T483 PolarHBondContact O-N 3.15Å; V478-T483 PolarHBondContact O-OG1 2.8Å; S479-T483 VanDerWaalsContact C-OG1 3.28Å; S479-T483 WeakPolarHBondContact CA-OG1 3.41Å; S479-T483 PolarHBondContact O-OG1 3.32Å; S480-T483 PolarHBondContact O-N 3.06Å; T483-S487 VanDerWaalsContact O-CB 3.3Å; T483-S487 WeakPolarHBondContact O-CB 3.1Å; T483-S487 PolarHBondContact O-N 3.2Å; T483-S487 PolarHBondContact O-OG 2.59Å; T483-M546 VanDerWaalsContact OG1-CG 3.3Å; T483-M546 WeakPolarHBondContact OG1-CG 3.47Å; T483-R549 HydrophobicContact CG2-CB 3.91Å
484	D	94.4	Very high	94.3	Very high	73 Å²	73	25.1 Å²	25.1	39%	0.39	14%	0.139	S	C	.	.	H	α-helix	trans	-64.3	-47.4	-179.6	-69	-14.8	0	0	0	110.2	L406 S480 S487 D488	L406-D484 HydrophobicContact CD2-CB 4.34Å; S480-D484 WeakPolarHBondContact O-CB 3.38Å; S480-D484 PolarHBondContact O-N 2.93Å; D484-S487 PolarHBondContact O-N 2.88Å; D484-D488 WeakPolarHBondContact O-CB 3.49Å; D484-D488 PolarHBondContact O-N 3.27Å
485	W	95.2	Very high	94.2	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.015	15%	0.154	C	C	.	.	H	α-helix	trans	-56.9	-52.1	176.3	176.5	78.3	0	0	0	112.1	L406 L409 F411 V421 L481 S487 D488 R489 L525 I529	L406-W485 HydrophobicContact CD1-CB 3.6Å; L406-W485 HydrophobicContact CD1-CG 4.33Å; L406-W485 HydrophobicContact CG-CB 4.41Å; L409-W485 PolarHBondContact O-NE1 2.91Å; F411-W485 HydrophobicContact CE2-CH2 4.21Å; F411-W485 HydrophobicContact CZ-CH2 4.1Å; V421-W485 HydrophobicContact CG1-CH2 4.47Å; V421-W485 HydrophobicContact CG1-CZ3 4.46Å; V421-W485 HydrophobicContact CG2-CD2 4.43Å; V421-W485 HydrophobicContact CG2-CH2 3.68Å; V421-W485 HydrophobicContact CG2-CZ2 3.56Å; V421-W485 HydrophobicContact CG2-CZ3 4.17Å; L481-W485 WeakPolarHBondContact O-CB 3.12Å; L481-W485 PolarHBondContact O-N 2.95Å; W485-S487 VanDerWaalsContact C-N 3.3Å; W485-S487 PolarHBondContact O-N 2.93Å; W485-D488 PolarHBondContact O-N 2.84Å; W485-R489 HydrophobicContact CD2-CG 4.27Å; W485-R489 HydrophobicContact CZ2-CG 4.13Å; W485-R489 WeakPolarHBondContact O-CG 3.36Å; W485-R489 PolarHBondContact O-N 3.31Å; W485-L525 HydrophobicContact CH2-CD1 3.77Å; W485-L525 HydrophobicContact CZ3-CD1 4.25Å; W485-I529 HydrophobicContact CZ3-CD1 4.12Å; W485-I529 HydrophobicContact CZ3-CG1 4.47Å
486	L	95.5	Very high	94	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.5	-40.1	-176.1	-177.3	63.1	0	0	0	110.8	L482 L490 L525 L526 I529 M546 T550	L482-L486 WeakPolarHBondContact O-CB 3.48Å; L482-L486 PolarHBondContact O-N 3.19Å; L486-L490 WeakPolarHBondContact O-CB 3.34Å; L486-L490 PolarHBondContact O-N 3.25Å; L486-L525 HydrophobicContact CD1-CD1 4.29Å; L486-L525 HydrophobicContact CD1-CD2 3.98Å; L486-L525 HydrophobicContact CD1-CG 3.77Å; L486-L526 HydrophobicContact CD2-CD2 4.21Å; L486-I529 HydrophobicContact CD1-CG2 3.85Å; L486-I529 HydrophobicContact CD2-CG2 3.72Å; L486-I529 HydrophobicContact CG-CG2 4.44Å; L486-M546 HydrophobicContact CD2-CE 4.1Å; L486-T550 HydrophobicContact CB-CG2 4.24Å; L486-T550 HydrophobicContact CD2-CG2 3.72Å; L486-T550 HydrophobicContact CG-CG2 3.63Å
487	S	95.1	Very high	93.8	Very high	13 Å²	13	27.1 Å²	27.1	9%	0.091	16%	0.156	C	C	.	.	H	α-helix	trans	-61.5	-50.1	176.7	-55.1	0	0	0	0	110.8	T483 D484 W485 R489 L490 I491 T550	T483-S487 VanDerWaalsContact O-CB 3.3Å; T483-S487 WeakPolarHBondContact O-CB 3.1Å; T483-S487 PolarHBondContact O-N 3.2Å; T483-S487 PolarHBondContact O-OG 2.59Å; D484-S487 PolarHBondContact O-N 2.88Å; W485-S487 VanDerWaalsContact C-N 3.3Å; W485-S487 PolarHBondContact O-N 2.93Å; S487-R489 PolarHBondContact O-N 3.2Å; S487-L490 PolarHBondContact O-N 3.46Å; S487-I491 WeakPolarHBondContact O-CB 3.33Å; S487-I491 VanDerWaalsContact O-CD1 3.27Å; S487-I491 WeakPolarHBondContact O-CD1 3.36Å; S487-I491 WeakPolarHBondContact O-CG1 3.47Å; S487-I491 PolarHBondContact O-N 3.02Å; S487-T550 WeakPolarHBondContact OG-CA 3.47Å; S487-T550 PolarHBondContact OG-OG1 2.65Å
488	D	94.1	Very high	93.5	Very high	65 Å²	65	30 Å²	30	35%	0.348	18%	0.176	S	C	.	.	H	α-helix	trans	-58	-49.2	177.8	178.9	70.5	0	0	0	112	D484 W485 L490 I491 C492	D484-D488 WeakPolarHBondContact O-CB 3.49Å; D484-D488 PolarHBondContact O-N 3.27Å; W485-D488 PolarHBondContact O-N 2.84Å; D488-L490 VanDerWaalsContact C-N 3.35Å; D488-L490 PolarHBondContact O-N 2.92Å; D488-I491 PolarHBondContact O-N 3.17Å; D488-C492 WeakPolarHBondContact O-CB 3.42Å; D488-C492 PolarHBondContact O-N 3.38Å; D488-C492 PolarHBondContact O-SG 3.29Å
489	R	93.6	Very high	93.1	Very high	46 Å²	46	33.7 Å²	33.7	17%	0.174	19%	0.194	C	C	.	.	H	α-helix	trans	-63.9	-39.2	179.7	-66.4	-48	-169.9	-147.3	3.1	112.7	D407 L409 W485 S487 R493 L525	D407-R489 PolarHBondContact O-NH2 2.9Å; L409-R489 PolarHBondContact O-NH2 3.23Å; W485-R489 HydrophobicContact CD2-CG 4.27Å; W485-R489 HydrophobicContact CZ2-CG 4.13Å; W485-R489 WeakPolarHBondContact O-CG 3.36Å; W485-R489 PolarHBondContact O-N 3.31Å; S487-R489 PolarHBondContact O-N 3.2Å; R489-R493 WeakPolarHBondContact O-CB 3.47Å; R489-R493 VanDerWaalsContact O-CG 3.27Å; R489-R493 WeakPolarHBondContact O-CG 3.46Å; R489-R493 PolarHBondContact O-N 3.39Å; R489-R493 VanDerWaalsContact O-N 3.08Å; R489-L525 HydrophobicContact CB-CD2 3.74Å
490	L	94.7	Very high	92.7	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-69.3	-45.7	179.3	-169.2	62.4	0	0	0	111	L486 S487 D488 C492 R493 W494 L526 T550 L551 A554	L486-L490 WeakPolarHBondContact O-CB 3.34Å; L486-L490 PolarHBondContact O-N 3.25Å; S487-L490 PolarHBondContact O-N 3.46Å; D488-L490 VanDerWaalsContact C-N 3.35Å; D488-L490 PolarHBondContact O-N 2.92Å; L490-C492 PolarHBondContact O-N 2.88Å; L490-R493 PolarHBondContact O-N 3.43Å; L490-W494 HydrophobicContact CD1-CD2 3.93Å; L490-W494 VanDerWaalsContact CD1-CE2 3.47Å; L490-W494 HydrophobicContact CD1-CE3 4.39Å; L490-W494 HydrophobicContact CD1-CG 4.49Å; L490-W494 HydrophobicContact CD1-CH2 4.09Å; L490-W494 HydrophobicContact CD1-CZ2 3.59Å; L490-W494 HydrophobicContact CD1-CZ3 4.46Å; L490-W494 HydrophobicContact CD2-CE3 4.35Å; L490-W494 HydrophobicContact CD2-CH2 3.82Å; L490-W494 HydrophobicContact CD2-CZ2 4.19Å; L490-W494 HydrophobicContact CD2-CZ3 3.91Å; L490-W494 HydrophobicContact CG-CD2 3.94Å; L490-W494 HydrophobicContact CG-CE3 3.95Å; L490-W494 HydrophobicContact CG-CH2 4.06Å; L490-W494 HydrophobicContact CG-CZ2 4.05Å; L490-W494 HydrophobicContact CG-CZ3 4Å; L490-W494 WeakPolarHBondContact O-CB 3.45Å; L490-W494 PolarHBondContact O-N 3.44Å; L490-L526 HydrophobicContact CD1-CD1 4.21Å; L490-L526 HydrophobicContact CD1-CG 4.23Å; L490-L526 HydrophobicContact CD2-CD1 4.05Å; L490-L526 HydrophobicContact CD2-CD2 4Å; L490-L526 HydrophobicContact CD2-CG 4.18Å; L490-T550 HydrophobicContact CD2-CG2 3.95Å; L490-L551 HydrophobicContact CD2-CD2 4.37Å; L490-A554 HydrophobicContact CB-CB 4.31Å; L490-A554 HydrophobicContact CD2-CB 3.53Å; L490-A554 HydrophobicContact CG-CB 3.9Å
491	I	94.7	Very high	92.1	Very high	42 Å²	42	31.4 Å²	31.4	22%	0.215	18%	0.177	C	C	.	.	H	α-helix	trans	-59.2	-47.7	176	-68.5	160.8	0	0	0	110.3	S487 D488 R493 W494 A495 T553 A554 I557	S487-I491 WeakPolarHBondContact O-CB 3.33Å; S487-I491 VanDerWaalsContact O-CD1 3.27Å; S487-I491 WeakPolarHBondContact O-CD1 3.36Å; S487-I491 WeakPolarHBondContact O-CG1 3.47Å; S487-I491 PolarHBondContact O-N 3.02Å; D488-I491 PolarHBondContact O-N 3.17Å; I491-R493 PolarHBondContact O-N 3Å; I491-W494 PolarHBondContact O-N 3.34Å; I491-A495 WeakPolarHBondContact O-CB 3.5Å; I491-A495 PolarHBondContact O-N 3.17Å; I491-T553 HydrophobicContact CD1-CG2 4.18Å; I491-A554 HydrophobicContact CG1-CB 4.08Å; I491-I557 HydrophobicContact CD1-CD1 3.54Å; I491-I557 HydrophobicContact CG1-CD1 3.93Å; I491-I557 HydrophobicContact CG2-CD1 4.26Å; I491-I557 HydrophobicContact CG2-CG2 4.13Å
492	C	93.1	Very high	91.5	Very high	78 Å²	78	37.4 Å²	37.4	53%	0.527	20%	0.199	S	C	.	.	H	α-helix	trans	-61	-41.2	178.7	-73.3	0	0	0	0	112.7	D488 L490	D488-C492 WeakPolarHBondContact O-CB 3.42Å; D488-C492 PolarHBondContact O-N 3.38Å; D488-C492 PolarHBondContact O-SG 3.29Å; L490-C492 PolarHBondContact O-N 2.88Å
493	R	92.2	Very high	90.7	Very high	91 Å²	91	40.5 Å²	40.5	34%	0.343	22%	0.215	S	C	.	.	H	α-helix	trans	-66.8	-45.1	176.8	-73.8	176.5	-173.1	-150.7	-2.7	111.4	R489 L490 I491 A495 A496 Y518 D521	R489-R493 WeakPolarHBondContact O-CB 3.47Å; R489-R493 VanDerWaalsContact O-CG 3.27Å; R489-R493 WeakPolarHBondContact O-CG 3.46Å; R489-R493 PolarHBondContact O-N 3.39Å; R489-R493 VanDerWaalsContact O-N 3.08Å; L490-R493 PolarHBondContact O-N 3.43Å; I491-R493 PolarHBondContact O-N 3Å; R493-A495 VanDerWaalsContact C-N 3.33Å; R493-A495 PolarHBondContact O-N 2.93Å; R493-A496 WeakPolarHBondContact O-CB 3.4Å; R493-A496 PolarHBondContact O-N 3.02Å; R493-Y518 WeakPolarHBondContact O-CB 3.36Å; R493-Y518 VanDerWaalsContact O-CD2 3.3Å; R493-Y518 WeakPolarHBondContact O-CD2 3.4Å; R493-D521 PolarHBondContact NH1-O 3.06Å
494	W	93.7	Very high	89.7	Confident	3 Å²	3	40.4 Å²	40.4	1%	0.011	22%	0.215	C	C	.	.	H	α-helix	trans	-76.1	-18.2	-177.8	-71.3	-4.8	0	0	0	114.1	L490 I491 A496 V497 M519 L526 L551 A554 T555 Y558 V608	L490-W494 HydrophobicContact CD1-CD2 3.93Å; L490-W494 VanDerWaalsContact CD1-CE2 3.47Å; L490-W494 HydrophobicContact CD1-CE3 4.39Å; L490-W494 HydrophobicContact CD1-CG 4.49Å; L490-W494 HydrophobicContact CD1-CH2 4.09Å; L490-W494 HydrophobicContact CD1-CZ2 3.59Å; L490-W494 HydrophobicContact CD1-CZ3 4.46Å; L490-W494 HydrophobicContact CD2-CE3 4.35Å; L490-W494 HydrophobicContact CD2-CH2 3.82Å; L490-W494 HydrophobicContact CD2-CZ2 4.19Å; L490-W494 HydrophobicContact CD2-CZ3 3.91Å; L490-W494 HydrophobicContact CG-CD2 3.94Å; L490-W494 HydrophobicContact CG-CE3 3.95Å; L490-W494 HydrophobicContact CG-CH2 4.06Å; L490-W494 HydrophobicContact CG-CZ2 4.05Å; L490-W494 HydrophobicContact CG-CZ3 4Å; L490-W494 WeakPolarHBondContact O-CB 3.45Å; L490-W494 PolarHBondContact O-N 3.44Å; I491-W494 PolarHBondContact O-N 3.34Å; W494-A496 PolarHBondContact O-N 2.88Å; W494-V497 WeakPolarHBondContact O-CB 3.43Å; W494-V497 VanDerWaalsContact O-CG1 3.28Å; W494-V497 WeakPolarHBondContact O-CG1 3.32Å; W494-V497 PolarHBondContact O-N 3.46Å; W494-M519 HydrophobicContact CZ2-SD 4.04Å; W494-M519 PolarHBondContact NE1-SD 3.41Å; W494-L526 HydrophobicContact CH2-CD1 4.45Å; W494-L526 HydrophobicContact CZ2-CD1 4.33Å; W494-L551 HydrophobicContact CH2-CD2 4.45Å; W494-A554 HydrophobicContact CE3-CB 3.98Å; W494-A554 HydrophobicContact CZ3-CB 3.78Å; W494-T555 HydrophobicContact CH2-CG2 4.33Å; W494-T555 HydrophobicContact CZ3-CG2 3.95Å; W494-Y558 HydrophobicContact CB-CD2 3.86Å; W494-Y558 HydrophobicContact CB-CE2 4.48Å; W494-Y558 HydrophobicContact CE3-CG 4.37Å; W494-Y558 HydrophobicContact CG-CD2 4.39Å; W494-V608 HydrophobicContact CH2-CG1 4.23Å; W494-V608 HydrophobicContact CH2-CG2 4.5Å; W494-V608 HydrophobicContact CZ2-CG2 4.15Å
495	A	92.6	Very high	88.5	Confident	37 Å²	37	40.1 Å²	40.1	31%	0.306	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-58.9	-25.4	172.3	0	0	0	0	0	112.8	I491 R493 V497 S498	I491-A495 WeakPolarHBondContact O-CB 3.5Å; I491-A495 PolarHBondContact O-N 3.17Å; R493-A495 VanDerWaalsContact C-N 3.33Å; R493-A495 PolarHBondContact O-N 2.93Å; A495-V497 PolarHBondContact O-N 3.21Å; A495-S498 PolarHBondContact O-N 3.06Å; A495-S498 VanDerWaalsContact O-N 3.1Å; A495-S498 PolarHBondContact O-OG 3.25Å
496	A	91.1	Very high	86.7	Confident	38 Å²	38	48.8 Å²	48.8	31%	0.314	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-60.1	-11.4	176.7	0	0	0	0	0	114.4	R493 W494 S498 E499 Y518	R493-A496 WeakPolarHBondContact O-CB 3.4Å; R493-A496 PolarHBondContact O-N 3.02Å; W494-A496 PolarHBondContact O-N 2.88Å; A496-S498 PolarHBondContact O-N 2.57Å; A496-E499 PolarHBondContact O-N 3.31Å; A496-Y518 HydrophobicContact CB-CD1 4.06Å; A496-Y518 HydrophobicContact CB-CD2 4.28Å; A496-Y518 HydrophobicContact CB-CG 3.78Å
497	V	90.2	Very high	84.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-55.5	-30	169.9	72.7	0	0	0	0	112.8	W494 A495 E499 L500 Y518 Y558 N561 V562 L601	W494-V497 WeakPolarHBondContact O-CB 3.43Å; W494-V497 VanDerWaalsContact O-CG1 3.28Å; W494-V497 WeakPolarHBondContact O-CG1 3.32Å; W494-V497 PolarHBondContact O-N 3.46Å; A495-V497 PolarHBondContact O-N 3.21Å; V497-E499 PolarHBondContact O-N 2.77Å; V497-L500 HydrophobicContact CG2-CD1 3.79Å; V497-L500 HydrophobicContact CG2-CG 4.47Å; V497-L500 WeakPolarHBondContact O-CB 3.21Å; V497-L500 WeakPolarHBondContact O-CG 3.4Å; V497-L500 PolarHBondContact O-N 2.86Å; V497-Y518 HydrophobicContact CB-CE2 4.27Å; V497-Y518 WeakPolarHBondContact CG2-OH 3.48Å; V497-Y558 HydrophobicContact CB-CD2 4.38Å; V497-Y558 HydrophobicContact CB-CE2 3.78Å; V497-Y558 HydrophobicContact CG1-CD2 4.15Å; V497-Y558 HydrophobicContact CG1-CE2 4.04Å; V497-Y558 HydrophobicContact CG2-CE2 3.81Å; V497-N561 HydrophobicContact CG1-CB 3.61Å; V497-V562 HydrophobicContact CG2-CG2 3.91Å; V497-L601 HydrophobicContact CG2-CD2 3.61Å
498	S	88.3	Confident	83.3	Confident	60 Å²	60	62.9 Å²	62.9	42%	0.42	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-64.8	-20.9	176.6	64.1	0	0	0	0	113.5	A495 A496 P501	A495-S498 PolarHBondContact O-N 3.06Å; A495-S498 VanDerWaalsContact O-N 3.1Å; A495-S498 PolarHBondContact O-OG 3.25Å; A496-S498 PolarHBondContact O-N 2.57Å; S498-P501 WeakPolarHBondContact O-CD 3.46Å
499	E	85.5	Confident	81.8	Confident	78 Å²	78	65.2 Å²	65.2	36%	0.364	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-87.5	-9.1	179.4	-59.8	-57.8	122.4	0	0	112.9	A496 V497 R502 L503	A496-E499 PolarHBondContact O-N 3.31Å; V497-E499 PolarHBondContact O-N 2.77Å; E499-R502 PolarHBondContact O-N 2.91Å; E499-R502 VanDerWaalsContact O-N 3.07Å; E499-R502 WeakPolarHBondContact OE2-CD 3.28Å; E499-R502 IonicContact OE2-CZ 3.91Å; E499-R502 IonicContact OE2-NE 3.71Å; E499-R502 IonicContact OE2-NH1 3.77Å; E499-R502 PolarHBondContact OE2-NH1 3.42Å; E499-L503 HydrophobicContact CB-CD1 4.47Å; E499-L503 WeakPolarHBondContact O-CG 3.31Å; E499-L503 PolarHBondContact O-N 3.27Å
500	L	84.7	Confident	80.4	Confident	5 Å²	5	71.3 Å²	71.3	3%	0.026	34%	0.339	C	S	.	.	H	α-helix	trans	-53.8	-44.4	179.3	-69.4	-179.5	0	0	0	113.2	V497 R502 L503 F504 Y518 Q600 L601	V497-L500 HydrophobicContact CG2-CD1 3.79Å; V497-L500 HydrophobicContact CG2-CG 4.47Å; V497-L500 WeakPolarHBondContact O-CB 3.21Å; V497-L500 WeakPolarHBondContact O-CG 3.4Å; V497-L500 PolarHBondContact O-N 2.86Å; L500-R502 VanDerWaalsContact C-N 3.32Å; L500-R502 PolarHBondContact O-N 2.7Å; L500-L503 PolarHBondContact O-N 3.05Å; L500-F504 HydrophobicContact CD2-CE2 4.2Å; L500-F504 WeakPolarHBondContact O-CD2 3.47Å; L500-F504 PolarHBondContact O-N 3.39Å; L500-Y518 HydrophobicContact CD2-CE1 4.29Å; L500-Q600 HydrophobicContact CD2-CG 4.17Å; L500-L601 HydrophobicContact CD1-CD2 3.66Å; L500-L601 HydrophobicContact CD1-CG 4.02Å
501	P	81.6	Confident	79.2	Confident	16 Å²	16	75.8 Å²	75.8	10%	0.104	36%	0.363	C	S	.	.	H	α-helix	trans	-59.4	-40.3	176.4	-25.7	36.6	0	0	0	113.2	S498 R505 V565 V569 I597	S498-P501 WeakPolarHBondContact O-CD 3.46Å; P501-R505 WeakPolarHBondContact O-CB 3.44Å; P501-R505 VanDerWaalsContact O-CG 3.22Å; P501-R505 WeakPolarHBondContact O-CG 3.41Å; P501-R505 PolarHBondContact O-N 2.87Å; P501-V565 HydrophobicContact CG-CG1 3.8Å; P501-V569 HydrophobicContact CG-CG2 4.18Å; P501-I597 HydrophobicContact CB-CD1 4.37Å
502	R	81	Confident	78.3	Confident	128 Å²	128	74.5 Å²	74.5	48%	0.483	36%	0.357	S	S	.	.	H	α-helix	trans	-68.3	-42.7	178.4	-68	177.6	75.4	-170.4	10.8	111	E499 L500 W506	E499-R502 PolarHBondContact O-N 2.91Å; E499-R502 VanDerWaalsContact O-N 3.07Å; E499-R502 WeakPolarHBondContact OE2-CD 3.28Å; E499-R502 IonicContact OE2-CZ 3.91Å; E499-R502 IonicContact OE2-NE 3.71Å; E499-R502 IonicContact OE2-NH1 3.77Å; E499-R502 PolarHBondContact OE2-NH1 3.42Å; L500-R502 VanDerWaalsContact C-N 3.32Å; L500-R502 PolarHBondContact O-N 2.7Å; R502-W506 WeakPolarHBondContact O-CB 3.31Å; R502-W506 PolarHBondContact O-N 2.97Å; R502-W506 VanDerWaalsContact O-N 3.09Å
503	L	77.3	Confident	77.6	Confident	68 Å²	68	75.6 Å²	75.6	36%	0.356	37%	0.366	S	S	.	.	H	α-helix	trans	-60.8	-51.5	179.3	-70	169.3	0	0	0	111.3	E499 L500 T507	E499-L503 HydrophobicContact CB-CD1 4.47Å; E499-L503 WeakPolarHBondContact O-CG 3.31Å; E499-L503 PolarHBondContact O-N 3.27Å; L500-L503 PolarHBondContact O-N 3.05Å; L503-T507 WeakPolarHBondContact O-CB 3.06Å; L503-T507 PolarHBondContact O-N 3.26Å; L503-T507 VanDerWaalsContact O-N 3.13Å; L503-T507 PolarHBondContact O-OG1 2.98Å
504	F	75	Confident	77.2	Confident	4 Å²	4	75.8 Å²	75.8	2%	0.018	38%	0.377	C	S	.	.	H	α-helix	trans	-75	-39.1	-177.2	-75.3	-75.8	0	0	0	113.5	L500 K509 P512 K596 I597 Q600	L500-F504 HydrophobicContact CD2-CE2 4.2Å; L500-F504 WeakPolarHBondContact O-CD2 3.47Å; L500-F504 PolarHBondContact O-N 3.39Å; F504-K509 HydrophobicContact CD1-CB 4.15Å; F504-K509 HydrophobicContact CE1-CB 4.13Å; F504-P512 HydrophobicContact CE1-CG 4.42Å; F504-P512 HydrophobicContact CZ-CB 4.18Å; F504-P512 HydrophobicContact CZ-CG 4.27Å; F504-K596 HydrophobicContact CD1-CB 3.66Å; F504-K596 HydrophobicContact CD1-CD 3.93Å; F504-K596 HydrophobicContact CD1-CG 4.43Å; F504-K596 HydrophobicContact CE1-CB 3.88Å; F504-K596 HydrophobicContact CE1-CD 4.36Å; F504-K596 HydrophobicContact CG-CB 4.22Å; F504-I597 HydrophobicContact CB-CD1 4.34Å; F504-I597 HydrophobicContact CB-CG1 3.88Å; F504-I597 HydrophobicContact CD2-CG1 3.76Å; F504-I597 HydrophobicContact CG-CG1 4.07Å; F504-Q600 HydrophobicContact CE2-CB 3.96Å; F504-Q600 HydrophobicContact CE2-CG 4.09Å; F504-Q600 HydrophobicContact CZ-CB 4.05Å; F504-Q600 HydrophobicContact CZ-CG 4.25Å
505	R	70	Confident	76.8	Confident	67 Å²	67	77.2 Å²	77.2	25%	0.253	39%	0.387	S	S	.	.	H	α-helix	trans	-73.9	-29.1	-178	-66.6	177.7	170.8	176.8	-3.6	113.8	P501 V569 D593 D594	P501-R505 WeakPolarHBondContact O-CB 3.44Å; P501-R505 VanDerWaalsContact O-CG 3.22Å; P501-R505 WeakPolarHBondContact O-CG 3.41Å; P501-R505 PolarHBondContact O-N 2.87Å; R505-V569 PolarHBondContact NH2-O 3.18Å; R505-D593 HydrophobicContact CG-CB 4.43Å; R505-D594 IonicContact CZ-OD1 2.87Å; R505-D594 IonicContact NE-OD1 2.92Å; R505-D594 IonicContact NH2-OD1 3.63Å; R505-D594 PolarHBondContact NH2-OD1 3.25Å
506	W	57.4	Low	76.7	Confident	186 Å²	186	76 Å²	76	71%	0.705	38%	0.376	S	S	*	.	H	α-helix	trans	-106.3	-32.6	-174.9	-63.1	-8	0	0	0	114.3	R502	R502-W506 WeakPolarHBondContact O-CB 3.31Å; R502-W506 PolarHBondContact O-N 2.97Å; R502-W506 VanDerWaalsContact O-N 3.09Å
507	T	57.7	Low	76.6	Confident	84 Å²	84	78.5 Å²	78.5	52%	0.515	39%	0.391	S	S	.	.	H	α-helix	trans	-94.6	1.6	-173.3	69.8	0	0	0	0	114.8	L503 K509	L503-T507 WeakPolarHBondContact O-CB 3.06Å; L503-T507 PolarHBondContact O-N 3.26Å; L503-T507 VanDerWaalsContact O-N 3.13Å; L503-T507 PolarHBondContact O-OG1 2.98Å; T507-K509 PolarHBondContact O-N 2.81Å; T507-K509 VanDerWaalsContact O-N 3.12Å
508	R	61	Low	76.7	Confident	224 Å²	224	79.5 Å²	79.5	85%	0.845	40%	0.395	S	S	*	.			trans	43.4	43.4	-176.1	-74	-171.5	176.5	-173.9	0.3	112.7
509	K	62.3	Low	76.8	Confident	114 Å²	114	76.7 Å²	76.7	50%	0.496	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-57.7	146.8	177.7	-116.2	-178.9	175.5	-175.2	0	111.2	F504 T507 K596	F504-K509 HydrophobicContact CD1-CB 4.15Å; F504-K509 HydrophobicContact CE1-CB 4.13Å; T507-K509 PolarHBondContact O-N 2.81Å; T507-K509 VanDerWaalsContact O-N 3.12Å; K509-K596 PolarHBondContact O-NZ 3.43Å
510	E	64.3	Low	77.1	Confident	174 Å²	174	75.7 Å²	75.7	81%	0.813	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-60.8	166.2	171.4	-67.5	-174.9	173.4	0	0	111.5
511	N	68.7	Low	77.4	Confident	95 Å²	95	79.2 Å²	79.2	51%	0.508	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-59.1	132.3	-178.9	-69.6	-2.6	0	0	0	110.5	S513 K596	N511-S513 PolarHBondContact O-N 2.89Å; N511-K596 VanDerWaalsContact OD1-CE 3.27Å; N511-K596 WeakPolarHBondContact OD1-CE 3.43Å
512	P	76.5	Confident	78	Confident	15 Å²	15	78.4 Å²	78.4	10%	0.097	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-67.7	121.9	-177.1	26.2	-32.2	0	0	0	110.9	F504 K596 L599 Q600 L603	F504-P512 HydrophobicContact CE1-CG 4.42Å; F504-P512 HydrophobicContact CZ-CB 4.18Å; F504-P512 HydrophobicContact CZ-CG 4.27Å; P512-K596 HydrophobicContact CG-CB 4.47Å; P512-K596 WeakPolarHBondContact CG-O 3.24Å; P512-L599 HydrophobicContact CG-CB 4.02Å; P512-L599 HydrophobicContact CG-CD2 3.93Å; P512-L599 HydrophobicContact CG-CG 3.96Å; P512-Q600 HydrophobicContact CB-CB 4.02Å; P512-Q600 HydrophobicContact CB-CG 4.49Å; P512-Q600 HydrophobicContact CG-CB 4.12Å; P512-L603 HydrophobicContact CB-CD1 4.25Å
513	S	78.2	Confident	78.5	Confident	101 Å²	101	72.4 Å²	72.4	71%	0.706	36%	0.363	S	S	*	.			trans	-114.8	-16.1	179	58.4	0	0	0	0	113.3	N511	N511-S513 PolarHBondContact O-N 2.89Å
514	T	83.9	Confident	79.3	Confident	94 Å²	94	73.3 Å²	73.3	58%	0.577	37%	0.368	S	S	*	.	S	Bend	trans	-130.6	153.6	-178.6	49.5	0	0	0	0	110.3	Q600	T514-Q600 PolarHBondContact O-NE2 2.84Å
515	P	85.7	Confident	80.1	Confident	33 Å²	33	73.3 Å²	73.3	21%	0.214	37%	0.368	C	S	.	.			trans	-57.5	150.6	172.7	-21	32.2	0	0	0	111.3	M520 D604 K607	P515-M520 HydrophobicContact CB-CG 4.15Å; P515-M520 HydrophobicContact CB-SD 4.01Å; P515-M520 HydrophobicContact CG-SD 4.14Å; P515-D604 WeakPolarHBondContact CA-OD1 3.45Å; P515-K607 HydrophobicContact CB-CB 3.91Å; P515-K607 HydrophobicContact CB-CG 4.17Å; P515-K607 HydrophobicContact CG-CB 3.69Å; P515-K607 HydrophobicContact CG-CD 4.45Å; P515-K607 HydrophobicContact CG-CG 4.03Å
516	S	90.3	Very high	81.3	Confident	11 Å²	11	70.2 Å²	70.2	8%	0.077	36%	0.357	C	S	.	.			trans	-57.5	143.9	-179.5	-61.1	0	0	0	0	110.8	Y518 M519 M520 Q600 D604	S516-Y518 VanDerWaalsContact C-N 3.29Å; S516-Y518 PolarHBondContact O-N 3.37Å; S516-Y518 WeakPolarHBondContact OG-CE1 3.3Å; S516-M519 WeakPolarHBondContact O-CA 3.24Å; S516-M519 WeakPolarHBondContact O-CB 3.26Å; S516-M519 PolarHBondContact O-N 3.4Å; S516-M520 PolarHBondContact O-N 3.46Å; S516-Q600 VanDerWaalsContact N-NE2 3.11Å; S516-Q600 VanDerWaalsContact OG-CG 3.29Å; S516-Q600 WeakPolarHBondContact OG-CG 3.44Å; S516-Q600 PolarHBondContact OG-NE2 3.18Å; S516-D604 WeakPolarHBondContact CB-OD1 3.34Å; S516-D604 WeakPolarHBondContact CB-OD2 3.4Å; S516-D604 PolarHBondContact N-OD1 3.42Å; S516-D604 PolarHBondContact OG-OD1 3.32Å; S516-D604 VanDerWaalsContact OG-OD1 3.12Å; S516-D604 PolarHBondContact OG-OD2 2.97Å
517	S	88.5	Confident	83	Confident	91 Å²	91	64 Å²	64	64%	0.636	34%	0.339	S	S	*	.	H	α-helix	trans	-56.5	-43.6	179.8	57.6	0	0	0	0	112.1	M519 M520 D521	S517-M519 PolarHBondContact O-N 3.19Å; S517-M520 WeakPolarHBondContact O-CB 3.44Å; S517-M520 PolarHBondContact O-N 3.33Å; S517-D521 WeakPolarHBondContact O-CB 3.47Å; S517-D521 PolarHBondContact O-N 2.79Å
518	Y	92	Very high	84.6	Confident	22 Å²	22	64.3 Å²	64.3	9%	0.086	33%	0.333	C	S	.	.	H	α-helix	trans	-59.9	-34.5	177.5	79.7	-98.5	0	0	0	112.2	R493 A496 V497 L500 S516 G522 Y558 D604	R493-Y518 WeakPolarHBondContact O-CB 3.36Å; R493-Y518 VanDerWaalsContact O-CD2 3.3Å; R493-Y518 WeakPolarHBondContact O-CD2 3.4Å; A496-Y518 HydrophobicContact CB-CD1 4.06Å; A496-Y518 HydrophobicContact CB-CD2 4.28Å; A496-Y518 HydrophobicContact CB-CG 3.78Å; V497-Y518 HydrophobicContact CB-CE2 4.27Å; V497-Y518 WeakPolarHBondContact CG2-OH 3.48Å; L500-Y518 HydrophobicContact CD2-CE1 4.29Å; S516-Y518 VanDerWaalsContact C-N 3.29Å; S516-Y518 PolarHBondContact O-N 3.37Å; S516-Y518 WeakPolarHBondContact OG-CE1 3.3Å; Y518-G522 PolarHBondContact O-N 2.87Å; Y518-Y558 HydrophobicContact CE2-CE2 4.11Å; Y518-Y558 PolarHBondContact OH-OH 3.04Å; Y518-D604 PolarHBondContact OH-OD2 3.24Å
519	M	92.1	Very high	86.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-72.9	-45.6	179.4	-177.7	52.6	80.2	0	0	110.6	W494 S516 S517 D521 G522 C523 Y558 D604 V608	W494-M519 HydrophobicContact CZ2-SD 4.04Å; W494-M519 PolarHBondContact NE1-SD 3.41Å; S516-M519 WeakPolarHBondContact O-CA 3.24Å; S516-M519 WeakPolarHBondContact O-CB 3.26Å; S516-M519 PolarHBondContact O-N 3.4Å; S517-M519 PolarHBondContact O-N 3.19Å; M519-D521 VanDerWaalsContact C-N 3.31Å; M519-D521 PolarHBondContact O-N 3.37Å; M519-G522 PolarHBondContact O-N 2.88Å; M519-C523 WeakPolarHBondContact O-CB 3.38Å; M519-C523 PolarHBondContact O-N 3.24Å; M519-C523 PolarHBondContact O-SG 3.25Å; M519-Y558 HydrophobicContact CE-CD2 4.5Å; M519-Y558 HydrophobicContact CE-CE1 3.97Å; M519-Y558 HydrophobicContact CE-CE2 3.72Å; M519-Y558 VanDerWaalsContact CE-CZ 3.42Å; M519-Y558 WeakPolarHBondContact CE-OH 3.26Å; M519-D604 HydrophobicContact CB-CB 4.35Å; M519-D604 HydrophobicContact CE-CB 4.03Å; M519-D604 HydrophobicContact CG-CB 4.02Å; M519-V608 HydrophobicContact CE-CG2 3.49Å; M519-V608 VanDerWaalsContact CE-CG2 3.49Å; M519-V608 HydrophobicContact CG-CG2 4.12Å; M519-V608 HydrophobicContact SD-CG2 3.1Å; M519-V608 WeakPolarHBondContact SD-CG2 3.35Å
520	M	91.7	Very high	87.6	Confident	57 Å²	57	50 Å²	50	28%	0.281	28%	0.278	S	S	.	.	H	α-helix	trans	-57.9	-44.4	172.8	-69.4	-62.6	-62	0	0	111.2	P515 S516 S517 G522 C523 N524 K607	P515-M520 HydrophobicContact CB-CG 4.15Å; P515-M520 HydrophobicContact CB-SD 4.01Å; P515-M520 HydrophobicContact CG-SD 4.14Å; S516-M520 PolarHBondContact O-N 3.46Å; S517-M520 WeakPolarHBondContact O-CB 3.44Å; S517-M520 PolarHBondContact O-N 3.33Å; M520-G522 PolarHBondContact O-N 2.89Å; M520-C523 PolarHBondContact O-N 3.34Å; M520-N524 VanDerWaalsContact O-CB 3.29Å; M520-N524 WeakPolarHBondContact O-CB 3.41Å; M520-N524 PolarHBondContact O-N 3.13Å; M520-N524 PolarHBondContact O-ND2 2.85Å; M520-K607 HydrophobicContact SD-CD 3.89Å; M520-K607 VanDerWaalsContact SD-CE 3.54Å; M520-K607 HydrophobicContact SD-CG 3.82Å
521	D	90.7	Very high	89	Confident	79 Å²	79	47.1 Å²	47.1	42%	0.422	26%	0.264	S	S	.	.	H	α-helix	trans	-62.7	-42.6	178.7	-68.4	-25.3	0	0	0	111.8	R493 S517 M519 L525	R493-D521 PolarHBondContact NH1-O 3.06Å; S517-D521 WeakPolarHBondContact O-CB 3.47Å; S517-D521 PolarHBondContact O-N 2.79Å; M519-D521 VanDerWaalsContact C-N 3.31Å; M519-D521 PolarHBondContact O-N 3.37Å; D521-L525 WeakPolarHBondContact O-CB 3.18Å; D521-L525 PolarHBondContact O-N 3.37Å; D521-L525 VanDerWaalsContact O-N 3.07Å
522	G	93	Very high	90.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-43.3	174.6	0	0	0	0	0	112.8	Y518 M519 M520 L525 L526	Y518-G522 PolarHBondContact O-N 2.87Å; M519-G522 PolarHBondContact O-N 2.88Å; M520-G522 PolarHBondContact O-N 2.89Å; G522-L525 WeakPolarHBondContact O-CB 3.37Å; G522-L525 PolarHBondContact O-N 2.9Å; G522-L526 PolarHBondContact O-N 2.91Å; G522-L526 VanDerWaalsContact O-N 3.11Å
523	C	92.9	Very high	90.9	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.007	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-44.8	175.7	-75.3	0	0	0	0	112.6	M519 M520 L525 L526 V527 V611	M519-C523 WeakPolarHBondContact O-CB 3.38Å; M519-C523 PolarHBondContact O-N 3.24Å; M519-C523 PolarHBondContact O-SG 3.25Å; M520-C523 PolarHBondContact O-N 3.34Å; C523-L525 VanDerWaalsContact C-N 3.27Å; C523-L525 PolarHBondContact O-N 2.69Å; C523-L526 WeakPolarHBondContact O-CB 3.33Å; C523-L526 PolarHBondContact O-N 3.27Å; C523-V527 WeakPolarHBondContact O-CG2 3.47Å; C523-V527 PolarHBondContact O-N 3.47Å; C523-V611 HydrophobicContact CB-CG2 3.91Å
524	N	92.8	Very high	91.5	Very high	87 Å²	87	40.9 Å²	40.9	47%	0.465	23%	0.225	S	C	.	.	H	α-helix	trans	-64.3	-35	178.1	-70	-21.2	0	0	0	111.3	M520 K528	M520-N524 VanDerWaalsContact O-CB 3.29Å; M520-N524 WeakPolarHBondContact O-CB 3.41Å; M520-N524 PolarHBondContact O-N 3.13Å; M520-N524 PolarHBondContact O-ND2 2.85Å; N524-K528 WeakPolarHBondContact O-CB 3.21Å; N524-K528 PolarHBondContact O-N 2.73Å
525	L	93.1	Very high	91.8	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-47.1	173.4	174.6	62.4	0	0	0	111.6	F411 W485 L486 R489 D521 G522 C523 K528 I529	F411-L525 HydrophobicContact CE2-CD1 3.53Å; F411-L525 HydrophobicContact CZ-CD1 3.91Å; W485-L525 HydrophobicContact CH2-CD1 3.77Å; W485-L525 HydrophobicContact CZ3-CD1 4.25Å; L486-L525 HydrophobicContact CD1-CD1 4.29Å; L486-L525 HydrophobicContact CD1-CD2 3.98Å; L486-L525 HydrophobicContact CD1-CG 3.77Å; R489-L525 HydrophobicContact CB-CD2 3.74Å; D521-L525 WeakPolarHBondContact O-CB 3.18Å; D521-L525 PolarHBondContact O-N 3.37Å; D521-L525 VanDerWaalsContact O-N 3.07Å; G522-L525 WeakPolarHBondContact O-CB 3.37Å; G522-L525 PolarHBondContact O-N 2.9Å; C523-L525 VanDerWaalsContact C-N 3.27Å; C523-L525 PolarHBondContact O-N 2.69Å; L525-K528 PolarHBondContact O-N 3.36Å; L525-I529 WeakPolarHBondContact O-CG2 3.47Å; L525-I529 PolarHBondContact O-N 3.46Å
526	L	93.7	Very high	91.9	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-59.5	-47.2	176.7	-75.4	169.1	0	0	0	112.3	L486 L490 W494 G522 C523 K528 I529 H530 T550 L551 L615	L486-L526 HydrophobicContact CD2-CD2 4.21Å; L490-L526 HydrophobicContact CD1-CD1 4.21Å; L490-L526 HydrophobicContact CD1-CG 4.23Å; L490-L526 HydrophobicContact CD2-CD1 4.05Å; L490-L526 HydrophobicContact CD2-CD2 4Å; L490-L526 HydrophobicContact CD2-CG 4.18Å; W494-L526 HydrophobicContact CH2-CD1 4.45Å; W494-L526 HydrophobicContact CZ2-CD1 4.33Å; G522-L526 PolarHBondContact O-N 2.91Å; G522-L526 VanDerWaalsContact O-N 3.11Å; C523-L526 WeakPolarHBondContact O-CB 3.33Å; C523-L526 PolarHBondContact O-N 3.27Å; L526-K528 PolarHBondContact O-N 3.04Å; L526-I529 WeakPolarHBondContact O-CG2 3.22Å; L526-H530 VanDerWaalsContact O-CB 3.25Å; L526-H530 WeakPolarHBondContact O-CB 3.39Å; L526-H530 PolarHBondContact O-N 3.4Å; L526-T550 HydrophobicContact CD2-CG2 4.44Å; L526-L551 HydrophobicContact CD1-CD2 3.74Å; L526-L551 HydrophobicContact CD2-CD2 4.17Å; L526-L615 HydrophobicContact CB-CD1 4.38Å
527	V	93.3	Very high	91.8	Very high	56 Å²	56	44.1 Å²	44.1	34%	0.339	25%	0.245	S	C	.	.	H	α-helix	trans	-63.7	-43.4	178.6	174.1	0	0	0	0	110.8	C523 H530 Q531 V611	C523-V527 WeakPolarHBondContact O-CG2 3.47Å; C523-V527 PolarHBondContact O-N 3.47Å; V527-H530 PolarHBondContact O-N 3.42Å; V527-Q531 WeakPolarHBondContact O-CB 3.35Å; V527-Q531 PolarHBondContact O-N 3.15Å; V527-V611 HydrophobicContact CG2-CG1 3.98Å
528	K	92.5	Very high	91.9	Very high	90 Å²	90	40 Å²	40	39%	0.391	22%	0.216	S	C	.	.	H	α-helix	trans	-64.3	-46.1	-178.8	-175.1	173	178	-174.2	0	112.2	F411 N524 L525 L526 Q531 L532	F411-K528 HydrophobicContact CD1-CD 4.22Å; F411-K528 HydrophobicContact CD2-CD 3.98Å; F411-K528 HydrophobicContact CE1-CD 3.96Å; F411-K528 HydrophobicContact CE1-CG 4.08Å; F411-K528 HydrophobicContact CE2-CD 3.67Å; F411-K528 HydrophobicContact CE2-CG 4.29Å; F411-K528 HydrophobicContact CG-CD 4.24Å; F411-K528 HydrophobicContact CZ-CB 4.31Å; F411-K528 HydrophobicContact CZ-CD 3.66Å; F411-K528 HydrophobicContact CZ-CG 3.81Å; N524-K528 WeakPolarHBondContact O-CB 3.21Å; N524-K528 PolarHBondContact O-N 2.73Å; L525-K528 PolarHBondContact O-N 3.36Å; L526-K528 PolarHBondContact O-N 3.04Å; K528-Q531 PolarHBondContact O-N 3.29Å; K528-L532 HydrophobicContact CG-CD1 4.22Å; K528-L532 WeakPolarHBondContact O-CG 3.44Å; K528-L532 PolarHBondContact O-N 3.02Å
529	I	92.8	Very high	91.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.9	-37.8	179.6	-163.8	65.6	0	0	0	111.6	V421 W485 L486 L525 L526 L532 L533	V421-I529 HydrophobicContact CG1-CD1 3.57Å; W485-I529 HydrophobicContact CZ3-CD1 4.12Å; W485-I529 HydrophobicContact CZ3-CG1 4.47Å; L486-I529 HydrophobicContact CD1-CG2 3.85Å; L486-I529 HydrophobicContact CD2-CG2 3.72Å; L486-I529 HydrophobicContact CG-CG2 4.44Å; L525-I529 WeakPolarHBondContact O-CG2 3.47Å; L525-I529 PolarHBondContact O-N 3.46Å; L526-I529 WeakPolarHBondContact O-CG2 3.22Å; I529-L532 PolarHBondContact O-N 2.86Å; I529-L533 HydrophobicContact CG1-CD1 4.07Å; I529-L533 WeakPolarHBondContact O-CG 3.36Å; I529-L533 PolarHBondContact O-N 3.21Å
530	H	93.1	Very high	91.8	Very high	38 Å²	38	46.3 Å²	46.3	18%	0.176	25%	0.253	C	S	.	.	H	α-helix	trans	-59.7	-46.3	174.1	167.8	-107.1	0	0	0	111.5	L526 V527 L533 S534 L615 P616	L526-H530 VanDerWaalsContact O-CB 3.25Å; L526-H530 WeakPolarHBondContact O-CB 3.39Å; L526-H530 PolarHBondContact O-N 3.4Å; V527-H530 PolarHBondContact O-N 3.42Å; H530-L533 PolarHBondContact O-N 2.85Å; H530-S534 PolarHBondContact NE2-OG 2.79Å; H530-S534 VanDerWaalsContact O-CB 3.3Å; H530-S534 WeakPolarHBondContact O-CB 3.22Å; H530-S534 PolarHBondContact O-N 3.41Å; H530-S534 PolarHBondContact O-OG 3.45Å; H530-L615 HydrophobicContact CB-CD2 3.62Å; H530-P616 WeakPolarHBondContact NE2-CD 3.13Å; H530-P616 WeakPolarHBondContact NE2-CG 3.27Å
531	Q	92.6	Very high	91.8	Very high	113 Å²	113	48.6 Å²	48.6	53%	0.528	27%	0.267	S	S	.	.	H	α-helix	trans	-62.2	-47.5	178	-174.8	173.9	1	0	0	111.5	V527 K528 L533 S534 D535	V527-Q531 WeakPolarHBondContact O-CB 3.35Å; V527-Q531 PolarHBondContact O-N 3.15Å; K528-Q531 PolarHBondContact O-N 3.29Å; Q531-L533 PolarHBondContact O-N 2.95Å; Q531-S534 PolarHBondContact O-N 3.49Å; Q531-D535 WeakPolarHBondContact O-CB 3.5Å; Q531-D535 VanDerWaalsContact O-CG 3.23Å; Q531-D535 PolarHBondContact O-N 3.04Å
532	L	91.9	Very high	91.9	Very high	36 Å²	36	45.8 Å²	45.8	19%	0.188	25%	0.251	C	S	.	.	H	α-helix	trans	-59.9	-43.4	179.4	-74.8	170	0	0	0	113	F411 V425 K528 I529 A536	F411-L532 HydrophobicContact CD1-CD1 3.98Å; F411-L532 HydrophobicContact CE1-CD1 3.4Å; F411-L532 VanDerWaalsContact CE1-CD1 3.4Å; F411-L532 HydrophobicContact CZ-CD1 4.38Å; V425-L532 HydrophobicContact CG1-CB 4.36Å; V425-L532 WeakPolarHBondContact CG1-O 3.31Å; K528-L532 HydrophobicContact CG-CD1 4.22Å; K528-L532 WeakPolarHBondContact O-CG 3.44Å; K528-L532 PolarHBondContact O-N 3.02Å; I529-L532 PolarHBondContact O-N 2.86Å; L532-A536 WeakPolarHBondContact O-CB 3.47Å; L532-A536 PolarHBondContact O-N 3.4Å
533	L	93	Very high	91.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-72.3	-31.7	178.5	-68.3	170.1	0	0	0	112.6	V425 L482 I529 H530 Q531 A536 S537 V538 L543 M546	V425-L533 HydrophobicContact CG2-CD2 3.95Å; L482-L533 HydrophobicContact CD1-CD2 3.9Å; I529-L533 HydrophobicContact CG1-CD1 4.07Å; I529-L533 WeakPolarHBondContact O-CG 3.36Å; I529-L533 PolarHBondContact O-N 3.21Å; H530-L533 PolarHBondContact O-N 2.85Å; Q531-L533 PolarHBondContact O-N 2.95Å; L533-A536 PolarHBondContact O-N 3.02Å; L533-S537 PolarHBondContact O-N 3.34Å; L533-V538 HydrophobicContact CB-CG2 4.33Å; L533-V538 HydrophobicContact CD2-CG2 3.97Å; L533-V538 WeakPolarHBondContact O-CG2 3.23Å; L533-V538 PolarHBondContact O-N 3.48Å; L533-L543 HydrophobicContact CB-CD1 3.91Å; L533-L543 HydrophobicContact CD1-CD1 3.84Å; L533-M546 HydrophobicContact CD1-CE 3.46Å; L533-M546 VanDerWaalsContact CD1-CE 3.46Å; L533-M546 HydrophobicContact CD1-SD 3.53Å; L533-M546 VanDerWaalsContact CD1-SD 3.53Å
534	S	91	Very high	91.9	Very high	44 Å²	44	51.1 Å²	51.1	31%	0.308	27%	0.271	S	S	.	.	H	α-helix	trans	-67.1	-45	173.3	-59.6	0	0	0	0	111.2	H530 Q531 A536 S537	H530-S534 PolarHBondContact NE2-OG 2.79Å; H530-S534 VanDerWaalsContact O-CB 3.3Å; H530-S534 WeakPolarHBondContact O-CB 3.22Å; H530-S534 PolarHBondContact O-N 3.41Å; H530-S534 PolarHBondContact O-OG 3.45Å; Q531-S534 PolarHBondContact O-N 3.49Å; S534-A536 PolarHBondContact O-N 2.71Å; S534-S537 PolarHBondContact O-N 2.77Å
535	D	90.2	Very high	91.9	Very high	103 Å²	103	49.4 Å²	49.4	55%	0.551	26%	0.261	S	S	*	.	H	α-helix	trans	-64.9	-31.1	176.8	-68.4	-16	0	0	0	111.8	Q531 S537	Q531-D535 WeakPolarHBondContact O-CB 3.5Å; Q531-D535 VanDerWaalsContact O-CG 3.23Å; Q531-D535 PolarHBondContact O-N 3.04Å; D535-S537 PolarHBondContact O-N 3.08Å
536	A	89	Confident	92.1	Very high	7 Å²	7	49.2 Å²	49.2	6%	0.058	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-2.5	171.9	0	0	0	0	0	114.3	V425 K429 L532 L533 S534 V538	V425-A536 HydrophobicContact CG1-CB 3.52Å; K429-A536 HydrophobicContact CB-CB 3.98Å; L532-A536 WeakPolarHBondContact O-CB 3.47Å; L532-A536 PolarHBondContact O-N 3.4Å; L533-A536 PolarHBondContact O-N 3.02Å; S534-A536 PolarHBondContact O-N 2.71Å; A536-V538 HydrophobicContact CB-CG2 4.1Å; A536-V538 PolarHBondContact O-N 3.37Å
537	S	88.3	Confident	92.1	Very high	95 Å²	95	49.1 Å²	49.1	66%	0.664	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	35.7	-179.5	-54.5	0	0	0	0	113.5	L533 S534 D535	L533-S537 PolarHBondContact O-N 3.34Å; S534-S537 PolarHBondContact O-N 2.77Å; D535-S537 PolarHBondContact O-N 3.08Å
538	V	90.3	Very high	92.1	Very high	5 Å²	5	48.7 Å²	48.7	3%	0.03	25%	0.252	C	S	.	.			trans	-63.7	141.7	175.4	176.2	0	0	0	0	109.9	I428 F432 V478 L533 A536 N540 L542	I428-V538 HydrophobicContact CG2-CG2 3.79Å; F432-V538 HydrophobicContact CE2-CG1 4.34Å; V478-V538 HydrophobicContact CG2-CG1 4.27Å; L533-V538 HydrophobicContact CB-CG2 4.33Å; L533-V538 HydrophobicContact CD2-CG2 3.97Å; L533-V538 WeakPolarHBondContact O-CG2 3.23Å; L533-V538 PolarHBondContact O-N 3.48Å; A536-V538 HydrophobicContact CB-CG2 4.1Å; A536-V538 PolarHBondContact O-N 3.37Å; V538-N540 PolarHBondContact O-N 2.98Å; V538-L542 HydrophobicContact CG1-CB 4.36Å; V538-L542 HydrophobicContact CG1-CD2 4.01Å; V538-L542 HydrophobicContact CG1-CG 4.4Å
539	P	91	Very high	92.3	Very high	37 Å²	37	49.7 Å²	49.7	24%	0.24	25%	0.253	C	S	.	.			trans	-51.5	126.8	178.2	-28.8	35.4	0	0	0	112.9	F432 N541 L542 L543	F432-P539 HydrophobicContact CD1-CG 4.15Å; F432-P539 HydrophobicContact CE1-CG 3.74Å; F432-P539 HydrophobicContact CE2-CG 4.35Å; F432-P539 HydrophobicContact CZ-CG 3.86Å; P539-N541 WeakPolarHBondContact CB-OD1 3.45Å; P539-N541 PolarHBondContact O-N 3.49Å; P539-N541 VanDerWaalsContact O-N 3.11Å; P539-L542 HydrophobicContact CB-CB 4.33Å; P539-L542 WeakPolarHBondContact O-CB 3.32Å; P539-L542 PolarHBondContact O-N 2.99Å; P539-L543 PolarHBondContact O-N 2.92Å; P539-L543 VanDerWaalsContact O-N 3.1Å
540	N	90.4	Very high	92.4	Very high	117 Å²	117	49.7 Å²	49.7	63%	0.626	25%	0.253	S	S	*	.	H	α-helix	trans	-58.8	-28.8	-173.8	-76.8	-27.6	0	0	0	113.7	V538 R544	V538-N540 PolarHBondContact O-N 2.98Å; N540-R544 VanDerWaalsContact O-CB 3.31Å; N540-R544 WeakPolarHBondContact O-CB 3.3Å; N540-R544 WeakPolarHBondContact O-CG 3.13Å; N540-R544 PolarHBondContact O-N 2.75Å; N540-R544 VanDerWaalsContact O-N 3.11Å; N540-R544 PolarHBondContact O-NE 3.4Å; N540-R544 VanDerWaalsContact O-NE 3.14Å
541	N	91.5	Very high	92.5	Very high	106 Å²	106	47.9 Å²	47.9	57%	0.567	24%	0.244	S	C	*	.	H	α-helix	trans	-66.3	-41.8	173.3	57.1	-48	0	0	0	111.9	P539 E545	P539-N541 WeakPolarHBondContact CB-OD1 3.45Å; P539-N541 PolarHBondContact O-N 3.49Å; P539-N541 VanDerWaalsContact O-N 3.11Å; N541-E545 WeakPolarHBondContact O-CB 3.3Å; N541-E545 PolarHBondContact O-N 2.97Å
542	L	92.6	Very high	92.5	Very high	19 Å²	19	43.7 Å²	43.7	10%	0.099	23%	0.225	C	C	.	.	H	α-helix	trans	-69.6	-42	-179.6	-174.8	61.6	0	0	0	111.3	F432 V478 V538 P539 E545 M546	F432-L542 HydrophobicContact CE2-CD2 4.35Å; F432-L542 HydrophobicContact CZ-CD2 3.91Å; V478-L542 HydrophobicContact CB-CD1 4.28Å; V478-L542 HydrophobicContact CB-CD2 3.76Å; V478-L542 HydrophobicContact CB-CG 3.88Å; V478-L542 HydrophobicContact CG1-CD1 4.43Å; V478-L542 HydrophobicContact CG1-CD2 4.2Å; V478-L542 HydrophobicContact CG1-CG 3.85Å; V478-L542 HydrophobicContact CG2-CD2 3.83Å; V478-L542 HydrophobicContact CG2-CG 4.4Å; V538-L542 HydrophobicContact CG1-CB 4.36Å; V538-L542 HydrophobicContact CG1-CD2 4.01Å; V538-L542 HydrophobicContact CG1-CG 4.4Å; P539-L542 HydrophobicContact CB-CB 4.33Å; P539-L542 WeakPolarHBondContact O-CB 3.32Å; P539-L542 PolarHBondContact O-N 2.99Å; L542-E545 PolarHBondContact O-N 3.19Å; L542-M546 WeakPolarHBondContact O-CB 3.34Å; L542-M546 PolarHBondContact O-N 3.49Å
543	L	93.7	Very high	92.7	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-61.7	-46.4	174.8	178.6	58.6	0	0	0	111.9	L533 P539 E545 M546 L547	L533-L543 HydrophobicContact CB-CD1 3.91Å; L533-L543 HydrophobicContact CD1-CD1 3.84Å; P539-L543 PolarHBondContact O-N 2.92Å; P539-L543 VanDerWaalsContact O-N 3.1Å; L543-E545 PolarHBondContact O-N 2.95Å; L543-M546 HydrophobicContact CD1-CE 3.92Å; L543-M546 PolarHBondContact O-N 3.22Å; L543-L547 HydrophobicContact CD1-CD1 4.2Å; L543-L547 HydrophobicContact CD1-CG 4.32Å; L543-L547 HydrophobicContact CG-CD1 4.29Å; L543-L547 WeakPolarHBondContact O-CG 3.5Å; L543-L547 PolarHBondContact O-N 2.74Å
544	R	93.3	Very high	92.7	Very high	111 Å²	111	45.2 Å²	45.2	42%	0.419	24%	0.236	S	C	.	.	H	α-helix	trans	-59.4	-45.5	176.9	-78.9	-173.6	-72.4	169.3	-1.2	112.1	N540 L547 R548 P616	N540-R544 VanDerWaalsContact O-CB 3.31Å; N540-R544 WeakPolarHBondContact O-CB 3.3Å; N540-R544 WeakPolarHBondContact O-CG 3.13Å; N540-R544 PolarHBondContact O-N 2.75Å; N540-R544 VanDerWaalsContact O-N 3.11Å; N540-R544 PolarHBondContact O-NE 3.4Å; N540-R544 VanDerWaalsContact O-NE 3.14Å; R544-L547 PolarHBondContact O-N 2.91Å; R544-R548 VanDerWaalsContact O-CB 3.31Å; R544-R548 WeakPolarHBondContact O-CB 3.44Å; R544-R548 PolarHBondContact O-N 2.89Å; R544-P616 HydrophobicContact CG-CB 4.29Å; R544-P616 WeakPolarHBondContact CG-O 3.31Å
545	E	93.4	Very high	92.9	Very high	52 Å²	52	43.1 Å²	43.1	24%	0.243	22%	0.222	C	C	.	.	H	α-helix	trans	-67.8	-38.7	-179.6	-179.2	62.1	-173.3	0	0	112.3	N541 L542 L543 R548 R549	N541-E545 WeakPolarHBondContact O-CB 3.3Å; N541-E545 PolarHBondContact O-N 2.97Å; L542-E545 PolarHBondContact O-N 3.19Å; L543-E545 PolarHBondContact O-N 2.95Å; E545-R548 VanDerWaalsContact CD-NH2 3.32Å; E545-R548 IonicContact OE1-CZ 2.86Å; E545-R548 IonicContact OE1-NE 3.08Å; E545-R548 IonicContact OE1-NH2 3.41Å; E545-R548 PolarHBondContact OE1-NH2 2.92Å; E545-R548 IonicContact OE2-CZ 3.79Å; E545-R548 IonicContact OE2-NE 3.84Å; E545-R548 PolarHBondContact OE2-NE 3.35Å; E545-R548 IonicContact OE2-NH2 3.9Å; E545-R548 PolarHBondContact OE2-NH2 3.41Å; E545-R549 WeakPolarHBondContact O-CG 3.25Å; E545-R549 PolarHBondContact O-N 3.5Å; E545-R549 IonicContact OE1-CZ 2.6Å; E545-R549 VanDerWaalsContact OE1-CZ 3.25Å; E545-R549 IonicContact OE1-NE 3.82Å; E545-R549 PolarHBondContact OE1-NE 3.4Å; E545-R549 IonicContact OE1-NH2 3.57Å; E545-R549 PolarHBondContact OE1-NH2 2.98Å
546	M	95.5	Very high	93	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-59.5	-52.5	173.5	-178.4	-160.9	76.8	0	0	110.7	V478 L482 T483 L486 L533 L542 L543 R548 R549 T550	V478-M546 HydrophobicContact CG1-CB 4.08Å; V478-M546 HydrophobicContact CG1-CG 4.18Å; V478-M546 HydrophobicContact CG1-SD 3.73Å; L482-M546 HydrophobicContact CB-SD 4.32Å; T483-M546 VanDerWaalsContact OG1-CG 3.3Å; T483-M546 WeakPolarHBondContact OG1-CG 3.47Å; L486-M546 HydrophobicContact CD2-CE 4.1Å; L533-M546 HydrophobicContact CD1-CE 3.46Å; L533-M546 VanDerWaalsContact CD1-CE 3.46Å; L533-M546 HydrophobicContact CD1-SD 3.53Å; L533-M546 VanDerWaalsContact CD1-SD 3.53Å; L542-M546 WeakPolarHBondContact O-CB 3.34Å; L542-M546 PolarHBondContact O-N 3.49Å; L543-M546 HydrophobicContact CD1-CE 3.92Å; L543-M546 PolarHBondContact O-N 3.22Å; M546-R548 PolarHBondContact O-N 3.16Å; M546-R549 PolarHBondContact O-N 3.24Å; M546-T550 WeakPolarHBondContact O-CB 3.4Å; M546-T550 PolarHBondContact O-N 3.43Å; M546-T550 PolarHBondContact O-OG1 2.96Å
547	L	94.8	Very high	93.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.8	-45.1	-179.8	-70.7	174.1	0	0	0	111.5	L543 R544 T550 L551 L615 P616 L617	L543-L547 HydrophobicContact CD1-CD1 4.2Å; L543-L547 HydrophobicContact CD1-CG 4.32Å; L543-L547 HydrophobicContact CG-CD1 4.29Å; L543-L547 WeakPolarHBondContact O-CG 3.5Å; L543-L547 PolarHBondContact O-N 2.74Å; R544-L547 PolarHBondContact O-N 2.91Å; L547-T550 PolarHBondContact O-N 2.87Å; L547-L551 HydrophobicContact CB-CD1 4.47Å; L547-L551 VanDerWaalsContact O-CB 3.24Å; L547-L551 WeakPolarHBondContact O-CB 3.42Å; L547-L551 WeakPolarHBondContact O-CD1 3.26Å; L547-L551 VanDerWaalsContact O-CG 3.24Å; L547-L551 WeakPolarHBondContact O-CG 3.46Å; L547-L551 PolarHBondContact O-N 2.97Å; L547-L615 HydrophobicContact CD1-CB 4.47Å; L547-L615 HydrophobicContact CD1-CD2 4.33Å; L547-P616 HydrophobicContact CD1-CG 4.19Å; L547-L617 HydrophobicContact CB-CD2 3.8Å
548	R	94.2	Very high	93.4	Very high	47 Å²	47	38.8 Å²	38.8	18%	0.177	19%	0.194	C	C	.	.	H	α-helix	trans	-55	-55	176.5	-171.3	-168.7	65.6	82.4	-9.2	111.1	R544 E545 M546 T550 L551 D552 P618 D620 C621	R544-R548 VanDerWaalsContact O-CB 3.31Å; R544-R548 WeakPolarHBondContact O-CB 3.44Å; R544-R548 PolarHBondContact O-N 2.89Å; E545-R548 VanDerWaalsContact CD-NH2 3.32Å; E545-R548 IonicContact OE1-CZ 2.86Å; E545-R548 IonicContact OE1-NE 3.08Å; E545-R548 IonicContact OE1-NH2 3.41Å; E545-R548 PolarHBondContact OE1-NH2 2.92Å; E545-R548 IonicContact OE2-CZ 3.79Å; E545-R548 IonicContact OE2-NE 3.84Å; E545-R548 PolarHBondContact OE2-NE 3.35Å; E545-R548 IonicContact OE2-NH2 3.9Å; E545-R548 PolarHBondContact OE2-NH2 3.41Å; M546-R548 PolarHBondContact O-N 3.16Å; R548-T550 PolarHBondContact O-N 2.62Å; R548-L551 PolarHBondContact O-N 2.81Å; R548-D552 WeakPolarHBondContact CG-OD2 3.26Å; R548-D552 IonicContact NH1-OD2 2.75Å; R548-D552 PolarHBondContact NH1-OD2 3.38Å; R548-D552 VanDerWaalsContact NH1-OD2 3.12Å; R548-D552 WeakPolarHBondContact O-CB 3.31Å; R548-D552 PolarHBondContact O-N 3.13Å; R548-P618 HydrophobicContact CB-CG 3.87Å; R548-P618 HydrophobicContact CG-CG 3.86Å; R548-D620 WeakPolarHBondContact CD-OD1 3.33Å; R548-C621 HydrophobicContact CG-CB 4.11Å
549	R	94.9	Very high	93.4	Very high	111 Å²	111	38.6 Å²	38.6	42%	0.419	19%	0.192	S	C	.	.	H	α-helix	trans	-60	-45.3	-179.3	-73.3	-178.7	-175	-170.9	2.3	113.1	T483 E545 M546 T553	T483-R549 HydrophobicContact CG2-CB 3.91Å; E545-R549 WeakPolarHBondContact O-CG 3.25Å; E545-R549 PolarHBondContact O-N 3.5Å; E545-R549 IonicContact OE1-CZ 2.6Å; E545-R549 VanDerWaalsContact OE1-CZ 3.25Å; E545-R549 IonicContact OE1-NE 3.82Å; E545-R549 PolarHBondContact OE1-NE 3.4Å; E545-R549 IonicContact OE1-NH2 3.57Å; E545-R549 PolarHBondContact OE1-NH2 2.98Å; M546-R549 PolarHBondContact O-N 3.24Å; R549-T553 WeakPolarHBondContact O-CB 3.48Å; R549-T553 PolarHBondContact O-N 3.25Å; R549-T553 PolarHBondContact O-OG1 3.42Å
550	T	95.4	Very high	93.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.9	-48.2	177.5	-68.3	0	0	0	0	110.9	L486 S487 L490 L526 M546 L547 R548 A554	L486-T550 HydrophobicContact CB-CG2 4.24Å; L486-T550 HydrophobicContact CD2-CG2 3.72Å; L486-T550 HydrophobicContact CG-CG2 3.63Å; S487-T550 WeakPolarHBondContact OG-CA 3.47Å; S487-T550 PolarHBondContact OG-OG1 2.65Å; L490-T550 HydrophobicContact CD2-CG2 3.95Å; L526-T550 HydrophobicContact CD2-CG2 4.44Å; M546-T550 WeakPolarHBondContact O-CB 3.4Å; M546-T550 PolarHBondContact O-N 3.43Å; M546-T550 PolarHBondContact O-OG1 2.96Å; L547-T550 PolarHBondContact O-N 2.87Å; R548-T550 PolarHBondContact O-N 2.62Å; T550-A554 VanDerWaalsContact O-CB 3.23Å; T550-A554 WeakPolarHBondContact O-CB 3.31Å; T550-A554 PolarHBondContact O-N 2.89Å
551	L	95	Very high	93.5	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-71.8	-43.6	-174.9	-73.5	166.5	0	0	0	112.3	L490 W494 L526 L547 R548 T553 A554 T555 L612 L615 L617 A623	L490-L551 HydrophobicContact CD2-CD2 4.37Å; W494-L551 HydrophobicContact CH2-CD2 4.45Å; L526-L551 HydrophobicContact CD1-CD2 3.74Å; L526-L551 HydrophobicContact CD2-CD2 4.17Å; L547-L551 HydrophobicContact CB-CD1 4.47Å; L547-L551 VanDerWaalsContact O-CB 3.24Å; L547-L551 WeakPolarHBondContact O-CB 3.42Å; L547-L551 WeakPolarHBondContact O-CD1 3.26Å; L547-L551 VanDerWaalsContact O-CG 3.24Å; L547-L551 WeakPolarHBondContact O-CG 3.46Å; L547-L551 PolarHBondContact O-N 2.97Å; R548-L551 PolarHBondContact O-N 2.81Å; L551-T553 VanDerWaalsContact C-N 3.27Å; L551-T553 PolarHBondContact O-N 3.21Å; L551-A554 PolarHBondContact O-N 2.74Å; L551-T555 VanDerWaalsContact O-CB 3.26Å; L551-T555 WeakPolarHBondContact O-CB 3.22Å; L551-T555 WeakPolarHBondContact O-CG2 3.35Å; L551-T555 PolarHBondContact O-N 2.9Å; L551-T555 PolarHBondContact O-OG1 2.83Å; L551-L612 HydrophobicContact CD1-CD2 3.5Å; L551-L612 VanDerWaalsContact CD1-CD2 3.5Å; L551-L612 HydrophobicContact CD2-CD2 3.67Å; L551-L612 HydrophobicContact CG-CD2 4.12Å; L551-L615 HydrophobicContact CD1-CD1 4.37Å; L551-L617 HydrophobicContact CD1-CD1 3.92Å; L551-L617 HydrophobicContact CD1-CD2 3.41Å; L551-L617 VanDerWaalsContact CD1-CD2 3.41Å; L551-L617 HydrophobicContact CD1-CG 4.31Å; L551-A623 HydrophobicContact CB-CB 4.07Å
552	D	94	Very high	93.4	Very high	24 Å²	24	32 Å²	32	13%	0.128	16%	0.155	C	C	.	.	H	α-helix	trans	-57.5	-44.4	176.7	-68.4	-13.8	0	0	0	110.4	R548 S556 C621 D622 A623	R548-D552 WeakPolarHBondContact CG-OD2 3.26Å; R548-D552 IonicContact NH1-OD2 2.75Å; R548-D552 PolarHBondContact NH1-OD2 3.38Å; R548-D552 VanDerWaalsContact NH1-OD2 3.12Å; R548-D552 WeakPolarHBondContact O-CB 3.31Å; R548-D552 PolarHBondContact O-N 3.13Å; D552-S556 WeakPolarHBondContact O-CB 3.25Å; D552-S556 PolarHBondContact O-N 2.97Å; D552-S556 VanDerWaalsContact O-N 3.13Å; D552-C621 PolarHBondContact OD1-SG 2.97Å; D552-D622 PolarHBondContact OD1-N 2.85Å; D552-A623 PolarHBondContact OD1-N 2.88Å
553	T	94.7	Very high	93.2	Very high	67 Å²	67	33.2 Å²	33.2	41%	0.411	17%	0.165	S	C	.	.	H	α-helix	trans	-67.5	-51	178.9	-51.8	0	0	0	0	111.6	I491 R549 L551 I557	I491-T553 HydrophobicContact CD1-CG2 4.18Å; R549-T553 WeakPolarHBondContact O-CB 3.48Å; R549-T553 PolarHBondContact O-N 3.25Å; R549-T553 PolarHBondContact O-OG1 3.42Å; L551-T553 VanDerWaalsContact C-N 3.27Å; L551-T553 PolarHBondContact O-N 3.21Å; T553-I557 HydrophobicContact CG2-CD1 4.18Å; T553-I557 WeakPolarHBondContact O-CG1 3.47Å; T553-I557 PolarHBondContact O-N 3.36Å; T553-I557 VanDerWaalsContact O-N 3.17Å
554	A	94.5	Very high	92.9	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-69.8	-40.1	-175.3	0	0	0	0	0	112.8	L490 I491 W494 T550 L551 I557 Y558	L490-A554 HydrophobicContact CB-CB 4.31Å; L490-A554 HydrophobicContact CD2-CB 3.53Å; L490-A554 HydrophobicContact CG-CB 3.9Å; I491-A554 HydrophobicContact CG1-CB 4.08Å; W494-A554 HydrophobicContact CE3-CB 3.98Å; W494-A554 HydrophobicContact CZ3-CB 3.78Å; T550-A554 VanDerWaalsContact O-CB 3.23Å; T550-A554 WeakPolarHBondContact O-CB 3.31Å; T550-A554 PolarHBondContact O-N 2.89Å; L551-A554 PolarHBondContact O-N 2.74Å; A554-I557 PolarHBondContact O-N 3.1Å; A554-Y558 VanDerWaalsContact O-CB 3.27Å; A554-Y558 WeakPolarHBondContact O-CB 3.49Å; A554-Y558 PolarHBondContact O-N 3.34Å
555	T	93.1	Very high	92.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-70.1	-36	177.8	57	0	0	0	0	112	W494 L551 Y558 A559 A623 L627	W494-T555 HydrophobicContact CH2-CG2 4.33Å; W494-T555 HydrophobicContact CZ3-CG2 3.95Å; L551-T555 VanDerWaalsContact O-CB 3.26Å; L551-T555 WeakPolarHBondContact O-CB 3.22Å; L551-T555 WeakPolarHBondContact O-CG2 3.35Å; L551-T555 PolarHBondContact O-N 2.9Å; L551-T555 PolarHBondContact O-OG1 2.83Å; T555-Y558 PolarHBondContact O-N 2.76Å; T555-A559 VanDerWaalsContact O-CB 3.24Å; T555-A559 WeakPolarHBondContact O-CB 3.35Å; T555-A559 PolarHBondContact O-N 2.94Å; T555-A623 HydrophobicContact CG2-CB 3.96Å; T555-A623 WeakPolarHBondContact OG1-CA 3.38Å; T555-L627 HydrophobicContact CG2-CD1 4.39Å; T555-L627 HydrophobicContact CG2-CD2 4.47Å; T555-L627 HydrophobicContact CG2-CG 4.41Å
556	S	92.6	Very high	92.2	Very high	53 Å²	53	32 Å²	32	37%	0.371	17%	0.165	S	C	.	.	H	α-helix	trans	-60.8	-47.1	173	-180	0	0	0	0	111.9	D552 A559 N560	D552-S556 WeakPolarHBondContact O-CB 3.25Å; D552-S556 PolarHBondContact O-N 2.97Å; D552-S556 VanDerWaalsContact O-N 3.13Å; S556-A559 WeakPolarHBondContact O-CB 3.44Å; S556-A559 PolarHBondContact O-N 2.89Å; S556-N560 PolarHBondContact O-N 3.48Å; S556-N560 VanDerWaalsContact O-N 3.1Å; S556-N560 PolarHBondContact O-ND2 3.17Å
557	I	93.3	Very high	91.5	Very high	60 Å²	60	34.8 Å²	34.8	31%	0.308	18%	0.184	S	C	.	.	H	α-helix	trans	-66.2	-43.5	177.1	-66.8	166.7	0	0	0	111.1	I491 T553 A554 A559 N560 N561	I491-I557 HydrophobicContact CD1-CD1 3.54Å; I491-I557 HydrophobicContact CG1-CD1 3.93Å; I491-I557 HydrophobicContact CG2-CD1 4.26Å; I491-I557 HydrophobicContact CG2-CG2 4.13Å; T553-I557 HydrophobicContact CG2-CD1 4.18Å; T553-I557 WeakPolarHBondContact O-CG1 3.47Å; T553-I557 PolarHBondContact O-N 3.36Å; T553-I557 VanDerWaalsContact O-N 3.17Å; A554-I557 PolarHBondContact O-N 3.1Å; I557-A559 VanDerWaalsContact C-N 3.32Å; I557-A559 PolarHBondContact O-N 3.38Å; I557-N560 PolarHBondContact O-N 2.82Å; I557-N561 PolarHBondContact O-N 3.27Å
558	Y	93.8	Very high	90.9	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-58.9	-43.6	175.5	-179.4	-106.8	0	0	0	111.7	W494 V497 Y518 M519 A554 T555 N560 N561 V562 L605	W494-Y558 HydrophobicContact CB-CD2 3.86Å; W494-Y558 HydrophobicContact CB-CE2 4.48Å; W494-Y558 HydrophobicContact CE3-CG 4.37Å; W494-Y558 HydrophobicContact CG-CD2 4.39Å; V497-Y558 HydrophobicContact CB-CD2 4.38Å; V497-Y558 HydrophobicContact CB-CE2 3.78Å; V497-Y558 HydrophobicContact CG1-CD2 4.15Å; V497-Y558 HydrophobicContact CG1-CE2 4.04Å; V497-Y558 HydrophobicContact CG2-CE2 3.81Å; Y518-Y558 HydrophobicContact CE2-CE2 4.11Å; Y518-Y558 PolarHBondContact OH-OH 3.04Å; M519-Y558 HydrophobicContact CE-CD2 4.5Å; M519-Y558 HydrophobicContact CE-CE1 3.97Å; M519-Y558 HydrophobicContact CE-CE2 3.72Å; M519-Y558 VanDerWaalsContact CE-CZ 3.42Å; M519-Y558 WeakPolarHBondContact CE-OH 3.26Å; A554-Y558 VanDerWaalsContact O-CB 3.27Å; A554-Y558 WeakPolarHBondContact O-CB 3.49Å; A554-Y558 PolarHBondContact O-N 3.34Å; T555-Y558 PolarHBondContact O-N 2.76Å; Y558-N560 VanDerWaalsContact C-N 3.32Å; Y558-N560 PolarHBondContact O-N 3.38Å; Y558-N561 PolarHBondContact O-N 2.97Å; Y558-V562 HydrophobicContact CD1-CG2 4.02Å; Y558-V562 HydrophobicContact CD2-CG2 4.31Å; Y558-V562 HydrophobicContact CE1-CG2 3.63Å; Y558-V562 HydrophobicContact CE2-CG2 3.98Å; Y558-V562 HydrophobicContact CG-CG2 4.35Å; Y558-V562 VanDerWaalsContact O-CG2 3.31Å; Y558-V562 WeakPolarHBondContact O-CG2 3.33Å; Y558-V562 PolarHBondContact O-N 3.03Å; Y558-L605 HydrophobicContact CE1-CD2 4.14Å
559	A	90.6	Very high	90.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.5	-42.3	176.9	0	0	0	0	0	112.7	T555 S556 I557 V562 S563 T626 L630	T555-A559 VanDerWaalsContact O-CB 3.24Å; T555-A559 WeakPolarHBondContact O-CB 3.35Å; T555-A559 PolarHBondContact O-N 2.94Å; S556-A559 WeakPolarHBondContact O-CB 3.44Å; S556-A559 PolarHBondContact O-N 2.89Å; I557-A559 VanDerWaalsContact C-N 3.32Å; I557-A559 PolarHBondContact O-N 3.38Å; A559-V562 PolarHBondContact O-N 3.23Å; A559-S563 WeakPolarHBondContact O-CB 3.23Å; A559-S563 PolarHBondContact O-N 3.05Å; A559-S563 PolarHBondContact O-OG 3.46Å; A559-T626 HydrophobicContact CB-CG2 3.55Å; A559-L630 HydrophobicContact CB-CD1 3.6Å; A559-L630 HydrophobicContact CB-CD2 3.94Å; A559-L630 HydrophobicContact CB-CG 3.93Å
560	N	91.7	Very high	89.2	Confident	83 Å²	83	31.8 Å²	31.8	44%	0.444	18%	0.184	S	C	.	.	H	α-helix	trans	-63.9	-44	175.7	-68.2	-27.7	0	0	0	111.3	S556 I557 Y558 S563 Q564	S556-N560 PolarHBondContact O-N 3.48Å; S556-N560 VanDerWaalsContact O-N 3.1Å; S556-N560 PolarHBondContact O-ND2 3.17Å; I557-N560 PolarHBondContact O-N 2.82Å; Y558-N560 VanDerWaalsContact C-N 3.32Å; Y558-N560 PolarHBondContact O-N 3.38Å; N560-S563 PolarHBondContact O-N 3.43Å; N560-Q564 WeakPolarHBondContact O-CG 3.12Å; N560-Q564 PolarHBondContact O-N 2.94Å
561	N	91.4	Very high	88.2	Confident	39 Å²	39	38 Å²	38	21%	0.209	21%	0.213	C	C	.	.	H	α-helix	trans	-64.3	-41.4	177.4	-68.4	-15.3	0	0	0	111.9	V497 I557 Y558 Q564 V565	V497-N561 HydrophobicContact CG1-CB 3.61Å; I557-N561 PolarHBondContact O-N 3.27Å; Y558-N561 PolarHBondContact O-N 2.97Å; N561-Q564 PolarHBondContact O-N 3.3Å; N561-V565 WeakPolarHBondContact O-CB 3.3Å; N561-V565 VanDerWaalsContact O-CG2 3.28Å; N561-V565 WeakPolarHBondContact O-CG2 3.12Å; N561-V565 PolarHBondContact O-N 3.33Å
562	V	89.8	Confident	87	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-62.8	-46.1	175.6	169.5	0	0	0	0	110.8	V497 Y558 A559 Q564 V565 L566 L601 L630	V497-V562 HydrophobicContact CG2-CG2 3.91Å; Y558-V562 HydrophobicContact CD1-CG2 4.02Å; Y558-V562 HydrophobicContact CD2-CG2 4.31Å; Y558-V562 HydrophobicContact CE1-CG2 3.63Å; Y558-V562 HydrophobicContact CE2-CG2 3.98Å; Y558-V562 HydrophobicContact CG-CG2 4.35Å; Y558-V562 VanDerWaalsContact O-CG2 3.31Å; Y558-V562 WeakPolarHBondContact O-CG2 3.33Å; Y558-V562 PolarHBondContact O-N 3.03Å; A559-V562 PolarHBondContact O-N 3.23Å; V562-Q564 VanDerWaalsContact C-N 3.31Å; V562-Q564 PolarHBondContact O-N 2.78Å; V562-V565 PolarHBondContact O-N 2.91Å; V562-L566 HydrophobicContact CG1-CD1 3.59Å; V562-L566 HydrophobicContact CG1-CG 4.28Å; V562-L566 WeakPolarHBondContact O-CB 3.39Å; V562-L566 VanDerWaalsContact O-CG 3.28Å; V562-L566 WeakPolarHBondContact O-CG 3.28Å; V562-L566 PolarHBondContact O-N 3.41Å; V562-L601 HydrophobicContact CG1-CD1 4.22Å; V562-L601 HydrophobicContact CG1-CD2 4.42Å; V562-L601 HydrophobicContact CG2-CD2 4Å; V562-L630 HydrophobicContact CB-CD2 4.29Å; V562-L630 HydrophobicContact CG1-CD2 4.06Å
563	S	87.4	Confident	85.5	Confident	43 Å²	43	41.1 Å²	41.1	30%	0.301	23%	0.234	S	C	.	.	H	α-helix	trans	-59.8	-42	177.2	-57.3	0	0	0	0	111.7	A559 N560 S567	A559-S563 WeakPolarHBondContact O-CB 3.23Å; A559-S563 PolarHBondContact O-N 3.05Å; A559-S563 PolarHBondContact O-OG 3.46Å; N560-S563 PolarHBondContact O-N 3.43Å; S563-S567 WeakPolarHBondContact O-CB 3.48Å; S563-S567 PolarHBondContact O-N 2.57Å; S563-S567 PolarHBondContact O-OG 3.42Å
564	Q	87.9	Confident	83.9	Confident	127 Å²	127	40.5 Å²	40.5	59%	0.593	23%	0.232	S	C	*	.	H	α-helix	trans	-63.8	-45.7	174.5	-74.1	179.5	4.2	0	0	111.9	N560 N561 V562 L566 S567 S568	N560-Q564 WeakPolarHBondContact O-CG 3.12Å; N560-Q564 PolarHBondContact O-N 2.94Å; N561-Q564 PolarHBondContact O-N 3.3Å; V562-Q564 VanDerWaalsContact C-N 3.31Å; V562-Q564 PolarHBondContact O-N 2.78Å; Q564-L566 PolarHBondContact O-N 3.18Å; Q564-S567 PolarHBondContact O-N 3.44Å; Q564-S567 PolarHBondContact O-OG 3.16Å; Q564-S568 WeakPolarHBondContact O-CB 3.42Å; Q564-S568 PolarHBondContact O-N 2.66Å; Q564-S568 PolarHBondContact O-OG 3.08Å
565	V	86.5	Confident	82.4	Confident	8 Å²	8	43.7 Å²	43.7	5%	0.048	26%	0.255	C	S	.	.	H	α-helix	trans	-58.6	-49.7	176.5	166.9	0	0	0	0	110.6	P501 N561 V562 S567 S568 V569 I597	P501-V565 HydrophobicContact CG-CG1 3.8Å; N561-V565 WeakPolarHBondContact O-CB 3.3Å; N561-V565 VanDerWaalsContact O-CG2 3.28Å; N561-V565 WeakPolarHBondContact O-CG2 3.12Å; N561-V565 PolarHBondContact O-N 3.33Å; V562-V565 PolarHBondContact O-N 2.91Å; V565-S567 PolarHBondContact O-N 2.9Å; V565-S568 PolarHBondContact O-N 3.18Å; V565-S568 PolarHBondContact O-OG 3.33Å; V565-V569 HydrophobicContact CG1-CG2 4.34Å; V565-V569 VanDerWaalsContact O-CG2 3.29Å; V565-V569 WeakPolarHBondContact O-CG2 3.49Å; V565-V569 PolarHBondContact O-N 3.33Å; V565-I597 HydrophobicContact CG1-CG2 4.38Å
566	L	84.7	Confident	80.6	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-59.9	-47.4	179.1	-69.9	164.3	0	0	0	111.4	V562 Q564 S568 V569 D570 K598 L601 M634 M637	V562-L566 HydrophobicContact CG1-CD1 3.59Å; V562-L566 HydrophobicContact CG1-CG 4.28Å; V562-L566 WeakPolarHBondContact O-CB 3.39Å; V562-L566 VanDerWaalsContact O-CG 3.28Å; V562-L566 WeakPolarHBondContact O-CG 3.28Å; V562-L566 PolarHBondContact O-N 3.41Å; Q564-L566 PolarHBondContact O-N 3.18Å; L566-S568 VanDerWaalsContact C-N 3.3Å; L566-S568 PolarHBondContact O-N 2.93Å; L566-V569 PolarHBondContact O-N 2.99Å; L566-V569 VanDerWaalsContact O-N 3.14Å; L566-D570 PolarHBondContact O-N 3.47Å; L566-K598 HydrophobicContact CD2-CG 4.24Å; L566-L601 HydrophobicContact CD2-CD1 3.91Å; L566-L601 HydrophobicContact CG-CD1 4.24Å; L566-M634 HydrophobicContact CD1-CG 4.17Å; L566-M637 HydrophobicContact CB-CE 4.14Å; L566-M637 HydrophobicContact CD1-CE 3.54Å; L566-M637 HydrophobicContact CD2-CE 3.93Å; L566-M637 HydrophobicContact CG-CE 4.05Å
567	S	82.3	Confident	78.7	Confident	59 Å²	59	48.3 Å²	48.3	41%	0.413	28%	0.28	S	S	.	.	H	α-helix	trans	-58.9	-39.6	176.2	75.7	0	0	0	0	112.8	S563 Q564 V565 Q571	S563-S567 WeakPolarHBondContact O-CB 3.48Å; S563-S567 PolarHBondContact O-N 2.57Å; S563-S567 PolarHBondContact O-OG 3.42Å; Q564-S567 PolarHBondContact O-N 3.44Å; Q564-S567 PolarHBondContact O-OG 3.16Å; V565-S567 PolarHBondContact O-N 2.9Å; S567-Q571 WeakPolarHBondContact O-CB 3.43Å; S567-Q571 VanDerWaalsContact O-CG 3.29Å; S567-Q571 WeakPolarHBondContact O-CG 3.46Å; S567-Q571 PolarHBondContact O-N 3.5Å
568	S	82	Confident	76.9	Confident	45 Å²	45	52.2 Å²	52.2	32%	0.315	30%	0.295	S	S	.	.	H	α-helix	trans	-71.3	-35.1	178.3	77.3	0	0	0	0	112.4	Q564 V565 L566 V572	Q564-S568 WeakPolarHBondContact O-CB 3.42Å; Q564-S568 PolarHBondContact O-N 2.66Å; Q564-S568 PolarHBondContact O-OG 3.08Å; V565-S568 PolarHBondContact O-N 3.18Å; V565-S568 PolarHBondContact O-OG 3.33Å; L566-S568 VanDerWaalsContact C-N 3.3Å; L566-S568 PolarHBondContact O-N 2.93Å; S568-V572 WeakPolarHBondContact O-CG2 3.44Å; S568-V572 PolarHBondContact O-N 3.46Å
569	V	78	Confident	74.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-66.2	-45.3	176.2	167.7	0	0	0	0	109.5	P501 R505 V565 L566 V572 S573 D594 I597	P501-V569 HydrophobicContact CG-CG2 4.18Å; R505-V569 PolarHBondContact NH2-O 3.18Å; V565-V569 HydrophobicContact CG1-CG2 4.34Å; V565-V569 VanDerWaalsContact O-CG2 3.29Å; V565-V569 WeakPolarHBondContact O-CG2 3.49Å; V565-V569 PolarHBondContact O-N 3.33Å; L566-V569 PolarHBondContact O-N 2.99Å; L566-V569 VanDerWaalsContact O-N 3.14Å; V569-V572 PolarHBondContact O-N 3.26Å; V569-S573 PolarHBondContact O-N 3.05Å; V569-D594 HydrophobicContact CG1-CB 3.81Å; V569-D594 WeakPolarHBondContact CG1-OD1 3.37Å; V569-I597 HydrophobicContact CG2-CD1 3.96Å; V569-I597 HydrophobicContact CG2-CG2 4.43Å
570	D	73.7	Confident	72.3	Confident	50 Å²	50	65.8 Å²	65.8	27%	0.267	36%	0.359	S	S	.	.	H	α-helix	trans	-69.9	-36.9	179.9	-68.7	-26.1	0	0	0	113.3	L566 V572 S573 S574 K598	L566-D570 PolarHBondContact O-N 3.47Å; D570-V572 VanDerWaalsContact C-N 3.26Å; D570-V572 PolarHBondContact O-N 2.98Å; D570-S573 WeakPolarHBondContact CA-OG 3.27Å; D570-S573 PolarHBondContact O-N 2.86Å; D570-S573 PolarHBondContact O-OG 3.01Å; D570-S573 VanDerWaalsContact O-OG 3.06Å; D570-S574 VanDerWaalsContact O-CB 3.29Å; D570-S574 WeakPolarHBondContact O-CB 3.48Å; D570-S574 PolarHBondContact O-N 3.15Å; D570-S574 PolarHBondContact O-OG 3.02Å; D570-K598 IonicContact OD1-NZ 3.25Å
571	Q	75.4	Confident	70	Confident	131 Å²	131	67.6 Å²	67.6	61%	0.612	36%	0.36	S	S	*	.	H	α-helix	trans	-60.8	-36.3	171.7	-78.7	-180	1.2	0	0	112.2	S567 S574 S575	S567-Q571 WeakPolarHBondContact O-CB 3.43Å; S567-Q571 VanDerWaalsContact O-CG 3.29Å; S567-Q571 WeakPolarHBondContact O-CG 3.46Å; S567-Q571 PolarHBondContact O-N 3.5Å; Q571-S574 WeakPolarHBondContact CA-OG 3.36Å; Q571-S574 PolarHBondContact O-OG 3.42Å; Q571-S575 WeakPolarHBondContact O-CB 3.34Å; Q571-S575 PolarHBondContact O-N 3.42Å; Q571-S575 PolarHBondContact O-OG 2.96Å
572	V	69.7	Low	67.6	Low	56 Å²	56	70.8 Å²	70.8	34%	0.339	39%	0.385	S	S	.	.	H	α-helix	trans	-78.7	-39.7	177.6	175.3	0	0	0	0	111.8	S568 V569 D570 S575 L576	S568-V572 WeakPolarHBondContact O-CG2 3.44Å; S568-V572 PolarHBondContact O-N 3.46Å; V569-V572 PolarHBondContact O-N 3.26Å; D570-V572 VanDerWaalsContact C-N 3.26Å; D570-V572 PolarHBondContact O-N 2.98Å; V572-S575 WeakPolarHBondContact O-CB 3.48Å; V572-S575 PolarHBondContact O-N 3.27Å; V572-L576 HydrophobicContact CG1-CD1 3.94Å; V572-L576 HydrophobicContact CG1-CG 4.49Å; V572-L576 WeakPolarHBondContact O-CB 3.4Å; V572-L576 PolarHBondContact O-N 3.5Å
573	S	63.4	Low	64.9	Low	34 Å²	34	76.2 Å²	76.2	24%	0.238	42%	0.419	C	S	.	.	H	α-helix	trans	-65.6	-38.6	177.5	74.8	0	0	0	0	111.8	V569 D570 S575 L576 S577 D594	V569-S573 PolarHBondContact O-N 3.05Å; D570-S573 WeakPolarHBondContact CA-OG 3.27Å; D570-S573 PolarHBondContact O-N 2.86Å; D570-S573 PolarHBondContact O-OG 3.01Å; D570-S573 VanDerWaalsContact O-OG 3.06Å; S573-S575 VanDerWaalsContact C-N 3.35Å; S573-L576 PolarHBondContact O-N 2.94Å; S573-S577 WeakPolarHBondContact O-CB 3.44Å; S573-S577 PolarHBondContact O-N 3.36Å; S573-S577 PolarHBondContact O-OG 2.91Å; S573-D594 VanDerWaalsContact CB-OD2 3.27Å; S573-D594 WeakPolarHBondContact CB-OD2 3.39Å
574	S	60.9	Low	62.4	Low	53 Å²	53	83.8 Å²	83.8	37%	0.371	45%	0.446	S	S	.	.	H	α-helix	trans	-67	-32.6	172.2	60.6	0	0	0	0	113	D570 Q571 S577 K578	D570-S574 VanDerWaalsContact O-CB 3.29Å; D570-S574 WeakPolarHBondContact O-CB 3.48Å; D570-S574 PolarHBondContact O-N 3.15Å; D570-S574 PolarHBondContact O-OG 3.02Å; Q571-S574 WeakPolarHBondContact CA-OG 3.36Å; Q571-S574 PolarHBondContact O-OG 3.42Å; S574-S577 WeakPolarHBondContact CA-OG 3.4Å; S574-S577 PolarHBondContact O-OG 3.32Å; S574-K578 WeakPolarHBondContact O-CG 3.39Å; S574-K578 PolarHBondContact O-N 3.11Å
575	S	61.8	Low	59.7	Low	69 Å²	69	86.9 Å²	86.9	48%	0.483	46%	0.463	S	S	.	.	H	α-helix	trans	-71.6	-39.2	172.9	-61.6	0	0	0	0	112.3	Q571 V572 S573 L579	Q571-S575 WeakPolarHBondContact O-CB 3.34Å; Q571-S575 PolarHBondContact O-N 3.42Å; Q571-S575 PolarHBondContact O-OG 2.96Å; V572-S575 WeakPolarHBondContact O-CB 3.48Å; V572-S575 PolarHBondContact O-N 3.27Å; S573-S575 VanDerWaalsContact C-N 3.35Å; S575-L579 PolarHBondContact O-N 3.11Å
576	L	55	Low	57	Low	83 Å²	83	91.4 Å²	91.4	44%	0.435	50%	0.501	S	S	.	.	H	α-helix	trans	-72	-36.6	177.7	-80.9	165.1	0	0	0	113	V572 S573 K578 L579 K580	V572-L576 HydrophobicContact CG1-CD1 3.94Å; V572-L576 HydrophobicContact CG1-CG 4.49Å; V572-L576 WeakPolarHBondContact O-CB 3.4Å; V572-L576 PolarHBondContact O-N 3.5Å; S573-L576 PolarHBondContact O-N 2.94Å; L576-K578 VanDerWaalsContact C-N 3.3Å; L576-K578 PolarHBondContact O-N 3.24Å; L576-L579 PolarHBondContact O-N 2.98Å; L576-L579 VanDerWaalsContact O-N 3.1Å; L576-K580 WeakPolarHBondContact O-CB 3.44Å; L576-K580 PolarHBondContact O-N 3.12Å
577	S	54.3	Low	54.4	Low	67 Å²	67	95.5 Å²	95.5	47%	0.469	54%	0.536	S	S	.	.	H	α-helix	trans	-66.2	-32.8	175.2	51.5	0	0	0	0	112.2	S573 S574 L579	S573-S577 WeakPolarHBondContact O-CB 3.44Å; S573-S577 PolarHBondContact O-N 3.36Å; S573-S577 PolarHBondContact O-OG 2.91Å; S574-S577 WeakPolarHBondContact CA-OG 3.4Å; S574-S577 PolarHBondContact O-OG 3.32Å; S577-L579 VanDerWaalsContact C-N 3.31Å; S577-L579 PolarHBondContact O-N 3.45Å
578	K	54.7	Low	52.5	Low	141 Å²	141	98 Å²	98	61%	0.613	56%	0.56	S	S	*	*	H	α-helix	trans	-64.2	-33	168.9	-72.7	174.2	-177.9	177.5	0	112.8	S574 L576	S574-K578 WeakPolarHBondContact O-CG 3.39Å; S574-K578 PolarHBondContact O-N 3.11Å; L576-K578 VanDerWaalsContact C-N 3.3Å; L576-K578 PolarHBondContact O-N 3.24Å
579	L	44.3	Very low	50.5	Low	131 Å²	131	103.5 Å²	103.5	69%	0.686	59%	0.586	S	S	*	*	H	α-helix	trans	-86.1	-36.9	-178.1	-119.8	142.6	0	0	0	113.8	S575 L576 S577 R581 S582	S575-L579 PolarHBondContact O-N 3.11Å; L576-L579 PolarHBondContact O-N 2.98Å; L576-L579 VanDerWaalsContact O-N 3.1Å; S577-L579 VanDerWaalsContact C-N 3.31Å; S577-L579 PolarHBondContact O-N 3.45Å; L579-R581 PolarHBondContact O-N 3.48Å; L579-S582 PolarHBondContact O-N 3.41Å
580	K	42.6	Very low	49.2	Very low	157 Å²	157	109 Å²	109	68%	0.683	62%	0.619	S	S	*	*	H	α-helix	trans	-70	-13.6	-179.6	-81.5	-174.9	176.5	-179.8	0	114.2	L576 S582 T583	L576-K580 WeakPolarHBondContact O-CB 3.44Å; L576-K580 PolarHBondContact O-N 3.12Å; K580-S582 PolarHBondContact O-N 3.3Å; K580-T583 PolarHBondContact O-N 3.06Å
581	R	43.6	Very low	48.5	Very low	121 Å²	121	110.2 Å²	110.2	46%	0.457	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.9	-13.9	170.3	-78.2	-175.3	-178	178.8	3.8	113.3	L579 G792 A793 C794	L579-R581 PolarHBondContact O-N 3.48Å; R581-G792 PolarHBondContact NH2-O 3.3Å; R581-G792 VanDerWaalsContact NH2-O 3.13Å; R581-A793 PolarHBondContact NH1-O 3.47Å; R581-A793 PolarHBondContact NH2-O 2.88Å; R581-C794 PolarHBondContact NH1-SG 3.49Å
582	S	41.7	Very low	48.3	Very low	105 Å²	105	107.4 Å²	107.4	73%	0.734	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-5.6	179.5	-52.9	0	0	0	0	115.8	L579 K580	L579-S582 PolarHBondContact O-N 3.41Å; K580-S582 PolarHBondContact O-N 3.3Å
583	T	33	Very low	48.4	Very low	116 Å²	116	107.6 Å²	107.6	71%	0.712	62%	0.619	S	S	*	*			trans	-145.2	102.2	177.7	-44.2	0	0	0	0	111.7	K580 M585	K580-T583 PolarHBondContact O-N 3.06Å; T583-M585 PolarHBondContact O-N 3.34Å
584	K	33.9	Very low	49	Very low	202 Å²	202	107.4 Å²	107.4	88%	0.878	62%	0.615	S	S	*	*			trans	-77	112.6	169.2	-75.7	178.7	175.1	178.3	0	109.5
585	M	31.2	Very low	49.7	Very low	191 Å²	191	105.9 Å²	105.9	94%	0.941	61%	0.608	S	S	*	*			trans	-162.4	144.8	149.5	-108.6	163.6	79.3	0	0	111.5	T583	T583-M585 PolarHBondContact O-N 3.34Å
586	A	31.1	Very low	50.6	Low	104 Å²	104	103.4 Å²	103.4	86%	0.86	59%	0.588	S	S	*	*			trans	-75.1	150.2	-160.3	0	0	0	0	0	116.3
587	A	30.4	Very low	52	Low	91 Å²	91	99.4 Å²	99.4	75%	0.752	57%	0.568	S	S	*	*			trans	-174.1	113.7	133.8	0	0	0	0	0	108.3
588	A	42.5	Very low	53.3	Low	110 Å²	110	98 Å²	98	91%	0.909	55%	0.553	S	S	*	*			trans	-104.5	34.4	-167.6	0	0	0	0	0	114.2
589	D	40.2	Very low	54.7	Low	162 Å²	162	94 Å²	94	87%	0.866	54%	0.538	S	S	*	.	S	Bend	trans	-148.2	28.2	179.8	-147.2	10.1	0	0	0	114.8
590	V	50.3	Low	56.8	Low	114 Å²	114	88.5 Å²	88.5	69%	0.691	51%	0.509	S	S	*	.	S	Bend	trans	-123.6	113.9	173.3	-176.5	0	0	0	0	107.9	S592	V590-S592 PolarHBondContact O-N 2.84Å
591	L	58.3	Low	59	Low	77 Å²	77	81 Å²	81	40%	0.403	48%	0.476	S	S	.	.			trans	-46.9	125.5	172.6	-157.4	85.4	0	0	0	108.7	K596 L599	L591-K596 HydrophobicContact CB-CG 4.45Å; L591-K596 HydrophobicContact CD2-CB 4.4Å; L591-K596 HydrophobicContact CD2-CG 3.77Å; L591-K596 HydrophobicContact CG-CG 4.49Å; L591-L599 HydrophobicContact CD2-CD2 4.13Å
592	S	70.3	Confident	61	Low	71 Å²	71	78.8 Å²	78.8	50%	0.497	47%	0.471	S	S	.	.			trans	-60.4	152	179.8	69.1	0	0	0	0	110.3	V590 D594 G595 K596	V590-S592 PolarHBondContact O-N 2.84Å; S592-D594 PolarHBondContact O-N 3.45Å; S592-D594 VanDerWaalsContact O-N 3.15Å; S592-G595 CarbonylContact O-C 3.56Å; S592-G595 WeakPolarHBondContact O-CA 3.43Å; S592-G595 PolarHBondContact O-N 2.97Å; S592-G595 PolarHBondContact OG-N 3.38Å; S592-K596 PolarHBondContact O-N 2.93Å
593	D	72.8	Confident	63.2	Low	60 Å²	60	75.9 Å²	75.9	32%	0.321	45%	0.447	S	S	.	.	H	α-helix	trans	-57	-31.6	176.9	-66.5	-28.5	0	0	0	111.6	R505 K596 I597	R505-D593 HydrophobicContact CG-CB 4.43Å; D593-K596 PolarHBondContact O-N 2.82Å; D593-K596 IonicContact OD1-NZ 2.92Å; D593-I597 VanDerWaalsContact O-CG1 3.32Å; D593-I597 WeakPolarHBondContact O-CG1 3.33Å; D593-I597 PolarHBondContact O-N 2.91Å
594	D	75.3	Confident	66	Low	30 Å²	30	70.4 Å²	70.4	16%	0.16	41%	0.413	C	S	.	.	H	α-helix	trans	-67.9	-39.5	173.5	-58.3	-26.2	0	0	0	111.8	R505 V569 S573 S592 I597 K598	R505-D594 IonicContact CZ-OD1 2.87Å; R505-D594 IonicContact NE-OD1 2.92Å; R505-D594 IonicContact NH2-OD1 3.63Å; R505-D594 PolarHBondContact NH2-OD1 3.25Å; V569-D594 HydrophobicContact CG1-CB 3.81Å; V569-D594 WeakPolarHBondContact CG1-OD1 3.37Å; S573-D594 VanDerWaalsContact CB-OD2 3.27Å; S573-D594 WeakPolarHBondContact CB-OD2 3.39Å; S592-D594 PolarHBondContact O-N 3.45Å; S592-D594 VanDerWaalsContact O-N 3.15Å; D594-I597 PolarHBondContact O-N 3.01Å; D594-K598 PolarHBondContact O-N 2.88Å
595	G	76	Confident	68.6	Low	21 Å²	21	61.5 Å²	61.5	22%	0.216	38%	0.375	C	S	.	.	H	α-helix	trans	-64.3	-37.1	172.2	0	0	0	0	0	112.7	S592 K598 L599	S592-G595 CarbonylContact O-C 3.56Å; S592-G595 WeakPolarHBondContact O-CA 3.43Å; S592-G595 PolarHBondContact O-N 2.97Å; S592-G595 PolarHBondContact OG-N 3.38Å; G595-K598 PolarHBondContact O-N 3.08Å; G595-L599 VanDerWaalsContact O-CB 3.31Å; G595-L599 WeakPolarHBondContact O-CB 3.14Å; G595-L599 PolarHBondContact O-N 3.12Å
596	K	81.5	Confident	71.3	Confident	17 Å²	17	59.2 Å²	59.2	7%	0.074	36%	0.36	C	S	.	.	H	α-helix	trans	-63.7	-42.1	173.1	-65.6	178	-175.1	175.1	0	111.5	F504 K509 N511 P512 L591 S592 D593 L599 Q600	F504-K596 HydrophobicContact CD1-CB 3.66Å; F504-K596 HydrophobicContact CD1-CD 3.93Å; F504-K596 HydrophobicContact CD1-CG 4.43Å; F504-K596 HydrophobicContact CE1-CB 3.88Å; F504-K596 HydrophobicContact CE1-CD 4.36Å; F504-K596 HydrophobicContact CG-CB 4.22Å; K509-K596 PolarHBondContact O-NZ 3.43Å; N511-K596 VanDerWaalsContact OD1-CE 3.27Å; N511-K596 WeakPolarHBondContact OD1-CE 3.43Å; P512-K596 HydrophobicContact CG-CB 4.47Å; P512-K596 WeakPolarHBondContact CG-O 3.24Å; L591-K596 HydrophobicContact CB-CG 4.45Å; L591-K596 HydrophobicContact CD2-CB 4.4Å; L591-K596 HydrophobicContact CD2-CG 3.77Å; L591-K596 HydrophobicContact CG-CG 4.49Å; S592-K596 PolarHBondContact O-N 2.93Å; D593-K596 PolarHBondContact O-N 2.82Å; D593-K596 IonicContact OD1-NZ 2.92Å; K596-L599 PolarHBondContact O-N 2.79Å; K596-Q600 WeakPolarHBondContact O-CB 3.41Å; K596-Q600 PolarHBondContact O-N 3.24Å
597	I	83.2	Confident	74.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-62.4	-47.6	177	-65.8	161.3	0	0	0	110.6	P501 F504 V565 V569 D593 D594 L599 Q600 L601	P501-I597 HydrophobicContact CB-CD1 4.37Å; F504-I597 HydrophobicContact CB-CD1 4.34Å; F504-I597 HydrophobicContact CB-CG1 3.88Å; F504-I597 HydrophobicContact CD2-CG1 3.76Å; F504-I597 HydrophobicContact CG-CG1 4.07Å; V565-I597 HydrophobicContact CG1-CG2 4.38Å; V569-I597 HydrophobicContact CG2-CD1 3.96Å; V569-I597 HydrophobicContact CG2-CG2 4.43Å; D593-I597 VanDerWaalsContact O-CG1 3.32Å; D593-I597 WeakPolarHBondContact O-CG1 3.33Å; D593-I597 PolarHBondContact O-N 2.91Å; D594-I597 PolarHBondContact O-N 3.01Å; I597-L599 PolarHBondContact O-N 2.62Å; I597-Q600 PolarHBondContact O-N 2.91Å; I597-L601 HydrophobicContact CG2-CD1 4.23Å; I597-L601 WeakPolarHBondContact O-CG 3.48Å; I597-L601 PolarHBondContact O-N 2.89Å
598	K	83	Confident	77	Confident	37 Å²	37	52.6 Å²	52.6	16%	0.161	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-44.8	177	-71.9	179.6	177.3	177.3	0	111.5	L566 D570 D594 G595 Q600 L601 Q602 M634 M637	L566-K598 HydrophobicContact CD2-CG 4.24Å; D570-K598 IonicContact OD1-NZ 3.25Å; D594-K598 PolarHBondContact O-N 2.88Å; G595-K598 PolarHBondContact O-N 3.08Å; K598-Q600 PolarHBondContact O-N 3.43Å; K598-L601 PolarHBondContact O-N 2.93Å; K598-Q602 WeakPolarHBondContact O-CG 3.48Å; K598-Q602 PolarHBondContact O-N 2.92Å; K598-M634 WeakPolarHBondContact O-CE 3.43Å; K598-M637 PolarHBondContact NZ-O 3.19Å
599	L	84.1	Confident	79.2	Confident	57 Å²	57	52.4 Å²	52.4	30%	0.298	27%	0.274	S	S	.	.	H	α-helix	trans	-62.8	-41.5	177.5	-177.2	61.2	0	0	0	112.3	P512 L591 G595 K596 I597 L601 Q602 L603	P512-L599 HydrophobicContact CG-CB 4.02Å; P512-L599 HydrophobicContact CG-CD2 3.93Å; P512-L599 HydrophobicContact CG-CG 3.96Å; L591-L599 HydrophobicContact CD2-CD2 4.13Å; G595-L599 VanDerWaalsContact O-CB 3.31Å; G595-L599 WeakPolarHBondContact O-CB 3.14Å; G595-L599 PolarHBondContact O-N 3.12Å; K596-L599 PolarHBondContact O-N 2.79Å; I597-L599 PolarHBondContact O-N 2.62Å; L599-L601 PolarHBondContact O-N 3.4Å; L599-Q602 PolarHBondContact O-N 3.29Å; L599-L603 WeakPolarHBondContact O-CG 3.42Å; L599-L603 PolarHBondContact O-N 3.41Å; L599-L603 VanDerWaalsContact O-N 3.11Å
600	Q	87.6	Confident	81.5	Confident	16 Å²	16	47.5 Å²	47.5	8%	0.075	25%	0.25	C	S	.	.	H	α-helix	trans	-62.4	-43.8	176.3	-175.7	64.2	73.7	0	0	111.9	L500 F504 P512 T514 S516 K596 I597 K598 Q602 L603 D604	L500-Q600 HydrophobicContact CD2-CG 4.17Å; F504-Q600 HydrophobicContact CE2-CB 3.96Å; F504-Q600 HydrophobicContact CE2-CG 4.09Å; F504-Q600 HydrophobicContact CZ-CB 4.05Å; F504-Q600 HydrophobicContact CZ-CG 4.25Å; P512-Q600 HydrophobicContact CB-CB 4.02Å; P512-Q600 HydrophobicContact CB-CG 4.49Å; P512-Q600 HydrophobicContact CG-CB 4.12Å; T514-Q600 PolarHBondContact O-NE2 2.84Å; S516-Q600 VanDerWaalsContact N-NE2 3.11Å; S516-Q600 VanDerWaalsContact OG-CG 3.29Å; S516-Q600 WeakPolarHBondContact OG-CG 3.44Å; S516-Q600 PolarHBondContact OG-NE2 3.18Å; K596-Q600 WeakPolarHBondContact O-CB 3.41Å; K596-Q600 PolarHBondContact O-N 3.24Å; I597-Q600 PolarHBondContact O-N 2.91Å; K598-Q600 PolarHBondContact O-N 3.43Å; Q600-Q602 VanDerWaalsContact C-N 3.3Å; Q600-Q602 PolarHBondContact O-N 3.48Å; Q600-L603 PolarHBondContact O-N 2.89Å; Q600-D604 PolarHBondContact NE2-OD1 3.47Å; Q600-D604 VanDerWaalsContact NE2-OD1 3.1Å; Q600-D604 PolarHBondContact O-N 3.42Å
601	L	88.3	Confident	83.4	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-36	176.5	-74.8	173	0	0	0	111.9	V497 L500 V562 L566 I597 K598 L599 D604 L605 M634	V497-L601 HydrophobicContact CG2-CD2 3.61Å; L500-L601 HydrophobicContact CD1-CD2 3.66Å; L500-L601 HydrophobicContact CD1-CG 4.02Å; V562-L601 HydrophobicContact CG1-CD1 4.22Å; V562-L601 HydrophobicContact CG1-CD2 4.42Å; V562-L601 HydrophobicContact CG2-CD2 4Å; L566-L601 HydrophobicContact CD2-CD1 3.91Å; L566-L601 HydrophobicContact CG-CD1 4.24Å; I597-L601 HydrophobicContact CG2-CD1 4.23Å; I597-L601 WeakPolarHBondContact O-CG 3.48Å; I597-L601 PolarHBondContact O-N 2.89Å; K598-L601 PolarHBondContact O-N 2.93Å; L599-L601 PolarHBondContact O-N 3.4Å; L601-D604 PolarHBondContact O-N 3Å; L601-L605 WeakPolarHBondContact O-CB 3.42Å; L601-L605 VanDerWaalsContact O-CG 3.32Å; L601-L605 WeakPolarHBondContact O-CG 3.4Å; L601-L605 PolarHBondContact O-N 3.4Å; L601-M634 HydrophobicContact CB-CE 3.28Å; L601-M634 HydrophobicContact CB-SD 3.92Å; L601-M634 HydrophobicContact CD1-CE 4.25Å; L601-M634 HydrophobicContact CG-CE 4.42Å
602	Q	86.3	Confident	84.9	Confident	74 Å²	74	38.8 Å²	38.8	35%	0.346	20%	0.2	S	C	.	.	H	α-helix	trans	-64.1	-43.4	174.7	-73.9	177.7	-27.2	0	0	111.6	K598 L599 Q600 D604 L605 F606 M634	K598-Q602 WeakPolarHBondContact O-CG 3.48Å; K598-Q602 PolarHBondContact O-N 2.92Å; L599-Q602 PolarHBondContact O-N 3.29Å; Q600-Q602 VanDerWaalsContact C-N 3.3Å; Q600-Q602 PolarHBondContact O-N 3.48Å; Q602-D604 VanDerWaalsContact C-N 3.31Å; Q602-D604 PolarHBondContact O-N 2.89Å; Q602-L605 PolarHBondContact O-N 2.71Å; Q602-F606 WeakPolarHBondContact O-CB 3.5Å; Q602-F606 PolarHBondContact O-N 2.84Å; Q602-M634 HydrophobicContact CB-CE 4.49Å; Q602-M634 HydrophobicContact CG-CE 3.62Å
603	L	88.2	Confident	85.8	Confident	44 Å²	44	40 Å²	40	23%	0.23	20%	0.202	C	C	.	.	H	α-helix	trans	-62.7	-39.3	175.2	-66.1	174.7	0	0	0	111.7	P512 L599 Q600 K607	P512-L603 HydrophobicContact CB-CD1 4.25Å; L599-L603 WeakPolarHBondContact O-CG 3.42Å; L599-L603 PolarHBondContact O-N 3.41Å; L599-L603 VanDerWaalsContact O-N 3.11Å; Q600-L603 PolarHBondContact O-N 2.89Å; L603-K607 WeakPolarHBondContact O-CB 3.24Å; L603-K607 PolarHBondContact O-N 3.46Å
604	D	91	Very high	86.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-48.1	177.5	-67.9	-3.9	0	0	0	111	P515 S516 Y518 M519 Q600 L601 Q602 F606 K607 V608	P515-D604 WeakPolarHBondContact CA-OD1 3.45Å; S516-D604 WeakPolarHBondContact CB-OD1 3.34Å; S516-D604 WeakPolarHBondContact CB-OD2 3.4Å; S516-D604 PolarHBondContact N-OD1 3.42Å; S516-D604 PolarHBondContact OG-OD1 3.32Å; S516-D604 VanDerWaalsContact OG-OD1 3.12Å; S516-D604 PolarHBondContact OG-OD2 2.97Å; Y518-D604 PolarHBondContact OH-OD2 3.24Å; M519-D604 HydrophobicContact CB-CB 4.35Å; M519-D604 HydrophobicContact CE-CB 4.03Å; M519-D604 HydrophobicContact CG-CB 4.02Å; Q600-D604 PolarHBondContact NE2-OD1 3.47Å; Q600-D604 VanDerWaalsContact NE2-OD1 3.1Å; Q600-D604 PolarHBondContact O-N 3.42Å; L601-D604 PolarHBondContact O-N 3Å; Q602-D604 VanDerWaalsContact C-N 3.31Å; Q602-D604 PolarHBondContact O-N 2.89Å; D604-F606 PolarHBondContact O-N 3.26Å; D604-K607 PolarHBondContact O-N 3Å; D604-V608 WeakPolarHBondContact O-CG2 3.39Å; D604-V608 PolarHBondContact O-N 3.12Å
605	L	89	Confident	87.3	Confident	15 Å²	15	40 Å²	40	8%	0.079	21%	0.207	C	C	.	.	H	α-helix	trans	-60.9	-43.1	176.7	-72.5	177.5	0	0	0	112.2	Y558 L601 Q602 K607 V608 K609 L627 L630 A631 M634	Y558-L605 HydrophobicContact CE1-CD2 4.14Å; L601-L605 WeakPolarHBondContact O-CB 3.42Å; L601-L605 VanDerWaalsContact O-CG 3.32Å; L601-L605 WeakPolarHBondContact O-CG 3.4Å; L601-L605 PolarHBondContact O-N 3.4Å; Q602-L605 PolarHBondContact O-N 2.71Å; L605-K607 VanDerWaalsContact C-N 3.29Å; L605-K607 PolarHBondContact O-N 3.49Å; L605-V608 PolarHBondContact O-N 2.95Å; L605-K609 WeakPolarHBondContact O-CB 3.31Å; L605-K609 PolarHBondContact O-N 2.95Å; L605-L627 HydrophobicContact CD2-CD2 3.55Å; L605-L630 HydrophobicContact CD1-CB 4.2Å; L605-L630 HydrophobicContact CD2-CB 4.35Å; L605-L630 HydrophobicContact CD2-CD1 4.04Å; L605-A631 HydrophobicContact CD1-CB 4.44Å; L605-M634 HydrophobicContact CD1-SD 3.43Å; L605-M634 WeakPolarHBondContact CD1-SD 3.3Å
606	F	88.5	Confident	87.8	Confident	143 Å²	143	41.5 Å²	41.5	63%	0.627	21%	0.213	S	C	*	.	H	α-helix	trans	-61.1	-41.1	176.5	-177.2	-95.5	0	0	0	111.4	Q602 D604 K609 T610	Q602-F606 WeakPolarHBondContact O-CB 3.5Å; Q602-F606 PolarHBondContact O-N 2.84Å; D604-F606 PolarHBondContact O-N 3.26Å; F606-K609 PolarHBondContact O-N 2.84Å; F606-T610 PolarHBondContact O-N 3.32Å; F606-T610 PolarHBondContact O-OG1 3.36Å
607	K	89.1	Confident	88.1	Confident	53 Å²	53	42.1 Å²	42.1	23%	0.23	22%	0.217	C	C	.	.	H	α-helix	trans	-66.3	-45.3	178.4	-178.9	59.2	-174.7	175.4	0	112.4	P515 M520 L603 D604 L605 K609 T610 V611	P515-K607 HydrophobicContact CB-CB 3.91Å; P515-K607 HydrophobicContact CB-CG 4.17Å; P515-K607 HydrophobicContact CG-CB 3.69Å; P515-K607 HydrophobicContact CG-CD 4.45Å; P515-K607 HydrophobicContact CG-CG 4.03Å; M520-K607 HydrophobicContact SD-CD 3.89Å; M520-K607 VanDerWaalsContact SD-CE 3.54Å; M520-K607 HydrophobicContact SD-CG 3.82Å; L603-K607 WeakPolarHBondContact O-CB 3.24Å; L603-K607 PolarHBondContact O-N 3.46Å; D604-K607 PolarHBondContact O-N 3Å; L605-K607 VanDerWaalsContact C-N 3.29Å; L605-K607 PolarHBondContact O-N 3.49Å; K607-K609 VanDerWaalsContact C-N 3.34Å; K607-T610 PolarHBondContact O-N 2.84Å; K607-V611 WeakPolarHBondContact O-CG2 3.17Å; K607-V611 PolarHBondContact O-N 3.39Å; K607-V611 VanDerWaalsContact O-N 3.15Å
608	V	91.2	Very high	88.2	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-59	-49.1	175.9	178.3	0	0	0	0	110	W494 M519 D604 L605 T610 V611 L612 L627	W494-V608 HydrophobicContact CH2-CG1 4.23Å; W494-V608 HydrophobicContact CH2-CG2 4.5Å; W494-V608 HydrophobicContact CZ2-CG2 4.15Å; M519-V608 HydrophobicContact CE-CG2 3.49Å; M519-V608 VanDerWaalsContact CE-CG2 3.49Å; M519-V608 HydrophobicContact CG-CG2 4.12Å; M519-V608 HydrophobicContact SD-CG2 3.1Å; M519-V608 WeakPolarHBondContact SD-CG2 3.35Å; D604-V608 WeakPolarHBondContact O-CG2 3.39Å; D604-V608 PolarHBondContact O-N 3.12Å; L605-V608 PolarHBondContact O-N 2.95Å; V608-T610 VanDerWaalsContact C-N 3.31Å; V608-T610 PolarHBondContact O-N 2.86Å; V608-V611 PolarHBondContact O-N 3.15Å; V608-L612 HydrophobicContact CG1-CD1 4.19Å; V608-L612 HydrophobicContact CG1-CG 4.12Å; V608-L612 WeakPolarHBondContact O-CG 3.42Å; V608-L612 PolarHBondContact O-N 3.46Å; V608-L627 HydrophobicContact CB-CD1 4.26Å; V608-L627 HydrophobicContact CG1-CD1 3.53Å; V608-L627 HydrophobicContact CG1-CD2 4.4Å
609	K	88.4	Confident	88.1	Confident	106 Å²	106	50.1 Å²	50.1	46%	0.461	26%	0.263	S	S	.	.	H	α-helix	trans	-54.9	-46.8	178.6	-175.3	177.6	179.1	178.3	0	111.9	L605 F606 K607 V611 L612 D613	L605-K609 WeakPolarHBondContact O-CB 3.31Å; L605-K609 PolarHBondContact O-N 2.95Å; F606-K609 PolarHBondContact O-N 2.84Å; K607-K609 VanDerWaalsContact C-N 3.34Å; K609-V611 PolarHBondContact O-N 2.62Å; K609-L612 PolarHBondContact O-N 2.69Å; K609-D613 PolarHBondContact O-N 2.96Å
610	T	90.1	Very high	88.1	Confident	60 Å²	60	52 Å²	52	37%	0.368	27%	0.274	S	S	.	.	H	α-helix	trans	-58.1	-37.1	177.3	-55	0	0	0	0	112.4	F606 K607 V608 S614	F606-T610 PolarHBondContact O-N 3.32Å; F606-T610 PolarHBondContact O-OG1 3.36Å; K607-T610 PolarHBondContact O-N 2.84Å; V608-T610 VanDerWaalsContact C-N 3.31Å; V608-T610 PolarHBondContact O-N 2.86Å; T610-S614 PolarHBondContact O-N 3.36Å
611	V	90.5	Very high	88.1	Confident	7 Å²	7	51.8 Å²	51.8	4%	0.042	27%	0.273	C	S	.	.	H	α-helix	trans	-77.2	-37.1	178.8	172.9	0	0	0	0	111.5	C523 V527 K607 V608 K609 D613 S614 L615	C523-V611 HydrophobicContact CB-CG2 3.91Å; V527-V611 HydrophobicContact CG2-CG1 3.98Å; K607-V611 WeakPolarHBondContact O-CG2 3.17Å; K607-V611 PolarHBondContact O-N 3.39Å; K607-V611 VanDerWaalsContact O-N 3.15Å; V608-V611 PolarHBondContact O-N 3.15Å; K609-V611 PolarHBondContact O-N 2.62Å; V611-D613 VanDerWaalsContact C-N 3.28Å; V611-D613 PolarHBondContact O-N 2.63Å; V611-S614 PolarHBondContact O-N 3.35Å; V611-S614 VanDerWaalsContact O-N 3.16Å; V611-S614 PolarHBondContact O-OG 3.38Å; V611-L615 HydrophobicContact CG1-CD1 4.09Å; V611-L615 VanDerWaalsContact O-CG 3.3Å; V611-L615 WeakPolarHBondContact O-CG 3.4Å; V611-L615 PolarHBondContact O-N 3.22Å
612	L	89.3	Confident	88.1	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-58.9	-43.6	171.6	-64.8	-177	0	0	0	111	L551 V608 K609 S614 L615 L617 A623 Y624 L627	L551-L612 HydrophobicContact CD1-CD2 3.5Å; L551-L612 VanDerWaalsContact CD1-CD2 3.5Å; L551-L612 HydrophobicContact CD2-CD2 3.67Å; L551-L612 HydrophobicContact CG-CD2 4.12Å; V608-L612 HydrophobicContact CG1-CD1 4.19Å; V608-L612 HydrophobicContact CG1-CG 4.12Å; V608-L612 WeakPolarHBondContact O-CG 3.42Å; V608-L612 PolarHBondContact O-N 3.46Å; K609-L612 PolarHBondContact O-N 2.69Å; L612-S614 PolarHBondContact O-N 3.12Å; L612-L615 PolarHBondContact O-N 2.81Å; L612-L617 HydrophobicContact CB-CD1 3.93Å; L612-L617 HydrophobicContact CD2-CD1 3.75Å; L612-L617 HydrophobicContact CG-CD1 4.37Å; L612-A623 HydrophobicContact CD1-CB 4.09Å; L612-Y624 HydrophobicContact CB-CE1 3.97Å; L612-Y624 HydrophobicContact CB-CE2 4.24Å; L612-Y624 HydrophobicContact CD1-CD1 4.37Å; L612-Y624 HydrophobicContact CD1-CE1 4.29Å; L612-Y624 PolarHBondContact O-OH 2.95Å; L612-L627 HydrophobicContact CD1-CD1 3.36Å
613	D	88.7	Confident	88.1	Confident	97 Å²	97	52.9 Å²	52.9	52%	0.519	28%	0.282	S	S	.	.	H	α-helix	trans	-63.2	-22.8	178.9	-65.1	-20.8	0	0	0	112.8	K609 V611 Y624	K609-D613 PolarHBondContact O-N 2.96Å; V611-D613 VanDerWaalsContact C-N 3.28Å; V611-D613 PolarHBondContact O-N 2.63Å; D613-Y624 VanDerWaalsContact CA-OH 3.32Å; D613-Y624 WeakPolarHBondContact CA-OH 3.47Å; D613-Y624 PolarHBondContact N-OH 3.47Å; D613-Y624 VanDerWaalsContact N-OH 3.15Å; D613-Y624 VanDerWaalsContact OD1-CE1 3.23Å; D613-Y624 WeakPolarHBondContact OD1-CE1 3.01Å; D613-Y624 PolarHBondContact OD1-OH 2.92Å
614	S	89.5	Confident	88	Confident	77 Å²	77	54.2 Å²	54.2	54%	0.538	28%	0.284	S	S	.	.	H	α-helix	trans	-91.3	-10	176.8	74.9	0	0	0	0	114.2	T610 V611 L612	T610-S614 PolarHBondContact O-N 3.36Å; V611-S614 PolarHBondContact O-N 3.35Å; V611-S614 VanDerWaalsContact O-N 3.16Å; V611-S614 PolarHBondContact O-OG 3.38Å; L612-S614 PolarHBondContact O-N 3.12Å
615	L	90.6	Very high	87.8	Confident	13 Å²	13	57.3 Å²	57.3	7%	0.068	31%	0.306	C	S	.	.	S	Bend	trans	-97.2	145.1	-177.9	-70.7	171.5	0	0	0	110.5	L526 H530 L547 L551 V611 L612 L617	L526-L615 HydrophobicContact CB-CD1 4.38Å; H530-L615 HydrophobicContact CB-CD2 3.62Å; L547-L615 HydrophobicContact CD1-CB 4.47Å; L547-L615 HydrophobicContact CD1-CD2 4.33Å; L551-L615 HydrophobicContact CD1-CD1 4.37Å; V611-L615 HydrophobicContact CG1-CD1 4.09Å; V611-L615 VanDerWaalsContact O-CG 3.3Å; V611-L615 WeakPolarHBondContact O-CG 3.4Å; V611-L615 PolarHBondContact O-N 3.22Å; L612-L615 PolarHBondContact O-N 2.81Å; L615-L617 VanDerWaalsContact C-N 3.34Å; L615-L617 HydrophobicContact CB-CD1 4.46Å; L615-L617 HydrophobicContact CB-CD2 4.38Å; L615-L617 HydrophobicContact CB-CG 4.09Å; L615-L617 PolarHBondContact O-N 3.27Å
616	P	86.8	Confident	87.7	Confident	52 Å²	52	57.1 Å²	57.1	34%	0.338	31%	0.305	S	S	.	.			trans	-73.4	91.9	173.4	30.8	-32.7	0	0	0	108.2	H530 R544 L547	H530-P616 WeakPolarHBondContact NE2-CD 3.13Å; H530-P616 WeakPolarHBondContact NE2-CG 3.27Å; R544-P616 HydrophobicContact CG-CB 4.29Å; R544-P616 WeakPolarHBondContact CG-O 3.31Å; L547-P616 HydrophobicContact CD1-CG 4.19Å
617	L	86.8	Confident	87.6	Confident	29 Å²	29	50.9 Å²	50.9	15%	0.152	28%	0.279	C	S	.	.			trans	-103.8	143	176.7	-61.5	173.7	0	0	0	110.2	L547 L551 L612 L615 C621 Y624	L547-L617 HydrophobicContact CB-CD2 3.8Å; L551-L617 HydrophobicContact CD1-CD1 3.92Å; L551-L617 HydrophobicContact CD1-CD2 3.41Å; L551-L617 VanDerWaalsContact CD1-CD2 3.41Å; L551-L617 HydrophobicContact CD1-CG 4.31Å; L612-L617 HydrophobicContact CB-CD1 3.93Å; L612-L617 HydrophobicContact CD2-CD1 3.75Å; L612-L617 HydrophobicContact CG-CD1 4.37Å; L615-L617 VanDerWaalsContact C-N 3.34Å; L615-L617 HydrophobicContact CB-CD1 4.46Å; L615-L617 HydrophobicContact CB-CD2 4.38Å; L615-L617 HydrophobicContact CB-CG 4.09Å; L615-L617 PolarHBondContact O-N 3.27Å; L617-C621 HydrophobicContact CB-CB 4.48Å; L617-Y624 HydrophobicContact CD1-CE2 3.91Å
618	P	85	Confident	87.3	Confident	27 Å²	27	51.1 Å²	51.1	18%	0.175	29%	0.287	C	S	.	.			trans	-75.6	158.2	172.4	34.3	-35.3	0	0	0	111	R548 D620 C621	R548-P618 HydrophobicContact CB-CG 3.87Å; R548-P618 HydrophobicContact CG-CG 3.86Å; P618-D620 WeakPolarHBondContact CB-OD1 3.34Å; P618-D620 WeakPolarHBondContact CG-OD1 3.34Å; P618-D620 PolarHBondContact O-N 3.2Å; P618-D620 VanDerWaalsContact O-N 3.15Å; P618-C621 WeakPolarHBondContact O-CB 3.37Å; P618-C621 PolarHBondContact O-N 3.04Å
619	D	80.8	Confident	87	Confident	179 Å²	179	57 Å²	57	96%	0.957	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-21	-175.5	-62	-38	0	0	0	113.4	C621	D619-C621 VanDerWaalsContact C-N 3.31Å; D619-C621 PolarHBondContact O-N 3.43Å
620	D	84.3	Confident	86.8	Confident	97 Å²	97	52 Å²	52	52%	0.519	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	14.1	-179.8	67.9	-27.4	0	0	0	113.8	R548 P618 D622	R548-D620 WeakPolarHBondContact CD-OD1 3.33Å; P618-D620 WeakPolarHBondContact CB-OD1 3.34Å; P618-D620 WeakPolarHBondContact CG-OD1 3.34Å; P618-D620 PolarHBondContact O-N 3.2Å; P618-D620 VanDerWaalsContact O-N 3.15Å; D620-D622 PolarHBondContact O-N 3.27Å
621	C	87	Confident	86.3	Confident	10 Å²	10	50.8 Å²	50.8	7%	0.068	28%	0.283	C	S	.	.			trans	-77.6	116	177.9	-172	0	0	0	0	112.2	R548 D552 L617 P618 D619 A623	R548-C621 HydrophobicContact CG-CB 4.11Å; D552-C621 PolarHBondContact OD1-SG 2.97Å; L617-C621 HydrophobicContact CB-CB 4.48Å; P618-C621 WeakPolarHBondContact O-CB 3.37Å; P618-C621 PolarHBondContact O-N 3.04Å; D619-C621 VanDerWaalsContact C-N 3.31Å; D619-C621 PolarHBondContact O-N 3.43Å; C621-A623 PolarHBondContact O-N 3.28Å; C621-A623 VanDerWaalsContact SG-CB 3.55Å
622	D	89.5	Confident	85.7	Confident	97 Å²	97	57 Å²	57	52%	0.519	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-10.6	-179.7	-78.7	-33.5	0	0	0	113.5	D552 D620 Y624 S625 T626	D552-D622 PolarHBondContact OD1-N 2.85Å; D620-D622 PolarHBondContact O-N 3.27Å; D622-Y624 VanDerWaalsContact C-N 3.26Å; D622-Y624 PolarHBondContact O-N 3.03Å; D622-S625 PolarHBondContact O-N 3.22Å; D622-S625 PolarHBondContact O-OG 2.89Å; D622-T626 VanDerWaalsContact O-CB 3.31Å; D622-T626 WeakPolarHBondContact O-CB 3.5Å; D622-T626 PolarHBondContact O-N 3.08Å; D622-T626 PolarHBondContact O-OG1 3.35Å
623	A	86.5	Confident	85	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-54.8	-42.2	176.4	0	0	0	0	0	112.4	L551 D552 T555 L612 C621 T626 L627	L551-A623 HydrophobicContact CB-CB 4.07Å; D552-A623 PolarHBondContact OD1-N 2.88Å; T555-A623 HydrophobicContact CG2-CB 3.96Å; T555-A623 WeakPolarHBondContact OG1-CA 3.38Å; L612-A623 HydrophobicContact CD1-CB 4.09Å; C621-A623 PolarHBondContact O-N 3.28Å; C621-A623 VanDerWaalsContact SG-CB 3.55Å; A623-T626 PolarHBondContact O-N 3.44Å; A623-L627 WeakPolarHBondContact O-CB 3.46Å; A623-L627 VanDerWaalsContact O-CG 3.26Å; A623-L627 WeakPolarHBondContact O-CG 3.35Å; A623-L627 PolarHBondContact O-N 3.41Å
624	Y	85.2	Confident	84.1	Confident	72 Å²	72	55.8 Å²	55.8	28%	0.282	30%	0.301	S	S	.	.	H	α-helix	trans	-67	-43.4	179.5	-81.3	-72.1	0	0	0	113	L612 D613 L617 D622 T626 S628	L612-Y624 HydrophobicContact CB-CE1 3.97Å; L612-Y624 HydrophobicContact CB-CE2 4.24Å; L612-Y624 HydrophobicContact CD1-CD1 4.37Å; L612-Y624 HydrophobicContact CD1-CE1 4.29Å; L612-Y624 PolarHBondContact O-OH 2.95Å; D613-Y624 VanDerWaalsContact CA-OH 3.32Å; D613-Y624 WeakPolarHBondContact CA-OH 3.47Å; D613-Y624 PolarHBondContact N-OH 3.47Å; D613-Y624 VanDerWaalsContact N-OH 3.15Å; D613-Y624 VanDerWaalsContact OD1-CE1 3.23Å; D613-Y624 WeakPolarHBondContact OD1-CE1 3.01Å; D613-Y624 PolarHBondContact OD1-OH 2.92Å; L617-Y624 HydrophobicContact CD1-CE2 3.91Å; D622-Y624 VanDerWaalsContact C-N 3.26Å; D622-Y624 PolarHBondContact O-N 3.03Å; Y624-T626 VanDerWaalsContact C-N 3.32Å; Y624-S628 VanDerWaalsContact O-CB 3.26Å; Y624-S628 WeakPolarHBondContact O-CB 3.35Å; Y624-S628 PolarHBondContact O-N 3.27Å; Y624-S628 PolarHBondContact O-OG 3.45Å
625	S	87.1	Confident	83	Confident	65 Å²	65	57.7 Å²	57.7	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-66.5	-39.9	179.4	68	0	0	0	0	110.4	D622 S628 R629	D622-S625 PolarHBondContact O-N 3.22Å; D622-S625 PolarHBondContact O-OG 2.89Å; S625-S628 PolarHBondContact O-N 3.3Å; S625-R629 WeakPolarHBondContact O-CB 3.39Å; S625-R629 PolarHBondContact O-N 3.31Å
626	T	87.4	Confident	81.5	Confident	12 Å²	12	62.7 Å²	62.7	7%	0.074	33%	0.328	C	S	.	.	H	α-helix	trans	-64	-48.4	177.7	-60.1	0	0	0	0	112.1	A559 D622 A623 Y624 R629 L630	A559-T626 HydrophobicContact CB-CG2 3.55Å; D622-T626 VanDerWaalsContact O-CB 3.31Å; D622-T626 WeakPolarHBondContact O-CB 3.5Å; D622-T626 PolarHBondContact O-N 3.08Å; D622-T626 PolarHBondContact O-OG1 3.35Å; A623-T626 PolarHBondContact O-N 3.44Å; Y624-T626 VanDerWaalsContact C-N 3.32Å; T626-R629 PolarHBondContact O-N 2.91Å; T626-L630 PolarHBondContact O-N 3.31Å; T626-L630 VanDerWaalsContact O-N 3.16Å
627	L	85	Confident	79.8	Confident	12 Å²	12	62 Å²	62	6%	0.063	32%	0.321	C	S	.	.	H	α-helix	trans	-69.1	-36.5	178.7	-66.7	170.9	0	0	0	112.5	T555 L605 V608 L612 A623 R629 L630 A631	T555-L627 HydrophobicContact CG2-CD1 4.39Å; T555-L627 HydrophobicContact CG2-CD2 4.47Å; T555-L627 HydrophobicContact CG2-CG 4.41Å; L605-L627 HydrophobicContact CD2-CD2 3.55Å; V608-L627 HydrophobicContact CB-CD1 4.26Å; V608-L627 HydrophobicContact CG1-CD1 3.53Å; V608-L627 HydrophobicContact CG1-CD2 4.4Å; L612-L627 HydrophobicContact CD1-CD1 3.36Å; A623-L627 WeakPolarHBondContact O-CB 3.46Å; A623-L627 VanDerWaalsContact O-CG 3.26Å; A623-L627 WeakPolarHBondContact O-CG 3.35Å; A623-L627 PolarHBondContact O-N 3.41Å; L627-R629 VanDerWaalsContact C-N 3.31Å; L627-R629 PolarHBondContact O-N 3.41Å; L627-L630 HydrophobicContact CD2-CD1 4.37Å; L627-L630 PolarHBondContact O-N 3Å; L627-A631 WeakPolarHBondContact O-CB 3.11Å; L627-A631 PolarHBondContact O-N 3.07Å
628	S	84.1	Confident	77.8	Confident	57 Å²	57	62.8 Å²	62.8	40%	0.399	33%	0.328	S	S	.	.	H	α-helix	trans	-66	-35.4	176.1	-60.1	0	0	0	0	111.8	Y624 S625 A631 K632	Y624-S628 VanDerWaalsContact O-CB 3.26Å; Y624-S628 WeakPolarHBondContact O-CB 3.35Å; Y624-S628 PolarHBondContact O-N 3.27Å; Y624-S628 PolarHBondContact O-OG 3.45Å; S625-S628 PolarHBondContact O-N 3.3Å; S628-A631 PolarHBondContact O-N 2.81Å; S628-K632 WeakPolarHBondContact O-CG 3.46Å; S628-K632 PolarHBondContact O-N 2.75Å; S628-K632 VanDerWaalsContact O-N 3.11Å
629	R	84.5	Confident	75.6	Confident	128 Å²	128	63.9 Å²	63.9	48%	0.483	34%	0.339	S	S	.	.	H	α-helix	trans	-62.7	-48.3	172.7	-176.3	178	67.3	-148	-3	111.1	S625 T626 L627 A631 K632 E633	S625-R629 WeakPolarHBondContact O-CB 3.39Å; S625-R629 PolarHBondContact O-N 3.31Å; T626-R629 PolarHBondContact O-N 2.91Å; L627-R629 VanDerWaalsContact C-N 3.31Å; L627-R629 PolarHBondContact O-N 3.41Å; R629-A631 PolarHBondContact O-N 3.31Å; R629-K632 PolarHBondContact O-N 2.75Å; R629-E633 WeakPolarHBondContact CG-OE1 3.49Å; R629-E633 WeakPolarHBondContact O-CG 3.45Å; R629-E633 PolarHBondContact O-N 3.01Å
630	L	83.5	Confident	73.4	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-60.2	-43.1	176	-70.3	172.8	0	0	0	112.5	A559 V562 L605 T626 L627 K632 E633 M634	A559-L630 HydrophobicContact CB-CD1 3.6Å; A559-L630 HydrophobicContact CB-CD2 3.94Å; A559-L630 HydrophobicContact CB-CG 3.93Å; V562-L630 HydrophobicContact CB-CD2 4.29Å; V562-L630 HydrophobicContact CG1-CD2 4.06Å; L605-L630 HydrophobicContact CD1-CB 4.2Å; L605-L630 HydrophobicContact CD2-CB 4.35Å; L605-L630 HydrophobicContact CD2-CD1 4.04Å; T626-L630 PolarHBondContact O-N 3.31Å; T626-L630 VanDerWaalsContact O-N 3.16Å; L627-L630 HydrophobicContact CD2-CD1 4.37Å; L627-L630 PolarHBondContact O-N 3Å; L630-K632 VanDerWaalsContact C-N 3.32Å; L630-K632 PolarHBondContact O-N 3.27Å; L630-E633 PolarHBondContact O-N 3.26Å; L630-M634 WeakPolarHBondContact O-CB 3.49Å; L630-M634 VanDerWaalsContact O-CG 3.3Å; L630-M634 WeakPolarHBondContact O-CG 3.47Å; L630-M634 PolarHBondContact O-N 3.29Å
631	A	81.2	Confident	71	Confident	34 Å²	34	61.4 Å²	61.4	28%	0.281	33%	0.329	S	S	.	.	H	α-helix	trans	-59.9	-42.9	178.3	0	0	0	0	0	111.5	L605 L627 S628 R629 M634 E635	L605-A631 HydrophobicContact CD1-CB 4.44Å; L627-A631 WeakPolarHBondContact O-CB 3.11Å; L627-A631 PolarHBondContact O-N 3.07Å; S628-A631 PolarHBondContact O-N 2.81Å; R629-A631 PolarHBondContact O-N 3.31Å; A631-M634 PolarHBondContact O-N 2.75Å; A631-E635 WeakPolarHBondContact O-CG 3.32Å; A631-E635 PolarHBondContact O-N 3.2Å
632	K	77.3	Confident	68.3	Low	137 Å²	137	69.8 Å²	69.8	60%	0.596	37%	0.365	S	S	*	.	H	α-helix	trans	-64.8	-42.8	174.8	-73.8	178.9	-179.8	-177.6	0	112.8	S628 R629 L630 M634 E635 N636	S628-K632 WeakPolarHBondContact O-CG 3.46Å; S628-K632 PolarHBondContact O-N 2.75Å; S628-K632 VanDerWaalsContact O-N 3.11Å; R629-K632 PolarHBondContact O-N 2.75Å; L630-K632 VanDerWaalsContact C-N 3.32Å; L630-K632 PolarHBondContact O-N 3.27Å; K632-M634 PolarHBondContact O-N 3.17Å; K632-E635 PolarHBondContact O-N 2.87Å; K632-N636 WeakPolarHBondContact O-CB 3.4Å; K632-N636 VanDerWaalsContact O-CG 3.23Å; K632-N636 PolarHBondContact O-N 3.4Å; K632-N636 PolarHBondContact O-ND2 3.49Å
633	E	73.8	Confident	65.4	Low	70 Å²	70	69 Å²	69	33%	0.327	36%	0.36	S	S	.	.	H	α-helix	trans	-57.6	-41.9	174.6	-73.6	169.7	-170	0	0	110.5	R629 L630 M637	R629-E633 WeakPolarHBondContact CG-OE1 3.49Å; R629-E633 WeakPolarHBondContact O-CG 3.45Å; R629-E633 PolarHBondContact O-N 3.01Å; L630-E633 PolarHBondContact O-N 3.26Å; E633-M637 VanDerWaalsContact O-CE 3.27Å; E633-M637 WeakPolarHBondContact O-CE 3.21Å; E633-M637 VanDerWaalsContact O-CG 3.31Å; E633-M637 WeakPolarHBondContact O-CG 3.47Å; E633-M637 PolarHBondContact O-N 2.84Å; E633-M637 VanDerWaalsContact O-N 3.17Å
634	M	70.5	Confident	62.7	Low	3 Å²	3	77.1 Å²	77.1	2%	0.015	40%	0.398	C	S	.	.	H	α-helix	trans	-69.3	-41.7	177	-70.7	-175.8	73	0	0	114.2	L566 K598 L601 Q602 L605 L630 A631 K632 M637 S638	L566-M634 HydrophobicContact CD1-CG 4.17Å; K598-M634 WeakPolarHBondContact O-CE 3.43Å; L601-M634 HydrophobicContact CB-CE 3.28Å; L601-M634 HydrophobicContact CB-SD 3.92Å; L601-M634 HydrophobicContact CD1-CE 4.25Å; L601-M634 HydrophobicContact CG-CE 4.42Å; Q602-M634 HydrophobicContact CB-CE 4.49Å; Q602-M634 HydrophobicContact CG-CE 3.62Å; L605-M634 HydrophobicContact CD1-SD 3.43Å; L605-M634 WeakPolarHBondContact CD1-SD 3.3Å; L630-M634 WeakPolarHBondContact O-CB 3.49Å; L630-M634 VanDerWaalsContact O-CG 3.3Å; L630-M634 WeakPolarHBondContact O-CG 3.47Å; L630-M634 PolarHBondContact O-N 3.29Å; A631-M634 PolarHBondContact O-N 2.75Å; K632-M634 PolarHBondContact O-N 3.17Å; M634-M637 HydrophobicContact CG-CE 4.43Å; M634-M637 PolarHBondContact O-N 3.18Å; M634-S638 PolarHBondContact O-N 3.05Å; M634-S638 PolarHBondContact O-OG 3.08Å
635	E	66	Low	60.2	Low	117 Å²	117	77.2 Å²	77.2	55%	0.547	41%	0.414	S	S	.	.	H	α-helix	trans	-60.1	-49	174.9	-78.6	174.6	-176.8	0	0	110.6	A631 K632 M637 S638 A639	A631-E635 WeakPolarHBondContact O-CG 3.32Å; A631-E635 PolarHBondContact O-N 3.2Å; K632-E635 PolarHBondContact O-N 2.87Å; E635-M637 PolarHBondContact O-N 3.49Å; E635-S638 PolarHBondContact O-N 2.85Å; E635-S638 PolarHBondContact O-OG 3.36Å; E635-A639 PolarHBondContact O-N 3.19Å; E635-A639 VanDerWaalsContact O-N 3.08Å
636	N	58.4	Low	57.7	Low	118 Å²	118	78.7 Å²	78.7	63%	0.631	42%	0.42	S	S	*	.	H	α-helix	trans	-57.6	-34.7	176.8	-71.5	-14.1	0	0	0	112.5	K632	K632-N636 WeakPolarHBondContact O-CB 3.4Å; K632-N636 VanDerWaalsContact O-CG 3.23Å; K632-N636 PolarHBondContact O-N 3.4Å; K632-N636 PolarHBondContact O-ND2 3.49Å
637	M	52.4	Low	55.5	Low	38 Å²	38	79.5 Å²	79.5	19%	0.187	43%	0.428	C	S	.	.	H	α-helix	trans	-85.4	-11.7	177.9	-70.9	-173.1	-70.1	0	0	114.9	L566 K598 E633 M634 E635	L566-M637 HydrophobicContact CB-CE 4.14Å; L566-M637 HydrophobicContact CD1-CE 3.54Å; L566-M637 HydrophobicContact CD2-CE 3.93Å; L566-M637 HydrophobicContact CG-CE 4.05Å; K598-M637 PolarHBondContact NZ-O 3.19Å; E633-M637 VanDerWaalsContact O-CE 3.27Å; E633-M637 WeakPolarHBondContact O-CE 3.21Å; E633-M637 VanDerWaalsContact O-CG 3.31Å; E633-M637 WeakPolarHBondContact O-CG 3.47Å; E633-M637 PolarHBondContact O-N 2.84Å; E633-M637 VanDerWaalsContact O-N 3.17Å; M634-M637 HydrophobicContact CG-CE 4.43Å; M634-M637 PolarHBondContact O-N 3.18Å; E635-M637 PolarHBondContact O-N 3.49Å
638	S	45.2	Very low	53.7	Low	45 Å²	45	80 Å²	80	32%	0.315	43%	0.432	S	S	.	.	H	α-helix	trans	-91	-29.7	174.5	68.2	0	0	0	0	112	M634 E635 E640 S641	M634-S638 PolarHBondContact O-N 3.05Å; M634-S638 PolarHBondContact O-OG 3.08Å; E635-S638 PolarHBondContact O-N 2.85Å; E635-S638 PolarHBondContact O-OG 3.36Å; S638-E640 PolarHBondContact O-N 3.32Å; S638-E640 VanDerWaalsContact O-N 3.17Å; S638-S641 PolarHBondContact O-N 3.47Å; S638-S641 PolarHBondContact O-OG 3.42Å
639	A	39	Very low	52.2	Low	49 Å²	49	79.2 Å²	79.2	41%	0.405	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-56.5	-27.2	172.2	0	0	0	0	0	112.5	E635 S641 F642 D643	E635-A639 PolarHBondContact O-N 3.19Å; E635-A639 VanDerWaalsContact O-N 3.08Å; A639-S641 PolarHBondContact O-N 3.24Å; A639-S641 VanDerWaalsContact O-N 3.16Å; A639-F642 CarbonylContact O-C 3.47Å; A639-F642 PolarHBondContact O-N 2.76Å; A639-D643 PolarHBondContact O-N 3.37Å
640	E	34.3	Very low	51	Low	133 Å²	133	73.8 Å²	73.8	62%	0.621	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-65.2	-15.4	175	-67.3	-168.3	156.7	0	0	114.7	S638	S638-E640 PolarHBondContact O-N 3.32Å; S638-E640 VanDerWaalsContact O-N 3.17Å
641	S	34.1	Very low	50.2	Low	91 Å²	91	76.1 Å²	76.1	64%	0.636	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-95.1	-9.7	177.2	62.1	0	0	0	0	115	S638 A639	S638-S641 PolarHBondContact O-N 3.47Å; S638-S641 PolarHBondContact O-OG 3.42Å; A639-S641 PolarHBondContact O-N 3.24Å; A639-S641 VanDerWaalsContact O-N 3.16Å
642	F	28.9	Very low	49.6	Very low	186 Å²	186	77.3 Å²	77.3	82%	0.816	42%	0.415	S	S	*	.	S	Bend	trans	-133.5	43.2	173.5	-77	-84.4	0	0	0	110	A639 E644	A639-F642 CarbonylContact O-C 3.47Å; A639-F642 PolarHBondContact O-N 2.76Å; F642-E644 PolarHBondContact O-N 3.4Å
643	D	30.4	Very low	49.3	Very low	81 Å²	81	71 Å²	71	43%	0.433	39%	0.387	S	S	.	.			trans	-77.2	85.8	168	-106.3	-3.4	0	0	0	107.3	A639 A645 R789	A639-D643 PolarHBondContact O-N 3.37Å; D643-A645 PolarHBondContact O-N 2.95Å; D643-R789 IonicContact OD2-CZ 3.71Å; D643-R789 IonicContact OD2-NH1 2.75Å; D643-R789 PolarHBondContact OD2-NH1 3.12Å; D643-R789 IonicContact OD2-NH2 3.12Å
644	E	28.1	Very low	49.3	Very low	170 Å²	170	74.3 Å²	74.3	79%	0.794	40%	0.397	S	S	*	.			trans	-42.1	124.6	149	-82.5	179.8	156	0	0	106.8	F642 V646	F642-E644 PolarHBondContact O-N 3.4Å; E644-V646 WeakPolarHBondContact O-CG2 3.48Å; E644-V646 PolarHBondContact O-N 3.48Å
645	A	32.5	Very low	49.4	Very low	75 Å²	75	74.2 Å²	74.2	62%	0.62	40%	0.396	S	S	*	.			trans	-66.3	84.2	-175.5	0	0	0	0	0	110.1	D643 A647	D643-A645 PolarHBondContact O-N 2.95Å; A645-A647 PolarHBondContact O-N 3.5Å
646	V	36	Very low	49.6	Very low	96 Å²	96	70.8 Å²	70.8	58%	0.582	38%	0.382	S	S	*	.			trans	-74.6	112.8	175.5	-176.6	0	0	0	0	107.6	E644 V648	E644-V646 WeakPolarHBondContact O-CG2 3.48Å; E644-V646 PolarHBondContact O-N 3.48Å; V646-V648 PolarHBondContact O-N 2.94Å
647	A	41.6	Very low	49.8	Very low	29 Å²	29	74 Å²	74	24%	0.24	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-60.3	122.1	170.8	0	0	0	0	0	109.2	A645 Y786	A645-A647 PolarHBondContact O-N 3.5Å; A647-Y786 HydrophobicContact CB-CD1 4.45Å
648	V	47.3	Very low	50.5	Low	22 Å²	22	73.7 Å²	73.7	13%	0.133	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	125.4	177.5	-175.4	0	0	0	0	108.5	V646 I650 P670 V672	V646-V648 PolarHBondContact O-N 2.94Å; V648-I650 PolarHBondContact O-N 3.37Å; V648-P670 HydrophobicContact CB-CG 4.46Å; V648-P670 HydrophobicContact CG1-CB 4.01Å; V648-P670 HydrophobicContact CG1-CG 3.97Å; V648-P670 WeakPolarHBondContact CG1-O 3.48Å; V648-P670 HydrophobicContact CG2-CB 4.33Å; V648-P670 HydrophobicContact CG2-CG 3.68Å; V648-V672 HydrophobicContact CG1-CG2 3.9Å
649	P	52.1	Low	51.6	Low	40 Å²	40	73.8 Å²	73.8	26%	0.26	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	132	177.9	25.8	-32.3	0	0	0	110.6	Y651 V672	P649-Y651 HydrophobicContact CB-CE2 3.99Å; P649-Y651 HydrophobicContact CG-CE2 4.09Å; P649-V672 PolarHBondContact O-N 2.89Å
650	I	58.2	Low	53.4	Low	14 Å²	14	75.7 Å²	75.7	7%	0.072	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	124.5	169.1	-54.3	174.5	0	0	0	107.9	V648 E652 V672 R674 L787	V648-I650 PolarHBondContact O-N 3.37Å; I650-E652 HydrophobicContact CG2-CG 4.5Å; I650-V672 CarbonylContact C-O 3.56Å; I650-V672 WeakPolarHBondContact CA-O 3.38Å; I650-V672 HydrophobicContact CG1-CB 4.25Å; I650-V672 HydrophobicContact CG1-CG1 4.45Å; I650-V672 HydrophobicContact CG2-CG1 4.44Å; I650-R674 HydrophobicContact CG2-CB 3.7Å; I650-L787 HydrophobicContact CD1-CB 3.8Å; I650-L787 HydrophobicContact CD1-CD1 3.71Å; I650-L787 HydrophobicContact CD1-CG 3.77Å; I650-L787 HydrophobicContact CG1-CB 4.43Å; I650-L787 HydrophobicContact CG1-CD1 4.43Å
651	Y	68.3	Low	55.3	Low	51 Å²	51	73.9 Å²	73.9	20%	0.2	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119	170.3	-58.8	-76.8	0	0	0	109.2	P649 V663 V665 V671 V672 L673 R674	P649-Y651 HydrophobicContact CB-CE2 3.99Å; P649-Y651 HydrophobicContact CG-CE2 4.09Å; Y651-V663 HydrophobicContact CD1-CB 4.33Å; Y651-V663 HydrophobicContact CD1-CG1 3.46Å; Y651-V663 VanDerWaalsContact CD1-CG1 3.46Å; Y651-V663 HydrophobicContact CD1-CG2 4.02Å; Y651-V663 HydrophobicContact CD2-CG1 4.42Å; Y651-V663 HydrophobicContact CE1-CB 4.37Å; Y651-V663 HydrophobicContact CE1-CG1 3.12Å; Y651-V663 HydrophobicContact CE1-CG2 4.39Å; Y651-V663 HydrophobicContact CE2-CG1 4.15Å; Y651-V663 HydrophobicContact CG-CG1 4.09Å; Y651-V663 VanDerWaalsContact CZ-CG1 3.49Å; Y651-V665 HydrophobicContact CD2-CG2 4.43Å; Y651-V665 HydrophobicContact CE2-CG1 4.12Å; Y651-V665 HydrophobicContact CE2-CG2 3.71Å; Y651-V671 HydrophobicContact CD2-CG1 3.8Å; Y651-V671 HydrophobicContact CE2-CG1 3.89Å; Y651-V672 PolarHBondContact N-O 3.25Å; Y651-L673 HydrophobicContact CD2-CD2 4.11Å; Y651-L673 HydrophobicContact CG-CD2 4.38Å; Y651-L673 WeakPolarHBondContact O-CA 3.46Å; Y651-R674 PolarHBondContact O-N 3.01Å
652	E	67.4	Low	57.2	Low	59 Å²	59	72.5 Å²	72.5	28%	0.276	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	123.5	179.4	-65.2	-172.6	158.2	0	0	110.3	I650 R674 V676	I650-E652 HydrophobicContact CG2-CG 4.5Å; E652-R674 CarbonylContact C-O 3.45Å; E652-R674 WeakPolarHBondContact CA-O 3.1Å; E652-V676 HydrophobicContact CB-CG2 4.08Å; E652-V676 HydrophobicContact CG-CG1 4.44Å
653	L	72.1	Confident	59.3	Low	5 Å²	5	64.9 Å²	64.9	3%	0.026	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	116.3	170.7	-71.2	80.5	0	0	0	108.1	L673 R674 C675 V676 W690 C731 A743 L745	L653-L673 HydrophobicContact CD1-CB 3.86Å; L653-L673 HydrophobicContact CD1-CD1 4.49Å; L653-L673 HydrophobicContact CD1-CD2 4.32Å; L653-L673 HydrophobicContact CD1-CG 4.46Å; L653-R674 PolarHBondContact N-O 3.43Å; L653-C675 WeakPolarHBondContact O-CA 3.48Å; L653-V676 PolarHBondContact O-N 3.04Å; L653-W690 HydrophobicContact CD1-CH2 4.04Å; L653-W690 HydrophobicContact CD1-CZ3 4.27Å; L653-W690 HydrophobicContact CD2-CH2 4.28Å; L653-W690 HydrophobicContact CD2-CZ3 3.9Å; L653-C731 HydrophobicContact CD2-CB 4.39Å; L653-A743 HydrophobicContact CB-CB 3.96Å; L653-A743 HydrophobicContact CD2-CB 4.31Å; L653-L745 HydrophobicContact CD1-CB 4.26Å; L653-L745 HydrophobicContact CD1-CD2 3.82Å; L653-L745 HydrophobicContact CD2-CB 3.63Å; L653-L745 HydrophobicContact CG-CB 3.88Å; L653-L745 HydrophobicContact CG-CD2 4.31Å
654	R	73.3	Confident	61.2	Low	138 Å²	138	64.9 Å²	64.9	52%	0.521	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	121.2	173.1	-72	176.9	-173.7	169	3.9	110.3	D656 V676 A743	R654-D656 PolarHBondContact O-N 2.97Å; R654-V676 CarbonylContact C-O 3.52Å; R654-V676 WeakPolarHBondContact CA-O 3.47Å; R654-V676 HydrophobicContact CG-CG2 3.75Å; R654-A743 WeakPolarHBondContact O-CB 3.38Å
655	L	71.2	Confident	63.2	Low	2 Å²	2	56.8 Å²	56.8	1%	0.01	31%	0.311	C	S	.	.			trans	-71.4	112.4	171.4	-85	170.6	0	0	0	110.6	C675 V676 I683 C731 A733 M741 A743	L655-C675 WeakPolarHBondContact CD1-SG 3.39Å; L655-C675 WeakPolarHBondContact CG-SG 3.29Å; L655-V676 PolarHBondContact N-O 3.1Å; L655-I683 HydrophobicContact CB-CD1 3.71Å; L655-I683 HydrophobicContact CD1-CD1 3.31Å; L655-I683 HydrophobicContact CG-CD1 4Å; L655-C731 WeakPolarHBondContact CD2-O 3.48Å; L655-A733 HydrophobicContact CD1-CB 3.41Å; L655-A733 VanDerWaalsContact CD1-CB 3.41Å; L655-A733 HydrophobicContact CD2-CB 4.39Å; L655-M741 HydrophobicContact CB-CB 4.12Å; L655-M741 HydrophobicContact CB-SD 4.38Å; L655-M741 HydrophobicContact CD2-CB 3.9Å; L655-M741 HydrophobicContact CG-CB 4.48Å; L655-A743 HydrophobicContact CD2-CB 4.12Å; L655-A743 HydrophobicContact CG-CB 4.48Å
656	D	71.6	Confident	64.7	Low	45 Å²	45	55 Å²	55	24%	0.241	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-134.4	-161.5	173.5	68.2	9.2	0	0	0	110.8	R654 G658 S659 L678 K742	R654-D656 PolarHBondContact O-N 2.97Å; D656-G658 PolarHBondContact O-N 2.95Å; D656-G658 WeakPolarHBondContact OD1-CA 3.44Å; D656-G658 PolarHBondContact OD1-N 3.24Å; D656-S659 VanDerWaalsContact CG-OG 3.22Å; D656-S659 PolarHBondContact OD1-N 2.7Å; D656-S659 PolarHBondContact OD1-OG 2.97Å; D656-S659 WeakPolarHBondContact OD2-CB 3.27Å; D656-S659 PolarHBondContact OD2-OG 3.25Å; D656-L678 HydrophobicContact CB-CD2 4.44Å; D656-K742 PolarHBondContact O-N 3.44Å; D656-K742 VanDerWaalsContact O-N 3.1Å
657	E	62.3	Low	66.1	Low	185 Å²	185	53.6 Å²	53.6	86%	0.864	28%	0.284	S	S	*	.	S	Bend	trans	-76.3	4.1	179.1	-66.3	-169.7	162.1	0	0	114.4
658	G	66.7	Low	67	Low	32 Å²	32	54.5 Å²	54.5	33%	0.33	30%	0.297	S	S	.	.	S	Bend	trans	132.3	34	169.1	0	0	0	0	0	116.9	D656 K742	D656-G658 PolarHBondContact O-N 2.95Å; D656-G658 WeakPolarHBondContact OD1-CA 3.44Å; D656-G658 PolarHBondContact OD1-N 3.24Å; G658-K742 WeakPolarHBondContact CA-O 3.22Å; G658-K742 PolarHBondContact N-O 3.14Å
659	S	68.7	Low	67.6	Low	47 Å²	47	54.6 Å²	54.6	33%	0.329	30%	0.303	S	S	.	.			trans	-64.2	149.8	171.9	66.1	0	0	0	0	111.6	D656 K744	D656-S659 VanDerWaalsContact CG-OG 3.22Å; D656-S659 PolarHBondContact OD1-N 2.7Å; D656-S659 PolarHBondContact OD1-OG 2.97Å; D656-S659 WeakPolarHBondContact OD2-CB 3.27Å; D656-S659 PolarHBondContact OD2-OG 3.25Å; S659-K744 PolarHBondContact O-N 3.23Å; S659-K744 VanDerWaalsContact O-N 3.1Å
660	Q	76.7	Confident	67.9	Low	89 Å²	89	55.2 Å²	55.2	42%	0.416	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	113	176.7	-176.1	-176.6	-30.1	0	0	109.4	K744	Q660-K744 CarbonylContact C-O 3.59Å; Q660-K744 VanDerWaalsContact CA-O 3.26Å; Q660-K744 WeakPolarHBondContact CA-O 3.31Å; Q660-K744 HydrophobicContact CB-CB 4.04Å; Q660-K744 HydrophobicContact CG-CB 3.93Å
661	E	72.9	Confident	68.3	Low	94 Å²	94	54.7 Å²	54.7	44%	0.439	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	155.8	171.6	-67.2	-170.7	171.5	0	0	110.4	K744 L745 R746	E661-K744 PolarHBondContact N-O 3.16Å; E661-L745 HydrophobicContact CB-CD1 3.78Å; E661-L745 CarbonylContact O-C 3.59Å; E661-L745 WeakPolarHBondContact O-CA 3.37Å; E661-R746 PolarHBondContact O-N 3.36Å
662	T	75.5	Confident	68.4	Low	62 Å²	62	52.8 Å²	52.8	38%	0.38	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	129.2	175.7	-56.7	0	0	0	0	108.9	R746 R748	T662-R746 VanDerWaalsContact CA-O 3.32Å; T662-R746 WeakPolarHBondContact CA-O 3.27Å; T662-R746 HydrophobicContact CG2-CB 4.21Å; T662-R746 HydrophobicContact CG2-CG 4.26Å; T662-R748 HydrophobicContact CG2-CG 4.13Å; T662-R748 VanDerWaalsContact CG2-CZ 3.43Å; T662-R748 VanDerWaalsContact CG2-NE 3.34Å
663	V	72	Confident	68.7	Low	26 Å²	26	50 Å²	50	16%	0.158	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	136.8	-177.6	169.5	0	0	0	0	109	Y651 V665 L745 R746 V747 R748	Y651-V663 HydrophobicContact CD1-CB 4.33Å; Y651-V663 HydrophobicContact CD1-CG1 3.46Å; Y651-V663 VanDerWaalsContact CD1-CG1 3.46Å; Y651-V663 HydrophobicContact CD1-CG2 4.02Å; Y651-V663 HydrophobicContact CD2-CG1 4.42Å; Y651-V663 HydrophobicContact CE1-CB 4.37Å; Y651-V663 HydrophobicContact CE1-CG1 3.12Å; Y651-V663 HydrophobicContact CE1-CG2 4.39Å; Y651-V663 HydrophobicContact CE2-CG1 4.15Å; Y651-V663 HydrophobicContact CG-CG1 4.09Å; Y651-V663 VanDerWaalsContact CZ-CG1 3.49Å; V663-V665 HydrophobicContact CG1-CG2 3.63Å; V663-L745 HydrophobicContact CB-CD1 4.26Å; V663-L745 HydrophobicContact CG2-CD1 3.69Å; V663-R746 PolarHBondContact N-O 2.86Å; V663-V747 WeakPolarHBondContact O-CA 3.49Å; V663-R748 PolarHBondContact O-N 2.88Å
664	D	70.4	Confident	68.9	Low	81 Å²	81	51.9 Å²	51.9	43%	0.433	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	120.6	173.1	-60.6	-56.1	0	0	0	108.9	R748	D664-R748 CarbonylContact C-O 3.55Å; D664-R748 WeakPolarHBondContact CA-O 2.87Å; D664-R748 WeakPolarHBondContact OD1-CB 3.49Å; D664-R748 IonicContact OD1-CZ 2.66Å; D664-R748 IonicContact OD1-NE 2.85Å; D664-R748 PolarHBondContact OD1-NE 3.07Å; D664-R748 IonicContact OD1-NH2 2.67Å; D664-R748 PolarHBondContact OD1-NH2 2.96Å; D664-R748 VanDerWaalsContact OD1-NH2 3.17Å; D664-R748 IonicContact OD2-CZ 2.63Å; D664-R748 IonicContact OD2-NE 3.87Å; D664-R748 IonicContact OD2-NH2 3.27Å; D664-R748 PolarHBondContact OD2-NH2 2.92Å
665	V	70.3	Confident	68.8	Low	1 Å²	1	45.3 Å²	45.3	1%	0.006	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	131.7	-174	-168.8	0	0	0	0	109.6	Y651 V663 V667 V671 L721 V747 R748 G750	Y651-V665 HydrophobicContact CD2-CG2 4.43Å; Y651-V665 HydrophobicContact CE2-CG1 4.12Å; Y651-V665 HydrophobicContact CE2-CG2 3.71Å; V663-V665 HydrophobicContact CG1-CG2 3.63Å; V665-V667 PolarHBondContact O-N 3.01Å; V665-V671 HydrophobicContact CG1-CB 4.4Å; V665-V671 HydrophobicContact CG1-CG1 4.17Å; V665-V671 HydrophobicContact CG1-CG2 3.34Å; V665-L721 HydrophobicContact CB-CD2 3.94Å; V665-L721 HydrophobicContact CG1-CD2 3.88Å; V665-V747 HydrophobicContact CB-CG1 4.13Å; V665-V747 HydrophobicContact CG2-CG1 3.8Å; V665-R748 PolarHBondContact N-O 3.25Å; V665-G750 PolarHBondContact O-N 3.11Å
666	P	64.8	Low	68.8	Low	37 Å²	37	45.2 Å²	45.2	24%	0.24	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	130.6	179.7	23.6	-31.9	0	0	0	111.7
667	V	64.2	Low	68.6	Low	66 Å²	66	45.2 Å²	45.2	40%	0.4	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	134.2	177.1	-179.3	0	0	0	0	109.4	V665 L721 E723 A749	V665-V667 PolarHBondContact O-N 3.01Å; V667-L721 CarbonylContact C-O 3.38Å; V667-L721 WeakPolarHBondContact CA-O 3.28Å; V667-L721 WeakPolarHBondContact CG1-O 3.46Å; V667-E723 HydrophobicContact CG1-CG 4.47Å; V667-A749 HydrophobicContact CG2-CB 3.49Å; V667-A749 VanDerWaalsContact CG2-CB 3.49Å
668	G	60.2	Low	68.8	Low	49 Å²	49	43 Å²	43	51%	0.505	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.6	-18.5	179.4	0	0	0	0	0	114.9	L721	G668-L721 PolarHBondContact N-O 3.17Å
669	G	59.9	Low	68.8	Low	24 Å²	24	46.1 Å²	46.1	25%	0.247	28%	0.276	C	S	.	.	S	Bend	trans	-93.5	164.8	178.7	0	0	0	0	0	114.2	L721	G669-L721 WeakPolarHBondContact O-CB 3.29Å; G669-L721 PolarHBondContact O-N 2.91Å; G669-L721 VanDerWaalsContact O-N 3.08Å
670	P	59	Low	68.5	Low	52 Å²	52	45.3 Å²	45.3	34%	0.338	28%	0.275	S	S	.	.			trans	-73.5	150.5	169.7	30.4	-34.6	0	0	0	111.8	V648 I718 Y719	V648-P670 HydrophobicContact CB-CG 4.46Å; V648-P670 HydrophobicContact CG1-CB 4.01Å; V648-P670 HydrophobicContact CG1-CG 3.97Å; V648-P670 WeakPolarHBondContact CG1-O 3.48Å; V648-P670 HydrophobicContact CG2-CB 4.33Å; V648-P670 HydrophobicContact CG2-CG 3.68Å; P670-I718 CarbonylContact C-O 3.59Å; P670-I718 WeakPolarHBondContact CA-O 3.28Å; P670-Y719 WeakPolarHBondContact CA-O 3.44Å
671	V	67.2	Low	67.9	Low	3 Å²	3	44.4 Å²	44.4	2%	0.018	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	135.6	-178.8	-173.9	0	0	0	0	109.5	Y651 V665 L673 I718 L721	Y651-V671 HydrophobicContact CD2-CG1 3.8Å; Y651-V671 HydrophobicContact CE2-CG1 3.89Å; V665-V671 HydrophobicContact CG1-CB 4.4Å; V665-V671 HydrophobicContact CG1-CG1 4.17Å; V665-V671 HydrophobicContact CG1-CG2 3.34Å; V671-L673 HydrophobicContact CG1-CD2 4.1Å; V671-I718 PolarHBondContact N-O 3.47Å; V671-I718 PolarHBondContact O-N 2.78Å; V671-L721 HydrophobicContact CG2-CB 3.96Å; V671-L721 HydrophobicContact CG2-CD1 4.19Å; V671-L721 HydrophobicContact CG2-CD2 4.17Å; V671-L721 HydrophobicContact CG2-CG 4.33Å
672	V	69.3	Low	67.4	Low	12 Å²	12	42.9 Å²	42.9	7%	0.073	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.6	174.3	-175.5	0	0	0	0	109.7	V648 P649 I650 Y651 N715 L716 K717	V648-V672 HydrophobicContact CG1-CG2 3.9Å; P649-V672 PolarHBondContact O-N 2.89Å; I650-V672 CarbonylContact C-O 3.56Å; I650-V672 WeakPolarHBondContact CA-O 3.38Å; I650-V672 HydrophobicContact CG1-CB 4.25Å; I650-V672 HydrophobicContact CG1-CG1 4.45Å; I650-V672 HydrophobicContact CG2-CG1 4.44Å; Y651-V672 PolarHBondContact N-O 3.25Å; V672-N715 HydrophobicContact CG1-CB 4.21Å; V672-L716 WeakPolarHBondContact CA-O 3.35Å; V672-K717 HydrophobicContact CG1-CG 4.35Å; V672-K717 HydrophobicContact CG2-CG 4.16Å
673	L	74.8	Confident	66.7	Low	0 Å²	0	41.1 Å²	41.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	126.9	170	-52.3	-174.4	0	0	0	109	Y651 L653 V671 W690 N715 L716 Y729 L745	Y651-L673 HydrophobicContact CD2-CD2 4.11Å; Y651-L673 HydrophobicContact CG-CD2 4.38Å; Y651-L673 WeakPolarHBondContact O-CA 3.46Å; L653-L673 HydrophobicContact CD1-CB 3.86Å; L653-L673 HydrophobicContact CD1-CD1 4.49Å; L653-L673 HydrophobicContact CD1-CD2 4.32Å; L653-L673 HydrophobicContact CD1-CG 4.46Å; V671-L673 HydrophobicContact CG1-CD2 4.1Å; L673-W690 HydrophobicContact CB-CH2 3.59Å; L673-W690 HydrophobicContact CB-CZ2 4.35Å; L673-W690 HydrophobicContact CB-CZ3 3.9Å; L673-W690 HydrophobicContact CD1-CZ3 4.07Å; L673-N715 WeakPolarHBondContact O-CA 3.44Å; L673-L716 HydrophobicContact CB-CB 4.24Å; L673-L716 HydrophobicContact CD1-CD2 4.08Å; L673-L716 PolarHBondContact N-O 3.11Å; L673-L716 PolarHBondContact O-N 3.47Å; L673-Y729 HydrophobicContact CD1-CD1 3.9Å; L673-Y729 HydrophobicContact CD1-CD2 4.14Å; L673-Y729 HydrophobicContact CD1-CG 3.65Å; L673-L745 HydrophobicContact CD1-CD2 4.23Å; L673-L745 HydrophobicContact CD2-CD2 3.52Å; L673-L745 HydrophobicContact CG-CD2 4.5Å
674	R	75.3	Confident	66.2	Low	45 Å²	45	44.3 Å²	44.3	17%	0.17	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.3	178.9	177.1	172.5	-66.4	163.1	0.9	110.2	I650 Y651 E652 L653 V676 N715	I650-R674 HydrophobicContact CG2-CB 3.7Å; Y651-R674 PolarHBondContact O-N 3.01Å; E652-R674 CarbonylContact C-O 3.45Å; E652-R674 WeakPolarHBondContact CA-O 3.1Å; L653-R674 PolarHBondContact N-O 3.43Å; R674-V676 HydrophobicContact CG-CG1 4.14Å; R674-N715 WeakPolarHBondContact CB-OD1 3.43Å; R674-N715 WeakPolarHBondContact CG-OD1 3.28Å; R674-N715 PolarHBondContact NE-OD1 3.3Å
675	C	72.3	Confident	65.8	Low	0 Å²	0	42.1 Å²	42.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	127.5	175.4	-163.9	0	0	0	0	111.5	L653 L655 I683 L688 W690 C731	L653-C675 WeakPolarHBondContact O-CA 3.48Å; L655-C675 WeakPolarHBondContact CD1-SG 3.39Å; L655-C675 WeakPolarHBondContact CG-SG 3.29Å; C675-I683 PolarHBondContact O-N 3.25Å; C675-L688 HydrophobicContact CB-CD1 3.86Å; C675-W690 HydrophobicContact CB-CZ2 4.31Å; C675-C731 PolarHBondContact SG-SG 3.39Å
676	V	70.3	Confident	65.5	Low	0 Å²	0	48.4 Å²	48.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	158.9	-179.7	-64.2	0	0	0	0	111.5	E652 L653 R654 L655 R674 T681	E652-V676 HydrophobicContact CB-CG2 4.08Å; E652-V676 HydrophobicContact CG-CG1 4.44Å; L653-V676 PolarHBondContact O-N 3.04Å; R654-V676 CarbonylContact C-O 3.52Å; R654-V676 WeakPolarHBondContact CA-O 3.47Å; R654-V676 HydrophobicContact CG-CG2 3.75Å; L655-V676 PolarHBondContact N-O 3.1Å; R674-V676 HydrophobicContact CG-CG1 4.14Å; V676-T681 CarbonylContact C-O 3.47Å; V676-T681 VanDerWaalsContact CA-O 3.28Å; V676-T681 WeakPolarHBondContact CA-O 3.47Å
677	D	68.1	Low	65.6	Low	44 Å²	44	51.7 Å²	51.7	24%	0.235	31%	0.306	C	S	.	.			trans	-82.5	-176.6	173.7	64.8	26.3	0	0	0	112.7	S679 G680 T681 I683	D677-S679 VanDerWaalsContact CG-OG 3.25Å; D677-S679 PolarHBondContact O-N 3.5Å; D677-S679 VanDerWaalsContact OD1-CA 3.31Å; D677-S679 WeakPolarHBondContact OD1-CA 3.39Å; D677-S679 WeakPolarHBondContact OD1-CB 3.43Å; D677-S679 PolarHBondContact OD1-N 3.12Å; D677-S679 PolarHBondContact OD1-OG 2.96Å; D677-S679 PolarHBondContact OD2-OG 3.22Å; D677-G680 PolarHBondContact O-N 2.72Å; D677-G680 PolarHBondContact OD1-N 2.97Å; D677-G680 VanDerWaalsContact OD1-N 3.08Å; D677-T681 PolarHBondContact N-O 2.95Å; D677-T681 PolarHBondContact OD1-N 3.1Å; D677-T681 PolarHBondContact OD1-OG1 3.2Å; D677-T681 WeakPolarHBondContact OD2-CB 3.5Å; D677-T681 PolarHBondContact OD2-OG1 2.83Å; D677-I683 HydrophobicContact CB-CD1 3.72Å; D677-I683 HydrophobicContact CB-CG1 3.7Å
678	L	66.8	Low	66	Low	139 Å²	139	49.4 Å²	49.4	73%	0.728	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-22.1	177.6	-71.1	169.1	0	0	0	113.9	D656	D656-L678 HydrophobicContact CB-CD2 4.44Å
679	S	66.2	Low	66.9	Low	98 Å²	98	50.7 Å²	50.7	69%	0.685	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-0.8	174.4	33.5	0	0	0	0	113.5	D677 T681	D677-S679 VanDerWaalsContact CG-OG 3.25Å; D677-S679 PolarHBondContact O-N 3.5Å; D677-S679 VanDerWaalsContact OD1-CA 3.31Å; D677-S679 WeakPolarHBondContact OD1-CA 3.39Å; D677-S679 WeakPolarHBondContact OD1-CB 3.43Å; D677-S679 PolarHBondContact OD1-N 3.12Å; D677-S679 PolarHBondContact OD1-OG 2.96Å; D677-S679 PolarHBondContact OD2-OG 3.22Å; S679-T681 PolarHBondContact OG-OG1 3.48Å
680	G	61.6	Low	68.1	Low	29 Å²	29	49.8 Å²	49.8	30%	0.299	27%	0.273	S	S	.	.	S	Bend	trans	76.9	10.5	-173.9	0	0	0	0	0	113.3	D677	D677-G680 PolarHBondContact O-N 2.72Å; D677-G680 PolarHBondContact OD1-N 2.97Å; D677-G680 VanDerWaalsContact OD1-N 3.08Å
681	T	64.7	Low	69.2	Low	71 Å²	71	48.6 Å²	48.6	44%	0.436	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-80.9	135.7	174.5	11.1	0	0	0	0	110.2	V676 D677 S679 I683	V676-T681 CarbonylContact C-O 3.47Å; V676-T681 VanDerWaalsContact CA-O 3.28Å; V676-T681 WeakPolarHBondContact CA-O 3.47Å; D677-T681 PolarHBondContact N-O 2.95Å; D677-T681 PolarHBondContact OD1-N 3.1Å; D677-T681 PolarHBondContact OD1-OG1 3.2Å; D677-T681 WeakPolarHBondContact OD2-CB 3.5Å; D677-T681 PolarHBondContact OD2-OG1 2.83Å; S679-T681 PolarHBondContact OG-OG1 3.48Å; T681-I683 PolarHBondContact O-N 3.28Å
682	P	62.9	Low	69.9	Low	62 Å²	62	50.2 Å²	50.2	40%	0.403	27%	0.269	S	S	.	.	B	Isolated β-bridge	trans	-58.5	131.5	174.7	-23.2	33	0	0	0	111.3	D684 V713	P682-D684 PolarHBondContact O-N 3.32Å; P682-V713 HydrophobicContact CB-CB 4.22Å; P682-V713 HydrophobicContact CB-CG1 3.66Å; P682-V713 HydrophobicContact CB-CG2 3.46Å; P682-V713 VanDerWaalsContact CB-CG2 3.46Å
683	I	61	Low	70.5	Confident	25 Å²	25	55.6 Å²	55.6	13%	0.128	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-81.4	118.8	-177.9	-72.3	168.8	0	0	0	109.8	L655 C675 D677 T681 N685	L655-I683 HydrophobicContact CB-CD1 3.71Å; L655-I683 HydrophobicContact CD1-CD1 3.31Å; L655-I683 HydrophobicContact CG-CD1 4Å; C675-I683 PolarHBondContact O-N 3.25Å; D677-I683 HydrophobicContact CB-CD1 3.72Å; D677-I683 HydrophobicContact CB-CG1 3.7Å; T681-I683 PolarHBondContact O-N 3.28Å; I683-N685 HydrophobicContact CG2-CB 3.59Å
684	D	61.5	Low	70.7	Confident	93 Å²	93	58 Å²	58	50%	0.497	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-87.3	99	166.4	-169.2	-30.9	0	0	0	108.4	P682 K711 K712	P682-D684 PolarHBondContact O-N 3.32Å; D684-K711 WeakPolarHBondContact OD2-CA 3.29Å; D684-K712 WeakPolarHBondContact CA-O 3.35Å; D684-K712 WeakPolarHBondContact OD1-CB 3.47Å; D684-K712 WeakPolarHBondContact OD1-CG 3.35Å; D684-K712 PolarHBondContact OD1-N 3.37Å; D684-K712 PolarHBondContact OD2-N 2.91Å
685	N	62	Low	71	Confident	35 Å²	35	62.6 Å²	62.6	19%	0.187	34%	0.342	C	S	.	.			trans	-146.4	120.6	-179.3	-167	-24	0	0	0	111.1	I683 F687 L688 K712 K734	I683-N685 HydrophobicContact CG2-CB 3.59Å; N685-F687 PolarHBondContact O-N 3.33Å; N685-F687 PolarHBondContact OD1-N 3.05Å; N685-L688 WeakPolarHBondContact O-CB 3.06Å; N685-L688 PolarHBondContact O-N 3.5Å; N685-K712 PolarHBondContact N-O 2.98Å; N685-K734 PolarHBondContact ND2-O 3.03Å
686	E	63.7	Low	71.3	Confident	133 Å²	133	71.4 Å²	71.4	62%	0.621	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.4	175.9	-68.2	-174.3	156.5	0	0	113.5	K712	E686-K712 HydrophobicContact CG-CD 3.75Å; E686-K712 IonicContact OE1-NZ 3.18Å; E686-K712 PolarHBondContact OE1-NZ 2.8Å
687	F	66.3	Low	71.5	Confident	105 Å²	105	72.5 Å²	72.5	46%	0.461	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	31.4	-177.2	-58.5	-74.6	0	0	0	113	N685 F689 K734	N685-F687 PolarHBondContact O-N 3.33Å; N685-F687 PolarHBondContact OD1-N 3.05Å; F687-F689 HydrophobicContact CB-CE2 4.37Å; F687-F689 WeakPolarHBondContact O-CD2 3.35Å; F687-F689 WeakPolarHBondContact O-CE2 3.49Å; F687-K734 HydrophobicContact CB-CB 3.88Å; F687-K734 HydrophobicContact CG-CB 4.45Å
688	L	73.3	Confident	71.5	Confident	18 Å²	18	72.2 Å²	72.2	9%	0.094	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.4	175.6	-166.8	160.8	0	0	0	110.7	C675 N685 S714 C731 I732	C675-L688 HydrophobicContact CB-CD1 3.86Å; N685-L688 WeakPolarHBondContact O-CB 3.06Å; N685-L688 PolarHBondContact O-N 3.5Å; L688-S714 VanDerWaalsContact CD2-CB 3.41Å; L688-S714 WeakPolarHBondContact CD2-OG 3.44Å; L688-C731 WeakPolarHBondContact CD2-SG 3.32Å; L688-C731 VanDerWaalsContact CG-SG 3.54Å; L688-I732 CarbonylContact C-O 3.57Å; L688-I732 WeakPolarHBondContact CA-O 3.43Å
689	F	79.7	Confident	71.2	Confident	77 Å²	77	72.7 Å²	72.7	34%	0.338	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.1	179.5	-54.9	-75.6	0	0	0	111.4	F687 C731 I732	F687-F689 HydrophobicContact CB-CE2 4.37Å; F687-F689 WeakPolarHBondContact O-CD2 3.35Å; F687-F689 WeakPolarHBondContact O-CE2 3.49Å; F689-C731 WeakPolarHBondContact O-CA 3.27Å; F689-I732 PolarHBondContact N-O 2.87Å; F689-I732 PolarHBondContact O-N 3.02Å
690	W	83.3	Confident	70.8	Confident	4 Å²	4	77.4 Å²	77.4	2%	0.015	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	135.5	169.4	-69.9	98.5	0	0	0	111	L653 L673 C675 L697 S714 L716 E730 C731	L653-W690 HydrophobicContact CD1-CH2 4.04Å; L653-W690 HydrophobicContact CD1-CZ3 4.27Å; L653-W690 HydrophobicContact CD2-CH2 4.28Å; L653-W690 HydrophobicContact CD2-CZ3 3.9Å; L673-W690 HydrophobicContact CB-CH2 3.59Å; L673-W690 HydrophobicContact CB-CZ2 4.35Å; L673-W690 HydrophobicContact CB-CZ3 3.9Å; L673-W690 HydrophobicContact CD1-CZ3 4.07Å; C675-W690 HydrophobicContact CB-CZ2 4.31Å; W690-L697 HydrophobicContact CB-CB 4.21Å; W690-L697 HydrophobicContact CB-CD1 4.01Å; W690-L697 PolarHBondContact O-N 3.19Å; W690-S714 VanDerWaalsContact CD1-OG 3.25Å; W690-S714 PolarHBondContact NE1-OG 2.89Å; W690-L716 HydrophobicContact CD2-CB 3.92Å; W690-L716 HydrophobicContact CD2-CD2 4.25Å; W690-L716 HydrophobicContact CE3-CB 4.32Å; W690-L716 HydrophobicContact CE3-CD2 4.09Å; W690-L716 HydrophobicContact CG-CB 4.3Å; W690-L716 HydrophobicContact CG-CD1 4.48Å; W690-L716 HydrophobicContact CH2-CB 4.47Å; W690-L716 HydrophobicContact CZ2-CB 4.09Å; W690-E730 CarbonylContact C-O 3.58Å; W690-E730 WeakPolarHBondContact CA-O 3.44Å; W690-C731 HydrophobicContact CD2-CB 4.39Å; W690-C731 HydrophobicContact CE3-CB 3.99Å; W690-C731 HydrophobicContact CH2-CB 4.1Å; W690-C731 HydrophobicContact CZ2-CB 4.48Å; W690-C731 HydrophobicContact CZ3-CB 3.85Å
691	L	82.2	Confident	70.4	Confident	27 Å²	27	83.6 Å²	83.6	14%	0.141	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	141.5	174.2	-61.1	153.9	0	0	0	108.9	Q695 R696 Y729 E730 I732	L691-Q695 CarbonylContact C-O 3.56Å; L691-Q695 WeakPolarHBondContact CA-O 3.35Å; L691-R696 HydrophobicContact CD2-CB 4.31Å; L691-Y729 CarbonylContact O-C 3.58Å; L691-Y729 WeakPolarHBondContact O-CA 3.42Å; L691-E730 HydrophobicContact CB-CB 4.09Å; L691-E730 HydrophobicContact CD1-CB 4.13Å; L691-E730 PolarHBondContact N-O 3.32Å; L691-E730 PolarHBondContact O-N 3.24Å; L691-I732 HydrophobicContact CD1-CD1 3.29Å; L691-I732 HydrophobicContact CD1-CG1 3.79Å
692	Y	83.4	Confident	70	Confident	37 Å²	37	81.8 Å²	81.8	15%	0.145	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	123.6	168	176.2	-114.6	0	0	0	108.8	G694 Q695 L697 S724 Y725 V726 Y729	Y692-G694 PolarHBondContact O-N 3.25Å; Y692-G694 VanDerWaalsContact O-N 3.09Å; Y692-Q695 PolarHBondContact N-O 3.28Å; Y692-Q695 PolarHBondContact O-N 2.92Å; Y692-L697 HydrophobicContact CG-CD2 4.44Å; Y692-S724 PolarHBondContact OH-O 2.7Å; Y692-Y725 WeakPolarHBondContact CE2-O 3.4Å; Y692-V726 PolarHBondContact OH-O 3.07Å; Y692-V726 VanDerWaalsContact OH-O 3.08Å; Y692-Y729 HydrophobicContact CD2-CD1 4.11Å; Y692-Y729 HydrophobicContact CD2-CD2 4.23Å; Y692-Y729 AromaticContact CD2-CE1 3.7Å; Y692-Y729 HydrophobicContact CD2-CE1 3.7Å; Y692-Y729 AromaticContact CD2-CE2 3.83Å; Y692-Y729 HydrophobicContact CD2-CE2 3.83Å; Y692-Y729 HydrophobicContact CD2-CG 4.36Å; Y692-Y729 AromaticContact CD2-CZ 3.55Å; Y692-Y729 HydrophobicContact CE2-CE1 4.43Å; Y692-Y729 AromaticContact CE2-CE2 3.88Å; Y692-Y729 HydrophobicContact CE2-CE2 3.88Å; Y692-Y729 AromaticContact CE2-CZ 3.82Å; Y692-Y729 HydrophobicContact CG-CE1 4.36Å
693	Q	81.9	Confident	69.7	Low	126 Å²	126	79.2 Å²	79.2	59%	0.589	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	36.5	-173.9	-56.4	-169.8	1.6	0	0	113	Q695 I728	Q693-Q695 VanDerWaalsContact C-N 3.33Å; Q693-Q695 PolarHBondContact O-N 2.73Å; Q693-I728 PolarHBondContact N-O 3.05Å
694	G	78.3	Confident	69.5	Low	49 Å²	49	82 Å²	82	51%	0.505	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.2	-1.8	-178.7	0	0	0	0	0	115.9	Y692	Y692-G694 PolarHBondContact O-N 3.25Å; Y692-G694 VanDerWaalsContact O-N 3.09Å
695	Q	82.1	Confident	69.5	Low	143 Å²	143	79.4 Å²	79.4	67%	0.668	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	140.5	174.7	-63.9	-172.5	9.2	0	0	111.5	L691 Y692 Q693 L697	L691-Q695 CarbonylContact C-O 3.56Å; L691-Q695 WeakPolarHBondContact CA-O 3.35Å; Y692-Q695 PolarHBondContact N-O 3.28Å; Y692-Q695 PolarHBondContact O-N 2.92Å; Q693-Q695 VanDerWaalsContact C-N 3.33Å; Q693-Q695 PolarHBondContact O-N 2.73Å; Q695-L697 PolarHBondContact O-N 3.11Å
696	R	78.9	Confident	69.3	Low	184 Å²	184	79 Å²	79	69%	0.694	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.4	122.8	178.7	-174.2	173.2	177.7	177.8	-2.1	110.1	L691	L691-R696 HydrophobicContact CD2-CB 4.31Å
697	L	74.2	Confident	68.8	Low	23 Å²	23	76.5 Å²	76.5	12%	0.12	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-74.2	127.5	172.6	-79.5	166.4	0	0	0	109.3	W690 Y692 Q695 I703 I705 L716 Y729	W690-L697 HydrophobicContact CB-CB 4.21Å; W690-L697 HydrophobicContact CB-CD1 4.01Å; W690-L697 PolarHBondContact O-N 3.19Å; Y692-L697 HydrophobicContact CG-CD2 4.44Å; Q695-L697 PolarHBondContact O-N 3.11Å; L697-I703 HydrophobicContact CD2-CD1 3.84Å; L697-I705 HydrophobicContact CB-CD1 4.45Å; L697-L716 HydrophobicContact CD1-CD1 4.21Å; L697-L716 HydrophobicContact CD1-CD2 3.77Å; L697-Y729 HydrophobicContact CD1-CD1 3.92Å; L697-Y729 HydrophobicContact CD1-CE1 3.94Å
698	G	68.4	Low	68.1	Low	39 Å²	39	75.4 Å²	75.4	40%	0.402	39%	0.387	S	S	.	.			trans	-112	168.2	166	0	0	0	0	0	110.2	R700	G698-R700 PolarHBondContact O-N 3.23Å
699	E	60.1	Low	66.7	Low	149 Å²	149	82.1 Å²	82.1	70%	0.696	42%	0.424	S	S	*	.			trans	-60.7	121.9	171.3	-66.3	179.5	171.5	0	0	109.6
700	R	56.6	Low	65.1	Low	196 Å²	196	87.5 Å²	87.5	74%	0.74	45%	0.447	S	S	*	.	B	Isolated β-bridge	trans	-141.2	163.8	178	-72.3	-173.8	179.4	179.9	1.7	108.2	G698 G702 I703	G698-R700 PolarHBondContact O-N 3.23Å; R700-G702 PolarHBondContact O-N 2.97Å; R700-I703 PolarHBondContact O-N 3.04Å; R700-I703 VanDerWaalsContact O-O 3.11Å
701	N	53.5	Low	63.3	Low	160 Å²	160	94 Å²	94	86%	0.856	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.4	113.2	176	-71.4	-7.9	0	0	0	110.9	Y725	N701-Y725 PolarHBondContact O-OH 3.31Å
702	G	56.1	Low	61.6	Low	33 Å²	33	97.1 Å²	97.1	34%	0.34	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.9	-15.1	178.3	0	0	0	0	0	116.6	R700 I718 Y719	R700-G702 PolarHBondContact O-N 2.97Å; G702-I718 WeakPolarHBondContact O-CA 3.37Å; G702-Y719 PolarHBondContact O-N 3.23Å
703	I	58.2	Low	60.1	Low	7 Å²	7	95.9 Å²	95.9	4%	0.036	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	120.2	175.9	-61.9	-178	0	0	0	110	L697 R700 L716 K717 I718 Y725	L697-I703 HydrophobicContact CD2-CD1 3.84Å; R700-I703 PolarHBondContact O-N 3.04Å; R700-I703 VanDerWaalsContact O-O 3.11Å; I703-L716 HydrophobicContact CG2-CD1 3.46Å; I703-L716 VanDerWaalsContact CG2-CD1 3.46Å; I703-L716 HydrophobicContact CG2-CG 4.43Å; I703-K717 WeakPolarHBondContact CA-O 3.49Å; I703-I718 HydrophobicContact CG1-CG1 4.32Å; I703-Y725 HydrophobicContact CD1-CD1 3.76Å; I703-Y725 HydrophobicContact CD1-CE1 3.31Å; I703-Y725 HydrophobicContact CG1-CD1 4.38Å; I703-Y725 HydrophobicContact CG1-CE1 3.77Å
704	M	56.8	Low	59.3	Low	85 Å²	85	90.2 Å²	90.2	42%	0.419	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.1	169	-85	177.8	36.9	0	0	110.8	K717 Y719	M704-K717 PolarHBondContact N-O 2.98Å; M704-K717 PolarHBondContact O-N 3.19Å; M704-Y719 HydrophobicContact CB-CE2 3.89Å; M704-Y719 HydrophobicContact CE-CE2 4.4Å; M704-Y719 WeakPolarHBondContact CE-OH 3.4Å; M704-Y719 HydrophobicContact CG-CE2 3.78Å; M704-Y719 HydrophobicContact SD-CE2 3.53Å; M704-Y719 VanDerWaalsContact SD-CE2 3.53Å; M704-Y719 PolarHBondContact SD-OH 3.2Å
705	I	60.1	Low	58.8	Low	38 Å²	38	88.7 Å²	88.7	20%	0.195	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	100.4	169.3	-60	170.9	0	0	0	106.5	L697 L716	L697-I705 HydrophobicContact CB-CD1 4.45Å; I705-L716 HydrophobicContact CD1-CD1 4.35Å; I705-L716 HydrophobicContact CG1-CD1 3.57Å
706	A	58.6	Low	58.3	Low	25 Å²	25	81.9 Å²	81.9	21%	0.207	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112.8	178.5	0	0	0	0	0	109.5	N715 K717	A706-N715 PolarHBondContact N-O 3.23Å; A706-N715 PolarHBondContact O-N 2.72Å; A706-K717 HydrophobicContact CB-CD 4.41Å
707	T	53.2	Low	57.9	Low	81 Å²	81	76.2 Å²	76.2	50%	0.497	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	121.7	161	45.3	0	0	0	0	108.4	D709 V713	T707-D709 PolarHBondContact O-N 3.23Å; T707-V713 WeakPolarHBondContact CA-O 3.46Å
708	D	50.8	Low	57.6	Low	82 Å²	82	75.3 Å²	75.3	44%	0.439	38%	0.382	S	S	.	.			trans	-67.5	124.6	171.8	-178.5	-14.1	0	0	0	109	K710 K711 V713	D708-K710 PolarHBondContact O-N 2.96Å; D708-K710 VanDerWaalsContact O-N 3.12Å; D708-K710 PolarHBondContact OD1-N 3.41Å; D708-K711 WeakPolarHBondContact CB-O 3.3Å; D708-K711 CarbonylContact O-C 3.28Å; D708-K711 VanDerWaalsContact O-C 3.28Å; D708-K711 PolarHBondContact O-N 3.06Å; D708-V713 PolarHBondContact N-O 3.14Å
709	D	43.9	Very low	57.3	Low	160 Å²	160	78.5 Å²	78.5	86%	0.856	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.8	-177.9	-64.2	-29.4	0	0	0	112.8	T707	T707-D709 PolarHBondContact O-N 3.23Å
710	K	47.5	Very low	57.4	Low	189 Å²	189	78 Å²	78	82%	0.822	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-23.4	-176.2	-66.4	-176.9	-179.8	175.8	0	114.4	D708	D708-K710 PolarHBondContact O-N 2.96Å; D708-K710 VanDerWaalsContact O-N 3.12Å; D708-K710 PolarHBondContact OD1-N 3.41Å
711	K	45.6	Very low	57.8	Low	141 Å²	141	68.8 Å²	68.8	61%	0.613	35%	0.346	S	S	*	.	S	Bend	trans	-150.1	111.8	179.8	-63.3	-178.6	-179.8	-179.4	0	104.5	D684 D708 V713	D684-K711 WeakPolarHBondContact OD2-CA 3.29Å; D708-K711 WeakPolarHBondContact CB-O 3.3Å; D708-K711 CarbonylContact O-C 3.28Å; D708-K711 VanDerWaalsContact O-C 3.28Å; D708-K711 PolarHBondContact O-N 3.06Å; K711-V713 HydrophobicContact CB-CG2 4.11Å; K711-V713 PolarHBondContact O-N 2.93Å
712	K	44.7	Very low	58.6	Low	93 Å²	93	64.5 Å²	64.5	40%	0.404	32%	0.323	S	S	.	.			trans	-71.9	62.9	-169.5	-47.7	171.1	170.5	161.2	0	112.5	D684 N685 E686	D684-K712 WeakPolarHBondContact CA-O 3.35Å; D684-K712 WeakPolarHBondContact OD1-CB 3.47Å; D684-K712 WeakPolarHBondContact OD1-CG 3.35Å; D684-K712 PolarHBondContact OD1-N 3.37Å; D684-K712 PolarHBondContact OD2-N 2.91Å; N685-K712 PolarHBondContact N-O 2.98Å; E686-K712 HydrophobicContact CG-CD 3.75Å; E686-K712 IonicContact OE1-NZ 3.18Å; E686-K712 PolarHBondContact OE1-NZ 2.8Å
713	V	53.5	Low	59.4	Low	11 Å²	11	70.4 Å²	70.4	7%	0.067	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-92.5	122.9	175.9	-179	0	0	0	0	106.9	P682 T707 D708 K711	P682-V713 HydrophobicContact CB-CB 4.22Å; P682-V713 HydrophobicContact CB-CG1 3.66Å; P682-V713 HydrophobicContact CB-CG2 3.46Å; P682-V713 VanDerWaalsContact CB-CG2 3.46Å; T707-V713 WeakPolarHBondContact CA-O 3.46Å; D708-V713 PolarHBondContact N-O 3.14Å; K711-V713 HydrophobicContact CB-CG2 4.11Å; K711-V713 PolarHBondContact O-N 2.93Å
714	S	63.9	Low	60.1	Low	6 Å²	6	73.7 Å²	73.7	4%	0.042	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	107.9	177.7	179.1	0	0	0	0	110.4	L688 W690	L688-S714 VanDerWaalsContact CD2-CB 3.41Å; L688-S714 WeakPolarHBondContact CD2-OG 3.44Å; W690-S714 VanDerWaalsContact CD1-OG 3.25Å; W690-S714 PolarHBondContact NE1-OG 2.89Å
715	N	68	Low	60.9	Low	18 Å²	18	71.6 Å²	71.6	10%	0.096	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	126.1	167.9	-60.7	-71.1	0	0	0	109.1	V672 L673 R674 A706	V672-N715 HydrophobicContact CG1-CB 4.21Å; L673-N715 WeakPolarHBondContact O-CA 3.44Å; R674-N715 WeakPolarHBondContact CB-OD1 3.43Å; R674-N715 WeakPolarHBondContact CG-OD1 3.28Å; R674-N715 PolarHBondContact NE-OD1 3.3Å; A706-N715 PolarHBondContact N-O 3.23Å; A706-N715 PolarHBondContact O-N 2.72Å
716	L	72.7	Confident	61.7	Low	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	117.1	169.6	-176.9	72.5	0	0	0	108.7	V672 L673 W690 L697 I703 I705 Y729	V672-L716 WeakPolarHBondContact CA-O 3.35Å; L673-L716 HydrophobicContact CB-CB 4.24Å; L673-L716 HydrophobicContact CD1-CD2 4.08Å; L673-L716 PolarHBondContact N-O 3.11Å; L673-L716 PolarHBondContact O-N 3.47Å; W690-L716 HydrophobicContact CD2-CB 3.92Å; W690-L716 HydrophobicContact CD2-CD2 4.25Å; W690-L716 HydrophobicContact CE3-CB 4.32Å; W690-L716 HydrophobicContact CE3-CD2 4.09Å; W690-L716 HydrophobicContact CG-CB 4.3Å; W690-L716 HydrophobicContact CG-CD1 4.48Å; W690-L716 HydrophobicContact CH2-CB 4.47Å; W690-L716 HydrophobicContact CZ2-CB 4.09Å; L697-L716 HydrophobicContact CD1-CD1 4.21Å; L697-L716 HydrophobicContact CD1-CD2 3.77Å; I703-L716 HydrophobicContact CG2-CD1 3.46Å; I703-L716 VanDerWaalsContact CG2-CD1 3.46Å; I703-L716 HydrophobicContact CG2-CG 4.43Å; I705-L716 HydrophobicContact CD1-CD1 4.35Å; I705-L716 HydrophobicContact CG1-CD1 3.57Å; L716-Y729 HydrophobicContact CD2-CD1 3.58Å; L716-Y729 HydrophobicContact CD2-CE1 3.68Å
717	K	69.3	Low	62.8	Low	65 Å²	65	71 Å²	71	28%	0.283	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.1	177.6	-59.5	-177.6	-179.7	175.5	0	109.6	V672 I703 M704 A706	V672-K717 HydrophobicContact CG1-CG 4.35Å; V672-K717 HydrophobicContact CG2-CG 4.16Å; I703-K717 WeakPolarHBondContact CA-O 3.49Å; M704-K717 PolarHBondContact N-O 2.98Å; M704-K717 PolarHBondContact O-N 3.19Å; A706-K717 HydrophobicContact CB-CD 4.41Å
718	I	67.8	Low	64.3	Low	3 Å²	3	69 Å²	69	2%	0.015	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	117.5	172.4	-51.8	177.4	0	0	0	106.3	P670 V671 G702 I703 L721 Y725 Y729	P670-I718 CarbonylContact C-O 3.59Å; P670-I718 WeakPolarHBondContact CA-O 3.28Å; V671-I718 PolarHBondContact N-O 3.47Å; V671-I718 PolarHBondContact O-N 2.78Å; G702-I718 WeakPolarHBondContact O-CA 3.37Å; I703-I718 HydrophobicContact CG1-CG1 4.32Å; I718-L721 HydrophobicContact CD1-CD1 4.02Å; I718-L721 HydrophobicContact CG2-CD1 4.32Å; I718-Y725 HydrophobicContact CG2-CD2 4.33Å; I718-Y725 HydrophobicContact CG2-CG 4.4Å; I718-Y729 HydrophobicContact CD1-CE1 3.96Å; I718-Y729 WeakPolarHBondContact CD1-OH 3.37Å
719	Y	62.5	Low	65.9	Low	106 Å²	106	65.2 Å²	65.2	42%	0.416	32%	0.316	S	S	.	.	S	Bend	trans	-80.3	-32.5	-174.1	-68.6	-74.6	0	0	0	113.4	P670 G702 M704	P670-Y719 WeakPolarHBondContact CA-O 3.44Å; G702-Y719 PolarHBondContact O-N 3.23Å; M704-Y719 HydrophobicContact CB-CE2 3.89Å; M704-Y719 HydrophobicContact CE-CE2 4.4Å; M704-Y719 WeakPolarHBondContact CE-OH 3.4Å; M704-Y719 HydrophobicContact CG-CE2 3.78Å; M704-Y719 HydrophobicContact SD-CE2 3.53Å; M704-Y719 VanDerWaalsContact SD-CE2 3.53Å; M704-Y719 PolarHBondContact SD-OH 3.2Å
720	Q	63.1	Low	67.7	Low	140 Å²	140	58.9 Å²	58.9	65%	0.654	28%	0.281	S	S	*	.	S	Bend	trans	-135.3	103.2	174.3	-105.9	177.7	-17.5	0	0	108.2	D722	Q720-D722 PolarHBondContact O-N 3.33Å
721	L	64.2	Low	69.4	Low	1 Å²	1	49.9 Å²	49.9	1%	0.005	24%	0.242	C	C	.	.			trans	-76.9	99.5	172.8	-169.7	88.7	0	0	0	109.2	V665 V667 G668 G669 V671 I718 V747	V665-L721 HydrophobicContact CB-CD2 3.94Å; V665-L721 HydrophobicContact CG1-CD2 3.88Å; V667-L721 CarbonylContact C-O 3.38Å; V667-L721 WeakPolarHBondContact CA-O 3.28Å; V667-L721 WeakPolarHBondContact CG1-O 3.46Å; G668-L721 PolarHBondContact N-O 3.17Å; G669-L721 WeakPolarHBondContact O-CB 3.29Å; G669-L721 PolarHBondContact O-N 2.91Å; G669-L721 VanDerWaalsContact O-N 3.08Å; V671-L721 HydrophobicContact CG2-CB 3.96Å; V671-L721 HydrophobicContact CG2-CD1 4.19Å; V671-L721 HydrophobicContact CG2-CD2 4.17Å; V671-L721 HydrophobicContact CG2-CG 4.33Å; I718-L721 HydrophobicContact CD1-CD1 4.02Å; I718-L721 HydrophobicContact CG2-CD1 4.32Å; L721-V747 HydrophobicContact CD1-CG1 4.48Å; L721-V747 HydrophobicContact CD2-CG1 4.32Å
722	D	70.4	Confident	71.1	Confident	70 Å²	70	45.1 Å²	45.1	37%	0.374	22%	0.223	S	C	.	.			trans	-86	174.4	164.3	66.1	36.3	0	0	0	111.9	Q720 S724 Y725	Q720-D722 PolarHBondContact O-N 3.33Å; D722-S724 PolarHBondContact O-N 3.29Å; D722-S724 VanDerWaalsContact OD1-CA 3.26Å; D722-S724 WeakPolarHBondContact OD1-CA 3.45Å; D722-S724 WeakPolarHBondContact OD1-CB 3.29Å; D722-S724 PolarHBondContact OD1-N 3.32Å; D722-S724 PolarHBondContact OD1-OG 3.49Å; D722-S724 PolarHBondContact OD2-OG 2.9Å; D722-Y725 HydrophobicContact CB-CD2 4.46Å; D722-Y725 VanDerWaalsContact CG-CD2 3.49Å; D722-Y725 PolarHBondContact O-N 3.41Å; D722-Y725 WeakPolarHBondContact OD1-CD2 3.36Å; D722-Y725 PolarHBondContact OD1-N 3.45Å; D722-Y725 WeakPolarHBondContact OD2-CE2 3.29Å
723	E	71.7	Confident	72.7	Confident	158 Å²	158	40.8 Å²	40.8	74%	0.738	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-60.9	-22.4	177.3	-68.1	-170.6	164.5	0	0	113.5	V667 Y725 V726	V667-E723 HydrophobicContact CG1-CG 4.47Å; E723-Y725 VanDerWaalsContact C-N 3.26Å; E723-Y725 PolarHBondContact O-N 3.48Å; E723-V726 WeakPolarHBondContact O-CB 3.44Å; E723-V726 PolarHBondContact O-N 2.89Å
724	S	73.7	Confident	73.5	Confident	76 Å²	76	44.7 Å²	44.7	53%	0.531	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-73.1	-19.4	179.8	84.1	0	0	0	0	113.1	Y692 D722	Y692-S724 PolarHBondContact OH-O 2.7Å; D722-S724 PolarHBondContact O-N 3.29Å; D722-S724 VanDerWaalsContact OD1-CA 3.26Å; D722-S724 WeakPolarHBondContact OD1-CA 3.45Å; D722-S724 WeakPolarHBondContact OD1-CB 3.29Å; D722-S724 PolarHBondContact OD1-N 3.32Å; D722-S724 PolarHBondContact OD1-OG 3.49Å; D722-S724 PolarHBondContact OD2-OG 2.9Å
725	Y	73.2	Confident	73.6	Confident	40 Å²	40	46.8 Å²	46.8	16%	0.157	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-90.5	-4.4	173.3	-64.4	-64.1	0	0	0	113.4	Y692 N701 I703 I718 D722 E723 G727 Y729	Y692-Y725 WeakPolarHBondContact CE2-O 3.4Å; N701-Y725 PolarHBondContact O-OH 3.31Å; I703-Y725 HydrophobicContact CD1-CD1 3.76Å; I703-Y725 HydrophobicContact CD1-CE1 3.31Å; I703-Y725 HydrophobicContact CG1-CD1 4.38Å; I703-Y725 HydrophobicContact CG1-CE1 3.77Å; I718-Y725 HydrophobicContact CG2-CD2 4.33Å; I718-Y725 HydrophobicContact CG2-CG 4.4Å; D722-Y725 HydrophobicContact CB-CD2 4.46Å; D722-Y725 VanDerWaalsContact CG-CD2 3.49Å; D722-Y725 PolarHBondContact O-N 3.41Å; D722-Y725 WeakPolarHBondContact OD1-CD2 3.36Å; D722-Y725 PolarHBondContact OD1-N 3.45Å; D722-Y725 WeakPolarHBondContact OD2-CE2 3.29Å; E723-Y725 VanDerWaalsContact C-N 3.26Å; E723-Y725 PolarHBondContact O-N 3.48Å; Y725-G727 PolarHBondContact O-N 2.9Å; Y725-Y729 WeakPolarHBondContact CB-OH 3.33Å; Y725-Y729 VanDerWaalsContact O-CE2 3.28Å; Y725-Y729 WeakPolarHBondContact O-CE2 3.48Å; Y725-Y729 PolarHBondContact O-OH 3.05Å
726	V	77.3	Confident	73.3	Confident	39 Å²	39	47.2 Å²	47.2	24%	0.236	25%	0.247	C	C	.	.			trans	-73.3	114	175.5	179.4	0	0	0	0	109.2	Y692 E723 V747 A749	Y692-V726 PolarHBondContact OH-O 3.07Å; Y692-V726 VanDerWaalsContact OH-O 3.08Å; E723-V726 WeakPolarHBondContact O-CB 3.44Å; E723-V726 PolarHBondContact O-N 2.89Å; V726-V747 VanDerWaalsContact CG1-O 3.28Å; V726-V747 WeakPolarHBondContact CG1-O 3.31Å; V726-A749 HydrophobicContact CG2-CB 4.17Å
727	G	82.8	Confident	72.8	Confident	11 Å²	11	52.2 Å²	52.2	11%	0.113	28%	0.28	C	S	.	.	S	Bend	trans	174.5	-162.6	-174.8	0	0	0	0	0	113.9	Y725 V747	Y725-G727 PolarHBondContact O-N 2.9Å; G727-V747 PolarHBondContact N-O 3.36Å; G727-V747 VanDerWaalsContact N-O 3.13Å; G727-V747 PolarHBondContact O-N 2.91Å
728	I	83.3	Confident	72.3	Confident	41 Å²	41	57.8 Å²	57.8	21%	0.21	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	118.3	-179.5	-55.4	174.7	0	0	0	108.7	Q693 E730 K744 R746	Q693-I728 PolarHBondContact N-O 3.05Å; I728-E730 HydrophobicContact CG2-CG 3.9Å; I728-K744 HydrophobicContact CG2-CB 4.42Å; I728-R746 HydrophobicContact CG1-CB 4.38Å; I728-R746 HydrophobicContact CG1-CG 4.33Å
729	Y	84.7	Confident	72.2	Confident	1 Å²	1	61.3 Å²	61.3	0%	0.004	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	130.9	168.4	-68.9	-92.7	0	0	0	108.9	L673 L691 Y692 L697 L716 I718 Y725 K744 L745 V747	L673-Y729 HydrophobicContact CD1-CD1 3.9Å; L673-Y729 HydrophobicContact CD1-CD2 4.14Å; L673-Y729 HydrophobicContact CD1-CG 3.65Å; L691-Y729 CarbonylContact O-C 3.58Å; L691-Y729 WeakPolarHBondContact O-CA 3.42Å; Y692-Y729 HydrophobicContact CD2-CD1 4.11Å; Y692-Y729 HydrophobicContact CD2-CD2 4.23Å; Y692-Y729 AromaticContact CD2-CE1 3.7Å; Y692-Y729 HydrophobicContact CD2-CE1 3.7Å; Y692-Y729 AromaticContact CD2-CE2 3.83Å; Y692-Y729 HydrophobicContact CD2-CE2 3.83Å; Y692-Y729 HydrophobicContact CD2-CG 4.36Å; Y692-Y729 AromaticContact CD2-CZ 3.55Å; Y692-Y729 HydrophobicContact CE2-CE1 4.43Å; Y692-Y729 AromaticContact CE2-CE2 3.88Å; Y692-Y729 HydrophobicContact CE2-CE2 3.88Å; Y692-Y729 AromaticContact CE2-CZ 3.82Å; Y692-Y729 HydrophobicContact CG-CE1 4.36Å; L697-Y729 HydrophobicContact CD1-CD1 3.92Å; L697-Y729 HydrophobicContact CD1-CE1 3.94Å; L716-Y729 HydrophobicContact CD2-CD1 3.58Å; L716-Y729 HydrophobicContact CD2-CE1 3.68Å; I718-Y729 HydrophobicContact CD1-CE1 3.96Å; I718-Y729 WeakPolarHBondContact CD1-OH 3.37Å; Y725-Y729 WeakPolarHBondContact CB-OH 3.33Å; Y725-Y729 VanDerWaalsContact O-CE2 3.28Å; Y725-Y729 WeakPolarHBondContact O-CE2 3.48Å; Y725-Y729 PolarHBondContact O-OH 3.05Å; Y729-K744 CarbonylContact O-C 3.57Å; Y729-K744 WeakPolarHBondContact O-CA 3.36Å; Y729-L745 PolarHBondContact N-O 3.42Å; Y729-L745 PolarHBondContact O-N 3.23Å; Y729-V747 HydrophobicContact CD2-CB 4.1Å; Y729-V747 HydrophobicContact CD2-CG2 3.56Å; Y729-V747 HydrophobicContact CE2-CB 3.99Å; Y729-V747 HydrophobicContact CE2-CG2 3.78Å
730	E	82.3	Confident	72.7	Confident	27 Å²	27	62.1 Å²	62.1	13%	0.126	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.5	175.6	-40.9	-172.7	169.8	0	0	109.2	W690 L691 I728 A743 K744	W690-E730 CarbonylContact C-O 3.58Å; W690-E730 WeakPolarHBondContact CA-O 3.44Å; L691-E730 HydrophobicContact CB-CB 4.09Å; L691-E730 HydrophobicContact CD1-CB 4.13Å; L691-E730 PolarHBondContact N-O 3.32Å; L691-E730 PolarHBondContact O-N 3.24Å; I728-E730 HydrophobicContact CG2-CG 3.9Å; E730-A743 CarbonylContact C-O 3.59Å; E730-A743 VanDerWaalsContact CA-O 3.31Å; E730-A743 WeakPolarHBondContact CA-O 3.16Å; E730-K744 HydrophobicContact CB-CG 4.22Å; E730-K744 VanDerWaalsContact CD-NZ 3.25Å; E730-K744 HydrophobicContact CG-CB 4.42Å; E730-K744 HydrophobicContact CG-CD 4.04Å; E730-K744 HydrophobicContact CG-CG 3.81Å; E730-K744 VanDerWaalsContact OE1-CD 3.3Å; E730-K744 WeakPolarHBondContact OE1-CD 3.35Å; E730-K744 WeakPolarHBondContact OE1-CE 3.45Å; E730-K744 IonicContact OE1-NZ 2.76Å; E730-K744 PolarHBondContact OE1-NZ 3.01Å; E730-K744 VanDerWaalsContact OE2-CE 3.27Å; E730-K744 WeakPolarHBondContact OE2-CE 3.36Å; E730-K744 IonicContact OE2-NZ 2.99Å; E730-K744 PolarHBondContact OE2-NZ 2.9Å
731	C	82.4	Confident	73.3	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	124.2	170.8	-173.8	0	0	0	0	108.1	L653 L655 C675 L688 F689 W690 K742 A743	L653-C731 HydrophobicContact CD2-CB 4.39Å; L655-C731 WeakPolarHBondContact CD2-O 3.48Å; C675-C731 PolarHBondContact SG-SG 3.39Å; L688-C731 WeakPolarHBondContact CD2-SG 3.32Å; L688-C731 VanDerWaalsContact CG-SG 3.54Å; F689-C731 WeakPolarHBondContact O-CA 3.27Å; W690-C731 HydrophobicContact CD2-CB 4.39Å; W690-C731 HydrophobicContact CE3-CB 3.99Å; W690-C731 HydrophobicContact CH2-CB 4.1Å; W690-C731 HydrophobicContact CZ2-CB 4.48Å; W690-C731 HydrophobicContact CZ3-CB 3.85Å; C731-K742 CarbonylContact O-C 3.59Å; C731-K742 WeakPolarHBondContact O-CA 3.44Å; C731-A743 PolarHBondContact N-O 2.95Å; C731-A743 PolarHBondContact O-N 2.82Å
732	I	81	Confident	74.2	Confident	41 Å²	41	62.8 Å²	62.8	21%	0.21	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	128.7	178.5	-58.1	-174.9	0	0	0	108.5	L688 F689 L691 L740 M741 K742	L688-I732 CarbonylContact C-O 3.57Å; L688-I732 WeakPolarHBondContact CA-O 3.43Å; F689-I732 PolarHBondContact N-O 2.87Å; F689-I732 PolarHBondContact O-N 3.02Å; L691-I732 HydrophobicContact CD1-CD1 3.29Å; L691-I732 HydrophobicContact CD1-CG1 3.79Å; I732-L740 HydrophobicContact CG2-CD2 3.77Å; I732-M741 WeakPolarHBondContact CA-O 3.32Å; I732-K742 HydrophobicContact CG1-CB 4.2Å
733	A	79.1	Confident	74.7	Confident	3 Å²	3	59.6 Å²	59.6	3%	0.025	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	142.3	171.6	0	0	0	0	0	111.1	L655 A735 M741	L655-A733 HydrophobicContact CD1-CB 3.41Å; L655-A733 VanDerWaalsContact CD1-CB 3.41Å; L655-A733 HydrophobicContact CD2-CB 4.39Å; A733-A735 PolarHBondContact O-N 3.37Å; A733-M741 PolarHBondContact N-O 3.13Å; A733-M741 PolarHBondContact O-N 2.98Å
734	K	70.5	Confident	75.2	Confident	93 Å²	93	54.7 Å²	54.7	40%	0.404	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	114.2	173.7	-173.2	175.3	-178.7	178.5	0	109.4	N685 F687 G736	N685-K734 PolarHBondContact ND2-O 3.03Å; F687-K734 HydrophobicContact CB-CB 3.88Å; F687-K734 HydrophobicContact CG-CB 4.45Å; K734-G736 WeakPolarHBondContact CE-O 3.45Å; K734-G736 WeakPolarHBondContact CG-O 3.4Å
735	A	65.1	Low	75.6	Confident	50 Å²	50	51.2 Å²	51.2	41%	0.413	28%	0.276	S	S	.	.			trans	-98.4	23.5	179.5	0	0	0	0	0	113.3	A733 T739 M741	A733-A735 PolarHBondContact O-N 3.37Å; A735-T739 PolarHBondContact N-O 3.43Å; A735-M741 HydrophobicContact CB-CE 3.35Å; A735-M741 HydrophobicContact CB-CG 3.75Å; A735-M741 HydrophobicContact CB-SD 3.7Å
736	G	61.6	Low	75.9	Confident	26 Å²	26	54.4 Å²	54.4	27%	0.268	29%	0.288	S	S	.	.	S	Bend	trans	148.2	179.7	-177.4	0	0	0	0	0	112.3	K734 H738	K734-G736 WeakPolarHBondContact CE-O 3.45Å; K734-G736 WeakPolarHBondContact CG-O 3.4Å; G736-H738 PolarHBondContact O-N 3.27Å; G736-H738 VanDerWaalsContact O-N 3.14Å
737	P	63.6	Low	76.1	Confident	106 Å²	106	52.7 Å²	52.7	69%	0.688	28%	0.278	S	S	*	.	S	Bend	trans	-58.9	-29.2	-174.1	18.4	-28.9	0	0	0	114.2
738	H	59	Low	75.8	Confident	181 Å²	181	57.9 Å²	57.9	84%	0.838	29%	0.294	S	S	*	.	S	Bend	trans	-132.9	7.7	-175.8	-60.2	-58.5	0	0	0	115.5	G736	G736-H738 PolarHBondContact O-N 3.27Å; G736-H738 VanDerWaalsContact O-N 3.14Å
739	T	64.5	Low	75.3	Confident	77 Å²	77	58.3 Å²	58.3	47%	0.472	30%	0.304	S	S	.	.			trans	-115.4	116.9	-176.3	-37.9	0	0	0	0	110.3	A735	A735-T739 PolarHBondContact N-O 3.43Å
740	L	72.7	Confident	74.1	Confident	123 Å²	123	59.2 Å²	59.2	64%	0.644	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	117	171.7	-74.8	164	0	0	0	108.2	I732	I732-L740 HydrophobicContact CG2-CD2 3.77Å
741	M	76.8	Confident	72.5	Confident	66 Å²	66	69.9 Å²	69.9	33%	0.325	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	139.8	165.6	-65.7	-178.3	-174.8	0	0	108.2	L655 I732 A733 A735	L655-M741 HydrophobicContact CB-CB 4.12Å; L655-M741 HydrophobicContact CB-SD 4.38Å; L655-M741 HydrophobicContact CD2-CB 3.9Å; L655-M741 HydrophobicContact CG-CB 4.48Å; I732-M741 WeakPolarHBondContact CA-O 3.32Å; A733-M741 PolarHBondContact N-O 3.13Å; A733-M741 PolarHBondContact O-N 2.98Å; A735-M741 HydrophobicContact CB-CE 3.35Å; A735-M741 HydrophobicContact CB-CG 3.75Å; A735-M741 HydrophobicContact CB-SD 3.7Å
742	K	81.8	Confident	70.8	Confident	89 Å²	89	78.1 Å²	78.1	39%	0.387	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	135.5	179.7	69.9	-169.4	179.4	-173.3	0	109.1	D656 G658 C731 I732	D656-K742 PolarHBondContact O-N 3.44Å; D656-K742 VanDerWaalsContact O-N 3.1Å; G658-K742 WeakPolarHBondContact CA-O 3.22Å; G658-K742 PolarHBondContact N-O 3.14Å; C731-K742 CarbonylContact O-C 3.59Å; C731-K742 WeakPolarHBondContact O-CA 3.44Å; I732-K742 HydrophobicContact CG1-CB 4.2Å
743	A	81.1	Confident	68.9	Low	3 Å²	3	81.2 Å²	81.2	3%	0.025	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.9	172.6	0	0	0	0	0	108.3	L653 R654 L655 E730 C731	L653-A743 HydrophobicContact CB-CB 3.96Å; L653-A743 HydrophobicContact CD2-CB 4.31Å; R654-A743 WeakPolarHBondContact O-CB 3.38Å; L655-A743 HydrophobicContact CD2-CB 4.12Å; L655-A743 HydrophobicContact CG-CB 4.48Å; E730-A743 CarbonylContact C-O 3.59Å; E730-A743 VanDerWaalsContact CA-O 3.31Å; E730-A743 WeakPolarHBondContact CA-O 3.16Å; C731-A743 PolarHBondContact N-O 2.95Å; C731-A743 PolarHBondContact O-N 2.82Å
744	K	83	Confident	66.8	Low	56 Å²	56	85.1 Å²	85.1	24%	0.243	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.6	177.1	-57.8	-166	179.8	-154.2	0	110.2	S659 Q660 E661 I728 Y729 E730	S659-K744 PolarHBondContact O-N 3.23Å; S659-K744 VanDerWaalsContact O-N 3.1Å; Q660-K744 CarbonylContact C-O 3.59Å; Q660-K744 VanDerWaalsContact CA-O 3.26Å; Q660-K744 WeakPolarHBondContact CA-O 3.31Å; Q660-K744 HydrophobicContact CB-CB 4.04Å; Q660-K744 HydrophobicContact CG-CB 3.93Å; E661-K744 PolarHBondContact N-O 3.16Å; I728-K744 HydrophobicContact CG2-CB 4.42Å; Y729-K744 CarbonylContact O-C 3.57Å; Y729-K744 WeakPolarHBondContact O-CA 3.36Å; E730-K744 HydrophobicContact CB-CG 4.22Å; E730-K744 VanDerWaalsContact CD-NZ 3.25Å; E730-K744 HydrophobicContact CG-CB 4.42Å; E730-K744 HydrophobicContact CG-CD 4.04Å; E730-K744 HydrophobicContact CG-CG 3.81Å; E730-K744 VanDerWaalsContact OE1-CD 3.3Å; E730-K744 WeakPolarHBondContact OE1-CD 3.35Å; E730-K744 WeakPolarHBondContact OE1-CE 3.45Å; E730-K744 IonicContact OE1-NZ 2.76Å; E730-K744 PolarHBondContact OE1-NZ 3.01Å; E730-K744 VanDerWaalsContact OE2-CE 3.27Å; E730-K744 WeakPolarHBondContact OE2-CE 3.36Å; E730-K744 IonicContact OE2-NZ 2.99Å; E730-K744 PolarHBondContact OE2-NZ 2.9Å
745	L	81.7	Confident	65.1	Low	2 Å²	2	85.4 Å²	85.4	1%	0.01	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	117.7	173.1	-172.8	71.9	0	0	0	109.2	L653 E661 V663 L673 Y729 V747	L653-L745 HydrophobicContact CD1-CB 4.26Å; L653-L745 HydrophobicContact CD1-CD2 3.82Å; L653-L745 HydrophobicContact CD2-CB 3.63Å; L653-L745 HydrophobicContact CG-CB 3.88Å; L653-L745 HydrophobicContact CG-CD2 4.31Å; E661-L745 HydrophobicContact CB-CD1 3.78Å; E661-L745 CarbonylContact O-C 3.59Å; E661-L745 WeakPolarHBondContact O-CA 3.37Å; V663-L745 HydrophobicContact CB-CD1 4.26Å; V663-L745 HydrophobicContact CG2-CD1 3.69Å; L673-L745 HydrophobicContact CD1-CD2 4.23Å; L673-L745 HydrophobicContact CD2-CD2 3.52Å; L673-L745 HydrophobicContact CG-CD2 4.5Å; Y729-L745 PolarHBondContact N-O 3.42Å; Y729-L745 PolarHBondContact O-N 3.23Å; L745-V747 HydrophobicContact CD2-CG2 4.13Å; L745-V747 HydrophobicContact CG-CG2 4.38Å
746	R	80.3	Confident	63.8	Low	108 Å²	108	88.6 Å²	88.6	41%	0.408	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	109.1	170.6	-178.7	175.5	-75.9	174.9	-3.4	108.8	E661 T662 V663 I728 R748	E661-R746 PolarHBondContact O-N 3.36Å; T662-R746 VanDerWaalsContact CA-O 3.32Å; T662-R746 WeakPolarHBondContact CA-O 3.27Å; T662-R746 HydrophobicContact CG2-CB 4.21Å; T662-R746 HydrophobicContact CG2-CG 4.26Å; V663-R746 PolarHBondContact N-O 2.86Å; I728-R746 HydrophobicContact CG1-CB 4.38Å; I728-R746 HydrophobicContact CG1-CG 4.33Å; R746-R748 HydrophobicContact CG-CG 4.4Å
747	V	80.2	Confident	62.5	Low	2 Å²	2	94.3 Å²	94.3	1%	0.012	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	124.9	172.8	175.2	0	0	0	0	108.4	V663 V665 L721 V726 G727 Y729 L745	V663-V747 WeakPolarHBondContact O-CA 3.49Å; V665-V747 HydrophobicContact CB-CG1 4.13Å; V665-V747 HydrophobicContact CG2-CG1 3.8Å; L721-V747 HydrophobicContact CD1-CG1 4.48Å; L721-V747 HydrophobicContact CD2-CG1 4.32Å; V726-V747 VanDerWaalsContact CG1-O 3.28Å; V726-V747 WeakPolarHBondContact CG1-O 3.31Å; G727-V747 PolarHBondContact N-O 3.36Å; G727-V747 VanDerWaalsContact N-O 3.13Å; G727-V747 PolarHBondContact O-N 2.91Å; Y729-V747 HydrophobicContact CD2-CB 4.1Å; Y729-V747 HydrophobicContact CD2-CG2 3.56Å; Y729-V747 HydrophobicContact CE2-CB 3.99Å; Y729-V747 HydrophobicContact CE2-CG2 3.78Å; L745-V747 HydrophobicContact CD2-CG2 4.13Å; L745-V747 HydrophobicContact CG-CG2 4.38Å
748	R	76.4	Confident	61.1	Low	120 Å²	120	98.3 Å²	98.3	45%	0.453	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	152.3	173.8	-71.8	-170.7	-55.6	-160.9	-2.7	109.4	T662 V663 D664 V665 R746 G750	T662-R748 HydrophobicContact CG2-CG 4.13Å; T662-R748 VanDerWaalsContact CG2-CZ 3.43Å; T662-R748 VanDerWaalsContact CG2-NE 3.34Å; V663-R748 PolarHBondContact O-N 2.88Å; D664-R748 CarbonylContact C-O 3.55Å; D664-R748 WeakPolarHBondContact CA-O 2.87Å; D664-R748 WeakPolarHBondContact OD1-CB 3.49Å; D664-R748 IonicContact OD1-CZ 2.66Å; D664-R748 IonicContact OD1-NE 2.85Å; D664-R748 PolarHBondContact OD1-NE 3.07Å; D664-R748 IonicContact OD1-NH2 2.67Å; D664-R748 PolarHBondContact OD1-NH2 2.96Å; D664-R748 VanDerWaalsContact OD1-NH2 3.17Å; D664-R748 IonicContact OD2-CZ 2.63Å; D664-R748 IonicContact OD2-NE 3.87Å; D664-R748 IonicContact OD2-NH2 3.27Å; D664-R748 PolarHBondContact OD2-NH2 2.92Å; V665-R748 PolarHBondContact N-O 3.25Å; R746-R748 HydrophobicContact CG-CG 4.4Å; R748-G750 PolarHBondContact O-N 3.44Å
749	A	73.2	Confident	59.8	Low	51 Å²	51	98.5 Å²	98.5	42%	0.421	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	112.2	172.7	0	0	0	0	0	110.6	V667 V726	V667-A749 HydrophobicContact CG2-CB 3.49Å; V667-A749 VanDerWaalsContact CG2-CB 3.49Å; V726-A749 HydrophobicContact CG2-CB 4.17Å
750	G	61	Low	58.5	Low	19 Å²	19	100.9 Å²	100.9	20%	0.196	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	145.5	170	0	0	0	0	0	111.4	V665 R748	V665-G750 PolarHBondContact O-N 3.11Å; R748-G750 PolarHBondContact O-N 3.44Å
751	R	48.7	Very low	56.8	Low	251 Å²	251	101.6 Å²	101.6	95%	0.947	51%	0.51	S	S	*	.	S	Bend	trans	-91.6	-6.3	-177.1	-77.6	-171	177	-168.8	-1.3	115.3
752	E	45.3	Very low	55.3	Low	174 Å²	174	104 Å²	104	81%	0.813	52%	0.523	S	S	*	.			trans	-133.6	121.9	-169.9	-69.5	-179.2	176.3	0	0	112.9	A754	E752-A754 PolarHBondContact O-N 3.18Å
753	S	40.9	Very low	53.5	Low	106 Å²	106	101.1 Å²	101.1	74%	0.741	51%	0.514	S	S	*	.			trans	-86	92.3	168.4	-38.2	0	0	0	0	107.8	S755	S753-S755 PolarHBondContact O-N 3.21Å
754	A	36.1	Very low	51.8	Low	84 Å²	84	103.6 Å²	103.6	69%	0.694	53%	0.53	S	S	*	.			trans	-66.5	119.6	173	0	0	0	0	0	109.3	E752 L756	E752-A754 PolarHBondContact O-N 3.18Å; A754-L756 PolarHBondContact O-N 2.88Å
755	S	35.4	Very low	50.2	Low	99 Å²	99	105.2 Å²	105.2	69%	0.692	55%	0.546	S	S	*	.			trans	-63.7	116.1	171.5	-179.5	0	0	0	0	109.2	S753 F757	S753-S755 PolarHBondContact O-N 3.21Å; S755-F757 VanDerWaalsContact C-N 3.34Å
756	L	36.8	Very low	48.5	Very low	118 Å²	118	111.4 Å²	111.4	62%	0.618	58%	0.579	S	S	*	*			trans	-92	13.7	-173.9	-79.2	163	0	0	0	113.8	A754 Q758 Y786	A754-L756 PolarHBondContact O-N 2.88Å; L756-Q758 PolarHBondContact O-N 3.37Å; L756-Y786 HydrophobicContact CD1-CE1 4.2Å
757	F	34.7	Very low	47	Very low	145 Å²	145	110.4 Å²	110.4	64%	0.636	58%	0.58	S	S	*	*			trans	-89.8	102	-178.9	-58	-76	0	0	0	111.1	S755	S755-F757 VanDerWaalsContact C-N 3.34Å
758	Q	33.3	Very low	45.3	Very low	191 Å²	191	116.5 Å²	116.5	89%	0.893	60%	0.603	S	S	*	*			trans	-123.2	116.9	159.4	-78.2	-174.8	-7.1	0	0	109.5	L756	L756-Q758 PolarHBondContact O-N 3.37Å
759	E	33	Very low	43.8	Very low	184 Å²	184	118 Å²	118	86%	0.86	62%	0.62	S	S	*	*			trans	32.8	109.5	162.8	-63.7	-178.7	172.4	0	0	119.6	E761	E759-E761 PolarHBondContact O-N 3.16Å; E759-E761 VanDerWaalsContact O-N 3.16Å
760	D	36.7	Very low	42.4	Very low	128 Å²	128	123.7 Å²	123.7	68%	0.684	64%	0.635	S	S	*	*			trans	10.6	71.9	145.9	-52.8	-5.4	0	0	0	119.6	M779	D760-M779 WeakPolarHBondContact OD1-CE 3.43Å
761	E	37.5	Very low	41.4	Very low	138 Å²	138	124 Å²	124	65%	0.645	63%	0.634	S	S	*	*			trans	-129.6	132.1	159.3	-75.5	-172.9	164.2	0	0	112.6	E759	E759-E761 PolarHBondContact O-N 3.16Å; E759-E761 VanDerWaalsContact O-N 3.16Å
762	L	43.7	Very low	41.2	Very low	117 Å²	117	116 Å²	116	61%	0.613	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-80.3	151.1	-179.6	-70.4	164.2	0	0	0	112.2	L778	L762-L778 HydrophobicContact CD2-CB 4.33Å; L762-L778 HydrophobicContact CD2-CD2 3.53Å; L762-L778 HydrophobicContact CD2-CG 4.46Å; L762-L778 WeakPolarHBondContact CD2-O 3.39Å
763	C	44.1	Very low	40.9	Very low	27 Å²	27	109.5 Å²	109.5	18%	0.182	59%	0.587	C	S	.	*	P	Polyproline II helix	trans	-59.4	130.1	179.4	-70.2	0	0	0	0	113.2	C777	C763-C777 VanDerWaalsContact SG-SG 3.66Å
764	P	45.9	Very low	41	Very low	56 Å²	56	107 Å²	107	36%	0.364	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-60.4	150.8	170.8	-19.4	30.1	0	0	0	112	D766 M767	P764-D766 PolarHBondContact O-N 3.22Å; P764-D766 VanDerWaalsContact O-N 3.15Å; P764-M767 PolarHBondContact O-N 3.15Å; P764-M767 VanDerWaalsContact O-N 3.12Å
765	P	49.4	Very low	41.3	Very low	89 Å²	89	104 Å²	104	58%	0.578	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-53.3	-38	-177.1	-23.7	32.6	0	0	0	113.8	M767 R768	P765-M767 PolarHBondContact O-N 3.22Å; P765-R768 WeakPolarHBondContact O-CG 3.32Å; P765-R768 PolarHBondContact O-N 3.26Å
766	D	47.1	Very low	41.5	Very low	133 Å²	133	104.6 Å²	104.6	71%	0.711	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-68.8	-18.3	-173.8	-35.8	-27.4	0	0	0	112.8	P764	P764-D766 PolarHBondContact O-N 3.22Å; P764-D766 VanDerWaalsContact O-N 3.15Å
767	M	47.2	Very low	41.9	Very low	87 Å²	87	99.9 Å²	99.9	43%	0.429	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-102.8	1.8	-177.1	-69.8	-67.3	-161.9	0	0	113.5	P764 P765 D769 F770 C771 P782	P764-M767 PolarHBondContact O-N 3.15Å; P764-M767 VanDerWaalsContact O-N 3.12Å; P765-M767 PolarHBondContact O-N 3.22Å; M767-D769 PolarHBondContact O-N 3.12Å; M767-F770 PolarHBondContact O-N 3.15Å; M767-F770 HydrophobicContact SD-CD2 3.85Å; M767-F770 HydrophobicContact SD-CE2 4.35Å; M767-C771 PolarHBondContact O-N 3.21Å; M767-P782 HydrophobicContact CG-CB 4.47Å
768	R	45.9	Very low	42	Very low	130 Å²	130	99.1 Å²	99.1	49%	0.491	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-62.6	-31.1	177.8	-66.8	-173.9	-176.1	-171.6	3	112.7	P765 F770 C771	P765-R768 WeakPolarHBondContact O-CG 3.32Å; P765-R768 PolarHBondContact O-N 3.26Å; R768-F770 VanDerWaalsContact C-N 3.29Å; R768-F770 PolarHBondContact O-N 3.3Å; R768-C771 WeakPolarHBondContact O-CB 3.27Å; R768-C771 PolarHBondContact O-N 3.12Å
769	D	44.2	Very low	42	Very low	151 Å²	151	94.3 Å²	94.3	81%	0.807	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-71.8	-22.7	-179.7	-65.9	-18.1	0	0	0	113	M767	M767-D769 PolarHBondContact O-N 3.12Å
770	F	42.9	Very low	42.2	Very low	171 Å²	171	88.8 Å²	88.8	75%	0.75	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-91.2	-9.1	175.4	-61.3	-82	0	0	0	112.6	M767 R768	M767-F770 PolarHBondContact O-N 3.15Å; M767-F770 HydrophobicContact SD-CD2 3.85Å; M767-F770 HydrophobicContact SD-CE2 4.35Å; R768-F770 VanDerWaalsContact C-N 3.29Å; R768-F770 PolarHBondContact O-N 3.3Å
771	C	40.5	Very low	42.1	Very low	24 Å²	24	90.9 Å²	90.9	16%	0.162	49%	0.489	C	S	.	.			trans	-82.7	120.7	177.4	-179.1	0	0	0	0	110.1	M767 R768 N773 G774 C777	M767-C771 PolarHBondContact O-N 3.21Å; R768-C771 WeakPolarHBondContact O-CB 3.27Å; R768-C771 PolarHBondContact O-N 3.12Å; C771-N773 PolarHBondContact O-N 2.77Å; C771-N773 PolarHBondContact SG-N 3.03Å; C771-N773 VanDerWaalsContact SG-N 3.39Å; C771-G774 PolarHBondContact O-N 3.13Å; C771-C777 PolarHBondContact SG-SG 2.82Å
772	S	45.3	Very low	41.9	Very low	83 Å²	83	87.5 Å²	87.5	58%	0.58	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.5	174	-31.5	0	0	0	0	113
773	N	39.3	Very low	41.5	Very low	38 Å²	38	86.1 Å²	86.1	20%	0.203	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	17.4	179.1	-66.3	-9.4	0	0	0	113.3	C771 G775 T776 C788	C771-N773 PolarHBondContact O-N 2.77Å; C771-N773 PolarHBondContact SG-N 3.03Å; C771-N773 VanDerWaalsContact SG-N 3.39Å; N773-G775 PolarHBondContact O-N 3.48Å; N773-G775 VanDerWaalsContact O-N 3.12Å; N773-T776 PolarHBondContact O-N 3.09Å; N773-T776 PolarHBondContact O-OG1 2.56Å; N773-C788 VanDerWaalsContact ND2-CB 3.35Å; N773-C788 WeakPolarHBondContact ND2-CB 3.5Å
774	G	42.8	Very low	41.3	Very low	55 Å²	55	90.3 Å²	90.3	57%	0.567	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	29.3	172.8	0	0	0	0	0	114.9	C771	C771-G774 PolarHBondContact O-N 3.13Å
775	G	41.2	Very low	41	Very low	20 Å²	20	90.1 Å²	90.1	21%	0.206	50%	0.504	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	15.2	178.4	0	0	0	0	0	116.2	N773	N773-G775 PolarHBondContact O-N 3.48Å; N773-G775 VanDerWaalsContact O-N 3.12Å
776	T	40.6	Very low	40.5	Very low	112 Å²	112	89.9 Å²	89.9	69%	0.687	49%	0.492	S	S	*	.			trans	-99.7	6.2	178.7	53.3	0	0	0	0	115.1	N773	N773-T776 PolarHBondContact O-N 3.09Å; N773-T776 PolarHBondContact O-OG1 2.56Å
777	C	44.2	Very low	40	Very low	18 Å²	18	86.1 Å²	86.1	12%	0.122	47%	0.471	C	S	.	.			trans	-77.9	125.9	175	54.2	0	0	0	0	111.2	C763 C771	C763-C777 VanDerWaalsContact SG-SG 3.66Å; C771-C777 PolarHBondContact SG-SG 2.82Å
778	L	37.2	Very low	39.5	Very low	130 Å²	130	83.1 Å²	83.1	68%	0.681	46%	0.459	S	S	*	.	S	Bend	trans	-81.7	-9.5	-173.6	-79.8	171.5	0	0	0	115	L762	L762-L778 HydrophobicContact CD2-CB 4.33Å; L762-L778 HydrophobicContact CD2-CD2 3.53Å; L762-L778 HydrophobicContact CD2-CG 4.46Å; L762-L778 WeakPolarHBondContact CD2-O 3.39Å
779	M	32.2	Very low	39	Very low	89 Å²	89	83.5 Å²	83.5	44%	0.438	46%	0.46	S	S	.	.	S	Bend	trans	-150.6	110.6	-171.5	-58.8	-69	-86.6	0	0	108.2	D760	D760-M779 WeakPolarHBondContact OD1-CE 3.43Å
780	H	39.1	Very low	38.3	Very low	69 Å²	69	83.6 Å²	83.6	32%	0.319	45%	0.45	S	S	.	.			trans	179.9	138.3	152.8	-77.4	138.1	0	0	0	110.2	C788	H780-C788 VanDerWaalsContact CE1-SG 3.51Å; H780-C788 PolarHBondContact ND1-SG 3.49Å
781	K	34	Very low	37.6	Very low	171 Å²	171	80 Å²	80	74%	0.743	44%	0.442	S	S	*	.			trans	-74.3	125.7	161.8	-142.2	172.8	-168.3	168	0	108.4	T783	K781-T783 PolarHBondContact O-N 3.1Å
782	P	33.6	Very low	36.9	Very low	67 Å²	67	80.2 Å²	80.2	44%	0.435	45%	0.448	S	S	.	.			trans	-67.2	104.2	-173.6	25.1	-31.9	0	0	0	110.5	M767	M767-P782 HydrophobicContact CG-CB 4.47Å
783	T	33.7	Very low	35.9	Very low	89 Å²	89	79.6 Å²	79.6	55%	0.546	45%	0.449	S	S	.	.			trans	-125.5	137.2	155.9	43	0	0	0	0	106.4	K781 T785	K781-T783 PolarHBondContact O-N 3.1Å; T783-T785 PolarHBondContact O-N 3.34Å
784	S	40.6	Very low	35.2	Very low	115 Å²	115	86.1 Å²	86.1	80%	0.804	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	22.6	-166.3	45.1	0	0	0	0	115.6
785	T	39.2	Very low	34.9	Very low	51 Å²	51	87.7 Å²	87.7	31%	0.313	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	9.9	-163.3	43.4	0	0	0	0	115.7	T783	T783-T785 PolarHBondContact O-N 3.34Å
786	Y	40.5	Very low	34.5	Very low	85 Å²	85	91.3 Å²	91.3	33%	0.333	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	134.9	-177.4	-54.7	-77.1	0	0	0	113.7	A647 L756	A647-Y786 HydrophobicContact CB-CD1 4.45Å; L756-Y786 HydrophobicContact CD1-CE1 4.2Å
787	L	35.3	Very low	34.2	Very low	53 Å²	53	90.1 Å²	90.1	28%	0.277	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	113.4	165.3	-105.1	156.2	0	0	0	107.9	I650 R789	I650-L787 HydrophobicContact CD1-CB 3.8Å; I650-L787 HydrophobicContact CD1-CD1 3.71Å; I650-L787 HydrophobicContact CD1-CG 3.77Å; I650-L787 HydrophobicContact CG1-CB 4.43Å; I650-L787 HydrophobicContact CG1-CD1 4.43Å; L787-R789 PolarHBondContact O-N 3.02Å
788	C	37.2	Very low	33.6	Very low	24 Å²	24	94.4 Å²	94.4	16%	0.162	52%	0.519	C	S	.	.			trans	-67.6	118.6	167.9	-81.3	0	0	0	0	109.4	N773 H780 Y790	N773-C788 VanDerWaalsContact ND2-CB 3.35Å; N773-C788 WeakPolarHBondContact ND2-CB 3.5Å; H780-C788 VanDerWaalsContact CE1-SG 3.51Å; H780-C788 PolarHBondContact ND1-SG 3.49Å; C788-Y790 PolarHBondContact O-N 3.22Å
789	R	34.4	Very low	33.4	Very low	138 Å²	138	92.1 Å²	92.1	52%	0.521	51%	0.509	S	S	.	.			trans	-75.3	111.1	174	-151.4	-173.7	178.3	-158.3	-12	108.8	D643 L787 V791	D643-R789 IonicContact OD2-CZ 3.71Å; D643-R789 IonicContact OD2-NH1 2.75Å; D643-R789 PolarHBondContact OD2-NH1 3.12Å; D643-R789 IonicContact OD2-NH2 3.12Å; L787-R789 PolarHBondContact O-N 3.02Å; R789-V791 VanDerWaalsContact CD-CG2 3.46Å; R789-V791 HydrophobicContact CG-CG2 3.48Å; R789-V791 VanDerWaalsContact CG-CG2 3.48Å; R789-V791 VanDerWaalsContact CZ-CG2 3.42Å
790	Y	29.8	Very low	33.5	Very low	153 Å²	153	92.3 Å²	92.3	60%	0.6	51%	0.513	S	S	*	.			trans	-103.1	97.9	153.2	-166.8	-94.7	0	0	0	106.7	C788 G792	C788-Y790 PolarHBondContact O-N 3.22Å; Y790-G792 VanDerWaalsContact C-N 3.29Å; Y790-G792 WeakPolarHBondContact CD1-O 3.33Å; Y790-G792 WeakPolarHBondContact CE1-O 3.47Å; Y790-G792 PolarHBondContact O-N 3.03Å; Y790-G792 VanDerWaalsContact O-N 3.11Å
791	V	28.9	Very low	33.1	Very low	95 Å²	95	94 Å²	94	58%	0.576	53%	0.527	S	S	*	.			trans	-82.8	85.1	170.4	-166.6	0	0	0	0	107.3	R789	R789-V791 VanDerWaalsContact CD-CG2 3.46Å; R789-V791 HydrophobicContact CG-CG2 3.48Å; R789-V791 VanDerWaalsContact CG-CG2 3.48Å; R789-V791 VanDerWaalsContact CZ-CG2 3.42Å
792	G	24.8	Very low	33	Very low	29 Å²	29	88.1 Å²	88.1	30%	0.299	51%	0.51	S	S	.	.	S	Bend	trans	-165.8	103.4	173.1	0	0	0	0	0	109	R581 Y790 C794	R581-G792 PolarHBondContact NH2-O 3.3Å; R581-G792 VanDerWaalsContact NH2-O 3.13Å; Y790-G792 VanDerWaalsContact C-N 3.29Å; Y790-G792 WeakPolarHBondContact CD1-O 3.33Å; Y790-G792 WeakPolarHBondContact CE1-O 3.47Å; Y790-G792 PolarHBondContact O-N 3.03Å; Y790-G792 VanDerWaalsContact O-N 3.11Å; G792-C794 PolarHBondContact O-N 3.28Å; G792-C794 VanDerWaalsContact O-N 3.14Å
793	A	24.6	Very low	32.9	Very low	71 Å²	71	89.8 Å²	89.8	59%	0.587	52%	0.517	S	S	*	.			trans	-39.6	118.5	-179.9	0	0	0	0	0	111.8	R581	R581-A793 PolarHBondContact NH1-O 3.47Å; R581-A793 PolarHBondContact NH2-O 2.88Å
794	C	26.3	Very low	32.9	Very low	175 Å²	175	89.9 Å²	89.9	100%	1.182	51%	0.514	S	S	*	.			trans	-111.6	0	155.5	-150.1	0	0	0	0	106.6	R581 G792	R581-C794 PolarHBondContact NH1-SG 3.49Å; G792-C794 PolarHBondContact O-N 3.28Å; G792-C794 VanDerWaalsContact O-N 3.14Å

Retrieved 794 of 794 residues in 310.8 ms (Link to these results)

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