A0A087XG93_POEFO Loading...

Alpha-catulin

AlphaFold DB , UniProt , Accession A0A087XG93, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 756 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.7	Very low	24.6	Very low	252 Å²	252	133.5 Å²	133.5	100%	1.241	83%	0.829	S	S	*	*				0	127.4	0	-70.6	169.5	171.4	0	0	107.4
2	A	22.6	Very low	24.8	Very low	109 Å²	109	136.3 Å²	136.3	90%	0.901	83%	0.834	S	S	*	*			trans	-146.9	136.8	174.8	0	0	0	0	0	107.7
3	S	21.7	Very low	25.5	Very low	117 Å²	117	132.7 Å²	132.7	82%	0.818	82%	0.818	S	S	*	*			trans	-124.3	110.4	-172.6	52.1	0	0	0	0	110.4
4	S	20.5	Very low	26.4	Very low	111 Å²	111	128.2 Å²	128.2	78%	0.776	81%	0.811	S	S	*	*			trans	-69.7	135.1	175.1	-52.6	0	0	0	0	111.3	C6	S4-C6 PolarHBondContact O-N 3.26Å
5	P	26.2	Very low	28.4	Very low	127 Å²	127	126.1 Å²	126.1	83%	0.825	79%	0.791	S	S	*	*			trans	-84.5	106.3	164.8	32	-29.3	0	0	0	109.8	G7	P5-G7 PolarHBondContact O-N 3.48Å
6	C	23	Very low	30.5	Very low	126 Å²	126	126.5 Å²	126.5	85%	0.851	78%	0.78	S	S	*	*			trans	-72.3	106	165	-68.2	0	0	0	0	109.2	S4	S4-C6 PolarHBondContact O-N 3.26Å
7	G	22.4	Very low	33.4	Very low	72 Å²	72	121.9 Å²	121.9	74%	0.742	75%	0.749	S	S	*	*			trans	-84.3	124	171.2	0	0	0	0	0	111.1	P5 S9	P5-G7 PolarHBondContact O-N 3.48Å; G7-S9 PolarHBondContact O-N 2.99Å
8	N	22.1	Very low	36	Very low	158 Å²	158	119 Å²	119	85%	0.845	72%	0.724	S	S	*	*			trans	-60.3	129.4	174.1	-78.8	-11	0	0	0	110.6	N10	N8-N10 PolarHBondContact O-N 2.93Å
9	S	25.3	Very low	38.5	Very low	89 Å²	89	112.9 Å²	112.9	62%	0.622	69%	0.687	S	S	*	*			trans	-79.4	104.8	175.1	44.3	0	0	0	0	110.9	G7 F11	G7-S9 PolarHBondContact O-N 2.99Å; S9-F11 PolarHBondContact O-N 3.01Å
10	N	26.1	Very low	40.8	Very low	152 Å²	152	111.1 Å²	111.1	81%	0.813	67%	0.667	S	S	*	*			trans	-67.5	80.6	165.7	-80.5	-8.1	0	0	0	109.8	N8 D12	N8-N10 PolarHBondContact O-N 2.93Å; N10-D12 PolarHBondContact O-N 3.13Å
11	F	33.2	Very low	42.9	Very low	156 Å²	156	108 Å²	108	68%	0.684	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	3	179.2	-106.5	-69.6	0	0	0	114.4	S9 S13	S9-F11 PolarHBondContact O-N 3.01Å; F11-S13 PolarHBondContact O-N 2.7Å
12	D	26.7	Very low	45.5	Very low	167 Å²	167	96.4 Å²	96.4	89%	0.893	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	7.6	178.5	-137.1	17.7	0	0	0	113	N10 G14	N10-D12 PolarHBondContact O-N 3.13Å; D12-G14 PolarHBondContact O-N 3.44Å
13	S	34.1	Very low	48.3	Very low	89 Å²	89	94.3 Å²	94.3	62%	0.622	57%	0.566	S	S	*	*	S	Bend	trans	-65.4	110.1	164.4	56.4	0	0	0	0	109.3	F11	F11-S13 PolarHBondContact O-N 2.7Å
14	G	38.5	Very low	51.1	Low	70 Å²	70	95.1 Å²	95.1	72%	0.722	56%	0.557	S	S	*	*			trans	-49.8	138.3	-166.4	0	0	0	0	0	115.7	D12 E16	D12-G14 PolarHBondContact O-N 3.44Å; G14-E16 PolarHBondContact O-N 3.12Å
15	L	55.6	Low	53.9	Low	97 Å²	97	93 Å²	93	51%	0.508	54%	0.539	S	S	.	.			trans	-69.9	74.8	176.1	-68.4	166.2	0	0	0	111.1	I17 T138	L15-I17 PolarHBondContact O-N 3.49Å; L15-T138 HydrophobicContact CB-CG2 4.16Å; L15-T138 HydrophobicContact CD1-CG2 3.96Å
16	E	62.1	Low	56.4	Low	132 Å²	132	87.2 Å²	87.2	62%	0.617	50%	0.501	S	S	*	.			trans	-62.9	119.9	176	-175.8	-176.7	-143.8	0	0	110.8	G14 K18	G14-E16 PolarHBondContact O-N 3.12Å; E16-K18 HydrophobicContact CG-CG 4.25Å; E16-K18 WeakPolarHBondContact O-CG 3.47Å; E16-K18 PolarHBondContact O-N 3.4Å; E16-K18 WeakPolarHBondContact OE2-CE 3.48Å; E16-K18 IonicContact OE2-NZ 3.99Å; E16-K18 PolarHBondContact OE2-NZ 3.11Å
17	I	79.6	Confident	58.9	Low	49 Å²	49	86.1 Å²	86.1	25%	0.251	49%	0.486	S	S	.	.			trans	-85.5	106.9	-179.2	-59.6	160.9	0	0	0	109.5	L15 V22 E23 L26 K201	L15-I17 PolarHBondContact O-N 3.49Å; I17-V22 HydrophobicContact CG1-CG1 4.42Å; I17-V22 HydrophobicContact CG2-CB 3.96Å; I17-V22 HydrophobicContact CG2-CG1 3.75Å; I17-E23 HydrophobicContact CG2-CB 3.81Å; I17-L26 HydrophobicContact CD1-CD1 3.57Å; I17-L26 HydrophobicContact CG1-CD1 4.15Å; I17-K201 WeakPolarHBondContact O-CD 3.3Å; I17-K201 PolarHBondContact O-NZ 2.9Å
18	K	80	Confident	61.3	Low	69 Å²	69	85.6 Å²	85.6	30%	0.3	47%	0.469	S	S	.	.			trans	-97.9	-13.4	-170.1	-45	-161.9	-175.5	-151.9	0	114.6	E16 K201 E263	E16-K18 HydrophobicContact CG-CG 4.25Å; E16-K18 WeakPolarHBondContact O-CG 3.47Å; E16-K18 PolarHBondContact O-N 3.4Å; E16-K18 WeakPolarHBondContact OE2-CE 3.48Å; E16-K18 IonicContact OE2-NZ 3.99Å; E16-K18 PolarHBondContact OE2-NZ 3.11Å; K18-K201 WeakPolarHBondContact O-CB 3.48Å; K18-K201 PolarHBondContact O-N 3.47Å; K18-E263 VanDerWaalsContact CD-OE1 3.25Å; K18-E263 WeakPolarHBondContact CD-OE1 3.39Å; K18-E263 IonicContact NZ-OE1 3.31Å; K18-E263 PolarHBondContact NZ-OE1 3.2Å; K18-E263 IonicContact NZ-OE2 3.49Å; K18-E263 PolarHBondContact NZ-OE2 2.94Å
19	T	84.7	Confident	63.6	Low	3 Å²	3	79.2 Å²	79.2	2%	0.018	44%	0.435	C	S	.	.	B	Isolated β-bridge	trans	-117.7	145.9	-178.2	34.1	0	0	0	0	112.7	S21 V22 E23 D145 R196 D199	T19-S21 VanDerWaalsContact C-N 3.35Å; T19-V22 WeakPolarHBondContact OG1-CG2 3.24Å; T19-E23 WeakPolarHBondContact O-CB 3.39Å; T19-E23 PolarHBondContact O-N 2.83Å; T19-D145 VanDerWaalsContact CG2-OD1 3.26Å; T19-D145 WeakPolarHBondContact CG2-OD1 3.45Å; T19-D145 PolarHBondContact OG1-OD1 2.94Å; T19-R196 VanDerWaalsContact CG2-NH1 3.31Å; T19-D199 CarbonylContact C-O 3.6Å; T19-D199 VanDerWaalsContact CA-O 3.32Å; T19-D199 WeakPolarHBondContact CA-O 2.97Å; T19-D199 WeakPolarHBondContact CB-OD2 3.28Å; T19-D199 HydrophobicContact CG2-CB 4.29Å; T19-D199 VanDerWaalsContact CG2-OD2 3.26Å; T19-D199 WeakPolarHBondContact CG2-OD2 3.43Å
20	R	85	Confident	65.9	Low	76 Å²	76	77.9 Å²	77.9	29%	0.287	42%	0.423	S	S	.	.	H	α-helix	trans	-70	-34.6	-179	-62.7	173.3	-156.8	-113.7	-5.2	110.7	E23 Q24 N198 D199 L200 K201 E203	R20-E23 PolarHBondContact O-N 3.06Å; R20-Q24 VanDerWaalsContact O-CB 3.24Å; R20-Q24 WeakPolarHBondContact O-CB 3.44Å; R20-Q24 WeakPolarHBondContact O-CG 3.34Å; R20-Q24 PolarHBondContact O-N 3.28Å; R20-N198 PolarHBondContact NE-O 2.95Å; R20-D199 WeakPolarHBondContact CG-O 3.39Å; R20-D199 PolarHBondContact N-O 3.32Å; R20-D199 PolarHBondContact N-OD1 3.2Å; R20-L200 PolarHBondContact NE-O 2.99Å; R20-L200 PolarHBondContact NH2-O 3.35Å; R20-K201 HydrophobicContact CG-CG 3.72Å; R20-E203 IonicContact CZ-OE1 3.88Å; R20-E203 IonicContact NH1-OE1 2.9Å; R20-E203 IonicContact NH2-OE1 2.69Å; R20-E203 PolarHBondContact NH2-OE1 3.44Å
21	S	83	Confident	68	Low	48 Å²	48	73.9 Å²	73.9	34%	0.336	41%	0.407	S	S	.	.	H	α-helix	trans	-58.8	-49.8	176.4	58.1	0	0	0	0	112.7	T19 T25 D199	T19-S21 VanDerWaalsContact C-N 3.35Å; S21-T25 WeakPolarHBondContact O-CB 3.41Å; S21-T25 PolarHBondContact O-N 3.33Å; S21-T25 VanDerWaalsContact O-N 3.11Å; S21-T25 PolarHBondContact O-OG1 2.79Å; S21-D199 VanDerWaalsContact CB-OD1 3.31Å; S21-D199 WeakPolarHBondContact CB-OD1 3.33Å; S21-D199 WeakPolarHBondContact CB-OD2 3.49Å; S21-D199 PolarHBondContact N-OD1 3.38Å; S21-D199 VanDerWaalsContact OG-CG 3.28Å; S21-D199 PolarHBondContact OG-OD1 2.84Å; S21-D199 PolarHBondContact OG-OD2 2.97Å
22	V	84	Confident	69.6	Low	8 Å²	8	71.5 Å²	71.5	5%	0.048	40%	0.398	C	S	.	.	H	α-helix	trans	-65.8	-44.5	176.4	176.3	0	0	0	0	110.7	I17 T19 T25 L26 L141	I17-V22 HydrophobicContact CG1-CG1 4.42Å; I17-V22 HydrophobicContact CG2-CB 3.96Å; I17-V22 HydrophobicContact CG2-CG1 3.75Å; T19-V22 WeakPolarHBondContact OG1-CG2 3.24Å; V22-T25 PolarHBondContact O-N 3.44Å; V22-L26 HydrophobicContact CG1-CD1 3.78Å; V22-L26 WeakPolarHBondContact O-CB 3.36Å; V22-L26 WeakPolarHBondContact O-CG 3.32Å; V22-L26 PolarHBondContact O-N 3.41Å; V22-L141 HydrophobicContact CG1-CB 3.87Å; V22-L141 HydrophobicContact CG1-CD1 4.16Å; V22-L141 HydrophobicContact CG2-CB 4.13Å
23	E	80.7	Confident	71.5	Confident	65 Å²	65	64.2 Å²	64.2	30%	0.304	36%	0.359	S	S	.	.	H	α-helix	trans	-60.4	-50.9	176.6	177.6	159.8	-105.6	0	0	112.7	I17 T19 R20 T25 L26 I27 K201	I17-E23 HydrophobicContact CG2-CB 3.81Å; T19-E23 WeakPolarHBondContact O-CB 3.39Å; T19-E23 PolarHBondContact O-N 2.83Å; R20-E23 PolarHBondContact O-N 3.06Å; E23-T25 PolarHBondContact O-N 2.95Å; E23-L26 PolarHBondContact O-N 3.4Å; E23-L26 VanDerWaalsContact O-N 3.1Å; E23-I27 HydrophobicContact CG-CD1 3.79Å; E23-I27 HydrophobicContact CG-CG1 4.35Å; E23-I27 VanDerWaalsContact O-CG1 3.3Å; E23-I27 WeakPolarHBondContact O-CG1 3.3Å; E23-I27 PolarHBondContact O-N 3.44Å; E23-K201 HydrophobicContact CB-CD 4.45Å; E23-K201 VanDerWaalsContact CD-NZ 3.28Å; E23-K201 WeakPolarHBondContact OE1-CE 3.31Å; E23-K201 IonicContact OE1-NZ 2.88Å; E23-K201 PolarHBondContact OE1-NZ 2.83Å; E23-K201 VanDerWaalsContact OE2-CD 3.28Å; E23-K201 WeakPolarHBondContact OE2-CD 3.45Å; E23-K201 WeakPolarHBondContact OE2-CE 3.22Å; E23-K201 IonicContact OE2-NZ 3.95Å; E23-K201 PolarHBondContact OE2-NZ 3.08Å
24	Q	80.8	Confident	73.2	Confident	134 Å²	134	62.9 Å²	62.9	63%	0.626	35%	0.347	S	S	*	.	H	α-helix	trans	-63.3	-29.2	179.2	-73.3	170.8	9.8	0	0	112.7	R20 P28	R20-Q24 VanDerWaalsContact O-CB 3.24Å; R20-Q24 WeakPolarHBondContact O-CB 3.44Å; R20-Q24 WeakPolarHBondContact O-CG 3.34Å; R20-Q24 PolarHBondContact O-N 3.28Å; Q24-P28 WeakPolarHBondContact O-CD 3.43Å
25	T	79.1	Confident	74.5	Confident	67 Å²	67	64.1 Å²	64.1	41%	0.411	34%	0.341	S	S	.	.	H	α-helix	trans	-76.9	-33.6	175	-56.8	0	0	0	0	111.8	S21 V22 E23 L141	S21-T25 WeakPolarHBondContact O-CB 3.41Å; S21-T25 PolarHBondContact O-N 3.33Å; S21-T25 VanDerWaalsContact O-N 3.11Å; S21-T25 PolarHBondContact O-OG1 2.79Å; V22-T25 PolarHBondContact O-N 3.44Å; E23-T25 PolarHBondContact O-N 2.95Å; T25-L141 HydrophobicContact CG2-CD1 3.88Å; T25-L141 HydrophobicContact CG2-CD2 4.13Å
26	L	79.4	Confident	74.9	Confident	5 Å²	5	61 Å²	61	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-82.1	-35	-180	-71.9	170.5	0	0	0	113.7	I17 V22 E23 L29 V30 L134 V137 T138 L141	I17-L26 HydrophobicContact CD1-CD1 3.57Å; I17-L26 HydrophobicContact CG1-CD1 4.15Å; V22-L26 HydrophobicContact CG1-CD1 3.78Å; V22-L26 WeakPolarHBondContact O-CB 3.36Å; V22-L26 WeakPolarHBondContact O-CG 3.32Å; V22-L26 PolarHBondContact O-N 3.41Å; E23-L26 PolarHBondContact O-N 3.4Å; E23-L26 VanDerWaalsContact O-N 3.1Å; L26-L29 HydrophobicContact CD2-CD2 4.42Å; L26-L29 PolarHBondContact O-N 3.01Å; L26-L29 VanDerWaalsContact O-N 3.08Å; L26-V30 WeakPolarHBondContact O-CG2 3.5Å; L26-V30 PolarHBondContact O-N 2.99Å; L26-L134 HydrophobicContact CD2-CD1 4.02Å; L26-V137 HydrophobicContact CD2-CG1 4Å; L26-T138 HydrophobicContact CD1-CG2 4.04Å; L26-T138 WeakPolarHBondContact CD2-OG1 3.28Å; L26-L141 HydrophobicContact CD1-CD1 4.2Å; L26-L141 HydrophobicContact CD2-CD1 3.84Å; L26-L141 HydrophobicContact CG-CD1 3.7Å
27	I	74.9	Confident	75.1	Confident	103 Å²	103	56.4 Å²	56.4	53%	0.528	30%	0.303	S	S	.	.	H	α-helix	trans	-46.8	-53.4	178.1	-76.3	163.9	0	0	0	113.8	E23 L29 V30 S31	E23-I27 HydrophobicContact CG-CD1 3.79Å; E23-I27 HydrophobicContact CG-CG1 4.35Å; E23-I27 VanDerWaalsContact O-CG1 3.3Å; E23-I27 WeakPolarHBondContact O-CG1 3.3Å; E23-I27 PolarHBondContact O-N 3.44Å; I27-L29 VanDerWaalsContact C-N 3.34Å; I27-L29 PolarHBondContact O-N 2.97Å; I27-V30 PolarHBondContact O-N 3.33Å; I27-S31 WeakPolarHBondContact O-CB 3.41Å; I27-S31 PolarHBondContact O-N 3.48Å
28	P	71.6	Confident	74.2	Confident	60 Å²	60	59.1 Å²	59.1	39%	0.39	32%	0.319	S	S	.	.	H	α-helix	trans	-67.1	-34.4	-179.7	25.7	-34.3	0	0	0	112.5	Q24 S31 Q32	Q24-P28 WeakPolarHBondContact O-CD 3.43Å; P28-S31 PolarHBondContact O-N 3.26Å; P28-Q32 WeakPolarHBondContact O-CB 3.25Å; P28-Q32 VanDerWaalsContact O-CG 3.25Å; P28-Q32 WeakPolarHBondContact O-CG 3.37Å; P28-Q32 PolarHBondContact O-N 3.36Å
29	L	71.3	Confident	73.2	Confident	25 Å²	25	59.7 Å²	59.7	13%	0.131	32%	0.322	C	S	.	.	H	α-helix	trans	-67.9	-44.1	176.7	-178.6	62.7	0	0	0	111.4	L26 I27 S31 Q32 I33 L133 L134 V137	L26-L29 HydrophobicContact CD2-CD2 4.42Å; L26-L29 PolarHBondContact O-N 3.01Å; L26-L29 VanDerWaalsContact O-N 3.08Å; I27-L29 VanDerWaalsContact C-N 3.34Å; I27-L29 PolarHBondContact O-N 2.97Å; L29-S31 VanDerWaalsContact C-N 3.34Å; L29-S31 PolarHBondContact O-N 3.11Å; L29-Q32 PolarHBondContact O-N 3.43Å; L29-I33 HydrophobicContact CD1-CD1 3.86Å; L29-I33 HydrophobicContact CD1-CG1 4.31Å; L29-I33 HydrophobicContact CG-CD1 3.84Å; L29-I33 VanDerWaalsContact O-CB 3.31Å; L29-I33 WeakPolarHBondContact O-CB 3.3Å; L29-I33 VanDerWaalsContact O-CG1 3.28Å; L29-I33 WeakPolarHBondContact O-CG1 3.16Å; L29-I33 PolarHBondContact O-N 2.96Å; L29-L133 HydrophobicContact CD1-CD2 4.2Å; L29-L134 HydrophobicContact CD2-CD1 4.27Å; L29-V137 HydrophobicContact CD2-CB 3.87Å; L29-V137 HydrophobicContact CD2-CG1 3.71Å; L29-V137 HydrophobicContact CD2-CG2 4.02Å
30	V	73.8	Confident	71.3	Confident	60 Å²	60	67.8 Å²	67.8	36%	0.364	36%	0.357	S	S	.	.	H	α-helix	trans	-60.8	-43.2	174.2	172.3	0	0	0	0	110.6	L26 I27 I33 T34 L134	L26-V30 WeakPolarHBondContact O-CG2 3.5Å; L26-V30 PolarHBondContact O-N 2.99Å; I27-V30 PolarHBondContact O-N 3.33Å; V30-I33 PolarHBondContact O-N 3.24Å; V30-T34 VanDerWaalsContact O-CB 3.22Å; V30-T34 WeakPolarHBondContact O-CB 3.39Å; V30-T34 PolarHBondContact O-N 3.39Å; V30-T34 PolarHBondContact O-OG1 3.2Å; V30-L134 HydrophobicContact CG2-CD1 3.6Å; V30-L134 HydrophobicContact CG2-CD2 4.09Å
31	S	69.6	Low	69.5	Low	68 Å²	68	68.5 Å²	68.5	48%	0.476	37%	0.367	S	S	.	.	H	α-helix	trans	-62.9	-46.6	177.1	-179.9	0	0	0	0	112.8	I27 P28 L29 T34 T35	I27-S31 WeakPolarHBondContact O-CB 3.41Å; I27-S31 PolarHBondContact O-N 3.48Å; P28-S31 PolarHBondContact O-N 3.26Å; L29-S31 VanDerWaalsContact C-N 3.34Å; L29-S31 PolarHBondContact O-N 3.11Å; S31-T34 PolarHBondContact O-N 3.31Å; S31-T35 WeakPolarHBondContact O-CB 3.33Å; S31-T35 PolarHBondContact O-N 2.85Å; S31-T35 PolarHBondContact O-OG1 2.94Å
32	Q	67	Low	67.8	Low	107 Å²	107	77.4 Å²	77.4	50%	0.5	39%	0.393	S	S	.	.	H	α-helix	trans	-63.6	-44.3	177	-71.9	169.9	13.8	0	0	112	P28 L29 T35 L36	P28-Q32 WeakPolarHBondContact O-CB 3.25Å; P28-Q32 VanDerWaalsContact O-CG 3.25Å; P28-Q32 WeakPolarHBondContact O-CG 3.37Å; P28-Q32 PolarHBondContact O-N 3.36Å; L29-Q32 PolarHBondContact O-N 3.43Å; Q32-T35 PolarHBondContact O-N 3.33Å; Q32-L36 WeakPolarHBondContact O-CG 3.32Å; Q32-L36 PolarHBondContact O-N 3.06Å
33	I	67.3	Low	66	Low	13 Å²	13	79.7 Å²	79.7	7%	0.067	41%	0.408	C	S	.	.	H	α-helix	trans	-62.9	-42.8	175.7	-74.9	171.7	0	0	0	111.3	L29 V30 T35 L36 I37 A130 L134	L29-I33 HydrophobicContact CD1-CD1 3.86Å; L29-I33 HydrophobicContact CD1-CG1 4.31Å; L29-I33 HydrophobicContact CG-CD1 3.84Å; L29-I33 VanDerWaalsContact O-CB 3.31Å; L29-I33 WeakPolarHBondContact O-CB 3.3Å; L29-I33 VanDerWaalsContact O-CG1 3.28Å; L29-I33 WeakPolarHBondContact O-CG1 3.16Å; L29-I33 PolarHBondContact O-N 2.96Å; V30-I33 PolarHBondContact O-N 3.24Å; I33-T35 PolarHBondContact O-N 3.04Å; I33-L36 PolarHBondContact O-N 2.91Å; I33-I37 HydrophobicContact CG2-CD1 3.68Å; I33-I37 HydrophobicContact CG2-CG1 4.44Å; I33-I37 WeakPolarHBondContact O-CB 3.39Å; I33-I37 VanDerWaalsContact O-CG1 3.3Å; I33-I37 WeakPolarHBondContact O-CG1 3.21Å; I33-I37 PolarHBondContact O-N 2.71Å; I33-A130 HydrophobicContact CD1-CB 4.49Å; I33-A130 HydrophobicContact CG1-CB 4.23Å; I33-A130 HydrophobicContact CG2-CB 3.87Å; I33-L134 HydrophobicContact CD1-CB 3.98Å
34	T	68.9	Low	64.5	Low	62 Å²	62	86.2 Å²	86.2	38%	0.38	44%	0.435	S	S	.	.	H	α-helix	trans	-63.6	-43.2	178.7	-60.4	0	0	0	0	110.8	V30 S31 I37 N38	V30-T34 VanDerWaalsContact O-CB 3.22Å; V30-T34 WeakPolarHBondContact O-CB 3.39Å; V30-T34 PolarHBondContact O-N 3.39Å; V30-T34 PolarHBondContact O-OG1 3.2Å; S31-T34 PolarHBondContact O-N 3.31Å; T34-I37 PolarHBondContact O-N 3.48Å; T34-N38 WeakPolarHBondContact CG2-ND2 3.47Å; T34-N38 VanDerWaalsContact O-CB 3.24Å; T34-N38 WeakPolarHBondContact O-CB 3.35Å; T34-N38 PolarHBondContact O-N 2.9Å
35	T	67	Low	63.1	Low	96 Å²	96	86.3 Å²	86.3	59%	0.589	43%	0.434	S	S	*	.	H	α-helix	trans	-61.3	-43.2	175.1	-59.2	0	0	0	0	112	S31 Q32 I33 H39	S31-T35 WeakPolarHBondContact O-CB 3.33Å; S31-T35 PolarHBondContact O-N 2.85Å; S31-T35 PolarHBondContact O-OG1 2.94Å; Q32-T35 PolarHBondContact O-N 3.33Å; I33-T35 PolarHBondContact O-N 3.04Å; T35-H39 PolarHBondContact O-N 2.93Å
36	L	63.5	Low	62.2	Low	31 Å²	31	85.8 Å²	85.8	16%	0.162	43%	0.433	C	S	.	.	H	α-helix	trans	-64.1	-38.9	176	-76.8	165.3	0	0	0	112.9	Q32 I33 V56 M126	Q32-L36 WeakPolarHBondContact O-CG 3.32Å; Q32-L36 PolarHBondContact O-N 3.06Å; I33-L36 PolarHBondContact O-N 2.91Å; L36-V56 HydrophobicContact CD1-CG1 4.35Å; L36-V56 HydrophobicContact CD2-CG1 4.1Å; L36-M126 VanDerWaalsContact O-CE 3.28Å; L36-M126 WeakPolarHBondContact O-CE 3.22Å
37	I	66.1	Low	61.4	Low	35 Å²	35	93.9 Å²	93.9	18%	0.179	47%	0.47	C	S	.	.	H	α-helix	trans	-77.6	-38.1	-178.2	-69.1	175	0	0	0	112.4	I33 T34 R123 V127 A130	I33-I37 HydrophobicContact CG2-CD1 3.68Å; I33-I37 HydrophobicContact CG2-CG1 4.44Å; I33-I37 WeakPolarHBondContact O-CB 3.39Å; I33-I37 VanDerWaalsContact O-CG1 3.3Å; I33-I37 WeakPolarHBondContact O-CG1 3.21Å; I33-I37 PolarHBondContact O-N 2.71Å; T34-I37 PolarHBondContact O-N 3.48Å; I37-R123 PolarHBondContact O-NH2 2.98Å; I37-V127 HydrophobicContact CD1-CG2 4.37Å; I37-V127 HydrophobicContact CG1-CG2 4.08Å; I37-V127 HydrophobicContact CG2-CG2 4.1Å; I37-A130 HydrophobicContact CD1-CB 4.24Å
38	N	60.8	Low	60.9	Low	107 Å²	107	99.4 Å²	99.4	57%	0.572	49%	0.485	S	S	*	.	H	α-helix	trans	-89	0.6	-174.2	-69.7	-11.7	0	0	0	114.4	T34 K40	T34-N38 WeakPolarHBondContact CG2-ND2 3.47Å; T34-N38 VanDerWaalsContact O-CB 3.24Å; T34-N38 WeakPolarHBondContact O-CB 3.35Å; T34-N38 PolarHBondContact O-N 2.9Å; N38-K40 PolarHBondContact O-N 3.07Å
39	H	59.6	Low	60.7	Low	80 Å²	80	98.9 Å²	98.9	37%	0.37	48%	0.48	S	S	.	.			trans	-55.6	114.5	173.9	-167.5	-60.1	0	0	0	110.5	T35	T35-H39 PolarHBondContact O-N 2.93Å
40	K	45	Very low	60.4	Low	173 Å²	173	99.7 Å²	99.7	75%	0.752	49%	0.488	S	S	*	.			trans	-61.1	146.6	-174.1	-72	178.8	177.6	172.4	0	111.9	N38 R42	N38-K40 PolarHBondContact O-N 3.07Å; K40-R42 PolarHBondContact O-N 3.29Å
41	D	45.8	Very low	60.3	Low	91 Å²	91	98.9 Å²	98.9	49%	0.487	49%	0.488	S	S	.	.	S	Bend	trans	-70.9	26.8	-176.8	-58.2	-94.3	0	0	0	115.3	R123	D41-R123 IonicContact OD1-CZ 3.83Å; D41-R123 IonicContact OD1-NH1 2.76Å; D41-R123 PolarHBondContact OD1-NH1 3.38Å; D41-R123 IonicContact OD2-CZ 3.76Å; D41-R123 IonicContact OD2-NH1 2.72Å; D41-R123 PolarHBondContact OD2-NH1 2.82Å
42	R	47.5	Very low	60.4	Low	235 Å²	235	97.9 Å²	97.9	89%	0.887	48%	0.484	S	S	*	.			trans	-143	89.8	175.8	-65.7	-173.6	179.8	-169.4	0.4	109	K40	K40-R42 PolarHBondContact O-N 3.29Å
43	P	45.8	Very low	60.7	Low	56 Å²	56	93.9 Å²	93.9	36%	0.364	47%	0.465	S	S	.	.				-128.2	160.6	103.9	37.1	-33.2	0	0	0	113.2	V119	P43-V119 HydrophobicContact CG-CG2 4.39Å
44	K	50.4	Low	61.2	Low	203 Å²	203	97.1 Å²	97.1	88%	0.883	48%	0.48	S	S	*	.			trans	-63.1	145.2	166.9	-64.9	178.4	179.9	177.6	0	109.1	S46	K44-S46 PolarHBondContact O-N 2.81Å
45	K	50.5	Low	61.7	Low	135 Å²	135	103 Å²	103	59%	0.587	50%	0.495	S	S	*	.			trans	-55.3	108.6	176.6	-80.5	-172.6	170	-177.7	0	110.9	V117	K45-V117 HydrophobicContact CD-CG1 3.94Å; K45-V117 VanDerWaalsContact CE-CG1 3.49Å; K45-V117 HydrophobicContact CG-CG1 4.48Å
46	S	61.2	Low	62.2	Low	56 Å²	56	101.5 Å²	101.5	39%	0.392	49%	0.486	S	S	.	.			trans	-101.5	138.2	158.7	-178.5	0	0	0	0	108.4	K44 R48 T49 S50	K44-S46 PolarHBondContact O-N 2.81Å; S46-R48 PolarHBondContact O-N 3.39Å; S46-T49 WeakPolarHBondContact O-CB 3.32Å; S46-T49 PolarHBondContact O-N 3.23Å; S46-S50 PolarHBondContact O-N 3.5Å; S46-S50 VanDerWaalsContact O-N 3.09Å
47	E	62.5	Low	63	Low	175 Å²	175	100.1 Å²	100.1	82%	0.818	48%	0.479	S	S	*	.	H	α-helix	trans	-56.6	-34.8	177.1	-62.2	178.7	135.4	0	0	111.7	T49 S50 A51	E47-T49 PolarHBondContact O-N 2.89Å; E47-S50 PolarHBondContact O-N 3.04Å; E47-A51 WeakPolarHBondContact O-CB 3.49Å; E47-A51 PolarHBondContact O-N 3.06Å
48	R	64.2	Low	63.9	Low	220 Å²	220	101.9 Å²	101.9	83%	0.83	49%	0.487	S	S	*	.	H	α-helix	trans	-59.8	-42.6	175.1	-67.6	-176.7	176.9	-178.1	-2.2	112.2	S46 A52	S46-R48 PolarHBondContact O-N 3.39Å; R48-A52 WeakPolarHBondContact O-CB 3.37Å; R48-A52 PolarHBondContact O-N 2.72Å
49	T	66.3	Low	64.9	Low	48 Å²	48	99.6 Å²	99.6	29%	0.294	48%	0.483	S	S	.	.	H	α-helix	trans	-68.3	-41.4	176.9	-46.8	0	0	0	0	111.1	S46 E47 A52 I53	S46-T49 WeakPolarHBondContact O-CB 3.32Å; S46-T49 PolarHBondContact O-N 3.23Å; E47-T49 PolarHBondContact O-N 2.89Å; T49-A52 PolarHBondContact O-N 2.76Å; T49-I53 HydrophobicContact CG2-CD1 4.23Å; T49-I53 WeakPolarHBondContact O-CG1 3.29Å; T49-I53 PolarHBondContact O-N 2.84Å
50	S	66.4	Low	66	Low	42 Å²	42	96.6 Å²	96.6	29%	0.294	47%	0.47	S	S	.	.	H	α-helix	trans	-63.5	-43	176.8	-156.2	0	0	0	0	111.9	S46 E47 I53 H54	S46-S50 PolarHBondContact O-N 3.5Å; S46-S50 VanDerWaalsContact O-N 3.09Å; E47-S50 PolarHBondContact O-N 3.04Å; S50-I53 PolarHBondContact O-N 3.41Å; S50-H54 PolarHBondContact O-N 3.06Å
51	A	71.5	Confident	68	Low	43 Å²	43	89.3 Å²	89.3	36%	0.355	44%	0.441	S	S	.	.	H	α-helix	trans	-66.2	-35	176.2	0	0	0	0	0	112.6	E47 R55	E47-A51 WeakPolarHBondContact O-CB 3.49Å; E47-A51 PolarHBondContact O-N 3.06Å; A51-R55 VanDerWaalsContact O-CG 3.26Å; A51-R55 WeakPolarHBondContact O-CG 3.2Å; A51-R55 PolarHBondContact O-N 3.25Å; A51-R55 VanDerWaalsContact O-N 3.13Å
52	A	72.1	Confident	69.9	Low	48 Å²	48	88.5 Å²	88.5	40%	0.397	44%	0.439	S	S	.	.	H	α-helix	trans	-64.5	-45.2	173.5	0	0	0	0	0	111.7	R48 T49 R55 V56	R48-A52 WeakPolarHBondContact O-CB 3.37Å; R48-A52 PolarHBondContact O-N 2.72Å; T49-A52 PolarHBondContact O-N 2.76Å; A52-R55 PolarHBondContact O-N 3.37Å; A52-V56 WeakPolarHBondContact O-CG2 3.44Å; A52-V56 PolarHBondContact O-N 3.02Å
53	I	72.5	Confident	71.7	Confident	22 Å²	22	80 Å²	80	11%	0.113	42%	0.419	C	S	.	.	H	α-helix	trans	-64.2	-42.7	179.6	-70.3	169.3	0	0	0	111.5	T49 S50 R55 V56 G57 T103 V119 F120	T49-I53 HydrophobicContact CG2-CD1 4.23Å; T49-I53 WeakPolarHBondContact O-CG1 3.29Å; T49-I53 PolarHBondContact O-N 2.84Å; S50-I53 PolarHBondContact O-N 3.41Å; I53-R55 PolarHBondContact O-N 3.27Å; I53-V56 PolarHBondContact O-N 3.22Å; I53-G57 PolarHBondContact O-N 3.24Å; I53-T103 HydrophobicContact CG2-CG2 3.72Å; I53-V119 HydrophobicContact CD1-CG1 3.31Å; I53-F120 HydrophobicContact CD1-CZ 4.34Å; I53-F120 HydrophobicContact CG2-CE1 3.84Å; I53-F120 HydrophobicContact CG2-CZ 4.41Å
54	H	78	Confident	73.8	Confident	82 Å²	82	77.8 Å²	77.8	38%	0.38	40%	0.404	S	S	.	.	H	α-helix	trans	-59.4	-45.4	173.7	179.2	-114.7	0	0	0	112.5	S50 V56 G57 Q58 D104	S50-H54 PolarHBondContact O-N 3.06Å; H54-V56 VanDerWaalsContact C-N 3.27Å; H54-V56 PolarHBondContact O-N 3.25Å; H54-G57 PolarHBondContact O-N 3.03Å; H54-Q58 PolarHBondContact NE2-NE2 2.95Å; H54-Q58 WeakPolarHBondContact O-CB 3.5Å; H54-Q58 VanDerWaalsContact O-CG 3.3Å; H54-Q58 WeakPolarHBondContact O-CG 3.49Å; H54-Q58 PolarHBondContact O-N 2.93Å; H54-D104 VanDerWaalsContact NE2-CG 3.31Å; H54-D104 IonicContact NE2-OD1 3Å; H54-D104 IonicContact NE2-OD2 3.76Å; H54-D104 PolarHBondContact NE2-OD2 2.91Å
55	R	79	Confident	75.7	Confident	184 Å²	184	69.1 Å²	69.1	69%	0.694	37%	0.372	S	S	*	.	H	α-helix	trans	-58.1	-38.3	174.7	-71.1	170.4	-168.8	179.6	3.2	112.2	A51 A52 I53 A59	A51-R55 VanDerWaalsContact O-CG 3.26Å; A51-R55 WeakPolarHBondContact O-CG 3.2Å; A51-R55 PolarHBondContact O-N 3.25Å; A51-R55 VanDerWaalsContact O-N 3.13Å; A52-R55 PolarHBondContact O-N 3.37Å; I53-R55 PolarHBondContact O-N 3.27Å; R55-A59 VanDerWaalsContact O-CB 3.27Å; R55-A59 WeakPolarHBondContact O-CB 3.35Å; R55-A59 PolarHBondContact O-N 3.43Å
56	V	77.8	Confident	77.5	Confident	66 Å²	66	71.3 Å²	71.3	40%	0.4	38%	0.377	S	S	.	.	H	α-helix	trans	-67	-47.4	177.8	172.7	0	0	0	0	111.3	L36 A52 I53 H54 Q58 A59 V60	L36-V56 HydrophobicContact CD1-CG1 4.35Å; L36-V56 HydrophobicContact CD2-CG1 4.1Å; A52-V56 WeakPolarHBondContact O-CG2 3.44Å; A52-V56 PolarHBondContact O-N 3.02Å; I53-V56 PolarHBondContact O-N 3.22Å; H54-V56 VanDerWaalsContact C-N 3.27Å; H54-V56 PolarHBondContact O-N 3.25Å; V56-Q58 PolarHBondContact O-N 3.41Å; V56-A59 PolarHBondContact O-N 3.1Å; V56-V60 WeakPolarHBondContact O-CG2 3.35Å; V56-V60 PolarHBondContact O-N 2.9Å
57	G	80.5	Confident	78.9	Confident	1 Å²	1	71 Å²	71	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-64	-39.1	178.5	0	0	0	0	0	113.3	I53 H54 V60 S61 T103	I53-G57 PolarHBondContact O-N 3.24Å; H54-G57 PolarHBondContact O-N 3.03Å; G57-V60 PolarHBondContact O-N 3.49Å; G57-S61 PolarHBondContact O-N 3.3Å; G57-T103 WeakPolarHBondContact CA-OG1 3.25Å
58	Q	83.6	Confident	80.4	Confident	73 Å²	73	62.7 Å²	62.7	34%	0.341	33%	0.33	S	S	.	.	H	α-helix	trans	-63.1	-43.1	171.8	-67.6	-66.9	-21.6	0	0	112	H54 V56 V60 S61 V62	H54-Q58 PolarHBondContact NE2-NE2 2.95Å; H54-Q58 WeakPolarHBondContact O-CB 3.5Å; H54-Q58 VanDerWaalsContact O-CG 3.3Å; H54-Q58 WeakPolarHBondContact O-CG 3.49Å; H54-Q58 PolarHBondContact O-N 2.93Å; V56-Q58 PolarHBondContact O-N 3.41Å; Q58-V60 VanDerWaalsContact C-N 3.31Å; Q58-V60 PolarHBondContact O-N 2.98Å; Q58-S61 PolarHBondContact O-N 2.89Å; Q58-V62 WeakPolarHBondContact O-CG2 3.37Å; Q58-V62 PolarHBondContact O-N 3.18Å
59	A	82.2	Confident	81.7	Confident	59 Å²	59	54.5 Å²	54.5	49%	0.488	31%	0.309	S	S	.	.	H	α-helix	trans	-62.8	-36.4	175.3	0	0	0	0	0	112.4	R55 V56 A63	R55-A59 VanDerWaalsContact O-CB 3.27Å; R55-A59 WeakPolarHBondContact O-CB 3.35Å; R55-A59 PolarHBondContact O-N 3.43Å; V56-A59 PolarHBondContact O-N 3.1Å; A59-A63 VanDerWaalsContact O-CB 3.29Å; A59-A63 WeakPolarHBondContact O-CB 3.35Å; A59-A63 PolarHBondContact O-N 2.88Å
60	V	83.4	Confident	82.9	Confident	16 Å²	16	56.4 Å²	56.4	10%	0.097	32%	0.321	C	S	.	.	H	α-helix	trans	-64.3	-52	173.7	169.8	0	0	0	0	111.1	V56 G57 Q58 V62 A63 V64 I99 L133	V56-V60 WeakPolarHBondContact O-CG2 3.35Å; V56-V60 PolarHBondContact O-N 2.9Å; G57-V60 PolarHBondContact O-N 3.49Å; Q58-V60 VanDerWaalsContact C-N 3.31Å; Q58-V60 PolarHBondContact O-N 2.98Å; V60-V62 VanDerWaalsContact C-N 3.32Å; V60-V62 PolarHBondContact O-N 3.04Å; V60-A63 PolarHBondContact O-N 3.24Å; V60-V64 HydrophobicContact CG1-CG2 4.2Å; V60-V64 WeakPolarHBondContact O-CB 3.37Å; V60-V64 VanDerWaalsContact O-CG2 3.23Å; V60-V64 WeakPolarHBondContact O-CG2 3.48Å; V60-V64 PolarHBondContact O-N 3.22Å; V60-I99 HydrophobicContact CG1-CD1 4.11Å; V60-I99 HydrophobicContact CG1-CG2 4.31Å; V60-L133 HydrophobicContact CG1-CD2 3.77Å
61	S	85.9	Confident	84	Confident	21 Å²	21	54.6 Å²	54.6	15%	0.147	31%	0.308	C	S	.	.	H	α-helix	trans	-57.4	-43.3	176.7	166.8	0	0	0	0	111.8	G57 Q58 A63 V64 G65 D97	G57-S61 PolarHBondContact O-N 3.3Å; Q58-S61 PolarHBondContact O-N 2.89Å; S61-A63 PolarHBondContact O-N 3.31Å; S61-V64 PolarHBondContact O-N 3.34Å; S61-G65 PolarHBondContact O-N 3.09Å; S61-D97 PolarHBondContact OG-OD1 3.33Å
62	V	86.3	Confident	85	Confident	74 Å²	74	56.2 Å²	56.2	45%	0.448	31%	0.309	S	S	.	.	H	α-helix	trans	-65.4	-38.8	177.2	172.7	0	0	0	0	112.7	Q58 V60 R66	Q58-V62 WeakPolarHBondContact O-CG2 3.37Å; Q58-V62 PolarHBondContact O-N 3.18Å; V60-V62 VanDerWaalsContact C-N 3.32Å; V60-V62 PolarHBondContact O-N 3.04Å; V62-R66 WeakPolarHBondContact O-CG 3.36Å; V62-R66 PolarHBondContact O-N 3.18Å
63	A	85.9	Confident	85.9	Confident	57 Å²	57	56.3 Å²	56.3	47%	0.471	31%	0.309	S	S	.	.	H	α-helix	trans	-66.8	-45.5	176.1	0	0	0	0	0	111.5	A59 V60 S61 R66 F67	A59-A63 VanDerWaalsContact O-CB 3.29Å; A59-A63 WeakPolarHBondContact O-CB 3.35Å; A59-A63 PolarHBondContact O-N 2.88Å; V60-A63 PolarHBondContact O-N 3.24Å; S61-A63 PolarHBondContact O-N 3.31Å; A63-R66 PolarHBondContact O-N 2.83Å; A63-F67 PolarHBondContact O-N 2.78Å
64	V	90	Very high	86.6	Confident	9 Å²	9	57.7 Å²	57.7	6%	0.055	32%	0.316	C	S	.	.	H	α-helix	trans	-63.1	-43.3	176.4	174	0	0	0	0	110.8	V60 S61 R66 F67 V68 A92 L133	V60-V64 HydrophobicContact CG1-CG2 4.2Å; V60-V64 WeakPolarHBondContact O-CB 3.37Å; V60-V64 VanDerWaalsContact O-CG2 3.23Å; V60-V64 WeakPolarHBondContact O-CG2 3.48Å; V60-V64 PolarHBondContact O-N 3.22Å; S61-V64 PolarHBondContact O-N 3.34Å; V64-R66 PolarHBondContact O-N 2.81Å; V64-F67 PolarHBondContact O-N 3.4Å; V64-F67 VanDerWaalsContact O-N 3.15Å; V64-V68 HydrophobicContact CG1-CG2 3.93Å; V64-V68 VanDerWaalsContact O-CB 3.32Å; V64-V68 WeakPolarHBondContact O-CB 3.3Å; V64-V68 VanDerWaalsContact O-CG2 3.23Å; V64-V68 WeakPolarHBondContact O-CG2 3.46Å; V64-V68 PolarHBondContact O-N 3.43Å; V64-A92 HydrophobicContact CG1-CB 4.31Å; V64-A92 WeakPolarHBondContact CG1-O 3.42Å; V64-L133 HydrophobicContact CB-CD1 4.44Å; V64-L133 HydrophobicContact CG1-CD1 3.94Å; V64-L133 HydrophobicContact CG2-CD1 3.57Å; V64-L133 HydrophobicContact CG2-CD2 3.83Å; V64-L133 HydrophobicContact CG2-CG 4.32Å
65	G	90.1	Very high	87.2	Confident	20 Å²	20	54.1 Å²	54.1	21%	0.206	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-32.2	176.9	0	0	0	0	0	113.7	S61 A69	S61-G65 PolarHBondContact O-N 3.09Å; G65-A69 WeakPolarHBondContact O-CB 3.18Å; G65-A69 PolarHBondContact O-N 3.47Å
66	R	89.2	Confident	87.6	Confident	181 Å²	181	48.8 Å²	48.8	68%	0.683	29%	0.292	S	S	*	.	H	α-helix	trans	-75	-45	172.4	-68.8	174.2	-174.4	174.8	5.4	112.5	V62 A63 V64 V68 A69 V70	V62-R66 WeakPolarHBondContact O-CG 3.36Å; V62-R66 PolarHBondContact O-N 3.18Å; A63-R66 PolarHBondContact O-N 2.83Å; V64-R66 PolarHBondContact O-N 2.81Å; R66-V68 VanDerWaalsContact C-N 3.34Å; R66-A69 PolarHBondContact O-N 3Å; R66-V70 PolarHBondContact O-N 3.43Å
67	F	89.5	Confident	88	Confident	50 Å²	50	53 Å²	53	22%	0.219	31%	0.307	C	S	.	.	H	α-helix	trans	-58.6	-47	176.3	169.9	-97.5	0	0	0	111.3	A63 V64 A69 V70 G71 V137 V140 L141	A63-F67 PolarHBondContact O-N 2.78Å; V64-F67 PolarHBondContact O-N 3.4Å; V64-F67 VanDerWaalsContact O-N 3.15Å; F67-A69 PolarHBondContact O-N 3.17Å; F67-V70 WeakPolarHBondContact O-CB 3.39Å; F67-V70 PolarHBondContact O-N 2.67Å; F67-G71 PolarHBondContact O-N 3.47Å; F67-G71 VanDerWaalsContact O-N 3.09Å; F67-V137 HydrophobicContact CD1-CG2 4.21Å; F67-V137 HydrophobicContact CE1-CB 4.17Å; F67-V137 HydrophobicContact CE1-CG1 3.9Å; F67-V137 HydrophobicContact CE1-CG2 3.91Å; F67-V137 HydrophobicContact CE2-CG1 4.31Å; F67-V137 HydrophobicContact CZ-CB 4.43Å; F67-V137 HydrophobicContact CZ-CG1 3.74Å; F67-V140 HydrophobicContact CE1-CB 3.73Å; F67-V140 HydrophobicContact CE1-CG1 3.54Å; F67-V140 HydrophobicContact CE1-CG2 4.15Å; F67-V140 HydrophobicContact CE2-CG1 4.33Å; F67-V140 HydrophobicContact CZ-CB 3.72Å; F67-V140 HydrophobicContact CZ-CG1 3.37Å; F67-L141 HydrophobicContact CE2-CD2 3.94Å; F67-L141 HydrophobicContact CE2-CG 4.16Å; F67-L141 HydrophobicContact CZ-CD2 4.27Å; F67-L141 HydrophobicContact CZ-CG 4.04Å
68	V	93.3	Very high	88.2	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.9	-40.1	177.9	172.6	0	0	0	0	111.5	V64 R66 V70 G71 E72 C89 A92 R93	V64-V68 HydrophobicContact CG1-CG2 3.93Å; V64-V68 VanDerWaalsContact O-CB 3.32Å; V64-V68 WeakPolarHBondContact O-CB 3.3Å; V64-V68 VanDerWaalsContact O-CG2 3.23Å; V64-V68 WeakPolarHBondContact O-CG2 3.46Å; V64-V68 PolarHBondContact O-N 3.43Å; R66-V68 VanDerWaalsContact C-N 3.34Å; V68-V70 VanDerWaalsContact C-N 3.27Å; V68-V70 PolarHBondContact O-N 2.95Å; V68-G71 CarbonylContact O-C 3.59Å; V68-G71 PolarHBondContact O-N 2.97Å; V68-G71 VanDerWaalsContact O-N 3.11Å; V68-E72 HydrophobicContact CG1-CG 4.15Å; V68-E72 VanDerWaalsContact CG1-OE1 3.29Å; V68-E72 WeakPolarHBondContact CG1-OE1 3.24Å; V68-E72 WeakPolarHBondContact O-CB 3.25Å; V68-E72 VanDerWaalsContact O-CG 3.31Å; V68-E72 WeakPolarHBondContact O-CG 3.47Å; V68-E72 PolarHBondContact O-N 3.32Å; V68-C89 HydrophobicContact CG1-CB 3.67Å; V68-C89 WeakPolarHBondContact CG1-O 3.44Å; V68-C89 WeakPolarHBondContact CG2-O 3.22Å; V68-A92 HydrophobicContact CG2-CB 3.81Å; V68-R93 HydrophobicContact CG1-CB 4.38Å; V68-R93 VanDerWaalsContact CG1-NH2 3.32Å; V68-R93 HydrophobicContact CG2-CB 4.37Å
69	A	92.1	Very high	88.3	Confident	48 Å²	48	57.5 Å²	57.5	40%	0.397	33%	0.329	S	S	.	.	H	α-helix	trans	-62.1	-32	175.8	0	0	0	0	0	113.2	G65 R66 F67 A73	G65-A69 WeakPolarHBondContact O-CB 3.18Å; G65-A69 PolarHBondContact O-N 3.47Å; R66-A69 PolarHBondContact O-N 3Å; F67-A69 PolarHBondContact O-N 3.17Å; A69-A73 WeakPolarHBondContact O-CB 3.41Å; A69-A73 PolarHBondContact O-N 3.3Å; A69-A73 VanDerWaalsContact O-N 3.09Å
70	V	91.1	Very high	88.5	Confident	89 Å²	89	62.5 Å²	62.5	54%	0.539	34%	0.342	S	S	.	.	H	α-helix	trans	-70.7	-43	172.1	176.1	0	0	0	0	110.8	R66 F67 V68 E72 A73 I74	R66-V70 PolarHBondContact O-N 3.43Å; F67-V70 WeakPolarHBondContact O-CB 3.39Å; F67-V70 PolarHBondContact O-N 2.67Å; V68-V70 VanDerWaalsContact C-N 3.27Å; V68-V70 PolarHBondContact O-N 2.95Å; V70-E72 PolarHBondContact O-N 3.37Å; V70-A73 PolarHBondContact O-N 2.97Å; V70-I74 HydrophobicContact CG1-CD1 3.84Å; V70-I74 WeakPolarHBondContact O-CG1 3.44Å; V70-I74 PolarHBondContact O-N 2.89Å
71	G	91.2	Very high	88.6	Confident	3 Å²	3	62.4 Å²	62.4	3%	0.031	34%	0.341	C	S	.	.	H	α-helix	trans	-62.5	-39.2	174.6	0	0	0	0	0	113.5	F67 V68 I74 A75 M85	F67-G71 PolarHBondContact O-N 3.47Å; F67-G71 VanDerWaalsContact O-N 3.09Å; V68-G71 CarbonylContact O-C 3.59Å; V68-G71 PolarHBondContact O-N 2.97Å; V68-G71 VanDerWaalsContact O-N 3.11Å; G71-I74 PolarHBondContact O-N 2.88Å; G71-A75 VanDerWaalsContact O-CB 3.28Å; G71-A75 WeakPolarHBondContact O-CB 3.4Å; G71-A75 PolarHBondContact O-N 3.34Å; G71-M85 WeakPolarHBondContact O-CG 3.31Å
72	E	91.5	Very high	88.8	Confident	78 Å²	78	64.9 Å²	64.9	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-65.4	-39.4	174.5	-73.3	165.2	171.7	0	0	112	V68 V70 A75 S76 C89 R93	V68-E72 HydrophobicContact CG1-CG 4.15Å; V68-E72 VanDerWaalsContact CG1-OE1 3.29Å; V68-E72 WeakPolarHBondContact CG1-OE1 3.24Å; V68-E72 WeakPolarHBondContact O-CB 3.25Å; V68-E72 VanDerWaalsContact O-CG 3.31Å; V68-E72 WeakPolarHBondContact O-CG 3.47Å; V68-E72 PolarHBondContact O-N 3.32Å; V70-E72 PolarHBondContact O-N 3.37Å; E72-A75 PolarHBondContact O-N 2.91Å; E72-S76 PolarHBondContact O-N 3.41Å; E72-S76 VanDerWaalsContact O-N 3.08Å; E72-C89 HydrophobicContact CG-CB 4.1Å; E72-R93 IonicContact OE1-CZ 2.76Å; E72-R93 IonicContact OE1-NE 2.7Å; E72-R93 IonicContact OE1-NH2 3.19Å; E72-R93 PolarHBondContact OE1-NH2 3.5Å; E72-R93 IonicContact OE2-NH2 2.68Å; E72-R93 PolarHBondContact OE2-NH2 3.17Å
73	A	91.5	Very high	89	Confident	50 Å²	50	67.7 Å²	67.7	41%	0.413	36%	0.362	S	S	.	.	H	α-helix	trans	-63.8	-49.9	173.1	0	0	0	0	0	111.5	A69 V70 A75 S76 E77	A69-A73 WeakPolarHBondContact O-CB 3.41Å; A69-A73 PolarHBondContact O-N 3.3Å; A69-A73 VanDerWaalsContact O-N 3.09Å; V70-A73 PolarHBondContact O-N 2.97Å; A73-A75 VanDerWaalsContact C-N 3.29Å; A73-A75 PolarHBondContact O-N 3.39Å; A73-S76 WeakPolarHBondContact O-CB 3.48Å; A73-S76 PolarHBondContact O-N 3.45Å; A73-S76 PolarHBondContact O-OG 2.97Å; A73-E77 PolarHBondContact O-N 3.16Å
74	I	87.4	Confident	89.2	Confident	51 Å²	51	68.4 Å²	68.4	26%	0.262	36%	0.355	S	S	.	.	H	α-helix	trans	-59.1	-39.4	176.6	-70.1	168.1	0	0	0	111.3	V70 G71 S76 E77 N78 M85 I147	V70-I74 HydrophobicContact CG1-CD1 3.84Å; V70-I74 WeakPolarHBondContact O-CG1 3.44Å; V70-I74 PolarHBondContact O-N 2.89Å; G71-I74 PolarHBondContact O-N 2.88Å; I74-S76 VanDerWaalsContact C-N 3.31Å; I74-S76 PolarHBondContact O-N 3.32Å; I74-E77 PolarHBondContact O-N 3.05Å; I74-N78 PolarHBondContact O-N 3.28Å; I74-N78 PolarHBondContact O-ND2 3.3Å; I74-M85 HydrophobicContact CG2-CE 4.25Å; I74-I147 HydrophobicContact CG2-CD1 3.42Å; I74-I147 VanDerWaalsContact CG2-CD1 3.42Å
75	A	89	Confident	89.3	Confident	6 Å²	6	68 Å²	68	5%	0.05	35%	0.353	C	S	.	.	H	α-helix	trans	-61.5	-37.8	174.3	0	0	0	0	0	112.4	G71 E72 A73 E77 N78 K82 M85	G71-A75 VanDerWaalsContact O-CB 3.28Å; G71-A75 WeakPolarHBondContact O-CB 3.4Å; G71-A75 PolarHBondContact O-N 3.34Å; E72-A75 PolarHBondContact O-N 2.91Å; A73-A75 VanDerWaalsContact C-N 3.29Å; A73-A75 PolarHBondContact O-N 3.39Å; A75-E77 VanDerWaalsContact C-N 3.26Å; A75-E77 PolarHBondContact O-N 2.94Å; A75-N78 PolarHBondContact O-N 3.03Å; A75-N78 VanDerWaalsContact O-N 3.16Å; A75-K82 HydrophobicContact CB-CG 4.4Å; A75-K82 WeakPolarHBondContact O-CB 3.32Å; A75-K82 WeakPolarHBondContact O-CG 3.36Å; A75-M85 HydrophobicContact CB-CB 3.9Å; A75-M85 HydrophobicContact CB-CG 3.73Å
76	S	87.4	Confident	89.4	Confident	73 Å²	73	68.5 Å²	68.5	51%	0.51	36%	0.358	S	S	.	.	H	α-helix	trans	-63.9	-31.8	-177.6	80.1	0	0	0	0	113	E72 A73 I74	E72-S76 PolarHBondContact O-N 3.41Å; E72-S76 VanDerWaalsContact O-N 3.08Å; A73-S76 WeakPolarHBondContact O-CB 3.48Å; A73-S76 PolarHBondContact O-N 3.45Å; A73-S76 PolarHBondContact O-OG 2.97Å; I74-S76 VanDerWaalsContact C-N 3.31Å; I74-S76 PolarHBondContact O-N 3.32Å
77	E	86.8	Confident	89.6	Confident	154 Å²	154	64 Å²	64	72%	0.72	35%	0.345	S	S	*	.	H	α-helix	trans	-82.6	-18.5	177.2	-61.7	178.4	170.8	0	0	113.2	A73 I74 A75	A73-E77 PolarHBondContact O-N 3.16Å; I74-E77 PolarHBondContact O-N 3.05Å; A75-E77 VanDerWaalsContact C-N 3.26Å; A75-E77 PolarHBondContact O-N 2.94Å
78	N	84.8	Confident	89.8	Confident	33 Å²	33	61.7 Å²	61.7	18%	0.176	33%	0.334	C	S	.	.			trans	-119.3	70.3	-168.3	-74.1	-87.4	0	0	0	112.2	I74 A75 E80 L81 K82 I147	I74-N78 PolarHBondContact O-N 3.28Å; I74-N78 PolarHBondContact O-ND2 3.3Å; A75-N78 PolarHBondContact O-N 3.03Å; A75-N78 VanDerWaalsContact O-N 3.16Å; N78-E80 PolarHBondContact O-N 3.49Å; N78-L81 PolarHBondContact O-N 2.7Å; N78-K82 PolarHBondContact O-N 3Å; N78-I147 HydrophobicContact CB-CD1 3.82Å; N78-I147 HydrophobicContact CB-CG1 4.2Å; N78-I147 WeakPolarHBondContact OD1-CG2 3.37Å
79	Q	85.9	Confident	89.9	Confident	136 Å²	136	61.7 Å²	61.7	64%	0.636	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	-33.4	-170.1	-171.1	65.8	17.2	0	0	115.3	K82	Q79-K82 VanDerWaalsContact OE1-CD 3.24Å
80	E	86.1	Confident	90	Very high	164 Å²	164	64.8 Å²	64.8	77%	0.766	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-26	178.1	-64.7	-177.5	168	0	0	115	N78 K150	N78-E80 PolarHBondContact O-N 3.49Å; E80-K150 IonicContact OE2-NZ 3.27Å; E80-K150 PolarHBondContact OE2-NZ 3.45Å
81	L	85.9	Confident	90.2	Very high	14 Å²	14	63 Å²	63	7%	0.073	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	0.4	-179.4	-68.3	173.4	0	0	0	112.2	N78 D83 E84 M85 R146 I147 K150	N78-L81 PolarHBondContact O-N 2.7Å; L81-D83 PolarHBondContact O-N 2.77Å; L81-E84 PolarHBondContact O-N 3.37Å; L81-M85 WeakPolarHBondContact O-CB 3.28Å; L81-M85 PolarHBondContact O-N 3.2Å; L81-R146 HydrophobicContact CD1-CB 4.11Å; L81-I147 HydrophobicContact CD1-CD1 4.38Å; L81-I147 HydrophobicContact CD1-CG1 3.66Å; L81-K150 HydrophobicContact CD1-CD 4.17Å
82	K	89.6	Confident	90.3	Very high	72 Å²	72	62.9 Å²	62.9	31%	0.313	32%	0.324	S	S	.	.	H	α-helix	trans	-56.2	-44.7	-174.6	-176.5	167.3	-179.4	167.1	0	113.4	A75 N78 Q79 G86	A75-K82 HydrophobicContact CB-CG 4.4Å; A75-K82 WeakPolarHBondContact O-CB 3.32Å; A75-K82 WeakPolarHBondContact O-CG 3.36Å; N78-K82 PolarHBondContact O-N 3Å; Q79-K82 VanDerWaalsContact OE1-CD 3.24Å; K82-G86 WeakPolarHBondContact O-CA 3.37Å; K82-G86 PolarHBondContact O-N 3.47Å
83	D	90.4	Very high	90.5	Very high	133 Å²	133	62.9 Å²	62.9	71%	0.711	32%	0.32	S	S	*	.	H	α-helix	trans	-75.9	-39.8	-177.6	-59	-24.3	0	0	0	111.6	L81 G86 Q87	L81-D83 PolarHBondContact O-N 2.77Å; D83-G86 PolarHBondContact O-N 3.42Å; D83-Q87 WeakPolarHBondContact O-CB 3.47Å; D83-Q87 PolarHBondContact O-N 3.2Å
84	E	90.8	Very high	90.7	Very high	72 Å²	72	66.9 Å²	66.9	34%	0.336	33%	0.325	S	S	.	.	H	α-helix	trans	-66.1	-42.7	176.6	-162	-175.1	-177.9	0	0	111.2	L81 A88 L143 R146	L81-E84 PolarHBondContact O-N 3.37Å; E84-A88 PolarHBondContact O-N 3.16Å; E84-A88 VanDerWaalsContact O-N 3.09Å; E84-L143 HydrophobicContact CB-CD1 4.34Å; E84-L143 HydrophobicContact CB-CD2 4.47Å; E84-L143 HydrophobicContact CG-CD1 3.93Å; E84-L143 HydrophobicContact CG-CD2 3.99Å; E84-L143 VanDerWaalsContact OE2-CD2 3.25Å; E84-L143 WeakPolarHBondContact OE2-CD2 3.42Å; E84-R146 IonicContact OE1-NH1 3.73Å; E84-R146 IonicContact OE2-NH1 3.33Å; E84-R146 PolarHBondContact OE2-NH1 2.93Å
85	M	92.2	Very high	90.9	Very high	1 Å²	1	64.7 Å²	64.7	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-67.2	-45.7	174.9	-174.8	67.6	94.6	0	0	111.3	G71 I74 A75 L81 Q87 A88 C89 V140 L143 A144 I147	G71-M85 WeakPolarHBondContact O-CG 3.31Å; I74-M85 HydrophobicContact CG2-CE 4.25Å; A75-M85 HydrophobicContact CB-CB 3.9Å; A75-M85 HydrophobicContact CB-CG 3.73Å; L81-M85 WeakPolarHBondContact O-CB 3.28Å; L81-M85 PolarHBondContact O-N 3.2Å; M85-Q87 VanDerWaalsContact C-N 3.32Å; M85-Q87 PolarHBondContact O-N 3.46Å; M85-A88 PolarHBondContact O-N 3.08Å; M85-C89 VanDerWaalsContact O-CB 3.26Å; M85-C89 WeakPolarHBondContact O-CB 3.5Å; M85-C89 PolarHBondContact O-N 3.45Å; M85-V140 HydrophobicContact SD-CB 4.22Å; M85-V140 HydrophobicContact SD-CG1 3.78Å; M85-V140 HydrophobicContact SD-CG2 4.3Å; M85-L143 HydrophobicContact CB-CD1 4.44Å; M85-L143 HydrophobicContact CE-CB 3.59Å; M85-L143 HydrophobicContact SD-CB 3.85Å; M85-L143 HydrophobicContact SD-CD1 4.31Å; M85-A144 HydrophobicContact CE-CB 4.23Å; M85-I147 HydrophobicContact CE-CD1 4.05Å
86	G	92.6	Very high	91	Very high	30 Å²	30	64.4 Å²	64.4	31%	0.309	31%	0.312	S	S	.	.	H	α-helix	trans	-58.5	-42	177	0	0	0	0	0	112.5	K82 D83 C89 F90	K82-G86 WeakPolarHBondContact O-CA 3.37Å; K82-G86 PolarHBondContact O-N 3.47Å; D83-G86 PolarHBondContact O-N 3.42Å; G86-C89 WeakPolarHBondContact O-CB 3.42Å; G86-C89 PolarHBondContact O-N 3.03Å; G86-F90 WeakPolarHBondContact O-CB 3.46Å; G86-F90 PolarHBondContact O-N 3.29Å
87	Q	92.9	Very high	91.1	Very high	88 Å²	88	63.8 Å²	63.8	41%	0.411	30%	0.303	S	S	.	.	H	α-helix	trans	-65.3	-43.4	174.4	180	60.1	25	0	0	112.2	D83 M85 F90 E91	D83-Q87 WeakPolarHBondContact O-CB 3.47Å; D83-Q87 PolarHBondContact O-N 3.2Å; M85-Q87 VanDerWaalsContact C-N 3.32Å; M85-Q87 PolarHBondContact O-N 3.46Å; Q87-F90 PolarHBondContact O-N 3.07Å; Q87-E91 WeakPolarHBondContact CG-OE1 3.32Å; Q87-E91 PolarHBondContact NE2-OE1 3.24Å; Q87-E91 WeakPolarHBondContact O-CB 3.45Å; Q87-E91 VanDerWaalsContact O-CG 3.25Å; Q87-E91 WeakPolarHBondContact O-CG 3.48Å; Q87-E91 PolarHBondContact O-N 2.95Å
88	A	93.9	Very high	91.3	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-39.4	176.5	0	0	0	0	0	112.3	E84 M85 E91 A92 K139 V140 L143	E84-A88 PolarHBondContact O-N 3.16Å; E84-A88 VanDerWaalsContact O-N 3.09Å; M85-A88 PolarHBondContact O-N 3.08Å; A88-E91 PolarHBondContact O-N 3.33Å; A88-A92 WeakPolarHBondContact O-CB 3.48Å; A88-A92 PolarHBondContact O-N 3.5Å; A88-K139 HydrophobicContact CB-CB 4.23Å; A88-K139 HydrophobicContact CB-CD 3.74Å; A88-K139 HydrophobicContact CB-CG 3.75Å; A88-V140 HydrophobicContact CB-CG2 3.58Å; A88-L143 HydrophobicContact CB-CD1 4.07Å
89	C	95	Very high	91.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-46.8	172.2	-88.7	0	0	0	0	112.3	V68 E72 M85 G86 A92 R93	V68-C89 HydrophobicContact CG1-CB 3.67Å; V68-C89 WeakPolarHBondContact CG1-O 3.44Å; V68-C89 WeakPolarHBondContact CG2-O 3.22Å; E72-C89 HydrophobicContact CG-CB 4.1Å; M85-C89 VanDerWaalsContact O-CB 3.26Å; M85-C89 WeakPolarHBondContact O-CB 3.5Å; M85-C89 PolarHBondContact O-N 3.45Å; G86-C89 WeakPolarHBondContact O-CB 3.42Å; G86-C89 PolarHBondContact O-N 3.03Å; C89-A92 PolarHBondContact O-N 2.96Å; C89-R93 WeakPolarHBondContact O-CB 3.39Å; C89-R93 PolarHBondContact O-N 2.78Å
90	F	94.6	Very high	91.4	Very high	113 Å²	113	50.5 Å²	50.5	50%	0.496	25%	0.246	S	C	.	.	H	α-helix	trans	-63.3	-43	175.3	175.3	-105.5	0	0	0	112.3	G86 Q87 R93 R94	G86-F90 WeakPolarHBondContact O-CB 3.46Å; G86-F90 PolarHBondContact O-N 3.29Å; Q87-F90 PolarHBondContact O-N 3.07Å; F90-R93 PolarHBondContact O-N 3.24Å; F90-R94 WeakPolarHBondContact O-CB 3.44Å; F90-R94 PolarHBondContact O-N 3.41Å
91	E	94.6	Very high	91.4	Very high	52 Å²	52	49.6 Å²	49.6	24%	0.243	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-44.8	175.1	-74.9	163.1	176.3	0	0	111.7	Q87 A88 A95 K139	Q87-E91 WeakPolarHBondContact CG-OE1 3.32Å; Q87-E91 PolarHBondContact NE2-OE1 3.24Å; Q87-E91 WeakPolarHBondContact O-CB 3.45Å; Q87-E91 VanDerWaalsContact O-CG 3.25Å; Q87-E91 WeakPolarHBondContact O-CG 3.48Å; Q87-E91 PolarHBondContact O-N 2.95Å; A88-E91 PolarHBondContact O-N 3.33Å; E91-A95 WeakPolarHBondContact O-CB 3.45Å; E91-A95 PolarHBondContact O-N 3.04Å; E91-K139 IonicContact OE1-NZ 3.73Å; E91-K139 IonicContact OE2-NZ 2.81Å; E91-K139 PolarHBondContact OE2-NZ 3.09Å
92	A	94.2	Very high	91.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.4	-48.6	177	0	0	0	0	0	112.1	V64 V68 A88 C89 R94 A95 G96 L133 S136 V137	V64-A92 HydrophobicContact CG1-CB 4.31Å; V64-A92 WeakPolarHBondContact CG1-O 3.42Å; V68-A92 HydrophobicContact CG2-CB 3.81Å; A88-A92 WeakPolarHBondContact O-CB 3.48Å; A88-A92 PolarHBondContact O-N 3.5Å; C89-A92 PolarHBondContact O-N 2.96Å; A92-R94 PolarHBondContact O-N 2.95Å; A92-A95 PolarHBondContact O-N 3.18Å; A92-A95 VanDerWaalsContact O-N 3.16Å; A92-G96 PolarHBondContact O-N 3.12Å; A92-L133 HydrophobicContact CB-CD1 4.42Å; A92-S136 WeakPolarHBondContact CA-OG 3.26Å; A92-S136 PolarHBondContact N-OG 2.9Å; A92-V137 HydrophobicContact CB-CG2 4.3Å
93	R	95.1	Very high	90.7	Very high	78 Å²	78	48 Å²	48	29%	0.294	24%	0.237	S	C	.	.	H	α-helix	trans	-55.5	-51.2	176.8	-166.4	-176.5	-64.2	-81.9	10.6	111	V68 E72 C89 F90 A95 G96 D97	V68-R93 HydrophobicContact CG1-CB 4.38Å; V68-R93 VanDerWaalsContact CG1-NH2 3.32Å; V68-R93 HydrophobicContact CG2-CB 4.37Å; E72-R93 IonicContact OE1-CZ 2.76Å; E72-R93 IonicContact OE1-NE 2.7Å; E72-R93 IonicContact OE1-NH2 3.19Å; E72-R93 PolarHBondContact OE1-NH2 3.5Å; E72-R93 IonicContact OE2-NH2 2.68Å; E72-R93 PolarHBondContact OE2-NH2 3.17Å; C89-R93 WeakPolarHBondContact O-CB 3.39Å; C89-R93 PolarHBondContact O-N 2.78Å; F90-R93 PolarHBondContact O-N 3.24Å; R93-A95 VanDerWaalsContact C-N 3.28Å; R93-A95 PolarHBondContact O-N 3.09Å; R93-G96 PolarHBondContact O-N 3.03Å; R93-G96 VanDerWaalsContact O-N 3.16Å; R93-D97 VanDerWaalsContact O-CG 3.3Å; R93-D97 PolarHBondContact O-N 3.22Å
94	R	94.6	Very high	89.9	Confident	134 Å²	134	45.1 Å²	45.1	51%	0.506	22%	0.221	S	C	.	.	H	α-helix	trans	-60.7	-34.4	178.7	-160.3	-173.5	81.7	-138.5	4.3	112.9	F90 A92 A98	F90-R94 WeakPolarHBondContact O-CB 3.44Å; F90-R94 PolarHBondContact O-N 3.41Å; A92-R94 PolarHBondContact O-N 2.95Å; R94-A98 VanDerWaalsContact O-CB 3.32Å; R94-A98 WeakPolarHBondContact O-CB 3.49Å; R94-A98 PolarHBondContact O-N 2.9Å
95	A	91.9	Very high	88.4	Confident	5 Å²	5	44.7 Å²	44.7	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-72.8	-40	176.1	0	0	0	0	0	112.5	E91 A92 R93 A98 I99 L132 L133	E91-A95 WeakPolarHBondContact O-CB 3.45Å; E91-A95 PolarHBondContact O-N 3.04Å; A92-A95 PolarHBondContact O-N 3.18Å; A92-A95 VanDerWaalsContact O-N 3.16Å; R93-A95 VanDerWaalsContact C-N 3.28Å; R93-A95 PolarHBondContact O-N 3.09Å; A95-A98 PolarHBondContact O-N 2.94Å; A95-I99 WeakPolarHBondContact O-CG1 3.32Å; A95-I99 PolarHBondContact O-N 3.26Å; A95-I99 VanDerWaalsContact O-N 3.08Å; A95-L132 HydrophobicContact CB-CB 4.06Å; A95-L133 HydrophobicContact CB-CB 3.8Å; A95-L133 HydrophobicContact CB-CD1 4.28Å
96	G	90.7	Very high	86.6	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.2	-43.4	173.3	0	0	0	0	0	112.7	A92 R93 I99 A100	A92-G96 PolarHBondContact O-N 3.12Å; R93-G96 PolarHBondContact O-N 3.03Å; R93-G96 VanDerWaalsContact O-N 3.16Å; G96-I99 WeakPolarHBondContact O-CB 3.26Å; G96-I99 PolarHBondContact O-N 3.19Å; G96-A100 PolarHBondContact O-N 3.39Å
97	D	90.9	Very high	84.2	Confident	60 Å²	60	51.6 Å²	51.6	32%	0.321	28%	0.278	S	S	.	.	H	α-helix	trans	-69.5	-35.6	178.7	-62.5	-24.6	0	0	0	112.1	S61 R93 I99 A100 Q101	S61-D97 PolarHBondContact OG-OD1 3.33Å; R93-D97 VanDerWaalsContact O-CG 3.3Å; R93-D97 PolarHBondContact O-N 3.22Å; D97-I99 VanDerWaalsContact C-N 3.34Å; D97-I99 PolarHBondContact O-N 3.46Å; D97-A100 PolarHBondContact O-N 3.2Å; D97-Q101 VanDerWaalsContact O-CG 3.31Å; D97-Q101 WeakPolarHBondContact O-CG 3.43Å; D97-Q101 PolarHBondContact O-N 2.97Å
98	A	90.1	Very high	81.7	Confident	30 Å²	30	51.3 Å²	51.3	25%	0.248	29%	0.291	C	S	.	.	H	α-helix	trans	-63.2	-37.7	171.2	0	0	0	0	0	112.4	R94 A95 L102 A129	R94-A98 VanDerWaalsContact O-CB 3.32Å; R94-A98 WeakPolarHBondContact O-CB 3.49Å; R94-A98 PolarHBondContact O-N 2.9Å; A95-A98 PolarHBondContact O-N 2.94Å; A98-L102 WeakPolarHBondContact O-CB 3.34Å; A98-L102 WeakPolarHBondContact O-CD1 3.35Å; A98-L102 WeakPolarHBondContact O-CG 3.46Å; A98-L102 PolarHBondContact O-N 3.15Å; A98-A129 HydrophobicContact CB-CB 4.12Å
99	I	86.4	Confident	79	Confident	7 Å²	7	60.4 Å²	60.4	4%	0.036	34%	0.336	C	S	.	.	H	α-helix	trans	-64	-47	172.8	-67.9	166	0	0	0	110.2	V60 A95 G96 D97 Q101 L102 T103 A129 L133	V60-I99 HydrophobicContact CG1-CD1 4.11Å; V60-I99 HydrophobicContact CG1-CG2 4.31Å; A95-I99 WeakPolarHBondContact O-CG1 3.32Å; A95-I99 PolarHBondContact O-N 3.26Å; A95-I99 VanDerWaalsContact O-N 3.08Å; G96-I99 WeakPolarHBondContact O-CB 3.26Å; G96-I99 PolarHBondContact O-N 3.19Å; D97-I99 VanDerWaalsContact C-N 3.34Å; D97-I99 PolarHBondContact O-N 3.46Å; I99-Q101 PolarHBondContact O-N 2.91Å; I99-L102 PolarHBondContact O-N 3.41Å; I99-T103 WeakPolarHBondContact O-CG2 3.45Å; I99-T103 PolarHBondContact O-N 3.32Å; I99-T103 PolarHBondContact O-OG1 3.09Å; I99-A129 HydrophobicContact CG1-CB 3.78Å; I99-L133 HydrophobicContact CD1-CB 4.2Å; I99-L133 HydrophobicContact CD1-CD2 3.69Å
100	A	86.3	Confident	76.2	Confident	7 Å²	7	68.8 Å²	68.8	6%	0.058	38%	0.375	C	S	.	.	H	α-helix	trans	-57.2	-47.2	177.7	0	0	0	0	0	111.9	G96 D97 T103 D104	G96-A100 PolarHBondContact O-N 3.39Å; D97-A100 PolarHBondContact O-N 3.2Å; A100-T103 PolarHBondContact O-N 3.09Å; A100-T103 PolarHBondContact O-OG1 3.03Å; A100-D104 PolarHBondContact O-N 3.09Å; A100-D104 VanDerWaalsContact O-N 3.12Å
101	Q	86.5	Confident	73.5	Confident	145 Å²	145	69.3 Å²	69.3	68%	0.678	39%	0.39	S	S	*	.	H	α-helix	trans	-60.7	-44.2	175.9	-70.5	170.4	14.1	0	0	112.7	D97 I99 T103 D104	D97-Q101 VanDerWaalsContact O-CG 3.31Å; D97-Q101 WeakPolarHBondContact O-CG 3.43Å; D97-Q101 PolarHBondContact O-N 2.97Å; I99-Q101 PolarHBondContact O-N 2.91Å; Q101-T103 PolarHBondContact O-N 3.33Å; Q101-D104 PolarHBondContact O-N 3.43Å
102	L	82.4	Confident	71.2	Confident	49 Å²	49	76.1 Å²	76.1	26%	0.257	42%	0.422	S	S	.	.	H	α-helix	trans	-68.9	-15.2	178	-72	165.8	0	0	0	113.6	A98 I99 D122 G125 A129	A98-L102 WeakPolarHBondContact O-CB 3.34Å; A98-L102 WeakPolarHBondContact O-CD1 3.35Å; A98-L102 WeakPolarHBondContact O-CG 3.46Å; A98-L102 PolarHBondContact O-N 3.15Å; I99-L102 PolarHBondContact O-N 3.41Å; L102-D122 HydrophobicContact CD2-CB 4.29Å; L102-G125 VanDerWaalsContact CD1-C 3.5Å; L102-A129 HydrophobicContact CD1-CB 4.07Å
103	T	77.8	Confident	68.3	Low	3 Å²	3	82.4 Å²	82.4	2%	0.018	46%	0.461	C	S	.	.	H	α-helix	trans	-96.2	-7.6	170.2	63.4	0	0	0	0	114.2	I53 G57 I99 A100 Q101 V105	I53-T103 HydrophobicContact CG2-CG2 3.72Å; G57-T103 WeakPolarHBondContact CA-OG1 3.25Å; I99-T103 WeakPolarHBondContact O-CG2 3.45Å; I99-T103 PolarHBondContact O-N 3.32Å; I99-T103 PolarHBondContact O-OG1 3.09Å; A100-T103 PolarHBondContact O-N 3.09Å; A100-T103 PolarHBondContact O-OG1 3.03Å; Q101-T103 PolarHBondContact O-N 3.33Å; T103-V105 PolarHBondContact O-N 3.43Å
104	D	73.6	Confident	65.4	Low	73 Å²	73	86 Å²	86	39%	0.39	49%	0.486	S	S	.	.			trans	-85.4	87.4	175.9	-169.8	-3.2	0	0	0	111.2	H54 A100 Q101 G106	H54-D104 VanDerWaalsContact NE2-CG 3.31Å; H54-D104 IonicContact NE2-OD1 3Å; H54-D104 IonicContact NE2-OD2 3.76Å; H54-D104 PolarHBondContact NE2-OD2 2.91Å; A100-D104 PolarHBondContact O-N 3.09Å; A100-D104 VanDerWaalsContact O-N 3.12Å; Q101-D104 PolarHBondContact O-N 3.43Å; D104-G106 PolarHBondContact O-N 3.28Å; D104-G106 WeakPolarHBondContact OD1-CA 3.22Å; D104-G106 PolarHBondContact OD1-N 2.98Å
105	V	60.5	Low	62.9	Low	64 Å²	64	83.4 Å²	83.4	39%	0.388	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	4.9	175.5	-157	0	0	0	0	111.7	T103	T103-V105 PolarHBondContact O-N 3.43Å
106	G	53.1	Low	60.3	Low	71 Å²	71	94.5 Å²	94.5	73%	0.732	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-18.5	-168.5	0	0	0	0	0	116.5	D104	D104-G106 PolarHBondContact O-N 3.28Å; D104-G106 WeakPolarHBondContact OD1-CA 3.22Å; D104-G106 PolarHBondContact OD1-N 2.98Å
107	S	43.6	Very low	58	Low	104 Å²	104	99.5 Å²	99.5	73%	0.727	57%	0.572	S	S	*	*	S	Bend	trans	-110.9	-15.5	-168.5	-160.1	0	0	0	0	115.4	M109	S107-M109 PolarHBondContact O-N 3.21Å
108	A	39.8	Very low	56	Low	83 Å²	83	99.7 Å²	99.7	69%	0.686	58%	0.575	S	S	*	*			trans	-80.2	86.3	-173.7	0	0	0	0	0	113.3	Q110	A108-Q110 PolarHBondContact O-N 3.47Å
109	M	38.3	Very low	54.1	Low	191 Å²	191	99.6 Å²	99.6	94%	0.941	57%	0.571	S	S	*	*			trans	-66.5	94.2	160.9	-78.7	-165.5	73.1	0	0	110.4	S107	S107-M109 PolarHBondContact O-N 3.21Å
110	Q	36.2	Very low	52.5	Low	175 Å²	175	100.1 Å²	100.1	82%	0.818	57%	0.573	S	S	*	*			trans	-125.2	133.3	161.6	-77.4	-172.6	-32	0	0	110.3	A108	A108-Q110 PolarHBondContact O-N 3.47Å
111	P	37.5	Very low	51.1	Low	125 Å²	125	105.2 Å²	105.2	81%	0.812	61%	0.609	S	S	*	*			trans	-69.4	158.7	178.1	30.7	-35.1	0	0	0	111.3
112	Q	45.4	Very low	50.1	Low	194 Å²	194	101.7 Å²	101.7	91%	0.907	60%	0.595	S	S	*	*			trans	-68.8	141	-173	-59.3	-176.8	7.5	0	0	113.4
113	T	34.4	Very low	49.5	Very low	133 Å²	133	103.3 Å²	103.3	82%	0.816	60%	0.597	S	S	*	*			trans	-152.4	141	148.2	7.3	0	0	0	0	111.1
114	D	34	Very low	49.5	Very low	153 Å²	153	107.4 Å²	107.4	82%	0.818	62%	0.622	S	S	*	*			trans	33.5	106.2	168.1	-65.8	-20.5	0	0	0	122.5	R116	D114-R116 PolarHBondContact O-N 3.07Å
115	G	41	Very low	49.8	Very low	80 Å²	80	104.4 Å²	104.4	83%	0.825	61%	0.609	S	S	*	*	S	Bend		87.3	-27.1	105.2	0	0	0	0	0	119.2
116	R	37.5	Very low	50.8	Low	237 Å²	237	101.6 Å²	101.6	89%	0.894	59%	0.592	S	S	*	*			trans	-139.9	71.8	177.8	-70.3	-169.2	-179.9	-178	1.9	113.2	D114 T118	D114-R116 PolarHBondContact O-N 3.07Å; R116-T118 PolarHBondContact O-N 3.46Å
117	V	42.3	Very low	52.1	Low	105 Å²	105	99.9 Å²	99.9	64%	0.636	57%	0.567	S	S	*	*			trans	-87.9	100.5	176.9	-176.7	0	0	0	0	110.7	K45	K45-V117 HydrophobicContact CD-CG1 3.94Å; K45-V117 VanDerWaalsContact CE-CG1 3.49Å; K45-V117 HydrophobicContact CG-CG1 4.48Å
118	T	49	Very low	54.1	Low	64 Å²	64	101.3 Å²	101.3	39%	0.393	56%	0.56	S	S	.	*			trans	-70.6	163.7	165.4	41.4	0	0	0	0	111.7	R116 F120	R116-T118 PolarHBondContact O-N 3.46Å; T118-F120 VanDerWaalsContact C-N 3.29Å; T118-F120 PolarHBondContact O-N 3.26Å; T118-F120 PolarHBondContact OG1-O 3.29Å
119	V	49.6	Very low	56.3	Low	28 Å²	28	97.6 Å²	97.6	17%	0.17	53%	0.529	C	S	.	.	S	Bend	trans	-60.2	-39.7	178.5	177.9	0	0	0	0	111.6	P43 I53	P43-V119 HydrophobicContact CG-CG2 4.39Å; I53-V119 HydrophobicContact CD1-CG1 3.31Å
120	F	54.3	Low	58.6	Low	18 Å²	18	88.6 Å²	88.6	8%	0.079	49%	0.486	C	S	.	.	S	Bend	trans	-98.5	138.6	172.6	-56.8	-78.1	0	0	0	110.4	I53 T118 R123 M126	I53-F120 HydrophobicContact CD1-CZ 4.34Å; I53-F120 HydrophobicContact CG2-CE1 3.84Å; I53-F120 HydrophobicContact CG2-CZ 4.41Å; T118-F120 VanDerWaalsContact C-N 3.29Å; T118-F120 PolarHBondContact O-N 3.26Å; T118-F120 PolarHBondContact OG1-O 3.29Å; F120-R123 HydrophobicContact CB-CB 4.38Å; F120-M126 HydrophobicContact CD1-CE 4.1Å; F120-M126 HydrophobicContact CD1-SD 3.68Å; F120-M126 HydrophobicContact CD2-CE 3.71Å; F120-M126 HydrophobicContact CD2-SD 4.36Å; F120-M126 HydrophobicContact CE1-CE 3.94Å; F120-M126 HydrophobicContact CE1-SD 3.32Å; F120-M126 WeakPolarHBondContact CE1-SD 3.25Å; F120-M126 HydrophobicContact CE2-CE 3.53Å; F120-M126 HydrophobicContact CE2-SD 4.07Å; F120-M126 HydrophobicContact CG-CE 4Å; F120-M126 HydrophobicContact CG-SD 4.19Å; F120-M126 HydrophobicContact CZ-CE 3.65Å; F120-M126 HydrophobicContact CZ-SD 3.55Å; F120-M126 VanDerWaalsContact CZ-SD 3.55Å
121	S	56.2	Low	60.9	Low	115 Å²	115	88.9 Å²	88.9	80%	0.804	48%	0.479	S	S	*	.	S	Bend	trans	-74.8	-35.8	172.2	41.5	0	0	0	0	112.2
122	D	66.1	Low	63.3	Low	71 Å²	71	87.3 Å²	87.3	38%	0.38	46%	0.463	S	S	.	.			trans	-130	86	168.5	-175.8	11.5	0	0	0	111.7	L102 T124 G125 M126	L102-D122 HydrophobicContact CD2-CB 4.29Å; D122-T124 PolarHBondContact O-N 3.39Å; D122-T124 WeakPolarHBondContact OD1-CA 3.47Å; D122-T124 VanDerWaalsContact OD1-CB 3.28Å; D122-T124 WeakPolarHBondContact OD1-CB 3.24Å; D122-T124 PolarHBondContact OD1-N 3.08Å; D122-G125 PolarHBondContact O-N 2.93Å; D122-G125 PolarHBondContact OD1-N 3.44Å; D122-G125 WeakPolarHBondContact OD2-CA 3.33Å; D122-G125 PolarHBondContact OD2-N 3.47Å; D122-M126 PolarHBondContact O-N 2.94Å
123	R	70.1	Confident	65.4	Low	83 Å²	83	78 Å²	78	31%	0.313	42%	0.42	S	S	.	.	H	α-helix	trans	-61	-30.2	172.3	-169.7	176.8	-173.3	175.7	2.6	112	I37 D41 F120 V127	I37-R123 PolarHBondContact O-NH2 2.98Å; D41-R123 IonicContact OD1-CZ 3.83Å; D41-R123 IonicContact OD1-NH1 2.76Å; D41-R123 PolarHBondContact OD1-NH1 3.38Å; D41-R123 IonicContact OD2-CZ 3.76Å; D41-R123 IonicContact OD2-NH1 2.72Å; D41-R123 PolarHBondContact OD2-NH1 2.82Å; F120-R123 HydrophobicContact CB-CB 4.38Å; R123-V127 VanDerWaalsContact O-CG2 3.3Å; R123-V127 WeakPolarHBondContact O-CG2 3.48Å; R123-V127 PolarHBondContact O-N 2.85Å
124	T	76.4	Confident	68	Low	88 Å²	88	74 Å²	74	54%	0.54	39%	0.394	S	S	.	.	H	α-helix	trans	-72.2	-43.6	-179.2	-53.4	0	0	0	0	110.6	D122 V127 K128	D122-T124 PolarHBondContact O-N 3.39Å; D122-T124 WeakPolarHBondContact OD1-CA 3.47Å; D122-T124 VanDerWaalsContact OD1-CB 3.28Å; D122-T124 WeakPolarHBondContact OD1-CB 3.24Å; D122-T124 PolarHBondContact OD1-N 3.08Å; T124-V127 PolarHBondContact O-N 2.75Å; T124-K128 HydrophobicContact CG2-CD 4.36Å; T124-K128 WeakPolarHBondContact O-CB 3.01Å; T124-K128 VanDerWaalsContact O-CG 3.3Å; T124-K128 WeakPolarHBondContact O-CG 3.48Å; T124-K128 PolarHBondContact O-N 3.13Å
125	G	80.9	Confident	70.6	Confident	11 Å²	11	69.9 Å²	69.9	11%	0.113	38%	0.377	C	S	.	.	H	α-helix	trans	-58.5	-45.8	170.9	0	0	0	0	0	112.1	L102 D122 V127 K128 A129	L102-G125 VanDerWaalsContact CD1-C 3.5Å; D122-G125 PolarHBondContact O-N 2.93Å; D122-G125 PolarHBondContact OD1-N 3.44Å; D122-G125 WeakPolarHBondContact OD2-CA 3.33Å; D122-G125 PolarHBondContact OD2-N 3.47Å; G125-V127 PolarHBondContact O-N 2.99Å; G125-K128 WeakPolarHBondContact O-CB 3.43Å; G125-K128 PolarHBondContact O-N 3.23Å; G125-A129 WeakPolarHBondContact O-CB 3.3Å; G125-A129 PolarHBondContact O-N 2.91Å
126	M	81.1	Confident	73	Confident	5 Å²	5	66.3 Å²	66.3	3%	0.025	34%	0.339	C	S	.	.	H	α-helix	trans	-62.4	-45.9	177.3	-175.4	-177.9	64.4	0	0	112	L36 F120 D122 K128 A129 A130	L36-M126 VanDerWaalsContact O-CE 3.28Å; L36-M126 WeakPolarHBondContact O-CE 3.22Å; F120-M126 HydrophobicContact CD1-CE 4.1Å; F120-M126 HydrophobicContact CD1-SD 3.68Å; F120-M126 HydrophobicContact CD2-CE 3.71Å; F120-M126 HydrophobicContact CD2-SD 4.36Å; F120-M126 HydrophobicContact CE1-CE 3.94Å; F120-M126 HydrophobicContact CE1-SD 3.32Å; F120-M126 WeakPolarHBondContact CE1-SD 3.25Å; F120-M126 HydrophobicContact CE2-CE 3.53Å; F120-M126 HydrophobicContact CE2-SD 4.07Å; F120-M126 HydrophobicContact CG-CE 4Å; F120-M126 HydrophobicContact CG-SD 4.19Å; F120-M126 HydrophobicContact CZ-CE 3.65Å; F120-M126 HydrophobicContact CZ-SD 3.55Å; F120-M126 VanDerWaalsContact CZ-SD 3.55Å; D122-M126 PolarHBondContact O-N 2.94Å; M126-K128 VanDerWaalsContact C-N 3.29Å; M126-K128 PolarHBondContact O-N 3.28Å; M126-A129 PolarHBondContact O-N 3.16Å; M126-A130 WeakPolarHBondContact O-CB 3.36Å; M126-A130 PolarHBondContact O-N 3.31Å
127	V	81.1	Confident	75.5	Confident	35 Å²	35	55.4 Å²	55.4	21%	0.212	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-38.4	176.6	171.5	0	0	0	0	111.3	I37 R123 T124 G125 R131	I37-V127 HydrophobicContact CD1-CG2 4.37Å; I37-V127 HydrophobicContact CG1-CG2 4.08Å; I37-V127 HydrophobicContact CG2-CG2 4.1Å; R123-V127 VanDerWaalsContact O-CG2 3.3Å; R123-V127 WeakPolarHBondContact O-CG2 3.48Å; R123-V127 PolarHBondContact O-N 2.85Å; T124-V127 PolarHBondContact O-N 2.75Å; G125-V127 PolarHBondContact O-N 2.99Å; V127-R131 WeakPolarHBondContact O-CB 3.09Å; V127-R131 VanDerWaalsContact O-CG 3.25Å; V127-R131 WeakPolarHBondContact O-CG 3.49Å; V127-R131 PolarHBondContact O-N 3.38Å
128	K	84.8	Confident	77.8	Confident	133 Å²	133	51 Å²	51	58%	0.578	27%	0.272	S	S	*	.	H	α-helix	trans	-65.2	-49.4	173.9	-75	169.9	177.9	175.6	0	111.9	T124 G125 M126 A130 R131 L132	T124-K128 HydrophobicContact CG2-CD 4.36Å; T124-K128 WeakPolarHBondContact O-CB 3.01Å; T124-K128 VanDerWaalsContact O-CG 3.3Å; T124-K128 WeakPolarHBondContact O-CG 3.48Å; T124-K128 PolarHBondContact O-N 3.13Å; G125-K128 WeakPolarHBondContact O-CB 3.43Å; G125-K128 PolarHBondContact O-N 3.23Å; M126-K128 VanDerWaalsContact C-N 3.29Å; M126-K128 PolarHBondContact O-N 3.28Å; K128-A130 PolarHBondContact O-N 2.82Å; K128-R131 PolarHBondContact O-N 2.71Å; K128-L132 WeakPolarHBondContact O-CB 3.48Å; K128-L132 VanDerWaalsContact O-CG 3.3Å; K128-L132 WeakPolarHBondContact O-CG 3.38Å; K128-L132 PolarHBondContact O-N 2.88Å
129	A	86.9	Confident	79.7	Confident	5 Å²	5	50.8 Å²	50.8	4%	0.041	27%	0.265	C	S	.	.	H	α-helix	trans	-63	-42.1	-178.7	0	0	0	0	0	111.8	A98 I99 L102 G125 M126 L132 L133	A98-A129 HydrophobicContact CB-CB 4.12Å; I99-A129 HydrophobicContact CG1-CB 3.78Å; L102-A129 HydrophobicContact CD1-CB 4.07Å; G125-A129 WeakPolarHBondContact O-CB 3.3Å; G125-A129 PolarHBondContact O-N 2.91Å; M126-A129 PolarHBondContact O-N 3.16Å; A129-L132 PolarHBondContact O-N 2.95Å; A129-L133 WeakPolarHBondContact O-CB 3.36Å; A129-L133 PolarHBondContact O-N 2.79Å
130	A	85	Confident	81.8	Confident	3 Å²	3	49.7 Å²	49.7	3%	0.025	26%	0.259	C	S	.	.	H	α-helix	trans	-66.5	-41.2	175.8	0	0	0	0	0	112.9	I33 I37 M126 K128 L133 L134	I33-A130 HydrophobicContact CD1-CB 4.49Å; I33-A130 HydrophobicContact CG1-CB 4.23Å; I33-A130 HydrophobicContact CG2-CB 3.87Å; I37-A130 HydrophobicContact CD1-CB 4.24Å; M126-A130 WeakPolarHBondContact O-CB 3.36Å; M126-A130 PolarHBondContact O-N 3.31Å; K128-A130 PolarHBondContact O-N 2.82Å; A130-L133 PolarHBondContact O-N 3.38Å; A130-L134 PolarHBondContact O-N 3.31Å
131	R	84.8	Confident	83.5	Confident	180 Å²	180	49.9 Å²	49.9	68%	0.679	26%	0.26	S	S	*	.	H	α-helix	trans	-63.3	-41.2	172.9	-76.5	174.9	179.4	-116.2	1.2	112.3	V127 K128 L134 S135	V127-R131 WeakPolarHBondContact O-CB 3.09Å; V127-R131 VanDerWaalsContact O-CG 3.25Å; V127-R131 WeakPolarHBondContact O-CG 3.49Å; V127-R131 PolarHBondContact O-N 3.38Å; K128-R131 PolarHBondContact O-N 2.71Å; R131-L134 PolarHBondContact O-N 3.27Å; R131-S135 WeakPolarHBondContact O-CB 3.48Å; R131-S135 PolarHBondContact O-N 2.97Å
132	L	89.3	Confident	85	Confident	92 Å²	92	46.5 Å²	46.5	48%	0.482	24%	0.235	S	C	.	.	H	α-helix	trans	-63.5	-41.1	174.7	-74.3	170.2	0	0	0	111.6	A95 K128 A129 S135 S136	A95-L132 HydrophobicContact CB-CB 4.06Å; K128-L132 WeakPolarHBondContact O-CB 3.48Å; K128-L132 VanDerWaalsContact O-CG 3.3Å; K128-L132 WeakPolarHBondContact O-CG 3.38Å; K128-L132 PolarHBondContact O-N 2.88Å; A129-L132 PolarHBondContact O-N 2.95Å; L132-S135 PolarHBondContact O-N 3.36Å; L132-S136 WeakPolarHBondContact O-CB 3.19Å; L132-S136 PolarHBondContact O-N 3.45Å; L132-S136 PolarHBondContact O-OG 3.28Å
133	L	89.4	Confident	86.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-47.7	176.3	-178.8	61.2	0	0	0	111.4	L29 V60 V64 A92 A95 I99 A129 A130 S135 S136 V137	L29-L133 HydrophobicContact CD1-CD2 4.2Å; V60-L133 HydrophobicContact CG1-CD2 3.77Å; V64-L133 HydrophobicContact CB-CD1 4.44Å; V64-L133 HydrophobicContact CG1-CD1 3.94Å; V64-L133 HydrophobicContact CG2-CD1 3.57Å; V64-L133 HydrophobicContact CG2-CD2 3.83Å; V64-L133 HydrophobicContact CG2-CG 4.32Å; A92-L133 HydrophobicContact CB-CD1 4.42Å; A95-L133 HydrophobicContact CB-CB 3.8Å; A95-L133 HydrophobicContact CB-CD1 4.28Å; I99-L133 HydrophobicContact CD1-CB 4.2Å; I99-L133 HydrophobicContact CD1-CD2 3.69Å; A129-L133 WeakPolarHBondContact O-CB 3.36Å; A129-L133 PolarHBondContact O-N 2.79Å; A130-L133 PolarHBondContact O-N 3.38Å; L133-S135 VanDerWaalsContact C-N 3.35Å; L133-S135 PolarHBondContact O-N 3.43Å; L133-S136 PolarHBondContact O-N 3.27Å; L133-S136 PolarHBondContact O-OG 3.38Å; L133-V137 HydrophobicContact CD1-CG2 3.7Å; L133-V137 HydrophobicContact CG-CG2 4.23Å; L133-V137 WeakPolarHBondContact O-CB 3.44Å; L133-V137 VanDerWaalsContact O-CG2 3.3Å; L133-V137 WeakPolarHBondContact O-CG2 3.3Å; L133-V137 PolarHBondContact O-N 2.67Å
134	L	87.4	Confident	87.1	Confident	49 Å²	49	40.6 Å²	40.6	26%	0.257	21%	0.213	S	C	.	.	H	α-helix	trans	-59.9	-44.8	177.7	-177.1	60.8	0	0	0	111.8	L26 L29 V30 I33 A130 R131 T138	L26-L134 HydrophobicContact CD2-CD1 4.02Å; L29-L134 HydrophobicContact CD2-CD1 4.27Å; V30-L134 HydrophobicContact CG2-CD1 3.6Å; V30-L134 HydrophobicContact CG2-CD2 4.09Å; I33-L134 HydrophobicContact CD1-CB 3.98Å; A130-L134 PolarHBondContact O-N 3.31Å; R131-L134 PolarHBondContact O-N 3.27Å; L134-T138 VanDerWaalsContact O-CB 3.3Å; L134-T138 WeakPolarHBondContact O-CB 3.34Å; L134-T138 PolarHBondContact O-N 2.98Å; L134-T138 PolarHBondContact O-OG1 3.37Å
135	S	88.9	Confident	87.8	Confident	66 Å²	66	37.6 Å²	37.6	46%	0.462	19%	0.194	S	C	.	.	H	α-helix	trans	-62.8	-47.8	178.6	179.9	0	0	0	0	112.5	R131 L132 L133 T138 K139	R131-S135 WeakPolarHBondContact O-CB 3.48Å; R131-S135 PolarHBondContact O-N 2.97Å; L132-S135 PolarHBondContact O-N 3.36Å; L133-S135 VanDerWaalsContact C-N 3.35Å; L133-S135 PolarHBondContact O-N 3.43Å; S135-T138 PolarHBondContact O-N 2.91Å; S135-K139 WeakPolarHBondContact O-CB 3.31Å; S135-K139 PolarHBondContact O-N 2.86Å
136	S	91.6	Very high	88.2	Confident	5 Å²	5	42.4 Å²	42.4	4%	0.035	21%	0.209	C	C	.	.	H	α-helix	trans	-71	-38.6	-179.2	51.6	0	0	0	0	113.5	A92 L132 L133 K139 V140	A92-S136 WeakPolarHBondContact CA-OG 3.26Å; A92-S136 PolarHBondContact N-OG 2.9Å; L132-S136 WeakPolarHBondContact O-CB 3.19Å; L132-S136 PolarHBondContact O-N 3.45Å; L132-S136 PolarHBondContact O-OG 3.28Å; L133-S136 PolarHBondContact O-N 3.27Å; L133-S136 PolarHBondContact O-OG 3.38Å; S136-K139 WeakPolarHBondContact O-CB 3.46Å; S136-K139 PolarHBondContact O-N 3.35Å; S136-V140 WeakPolarHBondContact O-CG2 3.44Å; S136-V140 PolarHBondContact O-N 2.82Å
137	V	90.8	Very high	88.6	Confident	7 Å²	7	42.4 Å²	42.4	4%	0.042	21%	0.209	C	C	.	.	H	α-helix	trans	-63.6	-42.1	171.6	170.8	0	0	0	0	111	L26 L29 F67 A92 L133 K139 V140 L141	L26-V137 HydrophobicContact CD2-CG1 4Å; L29-V137 HydrophobicContact CD2-CB 3.87Å; L29-V137 HydrophobicContact CD2-CG1 3.71Å; L29-V137 HydrophobicContact CD2-CG2 4.02Å; F67-V137 HydrophobicContact CD1-CG2 4.21Å; F67-V137 HydrophobicContact CE1-CB 4.17Å; F67-V137 HydrophobicContact CE1-CG1 3.9Å; F67-V137 HydrophobicContact CE1-CG2 3.91Å; F67-V137 HydrophobicContact CE2-CG1 4.31Å; F67-V137 HydrophobicContact CZ-CB 4.43Å; F67-V137 HydrophobicContact CZ-CG1 3.74Å; A92-V137 HydrophobicContact CB-CG2 4.3Å; L133-V137 HydrophobicContact CD1-CG2 3.7Å; L133-V137 HydrophobicContact CG-CG2 4.23Å; L133-V137 WeakPolarHBondContact O-CB 3.44Å; L133-V137 VanDerWaalsContact O-CG2 3.3Å; L133-V137 WeakPolarHBondContact O-CG2 3.3Å; L133-V137 PolarHBondContact O-N 2.67Å; V137-K139 VanDerWaalsContact C-N 3.32Å; V137-K139 PolarHBondContact O-N 2.95Å; V137-V140 PolarHBondContact O-N 3.4Å; V137-L141 HydrophobicContact CG1-CD1 4.07Å; V137-L141 WeakPolarHBondContact O-CG 3.44Å; V137-L141 PolarHBondContact O-N 2.93Å
138	T	89.5	Confident	89.1	Confident	12 Å²	12	43.5 Å²	43.5	7%	0.074	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-42.6	174.3	-55.3	0	0	0	0	111.1	L15 L26 L134 S135 L141 V142	L15-T138 HydrophobicContact CB-CG2 4.16Å; L15-T138 HydrophobicContact CD1-CG2 3.96Å; L26-T138 HydrophobicContact CD1-CG2 4.04Å; L26-T138 WeakPolarHBondContact CD2-OG1 3.28Å; L134-T138 VanDerWaalsContact O-CB 3.3Å; L134-T138 WeakPolarHBondContact O-CB 3.34Å; L134-T138 PolarHBondContact O-N 2.98Å; L134-T138 PolarHBondContact O-OG1 3.37Å; S135-T138 PolarHBondContact O-N 2.91Å; T138-L141 PolarHBondContact O-N 2.68Å; T138-V142 HydrophobicContact CG2-CG2 4.4Å; T138-V142 WeakPolarHBondContact O-CG2 3.47Å; T138-V142 PolarHBondContact O-N 2.76Å
139	K	90.5	Very high	89.4	Confident	60 Å²	60	38.3 Å²	38.3	26%	0.261	19%	0.194	S	C	.	.	H	α-helix	trans	-61.4	-46.4	175.9	-175.3	-179.9	169.6	-170.4	0	112.2	A88 E91 S135 S136 V137 L141 V142 L143	A88-K139 HydrophobicContact CB-CB 4.23Å; A88-K139 HydrophobicContact CB-CD 3.74Å; A88-K139 HydrophobicContact CB-CG 3.75Å; E91-K139 IonicContact OE1-NZ 3.73Å; E91-K139 IonicContact OE2-NZ 2.81Å; E91-K139 PolarHBondContact OE2-NZ 3.09Å; S135-K139 WeakPolarHBondContact O-CB 3.31Å; S135-K139 PolarHBondContact O-N 2.86Å; S136-K139 WeakPolarHBondContact O-CB 3.46Å; S136-K139 PolarHBondContact O-N 3.35Å; V137-K139 VanDerWaalsContact C-N 3.32Å; V137-K139 PolarHBondContact O-N 2.95Å; K139-L141 VanDerWaalsContact C-N 3.33Å; K139-L141 PolarHBondContact O-N 3.48Å; K139-V142 PolarHBondContact O-N 2.82Å; K139-L143 HydrophobicContact CG-CD1 4.09Å; K139-L143 WeakPolarHBondContact O-CB 3.22Å; K139-L143 VanDerWaalsContact O-CG 3.22Å; K139-L143 WeakPolarHBondContact O-CG 3.44Å; K139-L143 PolarHBondContact O-N 3.18Å
140	V	92.2	Very high	89.7	Confident	5 Å²	5	41.2 Å²	41.2	3%	0.03	21%	0.205	C	C	.	.	H	α-helix	trans	-58	-44.3	174	170.4	0	0	0	0	111.2	F67 M85 A88 S136 V137 L143 A144	F67-V140 HydrophobicContact CE1-CB 3.73Å; F67-V140 HydrophobicContact CE1-CG1 3.54Å; F67-V140 HydrophobicContact CE1-CG2 4.15Å; F67-V140 HydrophobicContact CE2-CG1 4.33Å; F67-V140 HydrophobicContact CZ-CB 3.72Å; F67-V140 HydrophobicContact CZ-CG1 3.37Å; M85-V140 HydrophobicContact SD-CB 4.22Å; M85-V140 HydrophobicContact SD-CG1 3.78Å; M85-V140 HydrophobicContact SD-CG2 4.3Å; A88-V140 HydrophobicContact CB-CG2 3.58Å; S136-V140 WeakPolarHBondContact O-CG2 3.44Å; S136-V140 PolarHBondContact O-N 2.82Å; V137-V140 PolarHBondContact O-N 3.4Å; V140-L143 PolarHBondContact O-N 2.9Å; V140-A144 PolarHBondContact O-N 2.92Å
141	L	90.8	Very high	90.1	Very high	22 Å²	22	45.1 Å²	45.1	12%	0.115	22%	0.223	C	C	.	.	H	α-helix	trans	-65.9	-41.6	179	-72.6	170.6	0	0	0	113.1	V22 T25 L26 F67 V137 T138 K139 L143 A144 D145	V22-L141 HydrophobicContact CG1-CB 3.87Å; V22-L141 HydrophobicContact CG1-CD1 4.16Å; V22-L141 HydrophobicContact CG2-CB 4.13Å; T25-L141 HydrophobicContact CG2-CD1 3.88Å; T25-L141 HydrophobicContact CG2-CD2 4.13Å; L26-L141 HydrophobicContact CD1-CD1 4.2Å; L26-L141 HydrophobicContact CD2-CD1 3.84Å; L26-L141 HydrophobicContact CG-CD1 3.7Å; F67-L141 HydrophobicContact CE2-CD2 3.94Å; F67-L141 HydrophobicContact CE2-CG 4.16Å; F67-L141 HydrophobicContact CZ-CD2 4.27Å; F67-L141 HydrophobicContact CZ-CG 4.04Å; V137-L141 HydrophobicContact CG1-CD1 4.07Å; V137-L141 WeakPolarHBondContact O-CG 3.44Å; V137-L141 PolarHBondContact O-N 2.93Å; T138-L141 PolarHBondContact O-N 2.68Å; K139-L141 VanDerWaalsContact C-N 3.33Å; K139-L141 PolarHBondContact O-N 3.48Å; L141-L143 VanDerWaalsContact C-N 3.31Å; L141-L143 PolarHBondContact O-N 3.42Å; L141-A144 PolarHBondContact O-N 3.35Å; L141-D145 PolarHBondContact O-N 2.84Å
142	V	88.6	Confident	90.6	Very high	45 Å²	45	36.6 Å²	36.6	27%	0.273	19%	0.191	S	C	.	.	H	α-helix	trans	-66.6	-32.6	175.6	169.8	0	0	0	0	111.7	T138 K139 D145 R146	T138-V142 HydrophobicContact CG2-CG2 4.4Å; T138-V142 WeakPolarHBondContact O-CG2 3.47Å; T138-V142 PolarHBondContact O-N 2.76Å; K139-V142 PolarHBondContact O-N 2.82Å; V142-D145 PolarHBondContact O-N 3.34Å; V142-R146 WeakPolarHBondContact O-CG 3.23Å; V142-R146 PolarHBondContact O-N 3.4Å; V142-R146 VanDerWaalsContact O-N 3.08Å
143	L	89.9	Confident	90.9	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-72.7	-32.4	173.4	-67.1	169.4	0	0	0	112.5	E84 M85 A88 K139 V140 L141 I147	E84-L143 HydrophobicContact CB-CD1 4.34Å; E84-L143 HydrophobicContact CB-CD2 4.47Å; E84-L143 HydrophobicContact CG-CD1 3.93Å; E84-L143 HydrophobicContact CG-CD2 3.99Å; E84-L143 VanDerWaalsContact OE2-CD2 3.25Å; E84-L143 WeakPolarHBondContact OE2-CD2 3.42Å; M85-L143 HydrophobicContact CB-CD1 4.44Å; M85-L143 HydrophobicContact CE-CB 3.59Å; M85-L143 HydrophobicContact SD-CB 3.85Å; M85-L143 HydrophobicContact SD-CD1 4.31Å; A88-L143 HydrophobicContact CB-CD1 4.07Å; K139-L143 HydrophobicContact CG-CD1 4.09Å; K139-L143 WeakPolarHBondContact O-CB 3.22Å; K139-L143 VanDerWaalsContact O-CG 3.22Å; K139-L143 WeakPolarHBondContact O-CG 3.44Å; K139-L143 PolarHBondContact O-N 3.18Å; V140-L143 PolarHBondContact O-N 2.9Å; L141-L143 VanDerWaalsContact C-N 3.31Å; L141-L143 PolarHBondContact O-N 3.42Å; L143-I147 WeakPolarHBondContact O-CG1 3.41Å; L143-I147 PolarHBondContact O-N 3.5Å
144	A	89.9	Confident	91.2	Very high	27 Å²	27	38.2 Å²	38.2	22%	0.223	20%	0.203	C	C	.	.	H	α-helix	trans	-67.7	-40.9	170.9	0	0	0	0	0	111.6	M85 V140 L141 R146 I147 V148	M85-A144 HydrophobicContact CE-CB 4.23Å; V140-A144 PolarHBondContact O-N 2.92Å; L141-A144 PolarHBondContact O-N 3.35Å; A144-R146 VanDerWaalsContact C-N 3.34Å; A144-R146 PolarHBondContact O-N 2.68Å; A144-I147 WeakPolarHBondContact O-CB 3.37Å; A144-I147 PolarHBondContact O-N 3.42Å; A144-V148 PolarHBondContact O-N 3.07Å; A144-V148 VanDerWaalsContact O-N 3.11Å
145	D	90	Very high	91.7	Very high	26 Å²	26	35.9 Å²	35.9	14%	0.139	19%	0.191	C	C	.	.	H	α-helix	trans	-59.3	-43.7	174.3	-164.3	91.7	0	0	0	111.7	T19 L141 V142 I147 V148 I149 R196	T19-D145 VanDerWaalsContact CG2-OD1 3.26Å; T19-D145 WeakPolarHBondContact CG2-OD1 3.45Å; T19-D145 PolarHBondContact OG1-OD1 2.94Å; L141-D145 PolarHBondContact O-N 2.84Å; V142-D145 PolarHBondContact O-N 3.34Å; D145-I147 VanDerWaalsContact C-N 3.27Å; D145-I147 PolarHBondContact O-N 3.49Å; D145-V148 PolarHBondContact O-N 2.93Å; D145-V148 VanDerWaalsContact O-N 3.17Å; D145-I149 WeakPolarHBondContact O-CG1 3.38Å; D145-I149 PolarHBondContact O-N 2.85Å; D145-I149 WeakPolarHBondContact OD2-CD1 3.44Å; D145-R196 VanDerWaalsContact CG-NH1 3.27Å; D145-R196 IonicContact OD1-CZ 3.17Å; D145-R196 IonicContact OD1-NH1 3.9Å; D145-R196 PolarHBondContact OD1-NH1 3.18Å; D145-R196 IonicContact OD1-NH2 2.86Å; D145-R196 IonicContact OD2-CZ 3.67Å; D145-R196 IonicContact OD2-NH1 3.57Å; D145-R196 PolarHBondContact OD2-NH1 3.06Å; D145-R196 IonicContact OD2-NH2 2.66Å; D145-R196 PolarHBondContact OD2-NH2 3.43Å
146	R	89.3	Confident	92.1	Very high	112 Å²	112	34.5 Å²	34.5	42%	0.423	18%	0.175	S	C	.	.	H	α-helix	trans	-57.6	-34.1	171.6	-80.1	172.5	149.8	-166.4	-2.9	113.7	L81 E84 V142 A144 K150	L81-R146 HydrophobicContact CD1-CB 4.11Å; E84-R146 IonicContact OE1-NH1 3.73Å; E84-R146 IonicContact OE2-NH1 3.33Å; E84-R146 PolarHBondContact OE2-NH1 2.93Å; V142-R146 WeakPolarHBondContact O-CG 3.23Å; V142-R146 PolarHBondContact O-N 3.4Å; V142-R146 VanDerWaalsContact O-N 3.08Å; A144-R146 VanDerWaalsContact C-N 3.34Å; A144-R146 PolarHBondContact O-N 2.68Å; R146-K150 WeakPolarHBondContact O-CG 3.49Å; R146-K150 PolarHBondContact O-N 3.32Å
147	I	89.8	Confident	92.4	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.026	19%	0.191	C	C	.	.	H	α-helix	trans	-71	-41.4	176.7	-72	166.9	0	0	0	110.7	I74 N78 L81 M85 L143 A144 D145 I149 K150 Q151	I74-I147 HydrophobicContact CG2-CD1 3.42Å; I74-I147 VanDerWaalsContact CG2-CD1 3.42Å; N78-I147 HydrophobicContact CB-CD1 3.82Å; N78-I147 HydrophobicContact CB-CG1 4.2Å; N78-I147 WeakPolarHBondContact OD1-CG2 3.37Å; L81-I147 HydrophobicContact CD1-CD1 4.38Å; L81-I147 HydrophobicContact CD1-CG1 3.66Å; M85-I147 HydrophobicContact CE-CD1 4.05Å; L143-I147 WeakPolarHBondContact O-CG1 3.41Å; L143-I147 PolarHBondContact O-N 3.5Å; A144-I147 WeakPolarHBondContact O-CB 3.37Å; A144-I147 PolarHBondContact O-N 3.42Å; D145-I147 VanDerWaalsContact C-N 3.27Å; D145-I147 PolarHBondContact O-N 3.49Å; I147-I149 VanDerWaalsContact C-N 3.33Å; I147-I149 PolarHBondContact O-N 3.33Å; I147-K150 PolarHBondContact O-N 2.86Å; I147-K150 VanDerWaalsContact O-N 3.14Å; I147-Q151 WeakPolarHBondContact O-CG 3.23Å; I147-Q151 PolarHBondContact O-N 3Å
148	V	91.3	Very high	92.8	Very high	57 Å²	57	40.9 Å²	40.9	35%	0.345	21%	0.205	S	C	.	.	H	α-helix	trans	-61.2	-41.4	173.2	178.4	0	0	0	0	111.1	A144 D145 K150 Q151 I152	A144-V148 PolarHBondContact O-N 3.07Å; A144-V148 VanDerWaalsContact O-N 3.11Å; D145-V148 PolarHBondContact O-N 2.93Å; D145-V148 VanDerWaalsContact O-N 3.17Å; V148-K150 VanDerWaalsContact C-N 3.35Å; V148-K150 PolarHBondContact O-N 3Å; V148-Q151 WeakPolarHBondContact O-CB 3.42Å; V148-Q151 PolarHBondContact O-N 2.9Å; V148-I152 HydrophobicContact CG1-CD1 4.32Å; V148-I152 WeakPolarHBondContact O-CG1 3.26Å; V148-I152 PolarHBondContact O-N 3.05Å
149	I	92.7	Very high	93.2	Very high	25 Å²	25	40.3 Å²	40.3	13%	0.128	20%	0.201	C	C	.	.	H	α-helix	trans	-59.5	-44.3	173.3	-65.2	163	0	0	0	111	D145 I147 Q151 I152 I153 V261 T262	D145-I149 WeakPolarHBondContact O-CG1 3.38Å; D145-I149 PolarHBondContact O-N 2.85Å; D145-I149 WeakPolarHBondContact OD2-CD1 3.44Å; I147-I149 VanDerWaalsContact C-N 3.33Å; I147-I149 PolarHBondContact O-N 3.33Å; I149-Q151 VanDerWaalsContact C-N 3.35Å; I149-Q151 PolarHBondContact O-N 3.45Å; I149-I152 PolarHBondContact O-N 2.93Å; I149-I153 HydrophobicContact CG2-CD1 3.87Å; I149-I153 WeakPolarHBondContact O-CG1 3.35Å; I149-I153 PolarHBondContact O-N 3.44Å; I149-V261 WeakPolarHBondContact CD1-O 3.41Å; I149-V261 HydrophobicContact CG1-CB 4.46Å; I149-V261 HydrophobicContact CG2-CB 4.44Å; I149-V261 HydrophobicContact CG2-CG2 4.09Å; I149-T262 HydrophobicContact CG2-CG2 4.18Å
150	K	91.6	Very high	93.5	Very high	65 Å²	65	39 Å²	39	28%	0.283	20%	0.197	S	C	.	.	H	α-helix	trans	-63.9	-35.6	175.9	-75.3	-175.4	180	-170.8	0	113.1	E80 L81 R146 I147 V148 I153 T154	E80-K150 IonicContact OE2-NZ 3.27Å; E80-K150 PolarHBondContact OE2-NZ 3.45Å; L81-K150 HydrophobicContact CD1-CD 4.17Å; R146-K150 WeakPolarHBondContact O-CG 3.49Å; R146-K150 PolarHBondContact O-N 3.32Å; I147-K150 PolarHBondContact O-N 2.86Å; I147-K150 VanDerWaalsContact O-N 3.14Å; V148-K150 VanDerWaalsContact C-N 3.35Å; V148-K150 PolarHBondContact O-N 3Å; K150-I153 PolarHBondContact O-N 2.99Å; K150-T154 WeakPolarHBondContact O-CB 3.3Å; K150-T154 PolarHBondContact O-N 3.48Å; K150-T154 PolarHBondContact O-OG1 2.75Å
151	Q	93.3	Very high	93.8	Very high	86 Å²	86	42.8 Å²	42.8	40%	0.402	22%	0.22	S	C	.	.	H	α-helix	trans	-63.2	-43.9	173.8	-71.4	171.8	-9.1	0	0	111.4	I147 V148 I149 T154 S155	I147-Q151 WeakPolarHBondContact O-CG 3.23Å; I147-Q151 PolarHBondContact O-N 3Å; V148-Q151 WeakPolarHBondContact O-CB 3.42Å; V148-Q151 PolarHBondContact O-N 2.9Å; I149-Q151 VanDerWaalsContact C-N 3.35Å; I149-Q151 PolarHBondContact O-N 3.45Å; Q151-T154 PolarHBondContact O-N 2.97Å; Q151-S155 WeakPolarHBondContact O-CB 3.46Å; Q151-S155 PolarHBondContact O-N 3Å
152	I	96.2	Very high	94.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-46.8	175.3	-65.7	165.1	0	0	0	111.2	V148 I149 T154 S155 R156 F189 L192 T193 R196 V257 I258 V261	V148-I152 HydrophobicContact CG1-CD1 4.32Å; V148-I152 WeakPolarHBondContact O-CG1 3.26Å; V148-I152 PolarHBondContact O-N 3.05Å; I149-I152 PolarHBondContact O-N 2.93Å; I152-T154 PolarHBondContact O-N 2.95Å; I152-S155 PolarHBondContact O-N 2.93Å; I152-R156 WeakPolarHBondContact O-CB 3.47Å; I152-R156 PolarHBondContact O-N 3.38Å; I152-F189 HydrophobicContact CG2-CE2 3.89Å; I152-L192 HydrophobicContact CG1-CB 3.99Å; I152-T193 HydrophobicContact CG2-CG2 4.09Å; I152-R196 HydrophobicContact CD1-CB 3.79Å; I152-R196 HydrophobicContact CD1-CG 3.84Å; I152-V257 HydrophobicContact CG2-CG1 4.05Å; I152-I258 HydrophobicContact CG2-CD1 4.42Å; I152-V261 HydrophobicContact CD1-CG1 4.15Å; I152-V261 HydrophobicContact CG2-CG2 4.2Å
153	I	95.9	Very high	94.5	Very high	47 Å²	47	39.7 Å²	39.7	24%	0.241	20%	0.202	C	C	.	.	H	α-helix	trans	-60.4	-44.5	176.5	-65.8	161.5	0	0	0	111.1	I149 K150 R156 N157 I258 T262	I149-I153 HydrophobicContact CG2-CD1 3.87Å; I149-I153 WeakPolarHBondContact O-CG1 3.35Å; I149-I153 PolarHBondContact O-N 3.44Å; K150-I153 PolarHBondContact O-N 2.99Å; I153-R156 PolarHBondContact O-N 3.31Å; I153-N157 WeakPolarHBondContact O-CB 3.31Å; I153-N157 PolarHBondContact O-N 2.9Å; I153-N157 PolarHBondContact O-ND2 3Å; I153-I258 HydrophobicContact CG1-CD1 3.95Å; I153-I258 HydrophobicContact CG1-CG2 4.48Å; I153-T262 HydrophobicContact CD1-CG2 3.88Å; I153-T262 HydrophobicContact CG1-CG2 4.46Å
154	T	95.7	Very high	94.8	Very high	80 Å²	80	42.5 Å²	42.5	49%	0.491	22%	0.217	S	C	.	.	H	α-helix	trans	-63.6	-43.4	179.8	-56.9	0	0	0	0	111	K150 Q151 I152 N157 K158	K150-T154 WeakPolarHBondContact O-CB 3.3Å; K150-T154 PolarHBondContact O-N 3.48Å; K150-T154 PolarHBondContact O-OG1 2.75Å; Q151-T154 PolarHBondContact O-N 2.97Å; I152-T154 PolarHBondContact O-N 2.95Å; T154-N157 PolarHBondContact O-N 3.2Å; T154-K158 PolarHBondContact O-N 3.32Å; T154-K158 VanDerWaalsContact O-N 3.08Å
155	S	97.8	Very high	95.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.5	-45.3	177.3	-163.9	0	0	0	0	111.8	Q151 I152 N157 K158 V159 E188	Q151-S155 WeakPolarHBondContact O-CB 3.46Å; Q151-S155 PolarHBondContact O-N 3Å; I152-S155 PolarHBondContact O-N 2.93Å; S155-N157 VanDerWaalsContact C-N 3.25Å; S155-N157 PolarHBondContact O-N 3.45Å; S155-K158 WeakPolarHBondContact O-CB 3.4Å; S155-K158 PolarHBondContact O-N 3.17Å; S155-K158 VanDerWaalsContact O-N 3.13Å; S155-V159 PolarHBondContact O-N 3.49Å; S155-V159 VanDerWaalsContact O-N 3.14Å; S155-E188 VanDerWaalsContact CB-OE1 3.29Å; S155-E188 WeakPolarHBondContact CB-OE1 3.48Å; S155-E188 PolarHBondContact OG-OE1 3.37Å
156	R	97.8	Very high	95.3	Very high	36 Å²	36	44.4 Å²	44.4	14%	0.136	22%	0.219	C	C	.	.	H	α-helix	trans	-55.2	-38.8	170.9	179.3	-90	-164.7	175	1.5	112.6	I152 I153 V159 L160 F189 L254 E255 I258	I152-R156 WeakPolarHBondContact O-CB 3.47Å; I152-R156 PolarHBondContact O-N 3.38Å; I153-R156 PolarHBondContact O-N 3.31Å; R156-V159 PolarHBondContact O-N 3.28Å; R156-L160 PolarHBondContact O-N 3.04Å; R156-F189 HydrophobicContact CB-CD2 4.26Å; R156-F189 HydrophobicContact CB-CE2 3.59Å; R156-F189 HydrophobicContact CB-CZ 3.98Å; R156-F189 HydrophobicContact CG-CE2 4.42Å; R156-F189 HydrophobicContact CG-CZ 4.33Å; R156-L254 HydrophobicContact CG-CB 4.05Å; R156-L254 HydrophobicContact CG-CD2 4.26Å; R156-E255 IonicContact CZ-OE2 3.4Å; R156-E255 IonicContact NH2-OE1 2.65Å; R156-E255 IonicContact NH2-OE2 3.57Å; R156-E255 PolarHBondContact NH2-OE2 2.98Å; R156-I258 HydrophobicContact CB-CD1 3.97Å; R156-I258 HydrophobicContact CG-CD1 3.96Å; R156-I258 HydrophobicContact CG-CG1 4.01Å
157	N	97.7	Very high	95.6	Very high	68 Å²	68	42 Å²	42	36%	0.364	21%	0.213	S	C	.	.	H	α-helix	trans	-74	-29.7	-179.8	-69.8	-14.3	0	0	0	112.8	I153 T154 S155 V161	I153-N157 WeakPolarHBondContact O-CB 3.31Å; I153-N157 PolarHBondContact O-N 2.9Å; I153-N157 PolarHBondContact O-ND2 3Å; T154-N157 PolarHBondContact O-N 3.2Å; S155-N157 VanDerWaalsContact C-N 3.25Å; S155-N157 PolarHBondContact O-N 3.45Å; N157-V161 WeakPolarHBondContact O-CG2 3.36Å; N157-V161 PolarHBondContact O-N 2.69Å
158	K	97.9	Very high	95.7	Very high	78 Å²	78	51 Å²	51	34%	0.339	25%	0.246	S	C	.	.	H	α-helix	trans	-59.5	-54.4	166.4	-61.7	171.3	-179.2	166	0	110.1	T154 S155 L160 V161 T162 E185 E188	T154-K158 PolarHBondContact O-N 3.32Å; T154-K158 VanDerWaalsContact O-N 3.08Å; S155-K158 WeakPolarHBondContact O-CB 3.4Å; S155-K158 PolarHBondContact O-N 3.17Å; S155-K158 VanDerWaalsContact O-N 3.13Å; K158-L160 VanDerWaalsContact C-N 3.3Å; K158-L160 PolarHBondContact O-N 3.35Å; K158-V161 WeakPolarHBondContact O-CA 3.24Å; K158-V161 WeakPolarHBondContact O-CB 3.4Å; K158-V161 PolarHBondContact O-N 3.01Å; K158-T162 PolarHBondContact O-N 3.44Å; K158-T162 PolarHBondContact O-OG1 3.06Å; K158-E185 HydrophobicContact CB-CB 4.45Å; K158-E185 HydrophobicContact CB-CG 4.13Å; K158-E185 HydrophobicContact CD-CG 4.46Å; K158-E185 VanDerWaalsContact O-OE2 3.09Å; K158-E188 IonicContact NZ-OE1 2.75Å; K158-E188 PolarHBondContact NZ-OE1 2.91Å; K158-E188 IonicContact NZ-OE2 2.61Å; K158-E188 PolarHBondContact NZ-OE2 3.17Å
159	V	98.3	Very high	95.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-54.6	-42.8	-179.8	171.7	0	0	0	0	111.8	S155 R156 T162 L163 F182 E185 M186 F189 L254	S155-V159 PolarHBondContact O-N 3.49Å; S155-V159 VanDerWaalsContact O-N 3.14Å; R156-V159 PolarHBondContact O-N 3.28Å; V159-T162 PolarHBondContact O-N 3.3Å; V159-T162 PolarHBondContact O-OG1 3.13Å; V159-L163 WeakPolarHBondContact O-CB 3.4Å; V159-L163 PolarHBondContact O-N 3.06Å; V159-F182 HydrophobicContact CG1-CD2 4.42Å; V159-F182 HydrophobicContact CG1-CE2 3.85Å; V159-E185 HydrophobicContact CG2-CB 3.85Å; V159-M186 HydrophobicContact CB-SD 4.38Å; V159-M186 HydrophobicContact CG1-CG 4.3Å; V159-M186 HydrophobicContact CG1-SD 3.43Å; V159-M186 WeakPolarHBondContact CG1-SD 3.49Å; V159-M186 HydrophobicContact CG2-CG 4.43Å; V159-M186 HydrophobicContact CG2-SD 3.96Å; V159-F189 HydrophobicContact CG2-CB 4.22Å; V159-L254 HydrophobicContact CG1-CD1 3.78Å; V159-L254 HydrophobicContact CG1-CD2 4.16Å
160	L	97.9	Very high	95.6	Very high	33 Å²	33	52.5 Å²	52.5	17%	0.173	26%	0.261	C	S	.	.	H	α-helix	trans	-63.9	-41.3	173.9	-79.1	-170.4	0	0	0	112.8	R156 K158 T162 L163 D164 R251 L254	R156-L160 PolarHBondContact O-N 3.04Å; K158-L160 VanDerWaalsContact C-N 3.3Å; K158-L160 PolarHBondContact O-N 3.35Å; L160-T162 VanDerWaalsContact C-N 3.31Å; L160-T162 PolarHBondContact O-N 3.06Å; L160-L163 HydrophobicContact CD2-CD2 4.28Å; L160-L163 PolarHBondContact O-N 3.31Å; L160-D164 WeakPolarHBondContact O-CB 3.34Å; L160-D164 PolarHBondContact O-N 3.06Å; L160-R251 HydrophobicContact CD2-CG 3.97Å; L160-L254 HydrophobicContact CD2-CD1 3.6Å; L160-L254 HydrophobicContact CG-CD1 4.15Å
161	V	97.8	Very high	95.6	Very high	85 Å²	85	52.7 Å²	52.7	52%	0.515	27%	0.268	S	S	.	.	H	α-helix	trans	-67.5	-29.6	179.2	168.9	0	0	0	0	112.2	N157 K158 K165	N157-V161 WeakPolarHBondContact O-CG2 3.36Å; N157-V161 PolarHBondContact O-N 2.69Å; K158-V161 WeakPolarHBondContact O-CA 3.24Å; K158-V161 WeakPolarHBondContact O-CB 3.4Å; K158-V161 PolarHBondContact O-N 3.01Å; V161-K165 WeakPolarHBondContact O-CD 3.35Å; V161-K165 VanDerWaalsContact O-CG 3.24Å; V161-K165 WeakPolarHBondContact O-CG 2.9Å
162	T	96.7	Very high	95.5	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	28%	0.275	C	S	.	.	H	α-helix	trans	-81.3	-34.6	170.9	44.9	0	0	0	0	113.1	K158 V159 L160 K165 L166 Q181 E185	K158-T162 PolarHBondContact O-N 3.44Å; K158-T162 PolarHBondContact O-OG1 3.06Å; V159-T162 PolarHBondContact O-N 3.3Å; V159-T162 PolarHBondContact O-OG1 3.13Å; L160-T162 VanDerWaalsContact C-N 3.31Å; L160-T162 PolarHBondContact O-N 3.06Å; T162-K165 WeakPolarHBondContact O-CB 3.38Å; T162-K165 PolarHBondContact O-N 2.85Å; T162-L166 WeakPolarHBondContact O-CG 3.32Å; T162-L166 PolarHBondContact O-N 2.86Å; T162-Q181 HydrophobicContact CG2-CB 4.28Å; T162-Q181 VanDerWaalsContact CG2-CD 3.43Å; T162-Q181 HydrophobicContact CG2-CG 3.79Å; T162-E185 WeakPolarHBondContact CB-OE2 3.23Å; T162-E185 WeakPolarHBondContact CG2-OE2 3.49Å; T162-E185 PolarHBondContact OG1-OE2 3.06Å
163	L	96.7	Very high	95.3	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.6	-47.2	173.3	-169.4	70	0	0	0	111.6	V159 L160 K165 L166 E167 F182 L223 F247 M250 R251	V159-L163 WeakPolarHBondContact O-CB 3.4Å; V159-L163 PolarHBondContact O-N 3.06Å; L160-L163 HydrophobicContact CD2-CD2 4.28Å; L160-L163 PolarHBondContact O-N 3.31Å; L163-K165 PolarHBondContact O-N 2.66Å; L163-L166 WeakPolarHBondContact O-CB 3.35Å; L163-L166 PolarHBondContact O-N 3.37Å; L163-L166 VanDerWaalsContact O-N 3.09Å; L163-E167 PolarHBondContact O-N 3.36Å; L163-F182 HydrophobicContact CB-CD2 4.45Å; L163-F182 HydrophobicContact CB-CE2 4.12Å; L163-F182 HydrophobicContact CD1-CE2 3.81Å; L163-F182 HydrophobicContact CD1-CZ 4.09Å; L163-L223 HydrophobicContact CD1-CD1 4.44Å; L163-L223 HydrophobicContact CD1-CD2 3.96Å; L163-F247 HydrophobicContact CD1-CD1 3.52Å; L163-F247 HydrophobicContact CD1-CE1 3.47Å; L163-F247 VanDerWaalsContact CD1-CE1 3.47Å; L163-F247 HydrophobicContact CD1-CZ 4.47Å; L163-F247 HydrophobicContact CD2-CD1 4.41Å; L163-F247 HydrophobicContact CG-CD1 3.68Å; L163-F247 HydrophobicContact CG-CE1 3.85Å; L163-F247 WeakPolarHBondContact O-CE1 3.45Å; L163-M250 HydrophobicContact CD2-CB 4.28Å; L163-R251 HydrophobicContact CD2-CG 3.79Å
164	D	96.7	Very high	95.3	Very high	62 Å²	62	63 Å²	63	33%	0.332	31%	0.314	S	S	.	.	H	α-helix	trans	-64.4	-22.2	176.9	-79.7	9.9	0	0	0	113.3	L160 R168 R251	L160-D164 WeakPolarHBondContact O-CB 3.34Å; L160-D164 PolarHBondContact O-N 3.06Å; D164-R168 WeakPolarHBondContact O-CD 3.43Å; D164-R168 WeakPolarHBondContact O-CG 3.28Å; D164-R168 PolarHBondContact O-NE 3.14Å; D164-R251 IonicContact OD1-CZ 3.08Å; D164-R251 IonicContact OD1-NE 3.6Å; D164-R251 PolarHBondContact OD1-NE 2.94Å; D164-R251 IonicContact OD1-NH2 3.77Å; D164-R251 PolarHBondContact OD1-NH2 3.42Å
165	K	96.2	Very high	95.2	Very high	87 Å²	87	59.4 Å²	59.4	38%	0.378	29%	0.291	S	S	.	.	H	α-helix	trans	-76.6	-51.4	167.9	-71.2	167.7	-171.4	172.9	0	110.9	V161 T162 L163 E167 R168 V169 I178	V161-K165 WeakPolarHBondContact O-CD 3.35Å; V161-K165 VanDerWaalsContact O-CG 3.24Å; V161-K165 WeakPolarHBondContact O-CG 2.9Å; T162-K165 WeakPolarHBondContact O-CB 3.38Å; T162-K165 PolarHBondContact O-N 2.85Å; L163-K165 PolarHBondContact O-N 2.66Å; K165-E167 PolarHBondContact O-N 3.47Å; K165-R168 PolarHBondContact O-N 2.94Å; K165-V169 WeakPolarHBondContact O-CG2 3.13Å; K165-V169 PolarHBondContact O-N 3.06Å; K165-I178 HydrophobicContact CB-CD1 4.21Å; K165-I178 HydrophobicContact CB-CG2 3.89Å; K165-I178 HydrophobicContact CD-CG2 4.49Å
166	L	95.4	Very high	95	Very high	5 Å²	5	63 Å²	63	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-51.7	-39.6	179.3	-79.8	178.3	0	0	0	112.6	T162 L163 R168 V169 F175 I178 F179 F182 L223 F247	T162-L166 WeakPolarHBondContact O-CG 3.32Å; T162-L166 PolarHBondContact O-N 2.86Å; L163-L166 WeakPolarHBondContact O-CB 3.35Å; L163-L166 PolarHBondContact O-N 3.37Å; L163-L166 VanDerWaalsContact O-N 3.09Å; L166-R168 PolarHBondContact O-N 3.08Å; L166-V169 PolarHBondContact O-N 3.09Å; L166-F175 HydrophobicContact CD2-CD2 3.91Å; L166-F175 HydrophobicContact CD2-CE2 3.95Å; L166-I178 HydrophobicContact CD2-CB 4Å; L166-I178 HydrophobicContact CD2-CG2 3.81Å; L166-I178 HydrophobicContact CG-CG2 3.86Å; L166-F179 HydrophobicContact CD1-CD2 3.97Å; L166-F179 HydrophobicContact CD2-CB 4Å; L166-F179 HydrophobicContact CD2-CD2 4.22Å; L166-F182 HydrophobicContact CD1-CB 3.76Å; L166-F182 HydrophobicContact CD1-CD1 3.87Å; L166-F182 HydrophobicContact CD1-CD2 4.03Å; L166-F182 HydrophobicContact CD1-CE1 4.48Å; L166-F182 HydrophobicContact CD1-CG 3.61Å; L166-L223 HydrophobicContact CD1-CD2 4.06Å; L166-F247 HydrophobicContact CB-CE1 3.99Å; L166-F247 HydrophobicContact CB-CZ 3.89Å
167	E	93.9	Very high	94.9	Very high	61 Å²	61	67.5 Å²	67.5	29%	0.285	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.7	180	-165.3	171.6	-116.8	0	0	113.8	L163 K165 F247 R251	L163-E167 PolarHBondContact O-N 3.36Å; K165-E167 PolarHBondContact O-N 3.47Å; E167-F247 HydrophobicContact CB-CD1 3.87Å; E167-F247 HydrophobicContact CB-CE1 3.56Å; E167-F247 HydrophobicContact CB-CZ 3.95Å; E167-F247 HydrophobicContact CG-CD1 4.09Å; E167-F247 HydrophobicContact CG-CE1 4.19Å; E167-F247 HydrophobicContact CG-CG 4.33Å; E167-F247 HydrophobicContact CG-CZ 4.47Å; E167-R251 VanDerWaalsContact CD-NH2 3.27Å; E167-R251 IonicContact OE1-CZ 3.65Å; E167-R251 IonicContact OE1-NH1 2.61Å; E167-R251 PolarHBondContact OE1-NH1 3.22Å; E167-R251 IonicContact OE1-NH2 2.62Å; E167-R251 PolarHBondContact OE1-NH2 2.74Å; E167-R251 IonicContact OE2-CZ 2.83Å; E167-R251 IonicContact OE2-NH1 3.8Å; E167-R251 IonicContact OE2-NH2 3.96Å; E167-R251 PolarHBondContact OE2-NH2 3.03Å
168	R	91.9	Very high	94.8	Very high	194 Å²	194	65.4 Å²	65.4	73%	0.732	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-2.9	-174.1	-58.7	175.8	-168.3	-133	-1	113.9	D164 K165 L166	D164-R168 WeakPolarHBondContact O-CD 3.43Å; D164-R168 WeakPolarHBondContact O-CG 3.28Å; D164-R168 PolarHBondContact O-NE 3.14Å; K165-R168 PolarHBondContact O-N 2.94Å; L166-R168 PolarHBondContact O-N 3.08Å
169	V	93.6	Very high	94.7	Very high	18 Å²	18	62.5 Å²	62.5	11%	0.109	31%	0.311	C	S	.	.			trans	-62.7	137	-176.8	173.5	0	0	0	0	110.8	K165 L166 T171 E174 F175 I178 L231	K165-V169 WeakPolarHBondContact O-CG2 3.13Å; K165-V169 PolarHBondContact O-N 3.06Å; L166-V169 PolarHBondContact O-N 3.09Å; V169-T171 WeakPolarHBondContact CG1-O 3.5Å; V169-E174 HydrophobicContact CG1-CB 4Å; V169-E174 HydrophobicContact CG1-CG 3.96Å; V169-E174 HydrophobicContact CG2-CG 4.09Å; V169-F175 HydrophobicContact CG1-CB 3.74Å; V169-I178 HydrophobicContact CG2-CD1 3.93Å; V169-L231 HydrophobicContact CG1-CD2 4.4Å; V169-L231 WeakPolarHBondContact O-CD2 3.36Å
170	S	89.1	Confident	94.6	Very high	97 Å²	97	66 Å²	66	68%	0.678	34%	0.335	S	S	*	.			trans	-112.5	-10.1	179.4	61.6	0	0	0	0	114
171	T	91.4	Very high	94.5	Very high	69 Å²	69	68.2 Å²	68.2	42%	0.423	35%	0.345	S	S	.	.	S	Bend	trans	-131	146.6	-177.7	74.9	0	0	0	0	112.7	V169 Q173 E174 F175	V169-T171 WeakPolarHBondContact CG1-O 3.5Å; T171-Q173 VanDerWaalsContact C-N 3.33Å; T171-Q173 PolarHBondContact O-N 3.03Å; T171-E174 PolarHBondContact O-N 3.4Å; T171-E174 WeakPolarHBondContact OG1-CB 3.39Å; T171-E174 PolarHBondContact OG1-N 3.42Å; T171-F175 WeakPolarHBondContact O-CB 3.28Å; T171-F175 PolarHBondContact O-N 3.22Å
172	F	91.4	Very high	94.5	Very high	127 Å²	127	64.2 Å²	64.2	56%	0.557	32%	0.321	S	S	*	.	H	α-helix	trans	-65.8	-32.9	-179.4	-175.2	-103.6	0	0	0	113.3	F175 V176 K228	F172-F175 HydrophobicContact CD2-CD1 4.35Å; F172-F175 HydrophobicContact CE2-CD1 4.37Å; F172-F175 WeakPolarHBondContact O-CB 3.04Å; F172-F175 PolarHBondContact O-N 2.96Å; F172-V176 HydrophobicContact CD1-CG2 4.3Å; F172-V176 HydrophobicContact CE1-CG2 3.85Å; F172-V176 HydrophobicContact CE2-CG2 4.26Å; F172-V176 HydrophobicContact CZ-CG2 3.82Å; F172-V176 WeakPolarHBondContact O-CG2 3.45Å; F172-V176 PolarHBondContact O-N 3.07Å; F172-K228 HydrophobicContact CE2-CG 4.39Å
173	Q	92.1	Very high	94.4	Very high	147 Å²	147	64.6 Å²	64.6	69%	0.687	33%	0.325	S	S	*	.	H	α-helix	trans	-67	-46	178.3	-175.9	179.6	0.2	0	0	111.8	T171 F175 Q177	T171-Q173 VanDerWaalsContact C-N 3.33Å; T171-Q173 PolarHBondContact O-N 3.03Å; Q173-F175 VanDerWaalsContact C-N 3.32Å; Q173-Q177 WeakPolarHBondContact O-CG 3.26Å; Q173-Q177 PolarHBondContact O-N 2.84Å
174	E	94.5	Very high	94.4	Very high	76 Å²	76	69.3 Å²	69.3	36%	0.355	35%	0.35	S	S	.	.	H	α-helix	trans	-61.3	-42.3	172.9	179.2	-179.6	-145.6	0	0	110.9	V169 T171 V176 Q177 I178	V169-E174 HydrophobicContact CG1-CB 4Å; V169-E174 HydrophobicContact CG1-CG 3.96Å; V169-E174 HydrophobicContact CG2-CG 4.09Å; T171-E174 PolarHBondContact O-N 3.4Å; T171-E174 WeakPolarHBondContact OG1-CB 3.39Å; T171-E174 PolarHBondContact OG1-N 3.42Å; E174-V176 PolarHBondContact O-N 3.08Å; E174-Q177 PolarHBondContact O-N 2.91Å; E174-I178 HydrophobicContact CG-CD1 3.66Å; E174-I178 HydrophobicContact CG-CG1 4.37Å; E174-I178 WeakPolarHBondContact O-CG1 3.35Å; E174-I178 PolarHBondContact O-N 3.44Å
175	F	94.8	Very high	94.4	Very high	3 Å²	3	67.5 Å²	67.5	1%	0.013	34%	0.34	C	S	.	.	H	α-helix	trans	-57.5	-49.7	178.7	175.9	-105.2	0	0	0	112.1	L166 V169 T171 F172 Q173 Q177 I178 F179 L224 K228 L231	L166-F175 HydrophobicContact CD2-CD2 3.91Å; L166-F175 HydrophobicContact CD2-CE2 3.95Å; V169-F175 HydrophobicContact CG1-CB 3.74Å; T171-F175 WeakPolarHBondContact O-CB 3.28Å; T171-F175 PolarHBondContact O-N 3.22Å; F172-F175 HydrophobicContact CD2-CD1 4.35Å; F172-F175 HydrophobicContact CE2-CD1 4.37Å; F172-F175 WeakPolarHBondContact O-CB 3.04Å; F172-F175 PolarHBondContact O-N 2.96Å; Q173-F175 VanDerWaalsContact C-N 3.32Å; F175-Q177 VanDerWaalsContact C-N 3.3Å; F175-Q177 PolarHBondContact O-N 2.77Å; F175-I178 PolarHBondContact O-N 2.77Å; F175-F179 HydrophobicContact CE2-CB 4.4Å; F175-F179 AromaticContact CE2-CD2 3.92Å; F175-F179 HydrophobicContact CE2-CD2 3.92Å; F175-F179 HydrophobicContact CZ-CB 4.3Å; F175-F179 AromaticContact CZ-CD2 3.7Å; F175-F179 HydrophobicContact CZ-CD2 3.7Å; F175-F179 HydrophobicContact CZ-CE2 4.35Å; F175-F179 HydrophobicContact CZ-CG 4.15Å; F175-F179 WeakPolarHBondContact O-CB 3.43Å; F175-F179 PolarHBondContact O-N 3.01Å; F175-L224 HydrophobicContact CE1-CD1 3.73Å; F175-L224 HydrophobicContact CZ-CD1 3.85Å; F175-K228 HydrophobicContact CE1-CG 4.14Å; F175-L231 HydrophobicContact CB-CD1 3.62Å; F175-L231 HydrophobicContact CD1-CD1 4.15Å; F175-L231 HydrophobicContact CD2-CD1 3.89Å; F175-L231 HydrophobicContact CG-CD1 3.6Å
176	V	93.9	Very high	94.4	Very high	75 Å²	75	64.1 Å²	64.1	46%	0.455	33%	0.325	S	S	.	.	H	α-helix	trans	-60.9	-39.5	179.7	171.2	0	0	0	0	111.6	F172 E174 S180	F172-V176 HydrophobicContact CD1-CG2 4.3Å; F172-V176 HydrophobicContact CE1-CG2 3.85Å; F172-V176 HydrophobicContact CE2-CG2 4.26Å; F172-V176 HydrophobicContact CZ-CG2 3.82Å; F172-V176 WeakPolarHBondContact O-CG2 3.45Å; F172-V176 PolarHBondContact O-N 3.07Å; E174-V176 PolarHBondContact O-N 3.08Å; V176-S180 WeakPolarHBondContact O-CB 3.19Å; V176-S180 PolarHBondContact O-N 3.04Å; V176-S180 VanDerWaalsContact O-N 3.11Å
177	Q	94.9	Very high	94.5	Very high	131 Å²	131	65.8 Å²	65.8	61%	0.612	34%	0.335	S	S	*	.	H	α-helix	trans	-66.5	-49	178.3	-69.1	178.3	-5.2	0	0	112.1	Q173 E174 F175 S180 Q181	Q173-Q177 WeakPolarHBondContact O-CG 3.26Å; Q173-Q177 PolarHBondContact O-N 2.84Å; E174-Q177 PolarHBondContact O-N 2.91Å; F175-Q177 VanDerWaalsContact C-N 3.3Å; F175-Q177 PolarHBondContact O-N 2.77Å; Q177-S180 WeakPolarHBondContact O-CB 3.46Å; Q177-S180 PolarHBondContact O-N 2.95Å; Q177-Q181 PolarHBondContact O-N 3.37Å; Q177-Q181 VanDerWaalsContact O-N 3.16Å
178	I	96.2	Very high	94.6	Very high	24 Å²	24	66.2 Å²	66.2	12%	0.123	34%	0.337	C	S	.	.	H	α-helix	trans	-73	-34	-177.4	-58.2	177.7	0	0	0	111	K165 L166 V169 E174 F175 S180 Q181 F182	K165-I178 HydrophobicContact CB-CD1 4.21Å; K165-I178 HydrophobicContact CB-CG2 3.89Å; K165-I178 HydrophobicContact CD-CG2 4.49Å; L166-I178 HydrophobicContact CD2-CB 4Å; L166-I178 HydrophobicContact CD2-CG2 3.81Å; L166-I178 HydrophobicContact CG-CG2 3.86Å; V169-I178 HydrophobicContact CG2-CD1 3.93Å; E174-I178 HydrophobicContact CG-CD1 3.66Å; E174-I178 HydrophobicContact CG-CG1 4.37Å; E174-I178 WeakPolarHBondContact O-CG1 3.35Å; E174-I178 PolarHBondContact O-N 3.44Å; F175-I178 PolarHBondContact O-N 2.77Å; I178-S180 VanDerWaalsContact C-N 3.32Å; I178-S180 PolarHBondContact O-N 2.92Å; I178-Q181 PolarHBondContact O-N 3.35Å; I178-F182 WeakPolarHBondContact O-CB 3.25Å; I178-F182 PolarHBondContact O-N 3.11Å
179	F	95.6	Very high	94.9	Very high	18 Å²	18	57 Å²	57	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-67.5	-34.6	175.9	-164.5	-85.4	0	0	0	111.6	L166 F175 F182 G183 L223 L224	L166-F179 HydrophobicContact CD1-CD2 3.97Å; L166-F179 HydrophobicContact CD2-CB 4Å; L166-F179 HydrophobicContact CD2-CD2 4.22Å; F175-F179 HydrophobicContact CE2-CB 4.4Å; F175-F179 AromaticContact CE2-CD2 3.92Å; F175-F179 HydrophobicContact CE2-CD2 3.92Å; F175-F179 HydrophobicContact CZ-CB 4.3Å; F175-F179 AromaticContact CZ-CD2 3.7Å; F175-F179 HydrophobicContact CZ-CD2 3.7Å; F175-F179 HydrophobicContact CZ-CE2 4.35Å; F175-F179 HydrophobicContact CZ-CG 4.15Å; F175-F179 WeakPolarHBondContact O-CB 3.43Å; F175-F179 PolarHBondContact O-N 3.01Å; F179-F182 HydrophobicContact CE2-CD1 4.44Å; F179-G183 PolarHBondContact O-N 3.36Å; F179-L223 HydrophobicContact CE2-CB 4.38Å; F179-L223 HydrophobicContact CE2-CD2 4.02Å; F179-L223 HydrophobicContact CE2-CG 4.19Å; F179-L224 HydrophobicContact CD1-CD1 4.16Å; F179-L224 HydrophobicContact CD2-CD1 4.41Å; F179-L224 HydrophobicContact CE1-CB 4.3Å; F179-L224 HydrophobicContact CE1-CD1 3.99Å; F179-L224 HydrophobicContact CE1-CD2 4.49Å; F179-L224 HydrophobicContact CE1-CG 4.49Å; F179-L224 HydrophobicContact CE2-CB 4.05Å; F179-L224 HydrophobicContact CE2-CD1 4.24Å; F179-L224 HydrophobicContact CG-CD1 4.39Å; F179-L224 HydrophobicContact CZ-CB 3.68Å; F179-L224 HydrophobicContact CZ-CD1 4.05Å; F179-L224 HydrophobicContact CZ-CG 4.32Å
180	S	95.3	Very high	94.9	Very high	72 Å²	72	57.6 Å²	57.6	50%	0.503	31%	0.309	S	S	.	.	H	α-helix	trans	-63.6	-43.4	170.3	-174.6	0	0	0	0	111.9	V176 Q177 I178 G183 N184	V176-S180 WeakPolarHBondContact O-CB 3.19Å; V176-S180 PolarHBondContact O-N 3.04Å; V176-S180 VanDerWaalsContact O-N 3.11Å; Q177-S180 WeakPolarHBondContact O-CB 3.46Å; Q177-S180 PolarHBondContact O-N 2.95Å; I178-S180 VanDerWaalsContact C-N 3.32Å; I178-S180 PolarHBondContact O-N 2.92Å; S180-G183 PolarHBondContact O-N 3.13Å; S180-N184 PolarHBondContact O-N 3.44Å; S180-N184 PolarHBondContact O-ND2 2.89Å
181	Q	96	Very high	95.2	Very high	81 Å²	81	56 Å²	56	38%	0.379	29%	0.291	S	S	.	.	H	α-helix	trans	-61.1	-51.2	174.1	-170.8	-172.9	-18.2	0	0	111.4	T162 Q177 I178 G183 N184 E185	T162-Q181 HydrophobicContact CG2-CB 4.28Å; T162-Q181 VanDerWaalsContact CG2-CD 3.43Å; T162-Q181 HydrophobicContact CG2-CG 3.79Å; Q177-Q181 PolarHBondContact O-N 3.37Å; Q177-Q181 VanDerWaalsContact O-N 3.16Å; I178-Q181 PolarHBondContact O-N 3.35Å; Q181-G183 VanDerWaalsContact C-N 3.31Å; Q181-G183 PolarHBondContact O-N 3.2Å; Q181-N184 PolarHBondContact O-N 3.32Å; Q181-N184 VanDerWaalsContact O-N 3.14Å; Q181-E185 PolarHBondContact NE2-OE1 2.92Å; Q181-E185 PolarHBondContact O-N 2.94Å; Q181-E185 VanDerWaalsContact O-N 3.09Å
182	F	97.6	Very high	95.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-54.7	-44.2	177.5	172.2	-100.3	0	0	0	112.3	V159 L163 L166 I178 F179 N184 E185 M186 T220 L223 M250	V159-F182 HydrophobicContact CG1-CD2 4.42Å; V159-F182 HydrophobicContact CG1-CE2 3.85Å; L163-F182 HydrophobicContact CB-CD2 4.45Å; L163-F182 HydrophobicContact CB-CE2 4.12Å; L163-F182 HydrophobicContact CD1-CE2 3.81Å; L163-F182 HydrophobicContact CD1-CZ 4.09Å; L166-F182 HydrophobicContact CD1-CB 3.76Å; L166-F182 HydrophobicContact CD1-CD1 3.87Å; L166-F182 HydrophobicContact CD1-CD2 4.03Å; L166-F182 HydrophobicContact CD1-CE1 4.48Å; L166-F182 HydrophobicContact CD1-CG 3.61Å; I178-F182 WeakPolarHBondContact O-CB 3.25Å; I178-F182 PolarHBondContact O-N 3.11Å; F179-F182 HydrophobicContact CE2-CD1 4.44Å; F182-N184 VanDerWaalsContact C-N 3.35Å; F182-N184 PolarHBondContact O-N 2.84Å; F182-E185 PolarHBondContact O-N 2.84Å; F182-M186 HydrophobicContact CD1-CG 4.24Å; F182-M186 HydrophobicContact CD2-CG 4.29Å; F182-M186 HydrophobicContact CE1-CG 3.79Å; F182-M186 HydrophobicContact CE2-CG 3.86Å; F182-M186 HydrophobicContact CE2-SD 4.27Å; F182-M186 HydrophobicContact CG-CG 4.47Å; F182-M186 HydrophobicContact CZ-CG 3.59Å; F182-M186 HydrophobicContact CZ-SD 4.12Å; F182-M186 WeakPolarHBondContact O-CB 3.09Å; F182-M186 WeakPolarHBondContact O-CG 3.49Å; F182-M186 PolarHBondContact O-N 2.95Å; F182-T220 HydrophobicContact CE1-CG2 4.44Å; F182-L223 HydrophobicContact CD1-CD2 4.21Å; F182-L223 HydrophobicContact CE1-CD2 3.51Å; F182-L223 HydrophobicContact CZ-CD2 3.7Å; F182-M250 HydrophobicContact CZ-CE 3.82Å; F182-M250 HydrophobicContact CZ-SD 4.16Å
183	G	95.5	Very high	95.6	Very high	9 Å²	9	48.7 Å²	48.7	9%	0.093	26%	0.255	C	S	.	.	H	α-helix	trans	-59.1	-42.4	176.9	0	0	0	0	0	113	F179 S180 Q181 M186 V187	F179-G183 PolarHBondContact O-N 3.36Å; S180-G183 PolarHBondContact O-N 3.13Å; Q181-G183 VanDerWaalsContact C-N 3.31Å; Q181-G183 PolarHBondContact O-N 3.2Å; G183-M186 PolarHBondContact O-N 2.85Å; G183-V187 WeakPolarHBondContact O-CG2 3.36Å; G183-V187 PolarHBondContact O-N 3.22Å
184	N	95.6	Very high	95.7	Very high	99 Å²	99	42 Å²	42	53%	0.529	23%	0.226	S	C	.	.	H	α-helix	trans	-67.3	-38.2	176.8	-69.4	-58.7	0	0	0	112.6	S180 Q181 F182 V187 E188	S180-N184 PolarHBondContact O-N 3.44Å; S180-N184 PolarHBondContact O-ND2 2.89Å; Q181-N184 PolarHBondContact O-N 3.32Å; Q181-N184 VanDerWaalsContact O-N 3.14Å; F182-N184 VanDerWaalsContact C-N 3.35Å; F182-N184 PolarHBondContact O-N 2.84Å; N184-V187 WeakPolarHBondContact O-CB 3.33Å; N184-V187 PolarHBondContact O-N 3.02Å; N184-E188 PolarHBondContact O-N 3.49Å; N184-E188 VanDerWaalsContact O-N 3.11Å
185	E	97.5	Very high	95.6	Very high	24 Å²	24	43.4 Å²	43.4	11%	0.112	24%	0.235	C	C	.	.	H	α-helix	trans	-70	-36.8	176.3	-67.7	173.1	-177.8	0	0	111.7	K158 V159 T162 Q181 F182 E188 F189	K158-E185 HydrophobicContact CB-CB 4.45Å; K158-E185 HydrophobicContact CB-CG 4.13Å; K158-E185 HydrophobicContact CD-CG 4.46Å; K158-E185 VanDerWaalsContact O-OE2 3.09Å; V159-E185 HydrophobicContact CG2-CB 3.85Å; T162-E185 WeakPolarHBondContact CB-OE2 3.23Å; T162-E185 WeakPolarHBondContact CG2-OE2 3.49Å; T162-E185 PolarHBondContact OG1-OE2 3.06Å; Q181-E185 PolarHBondContact NE2-OE1 2.92Å; Q181-E185 PolarHBondContact O-N 2.94Å; Q181-E185 VanDerWaalsContact O-N 3.09Å; F182-E185 PolarHBondContact O-N 2.84Å; E185-E188 PolarHBondContact O-N 3.37Å; E185-F189 WeakPolarHBondContact O-CB 3.39Å; E185-F189 PolarHBondContact O-N 2.75Å
186	M	97.1	Very high	95.5	Very high	17 Å²	17	44 Å²	44	8%	0.084	24%	0.238	C	C	.	.	H	α-helix	trans	-65	-35.6	171	-78.2	-60.2	-60.1	0	0	112.7	V159 F182 G183 F189 A190 L216 M250	V159-M186 HydrophobicContact CB-SD 4.38Å; V159-M186 HydrophobicContact CG1-CG 4.3Å; V159-M186 HydrophobicContact CG1-SD 3.43Å; V159-M186 WeakPolarHBondContact CG1-SD 3.49Å; V159-M186 HydrophobicContact CG2-CG 4.43Å; V159-M186 HydrophobicContact CG2-SD 3.96Å; F182-M186 HydrophobicContact CD1-CG 4.24Å; F182-M186 HydrophobicContact CD2-CG 4.29Å; F182-M186 HydrophobicContact CE1-CG 3.79Å; F182-M186 HydrophobicContact CE2-CG 3.86Å; F182-M186 HydrophobicContact CE2-SD 4.27Å; F182-M186 HydrophobicContact CG-CG 4.47Å; F182-M186 HydrophobicContact CZ-CG 3.59Å; F182-M186 HydrophobicContact CZ-SD 4.12Å; F182-M186 WeakPolarHBondContact O-CB 3.09Å; F182-M186 WeakPolarHBondContact O-CG 3.49Å; F182-M186 PolarHBondContact O-N 2.95Å; G183-M186 PolarHBondContact O-N 2.85Å; M186-F189 PolarHBondContact O-N 2.95Å; M186-A190 WeakPolarHBondContact O-CB 3.42Å; M186-A190 PolarHBondContact O-N 3.21Å; M186-L216 HydrophobicContact CE-CB 4Å; M186-L216 HydrophobicContact CE-CD2 4.33Å; M186-M250 HydrophobicContact CE-CE 4.13Å; M186-M250 HydrophobicContact SD-CE 4.45Å
187	V	96.4	Very high	95.5	Very high	39 Å²	39	42.2 Å²	42.2	24%	0.236	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-48	172.6	166.1	0	0	0	0	110.9	G183 N184 F189 A190 H191 L743	G183-V187 WeakPolarHBondContact O-CG2 3.36Å; G183-V187 PolarHBondContact O-N 3.22Å; N184-V187 WeakPolarHBondContact O-CB 3.33Å; N184-V187 PolarHBondContact O-N 3.02Å; V187-F189 PolarHBondContact O-N 2.88Å; V187-A190 PolarHBondContact O-N 3.35Å; V187-H191 PolarHBondContact O-CD2 3.03Å; V187-H191 PolarHBondContact O-N 2.66Å; V187-H191 VanDerWaalsContact O-N 3.14Å; V187-L743 HydrophobicContact CB-CD2 4.13Å; V187-L743 HydrophobicContact CG1-CD2 4.15Å; V187-L743 HydrophobicContact CG2-CD2 3.73Å; V187-L743 HydrophobicContact CG2-CG 4.14Å
188	E	95.6	Very high	95.2	Very high	70 Å²	70	40.9 Å²	40.9	33%	0.327	22%	0.222	S	C	.	.	H	α-helix	trans	-57	-49.4	175.8	-172.1	-164.9	114.5	0	0	111.2	S155 K158 N184 E185 A190 H191 L192	S155-E188 VanDerWaalsContact CB-OE1 3.29Å; S155-E188 WeakPolarHBondContact CB-OE1 3.48Å; S155-E188 PolarHBondContact OG-OE1 3.37Å; K158-E188 IonicContact NZ-OE1 2.75Å; K158-E188 PolarHBondContact NZ-OE1 2.91Å; K158-E188 IonicContact NZ-OE2 2.61Å; K158-E188 PolarHBondContact NZ-OE2 3.17Å; N184-E188 PolarHBondContact O-N 3.49Å; N184-E188 VanDerWaalsContact O-N 3.11Å; E185-E188 PolarHBondContact O-N 3.37Å; E188-A190 PolarHBondContact O-N 3.19Å; E188-H191 PolarHBondContact O-N 2.71Å; E188-L192 HydrophobicContact CG-CD1 4.28Å; E188-L192 WeakPolarHBondContact O-CG 3.34Å; E188-L192 PolarHBondContact O-N 2.69Å; E188-L192 VanDerWaalsContact O-N 3.12Å
189	F	97.9	Very high	94.9	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.009	23%	0.225	C	C	.	.	H	α-helix	trans	-65.2	-38.2	179.8	-171.4	-114.7	0	0	0	113	I152 R156 V159 E185 M186 V187 H191 L192 T193 L216 L254 V257	I152-F189 HydrophobicContact CG2-CE2 3.89Å; R156-F189 HydrophobicContact CB-CD2 4.26Å; R156-F189 HydrophobicContact CB-CE2 3.59Å; R156-F189 HydrophobicContact CB-CZ 3.98Å; R156-F189 HydrophobicContact CG-CE2 4.42Å; R156-F189 HydrophobicContact CG-CZ 4.33Å; V159-F189 HydrophobicContact CG2-CB 4.22Å; E185-F189 WeakPolarHBondContact O-CB 3.39Å; E185-F189 PolarHBondContact O-N 2.75Å; M186-F189 PolarHBondContact O-N 2.95Å; V187-F189 PolarHBondContact O-N 2.88Å; F189-H191 VanDerWaalsContact C-N 3.29Å; F189-H191 PolarHBondContact O-N 3.06Å; F189-L192 PolarHBondContact O-N 3.15Å; F189-T193 HydrophobicContact CD1-CG2 4.24Å; F189-T193 HydrophobicContact CD2-CG2 3.99Å; F189-T193 HydrophobicContact CE1-CG2 3.91Å; F189-T193 HydrophobicContact CE2-CG2 3.63Å; F189-T193 HydrophobicContact CG-CG2 4.29Å; F189-T193 HydrophobicContact CZ-CG2 3.63Å; F189-T193 WeakPolarHBondContact O-CB 3.47Å; F189-T193 WeakPolarHBondContact O-CG2 3.43Å; F189-T193 PolarHBondContact O-N 3.25Å; F189-T193 PolarHBondContact O-OG1 2.93Å; F189-L216 HydrophobicContact CD1-CD1 4.34Å; F189-L216 HydrophobicContact CE1-CD1 3.79Å; F189-L254 HydrophobicContact CD1-CD2 4.01Å; F189-L254 HydrophobicContact CE1-CD2 3.39Å; F189-L254 HydrophobicContact CZ-CD2 3.88Å; F189-V257 HydrophobicContact CE1-CG1 4.46Å; F189-V257 HydrophobicContact CE1-CG2 4.38Å; F189-V257 HydrophobicContact CE2-CG1 4.22Å; F189-V257 HydrophobicContact CZ-CB 4.04Å; F189-V257 HydrophobicContact CZ-CG1 3.61Å; F189-V257 HydrophobicContact CZ-CG2 4.24Å
190	A	94.4	Very high	94.6	Very high	29 Å²	29	40.8 Å²	40.8	24%	0.24	22%	0.222	C	C	.	.	H	α-helix	trans	-68	-25.5	177.5	0	0	0	0	0	113.1	M186 V187 E188 G194 R213 L743	M186-A190 WeakPolarHBondContact O-CB 3.42Å; M186-A190 PolarHBondContact O-N 3.21Å; V187-A190 PolarHBondContact O-N 3.35Å; E188-A190 PolarHBondContact O-N 3.19Å; A190-G194 PolarHBondContact O-N 3.35Å; A190-R213 PolarHBondContact O-NH1 3.46Å; A190-L743 HydrophobicContact CB-CD2 4.23Å
191	H	94.4	Very high	94.2	Very high	63 Å²	63	40.7 Å²	40.7	29%	0.292	21%	0.213	S	C	.	.	H	α-helix	trans	-76.9	-55.3	170	-70.4	-48.7	0	0	0	111.4	V187 E188 F189 T193 G194 D195 V740	V187-H191 PolarHBondContact O-CD2 3.03Å; V187-H191 PolarHBondContact O-N 2.66Å; V187-H191 VanDerWaalsContact O-N 3.14Å; E188-H191 PolarHBondContact O-N 2.71Å; F189-H191 VanDerWaalsContact C-N 3.29Å; F189-H191 PolarHBondContact O-N 3.06Å; H191-T193 VanDerWaalsContact C-N 3.31Å; H191-T193 PolarHBondContact O-N 3.4Å; H191-G194 WeakPolarHBondContact O-CA 3.13Å; H191-G194 PolarHBondContact O-N 2.67Å; H191-D195 PolarHBondContact O-N 3.08Å; H191-V740 WeakPolarHBondContact CE1-CG1 3.39Å
192	L	95.9	Very high	93.7	Very high	42 Å²	42	39.4 Å²	39.4	22%	0.22	21%	0.208	C	C	.	.	H	α-helix	trans	-55.3	-42.8	-178.8	-66.9	170.4	0	0	0	113.1	I152 E188 F189 R196	I152-L192 HydrophobicContact CG1-CB 3.99Å; E188-L192 HydrophobicContact CG-CD1 4.28Å; E188-L192 WeakPolarHBondContact O-CG 3.34Å; E188-L192 PolarHBondContact O-N 2.69Å; E188-L192 VanDerWaalsContact O-N 3.12Å; F189-L192 PolarHBondContact O-N 3.15Å; L192-R196 WeakPolarHBondContact O-CB 3.43Å; L192-R196 PolarHBondContact O-N 3.44Å; L192-R196 VanDerWaalsContact O-N 3.13Å
193	T	96.4	Very high	93.2	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-74.5	-24.4	177.5	56.9	0	0	0	0	113.4	I152 F189 H191 Q197 R213 V257	I152-T193 HydrophobicContact CG2-CG2 4.09Å; F189-T193 HydrophobicContact CD1-CG2 4.24Å; F189-T193 HydrophobicContact CD2-CG2 3.99Å; F189-T193 HydrophobicContact CE1-CG2 3.91Å; F189-T193 HydrophobicContact CE2-CG2 3.63Å; F189-T193 HydrophobicContact CG-CG2 4.29Å; F189-T193 HydrophobicContact CZ-CG2 3.63Å; F189-T193 WeakPolarHBondContact O-CB 3.47Å; F189-T193 WeakPolarHBondContact O-CG2 3.43Å; F189-T193 PolarHBondContact O-N 3.25Å; F189-T193 PolarHBondContact O-OG1 2.93Å; H191-T193 VanDerWaalsContact C-N 3.31Å; H191-T193 PolarHBondContact O-N 3.4Å; T193-Q197 WeakPolarHBondContact O-CB 3.3Å; T193-Q197 PolarHBondContact O-N 3.24Å; T193-R213 PolarHBondContact OG1-NH1 2.93Å; T193-V257 HydrophobicContact CG2-CG1 3.6Å
194	G	93.9	Very high	92.8	Very high	7 Å²	7	47 Å²	47	7%	0.072	24%	0.24	C	C	.	.	H	α-helix	trans	-76.6	-43.1	176.6	0	0	0	0	0	112.2	A190 H191 R196 Q197 N198 R213	A190-G194 PolarHBondContact O-N 3.35Å; H191-G194 WeakPolarHBondContact O-CA 3.13Å; H191-G194 PolarHBondContact O-N 2.67Å; G194-R196 VanDerWaalsContact C-N 3.32Å; G194-Q197 WeakPolarHBondContact O-CB 3.46Å; G194-Q197 PolarHBondContact O-N 2.69Å; G194-N198 PolarHBondContact O-N 2.63Å; G194-N198 VanDerWaalsContact O-N 3.13Å; G194-N198 PolarHBondContact O-ND2 2.95Å; G194-R213 VanDerWaalsContact CA-CZ 3.44Å
195	D	91.6	Very high	92.6	Very high	105 Å²	105	44.7 Å²	44.7	56%	0.561	23%	0.225	S	C	*	.	H	α-helix	trans	-63.2	-42.5	172.9	-65.7	-29.3	0	0	0	110.2	H191 Q197 N198 D199	H191-D195 PolarHBondContact O-N 3.08Å; D195-Q197 PolarHBondContact O-N 3.32Å; D195-N198 PolarHBondContact O-N 2.93Å; D195-D199 WeakPolarHBondContact O-CB 3.41Å; D195-D199 PolarHBondContact O-N 3.23Å
196	R	93.9	Very high	92.4	Very high	15 Å²	15	45.8 Å²	45.8	6%	0.057	23%	0.23	C	C	.	.	H	α-helix	trans	-62.9	-39.2	173.2	-170.4	56.2	167	-163.7	0.1	113.4	T19 D145 I152 L192 G194 N198 D199 L200 V261	T19-R196 VanDerWaalsContact CG2-NH1 3.31Å; D145-R196 VanDerWaalsContact CG-NH1 3.27Å; D145-R196 IonicContact OD1-CZ 3.17Å; D145-R196 IonicContact OD1-NH1 3.9Å; D145-R196 PolarHBondContact OD1-NH1 3.18Å; D145-R196 IonicContact OD1-NH2 2.86Å; D145-R196 IonicContact OD2-CZ 3.67Å; D145-R196 IonicContact OD2-NH1 3.57Å; D145-R196 PolarHBondContact OD2-NH1 3.06Å; D145-R196 IonicContact OD2-NH2 2.66Å; D145-R196 PolarHBondContact OD2-NH2 3.43Å; I152-R196 HydrophobicContact CD1-CB 3.79Å; I152-R196 HydrophobicContact CD1-CG 3.84Å; L192-R196 WeakPolarHBondContact O-CB 3.43Å; L192-R196 PolarHBondContact O-N 3.44Å; L192-R196 VanDerWaalsContact O-N 3.13Å; G194-R196 VanDerWaalsContact C-N 3.32Å; R196-N198 VanDerWaalsContact C-N 3.28Å; R196-N198 PolarHBondContact O-N 3.48Å; R196-D199 PolarHBondContact O-N 3.2Å; R196-L200 VanDerWaalsContact O-CG 3.3Å; R196-L200 WeakPolarHBondContact O-CG 3.25Å; R196-L200 PolarHBondContact O-N 3.46Å; R196-L200 VanDerWaalsContact O-N 3.1Å; R196-V261 HydrophobicContact CG-CG1 3.86Å
197	Q	93	Very high	92.1	Very high	38 Å²	38	45.5 Å²	45.5	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-57.8	-41.7	174.6	-176	-173.5	-14.6	0	0	111.5	T193 G194 D195 K206 M209	T193-Q197 WeakPolarHBondContact O-CB 3.3Å; T193-Q197 PolarHBondContact O-N 3.24Å; G194-Q197 WeakPolarHBondContact O-CB 3.46Å; G194-Q197 PolarHBondContact O-N 2.69Å; D195-Q197 PolarHBondContact O-N 3.32Å; Q197-K206 HydrophobicContact CG-CG 4.05Å; Q197-K206 WeakPolarHBondContact O-CD 3.49Å; Q197-K206 WeakPolarHBondContact O-CG 3.32Å; Q197-M209 HydrophobicContact CB-CB 4.43Å; Q197-M209 HydrophobicContact CB-CG 3.67Å; Q197-M209 HydrophobicContact CG-CB 4.24Å; Q197-M209 HydrophobicContact CG-CG 3.97Å
198	N	89.8	Confident	92.1	Very high	104 Å²	104	47.8 Å²	47.8	56%	0.556	24%	0.235	S	C	*	.	H	α-helix	trans	-75	-34.6	-179.6	-69.3	-47.1	0	0	0	112.8	R20 G194 D195 R196	R20-N198 PolarHBondContact NE-O 2.95Å; G194-N198 PolarHBondContact O-N 2.63Å; G194-N198 VanDerWaalsContact O-N 3.13Å; G194-N198 PolarHBondContact O-ND2 2.95Å; D195-N198 PolarHBondContact O-N 2.93Å; R196-N198 VanDerWaalsContact C-N 3.28Å; R196-N198 PolarHBondContact O-N 3.48Å
199	D	89.4	Confident	92.1	Very high	35 Å²	35	44.5 Å²	44.5	19%	0.187	22%	0.219	C	C	.	.	H	α-helix	trans	-77.7	-23.4	-178.4	-165.1	23.8	0	0	0	113.8	T19 R20 S21 D195 R196 K201	T19-D199 CarbonylContact C-O 3.6Å; T19-D199 VanDerWaalsContact CA-O 3.32Å; T19-D199 WeakPolarHBondContact CA-O 2.97Å; T19-D199 WeakPolarHBondContact CB-OD2 3.28Å; T19-D199 HydrophobicContact CG2-CB 4.29Å; T19-D199 VanDerWaalsContact CG2-OD2 3.26Å; T19-D199 WeakPolarHBondContact CG2-OD2 3.43Å; R20-D199 WeakPolarHBondContact CG-O 3.39Å; R20-D199 PolarHBondContact N-O 3.32Å; R20-D199 PolarHBondContact N-OD1 3.2Å; S21-D199 VanDerWaalsContact CB-OD1 3.31Å; S21-D199 WeakPolarHBondContact CB-OD1 3.33Å; S21-D199 WeakPolarHBondContact CB-OD2 3.49Å; S21-D199 PolarHBondContact N-OD1 3.38Å; S21-D199 VanDerWaalsContact OG-CG 3.28Å; S21-D199 PolarHBondContact OG-OD1 2.84Å; S21-D199 PolarHBondContact OG-OD2 2.97Å; D195-D199 WeakPolarHBondContact O-CB 3.41Å; D195-D199 PolarHBondContact O-N 3.23Å; R196-D199 PolarHBondContact O-N 3.2Å; D199-K201 PolarHBondContact O-N 3.01Å
200	L	88.9	Confident	92	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.026	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-58.7	129.6	175.2	-79.4	164.5	0	0	0	111.8	R20 R196 K205 K206 I260	R20-L200 PolarHBondContact NE-O 2.99Å; R20-L200 PolarHBondContact NH2-O 3.35Å; R196-L200 VanDerWaalsContact O-CG 3.3Å; R196-L200 WeakPolarHBondContact O-CG 3.25Å; R196-L200 PolarHBondContact O-N 3.46Å; R196-L200 VanDerWaalsContact O-N 3.1Å; L200-K205 HydrophobicContact CD1-CB 4.12Å; L200-K205 HydrophobicContact CD2-CB 4.38Å; L200-K205 HydrophobicContact CD2-CD 4.43Å; L200-K206 HydrophobicContact CB-CB 4.42Å; L200-I260 HydrophobicContact CD1-CG2 4.27Å
201	K	87.4	Confident	92.1	Very high	69 Å²	69	45.4 Å²	45.4	30%	0.3	23%	0.227	S	C	.	.	S	Bend	trans	-78.4	-34.6	170.9	-70.1	173.4	57.6	-177.2	0	112.5	I17 K18 R20 E23 D199 E203	I17-K201 WeakPolarHBondContact O-CD 3.3Å; I17-K201 PolarHBondContact O-NZ 2.9Å; K18-K201 WeakPolarHBondContact O-CB 3.48Å; K18-K201 PolarHBondContact O-N 3.47Å; R20-K201 HydrophobicContact CG-CG 3.72Å; E23-K201 HydrophobicContact CB-CD 4.45Å; E23-K201 VanDerWaalsContact CD-NZ 3.28Å; E23-K201 WeakPolarHBondContact OE1-CE 3.31Å; E23-K201 IonicContact OE1-NZ 2.88Å; E23-K201 PolarHBondContact OE1-NZ 2.83Å; E23-K201 VanDerWaalsContact OE2-CD 3.28Å; E23-K201 WeakPolarHBondContact OE2-CD 3.45Å; E23-K201 WeakPolarHBondContact OE2-CE 3.22Å; E23-K201 IonicContact OE2-NZ 3.95Å; E23-K201 PolarHBondContact OE2-NZ 3.08Å; D199-K201 PolarHBondContact O-N 3.01Å; K201-E203 PolarHBondContact O-N 3.41Å
202	D	86	Confident	92.3	Very high	54 Å²	54	42.4 Å²	42.4	29%	0.289	21%	0.213	S	C	.	.			trans	-72.1	104.8	179.8	179.4	-20.6	0	0	0	110.3	K204 K205 K206	D202-K204 PolarHBondContact O-N 2.88Å; D202-K204 WeakPolarHBondContact OD1-CA 3.42Å; D202-K204 WeakPolarHBondContact OD1-CB 3.24Å; D202-K204 PolarHBondContact OD1-N 2.96Å; D202-K205 HydrophobicContact CB-CB 4.05Å; D202-K205 HydrophobicContact CB-CD 4.03Å; D202-K205 HydrophobicContact CB-CG 4.23Å; D202-K205 PolarHBondContact O-N 3.03Å; D202-K205 PolarHBondContact OD1-N 3.05Å; D202-K205 WeakPolarHBondContact OD2-CD 3.31Å; D202-K205 WeakPolarHBondContact OD2-CE 3.29Å; D202-K205 VanDerWaalsContact OD2-CG 3.28Å; D202-K205 WeakPolarHBondContact OD2-CG 3.44Å; D202-K205 IonicContact OD2-NZ 2.71Å; D202-K205 PolarHBondContact OD2-NZ 3.44Å; D202-K206 WeakPolarHBondContact O-CB 3.34Å; D202-K206 PolarHBondContact O-N 3.1Å
203	E	85.9	Confident	92.3	Very high	83 Å²	83	43.3 Å²	43.3	39%	0.388	21%	0.214	S	C	.	.	H	α-helix	trans	-66.2	-22.5	-179.2	-65.2	-67.5	149.5	0	0	112.7	R20 K201 K206 A207 P447	R20-E203 IonicContact CZ-OE1 3.88Å; R20-E203 IonicContact NH1-OE1 2.9Å; R20-E203 IonicContact NH2-OE1 2.69Å; R20-E203 PolarHBondContact NH2-OE1 3.44Å; K201-E203 PolarHBondContact O-N 3.41Å; E203-K206 IonicContact OE1-NZ 2.67Å; E203-K206 PolarHBondContact OE1-NZ 3.05Å; E203-K206 WeakPolarHBondContact OE2-CD 3.44Å; E203-K206 IonicContact OE2-NZ 2.63Å; E203-K206 PolarHBondContact OE2-NZ 3.39Å; E203-A207 WeakPolarHBondContact O-CB 3.42Å; E203-A207 PolarHBondContact O-N 3.12Å; E203-P447 HydrophobicContact CB-CG 4.24Å
204	K	88.3	Confident	92.3	Very high	86 Å²	86	44.6 Å²	44.6	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-70.4	-48.5	173.6	-167.5	-162.7	-164.2	92.1	0	110.1	D202 K206 A207 R208 E446 I450	D202-K204 PolarHBondContact O-N 2.88Å; D202-K204 WeakPolarHBondContact OD1-CA 3.42Å; D202-K204 WeakPolarHBondContact OD1-CB 3.24Å; D202-K204 PolarHBondContact OD1-N 2.96Å; K204-K206 VanDerWaalsContact C-N 3.34Å; K204-K206 PolarHBondContact O-N 2.88Å; K204-A207 PolarHBondContact O-N 3Å; K204-R208 PolarHBondContact O-N 2.99Å; K204-E446 VanDerWaalsContact CD-OE2 3.29Å; K204-E446 WeakPolarHBondContact CD-OE2 3.36Å; K204-E446 WeakPolarHBondContact CE-OE2 3.28Å; K204-E446 WeakPolarHBondContact CG-OE2 3.37Å; K204-E446 IonicContact NZ-OE1 3.63Å; K204-E446 IonicContact NZ-OE2 2.75Å; K204-E446 PolarHBondContact NZ-OE2 3.49Å; K204-I450 HydrophobicContact CB-CD1 4.42Å; K204-I450 HydrophobicContact CG-CD1 3.63Å
205	K	90.8	Very high	92.5	Very high	50 Å²	50	44.8 Å²	44.8	22%	0.217	22%	0.224	C	C	.	.	H	α-helix	trans	-62.1	-40.9	173.6	-75.7	175.8	-167	136.8	0	111.8	L200 D202 R208 M209 I260 E263	L200-K205 HydrophobicContact CD1-CB 4.12Å; L200-K205 HydrophobicContact CD2-CB 4.38Å; L200-K205 HydrophobicContact CD2-CD 4.43Å; D202-K205 HydrophobicContact CB-CB 4.05Å; D202-K205 HydrophobicContact CB-CD 4.03Å; D202-K205 HydrophobicContact CB-CG 4.23Å; D202-K205 PolarHBondContact O-N 3.03Å; D202-K205 PolarHBondContact OD1-N 3.05Å; D202-K205 WeakPolarHBondContact OD2-CD 3.31Å; D202-K205 WeakPolarHBondContact OD2-CE 3.29Å; D202-K205 VanDerWaalsContact OD2-CG 3.28Å; D202-K205 WeakPolarHBondContact OD2-CG 3.44Å; D202-K205 IonicContact OD2-NZ 2.71Å; D202-K205 PolarHBondContact OD2-NZ 3.44Å; K205-R208 PolarHBondContact O-N 3.16Å; K205-M209 VanDerWaalsContact O-CB 3.29Å; K205-M209 WeakPolarHBondContact O-CB 3.29Å; K205-M209 PolarHBondContact O-N 3.47Å; K205-I260 HydrophobicContact CB-CG2 3.84Å; K205-I260 HydrophobicContact CG-CG2 4.17Å; K205-E263 WeakPolarHBondContact CE-OE1 3.1Å; K205-E263 IonicContact NZ-OE1 2.74Å; K205-E263 PolarHBondContact NZ-OE1 3.47Å
206	K	92.6	Very high	92.8	Very high	47 Å²	47	40 Å²	40	20%	0.204	20%	0.199	C	C	.	.	H	α-helix	trans	-63.9	-38	176.5	179.2	167.9	163.1	-131.9	0	112.8	Q197 L200 D202 E203 K204 M209 A210	Q197-K206 HydrophobicContact CG-CG 4.05Å; Q197-K206 WeakPolarHBondContact O-CD 3.49Å; Q197-K206 WeakPolarHBondContact O-CG 3.32Å; L200-K206 HydrophobicContact CB-CB 4.42Å; D202-K206 WeakPolarHBondContact O-CB 3.34Å; D202-K206 PolarHBondContact O-N 3.1Å; E203-K206 IonicContact OE1-NZ 2.67Å; E203-K206 PolarHBondContact OE1-NZ 3.05Å; E203-K206 WeakPolarHBondContact OE2-CD 3.44Å; E203-K206 IonicContact OE2-NZ 2.63Å; E203-K206 PolarHBondContact OE2-NZ 3.39Å; K204-K206 VanDerWaalsContact C-N 3.34Å; K204-K206 PolarHBondContact O-N 2.88Å; K206-M209 PolarHBondContact O-N 2.85Å; K206-A210 PolarHBondContact O-N 3.45Å
207	A	92.6	Very high	92.8	Very high	12 Å²	12	45.9 Å²	45.9	10%	0.099	23%	0.227	C	C	.	.	H	α-helix	trans	-68.4	-45.8	172.4	0	0	0	0	0	112.5	E203 K204 M209 A210 A211 P447 I450	E203-A207 WeakPolarHBondContact O-CB 3.42Å; E203-A207 PolarHBondContact O-N 3.12Å; K204-A207 PolarHBondContact O-N 3Å; A207-M209 VanDerWaalsContact C-N 3.26Å; A207-M209 PolarHBondContact O-N 2.97Å; A207-A210 WeakPolarHBondContact O-CB 3.27Å; A207-A210 PolarHBondContact O-N 3.24Å; A207-A211 PolarHBondContact O-N 2.67Å; A207-P447 HydrophobicContact CB-CB 3.88Å; A207-I450 HydrophobicContact CB-CB 4.26Å; A207-I450 HydrophobicContact CB-CD1 3.94Å; A207-I450 HydrophobicContact CB-CG2 4.1Å
208	R	95.3	Very high	92.8	Very high	87 Å²	87	45 Å²	45	33%	0.328	22%	0.222	S	C	.	.	H	α-helix	trans	-58.2	-40	172.9	-71	-169.1	67	-163.7	-4.9	111.7	K204 K205 A211 A212 E259 I260 I450	K204-R208 PolarHBondContact O-N 2.99Å; K205-R208 PolarHBondContact O-N 3.16Å; R208-A211 PolarHBondContact O-N 3.34Å; R208-A212 PolarHBondContact O-N 3.35Å; R208-E259 IonicContact CZ-OE2 2.68Å; R208-E259 IonicContact NH1-OE2 3.13Å; R208-E259 PolarHBondContact NH1-OE2 3.41Å; R208-E259 IonicContact NH2-OE2 2.71Å; R208-E259 PolarHBondContact NH2-OE2 3.19Å; R208-I260 HydrophobicContact CB-CD1 3.58Å; R208-I260 HydrophobicContact CB-CG1 4.04Å; R208-I450 HydrophobicContact CG-CD1 4.04Å; R208-I450 HydrophobicContact CG-CG1 4.49Å; R208-I450 HydrophobicContact CG-CG2 4.18Å
209	M	96.4	Very high	93	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-40.8	177.7	-175.8	60.7	70.5	0	0	111.5	Q197 K205 K206 A207 R213 V257 I260 V261	Q197-M209 HydrophobicContact CB-CB 4.43Å; Q197-M209 HydrophobicContact CB-CG 3.67Å; Q197-M209 HydrophobicContact CG-CB 4.24Å; Q197-M209 HydrophobicContact CG-CG 3.97Å; K205-M209 VanDerWaalsContact O-CB 3.29Å; K205-M209 WeakPolarHBondContact O-CB 3.29Å; K205-M209 PolarHBondContact O-N 3.47Å; K206-M209 PolarHBondContact O-N 2.85Å; A207-M209 VanDerWaalsContact C-N 3.26Å; A207-M209 PolarHBondContact O-N 2.97Å; M209-R213 WeakPolarHBondContact O-CB 3.49Å; M209-R213 WeakPolarHBondContact O-CD 3.49Å; M209-R213 VanDerWaalsContact O-CG 3.23Å; M209-R213 WeakPolarHBondContact O-CG 3.21Å; M209-R213 PolarHBondContact O-N 3.02Å; M209-R213 HydrophobicContact SD-CG 4.37Å; M209-V257 HydrophobicContact CE-CG1 4.08Å; M209-V257 HydrophobicContact SD-CG1 4.18Å; M209-V257 HydrophobicContact SD-CG2 4.05Å; M209-I260 HydrophobicContact CB-CD1 4.4Å; M209-I260 HydrophobicContact CB-CG2 4.47Å; M209-I260 HydrophobicContact CE-CB 3.97Å; M209-I260 HydrophobicContact CE-CD1 4.38Å; M209-I260 HydrophobicContact CE-CG2 3.73Å; M209-V261 HydrophobicContact CE-CG1 3.6Å
210	A	95.8	Very high	93.2	Very high	37 Å²	37	40.1 Å²	40.1	31%	0.306	20%	0.197	S	C	.	.	H	α-helix	trans	-60	-47.9	173.9	0	0	0	0	0	111.9	K206 A207 R213 A214	K206-A210 PolarHBondContact O-N 3.45Å; A207-A210 WeakPolarHBondContact O-CB 3.27Å; A207-A210 PolarHBondContact O-N 3.24Å; A210-R213 PolarHBondContact O-N 2.8Å; A210-A214 WeakPolarHBondContact O-CB 3.43Å; A210-A214 PolarHBondContact O-N 3.24Å
211	A	96.5	Very high	93.1	Very high	13 Å²	13	44.4 Å²	44.4	11%	0.107	22%	0.219	C	C	.	.	H	α-helix	trans	-60.9	-48.8	178.1	0	0	0	0	0	112.2	A207 R208 R213 A214 V215 H454	A207-A211 PolarHBondContact O-N 2.67Å; R208-A211 PolarHBondContact O-N 3.34Å; A211-R213 VanDerWaalsContact C-N 3.32Å; A211-R213 PolarHBondContact O-N 3.49Å; A211-A214 PolarHBondContact O-N 2.92Å; A211-V215 WeakPolarHBondContact O-CG2 3.45Å; A211-V215 PolarHBondContact O-N 3.43Å; A211-H454 HydrophobicContact CB-CB 3.87Å
212	A	97.6	Very high	93.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.6	-40.2	177.9	0	0	0	0	0	112.2	R208 V215 L216 Q256 V257	R208-A212 PolarHBondContact O-N 3.35Å; A212-V215 PolarHBondContact O-N 3.33Å; A212-L216 WeakPolarHBondContact O-CG 3.37Å; A212-L216 PolarHBondContact O-N 3.08Å; A212-L216 VanDerWaalsContact O-N 3.12Å; A212-Q256 HydrophobicContact CB-CB 4.18Å; A212-V257 HydrophobicContact CB-CG2 3.96Å
213	R	97.5	Very high	94	Very high	62 Å²	62	38.7 Å²	38.7	23%	0.234	19%	0.191	C	C	.	.	H	α-helix	trans	-65.4	-42.2	175	-73.9	163.1	52.8	68.7	2.8	112.3	A190 T193 G194 M209 A210 A211 V215 L216 E217	A190-R213 PolarHBondContact O-NH1 3.46Å; T193-R213 PolarHBondContact OG1-NH1 2.93Å; G194-R213 VanDerWaalsContact CA-CZ 3.44Å; M209-R213 WeakPolarHBondContact O-CB 3.49Å; M209-R213 WeakPolarHBondContact O-CD 3.49Å; M209-R213 VanDerWaalsContact O-CG 3.23Å; M209-R213 WeakPolarHBondContact O-CG 3.21Å; M209-R213 PolarHBondContact O-N 3.02Å; M209-R213 HydrophobicContact SD-CG 4.37Å; A210-R213 PolarHBondContact O-N 2.8Å; A211-R213 VanDerWaalsContact C-N 3.32Å; A211-R213 PolarHBondContact O-N 3.49Å; R213-V215 VanDerWaalsContact C-N 3.34Å; R213-V215 PolarHBondContact O-N 3.09Å; R213-L216 PolarHBondContact O-N 3.32Å; R213-E217 PolarHBondContact O-N 3.17Å
214	A	96.1	Very high	94.4	Very high	28 Å²	28	36 Å²	36	23%	0.231	18%	0.179	C	C	.	.	H	α-helix	trans	-63.1	-37.7	175.8	0	0	0	0	0	112.4	A210 A211 K218	A210-A214 WeakPolarHBondContact O-CB 3.43Å; A210-A214 PolarHBondContact O-N 3.24Å; A211-A214 PolarHBondContact O-N 2.92Å; A214-K218 WeakPolarHBondContact O-CG 3.15Å; A214-K218 PolarHBondContact O-N 3.11Å; A214-K218 VanDerWaalsContact O-N 3.1Å
215	V	97.1	Very high	94.7	Very high	10 Å²	10	32.1 Å²	32.1	6%	0.061	16%	0.163	C	C	.	.	H	α-helix	trans	-60.6	-47.6	171.5	175.5	0	0	0	0	111	A211 A212 R213 E217 C219 R249 A253	A211-V215 WeakPolarHBondContact O-CG2 3.45Å; A211-V215 PolarHBondContact O-N 3.43Å; A212-V215 PolarHBondContact O-N 3.33Å; R213-V215 VanDerWaalsContact C-N 3.34Å; R213-V215 PolarHBondContact O-N 3.09Å; V215-E217 PolarHBondContact O-N 3.15Å; V215-C219 VanDerWaalsContact O-CB 3.25Å; V215-C219 WeakPolarHBondContact O-CB 3.5Å; V215-C219 PolarHBondContact O-N 3.03Å; V215-C219 PolarHBondContact O-SG 2.83Å; V215-R249 HydrophobicContact CG1-CG 3.65Å; V215-A253 HydrophobicContact CB-CB 3.94Å; V215-A253 HydrophobicContact CG1-CB 3.69Å
216	L	97.5	Very high	95	Very high	6 Å²	6	29.7 Å²	29.7	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-63.4	-40.7	-179.4	-70	168.6	0	0	0	112.6	M186 F189 A212 R213 T220 M250 A253 L254 V257	M186-L216 HydrophobicContact CE-CB 4Å; M186-L216 HydrophobicContact CE-CD2 4.33Å; F189-L216 HydrophobicContact CD1-CD1 4.34Å; F189-L216 HydrophobicContact CE1-CD1 3.79Å; A212-L216 WeakPolarHBondContact O-CG 3.37Å; A212-L216 PolarHBondContact O-N 3.08Å; A212-L216 VanDerWaalsContact O-N 3.12Å; R213-L216 PolarHBondContact O-N 3.32Å; L216-T220 WeakPolarHBondContact O-CB 3.4Å; L216-T220 PolarHBondContact O-N 2.81Å; L216-T220 PolarHBondContact O-OG1 3.46Å; L216-M250 HydrophobicContact CD2-CB 4.44Å; L216-M250 HydrophobicContact CD2-CE 4Å; L216-A253 HydrophobicContact CD2-CB 3.84Å; L216-A253 HydrophobicContact CG-CB 3.8Å; L216-L254 HydrophobicContact CD1-CD2 4.05Å; L216-L254 HydrophobicContact CD2-CD2 3.84Å; L216-L254 HydrophobicContact CD2-CG 3.92Å; L216-V257 HydrophobicContact CD1-CG2 4.42Å
217	E	93.9	Very high	95.2	Very high	138 Å²	138	27.7 Å²	27.7	65%	0.645	14%	0.144	S	C	*	.	H	α-helix	trans	-61.9	-53.6	176.8	-174.8	171	-178.4	0	0	111.4	R213 V215 C219 T220	R213-E217 PolarHBondContact O-N 3.17Å; V215-E217 PolarHBondContact O-N 3.15Å; E217-C219 PolarHBondContact O-N 3.28Å; E217-T220 PolarHBondContact O-N 3.22Å
218	K	92.6	Very high	95.3	Very high	20 Å²	20	28.7 Å²	28.7	9%	0.087	15%	0.146	C	C	.	.	H	α-helix	trans	-60.4	-45.8	177.6	-66.2	-173.7	-173.6	-164.9	0	111.8	A214 T220 M221 M222 S495 D499	A214-K218 WeakPolarHBondContact O-CG 3.15Å; A214-K218 PolarHBondContact O-N 3.11Å; A214-K218 VanDerWaalsContact O-N 3.1Å; K218-T220 VanDerWaalsContact C-N 3.33Å; K218-T220 PolarHBondContact O-N 3.32Å; K218-M221 PolarHBondContact O-N 3.24Å; K218-M222 HydrophobicContact CB-SD 4.41Å; K218-M222 WeakPolarHBondContact O-CG 3.48Å; K218-M222 PolarHBondContact O-N 3.27Å; K218-M222 VanDerWaalsContact O-SD 3.39Å; K218-S495 WeakPolarHBondContact CE-OG 3.4Å; K218-S495 PolarHBondContact NZ-OG 3.06Å; K218-D499 IonicContact NZ-OD2 2.72Å; K218-D499 PolarHBondContact NZ-OD2 3.07Å
219	C	95.8	Very high	95.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.2	-32.9	179.8	-66.5	0	0	0	0	113.2	V215 E217 M221 M222 L223 V246 M250	V215-C219 VanDerWaalsContact O-CB 3.25Å; V215-C219 WeakPolarHBondContact O-CB 3.5Å; V215-C219 PolarHBondContact O-N 3.03Å; V215-C219 PolarHBondContact O-SG 2.83Å; E217-C219 PolarHBondContact O-N 3.28Å; C219-M221 VanDerWaalsContact C-N 3.26Å; C219-M221 PolarHBondContact O-N 3.26Å; C219-M222 PolarHBondContact O-N 2.79Å; C219-L223 VanDerWaalsContact O-CB 3.24Å; C219-L223 WeakPolarHBondContact O-CB 3.19Å; C219-L223 PolarHBondContact O-N 2.92Å; C219-V246 HydrophobicContact CB-CG1 3.96Å; C219-M250 HydrophobicContact CB-CE 4.14Å; C219-M250 HydrophobicContact CB-CG 3.29Å; C219-M250 HydrophobicContact CB-SD 3.72Å
220	T	92.9	Very high	95.4	Very high	35 Å²	35	25.3 Å²	25.3	22%	0.215	14%	0.135	C	C	.	.	H	α-helix	trans	-61.2	-36.3	178.5	-60.9	0	0	0	0	111.8	F182 L216 E217 K218 M250	F182-T220 HydrophobicContact CE1-CG2 4.44Å; L216-T220 WeakPolarHBondContact O-CB 3.4Å; L216-T220 PolarHBondContact O-N 2.81Å; L216-T220 PolarHBondContact O-OG1 3.46Å; E217-T220 PolarHBondContact O-N 3.22Å; K218-T220 VanDerWaalsContact C-N 3.33Å; K218-T220 PolarHBondContact O-N 3.32Å; T220-M250 WeakPolarHBondContact OG1-CE 3.26Å
221	M	87.6	Confident	95.4	Very high	96 Å²	96	26 Å²	26	47%	0.473	13%	0.134	S	C	.	.	H	α-helix	trans	-70	-48	174.4	-60.7	-175.1	-73.1	0	0	111.4	K218 C219 L223 L224	K218-M221 PolarHBondContact O-N 3.24Å; C219-M221 VanDerWaalsContact C-N 3.26Å; C219-M221 PolarHBondContact O-N 3.26Å; M221-L223 VanDerWaalsContact C-N 3.32Å; M221-L223 PolarHBondContact O-N 3Å; M221-L224 PolarHBondContact O-N 3.35Å
222	M	95.5	Very high	95.3	Very high	2 Å²	2	33 Å²	33	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-65.2	-32.6	-178.8	-61.7	156.4	73.8	0	0	112.9	K218 C219 L224 T225 A226 V246 I462 V488 F489 A492	K218-M222 HydrophobicContact CB-SD 4.41Å; K218-M222 WeakPolarHBondContact O-CG 3.48Å; K218-M222 PolarHBondContact O-N 3.27Å; K218-M222 VanDerWaalsContact O-SD 3.39Å; C219-M222 PolarHBondContact O-N 2.79Å; M222-L224 VanDerWaalsContact C-N 3.27Å; M222-L224 PolarHBondContact O-N 3.39Å; M222-T225 PolarHBondContact O-N 2.88Å; M222-T225 PolarHBondContact O-OG1 3.47Å; M222-A226 WeakPolarHBondContact O-CB 3.25Å; M222-A226 PolarHBondContact O-N 3.19Å; M222-V246 HydrophobicContact CB-CG1 4.37Å; M222-V246 HydrophobicContact CB-CG2 4.08Å; M222-V246 HydrophobicContact CE-CG2 4.41Å; M222-I462 HydrophobicContact CE-CG1 4.35Å; M222-V488 HydrophobicContact CG-CG1 4.1Å; M222-F489 HydrophobicContact CB-CE1 4.41Å; M222-F489 HydrophobicContact CB-CE2 3.99Å; M222-F489 HydrophobicContact CB-CZ 3.88Å; M222-F489 HydrophobicContact CE-CD1 3.52Å; M222-F489 HydrophobicContact CE-CE1 3.24Å; M222-F489 HydrophobicContact CE-CG 4.35Å; M222-F489 HydrophobicContact CE-CZ 3.91Å; M222-F489 HydrophobicContact CG-CE2 4.39Å; M222-F489 HydrophobicContact CG-CZ 4.37Å; M222-A492 HydrophobicContact CG-CB 4.5Å; M222-A492 HydrophobicContact SD-CB 4.03Å
223	L	95.8	Very high	95.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.8	-37.4	-179.7	-172.8	71.2	0	0	0	111.8	L163 L166 F179 F182 C219 M221 S227 V246 F247 M250	L163-L223 HydrophobicContact CD1-CD1 4.44Å; L163-L223 HydrophobicContact CD1-CD2 3.96Å; L166-L223 HydrophobicContact CD1-CD2 4.06Å; F179-L223 HydrophobicContact CE2-CB 4.38Å; F179-L223 HydrophobicContact CE2-CD2 4.02Å; F179-L223 HydrophobicContact CE2-CG 4.19Å; F182-L223 HydrophobicContact CD1-CD2 4.21Å; F182-L223 HydrophobicContact CE1-CD2 3.51Å; F182-L223 HydrophobicContact CZ-CD2 3.7Å; C219-L223 VanDerWaalsContact O-CB 3.24Å; C219-L223 WeakPolarHBondContact O-CB 3.19Å; C219-L223 PolarHBondContact O-N 2.92Å; M221-L223 VanDerWaalsContact C-N 3.32Å; M221-L223 PolarHBondContact O-N 3Å; L223-S227 WeakPolarHBondContact O-CB 3.48Å; L223-S227 PolarHBondContact O-N 3.42Å; L223-S227 VanDerWaalsContact O-N 3.09Å; L223-S227 PolarHBondContact O-OG 3.4Å; L223-V246 HydrophobicContact CB-CG1 4.02Å; L223-V246 HydrophobicContact CD1-CG1 3.99Å; L223-F247 HydrophobicContact CD1-CD1 4.31Å; L223-F247 HydrophobicContact CD1-CD2 3.64Å; L223-F247 HydrophobicContact CD1-CE1 4.07Å; L223-F247 HydrophobicContact CD1-CE2 3.39Å; L223-F247 HydrophobicContact CD1-CG 4.11Å; L223-F247 HydrophobicContact CD1-CZ 3.63Å; L223-M250 HydrophobicContact CB-SD 4.43Å; L223-M250 HydrophobicContact CD2-SD 3.97Å
224	L	94.2	Very high	95.1	Very high	27 Å²	27	36.1 Å²	36.1	14%	0.141	18%	0.183	C	C	.	.	H	α-helix	trans	-62.9	-53.5	-179.9	-179.8	56.8	0	0	0	111.1	F175 F179 M221 M222 K228 L750	F175-L224 HydrophobicContact CE1-CD1 3.73Å; F175-L224 HydrophobicContact CZ-CD1 3.85Å; F179-L224 HydrophobicContact CD1-CD1 4.16Å; F179-L224 HydrophobicContact CD2-CD1 4.41Å; F179-L224 HydrophobicContact CE1-CB 4.3Å; F179-L224 HydrophobicContact CE1-CD1 3.99Å; F179-L224 HydrophobicContact CE1-CD2 4.49Å; F179-L224 HydrophobicContact CE1-CG 4.49Å; F179-L224 HydrophobicContact CE2-CB 4.05Å; F179-L224 HydrophobicContact CE2-CD1 4.24Å; F179-L224 HydrophobicContact CG-CD1 4.39Å; F179-L224 HydrophobicContact CZ-CB 3.68Å; F179-L224 HydrophobicContact CZ-CD1 4.05Å; F179-L224 HydrophobicContact CZ-CG 4.32Å; M221-L224 PolarHBondContact O-N 3.35Å; M222-L224 VanDerWaalsContact C-N 3.27Å; M222-L224 PolarHBondContact O-N 3.39Å; L224-K228 HydrophobicContact CD1-CD 4.46Å; L224-K228 HydrophobicContact CD1-CG 4.47Å; L224-K228 HydrophobicContact CG-CD 4.42Å; L224-K228 WeakPolarHBondContact O-CB 3.47Å; L224-K228 VanDerWaalsContact O-CG 3.23Å; L224-K228 WeakPolarHBondContact O-CG 3.23Å; L224-K228 PolarHBondContact O-N 2.89Å; L224-L750 HydrophobicContact CD2-CD1 4.01Å; L224-L750 HydrophobicContact CD2-CD2 3.9Å
225	T	95.4	Very high	95	Very high	4 Å²	4	42.2 Å²	42.2	3%	0.025	21%	0.211	C	C	.	.	H	α-helix	trans	-72	-39	-176.3	57	0	0	0	0	112.1	M222 S227 K228 T229 E484 N485 V488	M222-T225 PolarHBondContact O-N 2.88Å; M222-T225 PolarHBondContact O-OG1 3.47Å; T225-S227 PolarHBondContact O-N 3.42Å; T225-K228 PolarHBondContact O-N 2.94Å; T225-T229 WeakPolarHBondContact O-CB 3.29Å; T225-T229 PolarHBondContact O-N 2.91Å; T225-T229 PolarHBondContact O-OG1 3.03Å; T225-E484 HydrophobicContact CG2-CG 3.96Å; T225-N485 WeakPolarHBondContact CB-OD1 3.45Å; T225-N485 PolarHBondContact O-OD1 3.48Å; T225-N485 PolarHBondContact OG1-OD1 3.46Å; T225-V488 HydrophobicContact CG2-CB 4.33Å; T225-V488 HydrophobicContact CG2-CG2 3.86Å
226	A	97.1	Very high	95	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.8	-41.2	179.5	0	0	0	0	0	111.5	M222 T229 C230 N242 K243 N485 F489	M222-A226 WeakPolarHBondContact O-CB 3.25Å; M222-A226 PolarHBondContact O-N 3.19Å; A226-T229 PolarHBondContact O-N 2.9Å; A226-C230 PolarHBondContact O-N 3.34Å; A226-C230 PolarHBondContact O-SG 3.18Å; A226-C230 VanDerWaalsContact O-SG 3.36Å; A226-N242 WeakPolarHBondContact CB-OD1 3.3Å; A226-K243 HydrophobicContact CB-CB 4.21Å; A226-N485 WeakPolarHBondContact CA-OD1 3.35Å; A226-N485 PolarHBondContact N-OD1 3.1Å; A226-F489 HydrophobicContact CB-CE2 4.3Å; A226-F489 HydrophobicContact CB-CZ 4.31Å
227	S	96.8	Very high	95	Very high	4 Å²	4	46.3 Å²	46.3	3%	0.028	23%	0.23	C	C	.	.	H	α-helix	trans	-68.8	-44.8	176.4	-54.7	0	0	0	0	112.3	L223 T225 T229 C230 L231	L223-S227 WeakPolarHBondContact O-CB 3.48Å; L223-S227 PolarHBondContact O-N 3.42Å; L223-S227 VanDerWaalsContact O-N 3.09Å; L223-S227 PolarHBondContact O-OG 3.4Å; T225-S227 PolarHBondContact O-N 3.42Å; S227-T229 PolarHBondContact O-N 3.3Å; S227-C230 PolarHBondContact O-N 2.99Å; S227-L231 WeakPolarHBondContact O-CG 3.47Å; S227-L231 PolarHBondContact O-N 2.86Å
228	K	94.9	Very high	95.1	Very high	33 Å²	33	40.2 Å²	40.2	14%	0.143	20%	0.203	C	C	.	.	H	α-helix	trans	-53.2	-42.2	170.5	-78.1	175.1	179.9	-177.5	0	111.7	F172 F175 L224 T225 L231 R232 I481 E484	F172-K228 HydrophobicContact CE2-CG 4.39Å; F175-K228 HydrophobicContact CE1-CG 4.14Å; L224-K228 HydrophobicContact CD1-CD 4.46Å; L224-K228 HydrophobicContact CD1-CG 4.47Å; L224-K228 HydrophobicContact CG-CD 4.42Å; L224-K228 WeakPolarHBondContact O-CB 3.47Å; L224-K228 VanDerWaalsContact O-CG 3.23Å; L224-K228 WeakPolarHBondContact O-CG 3.23Å; L224-K228 PolarHBondContact O-N 2.89Å; T225-K228 PolarHBondContact O-N 2.94Å; K228-L231 PolarHBondContact O-N 3.46Å; K228-R232 WeakPolarHBondContact O-CB 3.29Å; K228-R232 PolarHBondContact O-N 3.31Å; K228-I481 HydrophobicContact CB-CG2 3.82Å; K228-E484 IonicContact NZ-OE1 2.63Å; K228-E484 PolarHBondContact NZ-OE1 3.49Å; K228-E484 IonicContact NZ-OE2 3.65Å
229	T	96.7	Very high	95.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68.4	-43.5	-176.7	-55.4	0	0	0	0	111.4	T225 A226 S227 R232 H233 A239 T472 A482 N485	T225-T229 WeakPolarHBondContact O-CB 3.29Å; T225-T229 PolarHBondContact O-N 2.91Å; T225-T229 PolarHBondContact O-OG1 3.03Å; A226-T229 PolarHBondContact O-N 2.9Å; S227-T229 PolarHBondContact O-N 3.3Å; T229-R232 PolarHBondContact O-N 3.36Å; T229-H233 PolarHBondContact O-N 3.17Å; T229-A239 HydrophobicContact CG2-CB 4.03Å; T229-T472 HydrophobicContact CG2-CG2 3.57Å; T229-A482 HydrophobicContact CG2-CB 4.42Å; T229-N485 WeakPolarHBondContact OG1-CB 3.22Å
230	C	96.1	Very high	95.4	Very high	16 Å²	16	44.2 Å²	44.2	11%	0.108	22%	0.217	C	C	.	.	H	α-helix	trans	-62.3	-44.4	173	-67.3	0	0	0	0	112.5	A226 S227 R232 H233 P234 A239 K243	A226-C230 PolarHBondContact O-N 3.34Å; A226-C230 PolarHBondContact O-SG 3.18Å; A226-C230 VanDerWaalsContact O-SG 3.36Å; S227-C230 PolarHBondContact O-N 2.99Å; C230-R232 PolarHBondContact O-N 2.64Å; C230-H233 CarbonylContact O-C 3.52Å; C230-H233 VanDerWaalsContact O-C 3.24Å; C230-H233 PolarHBondContact O-N 3.33Å; C230-P234 VanDerWaalsContact O-CA 3.3Å; C230-P234 WeakPolarHBondContact O-CA 3.45Å; C230-P234 VanDerWaalsContact O-N 3.14Å; C230-A239 PolarHBondContact SG-O 3.09Å; C230-K243 HydrophobicContact CB-CD 4.03Å; C230-K243 WeakPolarHBondContact SG-CB 3.39Å
231	L	95.3	Very high	95.6	Very high	53 Å²	53	46.8 Å²	46.8	28%	0.277	23%	0.229	S	C	.	.	H	α-helix	trans	-63.7	-24.1	176.6	-72.5	169	0	0	0	112.8	V169 F175 S227 K228	V169-L231 HydrophobicContact CG1-CD2 4.4Å; V169-L231 WeakPolarHBondContact O-CD2 3.36Å; F175-L231 HydrophobicContact CB-CD1 3.62Å; F175-L231 HydrophobicContact CD1-CD1 4.15Å; F175-L231 HydrophobicContact CD2-CD1 3.89Å; F175-L231 HydrophobicContact CG-CD1 3.6Å; S227-L231 WeakPolarHBondContact O-CG 3.47Å; S227-L231 PolarHBondContact O-N 2.86Å; K228-L231 PolarHBondContact O-N 3.46Å
232	R	95.9	Very high	95.9	Very high	159 Å²	159	42.2 Å²	42.2	60%	0.6	21%	0.206	S	C	*	.	H	α-helix	trans	-86.7	-31.4	174.7	-174.4	56.6	-178.9	160.5	1.7	113.5	K228 T229 C230 I481	K228-R232 WeakPolarHBondContact O-CB 3.29Å; K228-R232 PolarHBondContact O-N 3.31Å; T229-R232 PolarHBondContact O-N 3.36Å; C230-R232 PolarHBondContact O-N 2.64Å; R232-I481 HydrophobicContact CB-CD1 4.2Å; R232-I481 HydrophobicContact CG-CD1 4.14Å
233	H	95.9	Very high	96	Very high	39 Å²	39	43.2 Å²	43.2	18%	0.181	21%	0.211	C	C	.	.			trans	-134.3	68.4	-173	-56.1	-61.5	0	0	0	110.5	T229 C230 D235 C236 H476 S479	T229-H233 PolarHBondContact O-N 3.17Å; C230-H233 CarbonylContact O-C 3.52Å; C230-H233 VanDerWaalsContact O-C 3.24Å; C230-H233 PolarHBondContact O-N 3.33Å; H233-D235 VanDerWaalsContact C-N 3.3Å; H233-D235 PolarHBondContact O-N 2.92Å; H233-C236 HydrophobicContact CB-CB 3.78Å; H233-C236 VanDerWaalsContact O-CB 3.26Å; H233-C236 WeakPolarHBondContact O-CB 3.13Å; H233-C236 PolarHBondContact O-N 2.88Å; H233-C236 VanDerWaalsContact O-N 3.09Å; H233-H476 AromaticContact CD2-CD2 3.49Å; H233-H476 PolarHBondContact CD2-CD2 2.8Å; H233-H476 VanDerWaalsContact CD2-CD2 3.49Å; H233-H476 AromaticContact CE1-CD2 3.65Å; H233-H476 AromaticContact CE1-CE1 3.73Å; H233-H476 AromaticContact CE1-CG 3.79Å; H233-H476 AromaticContact CE1-ND1 3.84Å; H233-H476 AromaticContact CE1-NE2 3.6Å; H233-H476 AromaticContact CG-CD2 3.32Å; H233-H476 AromaticContact CG-NE2 3.64Å; H233-H476 AromaticContact ND1-CD2 3.38Å; H233-H476 PolarHBondContact ND1-CD2 2.89Å; H233-H476 AromaticContact ND1-CG 3.61Å; H233-H476 AromaticContact ND1-NE2 3.66Å; H233-H476 WeakPolarHBondContact NE2-CB 3.35Å; H233-H476 AromaticContact NE2-CG 3.56Å; H233-S479 WeakPolarHBondContact NE2-CB 3.32Å
234	P	93.4	Very high	96	Very high	89 Å²	89	46.1 Å²	46.1	58%	0.578	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-31.5	-169.2	24.9	-34.9	0	0	0	113.7	C230 C236	C230-P234 VanDerWaalsContact O-CA 3.3Å; C230-P234 WeakPolarHBondContact O-CA 3.45Å; C230-P234 VanDerWaalsContact O-N 3.14Å; P234-C236 VanDerWaalsContact C-N 3.26Å; P234-C236 PolarHBondContact O-N 3.24Å
235	D	95	Very high	96.1	Very high	156 Å²	156	46.3 Å²	46.3	83%	0.834	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.4	1	179.1	-48.4	-69.2	0	0	0	113.4	H233 E237	H233-D235 VanDerWaalsContact C-N 3.3Å; H233-D235 PolarHBondContact O-N 2.92Å; D235-E237 PolarHBondContact O-N 3.04Å
236	C	96.6	Very high	96.3	Very high	7 Å²	7	46.1 Å²	46.1	5%	0.047	23%	0.23	C	C	.	.			trans	-88.7	102.1	-175.6	-167.2	0	0	0	0	111.4	H233 P234 S238 A239 R240	H233-C236 HydrophobicContact CB-CB 3.78Å; H233-C236 VanDerWaalsContact O-CB 3.26Å; H233-C236 WeakPolarHBondContact O-CB 3.13Å; H233-C236 PolarHBondContact O-N 2.88Å; H233-C236 VanDerWaalsContact O-N 3.09Å; P234-C236 VanDerWaalsContact C-N 3.26Å; P234-C236 PolarHBondContact O-N 3.24Å; C236-S238 VanDerWaalsContact C-N 3.33Å; C236-S238 PolarHBondContact O-N 2.82Å; C236-A239 HydrophobicContact CB-CB 3.92Å; C236-A239 WeakPolarHBondContact O-CB 3.18Å; C236-A239 PolarHBondContact O-N 3.18Å; C236-R240 PolarHBondContact O-N 3.08Å; C236-R240 VanDerWaalsContact O-N 3.09Å
237	E	97.2	Very high	96.3	Very high	95 Å²	95	46.1 Å²	46.1	44%	0.444	23%	0.23	S	C	.	.	H	α-helix	trans	-55.5	-43.4	-177.2	-171.3	59.5	-137.7	0	0	113	D235 A239 R240 I241	D235-E237 PolarHBondContact O-N 3.04Å; E237-A239 VanDerWaalsContact C-N 3.32Å; E237-A239 PolarHBondContact O-N 3.47Å; E237-R240 PolarHBondContact O-N 2.87Å; E237-R240 VanDerWaalsContact O-N 3.14Å; E237-R240 IonicContact OE1-CZ 2.76Å; E237-R240 IonicContact OE1-NH1 2.68Å; E237-R240 IonicContact OE1-NH2 2.61Å; E237-R240 PolarHBondContact OE1-NH2 3.45Å; E237-R240 IonicContact OE2-CZ 3.23Å; E237-R240 IonicContact OE2-NH1 2.78Å; E237-R240 PolarHBondContact OE2-NH1 3.29Å; E237-R240 IonicContact OE2-NH2 2.78Å; E237-R240 PolarHBondContact OE2-NH2 2.9Å; E237-I241 HydrophobicContact CG-CD1 3.98Å; E237-I241 WeakPolarHBondContact O-CG1 3.28Å; E237-I241 PolarHBondContact O-N 3.33Å
238	S	97.2	Very high	96.3	Very high	9 Å²	9	51.8 Å²	51.8	6%	0.063	26%	0.256	C	S	.	.	H	α-helix	trans	-69.5	-26.6	178.4	48.9	0	0	0	0	113.3	C236 N242 S468 T472	C236-S238 VanDerWaalsContact C-N 3.33Å; C236-S238 PolarHBondContact O-N 2.82Å; S238-N242 VanDerWaalsContact O-CB 3.23Å; S238-N242 WeakPolarHBondContact O-CB 3.49Å; S238-N242 PolarHBondContact O-N 2.59Å; S238-S468 WeakPolarHBondContact CB-O 3.4Å; S238-S468 PolarHBondContact O-OG 3.3Å; S238-T472 VanDerWaalsContact C-OG1 3.26Å; S238-T472 PolarHBondContact OG-OG1 3.11Å
239	A	97.4	Very high	96.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-67.4	-45.3	168.3	0	0	0	0	0	110.5	T229 C230 C236 E237 N242 K243 T472	T229-A239 HydrophobicContact CG2-CB 4.03Å; C230-A239 PolarHBondContact SG-O 3.09Å; C236-A239 HydrophobicContact CB-CB 3.92Å; C236-A239 WeakPolarHBondContact O-CB 3.18Å; C236-A239 PolarHBondContact O-N 3.18Å; E237-A239 VanDerWaalsContact C-N 3.32Å; E237-A239 PolarHBondContact O-N 3.47Å; A239-N242 WeakPolarHBondContact O-CB 3.35Å; A239-N242 PolarHBondContact O-N 2.98Å; A239-K243 PolarHBondContact O-N 3.28Å; A239-T472 HydrophobicContact CB-CG2 3.86Å; A239-T472 PolarHBondContact N-OG1 3.49Å
240	R	96.7	Very high	96.4	Very high	105 Å²	105	51.5 Å²	51.5	40%	0.396	25%	0.254	S	S	.	.	H	α-helix	trans	-65.3	-46	-177.6	-159.1	176	74.7	-116.5	-3.9	112.1	C236 E237 N242 K243 D244	C236-R240 PolarHBondContact O-N 3.08Å; C236-R240 VanDerWaalsContact O-N 3.09Å; E237-R240 PolarHBondContact O-N 2.87Å; E237-R240 VanDerWaalsContact O-N 3.14Å; E237-R240 IonicContact OE1-CZ 2.76Å; E237-R240 IonicContact OE1-NH1 2.68Å; E237-R240 IonicContact OE1-NH2 2.61Å; E237-R240 PolarHBondContact OE1-NH2 3.45Å; E237-R240 IonicContact OE2-CZ 3.23Å; E237-R240 IonicContact OE2-NH1 2.78Å; E237-R240 PolarHBondContact OE2-NH1 3.29Å; E237-R240 IonicContact OE2-NH2 2.78Å; E237-R240 PolarHBondContact OE2-NH2 2.9Å; R240-N242 VanDerWaalsContact C-N 3.32Å; R240-N242 PolarHBondContact O-N 3.4Å; R240-K243 PolarHBondContact O-N 2.77Å; R240-D244 WeakPolarHBondContact O-CB 3.46Å; R240-D244 PolarHBondContact O-N 3.42Å
241	I	95.9	Very high	96.5	Very high	88 Å²	88	53.7 Å²	53.7	45%	0.451	26%	0.26	S	S	.	.	H	α-helix	trans	-56.2	-46.4	172.9	-68.9	167.7	0	0	0	111	E237 K243 D244 A245	E237-I241 HydrophobicContact CG-CD1 3.98Å; E237-I241 WeakPolarHBondContact O-CG1 3.28Å; E237-I241 PolarHBondContact O-N 3.33Å; I241-K243 PolarHBondContact O-N 3.02Å; I241-D244 PolarHBondContact O-N 2.92Å; I241-A245 VanDerWaalsContact O-CB 3.29Å; I241-A245 WeakPolarHBondContact O-CB 3.15Å; I241-A245 PolarHBondContact O-N 2.9Å; I241-A245 VanDerWaalsContact O-N 3.07Å
242	N	95.6	Very high	96.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61	-43.5	178.9	-180	-99.2	0	0	0	111.8	A226 S238 A239 R240 Q465 N485 F489	A226-N242 WeakPolarHBondContact CB-OD1 3.3Å; S238-N242 VanDerWaalsContact O-CB 3.23Å; S238-N242 WeakPolarHBondContact O-CB 3.49Å; S238-N242 PolarHBondContact O-N 2.59Å; A239-N242 WeakPolarHBondContact O-CB 3.35Å; A239-N242 PolarHBondContact O-N 2.98Å; R240-N242 VanDerWaalsContact C-N 3.32Å; R240-N242 PolarHBondContact O-N 3.4Å; N242-Q465 PolarHBondContact ND2-O 2.86Å; N242-N485 PolarHBondContact OD1-ND2 2.62Å; N242-F489 WeakPolarHBondContact ND2-CE1 3.35Å; N242-F489 WeakPolarHBondContact ND2-CZ 3.36Å; N242-F489 WeakPolarHBondContact OD1-CE2 3.41Å; N242-F489 VanDerWaalsContact OD1-CZ 3.27Å; N242-F489 WeakPolarHBondContact OD1-CZ 3.09Å
243	K	96.4	Very high	96.6	Very high	24 Å²	24	46.1 Å²	46.1	10%	0.104	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-57.8	173.2	179.7	-176	71.8	66.9	0	112.1	A226 C230 A239 R240 I241 A245 V246 F247	A226-K243 HydrophobicContact CB-CB 4.21Å; C230-K243 HydrophobicContact CB-CD 4.03Å; C230-K243 WeakPolarHBondContact SG-CB 3.39Å; A239-K243 PolarHBondContact O-N 3.28Å; R240-K243 PolarHBondContact O-N 2.77Å; I241-K243 PolarHBondContact O-N 3.02Å; K243-A245 PolarHBondContact O-N 2.61Å; K243-V246 WeakPolarHBondContact O-CB 3.32Å; K243-V246 PolarHBondContact O-N 2.7Å; K243-F247 HydrophobicContact CD-CD2 4.34Å; K243-F247 HydrophobicContact CD-CE2 3.84Å; K243-F247 HydrophobicContact CG-CD2 3.6Å; K243-F247 HydrophobicContact CG-CE2 3.47Å; K243-F247 VanDerWaalsContact CG-CE2 3.47Å; K243-F247 WeakPolarHBondContact O-CD2 3.28Å; K243-F247 PolarHBondContact O-N 2.98Å; K243-F247 VanDerWaalsContact O-N 3.1Å
244	D	96.7	Very high	96.7	Very high	61 Å²	61	44.3 Å²	44.3	33%	0.326	23%	0.227	S	C	.	.	H	α-helix	trans	-62.2	-34	-170.5	-65.1	-12.6	0	0	0	111.6	R240 I241 V246 F247 H248	R240-D244 WeakPolarHBondContact O-CB 3.46Å; R240-D244 PolarHBondContact O-N 3.42Å; I241-D244 PolarHBondContact O-N 2.92Å; D244-V246 PolarHBondContact O-N 3.37Å; D244-F247 PolarHBondContact O-N 2.93Å; D244-H248 WeakPolarHBondContact O-CB 3.34Å; D244-H248 PolarHBondContact O-N 3.3Å
245	A	96.7	Very high	96.8	Very high	31 Å²	31	44.5 Å²	44.5	26%	0.256	22%	0.22	S	C	.	.	H	α-helix	trans	-64.2	-34.9	172.8	0	0	0	0	0	113.5	I241 K243 R249 Q465	I241-A245 VanDerWaalsContact O-CB 3.29Å; I241-A245 WeakPolarHBondContact O-CB 3.15Å; I241-A245 PolarHBondContact O-N 2.9Å; I241-A245 VanDerWaalsContact O-N 3.07Å; K243-A245 PolarHBondContact O-N 2.61Å; A245-R249 VanDerWaalsContact O-CB 3.29Å; A245-R249 WeakPolarHBondContact O-CB 3.49Å; A245-R249 PolarHBondContact O-N 3.36Å; A245-Q465 HydrophobicContact CB-CG 4.22Å; A245-Q465 VanDerWaalsContact CB-NE2 3.32Å
246	V	97.7	Very high	96.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-70	-46.1	173	-179.9	0	0	0	0	110.6	C219 M222 L223 K243 D244 H248 R249 M250 F489	C219-V246 HydrophobicContact CB-CG1 3.96Å; M222-V246 HydrophobicContact CB-CG1 4.37Å; M222-V246 HydrophobicContact CB-CG2 4.08Å; M222-V246 HydrophobicContact CE-CG2 4.41Å; L223-V246 HydrophobicContact CB-CG1 4.02Å; L223-V246 HydrophobicContact CD1-CG1 3.99Å; K243-V246 WeakPolarHBondContact O-CB 3.32Å; K243-V246 PolarHBondContact O-N 2.7Å; D244-V246 PolarHBondContact O-N 3.37Å; V246-H248 PolarHBondContact O-N 2.93Å; V246-R249 PolarHBondContact O-N 3.46Å; V246-M250 HydrophobicContact CG1-CG 4.42Å; V246-M250 WeakPolarHBondContact O-CG 3.21Å; V246-M250 PolarHBondContact O-N 3.27Å; V246-F489 HydrophobicContact CG2-CE1 4.08Å; V246-F489 HydrophobicContact CG2-CZ 3.69Å
247	F	97.7	Very high	96.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-56.7	-47.1	176.4	-86.1	-89.3	0	0	0	112	L163 L166 E167 L223 K243 D244 M250 R251	L163-F247 HydrophobicContact CD1-CD1 3.52Å; L163-F247 HydrophobicContact CD1-CE1 3.47Å; L163-F247 VanDerWaalsContact CD1-CE1 3.47Å; L163-F247 HydrophobicContact CD1-CZ 4.47Å; L163-F247 HydrophobicContact CD2-CD1 4.41Å; L163-F247 HydrophobicContact CG-CD1 3.68Å; L163-F247 HydrophobicContact CG-CE1 3.85Å; L163-F247 WeakPolarHBondContact O-CE1 3.45Å; L166-F247 HydrophobicContact CB-CE1 3.99Å; L166-F247 HydrophobicContact CB-CZ 3.89Å; E167-F247 HydrophobicContact CB-CD1 3.87Å; E167-F247 HydrophobicContact CB-CE1 3.56Å; E167-F247 HydrophobicContact CB-CZ 3.95Å; E167-F247 HydrophobicContact CG-CD1 4.09Å; E167-F247 HydrophobicContact CG-CE1 4.19Å; E167-F247 HydrophobicContact CG-CG 4.33Å; E167-F247 HydrophobicContact CG-CZ 4.47Å; L223-F247 HydrophobicContact CD1-CD1 4.31Å; L223-F247 HydrophobicContact CD1-CD2 3.64Å; L223-F247 HydrophobicContact CD1-CE1 4.07Å; L223-F247 HydrophobicContact CD1-CE2 3.39Å; L223-F247 HydrophobicContact CD1-CG 4.11Å; L223-F247 HydrophobicContact CD1-CZ 3.63Å; K243-F247 HydrophobicContact CD-CD2 4.34Å; K243-F247 HydrophobicContact CD-CE2 3.84Å; K243-F247 HydrophobicContact CG-CD2 3.6Å; K243-F247 HydrophobicContact CG-CE2 3.47Å; K243-F247 VanDerWaalsContact CG-CE2 3.47Å; K243-F247 WeakPolarHBondContact O-CD2 3.28Å; K243-F247 PolarHBondContact O-N 2.98Å; K243-F247 VanDerWaalsContact O-N 3.1Å; D244-F247 PolarHBondContact O-N 2.93Å; F247-M250 PolarHBondContact O-N 2.98Å; F247-R251 WeakPolarHBondContact O-CG 3.34Å; F247-R251 PolarHBondContact O-N 3.41Å; F247-R251 VanDerWaalsContact O-N 3.1Å
248	H	96.9	Very high	96.7	Very high	122 Å²	122	35.7 Å²	35.7	57%	0.565	17%	0.174	S	C	*	.	H	α-helix	trans	-59.1	-49.5	174.8	178.5	70.3	0	0	0	111.7	D244 V246 M250 R251 C252	D244-H248 WeakPolarHBondContact O-CB 3.34Å; D244-H248 PolarHBondContact O-N 3.3Å; V246-H248 PolarHBondContact O-N 2.93Å; H248-M250 VanDerWaalsContact C-N 3.32Å; H248-M250 PolarHBondContact O-N 3.32Å; H248-R251 PolarHBondContact O-N 2.95Å; H248-R251 VanDerWaalsContact O-N 3.15Å; H248-C252 PolarHBondContact O-N 3.36Å; H248-C252 PolarHBondContact O-SG 2.73Å; H248-C252 VanDerWaalsContact O-SG 3.41Å
249	R	96.3	Very high	96.4	Very high	26 Å²	26	38.7 Å²	38.7	10%	0.098	19%	0.187	C	C	.	.	H	α-helix	trans	-60.8	-38.3	-179.5	-170.1	173.6	-170.6	-179.7	-0.7	112.9	V215 A245 V246 A253 T458	V215-R249 HydrophobicContact CG1-CG 3.65Å; A245-R249 VanDerWaalsContact O-CB 3.29Å; A245-R249 WeakPolarHBondContact O-CB 3.49Å; A245-R249 PolarHBondContact O-N 3.36Å; V246-R249 PolarHBondContact O-N 3.46Å; R249-A253 PolarHBondContact O-N 3.38Å; R249-A253 VanDerWaalsContact O-N 3.09Å; R249-T458 PolarHBondContact NH2-OG1 3.2Å
250	M	97.9	Very high	96.2	Very high	1 Å²	1	39 Å²	39	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-65.2	-45.9	174.1	-67.9	-163.2	84.2	0	0	112	L163 F182 M186 L216 C219 T220 L223 V246 F247 H248 C252 A253 L254	L163-M250 HydrophobicContact CD2-CB 4.28Å; F182-M250 HydrophobicContact CZ-CE 3.82Å; F182-M250 HydrophobicContact CZ-SD 4.16Å; M186-M250 HydrophobicContact CE-CE 4.13Å; M186-M250 HydrophobicContact SD-CE 4.45Å; L216-M250 HydrophobicContact CD2-CB 4.44Å; L216-M250 HydrophobicContact CD2-CE 4Å; C219-M250 HydrophobicContact CB-CE 4.14Å; C219-M250 HydrophobicContact CB-CG 3.29Å; C219-M250 HydrophobicContact CB-SD 3.72Å; T220-M250 WeakPolarHBondContact OG1-CE 3.26Å; L223-M250 HydrophobicContact CB-SD 4.43Å; L223-M250 HydrophobicContact CD2-SD 3.97Å; V246-M250 HydrophobicContact CG1-CG 4.42Å; V246-M250 WeakPolarHBondContact O-CG 3.21Å; V246-M250 PolarHBondContact O-N 3.27Å; F247-M250 PolarHBondContact O-N 2.98Å; H248-M250 VanDerWaalsContact C-N 3.32Å; H248-M250 PolarHBondContact O-N 3.32Å; M250-C252 VanDerWaalsContact C-N 3.32Å; M250-C252 PolarHBondContact O-N 3.35Å; M250-A253 PolarHBondContact O-N 2.89Å; M250-L254 WeakPolarHBondContact O-CG 3.41Å; M250-L254 PolarHBondContact O-N 3.22Å
251	R	97.8	Very high	95.9	Very high	63 Å²	63	34.2 Å²	34.2	24%	0.238	17%	0.171	C	C	.	.	H	α-helix	trans	-57.7	-44.5	176.7	-70.3	-179	-179.9	118.2	-8.2	111.6	L160 L163 D164 E167 F247 H248 A253 L254 E255	L160-R251 HydrophobicContact CD2-CG 3.97Å; L163-R251 HydrophobicContact CD2-CG 3.79Å; D164-R251 IonicContact OD1-CZ 3.08Å; D164-R251 IonicContact OD1-NE 3.6Å; D164-R251 PolarHBondContact OD1-NE 2.94Å; D164-R251 IonicContact OD1-NH2 3.77Å; D164-R251 PolarHBondContact OD1-NH2 3.42Å; E167-R251 VanDerWaalsContact CD-NH2 3.27Å; E167-R251 IonicContact OE1-CZ 3.65Å; E167-R251 IonicContact OE1-NH1 2.61Å; E167-R251 PolarHBondContact OE1-NH1 3.22Å; E167-R251 IonicContact OE1-NH2 2.62Å; E167-R251 PolarHBondContact OE1-NH2 2.74Å; E167-R251 IonicContact OE2-CZ 2.83Å; E167-R251 IonicContact OE2-NH1 3.8Å; E167-R251 IonicContact OE2-NH2 3.96Å; E167-R251 PolarHBondContact OE2-NH2 3.03Å; F247-R251 WeakPolarHBondContact O-CG 3.34Å; F247-R251 PolarHBondContact O-N 3.41Å; F247-R251 VanDerWaalsContact O-N 3.1Å; H248-R251 PolarHBondContact O-N 2.95Å; H248-R251 VanDerWaalsContact O-N 3.15Å; R251-A253 PolarHBondContact O-N 3.15Å; R251-L254 PolarHBondContact O-N 2.91Å; R251-E255 PolarHBondContact O-N 3.45Å
252	C	96.2	Very high	95.5	Very high	51 Å²	51	32.5 Å²	32.5	35%	0.345	17%	0.165	S	C	.	.	H	α-helix	trans	-61.7	-42	175.9	-65.8	0	0	0	0	113	H248 M250 E255 Q256	H248-C252 PolarHBondContact O-N 3.36Å; H248-C252 PolarHBondContact O-SG 2.73Å; H248-C252 VanDerWaalsContact O-SG 3.41Å; M250-C252 VanDerWaalsContact C-N 3.32Å; M250-C252 PolarHBondContact O-N 3.35Å; C252-E255 WeakPolarHBondContact O-CB 3.24Å; C252-E255 PolarHBondContact O-N 3.03Å; C252-Q256 WeakPolarHBondContact O-CG 3.26Å; C252-Q256 PolarHBondContact O-N 2.69Å
253	A	97.3	Very high	94.2	Very high	2 Å²	2	36.4 Å²	36.4	2%	0.017	18%	0.183	C	C	.	.	H	α-helix	trans	-68.8	-35	176.9	0	0	0	0	0	112.8	V215 L216 R249 M250 R251 E255 Q256 V257	V215-A253 HydrophobicContact CB-CB 3.94Å; V215-A253 HydrophobicContact CG1-CB 3.69Å; L216-A253 HydrophobicContact CD2-CB 3.84Å; L216-A253 HydrophobicContact CG-CB 3.8Å; R249-A253 PolarHBondContact O-N 3.38Å; R249-A253 VanDerWaalsContact O-N 3.09Å; M250-A253 PolarHBondContact O-N 2.89Å; R251-A253 PolarHBondContact O-N 3.15Å; A253-E255 VanDerWaalsContact C-N 3.33Å; A253-Q256 PolarHBondContact O-N 3.07Å; A253-V257 WeakPolarHBondContact O-CG2 3.36Å; A253-V257 PolarHBondContact O-N 3.46Å
254	L	97.9	Very high	92.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.4	-37.7	170.4	-67.4	173.9	0	0	0	111.7	R156 V159 L160 F189 L216 M250 R251 I258	R156-L254 HydrophobicContact CG-CB 4.05Å; R156-L254 HydrophobicContact CG-CD2 4.26Å; V159-L254 HydrophobicContact CG1-CD1 3.78Å; V159-L254 HydrophobicContact CG1-CD2 4.16Å; L160-L254 HydrophobicContact CD2-CD1 3.6Å; L160-L254 HydrophobicContact CG-CD1 4.15Å; F189-L254 HydrophobicContact CD1-CD2 4.01Å; F189-L254 HydrophobicContact CE1-CD2 3.39Å; F189-L254 HydrophobicContact CZ-CD2 3.88Å; L216-L254 HydrophobicContact CD1-CD2 4.05Å; L216-L254 HydrophobicContact CD2-CD2 3.84Å; L216-L254 HydrophobicContact CD2-CG 3.92Å; M250-L254 WeakPolarHBondContact O-CG 3.41Å; M250-L254 PolarHBondContact O-N 3.22Å; R251-L254 PolarHBondContact O-N 2.91Å; L254-I258 WeakPolarHBondContact O-CG1 3.4Å; L254-I258 PolarHBondContact O-N 2.96Å
255	E	95.8	Very high	90	Very high	93 Å²	93	46.7 Å²	46.7	44%	0.435	23%	0.23	S	C	.	.	H	α-helix	trans	-62.3	-50	174.4	-148.3	66.2	-155.4	0	0	111.6	R156 R251 C252 A253 V257 I258 E259	R156-E255 IonicContact CZ-OE2 3.4Å; R156-E255 IonicContact NH2-OE1 2.65Å; R156-E255 IonicContact NH2-OE2 3.57Å; R156-E255 PolarHBondContact NH2-OE2 2.98Å; R251-E255 PolarHBondContact O-N 3.45Å; C252-E255 WeakPolarHBondContact O-CB 3.24Å; C252-E255 PolarHBondContact O-N 3.03Å; A253-E255 VanDerWaalsContact C-N 3.33Å; E255-V257 VanDerWaalsContact C-N 3.28Å; E255-V257 PolarHBondContact O-N 3.14Å; E255-I258 WeakPolarHBondContact O-CA 3.16Å; E255-I258 PolarHBondContact O-N 3.27Å; E255-E259 PolarHBondContact O-N 3.44Å
256	Q	94.7	Very high	87.2	Confident	51 Å²	51	48 Å²	48	24%	0.238	24%	0.238	C	C	.	.	H	α-helix	trans	-57.1	-39.3	179.2	-70.4	179.8	17.9	0	0	112.2	A212 C252 A253 I258 E259 I260	A212-Q256 HydrophobicContact CB-CB 4.18Å; C252-Q256 WeakPolarHBondContact O-CG 3.26Å; C252-Q256 PolarHBondContact O-N 2.69Å; A253-Q256 PolarHBondContact O-N 3.07Å; Q256-I258 VanDerWaalsContact C-N 3.3Å; Q256-I258 PolarHBondContact O-N 3.23Å; Q256-E259 PolarHBondContact O-N 2.74Å; Q256-I260 WeakPolarHBondContact O-CD1 3.45Å; Q256-I260 WeakPolarHBondContact O-CG1 3.43Å; Q256-I260 PolarHBondContact O-N 3.17Å; Q256-I260 VanDerWaalsContact O-N 3.09Å
257	V	96.5	Very high	84	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.9	-43.2	173.9	171.7	0	0	0	0	111.1	I152 F189 T193 M209 A212 L216 A253 E255 I260 V261	I152-V257 HydrophobicContact CG2-CG1 4.05Å; F189-V257 HydrophobicContact CE1-CG1 4.46Å; F189-V257 HydrophobicContact CE1-CG2 4.38Å; F189-V257 HydrophobicContact CE2-CG1 4.22Å; F189-V257 HydrophobicContact CZ-CB 4.04Å; F189-V257 HydrophobicContact CZ-CG1 3.61Å; F189-V257 HydrophobicContact CZ-CG2 4.24Å; T193-V257 HydrophobicContact CG2-CG1 3.6Å; M209-V257 HydrophobicContact CE-CG1 4.08Å; M209-V257 HydrophobicContact SD-CG1 4.18Å; M209-V257 HydrophobicContact SD-CG2 4.05Å; A212-V257 HydrophobicContact CB-CG2 3.96Å; L216-V257 HydrophobicContact CD1-CG2 4.42Å; A253-V257 WeakPolarHBondContact O-CG2 3.36Å; A253-V257 PolarHBondContact O-N 3.46Å; E255-V257 VanDerWaalsContact C-N 3.28Å; E255-V257 PolarHBondContact O-N 3.14Å; V257-I260 PolarHBondContact O-N 2.75Å; V257-V261 WeakPolarHBondContact O-CG2 3.33Å; V257-V261 PolarHBondContact O-N 3.3Å; V257-V261 VanDerWaalsContact O-N 3.15Å
258	I	94.4	Very high	81.1	Confident	23 Å²	23	57.5 Å²	57.5	12%	0.118	31%	0.31	C	S	.	.	H	α-helix	trans	-67.7	-42.1	179.6	-58.2	-45.7	0	0	0	111.4	I152 I153 R156 L254 E255 Q256 I260 V261 T262	I152-I258 HydrophobicContact CG2-CD1 4.42Å; I153-I258 HydrophobicContact CG1-CD1 3.95Å; I153-I258 HydrophobicContact CG1-CG2 4.48Å; R156-I258 HydrophobicContact CB-CD1 3.97Å; R156-I258 HydrophobicContact CG-CD1 3.96Å; R156-I258 HydrophobicContact CG-CG1 4.01Å; L254-I258 WeakPolarHBondContact O-CG1 3.4Å; L254-I258 PolarHBondContact O-N 2.96Å; E255-I258 WeakPolarHBondContact O-CA 3.16Å; E255-I258 PolarHBondContact O-N 3.27Å; Q256-I258 VanDerWaalsContact C-N 3.3Å; Q256-I258 PolarHBondContact O-N 3.23Å; I258-I260 VanDerWaalsContact C-N 3.3Å; I258-I260 PolarHBondContact O-N 2.81Å; I258-V261 PolarHBondContact O-N 2.66Å; I258-T262 HydrophobicContact CG2-CG2 3.8Å; I258-T262 WeakPolarHBondContact O-CB 3.42Å; I258-T262 WeakPolarHBondContact O-CG2 3.35Å; I258-T262 PolarHBondContact O-N 3.01Å; I258-T262 PolarHBondContact O-OG1 3.44Å
259	E	92.1	Very high	78	Confident	72 Å²	72	58.4 Å²	58.4	34%	0.336	32%	0.315	S	S	.	.	H	α-helix	trans	-52.7	-48.7	172.2	-66.9	178.5	-170.4	0	0	111.6	R208 E255 Q256 V261 E263	R208-E259 IonicContact CZ-OE2 2.68Å; R208-E259 IonicContact NH1-OE2 3.13Å; R208-E259 PolarHBondContact NH1-OE2 3.41Å; R208-E259 IonicContact NH2-OE2 2.71Å; R208-E259 PolarHBondContact NH2-OE2 3.19Å; E255-E259 PolarHBondContact O-N 3.44Å; Q256-E259 PolarHBondContact O-N 2.74Å; E259-V261 PolarHBondContact O-N 3.15Å; E259-E263 PolarHBondContact O-N 3.04Å
260	I	92.4	Very high	74.8	Confident	6 Å²	6	63.9 Å²	63.9	3%	0.031	35%	0.346	C	S	.	.	H	α-helix	trans	-67.1	-37.3	-173.8	-63.1	156.6	0	0	0	111.8	L200 K205 R208 M209 Q256 V257 I258	L200-I260 HydrophobicContact CD1-CG2 4.27Å; K205-I260 HydrophobicContact CB-CG2 3.84Å; K205-I260 HydrophobicContact CG-CG2 4.17Å; R208-I260 HydrophobicContact CB-CD1 3.58Å; R208-I260 HydrophobicContact CB-CG1 4.04Å; M209-I260 HydrophobicContact CB-CD1 4.4Å; M209-I260 HydrophobicContact CB-CG2 4.47Å; M209-I260 HydrophobicContact CE-CB 3.97Å; M209-I260 HydrophobicContact CE-CD1 4.38Å; M209-I260 HydrophobicContact CE-CG2 3.73Å; Q256-I260 WeakPolarHBondContact O-CD1 3.45Å; Q256-I260 WeakPolarHBondContact O-CG1 3.43Å; Q256-I260 PolarHBondContact O-N 3.17Å; Q256-I260 VanDerWaalsContact O-N 3.09Å; V257-I260 PolarHBondContact O-N 2.75Å; I258-I260 VanDerWaalsContact C-N 3.3Å; I258-I260 PolarHBondContact O-N 2.81Å
261	V	91.4	Very high	72	Confident	4 Å²	4	71.7 Å²	71.7	2%	0.024	38%	0.38	C	S	.	.	H	α-helix	trans	-88.6	-24.5	-178.1	-55.8	0	0	0	0	114.2	I149 I152 R196 M209 V257 I258 E259	I149-V261 WeakPolarHBondContact CD1-O 3.41Å; I149-V261 HydrophobicContact CG1-CB 4.46Å; I149-V261 HydrophobicContact CG2-CB 4.44Å; I149-V261 HydrophobicContact CG2-CG2 4.09Å; I152-V261 HydrophobicContact CD1-CG1 4.15Å; I152-V261 HydrophobicContact CG2-CG2 4.2Å; R196-V261 HydrophobicContact CG-CG1 3.86Å; M209-V261 HydrophobicContact CE-CG1 3.6Å; V257-V261 WeakPolarHBondContact O-CG2 3.33Å; V257-V261 PolarHBondContact O-N 3.3Å; V257-V261 VanDerWaalsContact O-N 3.15Å; I258-V261 PolarHBondContact O-N 2.66Å; E259-V261 PolarHBondContact O-N 3.15Å
262	T	86.6	Confident	69.6	Low	53 Å²	53	74.4 Å²	74.4	33%	0.325	40%	0.403	S	S	.	.	H	α-helix	trans	-92.6	-19.8	179.3	59.9	0	0	0	0	113.8	I149 I153 I258 A264	I149-T262 HydrophobicContact CG2-CG2 4.18Å; I153-T262 HydrophobicContact CD1-CG2 3.88Å; I153-T262 HydrophobicContact CG1-CG2 4.46Å; I258-T262 HydrophobicContact CG2-CG2 3.8Å; I258-T262 WeakPolarHBondContact O-CB 3.42Å; I258-T262 WeakPolarHBondContact O-CG2 3.35Å; I258-T262 PolarHBondContact O-N 3.01Å; I258-T262 PolarHBondContact O-OG1 3.44Å; T262-A264 PolarHBondContact O-N 3.27Å; T262-A264 WeakPolarHBondContact OG1-CB 3.28Å; T262-A264 PolarHBondContact OG1-N 2.94Å
263	E	69.5	Low	67.5	Low	81 Å²	81	75.4 Å²	75.4	38%	0.379	41%	0.405	S	S	.	.			trans	55.6	24.1	-169.6	-51.6	-169.7	144.9	0	0	113.7	K18 K205 E259 R265	K18-E263 VanDerWaalsContact CD-OE1 3.25Å; K18-E263 WeakPolarHBondContact CD-OE1 3.39Å; K18-E263 IonicContact NZ-OE1 3.31Å; K18-E263 PolarHBondContact NZ-OE1 3.2Å; K18-E263 IonicContact NZ-OE2 3.49Å; K18-E263 PolarHBondContact NZ-OE2 2.94Å; K205-E263 WeakPolarHBondContact CE-OE1 3.1Å; K205-E263 IonicContact NZ-OE1 2.74Å; K205-E263 PolarHBondContact NZ-OE1 3.47Å; E259-E263 PolarHBondContact O-N 3.04Å; E263-R265 PolarHBondContact O-N 3.37Å
264	A	56.4	Low	65.8	Low	64 Å²	64	80.7 Å²	80.7	53%	0.529	44%	0.439	S	S	.	.			trans	-58.6	107.6	171.4	0	0	0	0	0	109.2	T262 S266	T262-A264 PolarHBondContact O-N 3.27Å; T262-A264 WeakPolarHBondContact OG1-CB 3.28Å; T262-A264 PolarHBondContact OG1-N 2.94Å; A264-S266 PolarHBondContact O-N 3.01Å
265	R	47.3	Very low	64.6	Low	238 Å²	238	83.8 Å²	83.8	90%	0.898	46%	0.458	S	S	*	.			trans	-56.2	124.4	168.4	-72	-177.2	175.6	-176.8	-2.1	107.5	E263 C267	E263-R265 PolarHBondContact O-N 3.37Å; R265-C267 PolarHBondContact O-N 3.11Å; R265-C267 VanDerWaalsContact O-N 3.16Å
266	S	39.1	Very low	64.3	Low	59 Å²	59	79.5 Å²	79.5	41%	0.413	44%	0.438	S	S	.	.			trans	-57.5	121.4	177.8	51.5	0	0	0	0	109.4	A264 G268 E269	A264-S266 PolarHBondContact O-N 3.01Å; S266-G268 CarbonylContact C-O 3.4Å; S266-G268 WeakPolarHBondContact CB-O 3.2Å; S266-G268 PolarHBondContact O-N 3.04Å; S266-G268 PolarHBondContact OG-O 2.77Å; S266-E269 PolarHBondContact OG-O 3.11Å
267	C	30.8	Very low	64.3	Low	148 Å²	148	77.1 Å²	77.1	100%	1	43%	0.427	S	S	*	.	S	Bend	trans	-82.1	66.8	179.1	-161.9	0	0	0	0	109	R265	R265-C267 PolarHBondContact O-N 3.11Å; R265-C267 VanDerWaalsContact O-N 3.16Å
268	G	35.9	Very low	64.1	Low	51 Å²	51	79.3 Å²	79.3	53%	0.526	44%	0.436	S	S	.	.	S	Bend	trans	132.7	139.8	-164.7	0	0	0	0	0	110	S266	S266-G268 CarbonylContact C-O 3.4Å; S266-G268 WeakPolarHBondContact CB-O 3.2Å; S266-G268 PolarHBondContact O-N 3.04Å; S266-G268 PolarHBondContact OG-O 2.77Å
269	E	30.8	Very low	63.9	Low	140 Å²	140	79.8 Å²	79.8	65%	0.654	44%	0.439	S	S	*	.			trans	48.1	75.8	178.8	-65	-168.8	-159.8	0	0	115.6	S266 K271	S266-E269 PolarHBondContact OG-O 3.11Å; E269-K271 PolarHBondContact O-N 3.3Å; E269-K271 WeakPolarHBondContact OE2-CE 3.43Å; E269-K271 IonicContact OE2-NZ 3.46Å; E269-K271 PolarHBondContact OE2-NZ 3.29Å
270	N	31	Very low	63.9	Low	142 Å²	142	77.3 Å²	77.3	76%	0.759	43%	0.429	S	S	*	.			trans	-64.4	84.9	138.8	-87.5	-30.8	0	0	0	107.7	V272	N270-V272 PolarHBondContact O-N 3.39Å
271	K	38.9	Very low	64	Low	165 Å²	165	77.4 Å²	77.4	72%	0.717	43%	0.429	S	S	*	.			trans	-67.4	86.6	156.8	-84.5	177.3	174.1	140.9	0	107.2	E269 L273	E269-K271 PolarHBondContact O-N 3.3Å; E269-K271 WeakPolarHBondContact OE2-CE 3.43Å; E269-K271 IonicContact OE2-NZ 3.46Å; E269-K271 PolarHBondContact OE2-NZ 3.29Å; K271-L273 PolarHBondContact O-N 2.88Å
272	V	45.7	Very low	64	Low	119 Å²	119	82.6 Å²	82.6	72%	0.721	45%	0.452	S	S	*	.			trans	-55.7	114	168.5	178.9	0	0	0	0	106.1	N270 P274	N270-V272 PolarHBondContact O-N 3.39Å; V272-P274 WeakPolarHBondContact O-CD 3.24Å
273	L	53.8	Low	64.2	Low	73 Å²	73	83.5 Å²	83.5	38%	0.382	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-55.9	124.6	178.8	-133.2	71.9	0	0	0	107.8	K271 T275 I453	K271-L273 PolarHBondContact O-N 2.88Å; L273-T275 PolarHBondContact O-N 3.41Å; L273-T275 VanDerWaalsContact O-N 3.11Å; L273-I453 HydrophobicContact CD1-CD1 3.88Å; L273-I453 HydrophobicContact CD2-CD1 3.72Å; L273-I453 HydrophobicContact CG-CD1 3.8Å
274	P	60.5	Low	65.4	Low	112 Å²	112	79.7 Å²	79.7	73%	0.727	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-53.4	121.7	179	-27.8	35.7	0	0	0	109.9	V272 S276	V272-P274 WeakPolarHBondContact O-CD 3.24Å; P274-S276 PolarHBondContact O-N 3.45Å; P274-S276 VanDerWaalsContact O-N 3.11Å
275	T	73.3	Confident	67.2	Low	65 Å²	65	79.3 Å²	79.3	40%	0.399	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-64.1	117.9	-173.3	-52.7	0	0	0	0	109.7	L273 N279 R313	L273-T275 PolarHBondContact O-N 3.41Å; L273-T275 VanDerWaalsContact O-N 3.11Å; T275-N279 HydrophobicContact CG2-CB 4.08Å; T275-R313 PolarHBondContact O-NH1 2.98Å
276	S	88.8	Confident	69.3	Low	3 Å²	3	70.8 Å²	70.8	2%	0.021	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-55.7	147.7	-177.5	65	0	0	0	0	111.8	P274 Y278 N279 S280 E449	P274-S276 PolarHBondContact O-N 3.45Å; P274-S276 VanDerWaalsContact O-N 3.11Å; S276-Y278 PolarHBondContact O-N 2.87Å; S276-N279 PolarHBondContact O-N 3.48Å; S276-N279 VanDerWaalsContact O-N 3.09Å; S276-N279 PolarHBondContact OG-N 2.7Å; S276-N279 PolarHBondContact OG-ND2 3.05Å; S276-S280 PolarHBondContact O-N 3.29Å; S276-S280 VanDerWaalsContact O-N 3.13Å; S276-E449 VanDerWaalsContact CB-OE1 3.23Å; S276-E449 WeakPolarHBondContact CB-OE1 3.41Å; S276-E449 PolarHBondContact OG-OE1 3.37Å
277	I	94.5	Very high	71.8	Confident	2 Å²	2	69.4 Å²	69.4	1%	0.01	39%	0.39	C	S	.	.	H	α-helix	trans	-59.9	-36.1	177.7	-59	167.7	0	0	0	109.6	N279 S280 I281 L310 R313 F317 L382 H441	I277-N279 PolarHBondContact O-N 3.41Å; I277-S280 PolarHBondContact O-N 2.92Å; I277-I281 HydrophobicContact CG2-CD1 3.89Å; I277-I281 HydrophobicContact CG2-CG1 4.11Å; I277-I281 VanDerWaalsContact O-CB 3.29Å; I277-I281 WeakPolarHBondContact O-CB 3.38Å; I277-I281 WeakPolarHBondContact O-CG1 3.38Å; I277-I281 PolarHBondContact O-N 3.5Å; I277-L310 HydrophobicContact CG2-CD1 4.07Å; I277-R313 HydrophobicContact CD1-CB 4.36Å; I277-R313 WeakPolarHBondContact CD1-O 3.47Å; I277-R313 HydrophobicContact CG1-CB 3.94Å; I277-F317 HydrophobicContact CD1-CD2 4.06Å; I277-F317 HydrophobicContact CD1-CE2 3.7Å; I277-L382 HydrophobicContact CD1-CD1 4.27Å; I277-L382 HydrophobicContact CG2-CD1 3.79Å; I277-H441 HydrophobicContact CB-CB 4.16Å; I277-H441 HydrophobicContact CD1-CB 3.84Å; I277-H441 HydrophobicContact CG1-CB 3.95Å; I277-H441 PolarHBondContact N-O 2.99Å
278	Y	92.9	Very high	74.7	Confident	45 Å²	45	62.3 Å²	62.3	18%	0.176	34%	0.342	C	S	.	.	H	α-helix	trans	-53.4	-49	172.7	-179.5	-82.6	0	0	0	113.2	S276 I281 K282 H441 G444	S276-Y278 PolarHBondContact O-N 2.87Å; Y278-I281 PolarHBondContact O-N 2.66Å; Y278-K282 PolarHBondContact O-N 2.7Å; Y278-H441 WeakPolarHBondContact CB-O 3.48Å; Y278-H441 PolarHBondContact N-O 2.88Å; Y278-G444 WeakPolarHBondContact CE1-O 3.33Å; Y278-G444 VanDerWaalsContact CE2-CA 3.5Å
279	N	90.1	Very high	77.3	Confident	34 Å²	34	63.3 Å²	63.3	18%	0.182	33%	0.333	C	S	.	.	H	α-helix	trans	-67.9	-44.6	-179.2	-72.4	-34.1	0	0	0	110.6	T275 S276 I277 I281 K282 D283 E449	T275-N279 HydrophobicContact CG2-CB 4.08Å; S276-N279 PolarHBondContact O-N 3.48Å; S276-N279 VanDerWaalsContact O-N 3.09Å; S276-N279 PolarHBondContact OG-N 2.7Å; S276-N279 PolarHBondContact OG-ND2 3.05Å; I277-N279 PolarHBondContact O-N 3.41Å; N279-I281 VanDerWaalsContact C-N 3.32Å; N279-I281 PolarHBondContact O-N 2.88Å; N279-K282 WeakPolarHBondContact O-CA 3.32Å; N279-K282 WeakPolarHBondContact O-CB 3.3Å; N279-K282 PolarHBondContact O-N 3.45Å; N279-D283 PolarHBondContact O-N 3.43Å; N279-E449 PolarHBondContact ND2-OE1 3.02Å
280	S	92.9	Very high	80.1	Confident	20 Å²	20	59.4 Å²	59.4	14%	0.14	32%	0.32	C	S	.	.	H	α-helix	trans	-67.6	-28.2	176.1	-65.1	0	0	0	0	113.8	S276 I277 F284 R313	S276-S280 PolarHBondContact O-N 3.29Å; S276-S280 VanDerWaalsContact O-N 3.13Å; I277-S280 PolarHBondContact O-N 2.92Å; S280-F284 WeakPolarHBondContact O-CB 3.49Å; S280-F284 PolarHBondContact O-N 3.26Å; S280-R313 PolarHBondContact OG-NH1 3.31Å
281	I	94.3	Very high	82.7	Confident	7 Å²	7	52.6 Å²	52.6	4%	0.036	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-45.3	167.4	-84	179.6	0	0	0	110.8	I277 Y278 N279 K285 L310 I375 R379	I277-I281 HydrophobicContact CG2-CD1 3.89Å; I277-I281 HydrophobicContact CG2-CG1 4.11Å; I277-I281 VanDerWaalsContact O-CB 3.29Å; I277-I281 WeakPolarHBondContact O-CB 3.38Å; I277-I281 WeakPolarHBondContact O-CG1 3.38Å; I277-I281 PolarHBondContact O-N 3.5Å; Y278-I281 PolarHBondContact O-N 2.66Å; N279-I281 VanDerWaalsContact C-N 3.32Å; N279-I281 PolarHBondContact O-N 2.88Å; I281-K285 WeakPolarHBondContact O-CB 3.44Å; I281-K285 WeakPolarHBondContact O-CG 3.29Å; I281-K285 PolarHBondContact O-N 2.67Å; I281-L310 HydrophobicContact CG1-CD1 4Å; I281-L310 HydrophobicContact CG1-CD2 3.82Å; I281-L310 HydrophobicContact CG1-CG 4.41Å; I281-I375 HydrophobicContact CB-CG2 4.29Å; I281-I375 HydrophobicContact CG1-CG2 4.04Å; I281-I375 HydrophobicContact CG2-CG2 3.84Å; I281-R379 HydrophobicContact CD1-CB 3.8Å; I281-R379 HydrophobicContact CD1-CG 4.07Å; I281-R379 HydrophobicContact CG2-CB 4.43Å; I281-R379 HydrophobicContact CG2-CG 4.45Å
282	K	91.3	Very high	84.9	Confident	114 Å²	114	48.8 Å²	48.8	50%	0.496	27%	0.265	S	S	.	.	H	α-helix	trans	-65	-49.2	178.8	178.4	-162.9	168.3	-147.8	0	110.9	Y278 N279 F284 K285 C286	Y278-K282 PolarHBondContact O-N 2.7Å; N279-K282 WeakPolarHBondContact O-CA 3.32Å; N279-K282 WeakPolarHBondContact O-CB 3.3Å; N279-K282 PolarHBondContact O-N 3.45Å; K282-F284 PolarHBondContact O-N 3.09Å; K282-K285 PolarHBondContact O-N 2.9Å; K282-C286 PolarHBondContact O-N 2.98Å; K282-C286 PolarHBondContact O-SG 3.31Å; K282-C286 VanDerWaalsContact O-SG 3.37Å
283	D	91.4	Very high	86.7	Confident	72 Å²	72	51.6 Å²	51.6	39%	0.385	27%	0.27	S	S	.	.	H	α-helix	trans	-67.2	-37.1	-176.9	-58.3	-26.5	0	0	0	111.6	N279 S287	N279-D283 PolarHBondContact O-N 3.43Å; D283-S287 WeakPolarHBondContact O-CB 3.37Å; D283-S287 PolarHBondContact O-N 2.77Å; D283-S287 PolarHBondContact O-OG 3.45Å
284	F	94.4	Very high	88.1	Confident	1 Å²	1	51.9 Å²	51.9	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-61.4	-48.7	170	179.1	-86.8	0	0	0	111.6	S280 K282 C286 S287 V288 V303 Q306 L307 T342 T371 I375	S280-F284 WeakPolarHBondContact O-CB 3.49Å; S280-F284 PolarHBondContact O-N 3.26Å; K282-F284 PolarHBondContact O-N 3.09Å; F284-C286 PolarHBondContact O-N 3.26Å; F284-S287 VanDerWaalsContact O-CB 3.32Å; F284-S287 WeakPolarHBondContact O-CB 3.4Å; F284-S287 PolarHBondContact O-N 2.72Å; F284-S287 VanDerWaalsContact O-N 3.13Å; F284-V288 HydrophobicContact CD1-CG2 4.2Å; F284-V288 HydrophobicContact CE1-CG2 3.73Å; F284-V288 HydrophobicContact CZ-CG2 3.92Å; F284-V288 WeakPolarHBondContact O-CG2 3.26Å; F284-V288 PolarHBondContact O-N 3.2Å; F284-V303 HydrophobicContact CE2-CG1 3.78Å; F284-V303 WeakPolarHBondContact CE2-O 3.35Å; F284-V303 HydrophobicContact CZ-CG1 4.01Å; F284-Q306 HydrophobicContact CD2-CB 3.85Å; F284-Q306 HydrophobicContact CE2-CB 4.43Å; F284-L307 HydrophobicContact CE2-CB 3.82Å; F284-L307 HydrophobicContact CE2-CD1 4.45Å; F284-L307 HydrophobicContact CZ-CB 4.32Å; F284-L307 HydrophobicContact CZ-CD1 4.36Å; F284-T342 HydrophobicContact CZ-CG2 4.15Å; F284-T371 HydrophobicContact CE1-CG2 3.73Å; F284-T371 HydrophobicContact CZ-CG2 4.01Å; F284-I375 HydrophobicContact CD1-CD1 4.32Å; F284-I375 HydrophobicContact CD1-CG1 3.91Å; F284-I375 HydrophobicContact CD1-CG2 4.36Å; F284-I375 HydrophobicContact CE1-CD1 4.13Å; F284-I375 HydrophobicContact CE1-CG1 3.66Å
285	K	93.5	Very high	89	Confident	56 Å²	56	47.1 Å²	47.1	24%	0.243	24%	0.24	C	C	.	.	H	α-helix	trans	-61.8	-43.6	178.5	-79	-165.1	59.5	156.1	0	112.3	I281 K282 S287 V288 E289 C372 I375	I281-K285 WeakPolarHBondContact O-CB 3.44Å; I281-K285 WeakPolarHBondContact O-CG 3.29Å; I281-K285 PolarHBondContact O-N 2.67Å; K282-K285 PolarHBondContact O-N 2.9Å; K285-S287 VanDerWaalsContact C-N 3.32Å; K285-S287 PolarHBondContact O-N 2.99Å; K285-V288 PolarHBondContact O-N 2.99Å; K285-E289 VanDerWaalsContact CE-OE1 3.26Å; K285-E289 WeakPolarHBondContact CE-OE1 3.37Å; K285-E289 IonicContact NZ-OE1 3.58Å; K285-E289 WeakPolarHBondContact O-CB 3.42Å; K285-E289 VanDerWaalsContact O-CG 3.28Å; K285-E289 WeakPolarHBondContact O-CG 3.31Å; K285-E289 PolarHBondContact O-N 3.15Å; K285-C372 HydrophobicContact CD-CB 4.48Å; K285-C372 WeakPolarHBondContact CE-O 3.24Å; K285-C372 PolarHBondContact NZ-O 3.34Å; K285-I375 HydrophobicContact CD-CG2 4.15Å; K285-I375 HydrophobicContact CG-CB 4.43Å; K285-I375 HydrophobicContact CG-CG2 3.89Å
286	C	91.4	Very high	89.4	Confident	59 Å²	59	50.7 Å²	50.7	40%	0.399	25%	0.253	S	S	.	.	H	α-helix	trans	-60.8	-40.9	173.1	-66.4	0	0	0	0	111.7	K282 F284 V288 E289 C290	K282-C286 PolarHBondContact O-N 2.98Å; K282-C286 PolarHBondContact O-SG 3.31Å; K282-C286 VanDerWaalsContact O-SG 3.37Å; F284-C286 PolarHBondContact O-N 3.26Å; C286-V288 VanDerWaalsContact C-N 3.31Å; C286-V288 PolarHBondContact O-N 3.49Å; C286-E289 PolarHBondContact O-N 3.14Å; C286-C290 WeakPolarHBondContact O-CB 3.39Å; C286-C290 PolarHBondContact O-N 3.34Å; C286-C290 PolarHBondContact O-SG 2.84Å
287	S	91.3	Very high	88.8	Confident	29 Å²	29	53.5 Å²	53.5	20%	0.203	27%	0.272	C	S	.	.	H	α-helix	trans	-59.2	-39.7	175.7	-57.9	0	0	0	0	112.8	D283 F284 K285 Q306	D283-S287 WeakPolarHBondContact O-CB 3.37Å; D283-S287 PolarHBondContact O-N 2.77Å; D283-S287 PolarHBondContact O-OG 3.45Å; F284-S287 VanDerWaalsContact O-CB 3.32Å; F284-S287 WeakPolarHBondContact O-CB 3.4Å; F284-S287 PolarHBondContact O-N 2.72Å; F284-S287 VanDerWaalsContact O-N 3.13Å; K285-S287 VanDerWaalsContact C-N 3.32Å; K285-S287 PolarHBondContact O-N 2.99Å; S287-Q306 PolarHBondContact OG-NE2 3.26Å; S287-Q306 VanDerWaalsContact OG-NE2 3.08Å
288	V	91.8	Very high	88.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-76.3	-37.4	178.2	171.2	0	0	0	0	111.7	F284 K285 C286 L291 V303 L345 I368 T371	F284-V288 HydrophobicContact CD1-CG2 4.2Å; F284-V288 HydrophobicContact CE1-CG2 3.73Å; F284-V288 HydrophobicContact CZ-CG2 3.92Å; F284-V288 WeakPolarHBondContact O-CG2 3.26Å; F284-V288 PolarHBondContact O-N 3.2Å; K285-V288 PolarHBondContact O-N 2.99Å; C286-V288 VanDerWaalsContact C-N 3.31Å; C286-V288 PolarHBondContact O-N 3.49Å; V288-L291 WeakPolarHBondContact O-CB 3.4Å; V288-L291 WeakPolarHBondContact O-CG 3.37Å; V288-L291 PolarHBondContact O-N 3.3Å; V288-V303 HydrophobicContact CG2-CG1 3.81Å; V288-L345 HydrophobicContact CB-CD2 4.39Å; V288-L345 HydrophobicContact CG1-CD2 3.67Å; V288-L345 HydrophobicContact CG2-CD2 3.84Å; V288-I368 HydrophobicContact CG1-CB 4.36Å; V288-I368 HydrophobicContact CG1-CG1 4.21Å; V288-I368 HydrophobicContact CG1-CG2 4.11Å; V288-T371 HydrophobicContact CG1-CG2 4.26Å; V288-T371 HydrophobicContact CG2-CG2 4.27Å
289	E	90.9	Very high	88.1	Confident	72 Å²	72	55.8 Å²	55.8	34%	0.336	29%	0.292	S	S	.	.	H	α-helix	trans	-72.3	-30.2	179.5	-72.4	163.7	-174.5	0	0	112.4	K285 C286 L291 R292 C372	K285-E289 VanDerWaalsContact CE-OE1 3.26Å; K285-E289 WeakPolarHBondContact CE-OE1 3.37Å; K285-E289 IonicContact NZ-OE1 3.58Å; K285-E289 WeakPolarHBondContact O-CB 3.42Å; K285-E289 VanDerWaalsContact O-CG 3.28Å; K285-E289 WeakPolarHBondContact O-CG 3.31Å; K285-E289 PolarHBondContact O-N 3.15Å; C286-E289 PolarHBondContact O-N 3.14Å; E289-L291 PolarHBondContact O-N 3.38Å; E289-R292 WeakPolarHBondContact O-CB 3.45Å; E289-R292 WeakPolarHBondContact O-CG 3.29Å; E289-R292 PolarHBondContact O-N 3.18Å; E289-C372 PolarHBondContact OE1-SG 2.92Å
290	C	89.4	Confident	88	Confident	57 Å²	57	54.6 Å²	54.6	39%	0.385	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-64.6	-16.5	172.6	-75.8	0	0	0	0	114.5	C286 R292 E293 N294	C286-C290 WeakPolarHBondContact O-CB 3.39Å; C286-C290 PolarHBondContact O-N 3.34Å; C286-C290 PolarHBondContact O-SG 2.84Å; C290-R292 PolarHBondContact O-N 3.05Å; C290-E293 PolarHBondContact O-N 3.47Å; C290-N294 PolarHBondContact O-N 2.93Å; C290-N294 VanDerWaalsContact O-N 3.09Å
291	L	86.5	Confident	88	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-63.5	-23.8	176.5	-59.6	-178.7	0	0	0	112.6	V288 E289 E293 L295 L345 W349 I368	V288-L291 WeakPolarHBondContact O-CB 3.4Å; V288-L291 WeakPolarHBondContact O-CG 3.37Å; V288-L291 PolarHBondContact O-N 3.3Å; E289-L291 PolarHBondContact O-N 3.38Å; L291-E293 VanDerWaalsContact C-N 3.34Å; L291-L295 WeakPolarHBondContact O-CD2 3.28Å; L291-L345 HydrophobicContact CD1-CD1 4.21Å; L291-L345 HydrophobicContact CD1-CD2 4.48Å; L291-W349 HydrophobicContact CD1-CD2 4Å; L291-W349 HydrophobicContact CD1-CE3 3.78Å; L291-W349 HydrophobicContact CD1-CH2 4.38Å; L291-W349 HydrophobicContact CD1-CZ3 3.96Å; L291-W349 HydrophobicContact CD2-CD2 4.19Å; L291-W349 HydrophobicContact CD2-CE3 4.3Å; L291-W349 HydrophobicContact CD2-CH2 3.54Å; L291-W349 HydrophobicContact CD2-CZ2 3.38Å; L291-W349 HydrophobicContact CD2-CZ3 3.99Å; L291-I368 HydrophobicContact CB-CD1 4.01Å
292	R	85.3	Confident	87.9	Confident	85 Å²	85	65 Å²	65	32%	0.321	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-61.7	-40.6	174	-61.8	-168.4	160.5	106.5	3.9	113.2	E289 C290 E365 I368	E289-R292 WeakPolarHBondContact O-CB 3.45Å; E289-R292 WeakPolarHBondContact O-CG 3.29Å; E289-R292 PolarHBondContact O-N 3.18Å; C290-R292 PolarHBondContact O-N 3.05Å; R292-E365 VanDerWaalsContact CD-OE1 3.24Å; R292-E365 WeakPolarHBondContact CD-OE1 3.36Å; R292-E365 VanDerWaalsContact CG-OE1 3.22Å; R292-E365 WeakPolarHBondContact CG-OE1 3.48Å; R292-E365 IonicContact CZ-OE1 3.77Å; R292-E365 IonicContact CZ-OE2 2.65Å; R292-E365 VanDerWaalsContact NE-CD 3.26Å; R292-E365 IonicContact NE-OE1 2.7Å; R292-E365 PolarHBondContact NE-OE1 2.79Å; R292-E365 IonicContact NE-OE2 2.69Å; R292-E365 PolarHBondContact NE-OE2 3.37Å; R292-E365 IonicContact NH2-OE2 2.8Å; R292-E365 PolarHBondContact NH2-OE2 2.95Å; R292-I368 HydrophobicContact CG-CD1 4.1Å
293	E	83.4	Confident	87.9	Confident	177 Å²	177	59.6 Å²	59.6	83%	0.827	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-30.6	-174.7	-60.8	-178	170.9	0	0	111.8	C290 L291	C290-E293 PolarHBondContact O-N 3.47Å; L291-E293 VanDerWaalsContact C-N 3.34Å
294	N	82.5	Confident	88.1	Confident	79 Å²	79	58 Å²	58	42%	0.422	31%	0.305	S	S	.	.			trans	-155.2	101.4	-177.5	-177.6	-2.6	0	0	0	112.5	C290 H296 S297	C290-N294 PolarHBondContact O-N 2.93Å; C290-N294 VanDerWaalsContact O-N 3.09Å; N294-H296 PolarHBondContact O-N 2.94Å; N294-H296 WeakPolarHBondContact OD1-CA 3.41Å; N294-H296 PolarHBondContact OD1-N 2.76Å; N294-S297 WeakPolarHBondContact O-CB 3.1Å; N294-S297 PolarHBondContact O-N 2.69Å; N294-S297 PolarHBondContact O-OG 3.03Å; N294-S297 PolarHBondContact OD1-N 3Å
295	L	79.9	Confident	88.1	Confident	12 Å²	12	59.7 Å²	59.7	6%	0.063	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-6.6	175.7	-63.3	173.7	0	0	0	114.9	L291 W349 Q353 A357 L364	L291-L295 WeakPolarHBondContact O-CD2 3.28Å; L295-W349 PolarHBondContact O-NE1 3.25Å; L295-Q353 PolarHBondContact O-NE2 2.85Å; L295-A357 HydrophobicContact CD1-CB 4.39Å; L295-L364 HydrophobicContact CD2-CD2 3.4Å
296	H	80.3	Confident	88.1	Confident	141 Å²	141	59.3 Å²	59.3	65%	0.653	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	9.9	177.2	-55	-54.2	0	0	0	113.1	N294 S298	N294-H296 PolarHBondContact O-N 2.94Å; N294-H296 WeakPolarHBondContact OD1-CA 3.41Å; N294-H296 PolarHBondContact OD1-N 2.76Å; H296-S298 PolarHBondContact O-N 3.06Å
297	S	77.6	Confident	88.4	Confident	61 Å²	61	56.6 Å²	56.6	43%	0.427	30%	0.302	S	S	.	.	S	Bend	trans	-67.1	-20.5	176.2	56.2	0	0	0	0	113.9	N294	N294-S297 WeakPolarHBondContact O-CB 3.1Å; N294-S297 PolarHBondContact O-N 2.69Å; N294-S297 PolarHBondContact O-OG 3.03Å; N294-S297 PolarHBondContact OD1-N 3Å
298	S	83.6	Confident	88.6	Confident	27 Å²	27	58.3 Å²	58.3	19%	0.189	31%	0.307	C	S	.	.	S	Bend	trans	-153.2	-175.1	-175.9	-166.3	0	0	0	0	110.6	H296 F302 W349	H296-S298 PolarHBondContact O-N 3.06Å; S298-F302 VanDerWaalsContact OG-CD1 3.25Å; S298-F302 WeakPolarHBondContact OG-CD1 3.48Å; S298-W349 WeakPolarHBondContact O-CZ2 3.42Å
299	T	87.9	Confident	88.8	Confident	69 Å²	69	61 Å²	61	42%	0.423	32%	0.324	S	S	.	.			trans	-121.3	149.7	174.3	66.8	0	0	0	0	112.1	Q301 F302 V303 W349	T299-Q301 PolarHBondContact O-N 3.19Å; T299-F302 WeakPolarHBondContact O-CB 3.44Å; T299-F302 PolarHBondContact O-N 3.45Å; T299-F302 WeakPolarHBondContact OG1-CB 3.43Å; T299-F302 PolarHBondContact OG1-N 3.38Å; T299-V303 PolarHBondContact O-N 3.07Å; T299-W349 WeakPolarHBondContact O-CH2 3.36Å
300	P	89.4	Confident	89	Confident	9 Å²	9	57.7 Å²	57.7	6%	0.058	31%	0.308	C	S	.	.	H	α-helix	trans	-56.7	-36.9	177.9	-24.8	33	0	0	0	113.2	V303 A304 V346 W349 I350	P300-V303 PolarHBondContact O-N 3.1Å; P300-A304 WeakPolarHBondContact O-CB 3.5Å; P300-A304 PolarHBondContact O-N 3.03Å; P300-V346 HydrophobicContact CB-CB 4.41Å; P300-V346 HydrophobicContact CB-CG1 3.93Å; P300-V346 HydrophobicContact CB-CG2 4.06Å; P300-W349 VanDerWaalsContact CA-CZ3 3.4Å; P300-W349 HydrophobicContact CB-CE3 4.02Å; P300-W349 HydrophobicContact CB-CZ3 4.16Å; P300-W349 HydrophobicContact CG-CD2 3.96Å; P300-W349 HydrophobicContact CG-CE3 3.81Å; P300-W349 HydrophobicContact CG-CH2 4.39Å; P300-W349 HydrophobicContact CG-CZ3 4.05Å; P300-I350 HydrophobicContact CB-CD1 4.39Å; P300-I350 HydrophobicContact CB-CG1 4.37Å; P300-I350 HydrophobicContact CG-CD1 4.4Å; P300-I350 HydrophobicContact CG-CG1 3.91Å
301	Q	91.5	Very high	89.3	Confident	137 Å²	137	55.3 Å²	55.3	64%	0.64	29%	0.292	S	S	*	.	H	α-helix	trans	-68.4	-33.6	177.3	-61.5	78.2	9.4	0	0	112.4	T299 G305	T299-Q301 PolarHBondContact O-N 3.19Å; Q301-G305 PolarHBondContact O-N 3.46Å
302	F	91.9	Very high	89.7	Confident	109 Å²	109	60.3 Å²	60.3	48%	0.478	32%	0.315	S	S	.	.	H	α-helix	trans	-69.5	-42.9	176.4	178.9	-97.5	0	0	0	111.6	S298 T299 G305 Q306	S298-F302 VanDerWaalsContact OG-CD1 3.25Å; S298-F302 WeakPolarHBondContact OG-CD1 3.48Å; T299-F302 WeakPolarHBondContact O-CB 3.44Å; T299-F302 PolarHBondContact O-N 3.45Å; T299-F302 WeakPolarHBondContact OG1-CB 3.43Å; T299-F302 PolarHBondContact OG1-N 3.38Å; F302-G305 PolarHBondContact O-N 2.93Å; F302-Q306 HydrophobicContact CD1-CG 4.29Å; F302-Q306 HydrophobicContact CE1-CG 3.93Å; F302-Q306 HydrophobicContact CZ-CG 4.04Å; F302-Q306 WeakPolarHBondContact O-CG 3.14Å; F302-Q306 PolarHBondContact O-N 3.38Å
303	V	92.3	Very high	90.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.8	-45.1	175.1	176.6	0	0	0	0	110.8	F284 V288 T299 P300 G305 Q306 L307 T342 L345 W349	F284-V303 HydrophobicContact CE2-CG1 3.78Å; F284-V303 WeakPolarHBondContact CE2-O 3.35Å; F284-V303 HydrophobicContact CZ-CG1 4.01Å; V288-V303 HydrophobicContact CG2-CG1 3.81Å; T299-V303 PolarHBondContact O-N 3.07Å; P300-V303 PolarHBondContact O-N 3.1Å; V303-G305 VanDerWaalsContact C-N 3.35Å; V303-G305 PolarHBondContact O-N 2.97Å; V303-Q306 PolarHBondContact O-N 2.9Å; V303-L307 PolarHBondContact O-N 3.43Å; V303-L307 VanDerWaalsContact O-N 3.09Å; V303-T342 HydrophobicContact CG1-CG2 4.19Å; V303-L345 HydrophobicContact CG1-CD2 4.4Å; V303-W349 HydrophobicContact CB-CZ3 4.26Å; V303-W349 HydrophobicContact CG2-CH2 4.17Å; V303-W349 HydrophobicContact CG2-CZ3 3.73Å
304	A	94.4	Very high	90.7	Very high	39 Å²	39	51.3 Å²	51.3	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-59.6	-42.9	174.3	0	0	0	0	0	112.5	P300 L307 E308	P300-A304 WeakPolarHBondContact O-CB 3.5Å; P300-A304 PolarHBondContact O-N 3.03Å; A304-L307 WeakPolarHBondContact O-CB 3.36Å; A304-L307 PolarHBondContact O-N 3.18Å; A304-E308 PolarHBondContact O-N 3.33Å; A304-E308 VanDerWaalsContact O-N 3.09Å
305	G	94.9	Very high	91.3	Very high	35 Å²	35	52.6 Å²	52.6	36%	0.361	28%	0.277	S	S	.	.	H	α-helix	trans	-63.2	-41.2	175.9	0	0	0	0	0	113.3	Q301 F302 V303 L307 E308 T309	Q301-G305 PolarHBondContact O-N 3.46Å; F302-G305 PolarHBondContact O-N 2.93Å; V303-G305 VanDerWaalsContact C-N 3.35Å; V303-G305 PolarHBondContact O-N 2.97Å; G305-L307 VanDerWaalsContact C-N 3.27Å; G305-L307 PolarHBondContact O-N 3.23Å; G305-E308 PolarHBondContact O-N 2.87Å; G305-T309 PolarHBondContact O-N 2.65Å; G305-T309 PolarHBondContact O-OG1 3.22Å; G305-T309 VanDerWaalsContact O-OG1 3.09Å
306	Q	94.4	Very high	92	Very high	48 Å²	48	55.3 Å²	55.3	22%	0.224	29%	0.292	C	S	.	.	H	α-helix	trans	-60.6	-36.6	173.1	-74.5	-165.9	101	0	0	112.1	F284 S287 F302 V303 L310	F284-Q306 HydrophobicContact CD2-CB 3.85Å; F284-Q306 HydrophobicContact CE2-CB 4.43Å; S287-Q306 PolarHBondContact OG-NE2 3.26Å; S287-Q306 VanDerWaalsContact OG-NE2 3.08Å; F302-Q306 HydrophobicContact CD1-CG 4.29Å; F302-Q306 HydrophobicContact CE1-CG 3.93Å; F302-Q306 HydrophobicContact CZ-CG 4.04Å; F302-Q306 WeakPolarHBondContact O-CG 3.14Å; F302-Q306 PolarHBondContact O-N 3.38Å; V303-Q306 PolarHBondContact O-N 2.9Å; Q306-L310 WeakPolarHBondContact O-CB 3.34Å; Q306-L310 PolarHBondContact O-N 3.17Å
307	L	96.6	Very high	92.8	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-65.8	-48.7	175.4	-179.5	71.3	0	0	0	111.7	F284 V303 A304 G305 T309 L310 V311 A338 R339 T342 I375	F284-L307 HydrophobicContact CE2-CB 3.82Å; F284-L307 HydrophobicContact CE2-CD1 4.45Å; F284-L307 HydrophobicContact CZ-CB 4.32Å; F284-L307 HydrophobicContact CZ-CD1 4.36Å; V303-L307 PolarHBondContact O-N 3.43Å; V303-L307 VanDerWaalsContact O-N 3.09Å; A304-L307 WeakPolarHBondContact O-CB 3.36Å; A304-L307 PolarHBondContact O-N 3.18Å; G305-L307 VanDerWaalsContact C-N 3.27Å; G305-L307 PolarHBondContact O-N 3.23Å; L307-T309 VanDerWaalsContact C-N 3.33Å; L307-T309 PolarHBondContact O-N 3.05Å; L307-L310 CarbonylContact O-C 3.49Å; L307-L310 WeakPolarHBondContact O-CA 3.42Å; L307-L310 VanDerWaalsContact O-CB 3.24Å; L307-L310 WeakPolarHBondContact O-CB 3.16Å; L307-L310 PolarHBondContact O-N 3.41Å; L307-V311 HydrophobicContact CD1-CG2 4.32Å; L307-V311 HydrophobicContact CG-CG2 4.34Å; L307-V311 WeakPolarHBondContact O-CG2 3.36Å; L307-V311 PolarHBondContact O-N 3.35Å; L307-A338 HydrophobicContact CD1-CB 4.16Å; L307-R339 HydrophobicContact CD2-CB 4.22Å; L307-R339 HydrophobicContact CD2-CG 3.74Å; L307-T342 HydrophobicContact CB-CG2 4.5Å; L307-T342 HydrophobicContact CD2-CG2 4.13Å; L307-I375 HydrophobicContact CD1-CD1 3.64Å
308	E	96.6	Very high	93.7	Very high	65 Å²	65	46.1 Å²	46.1	30%	0.304	24%	0.243	S	C	.	.	H	α-helix	trans	-63.1	-42.3	-178	-63.6	-57.2	151.3	0	0	110.6	A304 G305 L310 V311 E312 R339	A304-E308 PolarHBondContact O-N 3.33Å; A304-E308 VanDerWaalsContact O-N 3.09Å; G305-E308 PolarHBondContact O-N 2.87Å; E308-L310 PolarHBondContact O-N 3.33Å; E308-V311 PolarHBondContact O-N 3.4Å; E308-V311 VanDerWaalsContact O-N 3.08Å; E308-E312 VanDerWaalsContact O-CG 3.31Å; E308-E312 WeakPolarHBondContact O-CG 3.35Å; E308-E312 PolarHBondContact O-N 3.09Å; E308-R339 VanDerWaalsContact CD-NE 3.31Å; E308-R339 WeakPolarHBondContact OE1-CD 3.33Å; E308-R339 WeakPolarHBondContact OE1-CG 3.48Å; E308-R339 IonicContact OE1-CZ 3.22Å; E308-R339 IonicContact OE1-NE 2.97Å; E308-R339 PolarHBondContact OE1-NE 3.12Å; E308-R339 IonicContact OE2-CZ 3.99Å; E308-R339 IonicContact OE2-NE 3.2Å; E308-R339 PolarHBondContact OE2-NE 3Å; E308-R339 IonicContact OE2-NH2 2.94Å; E308-R339 PolarHBondContact OE2-NH2 3.09Å
309	T	94.8	Very high	94.2	Very high	57 Å²	57	50.6 Å²	50.6	35%	0.35	27%	0.265	S	S	.	.	H	α-helix	trans	-59.6	-28.9	170.3	-56.5	0	0	0	0	113.5	G305 L307 R313	G305-T309 PolarHBondContact O-N 2.65Å; G305-T309 PolarHBondContact O-OG1 3.22Å; G305-T309 VanDerWaalsContact O-OG1 3.09Å; L307-T309 VanDerWaalsContact C-N 3.33Å; L307-T309 PolarHBondContact O-N 3.05Å; T309-R313 WeakPolarHBondContact O-CG 3.29Å
310	L	95.3	Very high	94.4	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-73.5	-41.4	174.3	-168.3	79	0	0	0	111.7	I277 I281 Q306 L307 E308 R313 T314 I375 L378	I277-L310 HydrophobicContact CG2-CD1 4.07Å; I281-L310 HydrophobicContact CG1-CD1 4Å; I281-L310 HydrophobicContact CG1-CD2 3.82Å; I281-L310 HydrophobicContact CG1-CG 4.41Å; Q306-L310 WeakPolarHBondContact O-CB 3.34Å; Q306-L310 PolarHBondContact O-N 3.17Å; L307-L310 CarbonylContact O-C 3.49Å; L307-L310 WeakPolarHBondContact O-CA 3.42Å; L307-L310 VanDerWaalsContact O-CB 3.24Å; L307-L310 WeakPolarHBondContact O-CB 3.16Å; L307-L310 PolarHBondContact O-N 3.41Å; E308-L310 PolarHBondContact O-N 3.33Å; L310-R313 PolarHBondContact O-N 3.24Å; L310-T314 PolarHBondContact O-N 2.88Å; L310-I375 HydrophobicContact CD2-CD1 3.91Å; L310-L378 HydrophobicContact CD2-CD2 4.07Å
311	V	96.2	Very high	94.5	Very high	7 Å²	7	51.9 Å²	51.9	4%	0.042	28%	0.275	C	S	.	.	H	α-helix	trans	-74.2	-36.8	-179.5	-179.4	0	0	0	0	111.5	L307 E308 R313 T314 C335	L307-V311 HydrophobicContact CD1-CG2 4.32Å; L307-V311 HydrophobicContact CG-CG2 4.34Å; L307-V311 WeakPolarHBondContact O-CG2 3.36Å; L307-V311 PolarHBondContact O-N 3.35Å; E308-V311 PolarHBondContact O-N 3.4Å; E308-V311 VanDerWaalsContact O-N 3.08Å; V311-R313 PolarHBondContact O-N 3.41Å; V311-T314 WeakPolarHBondContact O-CA 3.44Å; V311-T314 WeakPolarHBondContact O-CB 3.45Å; V311-T314 PolarHBondContact O-N 3.28Å; V311-T314 PolarHBondContact O-OG1 3.28Å; V311-C335 HydrophobicContact CG1-CB 3.8Å; V311-C335 HydrophobicContact CG2-CB 4.16Å
312	E	95.2	Very high	94.5	Very high	105 Å²	105	49.6 Å²	49.6	49%	0.491	26%	0.261	S	S	.	.	H	α-helix	trans	-51.8	-43.9	168.3	-74	167.1	-179.3	0	0	110.6	E308 T314 E315	E308-E312 VanDerWaalsContact O-CG 3.31Å; E308-E312 WeakPolarHBondContact O-CG 3.35Å; E308-E312 PolarHBondContact O-N 3.09Å; E312-T314 PolarHBondContact O-N 3.24Å; E312-E315 WeakPolarHBondContact O-CB 3.43Å; E312-E315 WeakPolarHBondContact O-CG 3.4Å; E312-E315 PolarHBondContact O-N 2.96Å
313	R	93.1	Very high	94.5	Very high	70 Å²	70	44.6 Å²	44.6	26%	0.264	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-8.2	175.2	-65.1	-173.2	-152.3	153	16.7	114.9	T275 I277 S280 T309 L310 V311	T275-R313 PolarHBondContact O-NH1 2.98Å; I277-R313 HydrophobicContact CD1-CB 4.36Å; I277-R313 WeakPolarHBondContact CD1-O 3.47Å; I277-R313 HydrophobicContact CG1-CB 3.94Å; S280-R313 PolarHBondContact OG-NH1 3.31Å; T309-R313 WeakPolarHBondContact O-CG 3.29Å; L310-R313 PolarHBondContact O-N 3.24Å; V311-R313 PolarHBondContact O-N 3.41Å
314	T	96.3	Very high	94.6	Very high	2 Å²	2	47 Å²	47	1%	0.012	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-8.6	168.1	69.9	0	0	0	0	112.5	L310 V311 E312 D316 F317 T318 L378 L382	L310-T314 PolarHBondContact O-N 2.88Å; V311-T314 WeakPolarHBondContact O-CA 3.44Å; V311-T314 WeakPolarHBondContact O-CB 3.45Å; V311-T314 PolarHBondContact O-N 3.28Å; V311-T314 PolarHBondContact O-OG1 3.28Å; E312-T314 PolarHBondContact O-N 3.24Å; T314-D316 PolarHBondContact O-N 3.03Å; T314-F317 WeakPolarHBondContact O-CA 3.32Å; T314-F317 WeakPolarHBondContact O-CB 3.47Å; T314-F317 PolarHBondContact O-N 3.48Å; T314-T318 PolarHBondContact O-N 3.09Å; T314-L378 HydrophobicContact CG2-CD1 4.31Å; T314-L378 HydrophobicContact CG2-CD2 4.43Å; T314-L382 HydrophobicContact CG2-CD1 4.04Å; T314-L382 HydrophobicContact CG2-CD2 4.22Å
315	E	95.1	Very high	94.7	Very high	106 Å²	106	51.1 Å²	51.1	50%	0.495	27%	0.268	S	S	.	.	H	α-helix	trans	-63.7	-30.4	172.7	-63.6	170	-174.1	0	0	111.8	E312 F317 T318 D319	E312-E315 WeakPolarHBondContact O-CB 3.43Å; E312-E315 WeakPolarHBondContact O-CG 3.4Å; E312-E315 PolarHBondContact O-N 2.96Å; E315-F317 PolarHBondContact O-N 3.3Å; E315-T318 WeakPolarHBondContact CA-OG1 3.44Å; E315-T318 PolarHBondContact O-N 2.91Å; E315-D319 WeakPolarHBondContact O-CB 3.31Å; E315-D319 PolarHBondContact O-N 3.45Å
316	D	94.1	Very high	94.7	Very high	69 Å²	69	57 Å²	57	37%	0.369	29%	0.286	S	S	.	.	H	α-helix	trans	-50.5	-33.4	167.8	-76.4	-54	0	0	0	112	T314 L438 H441	T314-D316 PolarHBondContact O-N 3.03Å; D316-L438 HydrophobicContact CB-CD2 4.48Å; D316-L438 WeakPolarHBondContact O-CD2 3.42Å; D316-H441 IonicContact OD2-CE1 3.52Å; D316-H441 PolarHBondContact OD2-CE1 3.39Å; D316-H441 IonicContact OD2-ND1 2.71Å; D316-H441 IonicContact OD2-NE2 2.71Å
317	F	97.1	Very high	94.8	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-91	-40.4	177.2	-72.7	-112.4	0	0	0	113.1	I277 T314 E315 T323 I331 L382 V385 A386 L438 H441 V442	I277-F317 HydrophobicContact CD1-CD2 4.06Å; I277-F317 HydrophobicContact CD1-CE2 3.7Å; T314-F317 WeakPolarHBondContact O-CA 3.32Å; T314-F317 WeakPolarHBondContact O-CB 3.47Å; T314-F317 PolarHBondContact O-N 3.48Å; E315-F317 PolarHBondContact O-N 3.3Å; F317-T323 WeakPolarHBondContact O-CB 3.34Å; F317-T323 WeakPolarHBondContact O-CG2 3.44Å; F317-T323 PolarHBondContact O-OG1 3.38Å; F317-I331 HydrophobicContact CB-CD1 3.79Å; F317-I331 HydrophobicContact CD1-CD1 4.23Å; F317-I331 HydrophobicContact CG-CD1 4.39Å; F317-L382 HydrophobicContact CB-CD2 4.16Å; F317-L382 HydrophobicContact CD1-CD2 3.73Å; F317-L382 HydrophobicContact CD2-CD2 3.87Å; F317-L382 HydrophobicContact CE1-CB 4.15Å; F317-L382 HydrophobicContact CE1-CD2 4.04Å; F317-L382 WeakPolarHBondContact CE1-O 3.34Å; F317-L382 HydrophobicContact CE2-CD2 4.19Å; F317-L382 HydrophobicContact CG-CD2 3.65Å; F317-L382 HydrophobicContact CZ-CB 4.28Å; F317-L382 HydrophobicContact CZ-CD2 4.27Å; F317-V385 HydrophobicContact CD1-CB 4.44Å; F317-V385 HydrophobicContact CD1-CG1 4.16Å; F317-A386 HydrophobicContact CE1-CB 3.92Å; F317-A386 HydrophobicContact CZ-CB 4.31Å; F317-L438 HydrophobicContact CD1-CD1 4.29Å; F317-L438 HydrophobicContact CD1-CD2 4.09Å; F317-L438 HydrophobicContact CD2-CD2 3.7Å; F317-L438 HydrophobicContact CE1-CB 4.24Å; F317-L438 HydrophobicContact CE1-CD1 4.41Å; F317-L438 HydrophobicContact CE1-CD2 4.17Å; F317-L438 HydrophobicContact CE2-CD2 3.76Å; F317-L438 HydrophobicContact CG-CD2 3.85Å; F317-L438 HydrophobicContact CZ-CB 4.11Å; F317-L438 HydrophobicContact CZ-CD2 3.99Å; F317-H441 HydrophobicContact CE2-CB 3.98Å; F317-H441 HydrophobicContact CZ-CB 4.32Å; F317-V442 HydrophobicContact CZ-CG1 4.07Å
318	T	96.4	Very high	94.8	Very high	9 Å²	9	60.1 Å²	60.1	6%	0.055	30%	0.298	C	S	.	.	H	α-helix	trans	-77	-33.7	-176.3	60	0	0	0	0	112.9	T314 E315 R328 I331 L332	T314-T318 PolarHBondContact O-N 3.09Å; E315-T318 WeakPolarHBondContact CA-OG1 3.44Å; E315-T318 PolarHBondContact O-N 2.91Å; T318-R328 HydrophobicContact CG2-CG 4.23Å; T318-R328 PolarHBondContact O-NE 3.38Å; T318-R328 PolarHBondContact O-NH2 3.42Å; T318-I331 HydrophobicContact CG2-CG2 4.11Å; T318-L332 HydrophobicContact CG2-CD2 4.1Å; T318-L332 HydrophobicContact CG2-CG 4.12Å
319	D	94.5	Very high	94.9	Very high	121 Å²	121	61.8 Å²	61.8	65%	0.647	31%	0.306	S	S	*	.	S	Bend	trans	-93.8	-7.9	-171.4	-70	32	0	0	0	111.6	E315	E315-D319 WeakPolarHBondContact O-CB 3.31Å; E315-D319 PolarHBondContact O-N 3.45Å
320	S	93	Very high	95	Very high	6 Å²	6	60.8 Å²	60.8	4%	0.042	30%	0.303	C	S	.	.			trans	-48.2	126	161.9	172.1	0	0	0	0	111.7	Y322 T323 R328 R389 E434	S320-Y322 PolarHBondContact O-N 3.18Å; S320-Y322 PolarHBondContact OG-N 2.86Å; S320-Y322 VanDerWaalsContact OG-N 3.16Å; S320-T323 WeakPolarHBondContact CB-OG1 3.47Å; S320-T323 PolarHBondContact O-N 3.35Å; S320-T323 PolarHBondContact OG-N 2.98Å; S320-R328 PolarHBondContact O-NH2 3.5Å; S320-R389 PolarHBondContact OG-NH1 3.24Å; S320-E434 VanDerWaalsContact CB-OE1 3.31Å; S320-E434 WeakPolarHBondContact CB-OE1 3.41Å; S320-E434 PolarHBondContact OG-OE1 3.01Å
321	P	91.3	Very high	95.1	Very high	99 Å²	99	60.7 Å²	60.7	64%	0.643	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.2	175.3	30.4	-35.1	0	0	0	112.8
322	Y	91.2	Very high	95.2	Very high	89 Å²	89	63.9 Å²	63.9	35%	0.349	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-7.1	-177.7	-48.3	-68.1	0	0	0	113.6	S320 Q431 E434	S320-Y322 PolarHBondContact O-N 3.18Å; S320-Y322 PolarHBondContact OG-N 2.86Å; S320-Y322 VanDerWaalsContact OG-N 3.16Å; Y322-Q431 HydrophobicContact CD1-CG 3.77Å; Y322-Q431 HydrophobicContact CD2-CG 4.16Å; Y322-Q431 HydrophobicContact CE1-CG 3.41Å; Y322-Q431 VanDerWaalsContact CE1-CG 3.41Å; Y322-Q431 HydrophobicContact CE2-CG 3.81Å; Y322-Q431 HydrophobicContact CG-CG 4.13Å; Y322-Q431 VanDerWaalsContact CZ-CG 3.42Å; Y322-E434 WeakPolarHBondContact CD2-OE1 3.35Å; Y322-E434 WeakPolarHBondContact CD2-OE2 3.31Å
323	T	92.5	Very high	95.4	Very high	5 Å²	5	60.6 Å²	60.6	3%	0.031	31%	0.313	C	S	.	.	S	Bend	trans	-76	127.8	170	-64.8	0	0	0	0	110.1	F317 S320 Q327 R328 V385	F317-T323 WeakPolarHBondContact O-CB 3.34Å; F317-T323 WeakPolarHBondContact O-CG2 3.44Å; F317-T323 PolarHBondContact O-OG1 3.38Å; S320-T323 WeakPolarHBondContact CB-OG1 3.47Å; S320-T323 PolarHBondContact O-N 3.35Å; S320-T323 PolarHBondContact OG-N 2.98Å; T323-Q327 HydrophobicContact CG2-CB 3.72Å; T323-R328 HydrophobicContact CG2-CB 4.23Å; T323-R328 PolarHBondContact O-NH1 3.18Å; T323-R328 PolarHBondContact O-NH2 3.26Å; T323-R328 VanDerWaalsContact O-NH2 3.15Å; T323-V385 HydrophobicContact CG2-CG1 4.47Å
324	S	93.7	Very high	95.6	Very high	49 Å²	49	58.6 Å²	58.6	34%	0.343	31%	0.309	S	S	.	.			trans	-67.8	160.6	-177.7	93.7	0	0	0	0	112.4	E326 Q327 R328	S324-E326 VanDerWaalsContact C-N 3.29Å; S324-E326 PolarHBondContact O-N 3.5Å; S324-E326 PolarHBondContact OG-N 2.69Å; S324-Q327 PolarHBondContact O-N 2.99Å; S324-Q327 WeakPolarHBondContact OG-CG 3.5Å; S324-Q327 PolarHBondContact OG-N 2.7Å; S324-Q327 VanDerWaalsContact OG-N 3.14Å; S324-R328 VanDerWaalsContact O-CB 3.3Å; S324-R328 WeakPolarHBondContact O-CB 3.46Å; S324-R328 PolarHBondContact O-N 3.38Å; S324-R328 PolarHBondContact O-NH1 3.23Å
325	H	95.6	Very high	95.7	Very high	126 Å²	126	58.5 Å²	58.5	58%	0.583	31%	0.309	S	S	*	.	H	α-helix	trans	-59.2	-41.3	175.4	-178.9	-99.8	0	0	0	111.8	R328 Q329	H325-R328 PolarHBondContact O-N 3.34Å; H325-Q329 VanDerWaalsContact CE1-CG 3.48Å; H325-Q329 WeakPolarHBondContact CE1-CG 3.41Å; H325-Q329 PolarHBondContact NE2-NE2 2.97Å; H325-Q329 WeakPolarHBondContact O-CB 3.32Å; H325-Q329 VanDerWaalsContact O-CG 3.25Å; H325-Q329 WeakPolarHBondContact O-CG 3.43Å; H325-Q329 PolarHBondContact O-N 2.94Å
326	E	95.7	Very high	95.8	Very high	159 Å²	159	59.1 Å²	59.1	74%	0.743	31%	0.311	S	S	*	.	H	α-helix	trans	-64.7	-44	178.7	-61.5	176.3	172.3	0	0	112.1	S324 Q329 A330	S324-E326 VanDerWaalsContact C-N 3.29Å; S324-E326 PolarHBondContact O-N 3.5Å; S324-E326 PolarHBondContact OG-N 2.69Å; E326-Q329 PolarHBondContact O-N 2.98Å; E326-A330 WeakPolarHBondContact O-CB 3.09Å; E326-A330 PolarHBondContact O-N 2.8Å
327	Q	96.3	Very high	96	Very high	55 Å²	55	59 Å²	59	26%	0.257	31%	0.311	S	S	.	.	H	α-helix	trans	-63.3	-43.5	176.6	-69.5	169.9	-26.9	0	0	111.5	T323 S324 A330 I331 V385	T323-Q327 HydrophobicContact CG2-CB 3.72Å; S324-Q327 PolarHBondContact O-N 2.99Å; S324-Q327 WeakPolarHBondContact OG-CG 3.5Å; S324-Q327 PolarHBondContact OG-N 2.7Å; S324-Q327 VanDerWaalsContact OG-N 3.14Å; Q327-A330 PolarHBondContact O-N 3.08Å; Q327-I331 WeakPolarHBondContact O-CG1 3.37Å; Q327-I331 PolarHBondContact O-N 3.4Å; Q327-V385 HydrophobicContact CB-CG1 4.41Å; Q327-V385 HydrophobicContact CB-CG2 3.91Å; Q327-V385 HydrophobicContact CG-CG2 3.97Å
328	R	97.3	Very high	96	Very high	61 Å²	61	59 Å²	59	23%	0.23	31%	0.311	C	S	.	.	H	α-helix	trans	-61.6	-46.4	176.4	-179.6	-178.2	-70.4	91.2	1.1	111.8	T318 S320 T323 S324 H325 A330 I331 L332	T318-R328 HydrophobicContact CG2-CG 4.23Å; T318-R328 PolarHBondContact O-NE 3.38Å; T318-R328 PolarHBondContact O-NH2 3.42Å; S320-R328 PolarHBondContact O-NH2 3.5Å; T323-R328 HydrophobicContact CG2-CB 4.23Å; T323-R328 PolarHBondContact O-NH1 3.18Å; T323-R328 PolarHBondContact O-NH2 3.26Å; T323-R328 VanDerWaalsContact O-NH2 3.15Å; S324-R328 VanDerWaalsContact O-CB 3.3Å; S324-R328 WeakPolarHBondContact O-CB 3.46Å; S324-R328 PolarHBondContact O-N 3.38Å; S324-R328 PolarHBondContact O-NH1 3.23Å; H325-R328 PolarHBondContact O-N 3.34Å; R328-A330 VanDerWaalsContact C-N 3.34Å; R328-A330 PolarHBondContact O-N 3.13Å; R328-I331 PolarHBondContact O-N 3.42Å; R328-L332 HydrophobicContact CG-CD1 3.99Å; R328-L332 WeakPolarHBondContact O-CB 3.38Å; R328-L332 VanDerWaalsContact O-CG 3.26Å; R328-L332 WeakPolarHBondContact O-CG 3.33Å; R328-L332 PolarHBondContact O-N 3.44Å
329	Q	97.4	Very high	96.1	Very high	101 Å²	101	62.4 Å²	62.4	47%	0.472	32%	0.322	S	S	.	.	H	α-helix	trans	-63.6	-38.6	175.7	-68.8	-67.8	-13	0	0	112.1	H325 E326 G333	H325-Q329 VanDerWaalsContact CE1-CG 3.48Å; H325-Q329 WeakPolarHBondContact CE1-CG 3.41Å; H325-Q329 PolarHBondContact NE2-NE2 2.97Å; H325-Q329 WeakPolarHBondContact O-CB 3.32Å; H325-Q329 VanDerWaalsContact O-CG 3.25Å; H325-Q329 WeakPolarHBondContact O-CG 3.43Å; H325-Q329 PolarHBondContact O-N 2.94Å; E326-Q329 PolarHBondContact O-N 2.98Å; Q329-G333 PolarHBondContact O-N 3.01Å
330	A	97.9	Very high	96.3	Very high	35 Å²	35	60.9 Å²	60.9	29%	0.289	31%	0.311	S	S	.	.	H	α-helix	trans	-63.1	-47.6	176.3	0	0	0	0	0	112.2	E326 Q327 R328 G333 V334 E381	E326-A330 WeakPolarHBondContact O-CB 3.09Å; E326-A330 PolarHBondContact O-N 2.8Å; Q327-A330 PolarHBondContact O-N 3.08Å; R328-A330 VanDerWaalsContact C-N 3.34Å; R328-A330 PolarHBondContact O-N 3.13Å; A330-G333 PolarHBondContact O-N 3.36Å; A330-V334 WeakPolarHBondContact O-CG2 3.28Å; A330-V334 PolarHBondContact O-N 3.13Å; A330-V334 VanDerWaalsContact O-N 3.14Å; A330-E381 HydrophobicContact CB-CG 4.06Å
331	I	98.3	Very high	96.5	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59.6	-52.2	175.7	-67.1	167.3	0	0	0	110.4	F317 T318 Q327 R328 G333 V334 C335 E381 L382 V385	F317-I331 HydrophobicContact CB-CD1 3.79Å; F317-I331 HydrophobicContact CD1-CD1 4.23Å; F317-I331 HydrophobicContact CG-CD1 4.39Å; T318-I331 HydrophobicContact CG2-CG2 4.11Å; Q327-I331 WeakPolarHBondContact O-CG1 3.37Å; Q327-I331 PolarHBondContact O-N 3.4Å; R328-I331 PolarHBondContact O-N 3.42Å; I331-G333 VanDerWaalsContact C-N 3.33Å; I331-G333 PolarHBondContact O-N 3.47Å; I331-V334 PolarHBondContact O-N 3.1Å; I331-V334 VanDerWaalsContact O-N 3.15Å; I331-C335 PolarHBondContact O-N 3.26Å; I331-C335 PolarHBondContact O-SG 2.92Å; I331-E381 HydrophobicContact CG1-CG 4.1Å; I331-L382 HydrophobicContact CD1-CD2 3.99Å; I331-L382 HydrophobicContact CG1-CD2 4.18Å; I331-L382 HydrophobicContact CG2-CD2 4.1Å; I331-V385 HydrophobicContact CD1-CB 4.44Å; I331-V385 HydrophobicContact CD1-CG1 4.42Å; I331-V385 HydrophobicContact CD1-CG2 4.1Å; I331-V385 HydrophobicContact CG1-CG2 4.46Å
332	L	98.1	Very high	96.8	Very high	74 Å²	74	57.2 Å²	57.2	39%	0.387	29%	0.285	S	S	.	.	H	α-helix	trans	-59.6	-40.4	-178.4	-71.3	171.4	0	0	0	112.7	T318 R328 C335 Q336	T318-L332 HydrophobicContact CG2-CD2 4.1Å; T318-L332 HydrophobicContact CG2-CG 4.12Å; R328-L332 HydrophobicContact CG-CD1 3.99Å; R328-L332 WeakPolarHBondContact O-CB 3.38Å; R328-L332 VanDerWaalsContact O-CG 3.26Å; R328-L332 WeakPolarHBondContact O-CG 3.33Å; R328-L332 PolarHBondContact O-N 3.44Å; L332-C335 PolarHBondContact O-N 3.47Å; L332-Q336 WeakPolarHBondContact O-CB 3.39Å; L332-Q336 PolarHBondContact O-N 3.4Å
333	G	98.1	Very high	97.1	Very high	36 Å²	36	58.6 Å²	58.6	37%	0.371	30%	0.295	S	S	.	.	H	α-helix	trans	-64	-40.5	176	0	0	0	0	0	113.1	Q329 A330 I331 Q336 L337	Q329-G333 PolarHBondContact O-N 3.01Å; A330-G333 PolarHBondContact O-N 3.36Å; I331-G333 VanDerWaalsContact C-N 3.33Å; I331-G333 PolarHBondContact O-N 3.47Å; G333-Q336 PolarHBondContact O-N 2.81Å; G333-L337 PolarHBondContact O-N 2.86Å
334	V	97.8	Very high	97.3	Very high	29 Å²	29	62 Å²	62	18%	0.176	31%	0.311	C	S	.	.	H	α-helix	trans	-71.4	-36.8	176.3	179	0	0	0	0	111.4	A330 I331 Q336 L337 A338 D377 L378	A330-V334 WeakPolarHBondContact O-CG2 3.28Å; A330-V334 PolarHBondContact O-N 3.13Å; A330-V334 VanDerWaalsContact O-N 3.14Å; I331-V334 PolarHBondContact O-N 3.1Å; I331-V334 VanDerWaalsContact O-N 3.15Å; V334-Q336 VanDerWaalsContact C-N 3.33Å; V334-Q336 PolarHBondContact O-N 2.99Å; V334-L337 PolarHBondContact O-N 3.35Å; V334-A338 WeakPolarHBondContact O-CB 3.32Å; V334-A338 PolarHBondContact O-N 2.98Å; V334-D377 HydrophobicContact CG1-CB 4.12Å; V334-L378 HydrophobicContact CG1-CB 3.89Å; V334-L378 HydrophobicContact CG1-CD1 4.27Å
335	C	98.3	Very high	97.4	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.8	-38.9	170.5	-68.2	0	0	0	0	112.3	V311 I331 L332 A338 R339 L378	V311-C335 HydrophobicContact CG1-CB 3.8Å; V311-C335 HydrophobicContact CG2-CB 4.16Å; I331-C335 PolarHBondContact O-N 3.26Å; I331-C335 PolarHBondContact O-SG 2.92Å; L332-C335 PolarHBondContact O-N 3.47Å; C335-A338 PolarHBondContact O-N 2.93Å; C335-R339 WeakPolarHBondContact O-CG 3.21Å; C335-R339 PolarHBondContact O-N 3.27Å; C335-R339 VanDerWaalsContact O-N 3.09Å; C335-L378 VanDerWaalsContact SG-CD1 3.53Å
336	Q	98.1	Very high	97.3	Very high	118 Å²	118	55.1 Å²	55.1	55%	0.551	28%	0.275	S	S	*	.	H	α-helix	trans	-65.1	-41.3	174.8	-171.8	176.6	13.7	0	0	111.9	L332 G333 V334 R339 Q340	L332-Q336 WeakPolarHBondContact O-CB 3.39Å; L332-Q336 PolarHBondContact O-N 3.4Å; G333-Q336 PolarHBondContact O-N 2.81Å; V334-Q336 VanDerWaalsContact C-N 3.33Å; V334-Q336 PolarHBondContact O-N 2.99Å; Q336-R339 PolarHBondContact O-N 2.87Å; Q336-Q340 WeakPolarHBondContact O-CG 3.47Å; Q336-Q340 PolarHBondContact O-N 2.9Å
337	L	97.8	Very high	97.3	Very high	67 Å²	67	54.2 Å²	54.2	35%	0.351	27%	0.271	S	S	.	.	H	α-helix	trans	-63.4	-43.6	174.1	-179.8	62.3	0	0	0	111.8	G333 V334 R339 Q340 E341	G333-L337 PolarHBondContact O-N 2.86Å; V334-L337 PolarHBondContact O-N 3.35Å; L337-R339 VanDerWaalsContact C-N 3.29Å; L337-R339 PolarHBondContact O-N 3.33Å; L337-Q340 PolarHBondContact O-N 3.31Å; L337-Q340 VanDerWaalsContact O-N 3.14Å; L337-E341 HydrophobicContact CD1-CG 4.15Å; L337-E341 HydrophobicContact CG-CG 4.5Å; L337-E341 PolarHBondContact O-N 2.89Å
338	A	97.9	Very high	97.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-37.9	177	0	0	0	0	0	112.5	L307 V334 C335 T342 I375	L307-A338 HydrophobicContact CD1-CB 4.16Å; V334-A338 WeakPolarHBondContact O-CB 3.32Å; V334-A338 PolarHBondContact O-N 2.98Å; C335-A338 PolarHBondContact O-N 2.93Å; A338-T342 WeakPolarHBondContact O-CB 3.48Å; A338-T342 PolarHBondContact O-N 3.4Å; A338-T342 PolarHBondContact O-OG1 2.91Å; A338-I375 HydrophobicContact CB-CD1 3.9Å
339	R	98.3	Very high	96.9	Very high	80 Å²	80	49.4 Å²	49.4	30%	0.302	25%	0.253	S	S	.	.	H	α-helix	trans	-63.2	-46.9	171.1	-72.7	178.1	172.8	125.4	-5.3	112.3	L307 E308 C335 Q336 L337 E341 T342 Q343	L307-R339 HydrophobicContact CD2-CB 4.22Å; L307-R339 HydrophobicContact CD2-CG 3.74Å; E308-R339 VanDerWaalsContact CD-NE 3.31Å; E308-R339 WeakPolarHBondContact OE1-CD 3.33Å; E308-R339 WeakPolarHBondContact OE1-CG 3.48Å; E308-R339 IonicContact OE1-CZ 3.22Å; E308-R339 IonicContact OE1-NE 2.97Å; E308-R339 PolarHBondContact OE1-NE 3.12Å; E308-R339 IonicContact OE2-CZ 3.99Å; E308-R339 IonicContact OE2-NE 3.2Å; E308-R339 PolarHBondContact OE2-NE 3Å; E308-R339 IonicContact OE2-NH2 2.94Å; E308-R339 PolarHBondContact OE2-NH2 3.09Å; C335-R339 WeakPolarHBondContact O-CG 3.21Å; C335-R339 PolarHBondContact O-N 3.27Å; C335-R339 VanDerWaalsContact O-N 3.09Å; Q336-R339 PolarHBondContact O-N 2.87Å; L337-R339 VanDerWaalsContact C-N 3.29Å; L337-R339 PolarHBondContact O-N 3.33Å; R339-E341 PolarHBondContact O-N 3.18Å; R339-T342 PolarHBondContact O-N 3Å; R339-Q343 WeakPolarHBondContact O-CB 3.25Å; R339-Q343 WeakPolarHBondContact O-CG 3.49Å; R339-Q343 PolarHBondContact O-N 3.5Å
340	Q	98	Very high	96.6	Very high	90 Å²	90	48.6 Å²	48.6	42%	0.421	25%	0.251	S	S	.	.	H	α-helix	trans	-63.4	-39.5	179.8	-72.6	172.5	-7	0	0	113	Q336 L337 Q344	Q336-Q340 WeakPolarHBondContact O-CG 3.47Å; Q336-Q340 PolarHBondContact O-N 2.9Å; L337-Q340 PolarHBondContact O-N 3.31Å; L337-Q340 VanDerWaalsContact O-N 3.14Å; Q340-Q344 WeakPolarHBondContact O-CG 3.42Å; Q340-Q344 PolarHBondContact O-N 3.36Å; Q340-Q344 VanDerWaalsContact O-N 3.15Å; Q340-Q344 PolarHBondContact O-NE2 3.44Å; Q340-Q344 VanDerWaalsContact O-NE2 3.08Å
341	E	97.9	Very high	96.2	Very high	24 Å²	24	52.4 Å²	52.4	11%	0.112	26%	0.263	C	S	.	.	H	α-helix	trans	-73.5	-38.5	177.2	-65.7	-55.8	154.1	0	0	112.2	L337 R339 Q343 Q344 L345 K370 T371	L337-E341 HydrophobicContact CD1-CG 4.15Å; L337-E341 HydrophobicContact CG-CG 4.5Å; L337-E341 PolarHBondContact O-N 2.89Å; R339-E341 PolarHBondContact O-N 3.18Å; E341-Q343 VanDerWaalsContact C-N 3.3Å; E341-Q343 PolarHBondContact O-N 2.97Å; E341-Q344 WeakPolarHBondContact O-CB 3.3Å; E341-Q344 PolarHBondContact O-N 2.67Å; E341-Q344 PolarHBondContact OE1-NE2 3.39Å; E341-Q344 PolarHBondContact OE2-NE2 3.36Å; E341-Q344 PolarHBondContact OE2-OE1 2.91Å; E341-L345 PolarHBondContact O-N 3.1Å; E341-K370 HydrophobicContact CG-CB 4.26Å; E341-K370 IonicContact OE1-NZ 2.62Å; E341-K370 WeakPolarHBondContact OE2-CB 3.3Å; E341-K370 WeakPolarHBondContact OE2-CD 3.28Å; E341-K370 IonicContact OE2-NZ 2.82Å; E341-T371 PolarHBondContact O-OG1 3.13Å
342	T	97	Very high	95.7	Very high	4 Å²	4	52.6 Å²	52.6	3%	0.025	26%	0.264	C	S	.	.	H	α-helix	trans	-67.8	-31	174.9	-54	0	0	0	0	112	F284 V303 L307 A338 R339 L345 V346	F284-T342 HydrophobicContact CZ-CG2 4.15Å; V303-T342 HydrophobicContact CG1-CG2 4.19Å; L307-T342 HydrophobicContact CB-CG2 4.5Å; L307-T342 HydrophobicContact CD2-CG2 4.13Å; A338-T342 WeakPolarHBondContact O-CB 3.48Å; A338-T342 PolarHBondContact O-N 3.4Å; A338-T342 PolarHBondContact O-OG1 2.91Å; R339-T342 PolarHBondContact O-N 3Å; T342-L345 WeakPolarHBondContact O-CB 3.19Å; T342-L345 PolarHBondContact O-N 3.42Å; T342-V346 WeakPolarHBondContact O-CB 3.4Å; T342-V346 VanDerWaalsContact O-CG2 3.32Å; T342-V346 WeakPolarHBondContact O-CG2 3.41Å; T342-V346 PolarHBondContact O-N 3.38Å
343	Q	97	Very high	95.2	Very high	117 Å²	117	51.7 Å²	51.7	55%	0.547	26%	0.258	S	S	.	.	H	α-helix	trans	-67.9	-39.1	171.4	-75	168.6	3.9	0	0	112.3	R339 E341 V346 H347	R339-Q343 WeakPolarHBondContact O-CB 3.25Å; R339-Q343 WeakPolarHBondContact O-CG 3.49Å; R339-Q343 PolarHBondContact O-N 3.5Å; E341-Q343 VanDerWaalsContact C-N 3.3Å; E341-Q343 PolarHBondContact O-N 2.97Å; Q343-V346 PolarHBondContact O-N 2.89Å; Q343-H347 PolarHBondContact O-N 3.4Å; Q343-H347 VanDerWaalsContact O-N 3.1Å
344	Q	96.4	Very high	94.6	Very high	78 Å²	78	53.8 Å²	53.8	36%	0.364	27%	0.267	S	S	.	.	H	α-helix	trans	-62.2	-44.3	171.1	-74.3	165.9	77.4	0	0	111.3	Q340 E341 H347 A348	Q340-Q344 WeakPolarHBondContact O-CG 3.42Å; Q340-Q344 PolarHBondContact O-N 3.36Å; Q340-Q344 VanDerWaalsContact O-N 3.15Å; Q340-Q344 PolarHBondContact O-NE2 3.44Å; Q340-Q344 VanDerWaalsContact O-NE2 3.08Å; E341-Q344 WeakPolarHBondContact O-CB 3.3Å; E341-Q344 PolarHBondContact O-N 2.67Å; E341-Q344 PolarHBondContact OE1-NE2 3.39Å; E341-Q344 PolarHBondContact OE2-NE2 3.36Å; E341-Q344 PolarHBondContact OE2-OE1 2.91Å; Q344-H347 PolarHBondContact O-N 2.91Å; Q344-A348 PolarHBondContact O-N 3.14Å
345	L	96.1	Very high	93.9	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-57.8	-47.7	174.9	175.1	67.2	0	0	0	112.3	V288 L291 V303 E341 T342 H347 A348 W349 L364 A367 I368 T371	V288-L345 HydrophobicContact CB-CD2 4.39Å; V288-L345 HydrophobicContact CG1-CD2 3.67Å; V288-L345 HydrophobicContact CG2-CD2 3.84Å; L291-L345 HydrophobicContact CD1-CD1 4.21Å; L291-L345 HydrophobicContact CD1-CD2 4.48Å; V303-L345 HydrophobicContact CG1-CD2 4.4Å; E341-L345 PolarHBondContact O-N 3.1Å; T342-L345 WeakPolarHBondContact O-CB 3.19Å; T342-L345 PolarHBondContact O-N 3.42Å; L345-H347 VanDerWaalsContact C-N 3.31Å; L345-H347 PolarHBondContact O-N 3.12Å; L345-A348 PolarHBondContact O-N 3.09Å; L345-W349 WeakPolarHBondContact O-CB 3.31Å; L345-W349 PolarHBondContact O-N 3.37Å; L345-L364 HydrophobicContact CD1-CD1 3.62Å; L345-A367 HydrophobicContact CB-CB 4.17Å; L345-A367 HydrophobicContact CD1-CB 4.15Å; L345-I368 HydrophobicContact CD1-CG1 3.62Å; L345-T371 HydrophobicContact CD2-CG2 3.95Å
346	V	94.8	Very high	93	Very high	29 Å²	29	65.6 Å²	65.6	18%	0.176	33%	0.328	C	S	.	.	H	α-helix	trans	-59.2	-41.3	177	161.7	0	0	0	0	111.4	P300 T342 Q343 I350	P300-V346 HydrophobicContact CB-CB 4.41Å; P300-V346 HydrophobicContact CB-CG1 3.93Å; P300-V346 HydrophobicContact CB-CG2 4.06Å; T342-V346 WeakPolarHBondContact O-CB 3.4Å; T342-V346 VanDerWaalsContact O-CG2 3.32Å; T342-V346 WeakPolarHBondContact O-CG2 3.41Å; T342-V346 PolarHBondContact O-N 3.38Å; Q343-V346 PolarHBondContact O-N 2.89Å; V346-I350 HydrophobicContact CG1-CD1 3.87Å; V346-I350 WeakPolarHBondContact O-CD1 3.39Å; V346-I350 VanDerWaalsContact O-CG1 3.24Å; V346-I350 WeakPolarHBondContact O-CG1 3.46Å; V346-I350 PolarHBondContact O-N 3.2Å; V346-I350 VanDerWaalsContact O-N 3.11Å
347	H	94.3	Very high	91.8	Very high	141 Å²	141	61.3 Å²	61.3	65%	0.653	31%	0.312	S	S	*	.	H	α-helix	trans	-63.7	-55	175.7	-100.6	-84	0	0	0	112.6	Q343 Q344 L345 W349 I350 E351	Q343-H347 PolarHBondContact O-N 3.4Å; Q343-H347 VanDerWaalsContact O-N 3.1Å; Q344-H347 PolarHBondContact O-N 2.91Å; L345-H347 VanDerWaalsContact C-N 3.31Å; L345-H347 PolarHBondContact O-N 3.12Å; H347-W349 PolarHBondContact O-N 3.14Å; H347-I350 PolarHBondContact O-N 2.99Å; H347-E351 PolarHBondContact O-N 3.36Å
348	A	93.1	Very high	90.4	Very high	15 Å²	15	67.8 Å²	67.8	12%	0.124	34%	0.338	C	S	.	.	H	α-helix	trans	-60.8	-33.8	-178.8	0	0	0	0	0	112.6	Q344 L345 A352 L364 A367	Q344-A348 PolarHBondContact O-N 3.14Å; L345-A348 PolarHBondContact O-N 3.09Å; A348-A352 WeakPolarHBondContact O-CB 3.5Å; A348-A352 PolarHBondContact O-N 2.82Å; A348-L364 HydrophobicContact CB-CB 4.37Å; A348-L364 HydrophobicContact CB-CD1 4.23Å; A348-A367 HydrophobicContact CB-CB 4.39Å
349	W	92.5	Very high	89.2	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-71.3	-42.4	177.4	-176.9	15.6	0	0	0	112.5	L291 L295 S298 T299 P300 V303 L345 H347 E351 A352 Q353 L364	L291-W349 HydrophobicContact CD1-CD2 4Å; L291-W349 HydrophobicContact CD1-CE3 3.78Å; L291-W349 HydrophobicContact CD1-CH2 4.38Å; L291-W349 HydrophobicContact CD1-CZ3 3.96Å; L291-W349 HydrophobicContact CD2-CD2 4.19Å; L291-W349 HydrophobicContact CD2-CE3 4.3Å; L291-W349 HydrophobicContact CD2-CH2 3.54Å; L291-W349 HydrophobicContact CD2-CZ2 3.38Å; L291-W349 HydrophobicContact CD2-CZ3 3.99Å; L295-W349 PolarHBondContact O-NE1 3.25Å; S298-W349 WeakPolarHBondContact O-CZ2 3.42Å; T299-W349 WeakPolarHBondContact O-CH2 3.36Å; P300-W349 VanDerWaalsContact CA-CZ3 3.4Å; P300-W349 HydrophobicContact CB-CE3 4.02Å; P300-W349 HydrophobicContact CB-CZ3 4.16Å; P300-W349 HydrophobicContact CG-CD2 3.96Å; P300-W349 HydrophobicContact CG-CE3 3.81Å; P300-W349 HydrophobicContact CG-CH2 4.39Å; P300-W349 HydrophobicContact CG-CZ3 4.05Å; V303-W349 HydrophobicContact CB-CZ3 4.26Å; V303-W349 HydrophobicContact CG2-CH2 4.17Å; V303-W349 HydrophobicContact CG2-CZ3 3.73Å; L345-W349 WeakPolarHBondContact O-CB 3.31Å; L345-W349 PolarHBondContact O-N 3.37Å; H347-W349 PolarHBondContact O-N 3.14Å; W349-E351 VanDerWaalsContact C-N 3.31Å; W349-E351 PolarHBondContact O-N 3.06Å; W349-A352 PolarHBondContact O-N 2.93Å; W349-Q353 WeakPolarHBondContact O-CG 3.5Å; W349-Q353 PolarHBondContact O-N 3.2Å; W349-L364 HydrophobicContact CB-CD1 3.92Å
350	I	91.2	Very high	88.1	Confident	84 Å²	84	72.8 Å²	72.8	43%	0.431	37%	0.369	S	S	.	.	H	α-helix	trans	-62.2	-41.2	174.2	-71	167	0	0	0	110.5	P300 V346 H347 Q353 S354	P300-I350 HydrophobicContact CB-CD1 4.39Å; P300-I350 HydrophobicContact CB-CG1 4.37Å; P300-I350 HydrophobicContact CG-CD1 4.4Å; P300-I350 HydrophobicContact CG-CG1 3.91Å; V346-I350 HydrophobicContact CG1-CD1 3.87Å; V346-I350 WeakPolarHBondContact O-CD1 3.39Å; V346-I350 VanDerWaalsContact O-CG1 3.24Å; V346-I350 WeakPolarHBondContact O-CG1 3.46Å; V346-I350 PolarHBondContact O-N 3.2Å; V346-I350 VanDerWaalsContact O-N 3.11Å; H347-I350 PolarHBondContact O-N 2.99Å; I350-Q353 PolarHBondContact O-N 2.61Å; I350-S354 WeakPolarHBondContact O-CB 3.34Å; I350-S354 PolarHBondContact O-N 3.36Å
351	E	90.3	Very high	87.5	Confident	115 Å²	115	71 Å²	71	54%	0.537	36%	0.364	S	S	.	.	H	α-helix	trans	-63.7	-49.3	176.5	-172.9	152.8	-171.2	0	0	111.8	H347 W349 Q353 S354 V355	H347-E351 PolarHBondContact O-N 3.36Å; W349-E351 VanDerWaalsContact C-N 3.31Å; W349-E351 PolarHBondContact O-N 3.06Å; E351-Q353 VanDerWaalsContact C-N 3.32Å; E351-Q353 PolarHBondContact O-N 3.33Å; E351-S354 WeakPolarHBondContact O-CB 3.34Å; E351-S354 PolarHBondContact O-N 3.01Å; E351-S354 PolarHBondContact O-OG 3.28Å; E351-V355 PolarHBondContact O-N 3.49Å; E351-V355 VanDerWaalsContact O-N 3.13Å
352	A	86.8	Confident	87.1	Confident	3 Å²	3	78 Å²	78	3%	0.025	40%	0.397	C	S	.	.	H	α-helix	trans	-58.3	-39.4	175.8	0	0	0	0	0	113.3	A348 W349 H356 A357 T361 L364	A348-A352 WeakPolarHBondContact O-CB 3.5Å; A348-A352 PolarHBondContact O-N 2.82Å; W349-A352 PolarHBondContact O-N 2.93Å; A352-H356 PolarHBondContact O-N 2.97Å; A352-A357 HydrophobicContact CB-CB 4.4Å; A352-A357 WeakPolarHBondContact O-CB 3.37Å; A352-A357 PolarHBondContact O-N 3.06Å; A352-A357 VanDerWaalsContact O-N 3.11Å; A352-T361 HydrophobicContact CB-CG2 4.13Å; A352-L364 HydrophobicContact CB-CD2 4.13Å
353	Q	87.1	Confident	86.8	Confident	55 Å²	55	84.3 Å²	84.3	26%	0.257	43%	0.426	S	S	.	.	H	α-helix	trans	-64.4	-40	172.7	-76.5	-173.7	-11.7	0	0	112.3	L295 W349 I350 E351 V355 H356	L295-Q353 PolarHBondContact O-NE2 2.85Å; W349-Q353 WeakPolarHBondContact O-CG 3.5Å; W349-Q353 PolarHBondContact O-N 3.2Å; I350-Q353 PolarHBondContact O-N 2.61Å; E351-Q353 VanDerWaalsContact C-N 3.32Å; E351-Q353 PolarHBondContact O-N 3.33Å; Q353-V355 VanDerWaalsContact C-N 3.33Å; Q353-V355 PolarHBondContact O-N 3.22Å; Q353-H356 PolarHBondContact O-N 3.3Å; Q353-H356 VanDerWaalsContact O-N 3.12Å; Q353-H356 PolarHBondContact O-ND1 3.08Å
354	S	85	Confident	86.5	Confident	80 Å²	80	78.7 Å²	78.7	56%	0.559	40%	0.4	S	S	*	.	H	α-helix	trans	-67.2	-30.8	-178.4	79	0	0	0	0	113.6	I350 E351 H356	I350-S354 WeakPolarHBondContact O-CB 3.34Å; I350-S354 PolarHBondContact O-N 3.36Å; E351-S354 WeakPolarHBondContact O-CB 3.34Å; E351-S354 PolarHBondContact O-N 3.01Å; E351-S354 PolarHBondContact O-OG 3.28Å; S354-H356 VanDerWaalsContact C-N 3.26Å
355	V	84.6	Confident	86.3	Confident	111 Å²	111	77.5 Å²	77.5	67%	0.673	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-1	175.9	-175.5	0	0	0	0	111.9	E351 Q353 A357	E351-V355 PolarHBondContact O-N 3.49Å; E351-V355 VanDerWaalsContact O-N 3.13Å; Q353-V355 VanDerWaalsContact C-N 3.33Å; Q353-V355 PolarHBondContact O-N 3.22Å; V355-A357 VanDerWaalsContact C-N 3.28Å; V355-A357 PolarHBondContact O-N 2.94Å
356	H	78.7	Confident	86.2	Confident	167 Å²	167	81.3 Å²	81.3	77%	0.773	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	40.3	-174.1	-58.5	-33.2	0	0	0	113.2	A352 Q353 S354 K358	A352-H356 PolarHBondContact O-N 2.97Å; Q353-H356 PolarHBondContact O-N 3.3Å; Q353-H356 VanDerWaalsContact O-N 3.12Å; Q353-H356 PolarHBondContact O-ND1 3.08Å; S354-H356 VanDerWaalsContact C-N 3.26Å; H356-K358 PolarHBondContact O-N 3.21Å
357	A	73.1	Confident	86.2	Confident	28 Å²	28	80.2 Å²	80.2	23%	0.231	41%	0.411	C	S	.	.			trans	-59.4	136.3	174	0	0	0	0	0	110.6	L295 A352 V355 T361	L295-A357 HydrophobicContact CD1-CB 4.39Å; A352-A357 HydrophobicContact CB-CB 4.4Å; A352-A357 WeakPolarHBondContact O-CB 3.37Å; A352-A357 PolarHBondContact O-N 3.06Å; A352-A357 VanDerWaalsContact O-N 3.11Å; V355-A357 VanDerWaalsContact C-N 3.28Å; V355-A357 PolarHBondContact O-N 2.94Å; A357-T361 HydrophobicContact CB-CG2 4.38Å
358	K	68.9	Low	86.2	Confident	203 Å²	203	73.5 Å²	73.5	88%	0.883	38%	0.38	S	S	*	.	S	Bend	trans	-86.9	-19.6	177.9	-69.6	-175.5	176.8	-179.6	0	113.6	H356	H356-K358 PolarHBondContact O-N 3.21Å
359	E	71.9	Confident	86.2	Confident	157 Å²	157	77.6 Å²	77.6	73%	0.734	40%	0.399	S	S	*	.	S	Bend	trans	-137.3	162.4	-174.1	-67.9	169.5	-166.4	0	0	107.2
360	A	75.6	Confident	86.3	Confident	27 Å²	27	81.5 Å²	81.5	22%	0.223	42%	0.417	C	S	.	.			trans	-65.1	137.4	178.9	0	0	0	0	0	111.6	L364 E365	A360-L364 HydrophobicContact CB-CD2 4.14Å; A360-L364 HydrophobicContact CB-CG 4.43Å; A360-E365 HydrophobicContact CB-CG 4.09Å
361	T	85.9	Confident	86.6	Confident	52 Å²	52	77.5 Å²	77.5	32%	0.319	40%	0.396	S	S	.	.			trans	-75.5	158.4	173.7	59.4	0	0	0	0	110.8	A352 A357 E363 L364 E365	A352-T361 HydrophobicContact CB-CG2 4.13Å; A357-T361 HydrophobicContact CB-CG2 4.38Å; T361-E363 PolarHBondContact O-N 3.19Å; T361-L364 PolarHBondContact O-N 3.15Å; T361-L364 VanDerWaalsContact OG1-CB 3.29Å; T361-L364 WeakPolarHBondContact OG1-CB 3.47Å; T361-L364 PolarHBondContact OG1-N 3.41Å; T361-E365 PolarHBondContact O-N 3.42Å
362	E	88.1	Confident	86.8	Confident	172 Å²	172	72.5 Å²	72.5	80%	0.804	37%	0.373	S	S	*	.	H	α-helix	trans	-56.7	-39.1	178	-63.2	-173.6	166.6	0	0	112.2	E365 V366	E362-E365 PolarHBondContact O-N 3.17Å; E362-V366 WeakPolarHBondContact O-CG2 3.43Å; E362-V366 PolarHBondContact O-N 3.43Å
363	E	90.9	Very high	87.2	Confident	136 Å²	136	76.7 Å²	76.7	64%	0.636	39%	0.393	S	S	*	.	H	α-helix	trans	-66.6	-38.8	176.5	-61	-176.6	154.3	0	0	112.3	T361 V366 A367	T361-E363 PolarHBondContact O-N 3.19Å; E363-V366 PolarHBondContact O-N 2.89Å; E363-A367 WeakPolarHBondContact O-CB 3.27Å; E363-A367 PolarHBondContact O-N 2.72Å
364	L	90.6	Very high	87.7	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-67.9	-40.6	174.9	179.5	57.8	0	0	0	111.4	L295 L345 A348 W349 A352 A360 T361 A367 I368	L295-L364 HydrophobicContact CD2-CD2 3.4Å; L345-L364 HydrophobicContact CD1-CD1 3.62Å; A348-L364 HydrophobicContact CB-CB 4.37Å; A348-L364 HydrophobicContact CB-CD1 4.23Å; W349-L364 HydrophobicContact CB-CD1 3.92Å; A352-L364 HydrophobicContact CB-CD2 4.13Å; A360-L364 HydrophobicContact CB-CD2 4.14Å; A360-L364 HydrophobicContact CB-CG 4.43Å; T361-L364 PolarHBondContact O-N 3.15Å; T361-L364 VanDerWaalsContact OG1-CB 3.29Å; T361-L364 WeakPolarHBondContact OG1-CB 3.47Å; T361-L364 PolarHBondContact OG1-N 3.41Å; L364-A367 PolarHBondContact O-N 2.53Å; L364-I368 HydrophobicContact CD1-CD1 4.29Å; L364-I368 HydrophobicContact CD1-CG1 4.29Å; L364-I368 HydrophobicContact CG-CD1 4.01Å; L364-I368 HydrophobicContact CG-CG1 4.47Å; L364-I368 WeakPolarHBondContact O-CB 3.27Å; L364-I368 VanDerWaalsContact O-CG1 3.26Å; L364-I368 WeakPolarHBondContact O-CG1 3.35Å; L364-I368 PolarHBondContact O-N 2.94Å
365	E	92.5	Very high	88.3	Confident	53 Å²	53	70.4 Å²	70.4	25%	0.248	36%	0.355	C	S	.	.	H	α-helix	trans	-60.8	-43.6	173.4	-84.7	-65.9	167.4	0	0	112.3	R292 A360 T361 E362 A367 I368 L369	R292-E365 VanDerWaalsContact CD-OE1 3.24Å; R292-E365 WeakPolarHBondContact CD-OE1 3.36Å; R292-E365 VanDerWaalsContact CG-OE1 3.22Å; R292-E365 WeakPolarHBondContact CG-OE1 3.48Å; R292-E365 IonicContact CZ-OE1 3.77Å; R292-E365 IonicContact CZ-OE2 2.65Å; R292-E365 VanDerWaalsContact NE-CD 3.26Å; R292-E365 IonicContact NE-OE1 2.7Å; R292-E365 PolarHBondContact NE-OE1 2.79Å; R292-E365 IonicContact NE-OE2 2.69Å; R292-E365 PolarHBondContact NE-OE2 3.37Å; R292-E365 IonicContact NH2-OE2 2.8Å; R292-E365 PolarHBondContact NH2-OE2 2.95Å; A360-E365 HydrophobicContact CB-CG 4.09Å; T361-E365 PolarHBondContact O-N 3.42Å; E362-E365 PolarHBondContact O-N 3.17Å; E365-A367 VanDerWaalsContact C-N 3.34Å; E365-A367 PolarHBondContact O-N 2.76Å; E365-I368 PolarHBondContact O-N 2.7Å; E365-L369 WeakPolarHBondContact O-CB 3.46Å; E365-L369 VanDerWaalsContact O-CG 3.28Å; E365-L369 WeakPolarHBondContact O-CG 3.33Å; E365-L369 PolarHBondContact O-N 2.7Å
366	V	93.9	Very high	88.8	Confident	79 Å²	79	66.1 Å²	66.1	48%	0.479	33%	0.333	S	S	.	.	H	α-helix	trans	-60.5	-44	173.1	170.3	0	0	0	0	110.8	E362 E363 L369 K370	E362-V366 WeakPolarHBondContact O-CG2 3.43Å; E362-V366 PolarHBondContact O-N 3.43Å; E363-V366 PolarHBondContact O-N 2.89Å; V366-L369 PolarHBondContact O-N 3.3Å; V366-K370 HydrophobicContact CG1-CD 4.44Å; V366-K370 HydrophobicContact CG1-CG 4.38Å; V366-K370 WeakPolarHBondContact O-CG 3.43Å; V366-K370 PolarHBondContact O-N 2.94Å
367	A	95.1	Very high	89.6	Confident	6 Å²	6	60.2 Å²	60.2	5%	0.05	31%	0.307	C	S	.	.	H	α-helix	trans	-67.4	-37.6	178.8	0	0	0	0	0	113.3	L345 A348 E363 L364 E365 T371	L345-A367 HydrophobicContact CB-CB 4.17Å; L345-A367 HydrophobicContact CD1-CB 4.15Å; A348-A367 HydrophobicContact CB-CB 4.39Å; E363-A367 WeakPolarHBondContact O-CB 3.27Å; E363-A367 PolarHBondContact O-N 2.72Å; L364-A367 PolarHBondContact O-N 2.53Å; E365-A367 VanDerWaalsContact C-N 3.34Å; E365-A367 PolarHBondContact O-N 2.76Å; A367-T371 VanDerWaalsContact O-CB 3.23Å; A367-T371 WeakPolarHBondContact O-CB 3.48Å; A367-T371 PolarHBondContact O-N 3.42Å; A367-T371 PolarHBondContact O-OG1 3.43Å
368	I	93.4	Very high	90.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.9	-50.1	171.4	-73.6	168.4	0	0	0	109.7	V288 L291 R292 L345 L364 E365 T371 C372	V288-I368 HydrophobicContact CG1-CB 4.36Å; V288-I368 HydrophobicContact CG1-CG1 4.21Å; V288-I368 HydrophobicContact CG1-CG2 4.11Å; L291-I368 HydrophobicContact CB-CD1 4.01Å; R292-I368 HydrophobicContact CG-CD1 4.1Å; L345-I368 HydrophobicContact CD1-CG1 3.62Å; L364-I368 HydrophobicContact CD1-CD1 4.29Å; L364-I368 HydrophobicContact CD1-CG1 4.29Å; L364-I368 HydrophobicContact CG-CD1 4.01Å; L364-I368 HydrophobicContact CG-CG1 4.47Å; L364-I368 WeakPolarHBondContact O-CB 3.27Å; L364-I368 VanDerWaalsContact O-CG1 3.26Å; L364-I368 WeakPolarHBondContact O-CG1 3.35Å; L364-I368 PolarHBondContact O-N 2.94Å; E365-I368 PolarHBondContact O-N 2.7Å; I368-T371 PolarHBondContact O-N 2.96Å; I368-C372 WeakPolarHBondContact O-CB 3.41Å; I368-C372 PolarHBondContact O-N 2.99Å
369	L	93.9	Very high	92.1	Very high	101 Å²	101	52.4 Å²	52.4	53%	0.529	27%	0.266	S	S	.	.	H	α-helix	trans	-62.2	-46.7	-179.6	-72.8	170.1	0	0	0	112.3	E365 V366 C372 Q373	E365-L369 WeakPolarHBondContact O-CB 3.46Å; E365-L369 VanDerWaalsContact O-CG 3.28Å; E365-L369 WeakPolarHBondContact O-CG 3.33Å; E365-L369 PolarHBondContact O-N 2.7Å; V366-L369 PolarHBondContact O-N 3.3Å; L369-C372 PolarHBondContact O-N 3.42Å; L369-Q373 WeakPolarHBondContact O-CB 3.48Å; L369-Q373 PolarHBondContact O-N 2.62Å
370	K	95.7	Very high	93.3	Very high	83 Å²	83	51.5 Å²	51.5	36%	0.361	26%	0.256	S	S	.	.	H	α-helix	trans	-62.2	-42.8	176.2	-71.1	-172.4	-171.5	-177	0	112.5	E341 V366 Q373 S374	E341-K370 HydrophobicContact CG-CB 4.26Å; E341-K370 IonicContact OE1-NZ 2.62Å; E341-K370 WeakPolarHBondContact OE2-CB 3.3Å; E341-K370 WeakPolarHBondContact OE2-CD 3.28Å; E341-K370 IonicContact OE2-NZ 2.82Å; V366-K370 HydrophobicContact CG1-CD 4.44Å; V366-K370 HydrophobicContact CG1-CG 4.38Å; V366-K370 WeakPolarHBondContact O-CG 3.43Å; V366-K370 PolarHBondContact O-N 2.94Å; K370-Q373 WeakPolarHBondContact O-CB 3.49Å; K370-Q373 PolarHBondContact O-N 2.93Å; K370-S374 PolarHBondContact O-N 3.46Å; K370-S374 PolarHBondContact O-OG 2.96Å
371	T	96.9	Very high	94.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.4	-44.9	178.1	-61	0	0	0	0	111.2	F284 V288 E341 L345 A367 I368 Q373 S374 I375	F284-T371 HydrophobicContact CE1-CG2 3.73Å; F284-T371 HydrophobicContact CZ-CG2 4.01Å; V288-T371 HydrophobicContact CG1-CG2 4.26Å; V288-T371 HydrophobicContact CG2-CG2 4.27Å; E341-T371 PolarHBondContact O-OG1 3.13Å; L345-T371 HydrophobicContact CD2-CG2 3.95Å; A367-T371 VanDerWaalsContact O-CB 3.23Å; A367-T371 WeakPolarHBondContact O-CB 3.48Å; A367-T371 PolarHBondContact O-N 3.42Å; A367-T371 PolarHBondContact O-OG1 3.43Å; I368-T371 PolarHBondContact O-N 2.96Å; T371-Q373 PolarHBondContact O-N 3.38Å; T371-S374 PolarHBondContact O-OG 2.97Å; T371-I375 WeakPolarHBondContact O-CG1 3.25Å; T371-I375 PolarHBondContact O-N 3.23Å
372	C	94.5	Very high	94.9	Very high	9 Å²	9	49.1 Å²	49.1	6%	0.061	24%	0.237	C	C	.	.	H	α-helix	trans	-67.2	-22	174.5	-81.3	0	0	0	0	113.6	K285 E289 I368 L369 G376	K285-C372 HydrophobicContact CD-CB 4.48Å; K285-C372 WeakPolarHBondContact CE-O 3.24Å; K285-C372 PolarHBondContact NZ-O 3.34Å; E289-C372 PolarHBondContact OE1-SG 2.92Å; I368-C372 WeakPolarHBondContact O-CB 3.41Å; I368-C372 PolarHBondContact O-N 2.99Å; L369-C372 PolarHBondContact O-N 3.42Å; C372-G376 PolarHBondContact O-N 3.27Å
373	Q	95.4	Very high	95.4	Very high	91 Å²	91	41.4 Å²	41.4	43%	0.425	20%	0.201	S	C	.	.	H	α-helix	trans	-79.6	-51.2	173.5	178.6	51.6	52.4	0	0	111.8	L369 K370 T371 I375 G376 D377	L369-Q373 WeakPolarHBondContact O-CB 3.48Å; L369-Q373 PolarHBondContact O-N 2.62Å; K370-Q373 WeakPolarHBondContact O-CB 3.49Å; K370-Q373 PolarHBondContact O-N 2.93Å; T371-Q373 PolarHBondContact O-N 3.38Å; Q373-I375 VanDerWaalsContact C-N 3.28Å; Q373-I375 PolarHBondContact O-N 3.41Å; Q373-G376 CarbonylContact O-C 3.53Å; Q373-G376 VanDerWaalsContact O-CA 3.25Å; Q373-G376 WeakPolarHBondContact O-CA 3.39Å; Q373-G376 PolarHBondContact O-N 3.47Å; Q373-D377 VanDerWaalsContact NE2-CG 3.26Å; Q373-D377 PolarHBondContact NE2-OD1 3.42Å; Q373-D377 PolarHBondContact NE2-OD2 3.43Å; Q373-D377 PolarHBondContact O-N 2.88Å
374	S	97.8	Very high	95.6	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-34.7	-178.9	61.6	0	0	0	0	112.8	K370 T371 D377 L378	K370-S374 PolarHBondContact O-N 3.46Å; K370-S374 PolarHBondContact O-OG 2.96Å; T371-S374 PolarHBondContact O-OG 2.97Å; S374-D377 WeakPolarHBondContact O-CB 3.42Å; S374-D377 PolarHBondContact O-N 3.49Å; S374-L378 PolarHBondContact O-N 3.28Å
375	I	96.6	Very high	95.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-70.8	-30.5	171	-65.4	-65.9	0	0	0	112.5	I281 F284 K285 L307 L310 A338 T371 Q373 D377 L378 R379	I281-I375 HydrophobicContact CB-CG2 4.29Å; I281-I375 HydrophobicContact CG1-CG2 4.04Å; I281-I375 HydrophobicContact CG2-CG2 3.84Å; F284-I375 HydrophobicContact CD1-CD1 4.32Å; F284-I375 HydrophobicContact CD1-CG1 3.91Å; F284-I375 HydrophobicContact CD1-CG2 4.36Å; F284-I375 HydrophobicContact CE1-CD1 4.13Å; F284-I375 HydrophobicContact CE1-CG1 3.66Å; K285-I375 HydrophobicContact CD-CG2 4.15Å; K285-I375 HydrophobicContact CG-CB 4.43Å; K285-I375 HydrophobicContact CG-CG2 3.89Å; L307-I375 HydrophobicContact CD1-CD1 3.64Å; L310-I375 HydrophobicContact CD2-CD1 3.91Å; A338-I375 HydrophobicContact CB-CD1 3.9Å; T371-I375 WeakPolarHBondContact O-CG1 3.25Å; T371-I375 PolarHBondContact O-N 3.23Å; Q373-I375 VanDerWaalsContact C-N 3.28Å; Q373-I375 PolarHBondContact O-N 3.41Å; I375-D377 VanDerWaalsContact C-N 3.33Å; I375-L378 HydrophobicContact CD1-CD2 4.47Å; I375-L378 PolarHBondContact O-N 3.26Å; I375-R379 PolarHBondContact O-N 3.08Å
376	G	94.5	Very high	96.2	Very high	21 Å²	21	38.3 Å²	38.3	22%	0.216	18%	0.184	C	C	.	.	H	α-helix	trans	-65.7	-35.6	168.3	0	0	0	0	0	112.7	C372 Q373 R379 R380	C372-G376 PolarHBondContact O-N 3.27Å; Q373-G376 CarbonylContact O-C 3.53Å; Q373-G376 VanDerWaalsContact O-CA 3.25Å; Q373-G376 WeakPolarHBondContact O-CA 3.39Å; Q373-G376 PolarHBondContact O-N 3.47Å; G376-R379 PolarHBondContact O-N 3.05Å; G376-R380 PolarHBondContact O-N 2.91Å
377	D	96.3	Very high	96.3	Very high	43 Å²	43	35.3 Å²	35.3	23%	0.23	17%	0.166	C	C	.	.	H	α-helix	trans	-71.6	-37.5	174	-67.2	-44.7	0	0	0	112.4	V334 Q373 S374 I375 R379 R380 E381	V334-D377 HydrophobicContact CG1-CB 4.12Å; Q373-D377 VanDerWaalsContact NE2-CG 3.26Å; Q373-D377 PolarHBondContact NE2-OD1 3.42Å; Q373-D377 PolarHBondContact NE2-OD2 3.43Å; Q373-D377 PolarHBondContact O-N 2.88Å; S374-D377 WeakPolarHBondContact O-CB 3.42Å; S374-D377 PolarHBondContact O-N 3.49Å; I375-D377 VanDerWaalsContact C-N 3.33Å; D377-R379 VanDerWaalsContact C-N 3.33Å; D377-R379 PolarHBondContact O-N 2.91Å; D377-R380 WeakPolarHBondContact O-CB 3.48Å; D377-R380 PolarHBondContact O-N 3.35Å; D377-R380 VanDerWaalsContact O-N 3.1Å; D377-R380 IonicContact OD1-CZ 2.81Å; D377-R380 IonicContact OD1-NE 3.44Å; D377-R380 PolarHBondContact OD1-NE 2.88Å; D377-R380 IonicContact OD1-NH2 2.73Å; D377-R380 PolarHBondContact OD1-NH2 2.96Å; D377-E381 PolarHBondContact O-N 3.06Å
378	L	97.6	Very high	96.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.1	-44.4	171	-175.3	56.2	0	0	0	111	L310 T314 V334 C335 S374 I375 R380 E381 L382	L310-L378 HydrophobicContact CD2-CD2 4.07Å; T314-L378 HydrophobicContact CG2-CD1 4.31Å; T314-L378 HydrophobicContact CG2-CD2 4.43Å; V334-L378 HydrophobicContact CG1-CB 3.89Å; V334-L378 HydrophobicContact CG1-CD1 4.27Å; C335-L378 VanDerWaalsContact SG-CD1 3.53Å; S374-L378 PolarHBondContact O-N 3.28Å; I375-L378 HydrophobicContact CD1-CD2 4.47Å; I375-L378 PolarHBondContact O-N 3.26Å; L378-R380 VanDerWaalsContact C-N 3.29Å; L378-R380 PolarHBondContact O-N 3.17Å; L378-E381 PolarHBondContact O-N 2.93Å; L378-L382 HydrophobicContact CD1-CD1 3.97Å; L378-L382 HydrophobicContact CD1-CG 4.07Å; L378-L382 HydrophobicContact CG-CD1 3.93Å; L378-L382 HydrophobicContact CG-CG 4.47Å; L378-L382 WeakPolarHBondContact O-CB 3.49Å; L378-L382 VanDerWaalsContact O-CG 3.29Å; L378-L382 WeakPolarHBondContact O-CG 3.38Å; L378-L382 PolarHBondContact O-N 2.91Å; L378-L382 VanDerWaalsContact O-N 3.07Å
379	R	96.6	Very high	96.3	Very high	67 Å²	67	37.2 Å²	37.2	25%	0.253	18%	0.179	S	C	.	.	H	α-helix	trans	-59.1	-39.5	173.1	-158.1	-174.5	112.4	168.4	0.5	112.1	I281 I375 G376 D377 H383 F511	I281-R379 HydrophobicContact CD1-CB 3.8Å; I281-R379 HydrophobicContact CD1-CG 4.07Å; I281-R379 HydrophobicContact CG2-CB 4.43Å; I281-R379 HydrophobicContact CG2-CG 4.45Å; I375-R379 PolarHBondContact O-N 3.08Å; G376-R379 PolarHBondContact O-N 3.05Å; D377-R379 VanDerWaalsContact C-N 3.33Å; D377-R379 PolarHBondContact O-N 2.91Å; R379-H383 VanDerWaalsContact O-CB 3.28Å; R379-H383 WeakPolarHBondContact O-CB 3.46Å; R379-H383 PolarHBondContact O-N 3.22Å; R379-F511 HydrophobicContact CG-CE2 4.3Å
380	R	97	Very high	96.4	Very high	138 Å²	138	32.4 Å²	32.4	52%	0.521	15%	0.154	S	C	.	.	H	α-helix	trans	-64.1	-49.4	177.6	-82.8	-165.9	-88.5	-137.3	5.3	112.1	G376 D377 L378 H383 K384 F511	G376-R380 PolarHBondContact O-N 2.91Å; D377-R380 WeakPolarHBondContact O-CB 3.48Å; D377-R380 PolarHBondContact O-N 3.35Å; D377-R380 VanDerWaalsContact O-N 3.1Å; D377-R380 IonicContact OD1-CZ 2.81Å; D377-R380 IonicContact OD1-NE 3.44Å; D377-R380 PolarHBondContact OD1-NE 2.88Å; D377-R380 IonicContact OD1-NH2 2.73Å; D377-R380 PolarHBondContact OD1-NH2 2.96Å; L378-R380 VanDerWaalsContact C-N 3.29Å; L378-R380 PolarHBondContact O-N 3.17Å; R380-H383 PolarHBondContact O-N 2.94Å; R380-K384 VanDerWaalsContact O-CB 3.27Å; R380-K384 WeakPolarHBondContact O-CB 3.35Å; R380-K384 PolarHBondContact O-N 3.13Å; R380-F511 HydrophobicContact CG-CZ 4.05Å
381	E	98	Very high	96.4	Very high	27 Å²	27	30.1 Å²	30.1	13%	0.126	15%	0.149	C	C	.	.	H	α-helix	trans	-70.5	-42.2	-174.4	-167.4	55.6	-144.3	0	0	111.8	A330 I331 D377 L378 H383 K384 V385	A330-E381 HydrophobicContact CB-CG 4.06Å; I331-E381 HydrophobicContact CG1-CG 4.1Å; D377-E381 PolarHBondContact O-N 3.06Å; L378-E381 PolarHBondContact O-N 2.93Å; E381-H383 PolarHBondContact O-N 3.48Å; E381-K384 WeakPolarHBondContact O-CB 3.48Å; E381-K384 PolarHBondContact O-N 3.03Å; E381-K384 IonicContact OE1-NZ 3.43Å; E381-K384 PolarHBondContact OE1-NZ 3.07Å; E381-K384 IonicContact OE2-NZ 3.47Å; E381-K384 PolarHBondContact OE2-NZ 2.67Å; E381-V385 WeakPolarHBondContact O-CG2 3.43Å; E381-V385 PolarHBondContact O-N 3.49Å
382	L	97.9	Very high	96.2	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-60.4	-44.9	174.5	-66.1	171.2	0	0	0	112	I277 T314 F317 I331 L378 V385 A386 V442	I277-L382 HydrophobicContact CD1-CD1 4.27Å; I277-L382 HydrophobicContact CG2-CD1 3.79Å; T314-L382 HydrophobicContact CG2-CD1 4.04Å; T314-L382 HydrophobicContact CG2-CD2 4.22Å; F317-L382 HydrophobicContact CB-CD2 4.16Å; F317-L382 HydrophobicContact CD1-CD2 3.73Å; F317-L382 HydrophobicContact CD2-CD2 3.87Å; F317-L382 HydrophobicContact CE1-CB 4.15Å; F317-L382 HydrophobicContact CE1-CD2 4.04Å; F317-L382 WeakPolarHBondContact CE1-O 3.34Å; F317-L382 HydrophobicContact CE2-CD2 4.19Å; F317-L382 HydrophobicContact CG-CD2 3.65Å; F317-L382 HydrophobicContact CZ-CB 4.28Å; F317-L382 HydrophobicContact CZ-CD2 4.27Å; I331-L382 HydrophobicContact CD1-CD2 3.99Å; I331-L382 HydrophobicContact CG1-CD2 4.18Å; I331-L382 HydrophobicContact CG2-CD2 4.1Å; L378-L382 HydrophobicContact CD1-CD1 3.97Å; L378-L382 HydrophobicContact CD1-CG 4.07Å; L378-L382 HydrophobicContact CG-CD1 3.93Å; L378-L382 HydrophobicContact CG-CG 4.47Å; L378-L382 WeakPolarHBondContact O-CB 3.49Å; L378-L382 VanDerWaalsContact O-CG 3.29Å; L378-L382 WeakPolarHBondContact O-CG 3.38Å; L378-L382 PolarHBondContact O-N 2.91Å; L378-L382 VanDerWaalsContact O-N 3.07Å; L382-V385 PolarHBondContact O-N 3.42Å; L382-A386 PolarHBondContact O-N 3.01Å; L382-V442 HydrophobicContact CB-CG1 4.14Å
383	H	97.3	Very high	96.1	Very high	10 Å²	10	34.9 Å²	34.9	5%	0.046	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-45.9	175.9	-177.8	89.6	0	0	0	111.7	R379 R380 E381 V385 A386 V387 V442 N508 F511	R379-H383 VanDerWaalsContact O-CB 3.28Å; R379-H383 WeakPolarHBondContact O-CB 3.46Å; R379-H383 PolarHBondContact O-N 3.22Å; R380-H383 PolarHBondContact O-N 2.94Å; E381-H383 PolarHBondContact O-N 3.48Å; H383-V385 VanDerWaalsContact C-N 3.34Å; H383-V385 PolarHBondContact O-N 3.29Å; H383-A386 PolarHBondContact O-N 2.87Å; H383-V387 VanDerWaalsContact O-CB 3.27Å; H383-V387 WeakPolarHBondContact O-CB 3.29Å; H383-V387 WeakPolarHBondContact O-CG2 3.46Å; H383-V387 PolarHBondContact O-N 2.84Å; H383-V442 HydrophobicContact CB-CB 4.43Å; H383-V442 HydrophobicContact CB-CG1 4.46Å; H383-N508 PolarHBondContact NE2-OD1 3.12Å; H383-F511 HydrophobicContact CB-CD2 3.72Å; H383-F511 HydrophobicContact CB-CE2 3.41Å; H383-F511 VanDerWaalsContact CB-CE2 3.41Å; H383-F511 HydrophobicContact CB-CG 4.5Å; H383-F511 HydrophobicContact CB-CZ 3.98Å; H383-F511 AromaticContact CD2-CD1 3.76Å; H383-F511 AromaticContact CD2-CD2 3.78Å; H383-F511 AromaticContact CD2-CE1 3.96Å; H383-F511 AromaticContact CD2-CE2 3.97Å; H383-F511 AromaticContact CD2-CG 3.67Å; H383-F511 WeakPolarHBondContact CE1-CB 3.27Å; H383-F511 AromaticContact CE1-CD2 3.67Å; H383-F511 AromaticContact CE1-CG 3.41Å; H383-F511 VanDerWaalsContact CE1-CG 3.41Å; H383-F511 WeakPolarHBondContact CE1-CG 3.37Å; H383-F511 AromaticContact CG-CD2 3.3Å; H383-F511 AromaticContact CG-CE2 3.48Å; H383-F511 VanDerWaalsContact CG-CE2 3.48Å; H383-F511 AromaticContact CG-CG 3.66Å; H383-F511 AromaticContact ND1-CD2 3.24Å; H383-F511 WeakPolarHBondContact ND1-CD2 3.34Å; H383-F511 AromaticContact ND1-CE2 3.91Å; H383-F511 AromaticContact ND1-CG 3.52Å; H383-F511 AromaticContact NE2-CD1 3.74Å; H383-F511 AromaticContact NE2-CD2 3.98Å; H383-F511 AromaticContact NE2-CG 3.51Å
384	K	96.6	Very high	96	Very high	123 Å²	123	32 Å²	32	54%	0.535	16%	0.161	S	C	.	.	H	α-helix	trans	-57.2	-42.8	176.1	163.3	169.2	162.5	-97.4	0	112.2	R380 E381 G388	R380-K384 VanDerWaalsContact O-CB 3.27Å; R380-K384 WeakPolarHBondContact O-CB 3.35Å; R380-K384 PolarHBondContact O-N 3.13Å; E381-K384 WeakPolarHBondContact O-CB 3.48Å; E381-K384 PolarHBondContact O-N 3.03Å; E381-K384 IonicContact OE1-NZ 3.43Å; E381-K384 PolarHBondContact OE1-NZ 3.07Å; E381-K384 IonicContact OE2-NZ 3.47Å; E381-K384 PolarHBondContact OE2-NZ 2.67Å; K384-G388 WeakPolarHBondContact O-CA 3.46Å; K384-G388 PolarHBondContact O-N 3.42Å
385	V	97.2	Very high	95.6	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-69	-50.7	178	172.9	0	0	0	0	111.6	F317 T323 Q327 I331 E381 L382 H383 R389	F317-V385 HydrophobicContact CD1-CB 4.44Å; F317-V385 HydrophobicContact CD1-CG1 4.16Å; T323-V385 HydrophobicContact CG2-CG1 4.47Å; Q327-V385 HydrophobicContact CB-CG1 4.41Å; Q327-V385 HydrophobicContact CB-CG2 3.91Å; Q327-V385 HydrophobicContact CG-CG2 3.97Å; I331-V385 HydrophobicContact CD1-CB 4.44Å; I331-V385 HydrophobicContact CD1-CG1 4.42Å; I331-V385 HydrophobicContact CD1-CG2 4.1Å; I331-V385 HydrophobicContact CG1-CG2 4.46Å; E381-V385 WeakPolarHBondContact O-CG2 3.43Å; E381-V385 PolarHBondContact O-N 3.49Å; L382-V385 PolarHBondContact O-N 3.42Å; H383-V385 VanDerWaalsContact C-N 3.34Å; H383-V385 PolarHBondContact O-N 3.29Å; V385-R389 VanDerWaalsContact O-CB 3.27Å; V385-R389 WeakPolarHBondContact O-CB 3.33Å; V385-R389 PolarHBondContact O-N 3.02Å
386	A	97.2	Very high	95.2	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.5	-47.5	179.4	0	0	0	0	0	112.5	F317 L382 H383 A390 L438 L439 V442	F317-A386 HydrophobicContact CE1-CB 3.92Å; F317-A386 HydrophobicContact CZ-CB 4.31Å; L382-A386 PolarHBondContact O-N 3.01Å; H383-A386 PolarHBondContact O-N 2.87Å; A386-A390 VanDerWaalsContact O-CB 3.3Å; A386-A390 WeakPolarHBondContact O-CB 3.32Å; A386-A390 PolarHBondContact O-N 3.21Å; A386-L438 HydrophobicContact CB-CB 4.1Å; A386-L439 HydrophobicContact CB-CD2 4.23Å; A386-V442 HydrophobicContact CB-CG2 3.86Å
387	V	96.4	Very high	94.7	Very high	16 Å²	16	41.4 Å²	41.4	10%	0.097	21%	0.209	C	C	.	.	H	α-helix	trans	-71.5	-38.8	-178.8	167.9	0	0	0	0	112.2	H383 S391 L439 L504 I507 N508	H383-V387 VanDerWaalsContact O-CB 3.27Å; H383-V387 WeakPolarHBondContact O-CB 3.29Å; H383-V387 WeakPolarHBondContact O-CG2 3.46Å; H383-V387 PolarHBondContact O-N 2.84Å; V387-S391 VanDerWaalsContact O-CB 3.3Å; V387-S391 WeakPolarHBondContact O-CB 3.37Å; V387-S391 PolarHBondContact O-N 3.41Å; V387-S391 PolarHBondContact O-OG 3.46Å; V387-L439 HydrophobicContact CG2-CD2 4.25Å; V387-L504 HydrophobicContact CB-CD1 4.16Å; V387-L504 HydrophobicContact CG1-CD1 4.01Å; V387-L504 HydrophobicContact CG2-CD1 3.86Å; V387-I507 HydrophobicContact CG2-CG2 4.49Å; V387-N508 VanDerWaalsContact CG1-ND2 3.31Å; V387-N508 WeakPolarHBondContact CG1-ND2 3.48Å
388	G	95.3	Very high	93.7	Very high	24 Å²	24	41.6 Å²	41.6	25%	0.247	22%	0.221	C	C	.	.	H	α-helix	trans	-59.8	-54.7	175	0	0	0	0	0	110.8	K384 A390 S391 D392	K384-G388 WeakPolarHBondContact O-CA 3.46Å; K384-G388 PolarHBondContact O-N 3.42Å; G388-A390 PolarHBondContact O-N 3.04Å; G388-S391 WeakPolarHBondContact O-CB 3.41Å; G388-S391 PolarHBondContact O-N 3.15Å; G388-S391 VanDerWaalsContact O-N 3.08Å; G388-D392 PolarHBondContact O-N 3.42Å
389	R	93.3	Very high	92.6	Very high	22 Å²	22	47.2 Å²	47.2	8%	0.083	25%	0.247	C	C	.	.	H	α-helix	trans	-54.4	-49.5	175.8	175.6	175.1	159.9	175.9	-1.8	112.3	S320 V385 S391 D392 L393 Q431 E434 T435 L438	S320-R389 PolarHBondContact OG-NH1 3.24Å; V385-R389 VanDerWaalsContact O-CB 3.27Å; V385-R389 WeakPolarHBondContact O-CB 3.33Å; V385-R389 PolarHBondContact O-N 3.02Å; R389-S391 VanDerWaalsContact C-N 3.31Å; R389-S391 PolarHBondContact O-N 3.34Å; R389-D392 PolarHBondContact O-N 2.89Å; R389-L393 WeakPolarHBondContact O-CB 3.18Å; R389-L393 PolarHBondContact O-N 3.45Å; R389-Q431 PolarHBondContact NH2-O 2.82Å; R389-E434 IonicContact CZ-OE1 3.21Å; R389-E434 IonicContact NH1-OE1 3.77Å; R389-E434 PolarHBondContact NH1-OE1 2.66Å; R389-E434 IonicContact NH2-OE1 3.08Å; R389-E434 PolarHBondContact NH2-OE1 3.36Å; R389-T435 HydrophobicContact CG-CG2 4.28Å; R389-T435 PolarHBondContact NE-OG1 2.98Å; R389-T435 PolarHBondContact NH2-OG1 3.38Å; R389-L438 VanDerWaalsContact NH1-CD1 3.34Å
390	A	95.9	Very high	91.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.9	-39	177.6	0	0	0	0	0	112.8	A386 G388 L394 T435 L439 M500 L504	A386-A390 VanDerWaalsContact O-CB 3.3Å; A386-A390 WeakPolarHBondContact O-CB 3.32Å; A386-A390 PolarHBondContact O-N 3.21Å; G388-A390 PolarHBondContact O-N 3.04Å; A390-L394 WeakPolarHBondContact O-CB 3.43Å; A390-L394 WeakPolarHBondContact O-CD1 3.23Å; A390-L394 VanDerWaalsContact O-CG 3.22Å; A390-L394 WeakPolarHBondContact O-CG 3.32Å; A390-L394 PolarHBondContact O-N 3.18Å; A390-T435 HydrophobicContact CB-CG2 3.63Å; A390-L439 HydrophobicContact CB-CD1 3.89Å; A390-L439 HydrophobicContact CB-CD2 4.18Å; A390-L439 HydrophobicContact CB-CG 4.31Å; A390-M500 HydrophobicContact CB-CE 4.28Å; A390-L504 HydrophobicContact CB-CD1 3.71Å; A390-L504 HydrophobicContact CB-CD2 3.83Å; A390-L504 HydrophobicContact CB-CG 4.39Å
391	S	95.5	Very high	91.4	Very high	36 Å²	36	44.8 Å²	44.8	25%	0.252	25%	0.247	S	C	.	.	H	α-helix	trans	-66	-42.6	177.7	-58.9	0	0	0	0	112.2	V387 G388 R389 K395	V387-S391 VanDerWaalsContact O-CB 3.3Å; V387-S391 WeakPolarHBondContact O-CB 3.37Å; V387-S391 PolarHBondContact O-N 3.41Å; V387-S391 PolarHBondContact O-OG 3.46Å; G388-S391 WeakPolarHBondContact O-CB 3.41Å; G388-S391 PolarHBondContact O-N 3.15Å; G388-S391 VanDerWaalsContact O-N 3.08Å; R389-S391 VanDerWaalsContact C-N 3.31Å; R389-S391 PolarHBondContact O-N 3.34Å; S391-K395 WeakPolarHBondContact O-CE 3.35Å; S391-K395 VanDerWaalsContact O-CG 3.26Å; S391-K395 WeakPolarHBondContact O-CG 3.46Å; S391-K395 PolarHBondContact O-N 3.01Å
392	D	92.9	Very high	91.1	Very high	92 Å²	92	44 Å²	44	49%	0.492	24%	0.244	S	C	.	.	H	α-helix	trans	-76.2	-37.2	-177.9	-66.3	-31.1	0	0	0	112	G388 R389 K395 A396	G388-D392 PolarHBondContact O-N 3.42Å; R389-D392 PolarHBondContact O-N 2.89Å; D392-K395 WeakPolarHBondContact O-CB 3.35Å; D392-K395 PolarHBondContact O-N 3.09Å; D392-K395 IonicContact OD1-NZ 3.62Å; D392-K395 PolarHBondContact OD1-NZ 3.04Å; D392-A396 PolarHBondContact O-N 2.85Å
393	L	92.1	Very high	90.9	Very high	16 Å²	16	44.2 Å²	44.2	8%	0.084	25%	0.246	C	C	.	.	H	α-helix	trans	-61.1	-46.9	172.3	-167.5	81.4	0	0	0	111.5	R389 K395 A396 H397 Q431 L432 T435	R389-L393 WeakPolarHBondContact O-CB 3.18Å; R389-L393 PolarHBondContact O-N 3.45Å; L393-K395 VanDerWaalsContact C-N 3.3Å; L393-K395 PolarHBondContact O-N 2.72Å; L393-A396 PolarHBondContact O-N 2.74Å; L393-A396 VanDerWaalsContact O-N 3.14Å; L393-H397 WeakPolarHBondContact CG-NE2 3.37Å; L393-H397 PolarHBondContact O-CD2 3.1Å; L393-H397 PolarHBondContact O-N 2.71Å; L393-Q431 HydrophobicContact CD1-CB 3.93Å; L393-L432 HydrophobicContact CD2-CD2 3.58Å; L393-L432 HydrophobicContact CD2-CG 3.93Å; L393-L432 HydrophobicContact CG-CD2 4.46Å; L393-T435 HydrophobicContact CD2-CG2 4.39Å
394	L	93.1	Very high	90.8	Very high	30 Å²	30	50.8 Å²	50.8	16%	0.157	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-33	176.7	-75.3	168.6	0	0	0	112.9	A390 G398 L497 M500 A501 L504	A390-L394 WeakPolarHBondContact O-CB 3.43Å; A390-L394 WeakPolarHBondContact O-CD1 3.23Å; A390-L394 VanDerWaalsContact O-CG 3.22Å; A390-L394 WeakPolarHBondContact O-CG 3.32Å; A390-L394 PolarHBondContact O-N 3.18Å; L394-G398 PolarHBondContact O-N 3.26Å; L394-L497 HydrophobicContact CD2-CB 4.39Å; L394-L497 HydrophobicContact CD2-CD2 4.07Å; L394-M500 HydrophobicContact CD1-CG 4.46Å; L394-M500 HydrophobicContact CD2-CB 4.4Å; L394-M500 HydrophobicContact CD2-CG 4.39Å; L394-M500 HydrophobicContact CD2-SD 4.11Å; L394-M500 HydrophobicContact CG-SD 4.48Å; L394-A501 HydrophobicContact CD1-CB 3.96Å; L394-L504 HydrophobicContact CD1-CD2 3.74Å
395	K	91	Very high	90.7	Very high	143 Å²	143	46 Å²	46	62%	0.622	25%	0.253	S	S	*	.	H	α-helix	trans	-64.5	-48	170.8	-67	162.6	-154.4	166	0	110.8	S391 D392 L393 H397 G398	S391-K395 WeakPolarHBondContact O-CE 3.35Å; S391-K395 VanDerWaalsContact O-CG 3.26Å; S391-K395 WeakPolarHBondContact O-CG 3.46Å; S391-K395 PolarHBondContact O-N 3.01Å; D392-K395 WeakPolarHBondContact O-CB 3.35Å; D392-K395 PolarHBondContact O-N 3.09Å; D392-K395 IonicContact OD1-NZ 3.62Å; D392-K395 PolarHBondContact OD1-NZ 3.04Å; L393-K395 VanDerWaalsContact C-N 3.3Å; L393-K395 PolarHBondContact O-N 2.72Å; K395-H397 VanDerWaalsContact C-N 3.34Å; K395-H397 PolarHBondContact O-N 2.71Å; K395-G398 PolarHBondContact O-N 3.07Å; K395-G398 VanDerWaalsContact O-N 3.1Å
396	A	86.9	Confident	90.7	Very high	71 Å²	71	45.9 Å²	45.9	59%	0.587	25%	0.253	S	S	*	.	H	α-helix	trans	-63.2	-36.2	-178.2	0	0	0	0	0	113.1	D392 L393 G398	D392-A396 PolarHBondContact O-N 2.85Å; L393-A396 PolarHBondContact O-N 2.74Å; L393-A396 VanDerWaalsContact O-N 3.14Å; A396-G398 VanDerWaalsContact C-N 3.29Å; A396-G398 PolarHBondContact O-N 3.31Å
397	H	84.3	Confident	90.7	Very high	8 Å²	8	48.4 Å²	48.4	4%	0.037	26%	0.263	C	S	.	.	H	α-helix	trans	-72.7	-17.4	174.8	-66.7	-59.5	0	0	0	114.2	L393 K395 E399 H400 Q428 L497	L393-H397 WeakPolarHBondContact CG-NE2 3.37Å; L393-H397 PolarHBondContact O-CD2 3.1Å; L393-H397 PolarHBondContact O-N 2.71Å; K395-H397 VanDerWaalsContact C-N 3.34Å; K395-H397 PolarHBondContact O-N 2.71Å; H397-E399 PolarHBondContact O-N 3.4Å; H397-H400 PolarHBondContact O-N 3.41Å; H397-Q428 VanDerWaalsContact CE1-CD 3.45Å; H397-Q428 PolarHBondContact CE1-OE1 3.44Å; H397-Q428 PolarHBondContact ND1-OE1 3.45Å; H397-Q428 VanDerWaalsContact ND1-OE1 3.16Å; H397-L497 HydrophobicContact CB-CD1 3.91Å; H397-L497 HydrophobicContact CB-CD2 4.21Å
398	G	75.4	Confident	90.7	Very high	47 Å²	47	49.7 Å²	49.7	49%	0.485	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-9.9	-177.6	0	0	0	0	0	115.5	L394 K395 A396 H400	L394-G398 PolarHBondContact O-N 3.26Å; K395-G398 PolarHBondContact O-N 3.07Å; K395-G398 VanDerWaalsContact O-N 3.1Å; A396-G398 VanDerWaalsContact C-N 3.29Å; A396-G398 PolarHBondContact O-N 3.31Å; G398-H400 PolarHBondContact O-CD2 3.38Å; G398-H400 VanDerWaalsContact O-CD2 3.23Å
399	E	74.8	Confident	90.9	Very high	118 Å²	118	48.7 Å²	48.7	55%	0.551	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-10.7	171.2	-61	-167.4	169.3	0	0	113.5	H397 L401 R404	H397-E399 PolarHBondContact O-N 3.4Å; E399-L401 HydrophobicContact CB-CD1 4.41Å; E399-L401 HydrophobicContact CB-CD2 4.08Å; E399-L401 HydrophobicContact CB-CG 3.81Å; E399-L401 PolarHBondContact O-N 3.22Å; E399-L401 VanDerWaalsContact O-N 3.08Å; E399-R404 PolarHBondContact O-NE 3.19Å; E399-R404 PolarHBondContact O-NH1 3.12Å
400	H	82.5	Confident	91.1	Very high	52 Å²	52	47.7 Å²	47.7	24%	0.241	26%	0.262	C	S	.	.			trans	51.1	27.6	178.4	-51.3	-104.9	0	0	0	114.7	H397 G398 L403 R404 D494	H397-H400 PolarHBondContact O-N 3.41Å; G398-H400 PolarHBondContact O-CD2 3.38Å; G398-H400 VanDerWaalsContact O-CD2 3.23Å; H400-L403 PolarHBondContact O-N 3.03Å; H400-R404 HydrophobicContact CB-CG 4.48Å; H400-R404 WeakPolarHBondContact O-CG 3.24Å; H400-R404 PolarHBondContact O-N 3Å; H400-D494 VanDerWaalsContact CE1-CG 3.46Å; H400-D494 IonicContact CE1-OD1 3.38Å; H400-D494 PolarHBondContact CE1-OD1 2.78Å; H400-D494 IonicContact CE1-OD2 3.73Å; H400-D494 VanDerWaalsContact ND1-CG 3.25Å; H400-D494 IonicContact ND1-OD1 3.27Å; H400-D494 PolarHBondContact ND1-OD1 3.36Å; H400-D494 IonicContact ND1-OD2 2.67Å; H400-D494 PolarHBondContact ND1-OD2 3.02Å
401	L	86.1	Confident	91.1	Very high	102 Å²	102	49.9 Å²	49.9	53%	0.534	28%	0.28	S	S	.	.	H	α-helix	trans	-56.4	-49.5	-167.1	-61.2	178	0	0	0	114.2	E399 L403 R404 A405	E399-L401 HydrophobicContact CB-CD1 4.41Å; E399-L401 HydrophobicContact CB-CD2 4.08Å; E399-L401 HydrophobicContact CB-CG 3.81Å; E399-L401 PolarHBondContact O-N 3.22Å; E399-L401 VanDerWaalsContact O-N 3.08Å; L401-L403 VanDerWaalsContact C-N 3.34Å; L401-L403 PolarHBondContact O-N 2.92Å; L401-R404 PolarHBondContact O-N 2.99Å; L401-A405 WeakPolarHBondContact O-CB 3.44Å; L401-A405 PolarHBondContact O-N 3.18Å
402	P	90.6	Very high	91.2	Very high	10 Å²	10	55.1 Å²	55.1	7%	0.065	30%	0.301	C	S	.	.	H	α-helix	trans	-68.3	-31.8	-178.9	-21.8	36.4	0	0	0	113.1	A405 L406 T424	P402-A405 PolarHBondContact O-N 3.23Å; P402-L406 WeakPolarHBondContact O-CB 3.41Å; P402-L406 VanDerWaalsContact O-CG 3.3Å; P402-L406 WeakPolarHBondContact O-CG 3.38Å; P402-L406 PolarHBondContact O-N 2.83Å; P402-T424 HydrophobicContact CB-CG2 4.39Å; P402-T424 HydrophobicContact CG-CG2 3.88Å
403	L	94.7	Very high	91.4	Very high	8 Å²	8	52 Å²	52	4%	0.042	29%	0.29	C	S	.	.	H	α-helix	trans	-68.5	-39.8	175.8	-58.6	-175.3	0	0	0	111.4	H400 L401 K407 L425 I466 C490 W493 D494	H400-L403 PolarHBondContact O-N 3.03Å; L401-L403 VanDerWaalsContact C-N 3.34Å; L401-L403 PolarHBondContact O-N 2.92Å; L403-K407 WeakPolarHBondContact O-CB 3.33Å; L403-K407 WeakPolarHBondContact O-CG 3.4Å; L403-K407 PolarHBondContact O-N 3.43Å; L403-L425 HydrophobicContact CD2-CD1 3.86Å; L403-L425 HydrophobicContact CD2-CD2 4.04Å; L403-I466 HydrophobicContact CD2-CD1 4.06Å; L403-I466 HydrophobicContact CD2-CG2 4.17Å; L403-C490 HydrophobicContact CD1-CB 4.31Å; L403-W493 HydrophobicContact CD1-CG 4.34Å; L403-D494 WeakPolarHBondContact CD1-OD1 3.48Å
404	R	95	Very high	91.7	Very high	148 Å²	148	54.3 Å²	54.3	56%	0.558	30%	0.303	S	S	*	.	H	α-helix	trans	-64.9	-42.7	173.1	-68.3	173.1	-177.2	171.7	6.2	111.2	E399 H400 L401 K407 A408	E399-R404 PolarHBondContact O-NE 3.19Å; E399-R404 PolarHBondContact O-NH1 3.12Å; H400-R404 HydrophobicContact CB-CG 4.48Å; H400-R404 WeakPolarHBondContact O-CG 3.24Å; H400-R404 PolarHBondContact O-N 3Å; L401-R404 PolarHBondContact O-N 2.99Å; R404-K407 PolarHBondContact O-N 3.15Å; R404-A408 PolarHBondContact O-N 3.44Å
405	A	95.5	Very high	91.8	Very high	21 Å²	21	57 Å²	57	17%	0.174	32%	0.316	C	S	.	.	H	α-helix	trans	-65.1	-43.5	178	0	0	0	0	0	112.5	L401 P402 A408 A409 Y421	L401-A405 WeakPolarHBondContact O-CB 3.44Å; L401-A405 PolarHBondContact O-N 3.18Å; P402-A405 PolarHBondContact O-N 3.23Å; A405-A408 PolarHBondContact O-N 3.21Å; A405-A409 WeakPolarHBondContact O-CB 3.34Å; A405-A409 PolarHBondContact O-N 3.31Å; A405-Y421 HydrophobicContact CB-CD1 3.8Å; A405-Y421 HydrophobicContact CB-CD2 3.62Å; A405-Y421 HydrophobicContact CB-CE1 3.89Å; A405-Y421 HydrophobicContact CB-CE2 3.7Å; A405-Y421 HydrophobicContact CB-CG 3.67Å
406	L	96.6	Very high	92.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62.8	-42.2	172.7	-76.3	165.7	0	0	0	112.3	P402 A408 G410 V418 L425 I466 A470	P402-L406 WeakPolarHBondContact O-CB 3.41Å; P402-L406 VanDerWaalsContact O-CG 3.3Å; P402-L406 WeakPolarHBondContact O-CG 3.38Å; P402-L406 PolarHBondContact O-N 2.83Å; L406-A408 VanDerWaalsContact C-N 3.31Å; L406-A408 PolarHBondContact O-N 3.31Å; L406-G410 PolarHBondContact O-N 2.91Å; L406-V418 HydrophobicContact CD2-CG1 4.1Å; L406-L425 HydrophobicContact CD1-CB 4.12Å; L406-L425 HydrophobicContact CD1-CD2 3.57Å; L406-L425 HydrophobicContact CD1-CG 4.45Å; L406-I466 HydrophobicContact CD1-CG2 4.25Å; L406-A470 HydrophobicContact CB-CB 4.27Å; L406-A470 HydrophobicContact CD2-CB 4.01Å
407	K	97	Very high	92.6	Very high	52 Å²	52	55.5 Å²	55.5	23%	0.226	30%	0.302	C	S	.	.	H	α-helix	trans	-61.7	-37.1	174.2	-78.6	-177.8	178.4	-172.8	0	112.3	L403 R404 A411 L486 E487	L403-K407 WeakPolarHBondContact O-CB 3.33Å; L403-K407 WeakPolarHBondContact O-CG 3.4Å; L403-K407 PolarHBondContact O-N 3.43Å; R404-K407 PolarHBondContact O-N 3.15Å; K407-A411 WeakPolarHBondContact O-CB 3.43Å; K407-A411 PolarHBondContact O-N 3.14Å; K407-L486 HydrophobicContact CB-CD2 4.34Å; K407-L486 HydrophobicContact CG-CD2 3.79Å; K407-L486 HydrophobicContact CG-CG 3.97Å; K407-E487 IonicContact NZ-OE1 2.69Å; K407-E487 PolarHBondContact NZ-OE1 2.86Å
408	A	97.2	Very high	93.3	Very high	44 Å²	44	55.1 Å²	55.1	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-72.4	-58.1	176.3	0	0	0	0	0	112.2	R404 A405 L406 G410 A411 E412	R404-A408 PolarHBondContact O-N 3.44Å; A405-A408 PolarHBondContact O-N 3.21Å; L406-A408 VanDerWaalsContact C-N 3.31Å; L406-A408 PolarHBondContact O-N 3.31Å; A408-G410 PolarHBondContact O-N 3.27Å; A408-A411 CarbonylContact O-C 3.59Å; A408-A411 WeakPolarHBondContact O-CA 3.48Å; A408-A411 PolarHBondContact O-N 2.98Å; A408-E412 WeakPolarHBondContact O-CG 3.37Å; A408-E412 PolarHBondContact O-N 3.31Å
409	A	97.6	Very high	94.3	Very high	3 Å²	3	55.4 Å²	55.4	3%	0.025	30%	0.298	C	S	.	.	H	α-helix	trans	-58.2	-36.2	-178.9	0	0	0	0	0	112.7	A405 E412 G413 N414 A417 V418 Y421	A405-A409 WeakPolarHBondContact O-CB 3.34Å; A405-A409 PolarHBondContact O-N 3.31Å; A409-E412 PolarHBondContact O-N 2.71Å; A409-G413 PolarHBondContact O-N 3.41Å; A409-N414 PolarHBondContact O-N 2.98Å; A409-A417 HydrophobicContact CB-CB 3.79Å; A409-V418 HydrophobicContact CB-CG2 3.72Å; A409-Y421 HydrophobicContact CB-CD2 4.18Å; A409-Y421 HydrophobicContact CB-CE2 4.26Å
410	G	97.5	Very high	95.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.3	-48.5	171.2	0	0	0	0	0	112.6	L406 A408 E412 G413 L473 A474	L406-G410 PolarHBondContact O-N 2.91Å; A408-G410 PolarHBondContact O-N 3.27Å; G410-E412 PolarHBondContact O-N 2.83Å; G410-G413 PolarHBondContact O-N 3.48Å; G410-G413 VanDerWaalsContact O-N 3.09Å; G410-L473 CarbonylContact O-C 3.59Å; G410-A474 WeakPolarHBondContact O-CA 3.48Å
411	A	97.4	Very high	96	Very high	47 Å²	47	55.9 Å²	55.9	39%	0.388	30%	0.298	S	S	.	.	H	α-helix	trans	-67.7	-19.9	178.6	0	0	0	0	0	113.8	K407 A408 L473	K407-A411 WeakPolarHBondContact O-CB 3.43Å; K407-A411 PolarHBondContact O-N 3.14Å; A408-A411 CarbonylContact O-C 3.59Å; A408-A411 WeakPolarHBondContact O-CA 3.48Å; A408-A411 PolarHBondContact O-N 2.98Å; A411-L473 HydrophobicContact CB-CD2 4.43Å
412	E	97.5	Very high	96.5	Very high	146 Å²	146	51.6 Å²	51.6	68%	0.682	28%	0.276	S	S	*	.	H	α-helix	trans	-85.6	-14.8	172.5	-70.5	170.1	-167.8	0	0	113.4	A408 A409 G410 N414	A408-E412 WeakPolarHBondContact O-CG 3.37Å; A408-E412 PolarHBondContact O-N 3.31Å; A409-E412 PolarHBondContact O-N 2.71Å; G410-E412 PolarHBondContact O-N 2.83Å; E412-N414 VanDerWaalsContact C-N 3.33Å; E412-N414 HydrophobicContact CB-CB 4.48Å
413	G	97.3	Very high	96.8	Very high	26 Å²	26	57.2 Å²	57.2	27%	0.268	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	12.2	-172.8	0	0	0	0	0	114.8	A409 G410 L415 A474 P477	A409-G413 PolarHBondContact O-N 3.41Å; G410-G413 PolarHBondContact O-N 3.48Å; G410-G413 VanDerWaalsContact O-N 3.09Å; G413-L415 PolarHBondContact O-N 3.47Å; G413-L415 VanDerWaalsContact O-N 3.1Å; G413-A474 WeakPolarHBondContact CA-O 3.36Å; G413-P477 VanDerWaalsContact CA-CG 3.41Å
414	N	97.3	Very high	96.7	Very high	65 Å²	65	59 Å²	59	35%	0.348	31%	0.307	S	S	.	.			trans	-84.9	86.3	-174.1	-170.5	-16.1	0	0	0	111.5	A409 E412 E416 A417 V418	A409-N414 PolarHBondContact O-N 2.98Å; E412-N414 VanDerWaalsContact C-N 3.33Å; E412-N414 HydrophobicContact CB-CB 4.48Å; N414-E416 VanDerWaalsContact C-N 3.25Å; N414-E416 PolarHBondContact O-N 2.75Å; N414-E416 PolarHBondContact OD1-N 2.95Å; N414-A417 HydrophobicContact CB-CB 4.08Å; N414-A417 VanDerWaalsContact CG-CB 3.46Å; N414-A417 WeakPolarHBondContact ND2-CB 3.29Å; N414-A417 PolarHBondContact O-N 3.42Å; N414-A417 PolarHBondContact OD1-N 3.49Å; N414-V418 WeakPolarHBondContact O-CG2 3.37Å; N414-V418 PolarHBondContact O-N 2.94Å
415	L	96.6	Very high	96.8	Very high	85 Å²	85	52 Å²	52	45%	0.445	28%	0.281	S	S	.	.	H	α-helix	trans	-59	-31.5	178.3	-73.8	167.2	0	0	0	113.7	G413 A419 A474 L475	G413-L415 PolarHBondContact O-N 3.47Å; G413-L415 VanDerWaalsContact O-N 3.1Å; L415-A419 WeakPolarHBondContact O-CB 3.38Å; L415-A419 PolarHBondContact O-N 2.98Å; L415-A474 HydrophobicContact CD2-CB 3.56Å; L415-A474 HydrophobicContact CG-CB 4.03Å; L415-L475 HydrophobicContact CD1-CD2 4.1Å; L415-L475 HydrophobicContact CD2-CD2 4.4Å; L415-L475 HydrophobicContact CD2-CG 4.37Å
416	E	97	Very high	96.8	Very high	167 Å²	167	53.7 Å²	53.7	78%	0.78	29%	0.289	S	S	*	.	H	α-helix	trans	-71.8	-46.8	179.3	-174.2	170.3	-160	0	0	111.1	N414 V418 A419 E420	N414-E416 VanDerWaalsContact C-N 3.25Å; N414-E416 PolarHBondContact O-N 2.75Å; N414-E416 PolarHBondContact OD1-N 2.95Å; E416-V418 VanDerWaalsContact C-N 3.34Å; E416-V418 PolarHBondContact O-N 3.23Å; E416-A419 WeakPolarHBondContact O-CB 3.46Å; E416-A419 PolarHBondContact O-N 3.13Å; E416-A419 VanDerWaalsContact O-N 3.15Å; E416-E420 PolarHBondContact O-N 3.06Å
417	A	97.1	Very high	96.7	Very high	16 Å²	16	58.4 Å²	58.4	13%	0.132	31%	0.311	C	S	.	.	H	α-helix	trans	-64.9	-36.4	173	0	0	0	0	0	112.2	A409 N414 A419 E420 Y421	A409-A417 HydrophobicContact CB-CB 3.79Å; N414-A417 HydrophobicContact CB-CB 4.08Å; N414-A417 VanDerWaalsContact CG-CB 3.46Å; N414-A417 WeakPolarHBondContact ND2-CB 3.29Å; N414-A417 PolarHBondContact O-N 3.42Å; N414-A417 PolarHBondContact OD1-N 3.49Å; A417-A419 VanDerWaalsContact C-N 3.34Å; A417-A419 PolarHBondContact O-N 3.22Å; A417-E420 PolarHBondContact O-N 3.25Å; A417-Y421 HydrophobicContact CB-CD2 4.43Å; A417-Y421 HydrophobicContact CB-CE2 4.08Å; A417-Y421 WeakPolarHBondContact O-CD2 3.48Å; A417-Y421 PolarHBondContact O-N 3.23Å
418	V	97.8	Very high	96.5	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-61.1	-42.8	170.9	167.5	0	0	0	0	110.9	L406 A409 N414 E416 E420 S422 A470 Q471 A474	L406-V418 HydrophobicContact CD2-CG1 4.1Å; A409-V418 HydrophobicContact CB-CG2 3.72Å; N414-V418 WeakPolarHBondContact O-CG2 3.37Å; N414-V418 PolarHBondContact O-N 2.94Å; E416-V418 VanDerWaalsContact C-N 3.34Å; E416-V418 PolarHBondContact O-N 3.23Å; V418-E420 PolarHBondContact O-N 2.96Å; V418-S422 WeakPolarHBondContact O-CB 3.41Å; V418-S422 PolarHBondContact O-N 3.02Å; V418-S422 PolarHBondContact O-OG 3.36Å; V418-A470 HydrophobicContact CG1-CB 4.06Å; V418-Q471 HydrophobicContact CG1-CG 4Å; V418-A474 HydrophobicContact CG2-CB 4.16Å
419	A	96.9	Very high	96.4	Very high	52 Å²	52	56.3 Å²	56.3	43%	0.43	29%	0.294	S	S	.	.	H	α-helix	trans	-65	-36.6	176.5	0	0	0	0	0	112.7	L415 E416 A417 R423	L415-A419 WeakPolarHBondContact O-CB 3.38Å; L415-A419 PolarHBondContact O-N 2.98Å; E416-A419 WeakPolarHBondContact O-CB 3.46Å; E416-A419 PolarHBondContact O-N 3.13Å; E416-A419 VanDerWaalsContact O-N 3.15Å; A417-A419 VanDerWaalsContact C-N 3.34Å; A417-A419 PolarHBondContact O-N 3.22Å; A419-R423 PolarHBondContact O-N 2.65Å
420	E	95.9	Very high	96.3	Very high	95 Å²	95	59.7 Å²	59.7	44%	0.444	31%	0.309	S	S	.	.	H	α-helix	trans	-63.5	-57.7	172.2	171.2	142.1	-105	0	0	112.3	E416 A417 V418 S422 R423 T424	E416-E420 PolarHBondContact O-N 3.06Å; A417-E420 PolarHBondContact O-N 3.25Å; V418-E420 PolarHBondContact O-N 2.96Å; E420-S422 PolarHBondContact O-N 3.09Å; E420-S422 VanDerWaalsContact O-N 3.16Å; E420-R423 WeakPolarHBondContact O-CB 3.33Å; E420-R423 PolarHBondContact O-N 2.71Å; E420-R423 IonicContact OE1-CZ 2.7Å; E420-R423 IonicContact OE1-NH1 3.53Å; E420-R423 IonicContact OE1-NH2 2.7Å; E420-R423 PolarHBondContact OE1-NH2 2.91Å; E420-T424 PolarHBondContact O-N 3.22Å
421	Y	97	Very high	96.2	Very high	86 Å²	86	62.3 Å²	62.3	34%	0.337	32%	0.322	S	S	.	.	H	α-helix	trans	-66	-20.6	-178.8	-58.8	-51	0	0	0	112.9	A405 A409 A417 T424 L425	A405-Y421 HydrophobicContact CB-CD1 3.8Å; A405-Y421 HydrophobicContact CB-CD2 3.62Å; A405-Y421 HydrophobicContact CB-CE1 3.89Å; A405-Y421 HydrophobicContact CB-CE2 3.7Å; A405-Y421 HydrophobicContact CB-CG 3.67Å; A409-Y421 HydrophobicContact CB-CD2 4.18Å; A409-Y421 HydrophobicContact CB-CE2 4.26Å; A417-Y421 HydrophobicContact CB-CD2 4.43Å; A417-Y421 HydrophobicContact CB-CE2 4.08Å; A417-Y421 WeakPolarHBondContact O-CD2 3.48Å; A417-Y421 PolarHBondContact O-N 3.23Å; Y421-T424 PolarHBondContact O-N 3.48Å; Y421-L425 WeakPolarHBondContact O-CB 3.32Å; Y421-L425 PolarHBondContact O-N 3.4Å
422	S	97.1	Very high	96.1	Very high	11 Å²	11	60.1 Å²	60.1	8%	0.077	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-33.2	169.7	-63.5	0	0	0	0	112.8	V418 E420 T426 I467	V418-S422 WeakPolarHBondContact O-CB 3.41Å; V418-S422 PolarHBondContact O-N 3.02Å; V418-S422 PolarHBondContact O-OG 3.36Å; E420-S422 PolarHBondContact O-N 3.09Å; E420-S422 VanDerWaalsContact O-N 3.16Å; S422-T426 WeakPolarHBondContact O-CB 3.44Å; S422-T426 PolarHBondContact O-N 3.11Å; S422-T426 PolarHBondContact O-OG1 3.04Å; S422-I467 WeakPolarHBondContact OG-CG2 3.32Å
423	R	96.1	Very high	96	Very high	128 Å²	128	53.4 Å²	53.4	48%	0.483	27%	0.272	S	S	.	.	H	α-helix	trans	-64.6	-50.1	171.7	-68.1	-176.7	-79.1	104.4	-5.6	110.3	A419 E420 L425 T426 E427	A419-R423 PolarHBondContact O-N 2.65Å; E420-R423 WeakPolarHBondContact O-CB 3.33Å; E420-R423 PolarHBondContact O-N 2.71Å; E420-R423 IonicContact OE1-CZ 2.7Å; E420-R423 IonicContact OE1-NH1 3.53Å; E420-R423 IonicContact OE1-NH2 2.7Å; E420-R423 PolarHBondContact OE1-NH2 2.91Å; R423-L425 PolarHBondContact O-N 2.74Å; R423-T426 WeakPolarHBondContact O-CA 3.45Å; R423-T426 WeakPolarHBondContact O-CB 3.46Å; R423-T426 PolarHBondContact O-N 3.12Å; R423-E427 WeakPolarHBondContact O-CG 3.27Å; R423-E427 PolarHBondContact O-N 3.44Å
424	T	94.3	Very high	95.9	Very high	46 Å²	46	53.6 Å²	53.6	28%	0.282	27%	0.266	S	S	.	.	H	α-helix	trans	-59.3	-41.9	177.8	-47.3	0	0	0	0	112.6	P402 E420 Y421 T426 E427 Q428	P402-T424 HydrophobicContact CB-CG2 4.39Å; P402-T424 HydrophobicContact CG-CG2 3.88Å; E420-T424 PolarHBondContact O-N 3.22Å; Y421-T424 PolarHBondContact O-N 3.48Å; T424-T426 VanDerWaalsContact C-N 3.33Å; T424-T426 PolarHBondContact O-N 3.46Å; T424-E427 PolarHBondContact O-N 2.94Å; T424-Q428 WeakPolarHBondContact O-CB 3.43Å; T424-Q428 WeakPolarHBondContact O-CG 3.43Å; T424-Q428 PolarHBondContact O-N 3.49Å
425	L	95.7	Very high	95.9	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-66.2	-34.8	174.4	-178.5	60.3	0	0	0	112	L403 L406 Y421 R423 Q428 K429 I466 I467 W493	L403-L425 HydrophobicContact CD2-CD1 3.86Å; L403-L425 HydrophobicContact CD2-CD2 4.04Å; L406-L425 HydrophobicContact CD1-CB 4.12Å; L406-L425 HydrophobicContact CD1-CD2 3.57Å; L406-L425 HydrophobicContact CD1-CG 4.45Å; Y421-L425 WeakPolarHBondContact O-CB 3.32Å; Y421-L425 PolarHBondContact O-N 3.4Å; R423-L425 PolarHBondContact O-N 2.74Å; L425-Q428 PolarHBondContact O-N 3.07Å; L425-K429 VanDerWaalsContact O-CB 3.3Å; L425-K429 WeakPolarHBondContact O-CB 3.31Å; L425-K429 PolarHBondContact O-N 3.37Å; L425-I466 HydrophobicContact CD2-CB 3.98Å; L425-I466 HydrophobicContact CD2-CD1 4.46Å; L425-I466 HydrophobicContact CD2-CG2 3.62Å; L425-I467 HydrophobicContact CD2-CG1 4.18Å; L425-W493 HydrophobicContact CD1-CH2 4.03Å; L425-W493 HydrophobicContact CD1-CZ2 3.8Å
426	T	96.6	Very high	95.9	Very high	56 Å²	56	46.4 Å²	46.4	34%	0.344	23%	0.229	S	C	.	.	H	α-helix	trans	-67.6	-44.1	176	-57.3	0	0	0	0	111.4	S422 R423 T424 Q428 K429 E430	S422-T426 WeakPolarHBondContact O-CB 3.44Å; S422-T426 PolarHBondContact O-N 3.11Å; S422-T426 PolarHBondContact O-OG1 3.04Å; R423-T426 WeakPolarHBondContact O-CA 3.45Å; R423-T426 WeakPolarHBondContact O-CB 3.46Å; R423-T426 PolarHBondContact O-N 3.12Å; T424-T426 VanDerWaalsContact C-N 3.33Å; T424-T426 PolarHBondContact O-N 3.46Å; T426-Q428 VanDerWaalsContact C-N 3.34Å; T426-Q428 PolarHBondContact O-N 2.8Å; T426-K429 WeakPolarHBondContact O-CB 3.35Å; T426-K429 PolarHBondContact O-N 3.04Å; T426-K429 VanDerWaalsContact O-N 3.13Å; T426-E430 PolarHBondContact O-N 2.99Å
427	E	93.9	Very high	95.7	Very high	99 Å²	99	43.3 Å²	43.3	46%	0.463	21%	0.21	S	C	.	.	H	α-helix	trans	-59	-44	173.8	-69	157.8	-161.5	0	0	111.5	R423 T424 E430 Q431	R423-E427 WeakPolarHBondContact O-CG 3.27Å; R423-E427 PolarHBondContact O-N 3.44Å; T424-E427 PolarHBondContact O-N 2.94Å; E427-E430 PolarHBondContact O-N 3.4Å; E427-Q431 WeakPolarHBondContact O-CG 3.08Å; E427-Q431 PolarHBondContact O-N 3.29Å; E427-Q431 VanDerWaalsContact O-N 3.12Å
428	Q	92.8	Very high	95.7	Very high	39 Å²	39	42.7 Å²	42.7	18%	0.182	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-38.6	173.3	-78.2	-164.4	-2.5	0	0	112.7	H397 T424 L425 T426 Q431 L432	H397-Q428 VanDerWaalsContact CE1-CD 3.45Å; H397-Q428 PolarHBondContact CE1-OE1 3.44Å; H397-Q428 PolarHBondContact ND1-OE1 3.45Å; H397-Q428 VanDerWaalsContact ND1-OE1 3.16Å; T424-Q428 WeakPolarHBondContact O-CB 3.43Å; T424-Q428 WeakPolarHBondContact O-CG 3.43Å; T424-Q428 PolarHBondContact O-N 3.49Å; L425-Q428 PolarHBondContact O-N 3.07Å; T426-Q428 VanDerWaalsContact C-N 3.34Å; T426-Q428 PolarHBondContact O-N 2.8Å; Q428-Q431 PolarHBondContact O-N 2.99Å; Q428-L432 WeakPolarHBondContact O-CD1 3.38Å; Q428-L432 WeakPolarHBondContact O-CG 3.4Å; Q428-L432 PolarHBondContact O-N 3.07Å
429	K	95.2	Very high	95.6	Very high	14 Å²	14	42.7 Å²	42.7	6%	0.061	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-44.7	176.6	-171.5	-136.4	70.3	175.7	0	111.9	L425 T426 L432 V433 F459 W493	L425-K429 VanDerWaalsContact O-CB 3.3Å; L425-K429 WeakPolarHBondContact O-CB 3.31Å; L425-K429 PolarHBondContact O-N 3.37Å; T426-K429 WeakPolarHBondContact O-CB 3.35Å; T426-K429 PolarHBondContact O-N 3.04Å; T426-K429 VanDerWaalsContact O-N 3.13Å; K429-L432 PolarHBondContact O-N 3.22Å; K429-V433 HydrophobicContact CG-CG2 4.5Å; K429-V433 WeakPolarHBondContact O-CB 3.37Å; K429-V433 VanDerWaalsContact O-CG2 3.23Å; K429-V433 WeakPolarHBondContact O-CG2 3.33Å; K429-V433 PolarHBondContact O-N 3.17Å; K429-F459 WeakPolarHBondContact CG-O 3.29Å; K429-W493 HydrophobicContact CB-CH2 3.82Å; K429-W493 HydrophobicContact CB-CZ3 4.4Å; K429-W493 HydrophobicContact CG-CH2 4.01Å; K429-W493 HydrophobicContact CG-CZ3 4.13Å
430	E	95.6	Very high	95.6	Very high	73 Å²	73	41 Å²	41	34%	0.341	19%	0.189	S	C	.	.	H	α-helix	trans	-66.3	-39.6	176.4	-54.9	-52.6	172.3	0	0	111.9	T426 E427 L432 V433 E434	T426-E430 PolarHBondContact O-N 2.99Å; E427-E430 PolarHBondContact O-N 3.4Å; E430-L432 VanDerWaalsContact C-N 3.32Å; E430-L432 PolarHBondContact O-N 3.15Å; E430-V433 PolarHBondContact O-N 2.97Å; E430-E434 WeakPolarHBondContact O-CB 3.32Å; E430-E434 PolarHBondContact O-N 3.02Å
431	Q	94.9	Very high	95.6	Very high	56 Å²	56	37.4 Å²	37.4	26%	0.262	17%	0.172	S	C	.	.	H	α-helix	trans	-57.8	-43.7	174.1	-73.4	173	36.8	0	0	112.2	Y322 R389 L393 E427 Q428 T435	Y322-Q431 HydrophobicContact CD1-CG 3.77Å; Y322-Q431 HydrophobicContact CD2-CG 4.16Å; Y322-Q431 HydrophobicContact CE1-CG 3.41Å; Y322-Q431 VanDerWaalsContact CE1-CG 3.41Å; Y322-Q431 HydrophobicContact CE2-CG 3.81Å; Y322-Q431 HydrophobicContact CG-CG 4.13Å; Y322-Q431 VanDerWaalsContact CZ-CG 3.42Å; R389-Q431 PolarHBondContact NH2-O 2.82Å; L393-Q431 HydrophobicContact CD1-CB 3.93Å; E427-Q431 WeakPolarHBondContact O-CG 3.08Å; E427-Q431 PolarHBondContact O-N 3.29Å; E427-Q431 VanDerWaalsContact O-N 3.12Å; Q428-Q431 PolarHBondContact O-N 2.99Å; Q431-T435 VanDerWaalsContact O-CB 3.28Å; Q431-T435 WeakPolarHBondContact O-CB 3.45Å; Q431-T435 PolarHBondContact O-N 3.28Å; Q431-T435 PolarHBondContact O-OG1 2.67Å
432	L	95.8	Very high	95.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66	-51.4	176.5	-77.2	160.1	0	0	0	112.2	L393 Q428 K429 E430 E434 T435 C436 F459 W493 L497 M500	L393-L432 HydrophobicContact CD2-CD2 3.58Å; L393-L432 HydrophobicContact CD2-CG 3.93Å; L393-L432 HydrophobicContact CG-CD2 4.46Å; Q428-L432 WeakPolarHBondContact O-CD1 3.38Å; Q428-L432 WeakPolarHBondContact O-CG 3.4Å; Q428-L432 PolarHBondContact O-N 3.07Å; K429-L432 PolarHBondContact O-N 3.22Å; E430-L432 VanDerWaalsContact C-N 3.32Å; E430-L432 PolarHBondContact O-N 3.15Å; L432-E434 PolarHBondContact O-N 3.35Å; L432-T435 PolarHBondContact O-N 3.44Å; L432-T435 VanDerWaalsContact O-N 3.16Å; L432-C436 PolarHBondContact O-N 3.18Å; L432-C436 PolarHBondContact O-SG 2.63Å; L432-F459 HydrophobicContact CB-CB 4.39Å; L432-F459 HydrophobicContact CB-CD1 4.36Å; L432-F459 HydrophobicContact CB-CD2 3.95Å; L432-F459 HydrophobicContact CB-CE2 4.27Å; L432-F459 HydrophobicContact CB-CG 4Å; L432-F459 HydrophobicContact CD1-CD1 3.91Å; L432-F459 HydrophobicContact CD1-CE1 3.92Å; L432-F459 HydrophobicContact CD1-CG 4.39Å; L432-F459 HydrophobicContact CD1-CZ 4.39Å; L432-F459 HydrophobicContact CD2-CE1 4.25Å; L432-F459 HydrophobicContact CD2-CE2 4.06Å; L432-F459 HydrophobicContact CD2-CZ 3.89Å; L432-W493 HydrophobicContact CD1-CH2 3.77Å; L432-W493 HydrophobicContact CD1-CZ2 3.29Å; L432-L497 HydrophobicContact CD1-CD2 4.15Å; L432-L497 HydrophobicContact CD2-CD2 3.7Å; L432-M500 HydrophobicContact CD2-CE 4.33Å; L432-M500 HydrophobicContact CD2-SD 3.66Å
433	V	95.8	Very high	95.2	Very high	5 Å²	5	33.2 Å²	33.2	3%	0.03	16%	0.155	C	C	.	.	H	α-helix	trans	-52	-53	177.5	159.3	0	0	0	0	111	K429 E430 T435 C436 R437 E456 F459 H460	K429-V433 HydrophobicContact CG-CG2 4.5Å; K429-V433 WeakPolarHBondContact O-CB 3.37Å; K429-V433 VanDerWaalsContact O-CG2 3.23Å; K429-V433 WeakPolarHBondContact O-CG2 3.33Å; K429-V433 PolarHBondContact O-N 3.17Å; E430-V433 PolarHBondContact O-N 2.97Å; V433-T435 VanDerWaalsContact C-N 3.35Å; V433-T435 PolarHBondContact O-N 3.16Å; V433-C436 WeakPolarHBondContact O-CB 3.41Å; V433-C436 PolarHBondContact O-N 2.84Å; V433-R437 PolarHBondContact O-N 3.28Å; V433-R437 VanDerWaalsContact O-N 3.08Å; V433-E456 HydrophobicContact CB-CG 4.26Å; V433-E456 HydrophobicContact CG1-CG 3.73Å; V433-E456 HydrophobicContact CG2-CG 4.48Å; V433-F459 HydrophobicContact CG2-CB 4.07Å; V433-H460 HydrophobicContact CG2-CB 4.03Å
434	E	94.9	Very high	94.9	Very high	30 Å²	30	27.4 Å²	27.4	14%	0.14	14%	0.135	C	C	.	.	H	α-helix	trans	-69.2	-33.2	-178.9	-164.9	-159.2	98.9	0	0	112	S320 Y322 R389 E430 L432 R437 L438	S320-E434 VanDerWaalsContact CB-OE1 3.31Å; S320-E434 WeakPolarHBondContact CB-OE1 3.41Å; S320-E434 PolarHBondContact OG-OE1 3.01Å; Y322-E434 WeakPolarHBondContact CD2-OE1 3.35Å; Y322-E434 WeakPolarHBondContact CD2-OE2 3.31Å; R389-E434 IonicContact CZ-OE1 3.21Å; R389-E434 IonicContact NH1-OE1 3.77Å; R389-E434 PolarHBondContact NH1-OE1 2.66Å; R389-E434 IonicContact NH2-OE1 3.08Å; R389-E434 PolarHBondContact NH2-OE1 3.36Å; E430-E434 WeakPolarHBondContact O-CB 3.32Å; E430-E434 PolarHBondContact O-N 3.02Å; L432-E434 PolarHBondContact O-N 3.35Å; E434-R437 WeakPolarHBondContact O-CB 3.43Å; E434-R437 PolarHBondContact O-N 3.47Å; E434-L438 WeakPolarHBondContact O-CG 3.32Å; E434-L438 PolarHBondContact O-N 3.21Å
435	T	96	Very high	94.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.3	-39.2	173.7	-56.3	0	0	0	0	111.9	R389 A390 L393 Q431 L432 V433 R437 L438 L439 M500	R389-T435 HydrophobicContact CG-CG2 4.28Å; R389-T435 PolarHBondContact NE-OG1 2.98Å; R389-T435 PolarHBondContact NH2-OG1 3.38Å; A390-T435 HydrophobicContact CB-CG2 3.63Å; L393-T435 HydrophobicContact CD2-CG2 4.39Å; Q431-T435 VanDerWaalsContact O-CB 3.28Å; Q431-T435 WeakPolarHBondContact O-CB 3.45Å; Q431-T435 PolarHBondContact O-N 3.28Å; Q431-T435 PolarHBondContact O-OG1 2.67Å; L432-T435 PolarHBondContact O-N 3.44Å; L432-T435 VanDerWaalsContact O-N 3.16Å; V433-T435 VanDerWaalsContact C-N 3.35Å; V433-T435 PolarHBondContact O-N 3.16Å; T435-R437 VanDerWaalsContact C-N 3.29Å; T435-R437 PolarHBondContact O-N 3.45Å; T435-L438 PolarHBondContact O-N 3.3Å; T435-L439 HydrophobicContact CG2-CD1 4.44Å; T435-L439 WeakPolarHBondContact O-CG 3.43Å; T435-L439 PolarHBondContact O-N 2.75Å; T435-M500 HydrophobicContact CG2-CE 3.66Å
436	C	96.4	Very high	94.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.3	-38.8	172	-73.8	0	0	0	0	111.6	L432 V433 L439 C440 E456	L432-C436 PolarHBondContact O-N 3.18Å; L432-C436 PolarHBondContact O-SG 2.63Å; V433-C436 WeakPolarHBondContact O-CB 3.41Å; V433-C436 PolarHBondContact O-N 2.84Å; C436-L439 PolarHBondContact O-N 2.93Å; C436-C440 PolarHBondContact O-N 2.94Å; C436-E456 HydrophobicContact CB-CB 3.84Å
437	R	94.7	Very high	94	Very high	102 Å²	102	29.1 Å²	29.1	39%	0.385	14%	0.14	S	C	.	.	H	α-helix	trans	-60.8	-53.6	173.2	-159.2	178.5	-57.3	142.9	6.6	111.5	V433 E434 T435 L439 C440 H441 E456	V433-R437 PolarHBondContact O-N 3.28Å; V433-R437 VanDerWaalsContact O-N 3.08Å; E434-R437 WeakPolarHBondContact O-CB 3.43Å; E434-R437 PolarHBondContact O-N 3.47Å; T435-R437 VanDerWaalsContact C-N 3.29Å; T435-R437 PolarHBondContact O-N 3.45Å; R437-L439 VanDerWaalsContact C-N 3.28Å; R437-L439 PolarHBondContact O-N 3.15Å; R437-C440 WeakPolarHBondContact O-CA 3.47Å; R437-C440 WeakPolarHBondContact O-CB 3.26Å; R437-C440 PolarHBondContact O-N 2.89Å; R437-H441 PolarHBondContact O-CD2 2.95Å; R437-H441 PolarHBondContact O-N 3.42Å; R437-E456 IonicContact CZ-OE1 2.93Å; R437-E456 VanDerWaalsContact CZ-OE1 3.27Å; R437-E456 IonicContact NE-OE1 2.69Å; R437-E456 PolarHBondContact NE-OE1 3.4Å; R437-E456 IonicContact NE-OE2 2.67Å; R437-E456 IonicContact NH2-OE1 3.35Å; R437-E456 PolarHBondContact NH2-OE1 3.06Å
438	L	95.9	Very high	93.9	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.016	12%	0.119	C	C	.	.	H	α-helix	trans	-55.3	-41.1	176.8	-64.9	-170.5	0	0	0	112.9	D316 F317 A386 R389 E434 T435 C440 H441	D316-L438 HydrophobicContact CB-CD2 4.48Å; D316-L438 WeakPolarHBondContact O-CD2 3.42Å; F317-L438 HydrophobicContact CD1-CD1 4.29Å; F317-L438 HydrophobicContact CD1-CD2 4.09Å; F317-L438 HydrophobicContact CD2-CD2 3.7Å; F317-L438 HydrophobicContact CE1-CB 4.24Å; F317-L438 HydrophobicContact CE1-CD1 4.41Å; F317-L438 HydrophobicContact CE1-CD2 4.17Å; F317-L438 HydrophobicContact CE2-CD2 3.76Å; F317-L438 HydrophobicContact CG-CD2 3.85Å; F317-L438 HydrophobicContact CZ-CB 4.11Å; F317-L438 HydrophobicContact CZ-CD2 3.99Å; A386-L438 HydrophobicContact CB-CB 4.1Å; R389-L438 VanDerWaalsContact NH1-CD1 3.34Å; E434-L438 WeakPolarHBondContact O-CG 3.32Å; E434-L438 PolarHBondContact O-N 3.21Å; T435-L438 PolarHBondContact O-N 3.3Å; L438-C440 VanDerWaalsContact C-N 3.3Å; L438-C440 PolarHBondContact O-N 3.42Å; L438-H441 PolarHBondContact O-N 2.74Å
439	L	96.8	Very high	93.9	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-61.9	-35.6	174.3	-73.6	172.5	0	0	0	112.4	A386 V387 A390 T435 C436 R437 H441 V442 S443 M500 L504 I507	A386-L439 HydrophobicContact CB-CD2 4.23Å; V387-L439 HydrophobicContact CG2-CD2 4.25Å; A390-L439 HydrophobicContact CB-CD1 3.89Å; A390-L439 HydrophobicContact CB-CD2 4.18Å; A390-L439 HydrophobicContact CB-CG 4.31Å; T435-L439 HydrophobicContact CG2-CD1 4.44Å; T435-L439 WeakPolarHBondContact O-CG 3.43Å; T435-L439 PolarHBondContact O-N 2.75Å; C436-L439 PolarHBondContact O-N 2.93Å; R437-L439 VanDerWaalsContact C-N 3.28Å; R437-L439 PolarHBondContact O-N 3.15Å; L439-H441 VanDerWaalsContact C-N 3.34Å; L439-H441 PolarHBondContact O-N 3.01Å; L439-V442 WeakPolarHBondContact O-CG2 3.49Å; L439-V442 PolarHBondContact O-N 3.17Å; L439-S443 WeakPolarHBondContact O-CA 3.21Å; L439-S443 VanDerWaalsContact O-CB 3.3Å; L439-S443 WeakPolarHBondContact O-CB 3.4Å; L439-S443 PolarHBondContact O-N 2.85Å; L439-M500 HydrophobicContact CD1-CE 4.03Å; L439-L504 HydrophobicContact CD1-CD1 4.39Å; L439-L504 HydrophobicContact CD2-CD1 3.68Å; L439-I507 HydrophobicContact CB-CD1 3.99Å; L439-I507 HydrophobicContact CD2-CD1 4.21Å
440	C	95.8	Very high	93.8	Very high	17 Å²	17	23.5 Å²	23.5	12%	0.115	11%	0.114	C	C	.	.	H	α-helix	trans	-57.2	-46	176.2	-165.2	0	0	0	0	111.7	C436 R437 L438 V442 S443 C452	C436-C440 PolarHBondContact O-N 2.94Å; R437-C440 WeakPolarHBondContact O-CA 3.47Å; R437-C440 WeakPolarHBondContact O-CB 3.26Å; R437-C440 PolarHBondContact O-N 2.89Å; L438-C440 VanDerWaalsContact C-N 3.3Å; L438-C440 PolarHBondContact O-N 3.42Å; C440-V442 PolarHBondContact O-N 2.98Å; C440-S443 PolarHBondContact O-N 2.94Å; C440-S443 PolarHBondContact O-OG 2.68Å; C440-C452 HydrophobicContact CB-CB 3.62Å
441	H	95.4	Very high	93.8	Very high	19 Å²	19	22.5 Å²	22.5	9%	0.088	11%	0.114	C	C	.	.	H	α-helix	trans	-62.6	-24.2	-178.7	-61.3	-97.5	0	0	0	114	I277 Y278 D316 F317 R437 L438 L439	I277-H441 HydrophobicContact CB-CB 4.16Å; I277-H441 HydrophobicContact CD1-CB 3.84Å; I277-H441 HydrophobicContact CG1-CB 3.95Å; I277-H441 PolarHBondContact N-O 2.99Å; Y278-H441 WeakPolarHBondContact CB-O 3.48Å; Y278-H441 PolarHBondContact N-O 2.88Å; D316-H441 IonicContact OD2-CE1 3.52Å; D316-H441 PolarHBondContact OD2-CE1 3.39Å; D316-H441 IonicContact OD2-ND1 2.71Å; D316-H441 IonicContact OD2-NE2 2.71Å; F317-H441 HydrophobicContact CE2-CB 3.98Å; F317-H441 HydrophobicContact CZ-CB 4.32Å; R437-H441 PolarHBondContact O-CD2 2.95Å; R437-H441 PolarHBondContact O-N 3.42Å; L438-H441 PolarHBondContact O-N 2.74Å; L439-H441 VanDerWaalsContact C-N 3.34Å; L439-H441 PolarHBondContact O-N 3.01Å
442	V	95.2	Very high	93.9	Very high	10 Å²	10	19.9 Å²	19.9	6%	0.061	10%	0.101	C	C	.	.	H	α-helix	trans	-110.2	-5.4	-178	-58.6	0	0	0	0	114	F317 L382 H383 A386 L439 C440 G444 I507	F317-V442 HydrophobicContact CZ-CG1 4.07Å; L382-V442 HydrophobicContact CB-CG1 4.14Å; H383-V442 HydrophobicContact CB-CB 4.43Å; H383-V442 HydrophobicContact CB-CG1 4.46Å; A386-V442 HydrophobicContact CB-CG2 3.86Å; L439-V442 WeakPolarHBondContact O-CG2 3.49Å; L439-V442 PolarHBondContact O-N 3.17Å; C440-V442 PolarHBondContact O-N 2.98Å; V442-G444 PolarHBondContact O-N 3.35Å; V442-G444 VanDerWaalsContact O-N 3.12Å; V442-I507 HydrophobicContact CG2-CG2 4.41Å
443	S	92.1	Very high	93.8	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.112	C	C	.	.			trans	-61.8	-22.4	-169.8	65.1	0	0	0	0	115.9	L439 C440 T445 L448 E449	L439-S443 WeakPolarHBondContact O-CA 3.21Å; L439-S443 VanDerWaalsContact O-CB 3.3Å; L439-S443 WeakPolarHBondContact O-CB 3.4Å; L439-S443 PolarHBondContact O-N 2.85Å; C440-S443 PolarHBondContact O-N 2.94Å; C440-S443 PolarHBondContact O-OG 2.68Å; S443-T445 VanDerWaalsContact C-N 3.33Å; S443-T445 PolarHBondContact O-N 3.08Å; S443-L448 WeakPolarHBondContact O-CD1 3.45Å; S443-E449 WeakPolarHBondContact OG-CG 3.3Å; S443-E449 PolarHBondContact OG-N 3.16Å
444	G	88.2	Confident	93.8	Very high	5 Å²	5	22.7 Å²	22.7	5%	0.052	12%	0.115	C	C	.	.			trans	80.8	-7.2	164.4	0	0	0	0	0	117.8	Y278 V442	Y278-G444 WeakPolarHBondContact CE1-O 3.33Å; Y278-G444 VanDerWaalsContact CE2-CA 3.5Å; V442-G444 PolarHBondContact O-N 3.35Å; V442-G444 VanDerWaalsContact O-N 3.12Å
445	T	88.6	Confident	93.9	Very high	31 Å²	31	21.3 Å²	21.3	19%	0.19	11%	0.109	C	C	.	.	S	Bend	trans	-152.3	142.6	172.1	59.9	0	0	0	0	111.1	S443 P447 L448 E449 V510 R515	S443-T445 VanDerWaalsContact C-N 3.33Å; S443-T445 PolarHBondContact O-N 3.08Å; T445-P447 VanDerWaalsContact C-CD 3.42Å; T445-P447 VanDerWaalsContact C-N 3.32Å; T445-P447 VanDerWaalsContact O-N 3.15Å; T445-L448 WeakPolarHBondContact O-CA 3.45Å; T445-L448 PolarHBondContact O-N 2.73Å; T445-E449 PolarHBondContact O-N 3.14Å; T445-E449 VanDerWaalsContact O-N 3.09Å; T445-V510 HydrophobicContact CG2-CG1 4.01Å; T445-R515 PolarHBondContact OG1-NH2 2.83Å
446	E	88.2	Confident	93.9	Very high	82 Å²	82	22.9 Å²	22.9	38%	0.383	12%	0.116	S	C	.	.	H	α-helix	trans	-50.8	-38.1	-178.7	-55.6	-172	-170.5	0	0	115.4	K204 L448 E449 I450	K204-E446 VanDerWaalsContact CD-OE2 3.29Å; K204-E446 WeakPolarHBondContact CD-OE2 3.36Å; K204-E446 WeakPolarHBondContact CE-OE2 3.28Å; K204-E446 WeakPolarHBondContact CG-OE2 3.37Å; K204-E446 IonicContact NZ-OE1 3.63Å; K204-E446 IonicContact NZ-OE2 2.75Å; K204-E446 PolarHBondContact NZ-OE2 3.49Å; E446-L448 PolarHBondContact O-N 3.34Å; E446-E449 PolarHBondContact O-N 2.97Å; E446-I450 WeakPolarHBondContact O-CD1 3.28Å; E446-I450 WeakPolarHBondContact O-CG1 3.23Å; E446-I450 PolarHBondContact O-N 3.4Å
447	P	90.8	Very high	93.8	Very high	27 Å²	27	27.4 Å²	27.4	18%	0.175	14%	0.137	C	C	.	.	H	α-helix	trans	-60.7	-32.4	175.1	-27.8	38.7	0	0	0	113.7	E203 A207 T445 T451	E203-P447 HydrophobicContact CB-CG 4.24Å; A207-P447 HydrophobicContact CB-CB 3.88Å; T445-P447 VanDerWaalsContact C-CD 3.42Å; T445-P447 VanDerWaalsContact C-N 3.32Å; T445-P447 VanDerWaalsContact O-N 3.15Å; P447-T451 PolarHBondContact O-N 3.39Å; P447-T451 PolarHBondContact O-OG1 2.93Å
448	L	93.2	Very high	93.9	Very high	5 Å²	5	22.6 Å²	22.6	3%	0.026	12%	0.119	C	C	.	.	H	α-helix	trans	-82.6	-33.1	176.9	-63.4	179.4	0	0	0	111.6	S443 T445 E446 I450 T451 C452 L503 E506 I507 V510	S443-L448 WeakPolarHBondContact O-CD1 3.45Å; T445-L448 WeakPolarHBondContact O-CA 3.45Å; T445-L448 PolarHBondContact O-N 2.73Å; E446-L448 PolarHBondContact O-N 3.34Å; L448-I450 VanDerWaalsContact C-N 3.34Å; L448-I450 PolarHBondContact O-N 3.4Å; L448-T451 CarbonylContact O-C 3.55Å; L448-T451 PolarHBondContact O-N 3.37Å; L448-T451 VanDerWaalsContact O-N 3.13Å; L448-C452 PolarHBondContact O-N 2.59Å; L448-C452 PolarHBondContact O-SG 3.28Å; L448-L503 HydrophobicContact CB-CD1 4.47Å; L448-L503 HydrophobicContact CD2-CD1 4Å; L448-E506 HydrophobicContact CD1-CB 4.44Å; L448-E506 HydrophobicContact CD2-CB 4.24Å; L448-I507 HydrophobicContact CD1-CG1 4.14Å; L448-V510 HydrophobicContact CD1-CG2 3.35Å
449	E	93.3	Very high	93.9	Very high	12 Å²	12	22.4 Å²	22.4	6%	0.056	12%	0.118	C	C	.	.	H	α-helix	trans	-56.4	-48.9	169.1	-63.6	174	174.1	0	0	110.4	S276 N279 S443 T445 E446 T451 C452 I453	S276-E449 VanDerWaalsContact CB-OE1 3.23Å; S276-E449 WeakPolarHBondContact CB-OE1 3.41Å; S276-E449 PolarHBondContact OG-OE1 3.37Å; N279-E449 PolarHBondContact ND2-OE1 3.02Å; S443-E449 WeakPolarHBondContact OG-CG 3.3Å; S443-E449 PolarHBondContact OG-N 3.16Å; T445-E449 PolarHBondContact O-N 3.14Å; T445-E449 VanDerWaalsContact O-N 3.09Å; E446-E449 PolarHBondContact O-N 2.97Å; E449-T451 VanDerWaalsContact C-N 3.29Å; E449-T451 PolarHBondContact O-N 3.13Å; E449-C452 WeakPolarHBondContact O-CB 3.36Å; E449-C452 PolarHBondContact O-N 3.45Å; E449-I453 WeakPolarHBondContact O-CG1 3.47Å; E449-I453 PolarHBondContact O-N 3.39Å
450	I	93.1	Very high	93.9	Very high	16 Å²	16	27.1 Å²	27.1	8%	0.082	14%	0.14	C	C	.	.	H	α-helix	trans	-59.5	-39.1	174.7	-69.1	160.9	0	0	0	111.8	K204 A207 R208 E446 L448 I453 H454	K204-I450 HydrophobicContact CB-CD1 4.42Å; K204-I450 HydrophobicContact CG-CD1 3.63Å; A207-I450 HydrophobicContact CB-CB 4.26Å; A207-I450 HydrophobicContact CB-CD1 3.94Å; A207-I450 HydrophobicContact CB-CG2 4.1Å; R208-I450 HydrophobicContact CG-CD1 4.04Å; R208-I450 HydrophobicContact CG-CG1 4.49Å; R208-I450 HydrophobicContact CG-CG2 4.18Å; E446-I450 WeakPolarHBondContact O-CD1 3.28Å; E446-I450 WeakPolarHBondContact O-CG1 3.23Å; E446-I450 PolarHBondContact O-N 3.4Å; L448-I450 VanDerWaalsContact C-N 3.34Å; L448-I450 PolarHBondContact O-N 3.4Å; I450-I453 PolarHBondContact O-N 2.87Å; I450-H454 WeakPolarHBondContact O-CB 3.3Å; I450-H454 PolarHBondContact O-N 3.04Å
451	T	95.1	Very high	93.8	Very high	53 Å²	53	28.7 Å²	28.7	33%	0.325	15%	0.149	S	C	.	.	H	α-helix	trans	-71.2	-32.9	179.1	-52.3	0	0	0	0	111.8	P447 L448 E449 A455 L503	P447-T451 PolarHBondContact O-N 3.39Å; P447-T451 PolarHBondContact O-OG1 2.93Å; L448-T451 CarbonylContact O-C 3.55Å; L448-T451 PolarHBondContact O-N 3.37Å; L448-T451 VanDerWaalsContact O-N 3.13Å; E449-T451 VanDerWaalsContact C-N 3.29Å; E449-T451 PolarHBondContact O-N 3.13Å; T451-A455 WeakPolarHBondContact O-CB 3.27Å; T451-A455 PolarHBondContact O-N 2.97Å; T451-L503 HydrophobicContact CG2-CD1 3.86Å; T451-L503 HydrophobicContact CG2-CD2 4.28Å; T451-L503 HydrophobicContact CG2-CG 4.47Å
452	C	96.4	Very high	93.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.6	-47.7	172.6	-64.1	0	0	0	0	111.2	C440 L448 E449 A455 E456 L503	C440-C452 HydrophobicContact CB-CB 3.62Å; L448-C452 PolarHBondContact O-N 2.59Å; L448-C452 PolarHBondContact O-SG 3.28Å; E449-C452 WeakPolarHBondContact O-CB 3.36Å; E449-C452 PolarHBondContact O-N 3.45Å; C452-A455 WeakPolarHBondContact O-CB 3.3Å; C452-A455 PolarHBondContact O-N 3.39Å; C452-A455 VanDerWaalsContact O-N 3.17Å; C452-E456 PolarHBondContact O-N 2.93Å; C452-L503 HydrophobicContact CB-CD2 4.48Å
453	I	94.8	Very high	93.9	Very high	43 Å²	43	27.5 Å²	27.5	22%	0.221	14%	0.143	C	C	.	.	H	α-helix	trans	-63.3	-43.6	178.4	-65.1	165.3	0	0	0	110.7	L273 E449 I450 A455 E456 E457	L273-I453 HydrophobicContact CD1-CD1 3.88Å; L273-I453 HydrophobicContact CD2-CD1 3.72Å; L273-I453 HydrophobicContact CG-CD1 3.8Å; E449-I453 WeakPolarHBondContact O-CG1 3.47Å; E449-I453 PolarHBondContact O-N 3.39Å; I450-I453 PolarHBondContact O-N 2.87Å; I453-A455 VanDerWaalsContact C-N 3.29Å; I453-A455 PolarHBondContact O-N 3.02Å; I453-E456 WeakPolarHBondContact O-CB 3.14Å; I453-E456 PolarHBondContact O-N 2.69Å; I453-E457 HydrophobicContact CG2-CG 4.47Å; I453-E457 WeakPolarHBondContact O-CG 3.33Å; I453-E457 PolarHBondContact O-N 2.73Å
454	H	95.3	Very high	94.1	Very high	21 Å²	21	30.7 Å²	30.7	10%	0.097	16%	0.164	C	C	.	.	H	α-helix	trans	-59.6	-37.9	174.2	171.1	54.4	0	0	0	112.7	A211 I450 T458	A211-H454 HydrophobicContact CB-CB 3.87Å; I450-H454 WeakPolarHBondContact O-CB 3.3Å; I450-H454 PolarHBondContact O-N 3.04Å; H454-T458 PolarHBondContact CE1-OG1 3.39Å; H454-T458 VanDerWaalsContact O-CB 3.25Å; H454-T458 WeakPolarHBondContact O-CB 3.36Å; H454-T458 PolarHBondContact O-N 3.16Å; H454-T458 PolarHBondContact O-OG1 3.45Å
455	A	96.3	Very high	94.6	Very high	2 Å²	2	30.8 Å²	30.8	2%	0.017	16%	0.163	C	C	.	.	H	α-helix	trans	-68.7	-43.4	174.9	0	0	0	0	0	112	T451 C452 I453 T458 F459 L503	T451-A455 WeakPolarHBondContact O-CB 3.27Å; T451-A455 PolarHBondContact O-N 2.97Å; C452-A455 WeakPolarHBondContact O-CB 3.3Å; C452-A455 PolarHBondContact O-N 3.39Å; C452-A455 VanDerWaalsContact O-N 3.17Å; I453-A455 VanDerWaalsContact C-N 3.29Å; I453-A455 PolarHBondContact O-N 3.02Å; A455-T458 PolarHBondContact O-N 3.3Å; A455-T458 VanDerWaalsContact O-N 3.16Å; A455-F459 VanDerWaalsContact O-CD2 3.22Å; A455-F459 WeakPolarHBondContact O-CD2 3.44Å; A455-F459 PolarHBondContact O-N 3.49Å; A455-L503 HydrophobicContact CB-CD2 4.41Å
456	E	95.8	Very high	95	Very high	33 Å²	33	29.3 Å²	29.3	15%	0.154	15%	0.154	C	C	.	.	H	α-helix	trans	-56.1	-54.9	175	-173.1	177.3	168.2	0	0	111.4	V433 C436 R437 C452 I453 T458 F459 H460	V433-E456 HydrophobicContact CB-CG 4.26Å; V433-E456 HydrophobicContact CG1-CG 3.73Å; V433-E456 HydrophobicContact CG2-CG 4.48Å; C436-E456 HydrophobicContact CB-CB 3.84Å; R437-E456 IonicContact CZ-OE1 2.93Å; R437-E456 VanDerWaalsContact CZ-OE1 3.27Å; R437-E456 IonicContact NE-OE1 2.69Å; R437-E456 PolarHBondContact NE-OE1 3.4Å; R437-E456 IonicContact NE-OE2 2.67Å; R437-E456 IonicContact NH2-OE1 3.35Å; R437-E456 PolarHBondContact NH2-OE1 3.06Å; C452-E456 PolarHBondContact O-N 2.93Å; I453-E456 WeakPolarHBondContact O-CB 3.14Å; I453-E456 PolarHBondContact O-N 2.69Å; E456-T458 PolarHBondContact O-N 2.9Å; E456-F459 PolarHBondContact O-N 2.75Å; E456-H460 WeakPolarHBondContact O-CB 3.35Å; E456-H460 PolarHBondContact O-N 2.81Å
457	E	95.3	Very high	95.5	Very high	95 Å²	95	26.5 Å²	26.5	44%	0.444	14%	0.142	S	C	.	.	H	α-helix	trans	-56.1	-37.5	175	-71.5	179.4	172.2	0	0	112.2	I453 H460 V461	I453-E457 HydrophobicContact CG2-CG 4.47Å; I453-E457 WeakPolarHBondContact O-CG 3.33Å; I453-E457 PolarHBondContact O-N 2.73Å; E457-H460 PolarHBondContact O-N 3.48Å; E457-V461 WeakPolarHBondContact O-CG2 3.32Å; E457-V461 PolarHBondContact O-N 3.45Å
458	T	96.1	Very high	95.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-73.5	-42.2	-175.9	-60.4	0	0	0	0	112.7	R249 H454 A455 E456 I462 Q496	R249-T458 PolarHBondContact NH2-OG1 3.2Å; H454-T458 PolarHBondContact CE1-OG1 3.39Å; H454-T458 VanDerWaalsContact O-CB 3.25Å; H454-T458 WeakPolarHBondContact O-CB 3.36Å; H454-T458 PolarHBondContact O-N 3.16Å; H454-T458 PolarHBondContact O-OG1 3.45Å; A455-T458 PolarHBondContact O-N 3.3Å; A455-T458 VanDerWaalsContact O-N 3.16Å; E456-T458 PolarHBondContact O-N 2.9Å; T458-I462 HydrophobicContact CG2-CD1 3.51Å; T458-I462 HydrophobicContact CG2-CG1 4.21Å; T458-I462 WeakPolarHBondContact O-CB 3.22Å; T458-I462 VanDerWaalsContact O-CG1 3.32Å; T458-I462 WeakPolarHBondContact O-CG1 3.31Å; T458-I462 PolarHBondContact O-N 3.07Å; T458-Q496 HydrophobicContact CG2-CB 4.38Å; T458-Q496 HydrophobicContact CG2-CG 3.8Å; T458-Q496 VanDerWaalsContact CG2-OE1 3.22Å
459	F	96.4	Very high	96	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64.2	-42.2	170.4	-70.6	-60.5	0	0	0	111.3	K429 L432 V433 A455 E456 V461 G463 W493 Q496 L497 M500	K429-F459 WeakPolarHBondContact CG-O 3.29Å; L432-F459 HydrophobicContact CB-CB 4.39Å; L432-F459 HydrophobicContact CB-CD1 4.36Å; L432-F459 HydrophobicContact CB-CD2 3.95Å; L432-F459 HydrophobicContact CB-CE2 4.27Å; L432-F459 HydrophobicContact CB-CG 4Å; L432-F459 HydrophobicContact CD1-CD1 3.91Å; L432-F459 HydrophobicContact CD1-CE1 3.92Å; L432-F459 HydrophobicContact CD1-CG 4.39Å; L432-F459 HydrophobicContact CD1-CZ 4.39Å; L432-F459 HydrophobicContact CD2-CE1 4.25Å; L432-F459 HydrophobicContact CD2-CE2 4.06Å; L432-F459 HydrophobicContact CD2-CZ 3.89Å; V433-F459 HydrophobicContact CG2-CB 4.07Å; A455-F459 VanDerWaalsContact O-CD2 3.22Å; A455-F459 WeakPolarHBondContact O-CD2 3.44Å; A455-F459 PolarHBondContact O-N 3.49Å; E456-F459 PolarHBondContact O-N 2.75Å; F459-V461 VanDerWaalsContact C-N 3.29Å; F459-V461 PolarHBondContact O-N 2.81Å; F459-G463 PolarHBondContact O-N 3.48Å; F459-W493 HydrophobicContact CB-CZ3 4.39Å; F459-W493 HydrophobicContact CD1-CD2 4.18Å; F459-W493 AromaticContact CD1-CE3 3.94Å; F459-W493 HydrophobicContact CD1-CE3 3.94Å; F459-W493 HydrophobicContact CD1-CH2 4.07Å; F459-W493 HydrophobicContact CD1-CZ2 4.3Å; F459-W493 AromaticContact CD1-CZ3 3.88Å; F459-W493 HydrophobicContact CD1-CZ3 3.88Å; F459-W493 HydrophobicContact CE1-CD2 4.41Å; F459-Q496 HydrophobicContact CD1-CB 4.39Å; F459-Q496 HydrophobicContact CD1-CG 4.01Å; F459-Q496 HydrophobicContact CD2-CG 4.24Å; F459-Q496 HydrophobicContact CE1-CB 3.8Å; F459-Q496 HydrophobicContact CE1-CG 3.62Å; F459-Q496 HydrophobicContact CE2-CG 3.89Å; F459-Q496 HydrophobicContact CG-CG 4.3Å; F459-Q496 HydrophobicContact CZ-CB 4.05Å; F459-Q496 HydrophobicContact CZ-CG 3.56Å; F459-L497 HydrophobicContact CE1-CD2 3.96Å; F459-L497 HydrophobicContact CE1-CG 4.19Å; F459-L497 HydrophobicContact CZ-CD2 3.94Å; F459-L497 HydrophobicContact CZ-CG 4.4Å; F459-M500 HydrophobicContact CE2-CB 4.34Å; F459-M500 HydrophobicContact CE2-SD 3.78Å; F459-M500 HydrophobicContact CZ-CB 4.32Å; F459-M500 HydrophobicContact CZ-SD 4.05Å
460	H	95.8	Very high	96.3	Very high	99 Å²	99	24.8 Å²	24.8	46%	0.458	13%	0.132	S	C	.	.	H	α-helix	trans	-57	-41.2	179.6	-169.4	97.4	0	0	0	112.5	V433 E456 E457 P464	V433-H460 HydrophobicContact CG2-CB 4.03Å; E456-H460 WeakPolarHBondContact O-CB 3.35Å; E456-H460 PolarHBondContact O-N 2.81Å; E457-H460 PolarHBondContact O-N 3.48Å; H460-P464 WeakPolarHBondContact O-CD 3.42Å
461	V	94.8	Very high	96.5	Very high	50 Å²	50	27.4 Å²	27.4	30%	0.303	14%	0.144	S	C	.	.	H	α-helix	trans	-85	-39.5	-179	178.4	0	0	0	0	113.5	E457 F459 Q465	E457-V461 WeakPolarHBondContact O-CG2 3.32Å; E457-V461 PolarHBondContact O-N 3.45Å; F459-V461 VanDerWaalsContact C-N 3.29Å; F459-V461 PolarHBondContact O-N 2.81Å; V461-Q465 WeakPolarHBondContact O-CG 3.42Å; V461-Q465 PolarHBondContact O-OE1 3.48Å
462	I	95.3	Very high	96.7	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-71.7	-36	-175.5	-65.7	178.1	0	0	0	112.1	M222 T458 Q465 I466 A492 W493	M222-I462 HydrophobicContact CE-CG1 4.35Å; T458-I462 HydrophobicContact CG2-CD1 3.51Å; T458-I462 HydrophobicContact CG2-CG1 4.21Å; T458-I462 WeakPolarHBondContact O-CB 3.22Å; T458-I462 VanDerWaalsContact O-CG1 3.32Å; T458-I462 WeakPolarHBondContact O-CG1 3.31Å; T458-I462 PolarHBondContact O-N 3.07Å; I462-Q465 WeakPolarHBondContact O-CB 3.28Å; I462-Q465 PolarHBondContact O-N 3.41Å; I462-I466 HydrophobicContact CG2-CD1 3.8Å; I462-I466 HydrophobicContact CG2-CG1 4.04Å; I462-I466 PolarHBondContact O-N 3.01Å; I462-A492 HydrophobicContact CD1-CB 4.06Å; I462-W493 HydrophobicContact CB-CE3 4.28Å; I462-W493 HydrophobicContact CG2-CB 4.06Å; I462-W493 HydrophobicContact CG2-CE3 4.04Å
463	G	96.6	Very high	96.8	Very high	2 Å²	2	25 Å²	25	2%	0.021	13%	0.129	C	C	.	.	H	α-helix	trans	-54.1	-55.5	-178.6	0	0	0	0	0	113.8	F459 Q465 I466 I467	F459-G463 PolarHBondContact O-N 3.48Å; G463-Q465 VanDerWaalsContact C-N 3.27Å; G463-Q465 PolarHBondContact O-N 3.24Å; G463-I466 PolarHBondContact O-N 2.98Å; G463-I467 PolarHBondContact O-N 3.16Å
464	P	97	Very high	97	Very high	68 Å²	68	23.2 Å²	23.2	44%	0.442	12%	0.121	S	C	.	.	H	α-helix	trans	-59.4	-33.4	173.9	-25.9	35.5	0	0	0	113.9	H460 I467 S468	H460-P464 WeakPolarHBondContact O-CD 3.42Å; P464-I467 PolarHBondContact O-N 2.9Å; P464-S468 PolarHBondContact O-N 2.89Å
465	Q	97.6	Very high	97.1	Very high	7 Å²	7	26.3 Å²	26.3	3%	0.033	14%	0.137	C	C	.	.	H	α-helix	trans	-69.4	-37.6	178.4	-68.6	179.3	-49.3	0	0	112.5	N242 A245 V461 I462 G463 S468 A469 F489	N242-Q465 PolarHBondContact ND2-O 2.86Å; A245-Q465 HydrophobicContact CB-CG 4.22Å; A245-Q465 VanDerWaalsContact CB-NE2 3.32Å; V461-Q465 WeakPolarHBondContact O-CG 3.42Å; V461-Q465 PolarHBondContact O-OE1 3.48Å; I462-Q465 WeakPolarHBondContact O-CB 3.28Å; I462-Q465 PolarHBondContact O-N 3.41Å; G463-Q465 VanDerWaalsContact C-N 3.27Å; G463-Q465 PolarHBondContact O-N 3.24Å; Q465-S468 PolarHBondContact O-N 3.42Å; Q465-A469 PolarHBondContact O-N 3.3Å; Q465-F489 HydrophobicContact CB-CD1 3.54Å; Q465-F489 HydrophobicContact CB-CE1 3.51Å; Q465-F489 HydrophobicContact CG-CE1 4.09Å
466	I	98.1	Very high	97.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-45.7	171.9	-69.3	168.1	0	0	0	110.5	L403 L406 L425 I462 G463 S468 A469 A470 L486 F489 W493	L403-I466 HydrophobicContact CD2-CD1 4.06Å; L403-I466 HydrophobicContact CD2-CG2 4.17Å; L406-I466 HydrophobicContact CD1-CG2 4.25Å; L425-I466 HydrophobicContact CD2-CB 3.98Å; L425-I466 HydrophobicContact CD2-CD1 4.46Å; L425-I466 HydrophobicContact CD2-CG2 3.62Å; I462-I466 HydrophobicContact CG2-CD1 3.8Å; I462-I466 HydrophobicContact CG2-CG1 4.04Å; I462-I466 PolarHBondContact O-N 3.01Å; G463-I466 PolarHBondContact O-N 2.98Å; I466-S468 VanDerWaalsContact C-N 3.31Å; I466-S468 PolarHBondContact O-N 3.13Å; I466-A469 PolarHBondContact O-N 3.36Å; I466-A470 WeakPolarHBondContact O-CB 3.49Å; I466-A470 PolarHBondContact O-N 3.06Å; I466-L486 HydrophobicContact CG2-CD1 3.99Å; I466-F489 HydrophobicContact CG1-CB 3.93Å; I466-W493 HydrophobicContact CD1-CB 3.74Å; I466-W493 HydrophobicContact CD1-CD2 4.14Å; I466-W493 HydrophobicContact CD1-CE3 4.05Å; I466-W493 HydrophobicContact CD1-CG 4.07Å
467	I	97.9	Very high	97.2	Very high	23 Å²	23	29.6 Å²	29.6	12%	0.118	16%	0.157	C	C	.	.	H	α-helix	trans	-57.7	-46.3	177.3	-67.9	168.1	0	0	0	110.4	S422 L425 G463 P464 A469 A470 Q471	S422-I467 WeakPolarHBondContact OG-CG2 3.32Å; L425-I467 HydrophobicContact CD2-CG1 4.18Å; G463-I467 PolarHBondContact O-N 3.16Å; P464-I467 PolarHBondContact O-N 2.9Å; I467-A469 PolarHBondContact O-N 3.35Å; I467-A470 PolarHBondContact O-N 2.69Å; I467-Q471 VanDerWaalsContact O-CG 3.31Å; I467-Q471 WeakPolarHBondContact O-CG 3.43Å; I467-Q471 PolarHBondContact O-N 2.9Å
468	S	97.9	Very high	97.3	Very high	7 Å²	7	30.7 Å²	30.7	5%	0.049	18%	0.175	C	C	.	.	H	α-helix	trans	-63.2	-39.6	177.7	-145.9	0	0	0	0	112.6	S238 P464 Q465 I466 T472	S238-S468 WeakPolarHBondContact CB-O 3.4Å; S238-S468 PolarHBondContact O-OG 3.3Å; P464-S468 PolarHBondContact O-N 2.89Å; Q465-S468 PolarHBondContact O-N 3.42Å; I466-S468 VanDerWaalsContact C-N 3.31Å; I466-S468 PolarHBondContact O-N 3.13Å; S468-T472 WeakPolarHBondContact O-CB 3.31Å; S468-T472 PolarHBondContact O-N 3.36Å; S468-T472 PolarHBondContact O-OG1 2.92Å
469	A	98.3	Very high	97.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-67.2	-37.7	173.7	0	0	0	0	0	112.8	Q465 I466 I467 T472 L473 L486	Q465-A469 PolarHBondContact O-N 3.3Å; I466-A469 PolarHBondContact O-N 3.36Å; I467-A469 PolarHBondContact O-N 3.35Å; A469-T472 WeakPolarHBondContact O-CB 3.42Å; A469-T472 PolarHBondContact O-N 3.1Å; A469-L473 PolarHBondContact O-N 3.25Å; A469-L486 HydrophobicContact CB-CB 4.2Å; A469-L486 HydrophobicContact CB-CD1 4.02Å
470	A	98.4	Very high	97.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68	-40.4	176.7	0	0	0	0	0	112.2	L406 V418 I466 I467 L473 A474 L486	L406-A470 HydrophobicContact CB-CB 4.27Å; L406-A470 HydrophobicContact CD2-CB 4.01Å; V418-A470 HydrophobicContact CG1-CB 4.06Å; I466-A470 WeakPolarHBondContact O-CB 3.49Å; I466-A470 PolarHBondContact O-N 3.06Å; I467-A470 PolarHBondContact O-N 2.69Å; A470-L473 PolarHBondContact O-N 2.93Å; A470-A474 WeakPolarHBondContact O-CB 3.18Å; A470-A474 PolarHBondContact O-N 3.48Å; A470-L486 HydrophobicContact CB-CD1 3.99Å; A470-L486 HydrophobicContact CB-CD2 4.14Å
471	Q	98.3	Very high	97.5	Very high	72 Å²	72	37.5 Å²	37.5	34%	0.336	21%	0.207	S	C	.	.	H	α-helix	trans	-61.9	-42.2	170.6	-70.8	169.2	-8.2	0	0	111.6	V418 I467 L473 A474 L475	V418-Q471 HydrophobicContact CG1-CG 4Å; I467-Q471 VanDerWaalsContact O-CG 3.31Å; I467-Q471 WeakPolarHBondContact O-CG 3.43Å; I467-Q471 PolarHBondContact O-N 2.9Å; Q471-L473 VanDerWaalsContact C-N 3.32Å; Q471-L473 PolarHBondContact O-N 3.08Å; Q471-A474 PolarHBondContact O-N 3Å; Q471-L475 WeakPolarHBondContact O-CG 3.18Å; Q471-L475 PolarHBondContact O-N 2.66Å
472	T	98.4	Very high	97.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-41.4	175.9	-55.8	0	0	0	0	111.8	T229 S238 A239 S468 A469 H476 A482	T229-T472 HydrophobicContact CG2-CG2 3.57Å; S238-T472 VanDerWaalsContact C-OG1 3.26Å; S238-T472 PolarHBondContact OG-OG1 3.11Å; A239-T472 HydrophobicContact CB-CG2 3.86Å; A239-T472 PolarHBondContact N-OG1 3.49Å; S468-T472 WeakPolarHBondContact O-CB 3.31Å; S468-T472 PolarHBondContact O-N 3.36Å; S468-T472 PolarHBondContact O-OG1 2.92Å; A469-T472 WeakPolarHBondContact O-CB 3.42Å; A469-T472 PolarHBondContact O-N 3.1Å; T472-H476 PolarHBondContact O-N 3.24Å; T472-A482 HydrophobicContact CG2-CB 4.22Å
473	L	98.6	Very high	97.8	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-68.3	-42.2	175.1	-178.2	59.8	0	0	0	111.7	G410 A411 A469 A470 Q471 L475 H476 P477 A482 K483 L486	G410-L473 CarbonylContact O-C 3.59Å; A411-L473 HydrophobicContact CB-CD2 4.43Å; A469-L473 PolarHBondContact O-N 3.25Å; A470-L473 PolarHBondContact O-N 2.93Å; Q471-L473 VanDerWaalsContact C-N 3.32Å; Q471-L473 PolarHBondContact O-N 3.08Å; L473-L475 VanDerWaalsContact C-N 3.3Å; L473-L475 PolarHBondContact O-N 2.94Å; L473-H476 CarbonylContact O-C 3.57Å; L473-H476 PolarHBondContact O-N 3.08Å; L473-P477 VanDerWaalsContact O-CA 3.22Å; L473-P477 WeakPolarHBondContact O-CA 3.44Å; L473-A482 HydrophobicContact CB-CB 4.3Å; L473-A482 HydrophobicContact CD1-CB 4.01Å; L473-K483 HydrophobicContact CD1-CB 3.98Å; L473-K483 HydrophobicContact CD2-CB 4.3Å; L473-K483 HydrophobicContact CD2-CG 4.44Å; L473-L486 HydrophobicContact CD2-CD2 3.77Å
474	A	98.4	Very high	97.8	Very high	6 Å²	6	43.5 Å²	43.5	5%	0.05	23%	0.229	C	C	.	.	H	α-helix	trans	-62.6	-34.5	177.4	0	0	0	0	0	113.3	G410 G413 L415 V418 A470 Q471 H476 P477	G410-A474 WeakPolarHBondContact O-CA 3.48Å; G413-A474 WeakPolarHBondContact CA-O 3.36Å; L415-A474 HydrophobicContact CD2-CB 3.56Å; L415-A474 HydrophobicContact CG-CB 4.03Å; V418-A474 HydrophobicContact CG2-CB 4.16Å; A470-A474 WeakPolarHBondContact O-CB 3.18Å; A470-A474 PolarHBondContact O-N 3.48Å; Q471-A474 PolarHBondContact O-N 3Å; A474-H476 VanDerWaalsContact C-N 3.29Å; A474-P477 WeakPolarHBondContact O-CG 3.19Å
475	L	98.1	Very high	97.9	Very high	86 Å²	86	40.2 Å²	40.2	45%	0.45	21%	0.208	S	C	.	.	H	α-helix	trans	-71.3	-24.1	172.3	-69.3	169.4	0	0	0	112.7	L415 Q471 L473	L415-L475 HydrophobicContact CD1-CD2 4.1Å; L415-L475 HydrophobicContact CD2-CD2 4.4Å; L415-L475 HydrophobicContact CD2-CG 4.37Å; Q471-L475 WeakPolarHBondContact O-CG 3.18Å; Q471-L475 PolarHBondContact O-N 2.66Å; L473-L475 VanDerWaalsContact C-N 3.3Å; L473-L475 PolarHBondContact O-N 2.94Å
476	H	97.7	Very high	97.9	Very high	49 Å²	49	40 Å²	40	23%	0.227	21%	0.207	C	C	.	.	S	Bend	trans	-137.6	61.2	-175.5	-53.3	-45.7	0	0	0	113.2	H233 T472 L473 A474 S478 S479	H233-H476 AromaticContact CD2-CD2 3.49Å; H233-H476 PolarHBondContact CD2-CD2 2.8Å; H233-H476 VanDerWaalsContact CD2-CD2 3.49Å; H233-H476 AromaticContact CE1-CD2 3.65Å; H233-H476 AromaticContact CE1-CE1 3.73Å; H233-H476 AromaticContact CE1-CG 3.79Å; H233-H476 AromaticContact CE1-ND1 3.84Å; H233-H476 AromaticContact CE1-NE2 3.6Å; H233-H476 AromaticContact CG-CD2 3.32Å; H233-H476 AromaticContact CG-NE2 3.64Å; H233-H476 AromaticContact ND1-CD2 3.38Å; H233-H476 PolarHBondContact ND1-CD2 2.89Å; H233-H476 AromaticContact ND1-CG 3.61Å; H233-H476 AromaticContact ND1-NE2 3.66Å; H233-H476 WeakPolarHBondContact NE2-CB 3.35Å; H233-H476 AromaticContact NE2-CG 3.56Å; T472-H476 PolarHBondContact O-N 3.24Å; L473-H476 CarbonylContact O-C 3.57Å; L473-H476 PolarHBondContact O-N 3.08Å; A474-H476 VanDerWaalsContact C-N 3.29Å; H476-S478 VanDerWaalsContact C-N 3.27Å; H476-S478 PolarHBondContact O-N 3.02Å; H476-S478 VanDerWaalsContact O-N 3.1Å; H476-S479 WeakPolarHBondContact O-CB 3.41Å; H476-S479 PolarHBondContact O-N 3.15Å
477	P	96.9	Very high	97.8	Very high	55 Å²	55	43.4 Å²	43.4	36%	0.357	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-25.8	-163.4	-24.5	36.5	0	0	0	115	G413 L473 A474 S479	G413-P477 VanDerWaalsContact CA-CG 3.41Å; L473-P477 VanDerWaalsContact O-CA 3.22Å; L473-P477 WeakPolarHBondContact O-CA 3.44Å; A474-P477 WeakPolarHBondContact O-CG 3.19Å; P477-S479 VanDerWaalsContact C-N 3.28Å; P477-S479 PolarHBondContact O-N 2.61Å
478	S	96.8	Very high	97.8	Very high	118 Å²	118	43.6 Å²	43.6	83%	0.825	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.6	175	57.8	0	0	0	0	114.2	H476 K480	H476-S478 VanDerWaalsContact C-N 3.27Å; H476-S478 PolarHBondContact O-N 3.02Å; H476-S478 VanDerWaalsContact O-N 3.1Å; S478-K480 PolarHBondContact O-N 2.78Å
479	S	97.9	Very high	97.8	Very high	11 Å²	11	43.3 Å²	43.3	8%	0.077	22%	0.223	C	C	.	.			trans	-81.9	102.1	-176.9	-171.4	0	0	0	0	111.9	H233 H476 P477 I481 A482 K483	H233-S479 WeakPolarHBondContact NE2-CB 3.32Å; H476-S479 WeakPolarHBondContact O-CB 3.41Å; H476-S479 PolarHBondContact O-N 3.15Å; P477-S479 VanDerWaalsContact C-N 3.28Å; P477-S479 PolarHBondContact O-N 2.61Å; S479-I481 PolarHBondContact O-N 2.75Å; S479-I481 VanDerWaalsContact O-N 3.16Å; S479-A482 PolarHBondContact O-N 3.07Å; S479-A482 VanDerWaalsContact O-N 3.14Å; S479-A482 PolarHBondContact OG-N 3.24Å; S479-K483 PolarHBondContact O-N 3.42Å; S479-K483 VanDerWaalsContact O-N 3.09Å
480	K	97.6	Very high	97.7	Very high	182 Å²	182	43.3 Å²	43.3	79%	0.791	22%	0.223	S	C	*	.	H	α-helix	trans	-52	-34.7	170.8	-65.4	-176.1	-179.3	179.1	0	112.5	S478 K483 E484	S478-K480 PolarHBondContact O-N 2.78Å; K480-K483 PolarHBondContact O-N 3.01Å; K480-E484 WeakPolarHBondContact O-CB 3.4Å; K480-E484 PolarHBondContact O-N 2.95Å
481	I	96.8	Very high	97.6	Very high	49 Å²	49	48.7 Å²	48.7	25%	0.251	25%	0.248	S	C	.	.	H	α-helix	trans	-70.7	-42.6	-179.5	-61.2	176.4	0	0	0	111	K228 R232 S479 K483 E484 N485	K228-I481 HydrophobicContact CB-CG2 3.82Å; R232-I481 HydrophobicContact CB-CD1 4.2Å; R232-I481 HydrophobicContact CG-CD1 4.14Å; S479-I481 PolarHBondContact O-N 2.75Å; S479-I481 VanDerWaalsContact O-N 3.16Å; I481-K483 VanDerWaalsContact C-N 3.26Å; I481-K483 PolarHBondContact O-N 3.19Å; I481-E484 PolarHBondContact O-N 2.67Å; I481-N485 WeakPolarHBondContact O-CB 3.43Å; I481-N485 PolarHBondContact O-N 2.93Å
482	A	98	Very high	97.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.7	-33.4	174.5	0	0	0	0	0	111.7	T229 T472 L473 S479 N485 L486	T229-A482 HydrophobicContact CG2-CB 4.42Å; T472-A482 HydrophobicContact CG2-CB 4.22Å; L473-A482 HydrophobicContact CB-CB 4.3Å; L473-A482 HydrophobicContact CD1-CB 4.01Å; S479-A482 PolarHBondContact O-N 3.07Å; S479-A482 VanDerWaalsContact O-N 3.14Å; S479-A482 PolarHBondContact OG-N 3.24Å; A482-N485 PolarHBondContact O-N 2.96Å; A482-L486 PolarHBondContact O-N 3.45Å; A482-L486 VanDerWaalsContact O-N 3.08Å
483	K	98.1	Very high	97.3	Very high	109 Å²	109	45.8 Å²	45.8	47%	0.474	24%	0.236	S	C	.	.	H	α-helix	trans	-69.3	-47.1	173.8	-174.5	176.7	175.7	177	0	112.2	L473 S479 K480 I481 N485 L486 E487	L473-K483 HydrophobicContact CD1-CB 3.98Å; L473-K483 HydrophobicContact CD2-CB 4.3Å; L473-K483 HydrophobicContact CD2-CG 4.44Å; S479-K483 PolarHBondContact O-N 3.42Å; S479-K483 VanDerWaalsContact O-N 3.09Å; K480-K483 PolarHBondContact O-N 3.01Å; I481-K483 VanDerWaalsContact C-N 3.26Å; I481-K483 PolarHBondContact O-N 3.19Å; K483-N485 PolarHBondContact O-N 3.45Å; K483-L486 PolarHBondContact O-N 3.33Å; K483-E487 WeakPolarHBondContact O-CB 3.25Å; K483-E487 PolarHBondContact O-N 2.91Å
484	E	97.6	Very high	97.1	Very high	70 Å²	70	47.8 Å²	47.8	33%	0.327	25%	0.247	S	C	.	.	H	α-helix	trans	-53.5	-40.3	172.5	-174.3	-169.2	150.8	0	0	110.9	T225 K228 K480 I481 E487 V488	T225-E484 HydrophobicContact CG2-CG 3.96Å; K228-E484 IonicContact NZ-OE1 2.63Å; K228-E484 PolarHBondContact NZ-OE1 3.49Å; K228-E484 IonicContact NZ-OE2 3.65Å; K480-E484 WeakPolarHBondContact O-CB 3.4Å; K480-E484 PolarHBondContact O-N 2.95Å; I481-E484 PolarHBondContact O-N 2.67Å; E484-E487 WeakPolarHBondContact O-CB 3.46Å; E484-E487 PolarHBondContact O-N 3.09Å; E484-V488 PolarHBondContact O-N 2.63Å; E484-V488 VanDerWaalsContact O-N 3.16Å
485	N	97.8	Very high	96.9	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.9	-51.6	175.8	-161.8	52.8	0	0	0	112.6	T225 A226 T229 N242 I481 A482 K483 E487 V488 F489	T225-N485 WeakPolarHBondContact CB-OD1 3.45Å; T225-N485 PolarHBondContact O-OD1 3.48Å; T225-N485 PolarHBondContact OG1-OD1 3.46Å; A226-N485 WeakPolarHBondContact CA-OD1 3.35Å; A226-N485 PolarHBondContact N-OD1 3.1Å; T229-N485 WeakPolarHBondContact OG1-CB 3.22Å; N242-N485 PolarHBondContact OD1-ND2 2.62Å; I481-N485 WeakPolarHBondContact O-CB 3.43Å; I481-N485 PolarHBondContact O-N 2.93Å; A482-N485 PolarHBondContact O-N 2.96Å; K483-N485 PolarHBondContact O-N 3.45Å; N485-E487 PolarHBondContact O-N 2.93Å; N485-V488 PolarHBondContact O-N 3.18Å; N485-F489 VanDerWaalsContact O-CD2 3.27Å; N485-F489 WeakPolarHBondContact O-CD2 3.47Å; N485-F489 PolarHBondContact O-N 3.25Å; N485-F489 VanDerWaalsContact O-N 3.15Å; N485-F489 VanDerWaalsContact OD1-CE2 3.31Å; N485-F489 WeakPolarHBondContact OD1-CE2 3.42Å
486	L	98.1	Very high	96.7	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-60.6	-33.2	176.1	-179.9	60.6	0	0	0	112.3	K407 I466 A469 A470 L473 A482 K483 C490	K407-L486 HydrophobicContact CB-CD2 4.34Å; K407-L486 HydrophobicContact CG-CD2 3.79Å; K407-L486 HydrophobicContact CG-CG 3.97Å; I466-L486 HydrophobicContact CG2-CD1 3.99Å; A469-L486 HydrophobicContact CB-CB 4.2Å; A469-L486 HydrophobicContact CB-CD1 4.02Å; A470-L486 HydrophobicContact CB-CD1 3.99Å; A470-L486 HydrophobicContact CB-CD2 4.14Å; L473-L486 HydrophobicContact CD2-CD2 3.77Å; A482-L486 PolarHBondContact O-N 3.45Å; A482-L486 VanDerWaalsContact O-N 3.08Å; K483-L486 PolarHBondContact O-N 3.33Å; L486-C490 PolarHBondContact O-N 2.85Å; L486-C490 PolarHBondContact O-SG 3.09Å; L486-C490 VanDerWaalsContact O-SG 3.33Å
487	E	97.3	Very high	96.6	Very high	72 Å²	72	44.1 Å²	44.1	34%	0.336	23%	0.231	S	C	.	.	H	α-helix	trans	-56.9	-57.7	174.4	-155.2	97	-99.4	0	0	111.1	K407 K483 E484 N485 F489 C490 E491	K407-E487 IonicContact NZ-OE1 2.69Å; K407-E487 PolarHBondContact NZ-OE1 2.86Å; K483-E487 WeakPolarHBondContact O-CB 3.25Å; K483-E487 PolarHBondContact O-N 2.91Å; E484-E487 WeakPolarHBondContact O-CB 3.46Å; E484-E487 PolarHBondContact O-N 3.09Å; N485-E487 PolarHBondContact O-N 2.93Å; E487-F489 PolarHBondContact O-N 2.78Å; E487-C490 PolarHBondContact O-N 2.87Å; E487-E491 WeakPolarHBondContact O-CG 3.47Å; E487-E491 PolarHBondContact O-N 2.96Å
488	V	97.3	Very high	96.5	Very high	28 Å²	28	45.3 Å²	45.3	17%	0.17	24%	0.241	C	C	.	.	H	α-helix	trans	-63.8	-37.5	-176.5	169.9	0	0	0	0	112.7	M222 T225 E484 N485 E491 A492	M222-V488 HydrophobicContact CG-CG1 4.1Å; T225-V488 HydrophobicContact CG2-CB 4.33Å; T225-V488 HydrophobicContact CG2-CG2 3.86Å; E484-V488 PolarHBondContact O-N 2.63Å; E484-V488 VanDerWaalsContact O-N 3.16Å; N485-V488 PolarHBondContact O-N 3.18Å; V488-E491 PolarHBondContact O-N 3.34Å; V488-A492 WeakPolarHBondContact O-CB 3.05Å; V488-A492 PolarHBondContact O-N 3.42Å
489	F	97.8	Very high	96.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-70.2	-32.2	177.2	-81.8	-102.6	0	0	0	112.4	M222 A226 N242 V246 Q465 I466 N485 E487 W493	M222-F489 HydrophobicContact CB-CE1 4.41Å; M222-F489 HydrophobicContact CB-CE2 3.99Å; M222-F489 HydrophobicContact CB-CZ 3.88Å; M222-F489 HydrophobicContact CE-CD1 3.52Å; M222-F489 HydrophobicContact CE-CE1 3.24Å; M222-F489 HydrophobicContact CE-CG 4.35Å; M222-F489 HydrophobicContact CE-CZ 3.91Å; M222-F489 HydrophobicContact CG-CE2 4.39Å; M222-F489 HydrophobicContact CG-CZ 4.37Å; A226-F489 HydrophobicContact CB-CE2 4.3Å; A226-F489 HydrophobicContact CB-CZ 4.31Å; N242-F489 WeakPolarHBondContact ND2-CE1 3.35Å; N242-F489 WeakPolarHBondContact ND2-CZ 3.36Å; N242-F489 WeakPolarHBondContact OD1-CE2 3.41Å; N242-F489 VanDerWaalsContact OD1-CZ 3.27Å; N242-F489 WeakPolarHBondContact OD1-CZ 3.09Å; V246-F489 HydrophobicContact CG2-CE1 4.08Å; V246-F489 HydrophobicContact CG2-CZ 3.69Å; Q465-F489 HydrophobicContact CB-CD1 3.54Å; Q465-F489 HydrophobicContact CB-CE1 3.51Å; Q465-F489 HydrophobicContact CG-CE1 4.09Å; I466-F489 HydrophobicContact CG1-CB 3.93Å; N485-F489 VanDerWaalsContact O-CD2 3.27Å; N485-F489 WeakPolarHBondContact O-CD2 3.47Å; N485-F489 PolarHBondContact O-N 3.25Å; N485-F489 VanDerWaalsContact O-N 3.15Å; N485-F489 VanDerWaalsContact OD1-CE2 3.31Å; N485-F489 WeakPolarHBondContact OD1-CE2 3.42Å; E487-F489 PolarHBondContact O-N 2.78Å; F489-W493 PolarHBondContact O-N 3.38Å
490	C	96.8	Very high	96.2	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.007	21%	0.214	C	C	.	.	H	α-helix	trans	-70.6	-40.8	169.6	-68.5	0	0	0	0	112	L403 L486 E487 A492 W493 D494	L403-C490 HydrophobicContact CD1-CB 4.31Å; L486-C490 PolarHBondContact O-N 2.85Å; L486-C490 PolarHBondContact O-SG 3.09Å; L486-C490 VanDerWaalsContact O-SG 3.33Å; E487-C490 PolarHBondContact O-N 2.87Å; C490-A492 VanDerWaalsContact C-N 3.29Å; C490-A492 PolarHBondContact O-N 3.35Å; C490-W493 WeakPolarHBondContact O-CB 3.42Å; C490-W493 PolarHBondContact O-N 3.14Å; C490-W493 VanDerWaalsContact O-N 3.09Å; C490-D494 PolarHBondContact O-N 3.14Å
491	E	95.3	Very high	96.1	Very high	113 Å²	113	35.7 Å²	35.7	53%	0.528	19%	0.194	S	C	.	.	H	α-helix	trans	-61.1	-37.2	176.1	-72	175.5	172.8	0	0	112.2	E487 V488 W493 D494 S495	E487-E491 WeakPolarHBondContact O-CG 3.47Å; E487-E491 PolarHBondContact O-N 2.96Å; V488-E491 PolarHBondContact O-N 3.34Å; E491-W493 VanDerWaalsContact C-N 3.3Å; E491-W493 PolarHBondContact O-N 3.27Å; E491-D494 PolarHBondContact O-N 3.35Å; E491-S495 VanDerWaalsContact O-CB 3.3Å; E491-S495 WeakPolarHBondContact O-CB 3.48Å; E491-S495 PolarHBondContact O-N 3.44Å
492	A	95.1	Very high	96	Very high	8 Å²	8	37.6 Å²	37.6	7%	0.066	20%	0.204	C	C	.	.	H	α-helix	trans	-64.4	-32	174.5	0	0	0	0	0	113.1	M222 I462 V488 C490 Q496	M222-A492 HydrophobicContact CG-CB 4.5Å; M222-A492 HydrophobicContact SD-CB 4.03Å; I462-A492 HydrophobicContact CD1-CB 4.06Å; V488-A492 WeakPolarHBondContact O-CB 3.05Å; V488-A492 PolarHBondContact O-N 3.42Å; C490-A492 VanDerWaalsContact C-N 3.29Å; C490-A492 PolarHBondContact O-N 3.35Å; A492-Q496 PolarHBondContact O-N 3.41Å; A492-Q496 VanDerWaalsContact O-N 3.17Å
493	W	95.7	Very high	95.8	Very high	3 Å²	3	37.9 Å²	37.9	1%	0.011	21%	0.205	C	C	.	.	H	α-helix	trans	-75.4	-44.2	173.8	176.5	-78.6	0	0	0	112.3	L403 L425 K429 L432 F459 I462 I466 F489 C490 E491 S495 Q496 L497	L403-W493 HydrophobicContact CD1-CG 4.34Å; L425-W493 HydrophobicContact CD1-CH2 4.03Å; L425-W493 HydrophobicContact CD1-CZ2 3.8Å; K429-W493 HydrophobicContact CB-CH2 3.82Å; K429-W493 HydrophobicContact CB-CZ3 4.4Å; K429-W493 HydrophobicContact CG-CH2 4.01Å; K429-W493 HydrophobicContact CG-CZ3 4.13Å; L432-W493 HydrophobicContact CD1-CH2 3.77Å; L432-W493 HydrophobicContact CD1-CZ2 3.29Å; F459-W493 HydrophobicContact CB-CZ3 4.39Å; F459-W493 HydrophobicContact CD1-CD2 4.18Å; F459-W493 AromaticContact CD1-CE3 3.94Å; F459-W493 HydrophobicContact CD1-CE3 3.94Å; F459-W493 HydrophobicContact CD1-CH2 4.07Å; F459-W493 HydrophobicContact CD1-CZ2 4.3Å; F459-W493 AromaticContact CD1-CZ3 3.88Å; F459-W493 HydrophobicContact CD1-CZ3 3.88Å; F459-W493 HydrophobicContact CE1-CD2 4.41Å; I462-W493 HydrophobicContact CB-CE3 4.28Å; I462-W493 HydrophobicContact CG2-CB 4.06Å; I462-W493 HydrophobicContact CG2-CE3 4.04Å; I466-W493 HydrophobicContact CD1-CB 3.74Å; I466-W493 HydrophobicContact CD1-CD2 4.14Å; I466-W493 HydrophobicContact CD1-CE3 4.05Å; I466-W493 HydrophobicContact CD1-CG 4.07Å; F489-W493 PolarHBondContact O-N 3.38Å; C490-W493 WeakPolarHBondContact O-CB 3.42Å; C490-W493 PolarHBondContact O-N 3.14Å; C490-W493 VanDerWaalsContact O-N 3.09Å; E491-W493 VanDerWaalsContact C-N 3.3Å; E491-W493 PolarHBondContact O-N 3.27Å; W493-S495 VanDerWaalsContact C-N 3.29Å; W493-S495 PolarHBondContact O-N 2.83Å; W493-Q496 CarbonylContact O-C 3Å; W493-Q496 WeakPolarHBondContact O-CA 3.14Å; W493-Q496 WeakPolarHBondContact O-CB 3.48Å; W493-Q496 PolarHBondContact O-N 3.22Å; W493-L497 PolarHBondContact O-N 3.06Å
494	D	93.6	Very high	95.7	Very high	42 Å²	42	33.3 Å²	33.3	23%	0.225	19%	0.186	C	C	.	.	H	α-helix	trans	-64.6	-35.8	177.1	-66.1	-23.7	0	0	0	111.1	H400 L403 C490 E491 L497 C498	H400-D494 VanDerWaalsContact CE1-CG 3.46Å; H400-D494 IonicContact CE1-OD1 3.38Å; H400-D494 PolarHBondContact CE1-OD1 2.78Å; H400-D494 IonicContact CE1-OD2 3.73Å; H400-D494 VanDerWaalsContact ND1-CG 3.25Å; H400-D494 IonicContact ND1-OD1 3.27Å; H400-D494 PolarHBondContact ND1-OD1 3.36Å; H400-D494 IonicContact ND1-OD2 2.67Å; H400-D494 PolarHBondContact ND1-OD2 3.02Å; L403-D494 WeakPolarHBondContact CD1-OD1 3.48Å; C490-D494 PolarHBondContact O-N 3.14Å; E491-D494 PolarHBondContact O-N 3.35Å; D494-L497 PolarHBondContact O-N 2.74Å; D494-C498 PolarHBondContact O-N 2.85Å; D494-C498 VanDerWaalsContact O-N 3.12Å; D494-C498 PolarHBondContact O-SG 3.48Å
495	S	93.8	Very high	95.5	Very high	44 Å²	44	36.2 Å²	36.2	31%	0.308	20%	0.198	S	C	.	.	H	α-helix	trans	-57.5	-46.3	164.7	160.2	0	0	0	0	111.9	K218 E491 W493 L497 C498 D499	K218-S495 WeakPolarHBondContact CE-OG 3.4Å; K218-S495 PolarHBondContact NZ-OG 3.06Å; E491-S495 VanDerWaalsContact O-CB 3.3Å; E491-S495 WeakPolarHBondContact O-CB 3.48Å; E491-S495 PolarHBondContact O-N 3.44Å; W493-S495 VanDerWaalsContact C-N 3.29Å; W493-S495 PolarHBondContact O-N 2.83Å; S495-L497 VanDerWaalsContact C-N 3.33Å; S495-L497 PolarHBondContact O-N 3.11Å; S495-C498 WeakPolarHBondContact O-CB 3.41Å; S495-C498 PolarHBondContact O-N 3.22Å; S495-C498 VanDerWaalsContact O-N 3.1Å; S495-D499 VanDerWaalsContact O-CG 3.27Å; S495-D499 PolarHBondContact O-N 3.23Å
496	Q	95.1	Very high	95.2	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.019	22%	0.219	C	C	.	.	H	α-helix	trans	-66.7	-32.8	-179.4	-165.8	59.7	41	0	0	113.1	T458 F459 A492 W493 C498 D499 M500	T458-Q496 HydrophobicContact CG2-CB 4.38Å; T458-Q496 HydrophobicContact CG2-CG 3.8Å; T458-Q496 VanDerWaalsContact CG2-OE1 3.22Å; F459-Q496 HydrophobicContact CD1-CB 4.39Å; F459-Q496 HydrophobicContact CD1-CG 4.01Å; F459-Q496 HydrophobicContact CD2-CG 4.24Å; F459-Q496 HydrophobicContact CE1-CB 3.8Å; F459-Q496 HydrophobicContact CE1-CG 3.62Å; F459-Q496 HydrophobicContact CE2-CG 3.89Å; F459-Q496 HydrophobicContact CG-CG 4.3Å; F459-Q496 HydrophobicContact CZ-CB 4.05Å; F459-Q496 HydrophobicContact CZ-CG 3.56Å; A492-Q496 PolarHBondContact O-N 3.41Å; A492-Q496 VanDerWaalsContact O-N 3.17Å; W493-Q496 CarbonylContact O-C 3Å; W493-Q496 WeakPolarHBondContact O-CA 3.14Å; W493-Q496 WeakPolarHBondContact O-CB 3.48Å; W493-Q496 PolarHBondContact O-N 3.22Å; Q496-C498 VanDerWaalsContact C-N 3.35Å; Q496-D499 PolarHBondContact O-N 3.04Å; Q496-M500 WeakPolarHBondContact O-CB 3.09Å; Q496-M500 PolarHBondContact O-N 3.38Å
497	L	95.3	Very high	95	Very high	16 Å²	16	40.7 Å²	40.7	8%	0.084	22%	0.218	C	C	.	.	H	α-helix	trans	-64.1	-39.5	170	-69.1	171.4	0	0	0	111.6	L394 H397 L432 F459 W493 D494 S495 M500 A501	L394-L497 HydrophobicContact CD2-CB 4.39Å; L394-L497 HydrophobicContact CD2-CD2 4.07Å; H397-L497 HydrophobicContact CB-CD1 3.91Å; H397-L497 HydrophobicContact CB-CD2 4.21Å; L432-L497 HydrophobicContact CD1-CD2 4.15Å; L432-L497 HydrophobicContact CD2-CD2 3.7Å; F459-L497 HydrophobicContact CE1-CD2 3.96Å; F459-L497 HydrophobicContact CE1-CG 4.19Å; F459-L497 HydrophobicContact CZ-CD2 3.94Å; F459-L497 HydrophobicContact CZ-CG 4.4Å; W493-L497 PolarHBondContact O-N 3.06Å; D494-L497 PolarHBondContact O-N 2.74Å; S495-L497 VanDerWaalsContact C-N 3.33Å; S495-L497 PolarHBondContact O-N 3.11Å; L497-M500 PolarHBondContact O-N 3.36Å; L497-A501 PolarHBondContact O-N 3.13Å
498	C	94.3	Very high	94.8	Very high	81 Å²	81	38.9 Å²	38.9	55%	0.547	21%	0.211	S	C	.	.	H	α-helix	trans	-65.6	-42	174.6	-64.8	0	0	0	0	112.1	D494 S495 Q496 A501 L502	D494-C498 PolarHBondContact O-N 2.85Å; D494-C498 VanDerWaalsContact O-N 3.12Å; D494-C498 PolarHBondContact O-SG 3.48Å; S495-C498 WeakPolarHBondContact O-CB 3.41Å; S495-C498 PolarHBondContact O-N 3.22Å; S495-C498 VanDerWaalsContact O-N 3.1Å; Q496-C498 VanDerWaalsContact C-N 3.35Å; C498-A501 WeakPolarHBondContact O-CB 3.38Å; C498-A501 PolarHBondContact O-N 2.86Å; C498-L502 PolarHBondContact O-N 3.37Å
499	D	94.1	Very high	94.2	Very high	63 Å²	63	37.7 Å²	37.7	34%	0.337	20%	0.204	S	C	.	.	H	α-helix	trans	-64.8	-40.2	176.2	-62.6	-32.7	0	0	0	111.3	K218 S495 Q496 A501 L502 L503	K218-D499 IonicContact NZ-OD2 2.72Å; K218-D499 PolarHBondContact NZ-OD2 3.07Å; S495-D499 VanDerWaalsContact O-CG 3.27Å; S495-D499 PolarHBondContact O-N 3.23Å; Q496-D499 PolarHBondContact O-N 3.04Å; D499-A501 VanDerWaalsContact C-N 3.33Å; D499-A501 PolarHBondContact O-N 3.17Å; D499-L502 PolarHBondContact O-N 2.97Å; D499-L503 WeakPolarHBondContact O-CB 3.47Å; D499-L503 PolarHBondContact O-N 3.23Å
500	M	95.6	Very high	93.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.2	-38.3	172.9	-174.3	-176.4	-178.7	0	0	112.1	A390 L394 L432 T435 L439 F459 Q496 L497 L502 L503 L504	A390-M500 HydrophobicContact CB-CE 4.28Å; L394-M500 HydrophobicContact CD1-CG 4.46Å; L394-M500 HydrophobicContact CD2-CB 4.4Å; L394-M500 HydrophobicContact CD2-CG 4.39Å; L394-M500 HydrophobicContact CD2-SD 4.11Å; L394-M500 HydrophobicContact CG-SD 4.48Å; L432-M500 HydrophobicContact CD2-CE 4.33Å; L432-M500 HydrophobicContact CD2-SD 3.66Å; T435-M500 HydrophobicContact CG2-CE 3.66Å; L439-M500 HydrophobicContact CD1-CE 4.03Å; F459-M500 HydrophobicContact CE2-CB 4.34Å; F459-M500 HydrophobicContact CE2-SD 3.78Å; F459-M500 HydrophobicContact CZ-CB 4.32Å; F459-M500 HydrophobicContact CZ-SD 4.05Å; Q496-M500 WeakPolarHBondContact O-CB 3.09Å; Q496-M500 PolarHBondContact O-N 3.38Å; L497-M500 PolarHBondContact O-N 3.36Å; M500-L502 VanDerWaalsContact C-N 3.34Å; M500-L503 PolarHBondContact O-N 2.88Å; M500-L504 VanDerWaalsContact O-CB 3.28Å; M500-L504 WeakPolarHBondContact O-CB 3.28Å; M500-L504 PolarHBondContact O-N 2.98Å
501	A	95.4	Very high	93.3	Very high	45 Å²	45	41 Å²	41	37%	0.372	22%	0.22	S	C	.	.	H	α-helix	trans	-67.7	-32.3	175.2	0	0	0	0	0	112.9	L394 L497 C498 D499 K505	L394-A501 HydrophobicContact CD1-CB 3.96Å; L497-A501 PolarHBondContact O-N 3.13Å; C498-A501 WeakPolarHBondContact O-CB 3.38Å; C498-A501 PolarHBondContact O-N 2.86Å; D499-A501 VanDerWaalsContact C-N 3.33Å; D499-A501 PolarHBondContact O-N 3.17Å; A501-K505 PolarHBondContact O-N 3.43Å
502	L	93.3	Very high	92.7	Very high	89 Å²	89	40.8 Å²	40.8	47%	0.466	22%	0.219	S	C	.	.	H	α-helix	trans	-70.7	-47.3	171.9	-68.6	174.2	0	0	0	111.4	C498 D499 M500 L504 K505 E506	C498-L502 PolarHBondContact O-N 3.37Å; D499-L502 PolarHBondContact O-N 2.97Å; M500-L502 VanDerWaalsContact C-N 3.34Å; L502-L504 VanDerWaalsContact C-N 3.35Å; L502-L504 PolarHBondContact O-N 3.21Å; L502-K505 WeakPolarHBondContact O-CA 3.29Å; L502-K505 WeakPolarHBondContact O-CB 3.5Å; L502-K505 PolarHBondContact O-N 3.1Å; L502-E506 PolarHBondContact O-N 3.36Å
503	L	95.1	Very high	91.7	Very high	6 Å²	6	43.5 Å²	43.5	3%	0.031	25%	0.247	C	C	.	.	H	α-helix	trans	-53.9	-49.1	174.1	171.7	61.5	0	0	0	111.6	L448 T451 C452 A455 D499 M500 K505 E506 I507	L448-L503 HydrophobicContact CB-CD1 4.47Å; L448-L503 HydrophobicContact CD2-CD1 4Å; T451-L503 HydrophobicContact CG2-CD1 3.86Å; T451-L503 HydrophobicContact CG2-CD2 4.28Å; T451-L503 HydrophobicContact CG2-CG 4.47Å; C452-L503 HydrophobicContact CB-CD2 4.48Å; A455-L503 HydrophobicContact CB-CD2 4.41Å; D499-L503 WeakPolarHBondContact O-CB 3.47Å; D499-L503 PolarHBondContact O-N 3.23Å; M500-L503 PolarHBondContact O-N 2.88Å; L503-K505 PolarHBondContact O-N 2.99Å; L503-E506 PolarHBondContact O-N 3.48Å; L503-E506 VanDerWaalsContact O-N 3.13Å; L503-I507 HydrophobicContact CD1-CD1 3.81Å; L503-I507 HydrophobicContact CD1-CG1 4.11Å; L503-I507 HydrophobicContact CG-CD1 3.92Å; L503-I507 WeakPolarHBondContact O-CG1 3.41Å; L503-I507 PolarHBondContact O-N 3.23Å
504	L	96	Very high	90.1	Very high	13 Å²	13	47.7 Å²	47.7	7%	0.068	26%	0.263	C	S	.	.	H	α-helix	trans	-58.2	-37.3	176.8	-177.4	62	0	0	0	112.3	V387 A390 L394 L439 M500 L502 N508	V387-L504 HydrophobicContact CB-CD1 4.16Å; V387-L504 HydrophobicContact CG1-CD1 4.01Å; V387-L504 HydrophobicContact CG2-CD1 3.86Å; A390-L504 HydrophobicContact CB-CD1 3.71Å; A390-L504 HydrophobicContact CB-CD2 3.83Å; A390-L504 HydrophobicContact CB-CG 4.39Å; L394-L504 HydrophobicContact CD1-CD2 3.74Å; L439-L504 HydrophobicContact CD1-CD1 4.39Å; L439-L504 HydrophobicContact CD2-CD1 3.68Å; M500-L504 VanDerWaalsContact O-CB 3.28Å; M500-L504 WeakPolarHBondContact O-CB 3.28Å; M500-L504 PolarHBondContact O-N 2.98Å; L502-L504 VanDerWaalsContact C-N 3.35Å; L502-L504 PolarHBondContact O-N 3.21Å; L504-N508 PolarHBondContact O-N 3.46Å; L504-N508 PolarHBondContact O-ND2 3.04Å
505	K	92.9	Very high	87.9	Confident	132 Å²	132	51.6 Å²	51.6	57%	0.574	28%	0.275	S	S	*	.	H	α-helix	trans	-67.8	-41.3	176.7	-164	179	-169.8	170	0	111.8	A501 L502 L503 D509	A501-K505 PolarHBondContact O-N 3.43Å; L502-K505 WeakPolarHBondContact O-CA 3.29Å; L502-K505 WeakPolarHBondContact O-CB 3.5Å; L502-K505 PolarHBondContact O-N 3.1Å; L503-K505 PolarHBondContact O-N 2.99Å; K505-D509 PolarHBondContact O-N 2.76Å
506	E	91.6	Very high	85.5	Confident	94 Å²	94	51.7 Å²	51.7	44%	0.439	28%	0.283	S	S	.	.	H	α-helix	trans	-71	-39.8	179.1	-68.6	-170.5	-172.2	0	0	112.6	L448 L502 L503 N508 D509 V510	L448-E506 HydrophobicContact CD1-CB 4.44Å; L448-E506 HydrophobicContact CD2-CB 4.24Å; L502-E506 PolarHBondContact O-N 3.36Å; L503-E506 PolarHBondContact O-N 3.48Å; L503-E506 VanDerWaalsContact O-N 3.13Å; E506-N508 VanDerWaalsContact C-N 3.28Å; E506-N508 PolarHBondContact O-N 3.29Å; E506-D509 WeakPolarHBondContact CA-OD2 3.44Å; E506-D509 WeakPolarHBondContact O-CB 3.28Å; E506-D509 PolarHBondContact O-N 3.12Å; E506-V510 VanDerWaalsContact O-CG2 3.27Å; E506-V510 WeakPolarHBondContact O-CG2 3.45Å; E506-V510 PolarHBondContact O-N 3.22Å
507	I	93.8	Very high	82.8	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-56.6	-42.4	173.6	-71.8	174	0	0	0	111	V387 L439 V442 L448 L503 D509 V510 F511	V387-I507 HydrophobicContact CG2-CG2 4.49Å; L439-I507 HydrophobicContact CB-CD1 3.99Å; L439-I507 HydrophobicContact CD2-CD1 4.21Å; V442-I507 HydrophobicContact CG2-CG2 4.41Å; L448-I507 HydrophobicContact CD1-CG1 4.14Å; L503-I507 HydrophobicContact CD1-CD1 3.81Å; L503-I507 HydrophobicContact CD1-CG1 4.11Å; L503-I507 HydrophobicContact CG-CD1 3.92Å; L503-I507 WeakPolarHBondContact O-CG1 3.41Å; L503-I507 PolarHBondContact O-N 3.23Å; I507-D509 VanDerWaalsContact C-N 3.32Å; I507-D509 PolarHBondContact O-N 2.61Å; I507-V510 PolarHBondContact O-N 2.66Å; I507-F511 WeakPolarHBondContact O-CB 3.49Å; I507-F511 PolarHBondContact O-N 3Å
508	N	92.2	Very high	80.1	Confident	34 Å²	34	60.6 Å²	60.6	18%	0.182	33%	0.327	C	S	.	.	H	α-helix	trans	-64.5	-32.5	174.7	-79.2	-66.9	0	0	0	113.3	H383 V387 L504 E506 F511 E512	H383-N508 PolarHBondContact NE2-OD1 3.12Å; V387-N508 VanDerWaalsContact CG1-ND2 3.31Å; V387-N508 WeakPolarHBondContact CG1-ND2 3.48Å; L504-N508 PolarHBondContact O-N 3.46Å; L504-N508 PolarHBondContact O-ND2 3.04Å; E506-N508 VanDerWaalsContact C-N 3.28Å; E506-N508 PolarHBondContact O-N 3.29Å; N508-F511 PolarHBondContact O-N 3.47Å; N508-E512 VanDerWaalsContact O-CB 3.31Å; N508-E512 WeakPolarHBondContact O-CB 3.46Å; N508-E512 WeakPolarHBondContact O-CG 3.39Å; N508-E512 PolarHBondContact O-N 2.94Å
509	D	86.6	Confident	77.5	Confident	4 Å²	4	64.5 Å²	64.5	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-71.5	-35.3	174.4	-54.5	-54.6	0	0	0	113.2	K505 E506 I507 F511 G513 R514 R515 K518	K505-D509 PolarHBondContact O-N 2.76Å; E506-D509 WeakPolarHBondContact CA-OD2 3.44Å; E506-D509 WeakPolarHBondContact O-CB 3.28Å; E506-D509 PolarHBondContact O-N 3.12Å; I507-D509 VanDerWaalsContact C-N 3.32Å; I507-D509 PolarHBondContact O-N 2.61Å; D509-F511 VanDerWaalsContact C-N 3.28Å; D509-G513 CarbonylContact O-C 3.58Å; D509-G513 PolarHBondContact O-N 2.9Å; D509-R514 HydrophobicContact CB-CB 4.03Å; D509-R514 PolarHBondContact O-N 3.33Å; D509-R514 IonicContact OD1-CZ 3.62Å; D509-R514 IonicContact OD1-NE 2.88Å; D509-R514 PolarHBondContact OD1-NE 3.44Å; D509-R514 IonicContact OD1-NH2 3.5Å; D509-R514 PolarHBondContact OD1-NH2 3.05Å; D509-R515 PolarHBondContact O-N 3.39Å; D509-K518 VanDerWaalsContact CG-CE 3.47Å; D509-K518 WeakPolarHBondContact OD1-CE 3.33Å; D509-K518 IonicContact OD1-NZ 3.89Å; D509-K518 PolarHBondContact OD1-NZ 3.39Å; D509-K518 WeakPolarHBondContact OD2-CD 3.46Å; D509-K518 WeakPolarHBondContact OD2-CE 3.4Å; D509-K518 IonicContact OD2-NZ 3.75Å; D509-K518 PolarHBondContact OD2-NZ 3.41Å
510	V	87.9	Confident	75	Confident	18 Å²	18	63.4 Å²	63.4	11%	0.109	33%	0.326	C	S	.	.	H	α-helix	trans	-63.9	-41.9	173.3	-171	0	0	0	0	109.8	T445 L448 E506 I507 G513 R515	T445-V510 HydrophobicContact CG2-CG1 4.01Å; L448-V510 HydrophobicContact CD1-CG2 3.35Å; E506-V510 VanDerWaalsContact O-CG2 3.27Å; E506-V510 WeakPolarHBondContact O-CG2 3.45Å; E506-V510 PolarHBondContact O-N 3.22Å; I507-V510 PolarHBondContact O-N 2.66Å; V510-G513 PolarHBondContact O-N 2.91Å; V510-R515 HydrophobicContact CG2-CB 4.24Å; V510-R515 VanDerWaalsContact CG2-CD 3.48Å; V510-R515 HydrophobicContact CG2-CG 3.98Å
511	F	87.4	Confident	72.4	Confident	52 Å²	52	67.1 Å²	67.1	23%	0.228	34%	0.341	C	S	.	.	H	α-helix	trans	-67.4	-45.1	178.9	-172.1	-89.4	0	0	0	113.1	R379 R380 H383 I507 N508 D509 G513	R379-F511 HydrophobicContact CG-CE2 4.3Å; R380-F511 HydrophobicContact CG-CZ 4.05Å; H383-F511 HydrophobicContact CB-CD2 3.72Å; H383-F511 HydrophobicContact CB-CE2 3.41Å; H383-F511 VanDerWaalsContact CB-CE2 3.41Å; H383-F511 HydrophobicContact CB-CG 4.5Å; H383-F511 HydrophobicContact CB-CZ 3.98Å; H383-F511 AromaticContact CD2-CD1 3.76Å; H383-F511 AromaticContact CD2-CD2 3.78Å; H383-F511 AromaticContact CD2-CE1 3.96Å; H383-F511 AromaticContact CD2-CE2 3.97Å; H383-F511 AromaticContact CD2-CG 3.67Å; H383-F511 WeakPolarHBondContact CE1-CB 3.27Å; H383-F511 AromaticContact CE1-CD2 3.67Å; H383-F511 AromaticContact CE1-CG 3.41Å; H383-F511 VanDerWaalsContact CE1-CG 3.41Å; H383-F511 WeakPolarHBondContact CE1-CG 3.37Å; H383-F511 AromaticContact CG-CD2 3.3Å; H383-F511 AromaticContact CG-CE2 3.48Å; H383-F511 VanDerWaalsContact CG-CE2 3.48Å; H383-F511 AromaticContact CG-CG 3.66Å; H383-F511 AromaticContact ND1-CD2 3.24Å; H383-F511 WeakPolarHBondContact ND1-CD2 3.34Å; H383-F511 AromaticContact ND1-CE2 3.91Å; H383-F511 AromaticContact ND1-CG 3.52Å; H383-F511 AromaticContact NE2-CD1 3.74Å; H383-F511 AromaticContact NE2-CD2 3.98Å; H383-F511 AromaticContact NE2-CG 3.51Å; I507-F511 WeakPolarHBondContact O-CB 3.49Å; I507-F511 PolarHBondContact O-N 3Å; N508-F511 PolarHBondContact O-N 3.47Å; D509-F511 VanDerWaalsContact C-N 3.28Å; F511-G513 VanDerWaalsContact C-N 3.27Å; F511-G513 PolarHBondContact O-N 3.41Å
512	E	82.7	Confident	70	Confident	109 Å²	109	68.3 Å²	68.3	51%	0.509	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	2.9	178.3	-66.5	-179.3	-100.7	0	0	113.7	N508 R514	N508-E512 VanDerWaalsContact O-CB 3.31Å; N508-E512 WeakPolarHBondContact O-CB 3.46Å; N508-E512 WeakPolarHBondContact O-CG 3.39Å; N508-E512 PolarHBondContact O-N 2.94Å; E512-R514 HydrophobicContact CB-CG 4.36Å; E512-R514 PolarHBondContact O-N 3.17Å; E512-R514 IonicContact OE1-CZ 3.62Å; E512-R514 IonicContact OE1-NH1 2.72Å; E512-R514 PolarHBondContact OE1-NH1 3.45Å; E512-R514 VanDerWaalsContact OE1-NH1 3.08Å; E512-R514 IonicContact OE1-NH2 2.7Å; E512-R514 PolarHBondContact OE1-NH2 3.33Å; E512-R514 IonicContact OE2-CZ 3.44Å; E512-R514 IonicContact OE2-NH1 2.74Å; E512-R514 PolarHBondContact OE2-NH1 3.22Å; E512-R514 IonicContact OE2-NH2 3.37Å
513	G	73.9	Confident	67.7	Low	64 Å²	64	65.3 Å²	65.3	66%	0.66	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	-3.2	-179.8	0	0	0	0	0	115.8	D509 V510 F511 R515	D509-G513 CarbonylContact O-C 3.58Å; D509-G513 PolarHBondContact O-N 2.9Å; V510-G513 PolarHBondContact O-N 2.91Å; F511-G513 VanDerWaalsContact C-N 3.27Å; F511-G513 PolarHBondContact O-N 3.41Å; G513-R515 PolarHBondContact O-N 3.25Å; G513-R515 VanDerWaalsContact O-N 3.07Å
514	R	60.7	Low	65.6	Low	91 Å²	91	65.8 Å²	65.8	34%	0.343	33%	0.33	S	S	.	.			trans	-70.2	5.3	178.4	-60.1	-166.4	-58.4	-106.8	-15.6	114.9	D509 E512 G516 D517	D509-R514 HydrophobicContact CB-CB 4.03Å; D509-R514 PolarHBondContact O-N 3.33Å; D509-R514 IonicContact OD1-CZ 3.62Å; D509-R514 IonicContact OD1-NE 2.88Å; D509-R514 PolarHBondContact OD1-NE 3.44Å; D509-R514 IonicContact OD1-NH2 3.5Å; D509-R514 PolarHBondContact OD1-NH2 3.05Å; E512-R514 HydrophobicContact CB-CG 4.36Å; E512-R514 PolarHBondContact O-N 3.17Å; E512-R514 IonicContact OE1-CZ 3.62Å; E512-R514 IonicContact OE1-NH1 2.72Å; E512-R514 PolarHBondContact OE1-NH1 3.45Å; E512-R514 VanDerWaalsContact OE1-NH1 3.08Å; E512-R514 IonicContact OE1-NH2 2.7Å; E512-R514 PolarHBondContact OE1-NH2 3.33Å; E512-R514 IonicContact OE2-CZ 3.44Å; E512-R514 IonicContact OE2-NH1 2.74Å; E512-R514 PolarHBondContact OE2-NH1 3.22Å; E512-R514 IonicContact OE2-NH2 3.37Å; R514-G516 PolarHBondContact O-N 2.94Å; R514-D517 PolarHBondContact O-N 3.22Å; R514-D517 VanDerWaalsContact O-N 3.15Å
515	R	48.4	Very low	63.5	Low	124 Å²	124	65.4 Å²	65.4	47%	0.468	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	64.4	-179.1	-157.7	-163.2	-155.1	-129.8	1.1	112.4	T445 D509 V510 G513	T445-R515 PolarHBondContact OG1-NH2 2.83Å; D509-R515 PolarHBondContact O-N 3.39Å; V510-R515 HydrophobicContact CG2-CB 4.24Å; V510-R515 VanDerWaalsContact CG2-CD 3.48Å; V510-R515 HydrophobicContact CG2-CG 3.98Å; G513-R515 PolarHBondContact O-N 3.25Å; G513-R515 VanDerWaalsContact O-N 3.07Å
516	G	42.8	Very low	61.7	Low	47 Å²	47	66.9 Å²	66.9	49%	0.485	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-173.8	-29	179	0	0	0	0	0	111.6	R514 K518	R514-G516 PolarHBondContact O-N 2.94Å; G516-K518 VanDerWaalsContact C-N 3.32Å; G516-K518 PolarHBondContact O-N 2.86Å
517	D	39.5	Very low	59.7	Low	118 Å²	118	65.2 Å²	65.2	63%	0.631	33%	0.327	S	S	*	.	S	Bend	trans	-85.5	4.2	179.9	-61.8	-43.3	0	0	0	114.3	R514	R514-D517 PolarHBondContact O-N 3.22Å; R514-D517 VanDerWaalsContact O-N 3.15Å
518	K	37.9	Very low	57.3	Low	89 Å²	89	67 Å²	67	39%	0.387	35%	0.345	S	S	.	.			trans	-108.5	117.6	175.4	-72.1	-168.8	178.2	173.1	0	111.1	D509 G516	D509-K518 VanDerWaalsContact CG-CE 3.47Å; D509-K518 WeakPolarHBondContact OD1-CE 3.33Å; D509-K518 IonicContact OD1-NZ 3.89Å; D509-K518 PolarHBondContact OD1-NZ 3.39Å; D509-K518 WeakPolarHBondContact OD2-CD 3.46Å; D509-K518 WeakPolarHBondContact OD2-CE 3.4Å; D509-K518 IonicContact OD2-NZ 3.75Å; D509-K518 PolarHBondContact OD2-NZ 3.41Å; G516-K518 VanDerWaalsContact C-N 3.32Å; G516-K518 PolarHBondContact O-N 2.86Å
519	R	39.1	Very low	54.7	Low	162 Å²	162	70.9 Å²	70.9	61%	0.611	36%	0.361	S	S	*	.			cis	-127	151.3	-5.8	-56.7	179.5	-169.5	178.2	4.4	109.4
520	P	41.1	Very low	52.4	Low	41 Å²	41	78.5 Å²	78.5	27%	0.266	40%	0.396	S	S	.	.			trans	-61.6	157	162.2	29.2	-34.7	0	0	0	110.8	L522 Q547 A551	P520-L522 PolarHBondContact O-N 2.95Å; P520-Q547 HydrophobicContact CG-CB 4.38Å; P520-A551 HydrophobicContact CB-CB 3.88Å; P520-A551 HydrophobicContact CG-CB 4.32Å
521	Y	42.5	Very low	49.7	Very low	77 Å²	77	82.2 Å²	82.2	30%	0.302	42%	0.423	S	S	.	.			trans	-68.6	119	-171.6	-175.5	-126.8	0	0	0	111.8	S523 P525 T596	Y521-S523 WeakPolarHBondContact CD1-O 3.28Å; Y521-S523 WeakPolarHBondContact CE1-O 3.34Å; Y521-S523 PolarHBondContact O-N 3.07Å; Y521-S523 VanDerWaalsContact O-N 3.1Å; Y521-P525 HydrophobicContact CE1-CB 4.43Å; Y521-P525 HydrophobicContact CE1-CG 3.57Å; Y521-T596 VanDerWaalsContact CB-O 3.26Å; Y521-T596 WeakPolarHBondContact CB-O 3.24Å
522	L	43.9	Very low	47.1	Very low	71 Å²	71	84.6 Å²	84.6	37%	0.372	45%	0.452	S	S	.	.	S	Bend	trans	-75.9	1.2	-162.5	-64.7	175.2	0	0	0	115.9	P520 K541 L542	P520-L522 PolarHBondContact O-N 2.95Å; L522-K541 WeakPolarHBondContact O-CA 3.41Å; L522-K541 WeakPolarHBondContact O-CG 3.41Å; L522-L542 PolarHBondContact O-N 3.01Å
523	S	46.3	Very low	44.6	Very low	25 Å²	25	85.8 Å²	85.8	18%	0.175	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	139.4	179.9	56.6	0	0	0	0	109.4	Y521 V540	Y521-S523 WeakPolarHBondContact CD1-O 3.28Å; Y521-S523 WeakPolarHBondContact CE1-O 3.34Å; Y521-S523 PolarHBondContact O-N 3.07Å; Y521-S523 VanDerWaalsContact O-N 3.1Å; S523-V540 VanDerWaalsContact CA-O 3.25Å; S523-V540 WeakPolarHBondContact CA-O 3.48Å; S523-V540 WeakPolarHBondContact CB-O 3.47Å
524	L	50.5	Low	42.9	Very low	17 Å²	17	91.1 Å²	91.1	9%	0.089	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	148.7	171.1	-71.7	173.6	0	0	0	111.2	V540 L542 F595 T605 T669 F670 V673	L524-V540 PolarHBondContact N-O 3.01Å; L524-L542 HydrophobicContact CD1-CD2 4.29Å; L524-L542 HydrophobicContact CD2-CD1 4.34Å; L524-L542 HydrophobicContact CG-CD1 4.17Å; L524-L542 HydrophobicContact CG-CD2 4.04Å; L524-L542 HydrophobicContact CG-CG 4.36Å; L524-F595 HydrophobicContact CD2-CE1 4.27Å; L524-F595 HydrophobicContact CD2-CZ 4.46Å; L524-T605 HydrophobicContact CB-CG2 4.04Å; L524-T605 HydrophobicContact CD1-CG2 4.35Å; L524-T669 HydrophobicContact CD1-CG2 4.48Å; L524-F670 HydrophobicContact CD1-CB 4.18Å; L524-F670 HydrophobicContact CD1-CD2 4.2Å; L524-V673 HydrophobicContact CD1-CG2 4.15Å; L524-V673 HydrophobicContact CD2-CB 4.33Å; L524-V673 HydrophobicContact CD2-CG1 3.87Å; L524-V673 HydrophobicContact CD2-CG2 4.17Å
525	P	52.2	Low	41.6	Very low	5 Å²	5	95.4 Å²	95.4	3%	0.032	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-64.1	164.3	175.2	-13.9	29.8	0	0	0	110.2	Y521 F595 K603	Y521-P525 HydrophobicContact CE1-CB 4.43Å; Y521-P525 HydrophobicContact CE1-CG 3.57Å; P525-F595 HydrophobicContact CB-CE2 4.34Å; P525-F595 VanDerWaalsContact CD-CZ 3.43Å; P525-F595 HydrophobicContact CG-CD2 3.93Å; P525-F595 HydrophobicContact CG-CE2 3.41Å; P525-F595 VanDerWaalsContact CG-CE2 3.41Å; P525-F595 HydrophobicContact CG-CZ 3.76Å; P525-K603 WeakPolarHBondContact CB-O 3.38Å
526	R	55.4	Low	40.9	Very low	163 Å²	163	95.9 Å²	95.9	62%	0.615	51%	0.512	S	S	*	.	B	Isolated β-bridge	trans	-56.2	137.7	-167.2	-62.9	177.7	-175.7	166	2.4	111.7	G528 T604 T605	R526-G528 PolarHBondContact O-N 2.93Å; R526-T604 WeakPolarHBondContact O-CA 3.26Å; R526-T604 VanDerWaalsContact O-CB 3.24Å; R526-T604 WeakPolarHBondContact O-CB 3.35Å; R526-T605 PolarHBondContact O-N 2.87Å
527	P	48.2	Very low	40.8	Very low	58 Å²	58	96.1 Å²	96.1	38%	0.377	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-59.1	128	164.4	-23.5	34.3	0	0	0	110.4
528	G	43.2	Very low	41.1	Very low	38 Å²	38	99.3 Å²	99.3	39%	0.392	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-61.7	143.3	175.2	0	0	0	0	0	111.6	R526	R526-G528 PolarHBondContact O-N 2.93Å
529	K	39	Very low	41.6	Very low	115 Å²	115	97.7 Å²	97.7	50%	0.5	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-103.1	134.1	178.7	-89	-166.2	171.3	-174	0	112.1	N533 K535	K529-N533 PolarHBondContact NZ-O 3.39Å; K529-K535 PolarHBondContact NZ-O 3.01Å
530	H	38.5	Very low	42.4	Very low	165 Å²	165	93 Å²	93	76%	0.764	51%	0.51	S	S	*	.			trans	-122.8	84	161.3	-65.9	-11.3	0	0	0	109.2
531	S	29.9	Very low	43	Very low	96 Å²	96	98.6 Å²	98.6	67%	0.671	53%	0.53	S	S	*	.	S	Bend	trans	170.4	146	161.1	38.5	0	0	0	0	110.6	N533	S531-N533 PolarHBondContact O-N 3.47Å
532	A	33.4	Very low	43.9	Very low	101 Å²	101	95.3 Å²	95.3	84%	0.835	52%	0.518	S	S	*	.	S	Bend	trans	-78	88.6	179.2	0	0	0	0	0	111.5
533	N	31	Very low	45.1	Very low	134 Å²	134	95.5 Å²	95.5	72%	0.717	52%	0.519	S	S	*	.			trans	-155.6	120.2	164.8	-108.5	-56.3	0	0	0	112.7	K529 S531 K535	K529-N533 PolarHBondContact NZ-O 3.39Å; S531-N533 PolarHBondContact O-N 3.47Å; N533-K535 PolarHBondContact O-N 2.89Å; N533-K535 VanDerWaalsContact O-N 3.1Å
534	L	36.4	Very low	46	Very low	177 Å²	177	97.8 Å²	97.8	93%	0.927	54%	0.54	S	S	*	.			trans	-81.2	86.8	-177	-84.2	78.6	0	0	0	112.1
535	K	33.8	Very low	47	Very low	180 Å²	180	104.8 Å²	104.8	78%	0.783	57%	0.572	S	S	*	*			trans	-132.4	127.4	151.4	-69.6	-172	178.4	179	0	109.2	K529 N533 A537	K529-K535 PolarHBondContact NZ-O 3.01Å; N533-K535 PolarHBondContact O-N 2.89Å; N533-K535 VanDerWaalsContact O-N 3.1Å; K535-A537 PolarHBondContact O-N 3.5Å
536	T	34.5	Very low	48.2	Very low	135 Å²	135	105.6 Å²	105.6	83%	0.828	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-71.7	116.3	-174.4	-15	0	0	0	0	110.3	K538	T536-K538 PolarHBondContact O-N 3.38Å
537	A	40.5	Very low	48.8	Very low	51 Å²	51	99.2 Å²	99.2	42%	0.421	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-71.4	126.7	171.3	0	0	0	0	0	109.1	K535	K535-A537 PolarHBondContact O-N 3.5Å
538	K	45.5	Very low	49.9	Very low	186 Å²	186	101 Å²	101	81%	0.809	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-70.4	144.4	174.5	-65.7	-175.6	177.6	-176.4	0	109.4	T536	T536-K538 PolarHBondContact O-N 3.38Å
539	A	49.2	Very low	51.7	Low	55 Å²	55	101.3 Å²	101.3	46%	0.455	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-61.5	138.7	166.5	0	0	0	0	0	108.9
540	V	54.3	Low	53.7	Low	64 Å²	64	96.3 Å²	96.3	39%	0.388	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	116.9	-173.4	-170.7	0	0	0	0	109	S523 L524 L542 K666	S523-V540 VanDerWaalsContact CA-O 3.25Å; S523-V540 WeakPolarHBondContact CA-O 3.48Å; S523-V540 WeakPolarHBondContact CB-O 3.47Å; L524-V540 PolarHBondContact N-O 3.01Å; V540-L542 PolarHBondContact O-N 3.12Å; V540-K666 HydrophobicContact CG1-CB 4.15Å; V540-K666 HydrophobicContact CG1-CD 3.83Å; V540-K666 HydrophobicContact CG1-CG 3.68Å
541	K	55.3	Low	55.5	Low	157 Å²	157	90.2 Å²	90.2	68%	0.683	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.2	130.7	178.8	-163.1	-178.1	179.4	-178.1	0	109.7	L522 K666	L522-K541 WeakPolarHBondContact O-CA 3.41Å; L522-K541 WeakPolarHBondContact O-CG 3.41Å; K541-K666 WeakPolarHBondContact O-CE 3.41Å
542	L	61.5	Low	58.1	Low	9 Å²	9	92 Å²	92	5%	0.047	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-80.6	152.8	170.2	-65.9	-178.9	0	0	0	109.8	L522 L524 V540 E546 Q547 F670	L522-L542 PolarHBondContact O-N 3.01Å; L524-L542 HydrophobicContact CD1-CD2 4.29Å; L524-L542 HydrophobicContact CD2-CD1 4.34Å; L524-L542 HydrophobicContact CG-CD1 4.17Å; L524-L542 HydrophobicContact CG-CD2 4.04Å; L524-L542 HydrophobicContact CG-CG 4.36Å; V540-L542 PolarHBondContact O-N 3.12Å; L542-E546 WeakPolarHBondContact CA-OE2 3.46Å; L542-E546 HydrophobicContact CB-CB 4.02Å; L542-E546 WeakPolarHBondContact CB-OE2 3.46Å; L542-E546 HydrophobicContact CD1-CB 4.48Å; L542-E546 HydrophobicContact CD2-CB 4.23Å; L542-E546 WeakPolarHBondContact CD2-OE2 3.42Å; L542-E546 HydrophobicContact CG-CB 4.47Å; L542-Q547 HydrophobicContact CB-CG 3.79Å; L542-Q547 PolarHBondContact O-NE2 2.94Å; L542-F670 HydrophobicContact CD1-CD2 4.14Å; L542-F670 HydrophobicContact CD1-CE2 4.01Å; L542-F670 HydrophobicContact CD2-CD2 3.53Å; L542-F670 HydrophobicContact CD2-CE2 4.11Å; L542-F670 HydrophobicContact CD2-CG 4.29Å; L542-F670 HydrophobicContact CG-CD2 4.49Å
543	D	69.3	Low	60.6	Low	74 Å²	74	87.9 Å²	87.9	40%	0.396	48%	0.475	S	S	.	.			trans	-79.7	-180	168.1	61.3	62.6	0	0	0	111.6	E545 E546 Q547 K666	D543-E545 VanDerWaalsContact C-N 3.34Å; D543-E545 PolarHBondContact OD1-N 3Å; D543-E546 PolarHBondContact N-OE2 3.46Å; D543-E546 WeakPolarHBondContact OD1-CG 3.4Å; D543-E546 PolarHBondContact OD1-N 2.86Å; D543-E546 WeakPolarHBondContact OD2-CG 3.44Å; D543-E546 VanDerWaalsContact OD2-OE2 3.14Å; D543-Q547 WeakPolarHBondContact O-CB 3.16Å; D543-Q547 WeakPolarHBondContact O-CG 3.41Å; D543-Q547 PolarHBondContact O-N 2.9Å; D543-Q547 VanDerWaalsContact O-N 3.11Å; D543-Q547 PolarHBondContact O-NE2 3.39Å; D543-K666 IonicContact OD2-NZ 3.57Å
544	A	63.9	Low	63.3	Low	73 Å²	73	81.5 Å²	81.5	60%	0.603	44%	0.441	S	S	*	.	H	α-helix	trans	-72.6	-26.4	-173.6	0	0	0	0	0	113.3	T548	A544-T548 WeakPolarHBondContact O-CB 3.39Å; A544-T548 PolarHBondContact O-N 2.72Å; A544-T548 VanDerWaalsContact O-N 3.16Å; A544-T548 PolarHBondContact O-OG1 3.32Å
545	E	71.8	Confident	65.5	Low	165 Å²	165	77 Å²	77	77%	0.771	42%	0.417	S	S	*	.	H	α-helix	trans	-82	-46.5	-179	-168.6	170	-175	0	0	109.9	D543 Q547 T548 S549	D543-E545 VanDerWaalsContact C-N 3.34Å; D543-E545 PolarHBondContact OD1-N 3Å; E545-Q547 VanDerWaalsContact C-N 3.29Å; E545-Q547 PolarHBondContact O-N 3.32Å; E545-T548 PolarHBondContact O-N 3.08Å; E545-T548 VanDerWaalsContact O-N 3.09Å; E545-S549 PolarHBondContact O-N 3.39Å
546	E	77.3	Confident	68.2	Low	21 Å²	21	70.9 Å²	70.9	10%	0.098	39%	0.391	C	S	.	.	H	α-helix	trans	-52.5	-44.9	169.3	-72.9	177.1	151.4	0	0	112.3	L542 D543 M550 K666 F670	L542-E546 WeakPolarHBondContact CA-OE2 3.46Å; L542-E546 HydrophobicContact CB-CB 4.02Å; L542-E546 WeakPolarHBondContact CB-OE2 3.46Å; L542-E546 HydrophobicContact CD1-CB 4.48Å; L542-E546 HydrophobicContact CD2-CB 4.23Å; L542-E546 WeakPolarHBondContact CD2-OE2 3.42Å; L542-E546 HydrophobicContact CG-CB 4.47Å; D543-E546 PolarHBondContact N-OE2 3.46Å; D543-E546 WeakPolarHBondContact OD1-CG 3.4Å; D543-E546 PolarHBondContact OD1-N 2.86Å; D543-E546 WeakPolarHBondContact OD2-CG 3.44Å; D543-E546 VanDerWaalsContact OD2-OE2 3.14Å; E546-M550 PolarHBondContact O-N 3.47Å; E546-K666 VanDerWaalsContact OE1-CE 3.3Å; E546-K666 WeakPolarHBondContact OE1-CE 3.5Å; E546-K666 IonicContact OE1-NZ 2.68Å; E546-K666 PolarHBondContact OE1-NZ 3.37Å; E546-K666 VanDerWaalsContact OE2-CE 3.28Å; E546-K666 WeakPolarHBondContact OE2-CE 3.43Å; E546-K666 IonicContact OE2-NZ 2.62Å; E546-K666 PolarHBondContact OE2-NZ 3.09Å; E546-F670 HydrophobicContact CB-CD2 4.24Å; E546-F670 HydrophobicContact CB-CE1 4.12Å; E546-F670 HydrophobicContact CB-CE2 3.67Å; E546-F670 HydrophobicContact CB-CZ 3.62Å; E546-F670 HydrophobicContact CG-CD1 3.96Å; E546-F670 HydrophobicContact CG-CD2 4.26Å; E546-F670 HydrophobicContact CG-CE1 3.75Å; E546-F670 HydrophobicContact CG-CE2 4.04Å; E546-F670 HydrophobicContact CG-CG 4.23Å; E546-F670 HydrophobicContact CG-CZ 3.8Å
547	Q	67.4	Low	70.9	Confident	30 Å²	30	64.4 Å²	64.4	14%	0.14	35%	0.352	C	S	.	.	H	α-helix	trans	-65	-40.1	176.6	-76.3	169.5	43.8	0	0	112.6	P520 L542 D543 E545 A551	P520-Q547 HydrophobicContact CG-CB 4.38Å; L542-Q547 HydrophobicContact CB-CG 3.79Å; L542-Q547 PolarHBondContact O-NE2 2.94Å; D543-Q547 WeakPolarHBondContact O-CB 3.16Å; D543-Q547 WeakPolarHBondContact O-CG 3.41Å; D543-Q547 PolarHBondContact O-N 2.9Å; D543-Q547 VanDerWaalsContact O-N 3.11Å; D543-Q547 PolarHBondContact O-NE2 3.39Å; E545-Q547 VanDerWaalsContact C-N 3.29Å; E545-Q547 PolarHBondContact O-N 3.32Å; Q547-A551 VanDerWaalsContact O-CB 3.28Å; Q547-A551 WeakPolarHBondContact O-CB 3.44Å; Q547-A551 PolarHBondContact O-N 2.91Å
548	T	72	Confident	73.5	Confident	95 Å²	95	67.5 Å²	67.5	58%	0.583	35%	0.352	S	S	*	.	H	α-helix	trans	-71.7	-38.8	-176.6	-58.1	0	0	0	0	111.4	A544 E545 K552	A544-T548 WeakPolarHBondContact O-CB 3.39Å; A544-T548 PolarHBondContact O-N 2.72Å; A544-T548 VanDerWaalsContact O-N 3.16Å; A544-T548 PolarHBondContact O-OG1 3.32Å; E545-T548 PolarHBondContact O-N 3.08Å; E545-T548 VanDerWaalsContact O-N 3.09Å; T548-K552 WeakPolarHBondContact O-CB 3.22Å; T548-K552 PolarHBondContact O-N 3.35Å; T548-K552 VanDerWaalsContact O-N 3.16Å
549	S	80.1	Confident	75.6	Confident	45 Å²	45	63.1 Å²	63.1	32%	0.315	34%	0.338	S	S	.	.	H	α-helix	trans	-57.5	-56	170.6	-172.9	0	0	0	0	110.8	E545 A551 K552 L553 D674	E545-S549 PolarHBondContact O-N 3.39Å; S549-A551 VanDerWaalsContact C-N 3.32Å; S549-A551 PolarHBondContact O-N 3.03Å; S549-K552 PolarHBondContact O-N 3.39Å; S549-L553 WeakPolarHBondContact O-CG 3.47Å; S549-L553 PolarHBondContact O-N 3.33Å; S549-D674 PolarHBondContact OG-OD1 2.93Å
550	M	82.6	Confident	77.7	Confident	9 Å²	9	61.6 Å²	61.6	4%	0.044	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-36	-177.8	-83	-64.5	-56.1	0	0	113.9	E546 G554 T596 F670 V673 I677	E546-M550 PolarHBondContact O-N 3.47Å; M550-G554 PolarHBondContact O-N 3.06Å; M550-T596 HydrophobicContact CE-CG2 3.47Å; M550-T596 VanDerWaalsContact CE-CG2 3.47Å; M550-F670 HydrophobicContact CG-CE2 3.61Å; M550-F670 HydrophobicContact CG-CZ 4.05Å; M550-V673 HydrophobicContact CE-CG1 3.92Å; M550-V673 HydrophobicContact SD-CG1 3.81Å; M550-I677 HydrophobicContact CE-CG1 4.03Å; M550-I677 HydrophobicContact SD-CG1 4.16Å
551	A	75.2	Confident	79.4	Confident	37 Å²	37	58.6 Å²	58.6	31%	0.306	30%	0.304	S	S	.	.	H	α-helix	trans	-63.8	-48.7	175.8	0	0	0	0	0	111.3	P520 Q547 S549 L555	P520-A551 HydrophobicContact CB-CB 3.88Å; P520-A551 HydrophobicContact CG-CB 4.32Å; Q547-A551 VanDerWaalsContact O-CB 3.28Å; Q547-A551 WeakPolarHBondContact O-CB 3.44Å; Q547-A551 PolarHBondContact O-N 2.91Å; S549-A551 VanDerWaalsContact C-N 3.32Å; S549-A551 PolarHBondContact O-N 3.03Å; A551-L555 PolarHBondContact O-N 3.41Å
552	K	85	Confident	81	Confident	133 Å²	133	54.6 Å²	54.6	58%	0.578	30%	0.295	S	S	*	.	H	α-helix	trans	-62.9	-51.9	178.7	177.2	177.8	171	178.7	0	111.6	T548 S549 G554 L555 E556	T548-K552 WeakPolarHBondContact O-CB 3.22Å; T548-K552 PolarHBondContact O-N 3.35Å; T548-K552 VanDerWaalsContact O-N 3.16Å; S549-K552 PolarHBondContact O-N 3.39Å; K552-G554 VanDerWaalsContact C-N 3.29Å; K552-G554 PolarHBondContact O-N 3.24Å; K552-L555 PolarHBondContact O-N 3.28Å; K552-L555 VanDerWaalsContact O-N 3.13Å; K552-E556 WeakPolarHBondContact CE-OE1 3.49Å; K552-E556 IonicContact NZ-OE1 2.65Å; K552-E556 WeakPolarHBondContact O-CG 3.36Å; K552-E556 PolarHBondContact O-N 2.95Å
553	L	86.1	Confident	82.5	Confident	15 Å²	15	57.9 Å²	57.9	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-37.4	-179.6	-67.7	-179.2	0	0	0	112.3	S549 L557 I677 Q678	S549-L553 WeakPolarHBondContact O-CG 3.47Å; S549-L553 PolarHBondContact O-N 3.33Å; L553-L557 WeakPolarHBondContact O-CB 3.33Å; L553-L557 PolarHBondContact O-N 3.44Å; L553-I677 HydrophobicContact CB-CG2 3.79Å; L553-Q678 HydrophobicContact CD1-CB 4.3Å; L553-Q678 VanDerWaalsContact CD2-OE1 3.3Å
554	G	86.6	Confident	83.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.6	-44.7	172.8	0	0	0	0	0	112.9	M550 K552 L557 R558 Y593	M550-G554 PolarHBondContact O-N 3.06Å; K552-G554 VanDerWaalsContact C-N 3.29Å; K552-G554 PolarHBondContact O-N 3.24Å; G554-L557 PolarHBondContact O-N 3.04Å; G554-R558 PolarHBondContact O-N 3.09Å; G554-Y593 WeakPolarHBondContact O-CD2 3.45Å
555	L	83.6	Confident	84.8	Confident	83 Å²	83	53.8 Å²	53.8	44%	0.435	28%	0.281	S	S	.	.	H	α-helix	trans	-65.1	-42.4	178.9	-175.8	62	0	0	0	112	A551 K552 L557 R558 L559	A551-L555 PolarHBondContact O-N 3.41Å; K552-L555 PolarHBondContact O-N 3.28Å; K552-L555 VanDerWaalsContact O-N 3.13Å; L555-L557 VanDerWaalsContact C-N 3.28Å; L555-L557 PolarHBondContact O-N 3.42Å; L555-R558 PolarHBondContact O-N 3.06Å; L555-L559 WeakPolarHBondContact O-CG 3.27Å; L555-L559 PolarHBondContact O-N 3.19Å; L555-L559 VanDerWaalsContact O-N 3.11Å
556	E	90.8	Very high	85.7	Confident	51 Å²	51	48.5 Å²	48.5	24%	0.238	26%	0.262	C	S	.	.	H	α-helix	trans	-58.4	-40.7	172.5	-70.8	177.4	-167.9	0	0	111.4	K552 L559 L560 R681	K552-E556 WeakPolarHBondContact CE-OE1 3.49Å; K552-E556 IonicContact NZ-OE1 2.65Å; K552-E556 WeakPolarHBondContact O-CG 3.36Å; K552-E556 PolarHBondContact O-N 2.95Å; E556-L559 PolarHBondContact O-N 2.97Å; E556-L560 WeakPolarHBondContact O-CG 3.36Å; E556-L560 PolarHBondContact O-N 3.19Å; E556-L560 VanDerWaalsContact O-N 3.09Å; E556-R681 HydrophobicContact CB-CG 4.36Å; E556-R681 WeakPolarHBondContact OE2-CD 3.23Å; E556-R681 IonicContact OE2-CZ 3.92Å; E556-R681 IonicContact OE2-NE 3.21Å; E556-R681 IonicContact OE2-NH1 2.64Å; E556-R681 PolarHBondContact OE2-NH1 3.14Å
557	L	91.9	Very high	86.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-68.6	-35.1	177.8	-168.5	63.8	0	0	0	113.2	L553 G554 L555 S561 A589 M592 I677 T680 R681 M684	L553-L557 WeakPolarHBondContact O-CB 3.33Å; L553-L557 PolarHBondContact O-N 3.44Å; G554-L557 PolarHBondContact O-N 3.04Å; L555-L557 VanDerWaalsContact C-N 3.28Å; L555-L557 PolarHBondContact O-N 3.42Å; L557-S561 PolarHBondContact O-N 3.01Å; L557-A589 HydrophobicContact CD1-CB 3.84Å; L557-A589 HydrophobicContact CD2-CB 4.44Å; L557-A589 VanDerWaalsContact CD2-O 3.29Å; L557-A589 WeakPolarHBondContact CD2-O 3.5Å; L557-A589 HydrophobicContact CG-CB 4.07Å; L557-M592 HydrophobicContact CD2-CB 3.89Å; L557-I677 HydrophobicContact CD2-CG2 4.3Å; L557-T680 HydrophobicContact CD1-CG2 4.03Å; L557-T680 HydrophobicContact CD2-CG2 4.38Å; L557-R681 HydrophobicContact CD1-CB 4.28Å; L557-M684 HydrophobicContact CD1-CG 4Å
558	R	93.4	Very high	87.3	Confident	115 Å²	115	47.1 Å²	47.1	43%	0.434	26%	0.256	S	S	.	.	H	α-helix	trans	-62.3	-46.2	172.1	168.2	173.7	171	166.2	-1.3	111.9	G554 L555 S561 S562 Y590 Y593	G554-R558 PolarHBondContact O-N 3.09Å; L555-R558 PolarHBondContact O-N 3.06Å; R558-S561 PolarHBondContact O-N 3.29Å; R558-S562 PolarHBondContact O-N 3.41Å; R558-S562 VanDerWaalsContact O-N 3.09Å; R558-Y590 HydrophobicContact CG-CE2 4.33Å; R558-Y593 HydrophobicContact CB-CD1 3.91Å; R558-Y593 HydrophobicContact CB-CD2 3.88Å; R558-Y593 HydrophobicContact CB-CE1 4.05Å; R558-Y593 HydrophobicContact CB-CE2 3.99Å; R558-Y593 HydrophobicContact CB-CG 3.79Å; R558-Y593 VanDerWaalsContact CD-CZ 3.43Å; R558-Y593 WeakPolarHBondContact CD-OH 3.47Å; R558-Y593 HydrophobicContact CG-CD1 4.34Å; R558-Y593 HydrophobicContact CG-CE1 4.14Å; R558-Y593 PolarHBondContact NH1-OH 2.83Å
559	L	89.9	Confident	88	Confident	95 Å²	95	49.9 Å²	49.9	50%	0.497	26%	0.262	S	S	.	.	H	α-helix	trans	-61.7	-51.3	-179.4	-67.8	170.9	0	0	0	109.8	L555 E556 S561 S562 D563	L555-L559 WeakPolarHBondContact O-CG 3.27Å; L555-L559 PolarHBondContact O-N 3.19Å; L555-L559 VanDerWaalsContact O-N 3.11Å; E556-L559 PolarHBondContact O-N 2.97Å; L559-S561 VanDerWaalsContact C-N 3.28Å; L559-S561 PolarHBondContact O-N 3.19Å; L559-S562 WeakPolarHBondContact O-CB 3.23Å; L559-S562 PolarHBondContact O-N 3.42Å; L559-D563 VanDerWaalsContact O-CG 3.23Å; L559-D563 PolarHBondContact O-N 3.44Å
560	L	93.1	Very high	88.4	Confident	22 Å²	22	52.8 Å²	52.8	12%	0.115	27%	0.269	C	S	.	.	H	α-helix	trans	-59.2	-33.3	177.5	-69.5	169.6	0	0	0	113.9	E556 V564 R681 M684 L688	E556-L560 WeakPolarHBondContact O-CG 3.36Å; E556-L560 PolarHBondContact O-N 3.19Å; E556-L560 VanDerWaalsContact O-N 3.09Å; L560-V564 WeakPolarHBondContact O-CB 3.23Å; L560-V564 WeakPolarHBondContact O-CG2 3.38Å; L560-V564 PolarHBondContact O-N 2.94Å; L560-V564 VanDerWaalsContact O-N 3.1Å; L560-R681 HydrophobicContact CD1-CG 3.53Å; L560-M684 HydrophobicContact CB-CB 3.94Å; L560-M684 HydrophobicContact CD1-CB 4.21Å; L560-L688 HydrophobicContact CD2-CD2 3.75Å
561	S	91.1	Very high	88.7	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.014	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-52.7	170.5	-174.4	0	0	0	0	111.1	L557 R558 L559 D563 V564 D565 A586	L557-S561 PolarHBondContact O-N 3.01Å; R558-S561 PolarHBondContact O-N 3.29Å; L559-S561 VanDerWaalsContact C-N 3.28Å; L559-S561 PolarHBondContact O-N 3.19Å; S561-D563 VanDerWaalsContact C-N 3.27Å; S561-D563 PolarHBondContact O-N 3.43Å; S561-V564 PolarHBondContact O-N 2.9Å; S561-D565 PolarHBondContact O-N 3.17Å; S561-D565 VanDerWaalsContact O-OD2 3.07Å; S561-D565 PolarHBondContact OG-OD2 3.12Å; S561-A586 PolarHBondContact OG-O 3.09Å; S561-A586 VanDerWaalsContact OG-O 3.04Å
562	S	89.3	Confident	88.9	Confident	72 Å²	72	57.8 Å²	57.8	50%	0.503	29%	0.286	S	S	.	.	H	α-helix	trans	-62.3	-34.4	-178.4	-165.3	0	0	0	0	112.8	R558 L559 S566	R558-S562 PolarHBondContact O-N 3.41Å; R558-S562 VanDerWaalsContact O-N 3.09Å; L559-S562 WeakPolarHBondContact O-CB 3.23Å; L559-S562 PolarHBondContact O-N 3.42Å; S562-S566 VanDerWaalsContact O-CB 3.32Å; S562-S566 WeakPolarHBondContact O-CB 3.4Å; S562-S566 PolarHBondContact O-N 2.92Å
563	D	92.2	Very high	88.6	Confident	78 Å²	78	56 Å²	56	42%	0.417	28%	0.279	S	S	.	.	H	α-helix	trans	-71.1	-39.3	176.8	-64.3	-30.7	0	0	0	111.5	L559 S561 E567 L688	L559-D563 VanDerWaalsContact O-CG 3.23Å; L559-D563 PolarHBondContact O-N 3.44Å; S561-D563 VanDerWaalsContact C-N 3.27Å; S561-D563 PolarHBondContact O-N 3.43Å; D563-E567 PolarHBondContact O-N 3Å; D563-L688 HydrophobicContact CB-CD1 3.85Å; D563-L688 HydrophobicContact CB-CD2 3.61Å; D563-L688 HydrophobicContact CB-CG 4.4Å
564	V	91.9	Very high	88.2	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.5	-45.9	173.9	164.2	0	0	0	0	111.1	L560 S561 S566 E567 V568 A586 M684 V687 L688 L691	L560-V564 WeakPolarHBondContact O-CB 3.23Å; L560-V564 WeakPolarHBondContact O-CG2 3.38Å; L560-V564 PolarHBondContact O-N 2.94Å; L560-V564 VanDerWaalsContact O-N 3.1Å; S561-V564 PolarHBondContact O-N 2.9Å; V564-S566 VanDerWaalsContact C-N 3.33Å; V564-S566 PolarHBondContact O-N 3.1Å; V564-E567 PolarHBondContact O-N 3.42Å; V564-V568 WeakPolarHBondContact O-CG2 3.46Å; V564-V568 PolarHBondContact O-N 3.21Å; V564-A586 HydrophobicContact CB-CB 4.4Å; V564-A586 HydrophobicContact CG1-CB 3.96Å; V564-M684 HydrophobicContact CB-CE 3.96Å; V564-M684 HydrophobicContact CG1-CE 4.23Å; V564-M684 HydrophobicContact CG2-CE 3.77Å; V564-V687 HydrophobicContact CG1-CG1 4.36Å; V564-V687 HydrophobicContact CG2-CG1 4.21Å; V564-L688 HydrophobicContact CG2-CB 3.89Å; V564-L688 HydrophobicContact CG2-CD1 4Å; V564-L688 HydrophobicContact CG2-CG 4.47Å; V564-L691 HydrophobicContact CB-CD1 4.45Å; V564-L691 HydrophobicContact CG1-CD1 3.82Å; V564-L691 HydrophobicContact CG2-CD1 4.32Å
565	D	89.6	Confident	87.7	Confident	62 Å²	62	67.3 Å²	67.3	33%	0.332	33%	0.332	S	S	.	.	H	α-helix	trans	-58	-46.5	175.6	-70.4	-47	0	0	0	110.6	S561 E567 V568 E569 A586	S561-D565 PolarHBondContact O-N 3.17Å; S561-D565 VanDerWaalsContact O-OD2 3.07Å; S561-D565 PolarHBondContact OG-OD2 3.12Å; D565-E567 PolarHBondContact O-N 3.42Å; D565-V568 PolarHBondContact O-N 3.44Å; D565-E569 PolarHBondContact O-N 2.91Å; D565-A586 WeakPolarHBondContact OD1-CB 3.15Å
566	S	90.5	Very high	87.8	Confident	54 Å²	54	65.6 Å²	65.6	38%	0.378	32%	0.321	S	S	.	.	H	α-helix	trans	-64.7	-36.7	177.2	-174.8	0	0	0	0	113.7	S562 V564 K570	S562-S566 VanDerWaalsContact O-CB 3.32Å; S562-S566 WeakPolarHBondContact O-CB 3.4Å; S562-S566 PolarHBondContact O-N 2.92Å; V564-S566 VanDerWaalsContact C-N 3.33Å; V564-S566 PolarHBondContact O-N 3.1Å; S566-K570 WeakPolarHBondContact O-CE 3.38Å
567	E	89.4	Confident	87.7	Confident	21 Å²	21	67 Å²	67	10%	0.098	33%	0.331	C	S	.	.	H	α-helix	trans	-69	-35.8	173.5	-175.6	57.1	-142.6	0	0	112	D563 V564 D565 K570 L688 L691 P692 N695	D563-E567 PolarHBondContact O-N 3Å; V564-E567 PolarHBondContact O-N 3.42Å; D565-E567 PolarHBondContact O-N 3.42Å; E567-K570 WeakPolarHBondContact O-CB 3.41Å; E567-K570 PolarHBondContact O-N 3.46Å; E567-K570 WeakPolarHBondContact OE2-CD 3.42Å; E567-K570 IonicContact OE2-NZ 3.78Å; E567-K570 PolarHBondContact OE2-NZ 3.36Å; E567-L688 HydrophobicContact CB-CD1 4.5Å; E567-L691 HydrophobicContact CB-CB 4.49Å; E567-L691 HydrophobicContact CG-CB 3.68Å; E567-P692 HydrophobicContact CG-CG 3.92Å; E567-N695 PolarHBondContact OE1-ND2 3.4Å
568	V	89.8	Confident	87.7	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.006	33%	0.332	C	S	.	.	H	α-helix	trans	-66.5	-35.2	176.1	170.6	0	0	0	0	112.2	V564 D565 K570 W571 Q574 V579 Q583 L691	V564-V568 WeakPolarHBondContact O-CG2 3.46Å; V564-V568 PolarHBondContact O-N 3.21Å; D565-V568 PolarHBondContact O-N 3.44Å; V568-K570 PolarHBondContact O-N 3.23Å; V568-W571 WeakPolarHBondContact O-CB 3.5Å; V568-W571 PolarHBondContact O-N 3.06Å; V568-Q574 PolarHBondContact O-NE2 3.44Å; V568-V579 HydrophobicContact CG1-CB 4.18Å; V568-V579 HydrophobicContact CG1-CG1 3.46Å; V568-V579 VanDerWaalsContact CG1-CG1 3.46Å; V568-V579 HydrophobicContact CG1-CG2 4.15Å; V568-Q583 HydrophobicContact CB-CG 4.41Å; V568-Q583 HydrophobicContact CG1-CG 3.78Å; V568-L691 HydrophobicContact CG2-CD1 4Å; V568-L691 HydrophobicContact CG2-CD2 4.17Å
569	E	86.8	Confident	87.6	Confident	152 Å²	152	61.7 Å²	61.7	71%	0.71	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.5	173.5	-72.6	-176.7	152.5	0	0	113.4	D565 W571	D565-E569 PolarHBondContact O-N 2.91Å; E569-W571 VanDerWaalsContact C-N 3.28Å; E569-W571 PolarHBondContact O-N 3.06Å
570	K	88.1	Confident	87.7	Confident	106 Å²	106	62.6 Å²	62.6	46%	0.461	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	0.1	178.7	-55.1	165.4	-157	158.1	0	113.5	S566 E567 V568 N695 K699	S566-K570 WeakPolarHBondContact O-CE 3.38Å; E567-K570 WeakPolarHBondContact O-CB 3.41Å; E567-K570 PolarHBondContact O-N 3.46Å; E567-K570 WeakPolarHBondContact OE2-CD 3.42Å; E567-K570 IonicContact OE2-NZ 3.78Å; E567-K570 PolarHBondContact OE2-NZ 3.36Å; V568-K570 PolarHBondContact O-N 3.23Å; K570-N695 PolarHBondContact O-ND2 3.44Å; K570-K699 PolarHBondContact O-NZ 3.17Å
571	W	88.7	Confident	87.7	Confident	8 Å²	8	62.1 Å²	62.1	3%	0.03	31%	0.305	C	S	.	.			trans	-91.3	131.1	174.7	-72	66.3	0	0	0	111.5	V568 E569 E573 Q574 H576 I578 V579 L691 N695 N698	V568-W571 WeakPolarHBondContact O-CB 3.5Å; V568-W571 PolarHBondContact O-N 3.06Å; E569-W571 VanDerWaalsContact C-N 3.28Å; E569-W571 PolarHBondContact O-N 3.06Å; W571-E573 VanDerWaalsContact C-N 3.34Å; W571-E573 PolarHBondContact O-N 3.33Å; W571-Q574 PolarHBondContact O-NE2 3.36Å; W571-H576 AromaticContact CZ3-CE1 3.93Å; W571-H576 AromaticContact CZ3-ND1 3.69Å; W571-I578 HydrophobicContact CH2-CB 4.42Å; W571-I578 HydrophobicContact CH2-CG2 4.07Å; W571-I578 HydrophobicContact CZ2-CG2 4.22Å; W571-V579 HydrophobicContact CB-CG2 3.66Å; W571-V579 HydrophobicContact CD2-CG2 3.32Å; W571-V579 HydrophobicContact CE3-CG2 3.54Å; W571-V579 HydrophobicContact CG-CG2 3.38Å; W571-V579 HydrophobicContact CZ3-CG2 4.28Å; W571-L691 HydrophobicContact CZ2-CD2 4.12Å; W571-N695 HydrophobicContact CD2-CB 4.27Å; W571-N695 HydrophobicContact CZ2-CB 3.76Å; W571-N698 HydrophobicContact CZ3-CB 4.34Å; W571-N698 VanDerWaalsContact CZ3-ND2 3.29Å; W571-N698 WeakPolarHBondContact CZ3-ND2 3.32Å
572	E	78.9	Confident	87.8	Confident	144 Å²	144	62.1 Å²	62.1	67%	0.673	30%	0.304	S	S	*	.	S	Bend	trans	-73.3	-24.8	-178.9	-71.5	152.5	-142.3	0	0	113.3	K699	E572-K699 WeakPolarHBondContact OE1-CE 3.5Å; E572-K699 IonicContact OE1-NZ 2.79Å; E572-K699 PolarHBondContact OE1-NZ 3.44Å
573	E	80.1	Confident	87.8	Confident	96 Å²	96	61.9 Å²	61.9	45%	0.449	30%	0.295	S	S	.	.			trans	-113.4	94.1	178	-84.7	163.7	-150.4	0	0	110.7	W571 E575 H576 K702	W571-E573 VanDerWaalsContact C-N 3.34Å; W571-E573 PolarHBondContact O-N 3.33Å; E573-E575 PolarHBondContact O-N 2.68Å; E573-H576 HydrophobicContact CB-CB 4.35Å; E573-H576 VanDerWaalsContact O-CB 3.31Å; E573-H576 WeakPolarHBondContact O-CB 3.46Å; E573-H576 PolarHBondContact O-N 3.04Å; E573-K702 IonicContact OE1-NZ 2.72Å; E573-K702 PolarHBondContact OE1-NZ 3.27Å; E573-K702 IonicContact OE2-NZ 3.68Å; E573-K702 PolarHBondContact OE2-NZ 3.1Å
574	Q	77.4	Confident	87.9	Confident	79 Å²	79	59.9 Å²	59.9	37%	0.369	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-8.4	177.5	-65.1	-65.6	-46	0	0	113.7	V568 W571	V568-Q574 PolarHBondContact O-NE2 3.44Å; W571-Q574 PolarHBondContact O-NE2 3.36Å
575	E	74.4	Confident	88.1	Confident	173 Å²	173	59.9 Å²	59.9	81%	0.808	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-10.9	174	-63.3	-173	165.9	0	0	113.2	E573 R580	E573-E575 PolarHBondContact O-N 2.68Å; E575-R580 VanDerWaalsContact O-CD 3.31Å; E575-R580 WeakPolarHBondContact O-CD 3.49Å; E575-R580 PolarHBondContact O-NE 3.24Å
576	H	86.2	Confident	88.1	Confident	46 Å²	46	56.9 Å²	56.9	21%	0.213	27%	0.272	C	S	.	.	S	Bend	trans	-63.7	135.9	-175.1	-168.5	-85.2	0	0	0	112.1	W571 E573 I578 V579 R580	W571-H576 AromaticContact CZ3-CE1 3.93Å; W571-H576 AromaticContact CZ3-ND1 3.69Å; E573-H576 HydrophobicContact CB-CB 4.35Å; E573-H576 VanDerWaalsContact O-CB 3.31Å; E573-H576 WeakPolarHBondContact O-CB 3.46Å; E573-H576 PolarHBondContact O-N 3.04Å; H576-I578 PolarHBondContact O-N 3.01Å; H576-V579 HydrophobicContact CB-CB 4.38Å; H576-V579 HydrophobicContact CB-CG2 4.5Å; H576-V579 WeakPolarHBondContact O-CA 3.34Å; H576-V579 VanDerWaalsContact O-CB 3.3Å; H576-V579 WeakPolarHBondContact O-CB 3.39Å; H576-V579 PolarHBondContact O-N 2.91Å; H576-R580 PolarHBondContact O-N 3.4Å
577	D	89.1	Confident	88.2	Confident	81 Å²	81	57.6 Å²	57.6	43%	0.433	28%	0.276	S	S	.	.	H	α-helix	trans	-58.6	-44.5	-168.6	-64.1	-41.2	0	0	0	113.7	V579 R580 Q581	D577-V579 PolarHBondContact O-N 3.39Å; D577-R580 PolarHBondContact O-N 2.81Å; D577-R580 IonicContact OD1-CZ 2.69Å; D577-R580 IonicContact OD1-NE 3.4Å; D577-R580 IonicContact OD1-NH2 2.75Å; D577-R580 PolarHBondContact OD1-NH2 3.09Å; D577-Q581 WeakPolarHBondContact O-CB 3.37Å; D577-Q581 WeakPolarHBondContact O-CG 3.31Å; D577-Q581 PolarHBondContact O-N 3.28Å; D577-Q581 PolarHBondContact O-OE1 2.71Å
578	I	92.6	Very high	88.5	Confident	4 Å²	4	57.3 Å²	57.3	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-54.2	-39.5	174.2	-65.3	178.9	0	0	0	111.8	W571 H576 S582 L622 L626 F629 L691	W571-I578 HydrophobicContact CH2-CB 4.42Å; W571-I578 HydrophobicContact CH2-CG2 4.07Å; W571-I578 HydrophobicContact CZ2-CG2 4.22Å; H576-I578 PolarHBondContact O-N 3.01Å; I578-S582 VanDerWaalsContact O-CB 3.28Å; I578-S582 WeakPolarHBondContact O-CB 3.37Å; I578-S582 PolarHBondContact O-N 3.38Å; I578-S582 VanDerWaalsContact O-N 3.09Å; I578-S582 PolarHBondContact O-OG 3.38Å; I578-L622 HydrophobicContact CB-CD1 4.22Å; I578-L622 HydrophobicContact CG1-CD1 4.29Å; I578-L622 HydrophobicContact CG2-CD1 4.02Å; I578-L626 HydrophobicContact CD1-CD2 3.89Å; I578-L626 HydrophobicContact CD1-CG 4.38Å; I578-L626 HydrophobicContact CG1-CD2 4.5Å; I578-F629 HydrophobicContact CD1-CB 3.95Å; I578-F629 HydrophobicContact CD1-CD1 4.38Å; I578-F629 HydrophobicContact CD1-CG 4.07Å; I578-L691 HydrophobicContact CG2-CD2 4Å
579	V	89.9	Confident	88.7	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-69.7	-53	179.9	153.2	0	0	0	0	110.5	V568 W571 H576 D577 Q581 S582 Q583	V568-V579 HydrophobicContact CG1-CB 4.18Å; V568-V579 HydrophobicContact CG1-CG1 3.46Å; V568-V579 VanDerWaalsContact CG1-CG1 3.46Å; V568-V579 HydrophobicContact CG1-CG2 4.15Å; W571-V579 HydrophobicContact CB-CG2 3.66Å; W571-V579 HydrophobicContact CD2-CG2 3.32Å; W571-V579 HydrophobicContact CE3-CG2 3.54Å; W571-V579 HydrophobicContact CG-CG2 3.38Å; W571-V579 HydrophobicContact CZ3-CG2 4.28Å; H576-V579 HydrophobicContact CB-CB 4.38Å; H576-V579 HydrophobicContact CB-CG2 4.5Å; H576-V579 WeakPolarHBondContact O-CA 3.34Å; H576-V579 VanDerWaalsContact O-CB 3.3Å; H576-V579 WeakPolarHBondContact O-CB 3.39Å; H576-V579 PolarHBondContact O-N 2.91Å; D577-V579 PolarHBondContact O-N 3.39Å; V579-Q581 VanDerWaalsContact C-N 3.33Å; V579-Q581 PolarHBondContact O-N 3.34Å; V579-S582 PolarHBondContact O-N 3.27Å; V579-S582 VanDerWaalsContact O-N 3.14Å; V579-Q583 PolarHBondContact O-N 3.34Å
580	R	91.7	Very high	88.9	Confident	114 Å²	114	54.3 Å²	54.3	43%	0.43	26%	0.258	S	S	.	.	H	α-helix	trans	-61.2	-41.6	-178.4	-58.8	-172.7	-56.9	94.6	-1.1	112.1	E575 H576 D577 Q583 S584	E575-R580 VanDerWaalsContact O-CD 3.31Å; E575-R580 WeakPolarHBondContact O-CD 3.49Å; E575-R580 PolarHBondContact O-NE 3.24Å; H576-R580 PolarHBondContact O-N 3.4Å; D577-R580 PolarHBondContact O-N 2.81Å; D577-R580 IonicContact OD1-CZ 2.69Å; D577-R580 IonicContact OD1-NE 3.4Å; D577-R580 IonicContact OD1-NH2 2.75Å; D577-R580 PolarHBondContact OD1-NH2 3.09Å; R580-Q583 PolarHBondContact O-N 2.91Å; R580-S584 WeakPolarHBondContact O-CB 3.35Å; R580-S584 PolarHBondContact O-N 2.96Å
581	Q	94.1	Very high	88.9	Confident	12 Å²	12	50.4 Å²	50.4	6%	0.056	24%	0.242	C	C	.	.	H	α-helix	trans	-69.1	-34.7	177.9	-71.5	162.7	-25.4	0	0	111.7	D577 V579 S584 L585 L622 S625	D577-Q581 WeakPolarHBondContact O-CB 3.37Å; D577-Q581 WeakPolarHBondContact O-CG 3.31Å; D577-Q581 PolarHBondContact O-N 3.28Å; D577-Q581 PolarHBondContact O-OE1 2.71Å; V579-Q581 VanDerWaalsContact C-N 3.33Å; V579-Q581 PolarHBondContact O-N 3.34Å; Q581-S584 WeakPolarHBondContact O-CB 3.49Å; Q581-S584 PolarHBondContact O-N 3.19Å; Q581-L585 VanDerWaalsContact O-CG 3.32Å; Q581-L585 WeakPolarHBondContact O-CG 3.24Å; Q581-L585 PolarHBondContact O-N 3.05Å; Q581-L622 HydrophobicContact CB-CB 4.13Å; Q581-L622 HydrophobicContact CB-CD1 4.17Å; Q581-S625 PolarHBondContact NE2-OG 3.14Å; Q581-S625 VanDerWaalsContact OE1-CB 3.29Å; Q581-S625 PolarHBondContact OE1-OG 3.3Å
582	S	92.4	Very high	89.1	Confident	1 Å²	1	50 Å²	50	1%	0.007	24%	0.241	C	C	.	.	H	α-helix	trans	-70.3	-38.6	175.4	-58.9	0	0	0	0	112.7	I578 V579 S584 L585 A586	I578-S582 VanDerWaalsContact O-CB 3.28Å; I578-S582 WeakPolarHBondContact O-CB 3.37Å; I578-S582 PolarHBondContact O-N 3.38Å; I578-S582 VanDerWaalsContact O-N 3.09Å; I578-S582 PolarHBondContact O-OG 3.38Å; V579-S582 PolarHBondContact O-N 3.27Å; V579-S582 VanDerWaalsContact O-N 3.14Å; S582-S584 VanDerWaalsContact C-N 3.33Å; S582-L585 PolarHBondContact O-N 3.36Å; S582-A586 WeakPolarHBondContact O-CB 3.28Å; S582-A586 PolarHBondContact O-N 2.82Å
583	Q	91.1	Very high	89.7	Confident	67 Å²	67	43.8 Å²	43.8	31%	0.313	21%	0.211	S	C	.	.	H	α-helix	trans	-62.2	-39.7	170	-74	165.3	-22.1	0	0	112.1	V568 V579 R580 A586 S587	V568-Q583 HydrophobicContact CB-CG 4.41Å; V568-Q583 HydrophobicContact CG1-CG 3.78Å; V579-Q583 PolarHBondContact O-N 3.34Å; R580-Q583 PolarHBondContact O-N 2.91Å; Q583-A586 PolarHBondContact O-N 3.36Å; Q583-S587 VanDerWaalsContact O-CB 3.32Å; Q583-S587 WeakPolarHBondContact O-CB 3.48Å; Q583-S587 PolarHBondContact O-N 3.13Å
584	S	93.1	Very high	89.7	Confident	36 Å²	36	40.2 Å²	40.2	25%	0.252	20%	0.195	S	C	.	.	H	α-helix	trans	-60.5	-48.4	174.9	-165.5	0	0	0	0	110.9	R580 Q581 S582 S587 M588 E618	R580-S584 WeakPolarHBondContact O-CB 3.35Å; R580-S584 PolarHBondContact O-N 2.96Å; Q581-S584 WeakPolarHBondContact O-CB 3.49Å; Q581-S584 PolarHBondContact O-N 3.19Å; S582-S584 VanDerWaalsContact C-N 3.33Å; S584-S587 PolarHBondContact O-N 3.3Å; S584-M588 WeakPolarHBondContact O-CE 3.11Å; S584-M588 VanDerWaalsContact O-CG 3.31Å; S584-M588 WeakPolarHBondContact O-CG 3.41Å; S584-M588 PolarHBondContact O-N 2.93Å; S584-E618 WeakPolarHBondContact CB-OE1 3.19Å; S584-E618 PolarHBondContact OG-OE1 3.16Å
585	L	95.4	Very high	90.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-44.3	174.7	-70.1	173.1	0	0	0	113	Q581 S582 M588 A589 L615 E618 L622 M684 V687	Q581-L585 VanDerWaalsContact O-CG 3.32Å; Q581-L585 WeakPolarHBondContact O-CG 3.24Å; Q581-L585 PolarHBondContact O-N 3.05Å; S582-L585 PolarHBondContact O-N 3.36Å; L585-M588 HydrophobicContact CD2-CE 4.24Å; L585-M588 PolarHBondContact O-N 2.72Å; L585-A589 VanDerWaalsContact O-CB 3.28Å; L585-A589 WeakPolarHBondContact O-CB 2.82Å; L585-A589 PolarHBondContact O-N 3.45Å; L585-L615 HydrophobicContact CD2-CD2 3.85Å; L585-L615 HydrophobicContact CD2-CG 3.75Å; L585-L615 WeakPolarHBondContact CD2-O 3.12Å; L585-E618 HydrophobicContact CD2-CB 4.11Å; L585-E618 HydrophobicContact CD2-CG 4.4Å; L585-E618 HydrophobicContact CG-CG 4.41Å; L585-L622 HydrophobicContact CD1-CB 4.43Å; L585-L622 HydrophobicContact CD1-CD2 3.51Å; L585-M684 HydrophobicContact CB-SD 4.07Å; L585-V687 HydrophobicContact CD1-CG2 3.94Å
586	A	90.8	Very high	90.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.2	-51.3	176.3	0	0	0	0	0	111.7	S561 V564 D565 S582 Q583 M588 A589 Y590 M684	S561-A586 PolarHBondContact OG-O 3.09Å; S561-A586 VanDerWaalsContact OG-O 3.04Å; V564-A586 HydrophobicContact CB-CB 4.4Å; V564-A586 HydrophobicContact CG1-CB 3.96Å; D565-A586 WeakPolarHBondContact OD1-CB 3.15Å; S582-A586 WeakPolarHBondContact O-CB 3.28Å; S582-A586 PolarHBondContact O-N 2.82Å; Q583-A586 PolarHBondContact O-N 3.36Å; A586-M588 VanDerWaalsContact C-N 3.3Å; A586-M588 PolarHBondContact O-N 3.23Å; A586-A589 WeakPolarHBondContact O-CB 3.4Å; A586-A589 PolarHBondContact O-N 2.97Å; A586-A589 VanDerWaalsContact O-N 3.15Å; A586-Y590 WeakPolarHBondContact O-CB 3.09Å; A586-Y590 PolarHBondContact O-N 3.48Å; A586-M684 HydrophobicContact CB-CE 4.03Å
587	S	93.1	Very high	89.9	Confident	68 Å²	68	30.7 Å²	30.7	48%	0.476	15%	0.148	S	C	.	.	H	α-helix	trans	-55.7	-41.9	175.8	-178.4	0	0	0	0	112.8	Q583 S584 Y590 N591	Q583-S587 VanDerWaalsContact O-CB 3.32Å; Q583-S587 WeakPolarHBondContact O-CB 3.48Å; Q583-S587 PolarHBondContact O-N 3.13Å; S584-S587 PolarHBondContact O-N 3.3Å; S587-Y590 PolarHBondContact O-N 3.16Å; S587-N591 PolarHBondContact O-N 3.24Å; S587-N591 PolarHBondContact O-ND2 3.02Å
588	M	95.5	Very high	88.8	Confident	16 Å²	16	28.1 Å²	28.1	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-70.5	-41.6	176.8	-68.4	-172.4	-77.4	0	0	112.4	S584 L585 A586 Y590 N591 M592 Q611 V614 L615 E618	S584-M588 WeakPolarHBondContact O-CE 3.11Å; S584-M588 VanDerWaalsContact O-CG 3.31Å; S584-M588 WeakPolarHBondContact O-CG 3.41Å; S584-M588 PolarHBondContact O-N 2.93Å; L585-M588 HydrophobicContact CD2-CE 4.24Å; L585-M588 PolarHBondContact O-N 2.72Å; A586-M588 VanDerWaalsContact C-N 3.3Å; A586-M588 PolarHBondContact O-N 3.23Å; M588-Y590 VanDerWaalsContact C-N 3.33Å; M588-Y590 PolarHBondContact O-N 3.41Å; M588-N591 PolarHBondContact O-N 3.11Å; M588-M592 WeakPolarHBondContact O-CG 3.33Å; M588-M592 PolarHBondContact O-N 3.05Å; M588-Q611 VanDerWaalsContact CG-NE2 3.25Å; M588-Q611 PolarHBondContact SD-NE2 3.01Å; M588-V614 HydrophobicContact SD-CB 4.28Å; M588-V614 HydrophobicContact SD-CG1 3.73Å; M588-L615 HydrophobicContact CB-CB 4.36Å; M588-L615 HydrophobicContact CB-CD1 3.8Å; M588-L615 HydrophobicContact CB-CG 4.27Å; M588-L615 HydrophobicContact CE-CB 4.34Å; M588-L615 HydrophobicContact SD-CB 4.25Å; M588-E618 HydrophobicContact CE-CB 3.66Å; M588-E618 HydrophobicContact CE-CG 3.88Å
589	A	93.6	Very high	87.6	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60.1	-40.8	172.9	0	0	0	0	0	111.9	L557 L585 A586 M592 Y593 L615 T680 M684	L557-A589 HydrophobicContact CD1-CB 3.84Å; L557-A589 HydrophobicContact CD2-CB 4.44Å; L557-A589 VanDerWaalsContact CD2-O 3.29Å; L557-A589 WeakPolarHBondContact CD2-O 3.5Å; L557-A589 HydrophobicContact CG-CB 4.07Å; L585-A589 VanDerWaalsContact O-CB 3.28Å; L585-A589 WeakPolarHBondContact O-CB 2.82Å; L585-A589 PolarHBondContact O-N 3.45Å; A586-A589 WeakPolarHBondContact O-CB 3.4Å; A586-A589 PolarHBondContact O-N 2.97Å; A586-A589 VanDerWaalsContact O-N 3.15Å; A589-M592 CarbonylContact O-C 3.58Å; A589-M592 WeakPolarHBondContact O-CB 3.21Å; A589-M592 PolarHBondContact O-N 3.21Å; A589-M592 VanDerWaalsContact O-N 3.17Å; A589-Y593 PolarHBondContact O-N 3.05Å; A589-L615 HydrophobicContact CB-CD1 4.49Å; A589-T680 HydrophobicContact CB-CG2 4.44Å; A589-M684 HydrophobicContact CB-CE 4.09Å; A589-M684 HydrophobicContact CB-CG 3.84Å; A589-M684 HydrophobicContact CB-SD 3.88Å
590	Y	90.7	Very high	86.8	Confident	90 Å²	90	33.1 Å²	33.1	35%	0.353	17%	0.172	S	C	.	.	H	α-helix	trans	-64.9	-38.3	175.2	-169.9	-107.2	0	0	0	112.4	R558 A586 S587 M588 M592 Y593 L594	R558-Y590 HydrophobicContact CG-CE2 4.33Å; A586-Y590 WeakPolarHBondContact O-CB 3.09Å; A586-Y590 PolarHBondContact O-N 3.48Å; S587-Y590 PolarHBondContact O-N 3.16Å; M588-Y590 VanDerWaalsContact C-N 3.33Å; M588-Y590 PolarHBondContact O-N 3.41Å; Y590-M592 VanDerWaalsContact C-N 3.32Å; Y590-M592 PolarHBondContact O-N 3.45Å; Y590-Y593 AromaticContact CD2-CD1 3.8Å; Y590-Y593 HydrophobicContact CD2-CD1 3.8Å; Y590-Y593 HydrophobicContact CD2-CE1 4.44Å; Y590-Y593 AromaticContact CE2-CD1 3.59Å; Y590-Y593 HydrophobicContact CE2-CD1 3.59Å; Y590-Y593 AromaticContact CE2-CE1 3.78Å; Y590-Y593 HydrophobicContact CE2-CE1 3.78Å; Y590-Y593 WeakPolarHBondContact O-CB 3.26Å; Y590-Y593 PolarHBondContact O-N 2.89Å; Y590-L594 HydrophobicContact CD1-CD1 4.01Å; Y590-L594 HydrophobicContact CD1-CG 4.27Å; Y590-L594 HydrophobicContact CE1-CD1 3.71Å; Y590-L594 HydrophobicContact CE1-CD2 4.2Å; Y590-L594 HydrophobicContact CE1-CG 3.99Å; Y590-L594 WeakPolarHBondContact O-CG 3.42Å; Y590-L594 PolarHBondContact O-N 2.81Å
591	N	88.8	Confident	85.9	Confident	24 Å²	24	34.3 Å²	34.3	13%	0.128	19%	0.186	C	C	.	.	H	α-helix	trans	-64.4	-36.5	171.8	-82.2	-79.7	0	0	0	112.2	S587 M588 L594 F595 L602	S587-N591 PolarHBondContact O-N 3.24Å; S587-N591 PolarHBondContact O-ND2 3.02Å; M588-N591 PolarHBondContact O-N 3.11Å; N591-L594 PolarHBondContact O-N 3.44Å; N591-F595 PolarHBondContact O-N 3.05Å; N591-F595 VanDerWaalsContact O-N 3.07Å; N591-L602 HydrophobicContact CB-CD1 4.35Å
592	M	93.4	Very high	85.3	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-69.8	-30.1	173.2	-65.5	178.7	66.3	0	0	112.6	L557 M588 A589 Y590 T596 L602 L608 Q611 A612 L615 I677 T680	L557-M592 HydrophobicContact CD2-CB 3.89Å; M588-M592 WeakPolarHBondContact O-CG 3.33Å; M588-M592 PolarHBondContact O-N 3.05Å; A589-M592 CarbonylContact O-C 3.58Å; A589-M592 WeakPolarHBondContact O-CB 3.21Å; A589-M592 PolarHBondContact O-N 3.21Å; A589-M592 VanDerWaalsContact O-N 3.17Å; Y590-M592 VanDerWaalsContact C-N 3.32Å; Y590-M592 PolarHBondContact O-N 3.45Å; M592-T596 WeakPolarHBondContact O-CG2 3.43Å; M592-L602 HydrophobicContact CG-CD1 4.3Å; M592-L608 HydrophobicContact CB-CD1 4.05Å; M592-L608 HydrophobicContact CE-CD1 3.93Å; M592-L608 HydrophobicContact CE-CG 4.36Å; M592-L608 HydrophobicContact CG-CD1 3.78Å; M592-Q611 HydrophobicContact CG-CB 4.37Å; M592-Q611 HydrophobicContact CG-CG 3.67Å; M592-Q611 HydrophobicContact SD-CG 3.97Å; M592-A612 HydrophobicContact CE-CB 4.09Å; M592-L615 HydrophobicContact SD-CD1 3.79Å; M592-I677 HydrophobicContact CB-CD1 4.11Å; M592-I677 HydrophobicContact CE-CD1 4.1Å; M592-T680 HydrophobicContact CE-CG2 4.23Å; M592-T680 VanDerWaalsContact CE-OG1 3.26Å; M592-T680 WeakPolarHBondContact CE-OG1 2.77Å; M592-T680 HydrophobicContact SD-CG2 3.99Å
593	Y	89.9	Confident	84.4	Confident	12 Å²	12	39.9 Å²	39.9	5%	0.047	21%	0.21	C	C	.	.	H	α-helix	trans	-64.6	-50.2	166.2	155.9	-111.6	0	0	0	111.9	G554 R558 A589 Y590 F595 T596 R597	G554-Y593 WeakPolarHBondContact O-CD2 3.45Å; R558-Y593 HydrophobicContact CB-CD1 3.91Å; R558-Y593 HydrophobicContact CB-CD2 3.88Å; R558-Y593 HydrophobicContact CB-CE1 4.05Å; R558-Y593 HydrophobicContact CB-CE2 3.99Å; R558-Y593 HydrophobicContact CB-CG 3.79Å; R558-Y593 VanDerWaalsContact CD-CZ 3.43Å; R558-Y593 WeakPolarHBondContact CD-OH 3.47Å; R558-Y593 HydrophobicContact CG-CD1 4.34Å; R558-Y593 HydrophobicContact CG-CE1 4.14Å; R558-Y593 PolarHBondContact NH1-OH 2.83Å; A589-Y593 PolarHBondContact O-N 3.05Å; Y590-Y593 AromaticContact CD2-CD1 3.8Å; Y590-Y593 HydrophobicContact CD2-CD1 3.8Å; Y590-Y593 HydrophobicContact CD2-CE1 4.44Å; Y590-Y593 AromaticContact CE2-CD1 3.59Å; Y590-Y593 HydrophobicContact CE2-CD1 3.59Å; Y590-Y593 AromaticContact CE2-CE1 3.78Å; Y590-Y593 HydrophobicContact CE2-CE1 3.78Å; Y590-Y593 WeakPolarHBondContact O-CB 3.26Å; Y590-Y593 PolarHBondContact O-N 2.89Å; Y593-F595 PolarHBondContact O-N 3.47Å; Y593-T596 PolarHBondContact O-N 3.02Å; Y593-T596 PolarHBondContact O-OG1 2.91Å; Y593-T596 VanDerWaalsContact O-OG1 3.05Å; Y593-R597 HydrophobicContact CE2-CG 4.21Å; Y593-R597 WeakPolarHBondContact OH-CD 3.47Å
594	L	80.3	Confident	83.9	Confident	22 Å²	22	38.2 Å²	38.2	12%	0.115	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-34.9	-179	-68.5	177.9	0	0	0	111.6	Y590 N591 T596 R597 G598 E599	Y590-L594 HydrophobicContact CD1-CD1 4.01Å; Y590-L594 HydrophobicContact CD1-CG 4.27Å; Y590-L594 HydrophobicContact CE1-CD1 3.71Å; Y590-L594 HydrophobicContact CE1-CD2 4.2Å; Y590-L594 HydrophobicContact CE1-CG 3.99Å; Y590-L594 WeakPolarHBondContact O-CG 3.42Å; Y590-L594 PolarHBondContact O-N 2.81Å; N591-L594 PolarHBondContact O-N 3.44Å; L594-T596 VanDerWaalsContact C-N 3.32Å; L594-T596 PolarHBondContact O-N 3.23Å; L594-R597 CarbonylContact O-C 3.6Å; L594-R597 WeakPolarHBondContact O-CA 3.47Å; L594-R597 PolarHBondContact O-N 2.84Å; L594-G598 PolarHBondContact O-N 3.35Å; L594-E599 CarbonylContact C-O 3.48Å; L594-E599 HydrophobicContact CB-CB 4.22Å; L594-E599 HydrophobicContact CD2-CB 4.14Å; L594-E599 PolarHBondContact O-N 3.24Å
595	F	85.6	Confident	83.6	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.009	20%	0.195	C	C	.	.	H	α-helix	trans	-56.8	-38.3	170.3	173.3	-80.3	0	0	0	113.4	L524 P525 N591 Y593 R597 G598 L602 T604 T605 L608 V673	L524-F595 HydrophobicContact CD2-CE1 4.27Å; L524-F595 HydrophobicContact CD2-CZ 4.46Å; P525-F595 HydrophobicContact CB-CE2 4.34Å; P525-F595 VanDerWaalsContact CD-CZ 3.43Å; P525-F595 HydrophobicContact CG-CD2 3.93Å; P525-F595 HydrophobicContact CG-CE2 3.41Å; P525-F595 VanDerWaalsContact CG-CE2 3.41Å; P525-F595 HydrophobicContact CG-CZ 3.76Å; N591-F595 PolarHBondContact O-N 3.05Å; N591-F595 VanDerWaalsContact O-N 3.07Å; Y593-F595 PolarHBondContact O-N 3.47Å; F595-R597 PolarHBondContact O-N 3.27Å; F595-G598 PolarHBondContact O-N 3.41Å; F595-L602 HydrophobicContact CB-CB 4.22Å; F595-L602 HydrophobicContact CB-CD1 4.11Å; F595-L602 HydrophobicContact CD2-CB 3.83Å; F595-T604 WeakPolarHBondContact CE2-O 3.32Å; F595-T605 HydrophobicContact CZ-CG2 4.16Å; F595-L608 HydrophobicContact CB-CD1 4.17Å; F595-L608 HydrophobicContact CD1-CD1 3.78Å; F595-L608 HydrophobicContact CD1-CD2 4.17Å; F595-L608 HydrophobicContact CD1-CG 4.41Å; F595-L608 HydrophobicContact CD2-CB 4.01Å; F595-L608 HydrophobicContact CD2-CD1 4.1Å; F595-L608 HydrophobicContact CE1-CB 4.38Å; F595-L608 HydrophobicContact CE1-CD1 4.15Å; F595-L608 HydrophobicContact CE1-CD2 3.7Å; F595-L608 HydrophobicContact CE1-CG 4.29Å; F595-L608 HydrophobicContact CE2-CB 3.63Å; F595-L608 HydrophobicContact CE2-CD1 4.39Å; F595-L608 HydrophobicContact CE2-CD2 4.45Å; F595-L608 HydrophobicContact CE2-CG 4.37Å; F595-L608 HydrophobicContact CG-CB 4.49Å; F595-L608 HydrophobicContact CG-CD1 3.77Å; F595-L608 HydrophobicContact CZ-CB 3.85Å; F595-L608 HydrophobicContact CZ-CD1 4.43Å; F595-L608 HydrophobicContact CZ-CD2 3.85Å; F595-L608 HydrophobicContact CZ-CG 4.25Å; F595-V673 HydrophobicContact CE1-CG1 3.97Å
596	T	83.1	Confident	83.1	Confident	10 Å²	10	40.2 Å²	40.2	6%	0.061	21%	0.213	C	C	.	.	H	α-helix	trans	-66.4	-20.9	177.7	86.6	0	0	0	0	112.6	Y521 M550 M592 Y593 L594 I677	Y521-T596 VanDerWaalsContact CB-O 3.26Å; Y521-T596 WeakPolarHBondContact CB-O 3.24Å; M550-T596 HydrophobicContact CE-CG2 3.47Å; M550-T596 VanDerWaalsContact CE-CG2 3.47Å; M592-T596 WeakPolarHBondContact O-CG2 3.43Å; Y593-T596 PolarHBondContact O-N 3.02Å; Y593-T596 PolarHBondContact O-OG1 2.91Å; Y593-T596 VanDerWaalsContact O-OG1 3.05Å; L594-T596 VanDerWaalsContact C-N 3.32Å; L594-T596 PolarHBondContact O-N 3.23Å; T596-I677 HydrophobicContact CG2-CD1 4.25Å
597	R	73.6	Confident	82.8	Confident	85 Å²	85	42.8 Å²	42.8	32%	0.321	23%	0.226	S	C	.	.	H	α-helix	trans	-95.4	-6.9	172.6	-64.6	-176.1	54.6	97	9	114	Y593 L594 F595 E599	Y593-R597 HydrophobicContact CE2-CG 4.21Å; Y593-R597 WeakPolarHBondContact OH-CD 3.47Å; L594-R597 CarbonylContact O-C 3.6Å; L594-R597 WeakPolarHBondContact O-CA 3.47Å; L594-R597 PolarHBondContact O-N 2.84Å; F595-R597 PolarHBondContact O-N 3.27Å; R597-E599 HydrophobicContact CB-CB 4.31Å; R597-E599 HydrophobicContact CB-CG 3.95Å; R597-E599 IonicContact CZ-OE1 3.6Å; R597-E599 VanDerWaalsContact CZ-OE1 3.23Å; R597-E599 IonicContact NE-OE1 3.74Å; R597-E599 PolarHBondContact NE-OE1 3.1Å; R597-E599 IonicContact NE-OE2 2.66Å; R597-E599 IonicContact NH2-OE1 2.69Å; R597-E599 PolarHBondContact NH2-OE1 2.95Å
598	G	67.2	Low	82.8	Confident	27 Å²	27	39.5 Å²	39.5	28%	0.278	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	12.5	-172.2	0	0	0	0	0	114.2	L594 F595	L594-G598 PolarHBondContact O-N 3.35Å; F595-G598 PolarHBondContact O-N 3.41Å
599	E	66.9	Low	82.7	Confident	80 Å²	80	39.4 Å²	39.4	37%	0.374	20%	0.203	S	C	.	.			trans	-96.5	-172.7	-178.1	-64.8	172.7	-152.6	0	0	110.2	L594 R597	L594-E599 CarbonylContact C-O 3.48Å; L594-E599 HydrophobicContact CB-CB 4.22Å; L594-E599 HydrophobicContact CD2-CB 4.14Å; L594-E599 PolarHBondContact O-N 3.24Å; R597-E599 HydrophobicContact CB-CB 4.31Å; R597-E599 HydrophobicContact CB-CG 3.95Å; R597-E599 IonicContact CZ-OE1 3.6Å; R597-E599 VanDerWaalsContact CZ-OE1 3.23Å; R597-E599 IonicContact NE-OE1 3.74Å; R597-E599 PolarHBondContact NE-OE1 3.1Å; R597-E599 IonicContact NE-OE2 2.66Å; R597-E599 IonicContact NH2-OE1 2.69Å; R597-E599 PolarHBondContact NH2-OE1 2.95Å
600	G	72.8	Confident	82.6	Confident	30 Å²	30	44.8 Å²	44.8	31%	0.309	23%	0.227	S	C	.	.	S	Bend	trans	67.6	-159.2	173	0	0	0	0	0	115.6	K603	G600-K603 WeakPolarHBondContact O-CE 3.41Å; G600-K603 PolarHBondContact O-NZ 3.12Å
601	L	72.6	Confident	82.8	Confident	139 Å²	139	42 Å²	42	73%	0.728	22%	0.218	S	C	*	.	S	Bend	trans	-86.2	-28.3	-171.4	-64.8	176.3	0	0	0	114.4
602	L	81.9	Confident	83.1	Confident	16 Å²	16	40.8 Å²	40.8	8%	0.084	21%	0.211	C	C	.	.			trans	-80.2	119.1	-173.6	-50.9	178	0	0	0	110.7	N591 M592 F595 D607 L608 Q611	N591-L602 HydrophobicContact CB-CD1 4.35Å; M592-L602 HydrophobicContact CG-CD1 4.3Å; F595-L602 HydrophobicContact CB-CB 4.22Å; F595-L602 HydrophobicContact CB-CD1 4.11Å; F595-L602 HydrophobicContact CD2-CB 3.83Å; L602-D607 HydrophobicContact CB-CB 4.11Å; L602-D607 HydrophobicContact CD2-CB 3.95Å; L602-L608 HydrophobicContact CD1-CD1 4.12Å; L602-Q611 HydrophobicContact CD1-CB 4.03Å; L602-Q611 HydrophobicContact CD1-CG 4.02Å; L602-Q611 HydrophobicContact CD2-CB 4.12Å; L602-Q611 HydrophobicContact CD2-CG 4.42Å
603	K	73.6	Confident	83.2	Confident	113 Å²	113	43 Å²	43	49%	0.491	22%	0.222	S	C	.	.			trans	-117.4	-6.4	-172.1	-57.4	-49.6	-174.5	-166.7	0	114.9	P525 G600 D607	P525-K603 WeakPolarHBondContact CB-O 3.38Å; G600-K603 WeakPolarHBondContact O-CE 3.41Å; G600-K603 PolarHBondContact O-NZ 3.12Å; K603-D607 WeakPolarHBondContact CA-OD2 3.15Å; K603-D607 PolarHBondContact N-OD2 3.27Å
604	T	81.1	Confident	83.4	Confident	33 Å²	33	45.1 Å²	45.1	20%	0.202	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-135.6	156.3	177.4	85.7	0	0	0	0	110.4	R526 F595 L606 D607 L608	R526-T604 WeakPolarHBondContact O-CA 3.26Å; R526-T604 VanDerWaalsContact O-CB 3.24Å; R526-T604 WeakPolarHBondContact O-CB 3.35Å; F595-T604 WeakPolarHBondContact CE2-O 3.32Å; T604-L606 PolarHBondContact O-N 2.8Å; T604-L606 WeakPolarHBondContact OG1-CB 3.44Å; T604-L606 PolarHBondContact OG1-N 3.44Å; T604-D607 PolarHBondContact N-OD2 3.35Å; T604-D607 WeakPolarHBondContact O-CB 3.42Å; T604-D607 PolarHBondContact O-N 2.71Å; T604-D607 VanDerWaalsContact O-N 3.12Å; T604-D607 PolarHBondContact OG1-N 2.68Å; T604-D607 PolarHBondContact OG1-OD1 3.36Å; T604-L608 PolarHBondContact O-N 3.44Å
605	T	85.3	Confident	84.2	Confident	5 Å²	5	44 Å²	44	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-64	-22.8	171.4	51.2	0	0	0	0	112.4	L524 R526 F595 L608 F609 T669 V673	L524-T605 HydrophobicContact CB-CG2 4.04Å; L524-T605 HydrophobicContact CD1-CG2 4.35Å; R526-T605 PolarHBondContact O-N 2.87Å; F595-T605 HydrophobicContact CZ-CG2 4.16Å; T605-L608 PolarHBondContact O-N 3.06Å; T605-F609 WeakPolarHBondContact O-CD2 3.49Å; T605-F609 VanDerWaalsContact O-CG 3.23Å; T605-F609 WeakPolarHBondContact O-CG 3.41Å; T605-F609 PolarHBondContact O-N 3.24Å; T605-F609 VanDerWaalsContact O-N 3.11Å; T605-T669 HydrophobicContact CG2-CG2 4.19Å; T605-V673 HydrophobicContact CG2-CG2 3.99Å
606	L	85.2	Confident	84.8	Confident	73 Å²	73	44 Å²	44	38%	0.382	23%	0.23	S	C	.	.	H	α-helix	trans	-68.7	-37.8	173.2	-177.9	63.8	0	0	0	111	T604 L608 F609 H610	T604-L606 PolarHBondContact O-N 2.8Å; T604-L606 WeakPolarHBondContact OG1-CB 3.44Å; T604-L606 PolarHBondContact OG1-N 3.44Å; L606-L608 VanDerWaalsContact C-N 3.3Å; L606-L608 PolarHBondContact O-N 3.49Å; L606-F609 PolarHBondContact O-N 3.5Å; L606-H610 WeakPolarHBondContact O-CB 3.42Å; L606-H610 PolarHBondContact O-N 2.61Å
607	D	85.2	Confident	85.3	Confident	53 Å²	53	47.3 Å²	47.3	28%	0.283	25%	0.245	S	C	.	.	H	α-helix	trans	-62.8	-39.2	175.6	-47	-11.7	0	0	0	110.5	L602 K603 T604 Q611	L602-D607 HydrophobicContact CB-CB 4.11Å; L602-D607 HydrophobicContact CD2-CB 3.95Å; K603-D607 WeakPolarHBondContact CA-OD2 3.15Å; K603-D607 PolarHBondContact N-OD2 3.27Å; T604-D607 PolarHBondContact N-OD2 3.35Å; T604-D607 WeakPolarHBondContact O-CB 3.42Å; T604-D607 PolarHBondContact O-N 2.71Å; T604-D607 VanDerWaalsContact O-N 3.12Å; T604-D607 PolarHBondContact OG1-N 2.68Å; T604-D607 PolarHBondContact OG1-OD1 3.36Å; D607-Q611 VanDerWaalsContact O-CB 3.28Å; D607-Q611 WeakPolarHBondContact O-CB 3.31Å; D607-Q611 PolarHBondContact O-N 2.94Å
608	L	92.1	Very high	86.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64	-45.6	173.8	-173.7	81.2	0	0	0	112	M592 F595 L602 T604 T605 L606 H610 Q611 A612 V673 I677	M592-L608 HydrophobicContact CB-CD1 4.05Å; M592-L608 HydrophobicContact CE-CD1 3.93Å; M592-L608 HydrophobicContact CE-CG 4.36Å; M592-L608 HydrophobicContact CG-CD1 3.78Å; F595-L608 HydrophobicContact CB-CD1 4.17Å; F595-L608 HydrophobicContact CD1-CD1 3.78Å; F595-L608 HydrophobicContact CD1-CD2 4.17Å; F595-L608 HydrophobicContact CD1-CG 4.41Å; F595-L608 HydrophobicContact CD2-CB 4.01Å; F595-L608 HydrophobicContact CD2-CD1 4.1Å; F595-L608 HydrophobicContact CE1-CB 4.38Å; F595-L608 HydrophobicContact CE1-CD1 4.15Å; F595-L608 HydrophobicContact CE1-CD2 3.7Å; F595-L608 HydrophobicContact CE1-CG 4.29Å; F595-L608 HydrophobicContact CE2-CB 3.63Å; F595-L608 HydrophobicContact CE2-CD1 4.39Å; F595-L608 HydrophobicContact CE2-CD2 4.45Å; F595-L608 HydrophobicContact CE2-CG 4.37Å; F595-L608 HydrophobicContact CG-CB 4.49Å; F595-L608 HydrophobicContact CG-CD1 3.77Å; F595-L608 HydrophobicContact CZ-CB 3.85Å; F595-L608 HydrophobicContact CZ-CD1 4.43Å; F595-L608 HydrophobicContact CZ-CD2 3.85Å; F595-L608 HydrophobicContact CZ-CG 4.25Å; L602-L608 HydrophobicContact CD1-CD1 4.12Å; T604-L608 PolarHBondContact O-N 3.44Å; T605-L608 PolarHBondContact O-N 3.06Å; L606-L608 VanDerWaalsContact C-N 3.3Å; L606-L608 PolarHBondContact O-N 3.49Å; L608-H610 VanDerWaalsContact C-N 3.34Å; L608-Q611 PolarHBondContact O-N 3.34Å; L608-A612 WeakPolarHBondContact O-CB 3.49Å; L608-A612 PolarHBondContact O-N 3.28Å; L608-V673 HydrophobicContact CD2-CB 4.21Å; L608-V673 HydrophobicContact CD2-CG1 3.77Å; L608-V673 HydrophobicContact CD2-CG2 3.97Å; L608-I677 HydrophobicContact CD1-CD1 3.92Å; L608-I677 HydrophobicContact CD2-CD1 4.23Å
609	F	93.3	Very high	87.8	Confident	14 Å²	14	43.6 Å²	43.6	6%	0.061	22%	0.224	C	C	.	.	H	α-helix	trans	-66.2	-38.6	179.9	-57.7	-34	0	0	0	111.4	T605 L606 A612 E613 K672 V673	T605-F609 WeakPolarHBondContact O-CD2 3.49Å; T605-F609 VanDerWaalsContact O-CG 3.23Å; T605-F609 WeakPolarHBondContact O-CG 3.41Å; T605-F609 PolarHBondContact O-N 3.24Å; T605-F609 VanDerWaalsContact O-N 3.11Å; L606-F609 PolarHBondContact O-N 3.5Å; F609-A612 WeakPolarHBondContact O-CB 3.38Å; F609-A612 PolarHBondContact O-N 3.18Å; F609-E613 WeakPolarHBondContact O-CG 3.45Å; F609-E613 PolarHBondContact O-N 3.38Å; F609-K672 HydrophobicContact CD1-CD 4.2Å; F609-K672 HydrophobicContact CD1-CG 4.26Å; F609-K672 HydrophobicContact CD2-CD 4.26Å; F609-K672 HydrophobicContact CE1-CB 4.17Å; F609-K672 HydrophobicContact CE1-CD 3.73Å; F609-K672 HydrophobicContact CE1-CG 3.58Å; F609-K672 HydrophobicContact CE2-CD 3.79Å; F609-K672 HydrophobicContact CE2-CG 4.48Å; F609-K672 HydrophobicContact CG-CD 4.46Å; F609-K672 HydrophobicContact CZ-CB 4.02Å; F609-K672 HydrophobicContact CZ-CD 3.51Å; F609-K672 HydrophobicContact CZ-CG 3.71Å; F609-V673 HydrophobicContact CE1-CG2 3.83Å; F609-V673 HydrophobicContact CZ-CG2 3.84Å
610	H	92.3	Very high	89.2	Confident	112 Å²	112	42.1 Å²	42.1	52%	0.519	22%	0.218	S	C	.	.	H	α-helix	trans	-64.8	-41.3	171.6	-175.4	48.5	0	0	0	112	L606 L608 A612 E613 V614	L606-H610 WeakPolarHBondContact O-CB 3.42Å; L606-H610 PolarHBondContact O-N 2.61Å; L608-H610 VanDerWaalsContact C-N 3.34Å; H610-A612 VanDerWaalsContact C-N 3.29Å; H610-A612 PolarHBondContact O-N 2.98Å; H610-E613 PolarHBondContact O-N 3.33Å; H610-V614 WeakPolarHBondContact O-CG2 3.35Å; H610-V614 PolarHBondContact O-N 3.24Å
611	Q	94.8	Very high	90.2	Very high	31 Å²	31	45.1 Å²	45.1	15%	0.145	22%	0.224	C	C	.	.	H	α-helix	trans	-60.5	-39.2	175.1	-174.2	65	90.6	0	0	112	M588 M592 L602 D607 L608 L615	M588-Q611 VanDerWaalsContact CG-NE2 3.25Å; M588-Q611 PolarHBondContact SD-NE2 3.01Å; M592-Q611 HydrophobicContact CG-CB 4.37Å; M592-Q611 HydrophobicContact CG-CG 3.67Å; M592-Q611 HydrophobicContact SD-CG 3.97Å; L602-Q611 HydrophobicContact CD1-CB 4.03Å; L602-Q611 HydrophobicContact CD1-CG 4.02Å; L602-Q611 HydrophobicContact CD2-CB 4.12Å; L602-Q611 HydrophobicContact CD2-CG 4.42Å; D607-Q611 VanDerWaalsContact O-CB 3.28Å; D607-Q611 WeakPolarHBondContact O-CB 3.31Å; D607-Q611 PolarHBondContact O-N 2.94Å; L608-Q611 PolarHBondContact O-N 3.34Å; Q611-L615 VanDerWaalsContact O-CB 3.24Å; Q611-L615 WeakPolarHBondContact O-CB 3.37Å; Q611-L615 PolarHBondContact O-N 2.85Å
612	A	95.9	Very high	91.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-67.1	-37.2	175.1	0	0	0	0	0	112.8	M592 L608 F609 H610 S616 L655 A659	M592-A612 HydrophobicContact CE-CB 4.09Å; L608-A612 WeakPolarHBondContact O-CB 3.49Å; L608-A612 PolarHBondContact O-N 3.28Å; F609-A612 WeakPolarHBondContact O-CB 3.38Å; F609-A612 PolarHBondContact O-N 3.18Å; H610-A612 VanDerWaalsContact C-N 3.29Å; H610-A612 PolarHBondContact O-N 2.98Å; A612-S616 WeakPolarHBondContact O-CB 3.32Å; A612-S616 PolarHBondContact O-N 2.94Å; A612-S616 PolarHBondContact O-OG 3.48Å; A612-L655 HydrophobicContact CB-CD1 3.85Å; A612-L655 HydrophobicContact CB-CD2 4.27Å; A612-L655 HydrophobicContact CB-CG 4.08Å; A612-L655 WeakPolarHBondContact O-CD2 3.47Å; A612-A659 HydrophobicContact CB-CB 4.05Å
613	E	94.1	Very high	92	Very high	47 Å²	47	37.9 Å²	37.9	22%	0.22	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-51.1	172.2	-71.1	175.4	-162.6	0	0	111	F609 H610 L615 S616 E617 A659 K660	F609-E613 WeakPolarHBondContact O-CG 3.45Å; F609-E613 PolarHBondContact O-N 3.38Å; H610-E613 PolarHBondContact O-N 3.33Å; E613-L615 VanDerWaalsContact C-N 3.34Å; E613-L615 PolarHBondContact O-N 3.4Å; E613-S616 PolarHBondContact O-N 2.91Å; E613-S616 PolarHBondContact O-OG 3.39Å; E613-E617 WeakPolarHBondContact O-CG 3.47Å; E613-E617 PolarHBondContact O-N 2.94Å; E613-A659 HydrophobicContact CG-CB 3.65Å; E613-K660 VanDerWaalsContact CD-CE 3.47Å; E613-K660 HydrophobicContact CG-CG 4.02Å; E613-K660 WeakPolarHBondContact OE1-CG 3.46Å; E613-K660 WeakPolarHBondContact OE2-CE 3.48Å
614	V	95.3	Very high	92.9	Very high	55 Å²	55	35.8 Å²	35.8	33%	0.333	19%	0.186	S	C	.	.	H	α-helix	trans	-62.2	-41.2	178.7	-179.3	0	0	0	0	111.4	M588 H610 S616 E617 E618	M588-V614 HydrophobicContact SD-CB 4.28Å; M588-V614 HydrophobicContact SD-CG1 3.73Å; H610-V614 WeakPolarHBondContact O-CG2 3.35Å; H610-V614 PolarHBondContact O-N 3.24Å; V614-S616 PolarHBondContact O-N 3.29Å; V614-E617 PolarHBondContact O-N 3Å; V614-E618 PolarHBondContact O-N 2.89Å
615	L	97.2	Very high	93.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.5	-41.4	175.7	-169.4	157.2	0	0	0	111.5	L585 M588 A589 M592 Q611 E613 E617 G619 L655 T680 I683	L585-L615 HydrophobicContact CD2-CD2 3.85Å; L585-L615 HydrophobicContact CD2-CG 3.75Å; L585-L615 WeakPolarHBondContact CD2-O 3.12Å; M588-L615 HydrophobicContact CB-CB 4.36Å; M588-L615 HydrophobicContact CB-CD1 3.8Å; M588-L615 HydrophobicContact CB-CG 4.27Å; M588-L615 HydrophobicContact CE-CB 4.34Å; M588-L615 HydrophobicContact SD-CB 4.25Å; A589-L615 HydrophobicContact CB-CD1 4.49Å; M592-L615 HydrophobicContact SD-CD1 3.79Å; Q611-L615 VanDerWaalsContact O-CB 3.24Å; Q611-L615 WeakPolarHBondContact O-CB 3.37Å; Q611-L615 PolarHBondContact O-N 2.85Å; E613-L615 VanDerWaalsContact C-N 3.34Å; E613-L615 PolarHBondContact O-N 3.4Å; L615-E617 VanDerWaalsContact C-N 3.32Å; L615-E617 PolarHBondContact O-N 2.65Å; L615-G619 PolarHBondContact O-N 3.39Å; L615-L655 HydrophobicContact CD2-CD2 3.85Å; L615-T680 HydrophobicContact CD1-CG2 3.4Å; L615-T680 VanDerWaalsContact CD1-CG2 3.4Å; L615-T680 HydrophobicContact CD2-CG2 3.96Å; L615-T680 HydrophobicContact CG-CG2 4.37Å; L615-I683 HydrophobicContact CD2-CD1 4.06Å; L615-I683 HydrophobicContact CD2-CG2 4.18Å
616	S	96.4	Very high	93.9	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65	-34.5	175.7	73.1	0	0	0	0	113.1	A612 E613 V614 L620 C652 Q656	A612-S616 WeakPolarHBondContact O-CB 3.32Å; A612-S616 PolarHBondContact O-N 2.94Å; A612-S616 PolarHBondContact O-OG 3.48Å; E613-S616 PolarHBondContact O-N 2.91Å; E613-S616 PolarHBondContact O-OG 3.39Å; V614-S616 PolarHBondContact O-N 3.29Å; S616-L620 WeakPolarHBondContact O-CG 3.49Å; S616-L620 PolarHBondContact O-N 3.31Å; S616-C652 WeakPolarHBondContact CB-O 3.46Å; S616-Q656 VanDerWaalsContact OG-CB 3.31Å; S616-Q656 WeakPolarHBondContact OG-CB 3.46Å; S616-Q656 WeakPolarHBondContact OG-CG 3.42Å
617	E	95	Very high	94.2	Very high	80 Å²	80	37.3 Å²	37.3	37%	0.374	19%	0.185	S	C	.	.	H	α-helix	trans	-76.1	-39.9	-179.6	-73	169.8	-164.9	0	0	111.3	E613 V614 L615 G619 L620 Q621 Q656 K660	E613-E617 WeakPolarHBondContact O-CG 3.47Å; E613-E617 PolarHBondContact O-N 2.94Å; V614-E617 PolarHBondContact O-N 3Å; L615-E617 VanDerWaalsContact C-N 3.32Å; L615-E617 PolarHBondContact O-N 2.65Å; E617-G619 VanDerWaalsContact C-N 3.35Å; E617-L620 PolarHBondContact O-N 2.94Å; E617-Q621 WeakPolarHBondContact O-CG 3.21Å; E617-Q621 PolarHBondContact O-N 3.5Å; E617-Q656 VanDerWaalsContact CG-NE2 3.31Å; E617-Q656 PolarHBondContact OE1-NE2 3.46Å; E617-K660 IonicContact OE1-NZ 3.24Å; E617-K660 PolarHBondContact OE1-NZ 3.11Å
618	E	96.3	Very high	94.5	Very high	34 Å²	34	38.8 Å²	38.8	16%	0.159	20%	0.196	C	C	.	.	H	α-helix	trans	-64.8	-37.7	169.9	-163.5	81.3	151	0	0	112	S584 L585 M588 V614 L620 Q621 L622	S584-E618 WeakPolarHBondContact CB-OE1 3.19Å; S584-E618 PolarHBondContact OG-OE1 3.16Å; L585-E618 HydrophobicContact CD2-CB 4.11Å; L585-E618 HydrophobicContact CD2-CG 4.4Å; L585-E618 HydrophobicContact CG-CG 4.41Å; M588-E618 HydrophobicContact CE-CB 3.66Å; M588-E618 HydrophobicContact CE-CG 3.88Å; V614-E618 PolarHBondContact O-N 2.89Å; E618-L620 VanDerWaalsContact C-N 3.33Å; E618-L620 PolarHBondContact O-N 3.3Å; E618-Q621 WeakPolarHBondContact O-CB 3.31Å; E618-Q621 PolarHBondContact O-N 2.88Å; E618-Q621 VanDerWaalsContact O-N 3.15Å; E618-Q621 PolarHBondContact OE2-NE2 3.5Å; E618-L622 PolarHBondContact O-N 2.8Å
619	G	96.3	Very high	94.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.7	-36.8	174.7	0	0	0	0	0	112.8	L615 E617 L622 C623	L615-G619 PolarHBondContact O-N 3.39Å; E617-G619 VanDerWaalsContact C-N 3.35Å; G619-L622 PolarHBondContact O-N 2.72Å; G619-C623 PolarHBondContact O-N 2.93Å; G619-C623 PolarHBondContact O-SG 2.93Å
620	L	95.7	Very high	94.1	Very high	49 Å²	49	39 Å²	39	26%	0.257	20%	0.198	S	C	.	.	H	α-helix	trans	-70.2	-32.7	172.3	-71.1	170.4	0	0	0	112.6	S616 E617 E618 C623 S624 V649 C652 Q653	S616-L620 WeakPolarHBondContact O-CG 3.49Å; S616-L620 PolarHBondContact O-N 3.31Å; E617-L620 PolarHBondContact O-N 2.94Å; E618-L620 VanDerWaalsContact C-N 3.33Å; E618-L620 PolarHBondContact O-N 3.3Å; L620-C623 PolarHBondContact O-N 3.16Å; L620-S624 PolarHBondContact O-N 2.92Å; L620-V649 HydrophobicContact CD2-CB 4.5Å; L620-V649 HydrophobicContact CD2-CG1 4.14Å; L620-V649 HydrophobicContact CD2-CG2 4.38Å; L620-C652 HydrophobicContact CD2-CB 3.97Å; L620-C652 HydrophobicContact CG-CB 3.88Å; L620-Q653 HydrophobicContact CD2-CG 4.44Å
621	Q	95.3	Very high	93.8	Very high	94 Å²	94	37.8 Å²	37.8	44%	0.439	20%	0.202	S	C	.	.	H	α-helix	trans	-65.4	-42.5	170.1	-67.8	177.2	62	0	0	111.7	E617 E618 C623 S624 S625	E617-Q621 WeakPolarHBondContact O-CG 3.21Å; E617-Q621 PolarHBondContact O-N 3.5Å; E618-Q621 WeakPolarHBondContact O-CB 3.31Å; E618-Q621 PolarHBondContact O-N 2.88Å; E618-Q621 VanDerWaalsContact O-N 3.15Å; E618-Q621 PolarHBondContact OE2-NE2 3.5Å; Q621-C623 VanDerWaalsContact C-N 3.3Å; Q621-C623 PolarHBondContact O-N 2.6Å; Q621-S624 WeakPolarHBondContact O-CA 3.26Å; Q621-S624 WeakPolarHBondContact O-CB 3.47Å; Q621-S624 PolarHBondContact O-N 2.92Å; Q621-S625 PolarHBondContact O-N 2.98Å; Q621-S625 PolarHBondContact O-OG 3.02Å
622	L	95.8	Very high	93.3	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-58.2	-42.3	173.9	178.2	57.6	0	0	0	111.4	I578 Q581 L585 E618 G619 S624 S625 L626 L648 V687	I578-L622 HydrophobicContact CB-CD1 4.22Å; I578-L622 HydrophobicContact CG1-CD1 4.29Å; I578-L622 HydrophobicContact CG2-CD1 4.02Å; Q581-L622 HydrophobicContact CB-CB 4.13Å; Q581-L622 HydrophobicContact CB-CD1 4.17Å; L585-L622 HydrophobicContact CD1-CB 4.43Å; L585-L622 HydrophobicContact CD1-CD2 3.51Å; E618-L622 PolarHBondContact O-N 2.8Å; G619-L622 PolarHBondContact O-N 2.72Å; L622-S624 PolarHBondContact O-N 3.15Å; L622-S625 PolarHBondContact O-N 3.4Å; L622-L626 HydrophobicContact CD1-CD1 4.16Å; L622-L626 HydrophobicContact CD1-CG 4.19Å; L622-L626 HydrophobicContact CG-CD1 3.88Å; L622-L626 HydrophobicContact CG-CG 4.42Å; L622-L626 WeakPolarHBondContact O-CB 3.49Å; L622-L626 WeakPolarHBondContact O-CG 3.36Å; L622-L626 PolarHBondContact O-N 3.44Å; L622-L648 HydrophobicContact CD2-CD2 4.28Å; L622-L648 HydrophobicContact CG-CD2 4.48Å; L622-V687 HydrophobicContact CD2-CG1 4.15Å; L622-V687 HydrophobicContact CD2-CG2 3.79Å
623	C	95.3	Very high	92.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.3	-31.1	172.3	-65.7	0	0	0	0	113.5	G619 L620 Q621 R627 T645 L648 V649	G619-C623 PolarHBondContact O-N 2.93Å; G619-C623 PolarHBondContact O-SG 2.93Å; L620-C623 PolarHBondContact O-N 3.16Å; Q621-C623 VanDerWaalsContact C-N 3.3Å; Q621-C623 PolarHBondContact O-N 2.6Å; C623-R627 WeakPolarHBondContact O-CB 3.47Å; C623-R627 WeakPolarHBondContact O-CD 3.3Å; C623-R627 VanDerWaalsContact O-CG 3.26Å; C623-R627 WeakPolarHBondContact O-CG 3.41Å; C623-R627 PolarHBondContact O-N 3.3Å; C623-R627 VanDerWaalsContact O-N 3.08Å; C623-T645 HydrophobicContact CB-CG2 3.8Å; C623-L648 VanDerWaalsContact SG-CD2 3.6Å; C623-L648 VanDerWaalsContact SG-CG 3.53Å; C623-V649 HydrophobicContact CB-CG2 3.6Å; C623-V649 VanDerWaalsContact SG-CG2 3.53Å
624	S	94.1	Very high	92	Very high	68 Å²	68	43.8 Å²	43.8	48%	0.476	24%	0.238	S	C	.	.	H	α-helix	trans	-70.6	-44.1	174.4	-159.7	0	0	0	0	111.7	L620 Q621 L622 R627 T628	L620-S624 PolarHBondContact O-N 2.92Å; Q621-S624 WeakPolarHBondContact O-CA 3.26Å; Q621-S624 WeakPolarHBondContact O-CB 3.47Å; Q621-S624 PolarHBondContact O-N 2.92Å; L622-S624 PolarHBondContact O-N 3.15Å; S624-R627 PolarHBondContact O-N 3.22Å; S624-T628 WeakPolarHBondContact O-CB 3.39Å; S624-T628 PolarHBondContact O-N 2.64Å; S624-T628 PolarHBondContact O-OG1 3.16Å
625	S	93.2	Very high	91.2	Very high	20 Å²	20	46.4 Å²	46.4	14%	0.14	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-43.4	174.8	-55.5	0	0	0	0	111.7	Q581 Q621 L622 R627 T628 F629	Q581-S625 PolarHBondContact NE2-OG 3.14Å; Q581-S625 VanDerWaalsContact OE1-CB 3.29Å; Q581-S625 PolarHBondContact OE1-OG 3.3Å; Q621-S625 PolarHBondContact O-N 2.98Å; Q621-S625 PolarHBondContact O-OG 3.02Å; L622-S625 PolarHBondContact O-N 3.4Å; S625-R627 PolarHBondContact O-N 3.42Å; S625-T628 PolarHBondContact O-N 3.44Å; S625-F629 WeakPolarHBondContact O-CB 3.26Å; S625-F629 PolarHBondContact O-N 3.31Å
626	L	93.1	Very high	90.3	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.016	29%	0.286	C	S	.	.	H	α-helix	trans	-62.7	-39.9	176	-75.6	163.5	0	0	0	112.5	I578 L622 F629 S630 V641 T645 L648 L690	I578-L626 HydrophobicContact CD1-CD2 3.89Å; I578-L626 HydrophobicContact CD1-CG 4.38Å; I578-L626 HydrophobicContact CG1-CD2 4.5Å; L622-L626 HydrophobicContact CD1-CD1 4.16Å; L622-L626 HydrophobicContact CD1-CG 4.19Å; L622-L626 HydrophobicContact CG-CD1 3.88Å; L622-L626 HydrophobicContact CG-CG 4.42Å; L622-L626 WeakPolarHBondContact O-CB 3.49Å; L622-L626 WeakPolarHBondContact O-CG 3.36Å; L622-L626 PolarHBondContact O-N 3.44Å; L626-F629 PolarHBondContact O-N 3.38Å; L626-S630 WeakPolarHBondContact O-CB 3.35Å; L626-S630 PolarHBondContact O-N 3.25Å; L626-V641 HydrophobicContact CD2-CG1 4.43Å; L626-T645 HydrophobicContact CB-CG2 4.06Å; L626-T645 HydrophobicContact CD1-CG2 4.37Å; L626-L648 HydrophobicContact CD1-CD2 4.12Å; L626-L690 HydrophobicContact CD1-CD1 3.8Å; L626-L690 HydrophobicContact CD2-CD2 4.32Å
627	R	92.2	Very high	89.5	Confident	121 Å²	121	57 Å²	57	46%	0.457	30%	0.299	S	S	.	.	H	α-helix	trans	-63.7	-46.4	172.6	-76.7	166.9	175.7	158.1	-3.9	111.8	C623 S624 S625 F629 S630 S631 T645	C623-R627 WeakPolarHBondContact O-CB 3.47Å; C623-R627 WeakPolarHBondContact O-CD 3.3Å; C623-R627 VanDerWaalsContact O-CG 3.26Å; C623-R627 WeakPolarHBondContact O-CG 3.41Å; C623-R627 PolarHBondContact O-N 3.3Å; C623-R627 VanDerWaalsContact O-N 3.08Å; S624-R627 PolarHBondContact O-N 3.22Å; S625-R627 PolarHBondContact O-N 3.42Å; R627-F629 VanDerWaalsContact C-N 3.25Å; R627-F629 PolarHBondContact O-N 2.97Å; R627-S630 WeakPolarHBondContact CA-OG 3.47Å; R627-S630 PolarHBondContact O-N 3.44Å; R627-S630 PolarHBondContact O-OG 2.74Å; R627-S631 PolarHBondContact O-N 3.2Å; R627-S631 VanDerWaalsContact O-N 3.08Å; R627-T645 HydrophobicContact CG-CG2 4.37Å
628	T	90.1	Very high	89	Confident	84 Å²	84	56.2 Å²	56.2	52%	0.515	29%	0.294	S	S	.	.	H	α-helix	trans	-64	-29.7	178	-53.7	0	0	0	0	112.6	S624 S625 S631 Q632	S624-T628 WeakPolarHBondContact O-CB 3.39Å; S624-T628 PolarHBondContact O-N 2.64Å; S624-T628 PolarHBondContact O-OG1 3.16Å; S625-T628 PolarHBondContact O-N 3.44Å; T628-S631 PolarHBondContact O-OG 2.96Å; T628-Q632 PolarHBondContact O-NE2 2.97Å
629	F	89.6	Confident	88.5	Confident	11 Å²	11	57.5 Å²	57.5	5%	0.048	31%	0.307	C	S	.	.	H	α-helix	trans	-73	-46.2	168.1	177.7	-105.8	0	0	0	111.5	I578 S625 L626 R627 S631 Q632 L633 S694 L697 N698	I578-F629 HydrophobicContact CD1-CB 3.95Å; I578-F629 HydrophobicContact CD1-CD1 4.38Å; I578-F629 HydrophobicContact CD1-CG 4.07Å; S625-F629 WeakPolarHBondContact O-CB 3.26Å; S625-F629 PolarHBondContact O-N 3.31Å; L626-F629 PolarHBondContact O-N 3.38Å; R627-F629 VanDerWaalsContact C-N 3.25Å; R627-F629 PolarHBondContact O-N 2.97Å; F629-S631 VanDerWaalsContact C-N 3.26Å; F629-S631 PolarHBondContact O-N 2.92Å; F629-Q632 WeakPolarHBondContact O-CB 3.3Å; F629-Q632 PolarHBondContact O-N 3.23Å; F629-L633 HydrophobicContact CD1-CD1 4.2Å; F629-L633 HydrophobicContact CE1-CD1 3.9Å; F629-L633 HydrophobicContact CE1-CD2 4.27Å; F629-L633 HydrophobicContact CE1-CG 4.42Å; F629-L633 HydrophobicContact CZ-CD2 4.19Å; F629-S694 WeakPolarHBondContact CZ-O 3.13Å; F629-L697 HydrophobicContact CE1-CB 4.18Å; F629-L697 HydrophobicContact CZ-CB 3.87Å; F629-N698 HydrophobicContact CE2-CB 3.94Å; F629-N698 HydrophobicContact CZ-CB 4.11Å
630	S	89.3	Confident	88.1	Confident	7 Å²	7	60.8 Å²	60.8	5%	0.049	33%	0.327	C	S	.	.	H	α-helix	trans	-62.1	-27.9	-177.2	77.1	0	0	0	0	114.4	L626 R627 Q632 L633 K638	L626-S630 WeakPolarHBondContact O-CB 3.35Å; L626-S630 PolarHBondContact O-N 3.25Å; R627-S630 WeakPolarHBondContact CA-OG 3.47Å; R627-S630 PolarHBondContact O-N 3.44Å; R627-S630 PolarHBondContact O-OG 2.74Å; S630-Q632 PolarHBondContact O-N 2.85Å; S630-L633 PolarHBondContact O-N 3.47Å; S630-K638 WeakPolarHBondContact O-CD 3.27Å; S630-K638 WeakPolarHBondContact O-CG 3.49Å
631	S	85.9	Confident	87.7	Confident	87 Å²	87	58.5 Å²	58.5	61%	0.608	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-9.2	174.2	53.7	0	0	0	0	114.1	R627 T628 F629	R627-S631 PolarHBondContact O-N 3.2Å; R627-S631 VanDerWaalsContact O-N 3.08Å; T628-S631 PolarHBondContact O-OG 2.96Å; F629-S631 VanDerWaalsContact C-N 3.26Å; F629-S631 PolarHBondContact O-N 2.92Å
632	Q	82.6	Confident	87.5	Confident	84 Å²	84	56.4 Å²	56.4	39%	0.393	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	2.3	176.5	-58.4	171.1	66.9	0	0	112.3	T628 F629 S630 Y701	T628-Q632 PolarHBondContact O-NE2 2.97Å; F629-Q632 WeakPolarHBondContact O-CB 3.3Å; F629-Q632 PolarHBondContact O-N 3.23Å; S630-Q632 PolarHBondContact O-N 2.85Å; Q632-Y701 HydrophobicContact CB-CE2 4.31Å
633	L	83.4	Confident	87.3	Confident	22 Å²	22	59.7 Å²	59.7	12%	0.115	33%	0.327	C	S	.	.	S	Bend	trans	-106.1	158.9	-175.6	-58.7	179.1	0	0	0	113	F629 S630 K638 V641 L697	F629-L633 HydrophobicContact CD1-CD1 4.2Å; F629-L633 HydrophobicContact CE1-CD1 3.9Å; F629-L633 HydrophobicContact CE1-CD2 4.27Å; F629-L633 HydrophobicContact CE1-CG 4.42Å; F629-L633 HydrophobicContact CZ-CD2 4.19Å; S630-L633 PolarHBondContact O-N 3.47Å; L633-K638 HydrophobicContact CB-CB 4Å; L633-V641 HydrophobicContact CD1-CG2 4.08Å; L633-L697 HydrophobicContact CD1-CD1 3.87Å; L633-L697 HydrophobicContact CD2-CB 4.07Å
634	V	81	Confident	87	Confident	98 Å²	98	61.6 Å²	61.6	59%	0.594	34%	0.335	S	S	*	.			trans	-71.2	146.5	171.4	-175.1	0	0	0	0	110.2	E636 E637 K638	V634-E636 VanDerWaalsContact C-N 3.34Å; V634-E636 PolarHBondContact O-N 2.96Å; V634-E636 VanDerWaalsContact O-N 3.14Å; V634-E637 PolarHBondContact O-N 3.43Å; V634-E637 VanDerWaalsContact O-N 3.12Å; V634-K638 WeakPolarHBondContact O-CB 3.39Å; V634-K638 PolarHBondContact O-N 3.09Å
635	D	77.1	Confident	87	Confident	109 Å²	109	58.4 Å²	58.4	58%	0.583	31%	0.313	S	S	*	.	H	α-helix	trans	-55.4	-35.2	-165.3	-76.5	-44.7	0	0	0	116	K638 S639	D635-K638 WeakPolarHBondContact OD1-CE 3.35Å; D635-K638 IonicContact OD1-NZ 3.07Å; D635-K638 PolarHBondContact OD1-NZ 3.2Å; D635-S639 WeakPolarHBondContact O-CB 3.3Å; D635-S639 PolarHBondContact O-N 3.18Å
636	E	78.6	Confident	87	Confident	165 Å²	165	62.7 Å²	62.7	77%	0.771	33%	0.331	S	S	*	.	H	α-helix	trans	-67.7	-50.7	175.4	-66.4	-162.4	151.7	0	0	112.2	V634 K638 S639	V634-E636 VanDerWaalsContact C-N 3.34Å; V634-E636 PolarHBondContact O-N 2.96Å; V634-E636 VanDerWaalsContact O-N 3.14Å; E636-K638 VanDerWaalsContact C-N 3.29Å; E636-K638 PolarHBondContact O-N 3.33Å; E636-S639 PolarHBondContact O-N 3.17Å; E636-S639 PolarHBondContact O-OG 3.37Å
637	E	80.4	Confident	87	Confident	59 Å²	59	67.2 Å²	67.2	28%	0.276	35%	0.351	S	S	.	.	H	α-helix	trans	-64	-37.5	179.1	-64.3	177.2	144.6	0	0	111.3	V634 V641 L697 K700	V634-E637 PolarHBondContact O-N 3.43Å; V634-E637 VanDerWaalsContact O-N 3.12Å; E637-V641 PolarHBondContact O-N 3.29Å; E637-L697 HydrophobicContact CB-CD1 4.3Å; E637-L697 HydrophobicContact CB-CD2 3.91Å; E637-L697 HydrophobicContact CG-CD2 3.87Å; E637-L697 WeakPolarHBondContact OE1-CD2 3.43Å; E637-K700 IonicContact OE1-NZ 2.71Å; E637-K700 PolarHBondContact OE1-NZ 2.68Å; E637-K700 IonicContact OE2-NZ 2.75Å; E637-K700 PolarHBondContact OE2-NZ 2.88Å
638	K	84.3	Confident	87.2	Confident	62 Å²	62	61.4 Å²	61.4	27%	0.27	33%	0.329	S	S	.	.	H	α-helix	trans	-61.8	-41.6	173.1	174.6	175	157.4	-159.1	0	112.6	S630 L633 V634 D635 E636 V640 V641 I642	S630-K638 WeakPolarHBondContact O-CD 3.27Å; S630-K638 WeakPolarHBondContact O-CG 3.49Å; L633-K638 HydrophobicContact CB-CB 4Å; V634-K638 WeakPolarHBondContact O-CB 3.39Å; V634-K638 PolarHBondContact O-N 3.09Å; D635-K638 WeakPolarHBondContact OD1-CE 3.35Å; D635-K638 IonicContact OD1-NZ 3.07Å; D635-K638 PolarHBondContact OD1-NZ 3.2Å; E636-K638 VanDerWaalsContact C-N 3.29Å; E636-K638 PolarHBondContact O-N 3.33Å; K638-V640 VanDerWaalsContact C-N 3.32Å; K638-V640 PolarHBondContact O-N 2.91Å; K638-V641 PolarHBondContact O-N 3.21Å; K638-I642 HydrophobicContact CG-CD1 3.68Å; K638-I642 HydrophobicContact CG-CG1 4.45Å; K638-I642 WeakPolarHBondContact O-CB 3.13Å; K638-I642 VanDerWaalsContact O-CG1 3.31Å; K638-I642 WeakPolarHBondContact O-CG1 3.41Å; K638-I642 PolarHBondContact O-N 3.2Å
639	S	86.2	Confident	87.5	Confident	61 Å²	61	58.1 Å²	58.1	43%	0.427	31%	0.309	S	S	.	.	H	α-helix	trans	-60.5	-39.7	-179.6	75.4	0	0	0	0	112.6	D635 E636 T643	D635-S639 WeakPolarHBondContact O-CB 3.3Å; D635-S639 PolarHBondContact O-N 3.18Å; E636-S639 PolarHBondContact O-N 3.17Å; E636-S639 PolarHBondContact O-OG 3.37Å; S639-T643 WeakPolarHBondContact O-CB 3.4Å; S639-T643 PolarHBondContact O-N 2.95Å; S639-T643 PolarHBondContact O-OG1 3.34Å
640	V	86.4	Confident	87.8	Confident	69 Å²	69	61.9 Å²	61.9	42%	0.418	33%	0.332	S	S	.	.	H	α-helix	trans	-67.4	-48.6	178.5	179.9	0	0	0	0	110.7	K638 I642 T643 E644 I693	K638-V640 VanDerWaalsContact C-N 3.32Å; K638-V640 PolarHBondContact O-N 2.91Å; V640-I642 VanDerWaalsContact C-N 3.35Å; V640-I642 PolarHBondContact O-N 3.21Å; V640-T643 PolarHBondContact O-N 3.21Å; V640-E644 PolarHBondContact O-N 3.4Å; V640-E644 VanDerWaalsContact O-N 3.16Å; V640-I693 HydrophobicContact CG1-CD1 4.43Å
641	V	88.6	Confident	88.2	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.006	34%	0.336	C	S	.	.	H	α-helix	trans	-62	-42	179.1	175.7	0	0	0	0	111.2	L626 L633 E637 K638 T645 L690 I693 L697	L626-V641 HydrophobicContact CD2-CG1 4.43Å; L633-V641 HydrophobicContact CD1-CG2 4.08Å; E637-V641 PolarHBondContact O-N 3.29Å; K638-V641 PolarHBondContact O-N 3.21Å; V641-T645 VanDerWaalsContact O-CB 3.27Å; V641-T645 WeakPolarHBondContact O-CB 3.23Å; V641-T645 PolarHBondContact O-N 2.9Å; V641-T645 PolarHBondContact O-OG1 3.24Å; V641-L690 HydrophobicContact CG1-CD2 4.42Å; V641-I693 HydrophobicContact CG2-CG2 4.09Å; V641-L697 HydrophobicContact CG2-CD1 3.89Å
642	I	90.6	Very high	88.7	Confident	51 Å²	51	58.6 Å²	58.6	26%	0.262	31%	0.307	S	S	.	.	H	α-helix	trans	-63.5	-46.7	176.3	-70	172.4	0	0	0	110.9	K638 V640 E644 T645 E646	K638-I642 HydrophobicContact CG-CD1 3.68Å; K638-I642 HydrophobicContact CG-CG1 4.45Å; K638-I642 WeakPolarHBondContact O-CB 3.13Å; K638-I642 VanDerWaalsContact O-CG1 3.31Å; K638-I642 WeakPolarHBondContact O-CG1 3.41Å; K638-I642 PolarHBondContact O-N 3.2Å; V640-I642 VanDerWaalsContact C-N 3.35Å; V640-I642 PolarHBondContact O-N 3.21Å; I642-E644 PolarHBondContact O-N 3.45Å; I642-T645 CarbonylContact O-C 3.24Å; I642-T645 WeakPolarHBondContact O-CB 3.42Å; I642-T645 PolarHBondContact O-N 2.67Å; I642-T645 VanDerWaalsContact O-N 3.12Å; I642-E646 HydrophobicContact CG2-CG 4.34Å; I642-E646 WeakPolarHBondContact O-CG 3.42Å; I642-E646 PolarHBondContact O-N 3.3Å
643	T	90.9	Very high	89.2	Confident	71 Å²	71	59 Å²	59	44%	0.436	31%	0.309	S	S	.	.	H	α-helix	trans	-58.5	-44.9	-178.4	-59.5	0	0	0	0	112.6	S639 V640 K647	S639-T643 WeakPolarHBondContact O-CB 3.4Å; S639-T643 PolarHBondContact O-N 2.95Å; S639-T643 PolarHBondContact O-OG1 3.34Å; V640-T643 PolarHBondContact O-N 3.21Å; T643-K647 PolarHBondContact O-N 3.03Å
644	E	89.9	Confident	89.7	Confident	40 Å²	40	62.2 Å²	62.2	19%	0.187	32%	0.323	C	S	.	.	H	α-helix	trans	-73.4	-33.1	176.3	-58.5	-49.5	128.3	0	0	112.2	V640 I642 E646 K647 L648 V686 L690	V640-E644 PolarHBondContact O-N 3.4Å; V640-E644 VanDerWaalsContact O-N 3.16Å; I642-E644 PolarHBondContact O-N 3.45Å; E644-E646 VanDerWaalsContact C-N 3.32Å; E644-E646 PolarHBondContact O-N 2.98Å; E644-K647 PolarHBondContact O-N 3.33Å; E644-K647 WeakPolarHBondContact OE1-CE 3.4Å; E644-K647 IonicContact OE1-NZ 2.74Å; E644-K647 PolarHBondContact OE1-NZ 3.48Å; E644-K647 WeakPolarHBondContact OE2-CD 3.19Å; E644-K647 WeakPolarHBondContact OE2-CE 3.47Å; E644-K647 IonicContact OE2-NZ 3.23Å; E644-K647 PolarHBondContact OE2-NZ 3.01Å; E644-L648 PolarHBondContact O-N 2.71Å; E644-V686 HydrophobicContact CB-CG1 4.48Å; E644-V686 WeakPolarHBondContact O-CG1 3.5Å; E644-L690 HydrophobicContact CB-CD1 4.24Å; E644-L690 HydrophobicContact CB-CD2 3.74Å; E644-L690 HydrophobicContact CB-CG 3.87Å
645	T	93.3	Very high	90.4	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-35.9	174.1	-58.4	0	0	0	0	112	C623 L626 R627 V641 I642 L648 V649	C623-T645 HydrophobicContact CB-CG2 3.8Å; L626-T645 HydrophobicContact CB-CG2 4.06Å; L626-T645 HydrophobicContact CD1-CG2 4.37Å; R627-T645 HydrophobicContact CG-CG2 4.37Å; V641-T645 VanDerWaalsContact O-CB 3.27Å; V641-T645 WeakPolarHBondContact O-CB 3.23Å; V641-T645 PolarHBondContact O-N 2.9Å; V641-T645 PolarHBondContact O-OG1 3.24Å; I642-T645 CarbonylContact O-C 3.24Å; I642-T645 WeakPolarHBondContact O-CB 3.42Å; I642-T645 PolarHBondContact O-N 2.67Å; I642-T645 VanDerWaalsContact O-N 3.12Å; T645-L648 WeakPolarHBondContact O-CB 3.13Å; T645-L648 PolarHBondContact O-N 3.15Å; T645-V649 WeakPolarHBondContact O-CG2 3.46Å; T645-V649 PolarHBondContact O-N 2.92Å
646	E	93.2	Very high	91.2	Very high	110 Å²	110	54.7 Å²	54.7	51%	0.514	28%	0.278	S	S	.	.	H	α-helix	trans	-67.6	-39.4	176.6	-74.6	-179.8	172.8	0	0	112.2	I642 E644 L648 V649 V650	I642-E646 HydrophobicContact CG2-CG 4.34Å; I642-E646 WeakPolarHBondContact O-CG 3.42Å; I642-E646 PolarHBondContact O-N 3.3Å; E644-E646 VanDerWaalsContact C-N 3.32Å; E644-E646 PolarHBondContact O-N 2.98Å; E646-L648 VanDerWaalsContact C-N 3.32Å; E646-L648 PolarHBondContact O-N 2.97Å; E646-V649 PolarHBondContact O-N 3.31Å; E646-V650 WeakPolarHBondContact O-CG2 3.37Å; E646-V650 PolarHBondContact O-N 2.87Å; E646-V650 VanDerWaalsContact O-N 3.11Å
647	K	94.4	Very high	91.8	Very high	97 Å²	97	52.8 Å²	52.8	42%	0.422	27%	0.271	S	S	.	.	H	α-helix	trans	-60.2	-43	170.5	-61.9	175.3	-160.6	167.8	0	111.5	T643 E644 V649 V650 L651	T643-K647 PolarHBondContact O-N 3.03Å; E644-K647 PolarHBondContact O-N 3.33Å; E644-K647 WeakPolarHBondContact OE1-CE 3.4Å; E644-K647 IonicContact OE1-NZ 2.74Å; E644-K647 PolarHBondContact OE1-NZ 3.48Å; E644-K647 WeakPolarHBondContact OE2-CD 3.19Å; E644-K647 WeakPolarHBondContact OE2-CE 3.47Å; E644-K647 IonicContact OE2-NZ 3.23Å; E644-K647 PolarHBondContact OE2-NZ 3.01Å; K647-V649 PolarHBondContact O-N 3.45Å; K647-V650 PolarHBondContact O-N 3.48Å; K647-L651 WeakPolarHBondContact O-CG 3.18Å; K647-L651 PolarHBondContact O-N 2.69Å
648	L	95.9	Very high	92.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.2	-43	177.3	-172.1	59.6	0	0	0	111.6	L622 C623 L626 E644 T645 E646 V650 L651 C652 I683 V686 V687 L690	L622-L648 HydrophobicContact CD2-CD2 4.28Å; L622-L648 HydrophobicContact CG-CD2 4.48Å; C623-L648 VanDerWaalsContact SG-CD2 3.6Å; C623-L648 VanDerWaalsContact SG-CG 3.53Å; L626-L648 HydrophobicContact CD1-CD2 4.12Å; E644-L648 PolarHBondContact O-N 2.71Å; T645-L648 WeakPolarHBondContact O-CB 3.13Å; T645-L648 PolarHBondContact O-N 3.15Å; E646-L648 VanDerWaalsContact C-N 3.32Å; E646-L648 PolarHBondContact O-N 2.97Å; L648-V650 PolarHBondContact O-N 3.02Å; L648-L651 PolarHBondContact O-N 3.16Å; L648-C652 WeakPolarHBondContact O-CB 3.25Å; L648-C652 PolarHBondContact O-N 3.4Å; L648-C652 PolarHBondContact O-SG 3.09Å; L648-I683 HydrophobicContact CD1-CB 4.37Å; L648-I683 HydrophobicContact CD1-CG2 3.82Å; L648-V686 HydrophobicContact CB-CG1 3.89Å; L648-V686 HydrophobicContact CD1-CB 4.29Å; L648-V686 HydrophobicContact CD1-CG1 4.32Å; L648-V687 HydrophobicContact CD1-CG2 3.93Å; L648-V687 HydrophobicContact CD2-CG2 4.07Å; L648-L690 HydrophobicContact CD2-CD1 3.97Å
649	V	96.1	Very high	92.4	Very high	15 Å²	15	48.4 Å²	48.4	9%	0.091	26%	0.259	C	S	.	.	H	α-helix	trans	-58.2	-46.6	174.2	170.4	0	0	0	0	111.9	L620 C623 T645 E646 K647 L651 C652 Q653	L620-V649 HydrophobicContact CD2-CB 4.5Å; L620-V649 HydrophobicContact CD2-CG1 4.14Å; L620-V649 HydrophobicContact CD2-CG2 4.38Å; C623-V649 HydrophobicContact CB-CG2 3.6Å; C623-V649 VanDerWaalsContact SG-CG2 3.53Å; T645-V649 WeakPolarHBondContact O-CG2 3.46Å; T645-V649 PolarHBondContact O-N 2.92Å; E646-V649 PolarHBondContact O-N 3.31Å; K647-V649 PolarHBondContact O-N 3.45Å; V649-L651 PolarHBondContact O-N 3.39Å; V649-C652 PolarHBondContact O-N 3.06Å; V649-Q653 HydrophobicContact CG1-CG 4.4Å; V649-Q653 WeakPolarHBondContact O-CB 3.36Å; V649-Q653 VanDerWaalsContact O-CG 3.32Å; V649-Q653 WeakPolarHBondContact O-CG 3.5Å; V649-Q653 PolarHBondContact O-N 3.11Å
650	V	95.9	Very high	92.4	Very high	89 Å²	89	50.5 Å²	50.5	54%	0.539	26%	0.261	S	S	.	.	H	α-helix	trans	-62	-43.8	179.6	173.3	0	0	0	0	111.2	E646 K647 L648 Q653 Q654	E646-V650 WeakPolarHBondContact O-CG2 3.37Å; E646-V650 PolarHBondContact O-N 2.87Å; E646-V650 VanDerWaalsContact O-N 3.11Å; K647-V650 PolarHBondContact O-N 3.48Å; L648-V650 PolarHBondContact O-N 3.02Å; V650-Q653 PolarHBondContact O-N 3.33Å; V650-Q654 WeakPolarHBondContact O-CB 3.46Å; V650-Q654 PolarHBondContact O-N 3.21Å
651	L	96.5	Very high	92.4	Very high	26 Å²	26	50.7 Å²	50.7	14%	0.136	26%	0.262	C	S	.	.	H	α-helix	trans	-66	-41.3	178.4	-69.5	169.3	0	0	0	112.5	K647 L648 V649 Q654 L655 T679 N682 I683 V686	K647-L651 WeakPolarHBondContact O-CG 3.18Å; K647-L651 PolarHBondContact O-N 2.69Å; L648-L651 PolarHBondContact O-N 3.16Å; V649-L651 PolarHBondContact O-N 3.39Å; L651-Q654 PolarHBondContact O-N 3.38Å; L651-L655 PolarHBondContact O-N 2.99Å; L651-T679 HydrophobicContact CD2-CG2 4.48Å; L651-T679 WeakPolarHBondContact O-CG2 3.37Å; L651-N682 HydrophobicContact CD1-CB 4.02Å; L651-N682 HydrophobicContact CD2-CB 3.91Å; L651-I683 HydrophobicContact CB-CD1 4.48Å; L651-I683 HydrophobicContact CB-CG1 3.66Å; L651-V686 HydrophobicContact CD1-CG2 3.89Å
652	C	96.6	Very high	92.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.5	-43.9	174.6	-66.9	0	0	0	0	111.6	S616 L620 L648 V649 Q654 L655 Q656	S616-C652 WeakPolarHBondContact CB-O 3.46Å; L620-C652 HydrophobicContact CD2-CB 3.97Å; L620-C652 HydrophobicContact CG-CB 3.88Å; L648-C652 WeakPolarHBondContact O-CB 3.25Å; L648-C652 PolarHBondContact O-N 3.4Å; L648-C652 PolarHBondContact O-SG 3.09Å; V649-C652 PolarHBondContact O-N 3.06Å; C652-Q654 PolarHBondContact O-N 3.47Å; C652-L655 PolarHBondContact O-N 2.84Å; C652-Q656 WeakPolarHBondContact O-CB 3.44Å; C652-Q656 PolarHBondContact O-N 3.24Å
653	Q	93.7	Very high	91.8	Very high	93 Å²	93	56.3 Å²	56.3	44%	0.435	30%	0.301	S	S	.	.	H	α-helix	trans	-62.9	-40.8	175.1	-72.6	174.7	-7.7	0	0	112.2	L620 V649 V650 Q656 M657	L620-Q653 HydrophobicContact CD2-CG 4.44Å; V649-Q653 HydrophobicContact CG1-CG 4.4Å; V649-Q653 WeakPolarHBondContact O-CB 3.36Å; V649-Q653 VanDerWaalsContact O-CG 3.32Å; V649-Q653 WeakPolarHBondContact O-CG 3.5Å; V649-Q653 PolarHBondContact O-N 3.11Å; V650-Q653 PolarHBondContact O-N 3.33Å; Q653-Q656 PolarHBondContact O-N 3.35Å; Q653-M657 HydrophobicContact CB-CE 4.49Å; Q653-M657 WeakPolarHBondContact O-CE 3.41Å; Q653-M657 WeakPolarHBondContact O-CG 3.4Å; Q653-M657 PolarHBondContact O-N 3.46Å
654	Q	94.4	Very high	91.1	Very high	89 Å²	89	61.7 Å²	61.7	42%	0.416	32%	0.321	S	S	.	.	H	α-helix	trans	-59.8	-45.9	174.1	179.7	179.3	-9.8	0	0	111.5	V650 L651 C652 G658 T679	V650-Q654 WeakPolarHBondContact O-CB 3.46Å; V650-Q654 PolarHBondContact O-N 3.21Å; L651-Q654 PolarHBondContact O-N 3.38Å; C652-Q654 PolarHBondContact O-N 3.47Å; Q654-G658 PolarHBondContact O-N 3.48Å; Q654-T679 HydrophobicContact CB-CG2 4.24Å; Q654-T679 HydrophobicContact CG-CG2 4.09Å
655	L	95.8	Very high	90.4	Very high	3 Å²	3	62.4 Å²	62.4	2%	0.016	34%	0.339	C	S	.	.	H	α-helix	trans	-62.9	-45.1	176.7	-174.6	62.5	0	0	0	111.3	A612 L615 L651 C652 M657 G658 A659 T679 I683	A612-L655 HydrophobicContact CB-CD1 3.85Å; A612-L655 HydrophobicContact CB-CD2 4.27Å; A612-L655 HydrophobicContact CB-CG 4.08Å; A612-L655 WeakPolarHBondContact O-CD2 3.47Å; L615-L655 HydrophobicContact CD2-CD2 3.85Å; L651-L655 PolarHBondContact O-N 2.99Å; C652-L655 PolarHBondContact O-N 2.84Å; L655-M657 PolarHBondContact O-N 2.98Å; L655-G658 PolarHBondContact O-N 3.08Å; L655-A659 VanDerWaalsContact O-CB 3.24Å; L655-A659 WeakPolarHBondContact O-CB 3.12Å; L655-A659 PolarHBondContact O-N 3.1Å; L655-T679 HydrophobicContact CB-CG2 3.9Å; L655-I683 HydrophobicContact CB-CD1 4.11Å; L655-I683 HydrophobicContact CD2-CD1 3.67Å
656	Q	92.6	Very high	89.4	Confident	45 Å²	45	65.6 Å²	65.6	21%	0.21	35%	0.353	C	S	.	.	H	α-helix	trans	-63.5	-43.2	-178.8	-157.9	-175.8	36.2	0	0	112.3	S616 E617 C652 Q653 K660	S616-Q656 VanDerWaalsContact OG-CB 3.31Å; S616-Q656 WeakPolarHBondContact OG-CB 3.46Å; S616-Q656 WeakPolarHBondContact OG-CG 3.42Å; E617-Q656 VanDerWaalsContact CG-NE2 3.31Å; E617-Q656 PolarHBondContact OE1-NE2 3.46Å; C652-Q656 WeakPolarHBondContact O-CB 3.44Å; C652-Q656 PolarHBondContact O-N 3.24Å; Q653-Q656 PolarHBondContact O-N 3.35Å; Q656-K660 HydrophobicContact CG-CD 4.14Å; Q656-K660 VanDerWaalsContact NE2-NZ 3.15Å; Q656-K660 WeakPolarHBondContact O-CB 3.26Å; Q656-K660 WeakPolarHBondContact O-CG 3.3Å; Q656-K660 PolarHBondContact O-N 2.85Å; Q656-K660 VanDerWaalsContact O-N 3.12Å
657	M	91.6	Very high	88.8	Confident	125 Å²	125	64.4 Å²	64.4	62%	0.616	35%	0.353	S	S	*	.	H	α-helix	trans	-68.3	-42.2	175.5	-69.6	-174.1	-69.5	0	0	112	Q653 L655 K660 T661	Q653-M657 HydrophobicContact CB-CE 4.49Å; Q653-M657 WeakPolarHBondContact O-CE 3.41Å; Q653-M657 WeakPolarHBondContact O-CG 3.4Å; Q653-M657 PolarHBondContact O-N 3.46Å; L655-M657 PolarHBondContact O-N 2.98Å; M657-K660 PolarHBondContact O-N 3.02Å; M657-T661 PolarHBondContact O-N 2.98Å; M657-T661 PolarHBondContact O-OG1 3.34Å
658	G	89	Confident	88.2	Confident	27 Å²	27	61.3 Å²	61.3	28%	0.278	35%	0.346	S	S	.	.	H	α-helix	trans	-61	-47.6	176.5	0	0	0	0	0	112.1	Q654 L655 K660 T661 K672	Q654-G658 PolarHBondContact O-N 3.48Å; L655-G658 PolarHBondContact O-N 3.08Å; G658-K660 PolarHBondContact O-N 3.4Å; G658-T661 WeakPolarHBondContact O-CB 3.24Å; G658-T661 PolarHBondContact O-N 3.05Å; G658-K672 WeakPolarHBondContact O-CE 3.24Å
659	A	88.9	Confident	87.7	Confident	2 Å²	2	62.1 Å²	62.1	2%	0.017	35%	0.351	C	S	.	.	H	α-helix	trans	-65.1	-37.5	179.6	0	0	0	0	0	112.8	A612 E613 L655 T661 K672	A612-A659 HydrophobicContact CB-CB 4.05Å; E613-A659 HydrophobicContact CG-CB 3.65Å; L655-A659 VanDerWaalsContact O-CB 3.24Å; L655-A659 WeakPolarHBondContact O-CB 3.12Å; L655-A659 PolarHBondContact O-N 3.1Å; A659-T661 VanDerWaalsContact C-N 3.31Å; A659-T661 PolarHBondContact O-N 3.24Å; A659-K672 VanDerWaalsContact O-CE 3.26Å; A659-K672 WeakPolarHBondContact O-CE 3.39Å; A659-K672 PolarHBondContact O-NZ 2.82Å
660	K	86.7	Confident	87.2	Confident	106 Å²	106	62.4 Å²	62.4	46%	0.461	35%	0.351	S	S	.	.	H	α-helix	trans	-77.2	-11.6	177.8	-68.6	173.2	-173.2	179.6	0	113.9	E613 E617 Q656 M657 G658	E613-K660 VanDerWaalsContact CD-CE 3.47Å; E613-K660 HydrophobicContact CG-CG 4.02Å; E613-K660 WeakPolarHBondContact OE1-CG 3.46Å; E613-K660 WeakPolarHBondContact OE2-CE 3.48Å; E617-K660 IonicContact OE1-NZ 3.24Å; E617-K660 PolarHBondContact OE1-NZ 3.11Å; Q656-K660 HydrophobicContact CG-CD 4.14Å; Q656-K660 VanDerWaalsContact NE2-NZ 3.15Å; Q656-K660 WeakPolarHBondContact O-CB 3.26Å; Q656-K660 WeakPolarHBondContact O-CG 3.3Å; Q656-K660 PolarHBondContact O-N 2.85Å; Q656-K660 VanDerWaalsContact O-N 3.12Å; M657-K660 PolarHBondContact O-N 3.02Å; G658-K660 PolarHBondContact O-N 3.4Å
661	T	86.6	Confident	86.8	Confident	73 Å²	73	63.9 Å²	63.9	45%	0.448	35%	0.352	S	S	.	.	S	Bend	trans	-73.4	125.9	-179.9	-64.4	0	0	0	0	112.3	M657 G658 A659 K672	M657-T661 PolarHBondContact O-N 2.98Å; M657-T661 PolarHBondContact O-OG1 3.34Å; G658-T661 WeakPolarHBondContact O-CB 3.24Å; G658-T661 PolarHBondContact O-N 3.05Å; A659-T661 VanDerWaalsContact C-N 3.31Å; A659-T661 PolarHBondContact O-N 3.24Å; T661-K672 PolarHBondContact O-NZ 3.42Å
662	P	81.8	Confident	86.6	Confident	120 Å²	120	63.9 Å²	63.9	78%	0.779	35%	0.35	S	S	*	.			trans	-74.5	139.5	177.7	30.3	-34.6	0	0	0	111.9
663	V	83	Confident	86.3	Confident	50 Å²	50	63.9 Å²	63.9	30%	0.303	35%	0.35	S	S	.	.			trans	-135	151	179.1	-67.5	0	0	0	0	111.3	A668 K672	V663-A668 HydrophobicContact CB-CB 4.07Å; V663-A668 HydrophobicContact CG1-CB 4.29Å; V663-K672 HydrophobicContact CG1-CB 4.28Å; V663-K672 HydrophobicContact CG1-CD 3.95Å; V663-K672 HydrophobicContact CG2-CB 4.34Å; V663-K672 HydrophobicContact CG2-CD 3.7Å
664	Q	76.4	Confident	86.2	Confident	184 Å²	184	61.3 Å²	61.3	86%	0.86	34%	0.34	S	S	*	.			trans	-137.1	146.4	177.3	-61.9	-171.5	8.7	0	0	110.8
665	G	75.2	Confident	86.1	Confident	55 Å²	55	59.7 Å²	59.7	57%	0.567	34%	0.339	S	S	*	.	S	Bend	trans	83.3	163.7	-176.1	0	0	0	0	0	114.2	T669	G665-T669 WeakPolarHBondContact O-CB 3.32Å; G665-T669 PolarHBondContact O-N 2.65Å; G665-T669 PolarHBondContact O-OG1 3.23Å
666	K	73.8	Confident	86.1	Confident	69 Å²	69	59.7 Å²	59.7	30%	0.3	34%	0.339	S	S	.	.	H	α-helix	trans	-55.7	-60.8	-176.3	-178.7	-159.8	-179.7	-141.1	0	111.3	V540 K541 D543 E546 A668 T669 F670	V540-K666 HydrophobicContact CG1-CB 4.15Å; V540-K666 HydrophobicContact CG1-CD 3.83Å; V540-K666 HydrophobicContact CG1-CG 3.68Å; K541-K666 WeakPolarHBondContact O-CE 3.41Å; D543-K666 IonicContact OD2-NZ 3.57Å; E546-K666 VanDerWaalsContact OE1-CE 3.3Å; E546-K666 WeakPolarHBondContact OE1-CE 3.5Å; E546-K666 IonicContact OE1-NZ 2.68Å; E546-K666 PolarHBondContact OE1-NZ 3.37Å; E546-K666 VanDerWaalsContact OE2-CE 3.28Å; E546-K666 WeakPolarHBondContact OE2-CE 3.43Å; E546-K666 IonicContact OE2-NZ 2.62Å; E546-K666 PolarHBondContact OE2-NZ 3.09Å; K666-A668 PolarHBondContact O-N 3Å; K666-T669 WeakPolarHBondContact O-CA 3.13Å; K666-T669 WeakPolarHBondContact O-CB 3.23Å; K666-T669 PolarHBondContact O-N 2.75Å; K666-F670 PolarHBondContact O-N 3.35Å
667	T	78.9	Confident	86.2	Confident	84 Å²	84	57.6 Å²	57.6	52%	0.515	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-46.9	-166.1	-42.9	0	0	0	0	112.1	T669 F670 Q671	T667-T669 VanDerWaalsContact C-N 3.31Å; T667-T669 PolarHBondContact O-N 3.01Å; T667-F670 PolarHBondContact O-N 3.11Å; T667-Q671 WeakPolarHBondContact O-CB 3.36Å; T667-Q671 VanDerWaalsContact O-CG 3.3Å; T667-Q671 WeakPolarHBondContact O-CG 3.39Å; T667-Q671 PolarHBondContact O-N 2.65Å
668	A	82.6	Confident	86.4	Confident	33 Å²	33	54.4 Å²	54.4	27%	0.273	31%	0.313	S	S	.	.	H	α-helix	trans	-65.6	-32.6	176.2	0	0	0	0	0	112.7	V663 K666 K672	V663-A668 HydrophobicContact CB-CB 4.07Å; V663-A668 HydrophobicContact CG1-CB 4.29Å; K666-A668 PolarHBondContact O-N 3Å; A668-K672 WeakPolarHBondContact O-CB 3.26Å; A668-K672 PolarHBondContact O-N 3.18Å; A668-K672 VanDerWaalsContact O-N 3.1Å
669	T	85.2	Confident	86.7	Confident	17 Å²	17	53.4 Å²	53.4	10%	0.104	30%	0.301	C	S	.	.	H	α-helix	trans	-68.3	-43	173.4	-52.8	0	0	0	0	111.3	L524 T605 G665 K666 T667 K672 V673	L524-T669 HydrophobicContact CD1-CG2 4.48Å; T605-T669 HydrophobicContact CG2-CG2 4.19Å; G665-T669 WeakPolarHBondContact O-CB 3.32Å; G665-T669 PolarHBondContact O-N 2.65Å; G665-T669 PolarHBondContact O-OG1 3.23Å; K666-T669 WeakPolarHBondContact O-CA 3.13Å; K666-T669 WeakPolarHBondContact O-CB 3.23Å; K666-T669 PolarHBondContact O-N 2.75Å; T667-T669 VanDerWaalsContact C-N 3.31Å; T667-T669 PolarHBondContact O-N 3.01Å; T669-K672 PolarHBondContact O-N 3.24Å; T669-V673 WeakPolarHBondContact O-CG2 3.44Å; T669-V673 PolarHBondContact O-N 3.12Å
670	F	86.6	Confident	87.1	Confident	20 Å²	20	53.3 Å²	53.3	9%	0.088	30%	0.3	C	S	.	.	H	α-helix	trans	-64.7	-49.2	176.3	176.9	-94.8	0	0	0	112	L524 L542 E546 M550 K666 T667 K672 V673 D674	L524-F670 HydrophobicContact CD1-CB 4.18Å; L524-F670 HydrophobicContact CD1-CD2 4.2Å; L542-F670 HydrophobicContact CD1-CD2 4.14Å; L542-F670 HydrophobicContact CD1-CE2 4.01Å; L542-F670 HydrophobicContact CD2-CD2 3.53Å; L542-F670 HydrophobicContact CD2-CE2 4.11Å; L542-F670 HydrophobicContact CD2-CG 4.29Å; L542-F670 HydrophobicContact CG-CD2 4.49Å; E546-F670 HydrophobicContact CB-CD2 4.24Å; E546-F670 HydrophobicContact CB-CE1 4.12Å; E546-F670 HydrophobicContact CB-CE2 3.67Å; E546-F670 HydrophobicContact CB-CZ 3.62Å; E546-F670 HydrophobicContact CG-CD1 3.96Å; E546-F670 HydrophobicContact CG-CD2 4.26Å; E546-F670 HydrophobicContact CG-CE1 3.75Å; E546-F670 HydrophobicContact CG-CE2 4.04Å; E546-F670 HydrophobicContact CG-CG 4.23Å; E546-F670 HydrophobicContact CG-CZ 3.8Å; M550-F670 HydrophobicContact CG-CE2 3.61Å; M550-F670 HydrophobicContact CG-CZ 4.05Å; K666-F670 PolarHBondContact O-N 3.35Å; T667-F670 PolarHBondContact O-N 3.11Å; F670-K672 PolarHBondContact O-N 2.68Å; F670-V673 WeakPolarHBondContact O-CA 3.32Å; F670-V673 WeakPolarHBondContact O-CB 3.4Å; F670-V673 PolarHBondContact O-N 3.49Å; F670-D674 HydrophobicContact CE1-CB 4.11Å; F670-D674 HydrophobicContact CZ-CB 4.2Å; F670-D674 PolarHBondContact O-N 3.34Å
671	Q	87.8	Confident	87.6	Confident	121 Å²	121	51 Å²	51	57%	0.565	29%	0.288	S	S	*	.	H	α-helix	trans	-56.9	-37.8	177.1	-73.3	169.4	-29.4	0	0	112.3	T667 S675	T667-Q671 WeakPolarHBondContact O-CB 3.36Å; T667-Q671 VanDerWaalsContact O-CG 3.3Å; T667-Q671 WeakPolarHBondContact O-CG 3.39Å; T667-Q671 PolarHBondContact O-N 2.65Å; Q671-S675 WeakPolarHBondContact O-CB 3.19Å; Q671-S675 PolarHBondContact O-N 3.5Å
672	K	90.9	Very high	88.1	Confident	25 Å²	25	49.6 Å²	49.6	11%	0.109	28%	0.278	C	S	.	.	H	α-helix	trans	-68.6	-39	173.9	-172.4	-177.7	165.3	180	0	112.4	F609 G658 A659 T661 V663 A668 T669 F670 S676	F609-K672 HydrophobicContact CD1-CD 4.2Å; F609-K672 HydrophobicContact CD1-CG 4.26Å; F609-K672 HydrophobicContact CD2-CD 4.26Å; F609-K672 HydrophobicContact CE1-CB 4.17Å; F609-K672 HydrophobicContact CE1-CD 3.73Å; F609-K672 HydrophobicContact CE1-CG 3.58Å; F609-K672 HydrophobicContact CE2-CD 3.79Å; F609-K672 HydrophobicContact CE2-CG 4.48Å; F609-K672 HydrophobicContact CG-CD 4.46Å; F609-K672 HydrophobicContact CZ-CB 4.02Å; F609-K672 HydrophobicContact CZ-CD 3.51Å; F609-K672 HydrophobicContact CZ-CG 3.71Å; G658-K672 WeakPolarHBondContact O-CE 3.24Å; A659-K672 VanDerWaalsContact O-CE 3.26Å; A659-K672 WeakPolarHBondContact O-CE 3.39Å; A659-K672 PolarHBondContact O-NZ 2.82Å; T661-K672 PolarHBondContact O-NZ 3.42Å; V663-K672 HydrophobicContact CG1-CB 4.28Å; V663-K672 HydrophobicContact CG1-CD 3.95Å; V663-K672 HydrophobicContact CG2-CB 4.34Å; V663-K672 HydrophobicContact CG2-CD 3.7Å; A668-K672 WeakPolarHBondContact O-CB 3.26Å; A668-K672 PolarHBondContact O-N 3.18Å; A668-K672 VanDerWaalsContact O-N 3.1Å; T669-K672 PolarHBondContact O-N 3.24Å; F670-K672 PolarHBondContact O-N 2.68Å; K672-S676 WeakPolarHBondContact O-CB 3.47Å; K672-S676 PolarHBondContact O-N 3.36Å; K672-S676 PolarHBondContact O-OG 3.28Å
673	V	91.2	Very high	88.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-54.8	174.4	167.8	0	0	0	0	110.8	L524 M550 F595 T605 L608 F609 T669 F670 S675 S676 I677	L524-V673 HydrophobicContact CD1-CG2 4.15Å; L524-V673 HydrophobicContact CD2-CB 4.33Å; L524-V673 HydrophobicContact CD2-CG1 3.87Å; L524-V673 HydrophobicContact CD2-CG2 4.17Å; M550-V673 HydrophobicContact CE-CG1 3.92Å; M550-V673 HydrophobicContact SD-CG1 3.81Å; F595-V673 HydrophobicContact CE1-CG1 3.97Å; T605-V673 HydrophobicContact CG2-CG2 3.99Å; L608-V673 HydrophobicContact CD2-CB 4.21Å; L608-V673 HydrophobicContact CD2-CG1 3.77Å; L608-V673 HydrophobicContact CD2-CG2 3.97Å; F609-V673 HydrophobicContact CE1-CG2 3.83Å; F609-V673 HydrophobicContact CZ-CG2 3.84Å; T669-V673 WeakPolarHBondContact O-CG2 3.44Å; T669-V673 PolarHBondContact O-N 3.12Å; F670-V673 WeakPolarHBondContact O-CA 3.32Å; F670-V673 WeakPolarHBondContact O-CB 3.4Å; F670-V673 PolarHBondContact O-N 3.49Å; V673-S675 PolarHBondContact O-N 3.47Å; V673-S676 WeakPolarHBondContact O-CA 3.46Å; V673-S676 WeakPolarHBondContact O-CB 3.38Å; V673-S676 PolarHBondContact O-N 2.83Å; V673-I677 HydrophobicContact CG1-CG1 4.43Å; V673-I677 WeakPolarHBondContact O-CG1 3.43Å; V673-I677 PolarHBondContact O-N 3.3Å
674	D	90.6	Very high	89.6	Confident	39 Å²	39	41.5 Å²	41.5	21%	0.209	23%	0.227	C	C	.	.	H	α-helix	trans	-55.6	-48.8	-179.7	-177.4	100.7	0	0	0	110.9	S549 F670 S676 I677 Q678	S549-D674 PolarHBondContact OG-OD1 2.93Å; F670-D674 HydrophobicContact CE1-CB 4.11Å; F670-D674 HydrophobicContact CZ-CB 4.2Å; F670-D674 PolarHBondContact O-N 3.34Å; D674-S676 VanDerWaalsContact C-N 3.33Å; D674-S676 PolarHBondContact O-N 2.88Å; D674-I677 PolarHBondContact O-N 3.01Å; D674-Q678 VanDerWaalsContact O-CB 3.26Å; D674-Q678 WeakPolarHBondContact O-CB 3.38Å; D674-Q678 PolarHBondContact O-N 3.47Å
675	S	93.5	Very high	90.5	Very high	56 Å²	56	35.9 Å²	35.9	39%	0.392	21%	0.205	S	C	.	.	H	α-helix	trans	-60.4	-36.1	174.2	-176.9	0	0	0	0	113.9	Q671 V673 T679	Q671-S675 WeakPolarHBondContact O-CB 3.19Å; Q671-S675 PolarHBondContact O-N 3.5Å; V673-S675 PolarHBondContact O-N 3.47Å; S675-T679 VanDerWaalsContact O-CB 3.3Å; S675-T679 WeakPolarHBondContact O-CB 3.06Å; S675-T679 PolarHBondContact O-N 2.93Å; S675-T679 PolarHBondContact O-OG1 2.98Å
676	S	95.1	Very high	91.5	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-68.6	-44.9	176.6	-58.7	0	0	0	0	111.6	K672 V673 D674 T680	K672-S676 WeakPolarHBondContact O-CB 3.47Å; K672-S676 PolarHBondContact O-N 3.36Å; K672-S676 PolarHBondContact O-OG 3.28Å; V673-S676 WeakPolarHBondContact O-CA 3.46Å; V673-S676 WeakPolarHBondContact O-CB 3.38Å; V673-S676 PolarHBondContact O-N 2.83Å; D674-S676 VanDerWaalsContact C-N 3.33Å; D674-S676 PolarHBondContact O-N 2.88Å; S676-T680 WeakPolarHBondContact O-CB 3.39Å; S676-T680 PolarHBondContact O-N 3.1Å; S676-T680 PolarHBondContact O-OG1 2.85Å
677	I	94.9	Very high	92.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.3	-47.8	175	-57.7	-61.3	0	0	0	110	M550 L553 L557 M592 T596 L608 V673 D674 T679 T680 R681	M550-I677 HydrophobicContact CE-CG1 4.03Å; M550-I677 HydrophobicContact SD-CG1 4.16Å; L553-I677 HydrophobicContact CB-CG2 3.79Å; L557-I677 HydrophobicContact CD2-CG2 4.3Å; M592-I677 HydrophobicContact CB-CD1 4.11Å; M592-I677 HydrophobicContact CE-CD1 4.1Å; T596-I677 HydrophobicContact CG2-CD1 4.25Å; L608-I677 HydrophobicContact CD1-CD1 3.92Å; L608-I677 HydrophobicContact CD2-CD1 4.23Å; V673-I677 HydrophobicContact CG1-CG1 4.43Å; V673-I677 WeakPolarHBondContact O-CG1 3.43Å; V673-I677 PolarHBondContact O-N 3.3Å; D674-I677 PolarHBondContact O-N 3.01Å; I677-T679 PolarHBondContact O-N 3.37Å; I677-T680 WeakPolarHBondContact O-CB 3.47Å; I677-T680 PolarHBondContact O-N 3.22Å; I677-R681 WeakPolarHBondContact O-CB 3.22Å; I677-R681 PolarHBondContact O-N 3.27Å
678	Q	95.2	Very high	93.4	Very high	59 Å²	59	28.9 Å²	28.9	28%	0.276	16%	0.155	S	C	.	.	H	α-helix	trans	-62.9	-42.1	-178.1	175.6	62.2	-14.4	0	0	112.8	L553 D674 R681 N682	L553-Q678 HydrophobicContact CD1-CB 4.3Å; L553-Q678 VanDerWaalsContact CD2-OE1 3.3Å; D674-Q678 VanDerWaalsContact O-CB 3.26Å; D674-Q678 WeakPolarHBondContact O-CB 3.38Å; D674-Q678 PolarHBondContact O-N 3.47Å; Q678-R681 PolarHBondContact O-N 2.86Å; Q678-N682 PolarHBondContact O-N 3.4Å; Q678-N682 VanDerWaalsContact O-N 3.1Å; Q678-N682 PolarHBondContact O-ND2 3.21Å; Q678-N682 PolarHBondContact O-OD1 3.29Å
679	T	96.5	Very high	93.9	Very high	5 Å²	5	29.8 Å²	29.8	3%	0.031	16%	0.159	C	C	.	.	H	α-helix	trans	-69	-38.4	176.4	-51.3	0	0	0	0	110.8	L651 Q654 L655 S675 I677 N682 I683	L651-T679 HydrophobicContact CD2-CG2 4.48Å; L651-T679 WeakPolarHBondContact O-CG2 3.37Å; Q654-T679 HydrophobicContact CB-CG2 4.24Å; Q654-T679 HydrophobicContact CG-CG2 4.09Å; L655-T679 HydrophobicContact CB-CG2 3.9Å; S675-T679 VanDerWaalsContact O-CB 3.3Å; S675-T679 WeakPolarHBondContact O-CB 3.06Å; S675-T679 PolarHBondContact O-N 2.93Å; S675-T679 PolarHBondContact O-OG1 2.98Å; I677-T679 PolarHBondContact O-N 3.37Å; T679-N682 PolarHBondContact O-N 2.91Å; T679-I683 WeakPolarHBondContact O-CG1 3.35Å; T679-I683 PolarHBondContact O-N 3.08Å
680	T	97.6	Very high	94.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-42.1	174	-56.2	0	0	0	0	112.2	L557 A589 M592 L615 S676 I677 N682 I683 M684	L557-T680 HydrophobicContact CD1-CG2 4.03Å; L557-T680 HydrophobicContact CD2-CG2 4.38Å; A589-T680 HydrophobicContact CB-CG2 4.44Å; M592-T680 HydrophobicContact CE-CG2 4.23Å; M592-T680 VanDerWaalsContact CE-OG1 3.26Å; M592-T680 WeakPolarHBondContact CE-OG1 2.77Å; M592-T680 HydrophobicContact SD-CG2 3.99Å; L615-T680 HydrophobicContact CD1-CG2 3.4Å; L615-T680 VanDerWaalsContact CD1-CG2 3.4Å; L615-T680 HydrophobicContact CD2-CG2 3.96Å; L615-T680 HydrophobicContact CG-CG2 4.37Å; S676-T680 WeakPolarHBondContact O-CB 3.39Å; S676-T680 PolarHBondContact O-N 3.1Å; S676-T680 PolarHBondContact O-OG1 2.85Å; I677-T680 WeakPolarHBondContact O-CB 3.47Å; I677-T680 PolarHBondContact O-N 3.22Å; T680-N682 VanDerWaalsContact C-N 3.32Å; T680-N682 PolarHBondContact O-N 2.96Å; T680-I683 WeakPolarHBondContact O-CB 3.4Å; T680-I683 PolarHBondContact O-N 3.1Å; T680-M684 WeakPolarHBondContact O-CG 3.35Å; T680-M684 PolarHBondContact O-N 3.25Å
681	R	96.8	Very high	94.6	Very high	57 Å²	57	28.3 Å²	28.3	22%	0.215	15%	0.152	C	C	.	.	H	α-helix	trans	-57.1	-46	173.4	-172.5	-154.4	67.6	145.5	8	111	E556 L557 L560 I677 Q678 I683 M684 T685	E556-R681 HydrophobicContact CB-CG 4.36Å; E556-R681 WeakPolarHBondContact OE2-CD 3.23Å; E556-R681 IonicContact OE2-CZ 3.92Å; E556-R681 IonicContact OE2-NE 3.21Å; E556-R681 IonicContact OE2-NH1 2.64Å; E556-R681 PolarHBondContact OE2-NH1 3.14Å; L557-R681 HydrophobicContact CD1-CB 4.28Å; L560-R681 HydrophobicContact CD1-CG 3.53Å; I677-R681 WeakPolarHBondContact O-CB 3.22Å; I677-R681 PolarHBondContact O-N 3.27Å; Q678-R681 PolarHBondContact O-N 2.86Å; R681-I683 PolarHBondContact O-N 2.98Å; R681-M684 PolarHBondContact O-N 3.37Å; R681-T685 PolarHBondContact O-N 2.98Å; R681-T685 PolarHBondContact O-OG1 3.38Å; R681-T685 VanDerWaalsContact O-OG1 3.06Å
682	N	96.7	Very high	94.7	Very high	44 Å²	44	25 Å²	25	24%	0.235	14%	0.141	C	C	.	.	H	α-helix	trans	-63.8	-39.2	177.8	-62.6	-15.6	0	0	0	112.4	L651 Q678 T679 T680 T685 V686	L651-N682 HydrophobicContact CD1-CB 4.02Å; L651-N682 HydrophobicContact CD2-CB 3.91Å; Q678-N682 PolarHBondContact O-N 3.4Å; Q678-N682 VanDerWaalsContact O-N 3.1Å; Q678-N682 PolarHBondContact O-ND2 3.21Å; Q678-N682 PolarHBondContact O-OD1 3.29Å; T679-N682 PolarHBondContact O-N 2.91Å; T680-N682 VanDerWaalsContact C-N 3.32Å; T680-N682 PolarHBondContact O-N 2.96Å; N682-T685 PolarHBondContact O-N 3.37Å; N682-V686 PolarHBondContact O-N 3.4Å
683	I	97.6	Very high	94.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-56.4	-52	171.8	-71.4	170.2	0	0	0	109.8	L615 L648 L651 L655 T679 T680 R681 T685 V686 V687	L615-I683 HydrophobicContact CD2-CD1 4.06Å; L615-I683 HydrophobicContact CD2-CG2 4.18Å; L648-I683 HydrophobicContact CD1-CB 4.37Å; L648-I683 HydrophobicContact CD1-CG2 3.82Å; L651-I683 HydrophobicContact CB-CD1 4.48Å; L651-I683 HydrophobicContact CB-CG1 3.66Å; L655-I683 HydrophobicContact CB-CD1 4.11Å; L655-I683 HydrophobicContact CD2-CD1 3.67Å; T679-I683 WeakPolarHBondContact O-CG1 3.35Å; T679-I683 PolarHBondContact O-N 3.08Å; T680-I683 WeakPolarHBondContact O-CB 3.4Å; T680-I683 PolarHBondContact O-N 3.1Å; R681-I683 PolarHBondContact O-N 2.98Å; I683-T685 VanDerWaalsContact C-N 3.33Å; I683-T685 PolarHBondContact O-N 3.01Å; I683-V686 PolarHBondContact O-N 2.77Å; I683-V686 VanDerWaalsContact O-N 3.1Å; I683-V687 HydrophobicContact CG2-CG2 4.44Å; I683-V687 WeakPolarHBondContact O-CG2 3.45Å; I683-V687 PolarHBondContact O-N 2.87Å
684	M	97.7	Very high	94.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.6	-37	-179.5	-67.2	-60.4	-68.6	0	0	112.8	L557 L560 V564 L585 A586 A589 T680 R681 V686 V687 L688	L557-M684 HydrophobicContact CD1-CG 4Å; L560-M684 HydrophobicContact CB-CB 3.94Å; L560-M684 HydrophobicContact CD1-CB 4.21Å; V564-M684 HydrophobicContact CB-CE 3.96Å; V564-M684 HydrophobicContact CG1-CE 4.23Å; V564-M684 HydrophobicContact CG2-CE 3.77Å; L585-M684 HydrophobicContact CB-SD 4.07Å; A586-M684 HydrophobicContact CB-CE 4.03Å; A589-M684 HydrophobicContact CB-CE 4.09Å; A589-M684 HydrophobicContact CB-CG 3.84Å; A589-M684 HydrophobicContact CB-SD 3.88Å; T680-M684 WeakPolarHBondContact O-CG 3.35Å; T680-M684 PolarHBondContact O-N 3.25Å; R681-M684 PolarHBondContact O-N 3.37Å; M684-V686 VanDerWaalsContact C-N 3.34Å; M684-V686 PolarHBondContact O-N 2.9Å; M684-V687 PolarHBondContact O-N 3.33Å; M684-L688 WeakPolarHBondContact O-CB 3.46Å; M684-L688 PolarHBondContact O-N 3.45Å
685	T	96.7	Very high	94.6	Very high	67 Å²	67	25.4 Å²	25.4	41%	0.411	14%	0.144	S	C	.	.	H	α-helix	trans	-60.5	-39.8	173.4	-53.8	0	0	0	0	112.7	R681 N682 I683 S689	R681-T685 PolarHBondContact O-N 2.98Å; R681-T685 PolarHBondContact O-OG1 3.38Å; R681-T685 VanDerWaalsContact O-OG1 3.06Å; N682-T685 PolarHBondContact O-N 3.37Å; I683-T685 VanDerWaalsContact C-N 3.33Å; I683-T685 PolarHBondContact O-N 3.01Å; T685-S689 PolarHBondContact O-N 3.36Å
686	V	96.3	Very high	94.3	Very high	18 Å²	18	30.6 Å²	30.6	11%	0.109	16%	0.159	C	C	.	.	H	α-helix	trans	-76.1	-35.1	178.9	178.4	0	0	0	0	111.7	E644 L648 L651 N682 I683 M684 L688 S689 L690	E644-V686 HydrophobicContact CB-CG1 4.48Å; E644-V686 WeakPolarHBondContact O-CG1 3.5Å; L648-V686 HydrophobicContact CB-CG1 3.89Å; L648-V686 HydrophobicContact CD1-CB 4.29Å; L648-V686 HydrophobicContact CD1-CG1 4.32Å; L651-V686 HydrophobicContact CD1-CG2 3.89Å; N682-V686 PolarHBondContact O-N 3.4Å; I683-V686 PolarHBondContact O-N 2.77Å; I683-V686 VanDerWaalsContact O-N 3.1Å; M684-V686 VanDerWaalsContact C-N 3.34Å; M684-V686 PolarHBondContact O-N 2.9Å; V686-L688 VanDerWaalsContact C-N 3.33Å; V686-S689 PolarHBondContact O-N 3.02Å; V686-S689 PolarHBondContact O-OG 3.23Å; V686-L690 HydrophobicContact CG1-CD1 3.94Å; V686-L690 WeakPolarHBondContact O-CB 3.4Å; V686-L690 WeakPolarHBondContact O-CD1 3.45Å; V686-L690 WeakPolarHBondContact O-CG 3.43Å; V686-L690 PolarHBondContact O-N 3.49Å
687	V	96.1	Very high	93.9	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-61.7	-43	171.4	173.4	0	0	0	0	110.9	V564 L585 L622 L648 I683 M684 S689 L690 L691	V564-V687 HydrophobicContact CG1-CG1 4.36Å; V564-V687 HydrophobicContact CG2-CG1 4.21Å; L585-V687 HydrophobicContact CD1-CG2 3.94Å; L622-V687 HydrophobicContact CD2-CG1 4.15Å; L622-V687 HydrophobicContact CD2-CG2 3.79Å; L648-V687 HydrophobicContact CD1-CG2 3.93Å; L648-V687 HydrophobicContact CD2-CG2 4.07Å; I683-V687 HydrophobicContact CG2-CG2 4.44Å; I683-V687 WeakPolarHBondContact O-CG2 3.45Å; I683-V687 PolarHBondContact O-N 2.87Å; M684-V687 PolarHBondContact O-N 3.33Å; V687-S689 VanDerWaalsContact C-N 3.35Å; V687-S689 PolarHBondContact O-N 3.38Å; V687-L690 PolarHBondContact O-N 3.22Å; V687-L691 HydrophobicContact CG1-CD1 3.85Å; V687-L691 HydrophobicContact CG1-CG 4.3Å; V687-L691 WeakPolarHBondContact O-CG 3.17Å; V687-L691 PolarHBondContact O-N 2.94Å
688	L	95	Very high	93.5	Very high	42 Å²	42	31.7 Å²	31.7	22%	0.22	17%	0.165	C	C	.	.	H	α-helix	trans	-66.9	-30.7	178.7	-174.3	59.7	0	0	0	113.3	L560 D563 V564 E567 M684 V686 P692	L560-L688 HydrophobicContact CD2-CD2 3.75Å; D563-L688 HydrophobicContact CB-CD1 3.85Å; D563-L688 HydrophobicContact CB-CD2 3.61Å; D563-L688 HydrophobicContact CB-CG 4.4Å; V564-L688 HydrophobicContact CG2-CB 3.89Å; V564-L688 HydrophobicContact CG2-CD1 4Å; V564-L688 HydrophobicContact CG2-CG 4.47Å; E567-L688 HydrophobicContact CB-CD1 4.5Å; M684-L688 WeakPolarHBondContact O-CB 3.46Å; M684-L688 PolarHBondContact O-N 3.45Å; V686-L688 VanDerWaalsContact C-N 3.33Å; L688-P692 WeakPolarHBondContact O-CD 3.46Å
689	S	93.4	Very high	93	Very high	51 Å²	51	32.4 Å²	32.4	36%	0.357	17%	0.167	S	C	.	.	H	α-helix	trans	-77.2	-32.5	173.3	68.3	0	0	0	0	112.9	T685 V686 V687 I693	T685-S689 PolarHBondContact O-N 3.36Å; V686-S689 PolarHBondContact O-N 3.02Å; V686-S689 PolarHBondContact O-OG 3.23Å; V687-S689 VanDerWaalsContact C-N 3.35Å; V687-S689 PolarHBondContact O-N 3.38Å; S689-I693 WeakPolarHBondContact O-CD1 3.41Å; S689-I693 WeakPolarHBondContact O-CG1 3.46Å
690	L	93.2	Very high	92.3	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-71.3	-44.4	177.6	-83.7	161.9	0	0	0	113.1	L626 V641 E644 L648 V686 V687 I693 S694	L626-L690 HydrophobicContact CD1-CD1 3.8Å; L626-L690 HydrophobicContact CD2-CD2 4.32Å; V641-L690 HydrophobicContact CG1-CD2 4.42Å; E644-L690 HydrophobicContact CB-CD1 4.24Å; E644-L690 HydrophobicContact CB-CD2 3.74Å; E644-L690 HydrophobicContact CB-CG 3.87Å; L648-L690 HydrophobicContact CD2-CD1 3.97Å; V686-L690 HydrophobicContact CG1-CD1 3.94Å; V686-L690 WeakPolarHBondContact O-CB 3.4Å; V686-L690 WeakPolarHBondContact O-CD1 3.45Å; V686-L690 WeakPolarHBondContact O-CG 3.43Å; V686-L690 PolarHBondContact O-N 3.49Å; V687-L690 PolarHBondContact O-N 3.22Å; L690-I693 WeakPolarHBondContact O-CB 3.39Å; L690-I693 PolarHBondContact O-N 2.88Å; L690-I693 VanDerWaalsContact O-N 3.13Å; L690-S694 PolarHBondContact O-N 3.09Å; L690-S694 PolarHBondContact O-OG 3.42Å
691	L	93.4	Very high	91.4	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-55.1	-48.7	-171	-85.8	166.8	0	0	0	115	V564 E567 V568 W571 I578 V687 I693 S694 N695	V564-L691 HydrophobicContact CB-CD1 4.45Å; V564-L691 HydrophobicContact CG1-CD1 3.82Å; V564-L691 HydrophobicContact CG2-CD1 4.32Å; E567-L691 HydrophobicContact CB-CB 4.49Å; E567-L691 HydrophobicContact CG-CB 3.68Å; V568-L691 HydrophobicContact CG2-CD1 4Å; V568-L691 HydrophobicContact CG2-CD2 4.17Å; W571-L691 HydrophobicContact CZ2-CD2 4.12Å; I578-L691 HydrophobicContact CG2-CD2 4Å; V687-L691 HydrophobicContact CG1-CD1 3.85Å; V687-L691 HydrophobicContact CG1-CG 4.3Å; V687-L691 WeakPolarHBondContact O-CG 3.17Å; V687-L691 PolarHBondContact O-N 2.94Å; L691-I693 VanDerWaalsContact C-N 3.3Å; L691-I693 PolarHBondContact O-N 3.38Å; L691-S694 PolarHBondContact O-N 3.08Å; L691-N695 VanDerWaalsContact O-CB 3.28Å; L691-N695 WeakPolarHBondContact O-CB 3.2Å; L691-N695 PolarHBondContact O-N 3.4Å
692	P	90.5	Very high	90.3	Very high	53 Å²	53	38.2 Å²	38.2	34%	0.344	19%	0.192	S	C	.	.	H	α-helix	trans	-64.9	-34.8	178.8	-18.6	29.9	0	0	0	112.6	E567 L688 K696	E567-P692 HydrophobicContact CG-CG 3.92Å; L688-P692 WeakPolarHBondContact O-CD 3.46Å; P692-K696 WeakPolarHBondContact O-CB 3.28Å; P692-K696 PolarHBondContact O-N 3.31Å
693	I	89.4	Confident	89.2	Confident	60 Å²	60	40 Å²	40	31%	0.308	21%	0.208	S	C	.	.	H	α-helix	trans	-66.6	-51.3	177.9	-60.3	175.3	0	0	0	109.1	V640 V641 S689 L690 L691 N695 K696 L697	V640-I693 HydrophobicContact CG1-CD1 4.43Å; V641-I693 HydrophobicContact CG2-CG2 4.09Å; S689-I693 WeakPolarHBondContact O-CD1 3.41Å; S689-I693 WeakPolarHBondContact O-CG1 3.46Å; L690-I693 WeakPolarHBondContact O-CB 3.39Å; L690-I693 PolarHBondContact O-N 2.88Å; L690-I693 VanDerWaalsContact O-N 3.13Å; L691-I693 VanDerWaalsContact C-N 3.3Å; L691-I693 PolarHBondContact O-N 3.38Å; I693-N695 VanDerWaalsContact C-N 3.33Å; I693-N695 PolarHBondContact O-N 3.28Å; I693-K696 PolarHBondContact O-N 2.94Å; I693-L697 HydrophobicContact CG2-CD1 3.71Å; I693-L697 HydrophobicContact CG2-CG 4.48Å; I693-L697 WeakPolarHBondContact O-CB 3.35Å; I693-L697 VanDerWaalsContact O-CG 3.24Å; I693-L697 WeakPolarHBondContact O-CG 3.36Å; I693-L697 PolarHBondContact O-N 3.4Å
694	S	90.3	Very high	87.7	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.4	-39.7	175.8	-62.8	0	0	0	0	112.5	F629 L690 L691 L697 N698	F629-S694 WeakPolarHBondContact CZ-O 3.13Å; L690-S694 PolarHBondContact O-N 3.09Å; L690-S694 PolarHBondContact O-OG 3.42Å; L691-S694 PolarHBondContact O-N 3.08Å; S694-L697 PolarHBondContact O-N 3.48Å; S694-N698 WeakPolarHBondContact O-CB 3.42Å; S694-N698 PolarHBondContact O-N 2.86Å
695	N	90.1	Very high	86	Confident	12 Å²	12	51.2 Å²	51.2	6%	0.064	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-51	177.8	-163.9	0.8	0	0	0	111.2	E567 K570 W571 L691 I693 L697 N698 K699	E567-N695 PolarHBondContact OE1-ND2 3.4Å; K570-N695 PolarHBondContact O-ND2 3.44Å; W571-N695 HydrophobicContact CD2-CB 4.27Å; W571-N695 HydrophobicContact CZ2-CB 3.76Å; L691-N695 VanDerWaalsContact O-CB 3.28Å; L691-N695 WeakPolarHBondContact O-CB 3.2Å; L691-N695 PolarHBondContact O-N 3.4Å; I693-N695 VanDerWaalsContact C-N 3.33Å; I693-N695 PolarHBondContact O-N 3.28Å; N695-L697 PolarHBondContact O-N 2.68Å; N695-N698 PolarHBondContact O-N 3.16Å; N695-K699 WeakPolarHBondContact O-CG 3.4Å; N695-K699 PolarHBondContact O-N 2.96Å; N695-K699 WeakPolarHBondContact OD1-CE 3.36Å
696	K	88.2	Confident	84.1	Confident	165 Å²	165	52.4 Å²	52.4	72%	0.717	26%	0.261	S	S	*	.	H	α-helix	trans	-59.7	-45.3	177.9	-176.7	-179.2	177.6	-175	0	112.1	P692 I693 K699 K700	P692-K696 WeakPolarHBondContact O-CB 3.28Å; P692-K696 PolarHBondContact O-N 3.31Å; I693-K696 PolarHBondContact O-N 2.94Å; K696-K699 PolarHBondContact O-N 3.05Å; K696-K700 PolarHBondContact O-N 3.48Å
697	L	86.6	Confident	82	Confident	14 Å²	14	54.8 Å²	54.8	7%	0.073	28%	0.279	C	S	.	.	H	α-helix	trans	-68.7	-36.2	179.5	-68	171.2	0	0	0	112.1	F629 L633 E637 V641 I693 S694 N695 K700 Y701	F629-L697 HydrophobicContact CE1-CB 4.18Å; F629-L697 HydrophobicContact CZ-CB 3.87Å; L633-L697 HydrophobicContact CD1-CD1 3.87Å; L633-L697 HydrophobicContact CD2-CB 4.07Å; E637-L697 HydrophobicContact CB-CD1 4.3Å; E637-L697 HydrophobicContact CB-CD2 3.91Å; E637-L697 HydrophobicContact CG-CD2 3.87Å; E637-L697 WeakPolarHBondContact OE1-CD2 3.43Å; V641-L697 HydrophobicContact CG2-CD1 3.89Å; I693-L697 HydrophobicContact CG2-CD1 3.71Å; I693-L697 HydrophobicContact CG2-CG 4.48Å; I693-L697 WeakPolarHBondContact O-CB 3.35Å; I693-L697 VanDerWaalsContact O-CG 3.24Å; I693-L697 WeakPolarHBondContact O-CG 3.36Å; I693-L697 PolarHBondContact O-N 3.4Å; S694-L697 PolarHBondContact O-N 3.48Å; N695-L697 PolarHBondContact O-N 2.68Å; L697-K700 PolarHBondContact O-N 2.62Å; L697-Y701 WeakPolarHBondContact O-CB 3.3Å; L697-Y701 PolarHBondContact O-N 3.36Å
698	N	85.5	Confident	79.7	Confident	11 Å²	11	60 Å²	60	6%	0.059	31%	0.306	C	S	.	.	H	α-helix	trans	-63.4	-44.3	174.7	-170.4	14	0	0	0	111.3	W571 F629 S694 N695 Y701 K702	W571-N698 HydrophobicContact CZ3-CB 4.34Å; W571-N698 VanDerWaalsContact CZ3-ND2 3.29Å; W571-N698 WeakPolarHBondContact CZ3-ND2 3.32Å; F629-N698 HydrophobicContact CE2-CB 3.94Å; F629-N698 HydrophobicContact CZ-CB 4.11Å; S694-N698 WeakPolarHBondContact O-CB 3.42Å; S694-N698 PolarHBondContact O-N 2.86Å; N695-N698 PolarHBondContact O-N 3.16Å; N698-Y701 PolarHBondContact O-N 2.63Å; N698-K702 WeakPolarHBondContact O-CB 3.47Å; N698-K702 WeakPolarHBondContact O-CG 3.43Å; N698-K702 PolarHBondContact O-N 2.84Å; N698-K702 WeakPolarHBondContact OD1-CE 3.48Å
699	K	84.9	Confident	77.1	Confident	74 Å²	74	62.2 Å²	62.2	32%	0.322	33%	0.325	S	S	.	.	H	α-helix	trans	-65.4	-38.6	176.5	-65.9	-172.9	-168.8	-160.7	0	112.5	K570 E572 N695 K696 S703	K570-K699 PolarHBondContact O-NZ 3.17Å; E572-K699 WeakPolarHBondContact OE1-CE 3.5Å; E572-K699 IonicContact OE1-NZ 2.79Å; E572-K699 PolarHBondContact OE1-NZ 3.44Å; N695-K699 WeakPolarHBondContact O-CG 3.4Å; N695-K699 PolarHBondContact O-N 2.96Å; N695-K699 WeakPolarHBondContact OD1-CE 3.36Å; K696-K699 PolarHBondContact O-N 3.05Å; K699-S703 WeakPolarHBondContact O-CB 3.49Å; K699-S703 PolarHBondContact O-N 3.45Å; K699-S703 VanDerWaalsContact O-N 3.12Å; K699-S703 PolarHBondContact O-OG 2.7Å
700	K	83.1	Confident	74.6	Confident	72 Å²	72	64.5 Å²	64.5	31%	0.313	34%	0.341	S	S	.	.	H	α-helix	trans	-59.8	-56.6	171.3	179.1	-170.3	171.2	-168	0	111.2	E637 K696 L697 K702 S703 E704	E637-K700 IonicContact OE1-NZ 2.71Å; E637-K700 PolarHBondContact OE1-NZ 2.68Å; E637-K700 IonicContact OE2-NZ 2.75Å; E637-K700 PolarHBondContact OE2-NZ 2.88Å; K696-K700 PolarHBondContact O-N 3.48Å; L697-K700 PolarHBondContact O-N 2.62Å; K700-K702 VanDerWaalsContact C-N 3.33Å; K700-K702 PolarHBondContact O-N 3.24Å; K700-S703 WeakPolarHBondContact O-CB 3.37Å; K700-S703 PolarHBondContact O-N 2.87Å; K700-E704 WeakPolarHBondContact CE-OE1 3.4Å; K700-E704 WeakPolarHBondContact CG-OE1 3.45Å; K700-E704 PolarHBondContact O-N 2.77Å
701	Y	76.9	Confident	71.9	Confident	57 Å²	57	71.3 Å²	71.3	22%	0.224	38%	0.377	C	S	.	.	H	α-helix	trans	-58.2	-41.4	-178.5	178.8	-105.9	0	0	0	112.5	Q632 L697 N698 E704 R705	Q632-Y701 HydrophobicContact CB-CE2 4.31Å; L697-Y701 WeakPolarHBondContact O-CB 3.3Å; L697-Y701 PolarHBondContact O-N 3.36Å; N698-Y701 PolarHBondContact O-N 2.63Å; Y701-E704 PolarHBondContact O-N 2.78Å; Y701-R705 VanDerWaalsContact O-CB 3.24Å; Y701-R705 WeakPolarHBondContact O-CB 3.19Å; Y701-R705 PolarHBondContact O-N 3.07Å; Y701-R705 PolarHBondContact OH-NH1 3.09Å
702	K	75.6	Confident	69	Low	56 Å²	56	79 Å²	79	24%	0.243	41%	0.413	C	S	.	.	H	α-helix	trans	-61.9	-43.6	173.9	-75.9	178.5	179.2	-178.3	0	112.4	E573 N698 K700 R705 T706	E573-K702 IonicContact OE1-NZ 2.72Å; E573-K702 PolarHBondContact OE1-NZ 3.27Å; E573-K702 IonicContact OE2-NZ 3.68Å; E573-K702 PolarHBondContact OE2-NZ 3.1Å; N698-K702 WeakPolarHBondContact O-CB 3.47Å; N698-K702 WeakPolarHBondContact O-CG 3.43Å; N698-K702 PolarHBondContact O-N 2.84Å; N698-K702 WeakPolarHBondContact OD1-CE 3.48Å; K700-K702 VanDerWaalsContact C-N 3.33Å; K700-K702 PolarHBondContact O-N 3.24Å; K702-R705 PolarHBondContact O-N 3.46Å; K702-T706 WeakPolarHBondContact O-CB 3.47Å; K702-T706 PolarHBondContact O-N 3.25Å; K702-T706 PolarHBondContact O-OG1 2.96Å
703	S	71.9	Confident	66.3	Low	80 Å²	80	83.9 Å²	83.9	56%	0.559	44%	0.436	S	S	*	.	H	α-helix	trans	-61.4	-45.4	178.3	-56.1	0	0	0	0	111.7	K699 K700 T706 S707	K699-S703 WeakPolarHBondContact O-CB 3.49Å; K699-S703 PolarHBondContact O-N 3.45Å; K699-S703 VanDerWaalsContact O-N 3.12Å; K699-S703 PolarHBondContact O-OG 2.7Å; K700-S703 WeakPolarHBondContact O-CB 3.37Å; K700-S703 PolarHBondContact O-N 2.87Å; S703-T706 PolarHBondContact O-N 3.35Å; S703-S707 PolarHBondContact O-N 3.46Å; S703-S707 VanDerWaalsContact O-N 3.07Å
704	E	66.6	Low	63.5	Low	86 Å²	86	93.1 Å²	93.1	40%	0.402	47%	0.467	S	S	.	.	H	α-helix	trans	-64.8	-42.3	176.1	-69.1	168.8	177.6	0	0	111.9	K700 Y701 T706 S707 L708	K700-E704 WeakPolarHBondContact CE-OE1 3.4Å; K700-E704 WeakPolarHBondContact CG-OE1 3.45Å; K700-E704 PolarHBondContact O-N 2.77Å; Y701-E704 PolarHBondContact O-N 2.78Å; E704-T706 PolarHBondContact O-N 3.27Å; E704-S707 PolarHBondContact O-N 3.3Å; E704-S707 PolarHBondContact O-OG 2.96Å; E704-L708 PolarHBondContact O-N 3.19Å
705	R	62.5	Low	60.5	Low	150 Å²	150	96.5 Å²	96.5	57%	0.566	50%	0.502	S	S	*	.	H	α-helix	trans	-68.3	-33.8	177.7	-161.4	174.1	-169.1	172.2	5.3	112.3	Y701 K702 S709	Y701-R705 VanDerWaalsContact O-CB 3.24Å; Y701-R705 WeakPolarHBondContact O-CB 3.19Å; Y701-R705 PolarHBondContact O-N 3.07Å; Y701-R705 PolarHBondContact OH-NH1 3.09Å; K702-R705 PolarHBondContact O-N 3.46Å; R705-S709 WeakPolarHBondContact O-CB 3.3Å; R705-S709 PolarHBondContact O-N 2.93Å; R705-S709 PolarHBondContact O-OG 3.31Å
706	T	56.8	Low	57.5	Low	93 Å²	93	105.6 Å²	105.6	57%	0.571	54%	0.544	S	S	*	.	H	α-helix	trans	-65.5	-45.3	172	-58.2	0	0	0	0	111.1	K702 S703 E704 L708 S709 S710	K702-T706 WeakPolarHBondContact O-CB 3.47Å; K702-T706 PolarHBondContact O-N 3.25Å; K702-T706 PolarHBondContact O-OG1 2.96Å; S703-T706 PolarHBondContact O-N 3.35Å; E704-T706 PolarHBondContact O-N 3.27Å; T706-L708 PolarHBondContact O-N 3.18Å; T706-S709 PolarHBondContact O-N 3.42Å; T706-S709 PolarHBondContact O-OG 2.97Å; T706-S710 PolarHBondContact O-N 3.14Å; T706-S710 PolarHBondContact O-OG 3.46Å
707	S	50.9	Low	54.6	Low	68 Å²	68	109 Å²	109	48%	0.476	55%	0.552	S	S	.	*	H	α-helix	trans	-67.4	-32.9	179.1	67.8	0	0	0	0	113.6	S703 E704 S710	S703-S707 PolarHBondContact O-N 3.46Å; S703-S707 VanDerWaalsContact O-N 3.07Å; E704-S707 PolarHBondContact O-N 3.3Å; E704-S707 PolarHBondContact O-OG 2.96Å; S707-S710 PolarHBondContact O-OG 2.87Å
708	L	49.3	Very low	52.4	Low	109 Å²	109	113.6 Å²	113.6	57%	0.571	58%	0.583	S	S	*	*	H	α-helix	trans	-69.2	-38.4	170.2	-80	160.8	0	0	0	112.6	E704 T706 S710 L711	E704-L708 PolarHBondContact O-N 3.19Å; T706-L708 PolarHBondContact O-N 3.18Å; L708-S710 PolarHBondContact O-N 3.16Å; L708-L711 PolarHBondContact O-N 3.25Å
709	S	38.9	Very low	49.5	Very low	89 Å²	89	120 Å²	120	62%	0.622	62%	0.617	S	S	*	*	H	α-helix	trans	-63.8	-22.5	179.2	72.3	0	0	0	0	113.9	R705 T706 L711	R705-S709 WeakPolarHBondContact O-CB 3.3Å; R705-S709 PolarHBondContact O-N 2.93Å; R705-S709 PolarHBondContact O-OG 3.31Å; T706-S709 PolarHBondContact O-N 3.42Å; T706-S709 PolarHBondContact O-OG 2.97Å; S709-L711 VanDerWaalsContact C-N 3.29Å; S709-L711 PolarHBondContact O-N 3.1Å
710	S	41.5	Very low	46.7	Very low	99 Å²	99	120.6 Å²	120.6	69%	0.692	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	1.2	172.5	39.3	0	0	0	0	115.2	T706 S707 L708	T706-S710 PolarHBondContact O-N 3.14Å; T706-S710 PolarHBondContact O-OG 3.46Å; S707-S710 PolarHBondContact O-OG 2.87Å; L708-S710 PolarHBondContact O-N 3.16Å
711	L	35.9	Very low	43.9	Very low	148 Å²	148	122.6 Å²	122.6	78%	0.775	66%	0.659	S	S	*	*	S	Bend	trans	-125.3	-2.3	-171.3	-98.8	165.2	0	0	0	115.7	L708 S709	L708-L711 PolarHBondContact O-N 3.25Å; S709-L711 VanDerWaalsContact C-N 3.29Å; S709-L711 PolarHBondContact O-N 3.1Å
712	Q	33.7	Very low	41.5	Very low	164 Å²	164	126 Å²	126	77%	0.766	69%	0.686	S	S	*	*			trans	-138.3	54.2	-170.4	-155.9	168.9	13	0	0	114.4
713	D	32.8	Very low	39.8	Very low	154 Å²	154	128.5 Å²	128.5	82%	0.824	71%	0.708	S	S	*	*			trans	-104	59.7	171.7	-169.2	24.1	0	0	0	112.1
714	W	31	Very low	37.6	Very low	255 Å²	255	130.6 Å²	130.6	97%	0.966	72%	0.717	S	S	*	*			trans	-156.1	118.5	167.5	-82.8	97.1	0	0	0	109.8
715	G	28	Very low	35.7	Very low	71 Å²	71	133.8 Å²	133.8	73%	0.732	73%	0.73	S	S	*	*			trans	130.2	82.7	161.6	0	0	0	0	0	118.9
716	E	26.2	Very low	33.9	Very low	202 Å²	202	133.3 Å²	133.3	94%	0.944	73%	0.734	S	S	*	*			trans	65.5	163.5	141.9	-54.3	-167	131.5	0	0	122.5
717	R	27	Very low	32.4	Very low	236 Å²	236	137.4 Å²	137.4	89%	0.891	75%	0.746	S	S	*	*			trans	-122.3	-178.6	178.3	-70.9	-178.8	168.8	-173.8	-2.3	108
718	P	41.2	Very low	31.2	Very low	111 Å²	111	138.7 Å²	138.7	72%	0.721	76%	0.761	S	S	*	*			cis	-134.4	-152.5	2.5	49.9	-32.2	0	0	0	111.2
719	D	24.7	Very low	30	Very low	146 Å²	146	137.8 Å²	137.8	78%	0.781	77%	0.769	S	S	*	*			cis	-157.1	177.7	-18.2	-139.8	-56.3	0	0	0	109
720	A	25.9	Very low	29.4	Very low	86 Å²	86	141.5 Å²	141.5	71%	0.711	78%	0.781	S	S	*	*			trans	62.7	146.6	153.7	0	0	0	0	0	119.8
721	S	24.5	Very low	28.5	Very low	115 Å²	115	142.5 Å²	142.5	80%	0.804	79%	0.788	S	S	*	*			cis	-157.7	156.4	-10.3	49.5	0	0	0	0	111.8
722	T	26	Very low	27.8	Very low	129 Å²	129	138.4 Å²	138.4	79%	0.791	78%	0.782	S	S	*	*			trans	-71.5	179.1	166.2	45.9	0	0	0	0	111.2
723	P	39.3	Very low	27.5	Very low	108 Å²	108	140.7 Å²	140.7	70%	0.701	79%	0.789	S	S	*	*			cis	-159.4	-168.1	31.1	44.5	-20.2	0	0	0	120.4
724	V	26.2	Very low	27	Very low	124 Å²	124	140.7 Å²	140.7	75%	0.752	79%	0.789	S	S	*	*			trans	70.2	142.6	144.1	153.6	0	0	0	0	117.9
725	K	26.9	Very low	26.6	Very low	153 Å²	153	135.2 Å²	135.2	67%	0.665	78%	0.784	S	S	*	*			cis	-171.9	167.5	-10.6	-110.4	-173.2	178.3	-128.9	0	108.2
726	E	24.9	Very low	26.5	Very low	140 Å²	140	139.1 Å²	139.1	65%	0.654	79%	0.788	S	S	*	*			cis	-153.9	-120.1	-11.8	-163.9	142.1	-109.8	0	0	111.1
727	E	25.2	Very low	26.4	Very low	179 Å²	179	133.1 Å²	133.1	84%	0.836	78%	0.78	S	S	*	*			trans	-136.8	159.6	-168.6	-55.4	173.9	127.1	0	0	113.2
728	A	25.3	Very low	26.3	Very low	94 Å²	94	131.2 Å²	131.2	78%	0.777	78%	0.779	S	S	*	*			trans	168.2	122.2	138.1	0	0	0	0	0	109.7
729	A	24.1	Very low	25.5	Very low	90 Å²	90	129.6 Å²	129.6	74%	0.744	78%	0.782	S	S	*	*				69	136.8	65.9	0	0	0	0	0	113.8
730	L	26.1	Very low	25.7	Very low	168 Å²	168	127.4 Å²	127.4	88%	0.88	77%	0.774	S	S	*	*			cis	-167.5	170.6	-1.7	-118.8	172.3	0	0	0	110.2
731	S	22.7	Very low	25.7	Very low	119 Å²	119	130.8 Å²	130.8	83%	0.832	77%	0.773	S	S	*	*			trans	72.6	147.9	165.1	-164.6	0	0	0	0	118.5
732	G	22.8	Very low	25.9	Very low	63 Å²	63	130.2 Å²	130.2	65%	0.649	77%	0.769	S	S	*	*			cis	161.4	147.4	-13.9	0	0	0	0	0	116.8
733	K	25.9	Very low	26	Very low	212 Å²	212	127.3 Å²	127.3	92%	0.922	75%	0.748	S	S	*	*			trans	71.7	126.8	165.9	-69.8	-175.4	176.4	178.6	0	121
734	N	23.1	Very low	25.5	Very low	154 Å²	154	128 Å²	128	82%	0.824	74%	0.742	S	S	*	*			trans	-89.3	158.3	158.4	-70.6	-25.6	0	0	0	111.8
735	T	23.7	Very low	25.7	Very low	140 Å²	140	130.3 Å²	130.3	86%	0.859	74%	0.744	S	S	*	*			trans	-137.1	136.5	148.5	47.8	0	0	0	0	109.2
736	N	25.8	Very low	25.9	Very low	153 Å²	153	131 Å²	131	82%	0.818	75%	0.749	S	S	*	*			trans	-142.7	142.1	178.5	-105.8	-25.2	0	0	0	109.3
737	G	23	Very low	26.2	Very low	75 Å²	75	128.2 Å²	128.2	77%	0.773	74%	0.739	S	S	*	*			trans	-140.5	131.5	173.3	0	0	0	0	0	110.1
738	F	25.3	Very low	26.4	Very low	197 Å²	197	123.6 Å²	123.6	86%	0.864	73%	0.731	S	S	*	*			trans	-99.2	139.6	177.4	-88.2	-98.4	0	0	0	110.6
739	G	24.2	Very low	26.7	Very low	76 Å²	76	122.2 Å²	122.2	78%	0.784	73%	0.726	S	S	*	*			trans	-111.9	130.4	-179.5	0	0	0	0	0	112.3
740	V	28.5	Very low	27	Very low	101 Å²	101	122.2 Å²	122.2	61%	0.612	71%	0.713	S	S	*	*			trans	-76.6	124.1	173.5	175.2	0	0	0	0	110	H191	H191-V740 WeakPolarHBondContact CE1-CG1 3.39Å
741	K	25.5	Very low	27.2	Very low	157 Å²	157	121.6 Å²	121.6	68%	0.683	71%	0.711	S	S	*	*			trans	-152.7	94.4	168.4	-79.8	-161.9	170.3	-83.6	0	112.7	E744	K741-E744 IonicContact NZ-OE1 2.68Å; K741-E744 PolarHBondContact NZ-OE1 3.04Å; K741-E744 IonicContact NZ-OE2 2.77Å; K741-E744 PolarHBondContact NZ-OE2 3.41Å
742	S	28.5	Very low	27.6	Very low	103 Å²	103	123.8 Å²	123.8	72%	0.72	71%	0.712	S	S	*	*	S	Bend	trans	-165.6	54.2	158	-154.8	0	0	0	0	113.1
743	L	28.8	Very low	28	Very low	67 Å²	67	128.6 Å²	128.6	35%	0.351	72%	0.722	S	S	.	*	S	Bend	trans	-144.3	-27.5	171.4	-145.5	54.7	0	0	0	113.5	V187 A190 Q745 H746	V187-L743 HydrophobicContact CB-CD2 4.13Å; V187-L743 HydrophobicContact CG1-CD2 4.15Å; V187-L743 HydrophobicContact CG2-CD2 3.73Å; V187-L743 HydrophobicContact CG2-CG 4.14Å; A190-L743 HydrophobicContact CB-CD2 4.23Å; L743-Q745 PolarHBondContact O-N 3.4Å; L743-Q745 VanDerWaalsContact O-N 3.08Å; L743-H746 PolarHBondContact O-N 3.25Å
744	E	28.7	Very low	28.1	Very low	123 Å²	123	127.8 Å²	127.8	58%	0.575	72%	0.722	S	S	*	*	H	α-helix	trans	-53.2	-28.7	172.4	-61.7	168.7	126.7	0	0	114.1	K741 H746	K741-E744 IonicContact NZ-OE1 2.68Å; K741-E744 PolarHBondContact NZ-OE1 3.04Å; K741-E744 IonicContact NZ-OE2 2.77Å; K741-E744 PolarHBondContact NZ-OE2 3.41Å; E744-H746 PolarHBondContact O-N 2.75Å
745	Q	31.3	Very low	28.5	Very low	173 Å²	173	125.9 Å²	125.9	81%	0.808	72%	0.72	S	S	*	*	H	α-helix	trans	-81.8	-10	-169.9	-68	-166.3	-57.3	0	0	115.4	L743	L743-Q745 PolarHBondContact O-N 3.4Å; L743-Q745 VanDerWaalsContact O-N 3.08Å
746	H	29.8	Very low	28.7	Very low	166 Å²	166	132.5 Å²	132.5	77%	0.769	74%	0.737	S	S	*	*	H	α-helix	trans	-91.5	-23.1	173.5	-115.8	100.9	0	0	0	113.5	L743 E744	L743-H746 PolarHBondContact O-N 3.25Å; E744-H746 PolarHBondContact O-N 2.75Å
747	L	31.8	Very low	28.9	Very low	83 Å²	83	131.5 Å²	131.5	44%	0.435	73%	0.733	S	S	.	*	H	α-helix	trans	-81.6	-17.2	178.5	-71.5	167.4	0	0	0	113.4	G749	L747-G749 PolarHBondContact O-N 3.1Å
748	A	29.6	Very low	29.2	Very low	81 Å²	81	134.4 Å²	134.4	67%	0.669	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-10.5	-178.2	0	0	0	0	0	114.9
749	G	31.2	Very low	29.4	Very low	66 Å²	66	130.9 Å²	130.9	68%	0.68	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-11.9	-177.8	0	0	0	0	0	115.9	L747	L747-G749 PolarHBondContact O-N 3.1Å
750	L	31.8	Very low	29.7	Very low	89 Å²	89	134.2 Å²	134.2	47%	0.466	72%	0.72	S	S	.	*	S	Bend	trans	-93.1	-6.2	-166.3	-68.1	171.7	0	0	0	115.8	L224 L752	L224-L750 HydrophobicContact CD2-CD1 4.01Å; L224-L750 HydrophobicContact CD2-CD2 3.9Å; L750-L752 PolarHBondContact O-N 2.87Å
751	N	28.3	Very low	29.8	Very low	155 Å²	155	136.3 Å²	136.3	83%	0.829	73%	0.727	S	S	*	*	S	Bend	trans	-97.5	35.1	-174.3	-75	-5.4	0	0	0	114.6
752	L	31.3	Very low	30	Very low	165 Å²	165	134.9 Å²	134.9	86%	0.864	73%	0.73	S	S	*	*			trans	-133.5	39.1	-180	-149.7	83.2	0	0	0	114.8	L750	L750-L752 PolarHBondContact O-N 2.87Å
753	L	31.3	Very low	30.2	Very low	165 Å²	165	137.1 Å²	137.1	86%	0.864	73%	0.73	S	S	*	*			trans	-137.2	37.2	173.2	-100.1	175.7	0	0	0	114.3
754	E	28.9	Very low	30.3	Very low	194 Å²	194	142.5 Å²	142.5	91%	0.907	76%	0.76	S	S	*	*			trans	-118.2	66.4	166.4	-72.3	-160.3	141	0	0	112.3
755	S	30.4	Very low	30.4	Very low	114 Å²	114	144.2 Å²	144.2	80%	0.797	78%	0.775	S	S	*	*			trans	178.1	131.6	138.2	37	0	0	0	0	112.7
756	K	29	Very low	30.3	Very low	279 Å²	279	141.5 Å²	141.5	100%	1.213	77%	0.772	S	S	*	*			trans	77.2	0	-178.9	-55.9	-177.3	179.6	179.4	0	116.1

Retrieved 756 of 756 residues in 256.7 ms (Link to these results)

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