A0A3Q0KDS9_SCHMA Loading...

Saposin B-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KDS9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 200 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	44.2	Very low	78.3	Confident	232 Å²	232	117.3 Å²	117.3	100%	1.143	62%	0.624	S	S	*	*				0	95	0	-67.4	161.9	76.8	0	0	108.9
2	K	61.6	Low	79.2	Confident	171 Å²	171	113.7 Å²	113.7	74%	0.743	62%	0.615	S	S	*	*			trans	177.5	-11	169.6	-101.6	164.3	-169.5	-172.7	0	117	L4 C5	K2-L4 PolarHBondContact O-N 3.47Å; K2-C5 VanDerWaalsContact O-CB 3.26Å; K2-C5 WeakPolarHBondContact O-CB 3.48Å; K2-C5 PolarHBondContact O-N 3.17Å
3	P	62.8	Low	80.1	Confident	99 Å²	99	112.9 Å²	112.9	64%	0.643	61%	0.61	S	S	*	*	H	α-helix	trans	-66.8	-28	-176.2	26.7	-32.5	0	0	0	112.8	C5 I6 L7	P3-C5 PolarHBondContact O-N 2.66Å; P3-I6 PolarHBondContact O-N 3.06Å; P3-L7 PolarHBondContact O-N 3.15Å
4	L	72.3	Confident	80.8	Confident	137 Å²	137	112 Å²	112	72%	0.717	60%	0.603	S	S	*	*	H	α-helix	trans	-55.7	-30.5	170.2	-79.1	147.5	0	0	0	112.6	K2 C8	K2-L4 PolarHBondContact O-N 3.47Å; L4-C8 PolarHBondContact O-N 3.3Å; L4-C8 VanDerWaalsContact O-N 3.09Å; L4-C8 PolarHBondContact O-SG 3.29Å
5	C	82.8	Confident	81.4	Confident	80 Å²	80	114 Å²	114	54%	0.541	60%	0.604	S	S	.	*	H	α-helix	trans	-74.2	-39.2	-176.9	-152.1	0	0	0	0	112	K2 P3 C8 L9	K2-C5 VanDerWaalsContact O-CB 3.26Å; K2-C5 WeakPolarHBondContact O-CB 3.48Å; K2-C5 PolarHBondContact O-N 3.17Å; P3-C5 PolarHBondContact O-N 2.66Å; C5-C8 PolarHBondContact O-N 3.13Å; C5-L9 WeakPolarHBondContact O-CG 3.32Å; C5-L9 PolarHBondContact O-N 3.05Å; C5-L9 VanDerWaalsContact O-N 3.16Å
6	I	86.5	Confident	81.9	Confident	114 Å²	114	116.3 Å²	116.3	59%	0.585	60%	0.603	S	S	*	*	H	α-helix	trans	-68.4	-43.6	176.5	-60	174.6	0	0	0	110.2	P3 C8 L9 L10	P3-I6 PolarHBondContact O-N 3.06Å; I6-C8 VanDerWaalsContact C-N 3.31Å; I6-C8 PolarHBondContact O-N 3.25Å; I6-L9 PolarHBondContact O-N 3.5Å; I6-L10 HydrophobicContact CG2-CD1 4.32Å; I6-L10 WeakPolarHBondContact O-CG 3.18Å; I6-L10 PolarHBondContact O-N 3.33Å
7	L	88.8	Confident	82.1	Confident	104 Å²	104	114.1 Å²	114.1	55%	0.545	60%	0.596	S	S	.	*	H	α-helix	trans	-60.2	-42.4	178	-169	71.2	0	0	0	111.3	P3 L9 L10 I11	P3-L7 PolarHBondContact O-N 3.15Å; L7-L9 PolarHBondContact O-N 3.19Å; L7-L10 PolarHBondContact O-N 2.87Å; L7-I11 HydrophobicContact CG-CD1 4.04Å; L7-I11 VanDerWaalsContact O-CG1 3.26Å; L7-I11 WeakPolarHBondContact O-CG1 3.2Å; L7-I11 PolarHBondContact O-N 2.93Å
8	C	88.8	Confident	82.2	Confident	72 Å²	72	112.4 Å²	112.4	49%	0.486	59%	0.588	S	S	.	*	H	α-helix	trans	-60	-43.6	174.6	-70.5	0	0	0	0	112.5	L4 C5 I6 L10 I11 S12	L4-C8 PolarHBondContact O-N 3.3Å; L4-C8 VanDerWaalsContact O-N 3.09Å; L4-C8 PolarHBondContact O-SG 3.29Å; C5-C8 PolarHBondContact O-N 3.13Å; I6-C8 VanDerWaalsContact C-N 3.31Å; I6-C8 PolarHBondContact O-N 3.25Å; C8-L10 PolarHBondContact O-N 3.11Å; C8-I11 PolarHBondContact O-N 3.37Å; C8-S12 PolarHBondContact O-N 2.04Å; C8-S12 PolarHBondContact O-OG 3.47Å; C8-S12 VanDerWaalsContact O-OG 3.07Å
9	L	90.3	Very high	82.3	Confident	110 Å²	110	109.3 Å²	109.3	58%	0.576	58%	0.576	S	S	*	*	H	α-helix	trans	-63.4	-40.8	178.5	-71	172.3	0	0	0	112.4	C5 I6 L7 S12 L13	C5-L9 WeakPolarHBondContact O-CG 3.32Å; C5-L9 PolarHBondContact O-N 3.05Å; C5-L9 VanDerWaalsContact O-N 3.16Å; I6-L9 PolarHBondContact O-N 3.5Å; L7-L9 PolarHBondContact O-N 3.19Å; L9-S12 PolarHBondContact O-N 3.48Å; L9-L13 WeakPolarHBondContact O-CB 3.22Å; L9-L13 PolarHBondContact O-N 3.36Å
10	L	92	Very high	82.2	Confident	94 Å²	94	108 Å²	108	49%	0.492	57%	0.569	S	S	.	*	H	α-helix	trans	-64.6	-43.5	176.3	-68.6	175.3	0	0	0	111.5	I6 L7 C8 L13 I14	I6-L10 HydrophobicContact CG2-CD1 4.32Å; I6-L10 WeakPolarHBondContact O-CG 3.18Å; I6-L10 PolarHBondContact O-N 3.33Å; L7-L10 PolarHBondContact O-N 2.87Å; C8-L10 PolarHBondContact O-N 3.11Å; L10-L13 PolarHBondContact O-N 3.07Å; L10-I14 VanDerWaalsContact O-CG1 3.3Å; L10-I14 WeakPolarHBondContact O-CG1 3.26Å; L10-I14 PolarHBondContact O-N 3.26Å
11	I	91.1	Very high	81.8	Confident	77 Å²	77	108 Å²	108	40%	0.395	57%	0.567	S	S	.	*	H	α-helix	trans	-60.5	-46.6	175.8	-69.1	167.6	0	0	0	110.1	L7 C8 L13 I14 F15	L7-I11 HydrophobicContact CG-CD1 4.04Å; L7-I11 VanDerWaalsContact O-CG1 3.26Å; L7-I11 WeakPolarHBondContact O-CG1 3.2Å; L7-I11 PolarHBondContact O-N 2.93Å; C8-I11 PolarHBondContact O-N 3.37Å; I11-L13 PolarHBondContact O-N 2.88Å; I11-I14 PolarHBondContact O-N 3.22Å; I11-F15 HydrophobicContact CG2-CD2 3.59Å; I11-F15 HydrophobicContact CG2-CE2 3.39Å; I11-F15 WeakPolarHBondContact O-CD2 3.22Å; I11-F15 PolarHBondContact O-N 3.08Å
12	S	89.2	Confident	83.5	Confident	74 Å²	74	103.5 Å²	103.5	52%	0.517	54%	0.543	S	S	.	.	H	α-helix	trans	-60.7	-40.6	176.6	-62.4	0	0	0	0	113	C8 L9 F15 Y16	C8-S12 PolarHBondContact O-N 2.04Å; C8-S12 PolarHBondContact O-OG 3.47Å; C8-S12 VanDerWaalsContact O-OG 3.07Å; L9-S12 PolarHBondContact O-N 3.48Å; S12-F15 PolarHBondContact O-N 3.44Å; S12-Y16 WeakPolarHBondContact O-CB 3.32Å; S12-Y16 PolarHBondContact O-N 3.48Å
13	L	90.6	Very high	84.2	Confident	104 Å²	104	100.6 Å²	100.6	55%	0.545	54%	0.536	S	S	.	.	H	α-helix	trans	-63.7	-42.9	175.4	-92.2	155	0	0	0	112.3	L9 L10 I11 Y16 V17	L9-L13 WeakPolarHBondContact O-CB 3.22Å; L9-L13 PolarHBondContact O-N 3.36Å; L10-L13 PolarHBondContact O-N 3.07Å; I11-L13 PolarHBondContact O-N 2.88Å; L13-Y16 PolarHBondContact O-N 3.39Å; L13-V17 WeakPolarHBondContact O-CG2 3.42Å; L13-V17 PolarHBondContact O-N 3.11Å
14	I	91.1	Very high	85	Confident	100 Å²	100	98.7 Å²	98.7	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-45.6	176.9	-68.8	164.9	0	0	0	110.3	L10 I11 Y16 V17 N18	L10-I14 VanDerWaalsContact O-CG1 3.3Å; L10-I14 WeakPolarHBondContact O-CG1 3.26Å; L10-I14 PolarHBondContact O-N 3.26Å; I11-I14 PolarHBondContact O-N 3.22Å; I14-Y16 VanDerWaalsContact C-N 3.31Å; I14-Y16 PolarHBondContact O-N 2.99Å; I14-V17 PolarHBondContact O-N 3.13Å; I14-N18 WeakPolarHBondContact O-CB 3.42Å; I14-N18 VanDerWaalsContact O-CG 3.22Å; I14-N18 PolarHBondContact O-N 3.36Å; I14-N18 PolarHBondContact O-ND2 2.92Å
15	F	89.1	Confident	85.2	Confident	142 Å²	142	96.5 Å²	96.5	62%	0.623	51%	0.513	S	S	*	.	H	α-helix	trans	-60.1	-41.1	175.5	-82	-65.6	0	0	0	112.2	I11 S12 N18 S19	I11-F15 HydrophobicContact CG2-CD2 3.59Å; I11-F15 HydrophobicContact CG2-CE2 3.39Å; I11-F15 WeakPolarHBondContact O-CD2 3.22Å; I11-F15 PolarHBondContact O-N 3.08Å; S12-F15 PolarHBondContact O-N 3.44Å; F15-N18 PolarHBondContact O-N 2.89Å; F15-S19 PolarHBondContact O-N 3.28Å; F15-S19 PolarHBondContact O-OG 3.42Å
16	Y	88.8	Confident	84.7	Confident	151 Å²	151	98.1 Å²	98.1	59%	0.592	51%	0.513	S	S	*	.	H	α-helix	trans	-65.8	-42.8	178.2	-177.4	-107	0	0	0	113.1	S12 L13 I14 S19 I20	S12-Y16 WeakPolarHBondContact O-CB 3.32Å; S12-Y16 PolarHBondContact O-N 3.48Å; L13-Y16 PolarHBondContact O-N 3.39Å; I14-Y16 VanDerWaalsContact C-N 3.31Å; I14-Y16 PolarHBondContact O-N 2.99Å; Y16-S19 WeakPolarHBondContact CA-OG 3.01Å; Y16-S19 PolarHBondContact O-N 2.83Å; Y16-S19 PolarHBondContact O-OG 3.21Å; Y16-I20 HydrophobicContact CD1-CD1 3.8Å; Y16-I20 HydrophobicContact CE1-CD1 3.3Å; Y16-I20 HydrophobicContact CE1-CG1 4.42Å; Y16-I20 HydrophobicContact CE2-CD1 4.23Å; Y16-I20 HydrophobicContact CG-CD1 4.46Å; Y16-I20 WeakPolarHBondContact O-CG1 3.03Å; Y16-I20 PolarHBondContact O-N 3.09Å
17	V	86.7	Confident	84.3	Confident	78 Å²	78	98.7 Å²	98.7	47%	0.473	51%	0.513	S	S	.	.	H	α-helix	trans	-67	-41	176.3	174.4	0	0	0	0	110.8	L13 I14 S19 I20 M21	L13-V17 WeakPolarHBondContact O-CG2 3.42Å; L13-V17 PolarHBondContact O-N 3.11Å; I14-V17 PolarHBondContact O-N 3.13Å; V17-S19 VanDerWaalsContact C-N 3.34Å; V17-S19 PolarHBondContact O-N 2.9Å; V17-I20 PolarHBondContact O-N 3.11Å; V17-M21 PolarHBondContact O-N 3.48Å
18	N	82.7	Confident	83.6	Confident	85 Å²	85	98.9 Å²	98.9	46%	0.455	51%	0.513	S	S	.	.	H	α-helix	trans	-62.4	-40.8	175.6	-72.7	-16.6	0	0	0	111.6	I14 F15 M21 E22	I14-N18 WeakPolarHBondContact O-CB 3.42Å; I14-N18 VanDerWaalsContact O-CG 3.22Å; I14-N18 PolarHBondContact O-N 3.36Å; I14-N18 PolarHBondContact O-ND2 2.92Å; F15-N18 PolarHBondContact O-N 2.89Å; N18-M21 PolarHBondContact O-N 3.37Å; N18-E22 WeakPolarHBondContact O-CB 3.25Å; N18-E22 PolarHBondContact O-N 3.41Å
19	S	83.9	Confident	83	Confident	53 Å²	53	100.2 Å²	100.2	37%	0.371	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-39.1	176.3	62.7	0	0	0	0	112.6	F15 Y16 V17 E22 D23	F15-S19 PolarHBondContact O-N 3.28Å; F15-S19 PolarHBondContact O-OG 3.42Å; Y16-S19 WeakPolarHBondContact CA-OG 3.01Å; Y16-S19 PolarHBondContact O-N 2.83Å; Y16-S19 PolarHBondContact O-OG 3.21Å; V17-S19 VanDerWaalsContact C-N 3.34Å; V17-S19 PolarHBondContact O-N 2.9Å; S19-E22 PolarHBondContact O-N 3.16Å; S19-D23 PolarHBondContact O-N 3.38Å
20	I	80.5	Confident	82.3	Confident	82 Å²	82	98.8 Å²	98.8	42%	0.421	51%	0.505	S	S	.	.	H	α-helix	trans	-64.9	-43.5	174.9	-69.3	168.8	0	0	0	111.2	Y16 V17 E22 D23 S24	Y16-I20 HydrophobicContact CD1-CD1 3.8Å; Y16-I20 HydrophobicContact CE1-CD1 3.3Å; Y16-I20 HydrophobicContact CE1-CG1 4.42Å; Y16-I20 HydrophobicContact CE2-CD1 4.23Å; Y16-I20 HydrophobicContact CG-CD1 4.46Å; Y16-I20 WeakPolarHBondContact O-CG1 3.03Å; Y16-I20 PolarHBondContact O-N 3.09Å; V17-I20 PolarHBondContact O-N 3.11Å; I20-E22 VanDerWaalsContact C-N 3.35Å; I20-D23 PolarHBondContact O-N 3.35Å; I20-S24 PolarHBondContact O-N 3.06Å
21	M	74.2	Confident	81.5	Confident	110 Å²	110	100.3 Å²	100.3	54%	0.542	51%	0.51	S	S	.	.	H	α-helix	trans	-61.2	-45	176.5	-81.2	-113.8	-64	0	0	111.2	V17 N18 S24 I25	V17-M21 PolarHBondContact O-N 3.48Å; N18-M21 PolarHBondContact O-N 3.37Å; M21-S24 PolarHBondContact O-N 3.44Å; M21-S24 PolarHBondContact O-OG 3.07Å; M21-I25 WeakPolarHBondContact O-CG1 3.49Å; M21-I25 PolarHBondContact O-N 3.26Å
22	E	80.1	Confident	80.3	Confident	137 Å²	137	104 Å²	104	64%	0.64	52%	0.523	S	S	*	.	H	α-helix	trans	-62.5	-44	178.1	-167.6	154.2	-161	0	0	111.6	N18 S19 I20 S24 I25 H26	N18-E22 WeakPolarHBondContact O-CB 3.25Å; N18-E22 PolarHBondContact O-N 3.41Å; S19-E22 PolarHBondContact O-N 3.16Å; I20-E22 VanDerWaalsContact C-N 3.35Å; E22-S24 VanDerWaalsContact C-N 3.33Å; E22-S24 PolarHBondContact O-N 3.17Å; E22-I25 PolarHBondContact O-N 3.48Å; E22-H26 WeakPolarHBondContact O-CB 3.39Å; E22-H26 PolarHBondContact O-N 3.42Å
23	D	76.9	Confident	79.2	Confident	110 Å²	110	104.2 Å²	104.2	59%	0.588	52%	0.519	S	S	*	.	H	α-helix	trans	-59.1	-42.8	173.1	-85	-14.5	0	0	0	112	S19 I20 I25 H26 Q27	S19-D23 PolarHBondContact O-N 3.38Å; I20-D23 PolarHBondContact O-N 3.35Å; D23-I25 PolarHBondContact O-N 2.94Å; D23-H26 PolarHBondContact O-N 3.38Å; D23-Q27 VanDerWaalsContact O-CG 3.31Å; D23-Q27 WeakPolarHBondContact O-CG 3.2Å; D23-Q27 PolarHBondContact O-N 2.82Å
24	S	78.5	Confident	78	Confident	59 Å²	59	104.1 Å²	104.1	41%	0.413	52%	0.518	S	S	.	.	H	α-helix	trans	-65.8	-38.2	178.9	74.5	0	0	0	0	112.6	I20 M21 E22 H26 L28	I20-S24 PolarHBondContact O-N 3.06Å; M21-S24 PolarHBondContact O-N 3.44Å; M21-S24 PolarHBondContact O-OG 3.07Å; E22-S24 VanDerWaalsContact C-N 3.33Å; E22-S24 PolarHBondContact O-N 3.17Å; S24-H26 VanDerWaalsContact C-N 3.35Å; S24-L28 PolarHBondContact O-N 3.46Å
25	I	75.9	Confident	76.5	Confident	90 Å²	90	107.1 Å²	107.1	46%	0.462	52%	0.523	S	S	.	.	H	α-helix	trans	-65.2	-42.9	172.9	-68.8	168.2	0	0	0	109.6	M21 E22 D23 Q27 L28 Q29	M21-I25 WeakPolarHBondContact O-CG1 3.49Å; M21-I25 PolarHBondContact O-N 3.26Å; E22-I25 PolarHBondContact O-N 3.48Å; D23-I25 PolarHBondContact O-N 2.94Å; I25-Q27 PolarHBondContact O-N 3.45Å; I25-L28 WeakPolarHBondContact O-CB 3.41Å; I25-L28 PolarHBondContact O-N 3.36Å; I25-Q29 HydrophobicContact CG2-CG 4.44Å; I25-Q29 WeakPolarHBondContact O-CB 3.27Å; I25-Q29 WeakPolarHBondContact O-CG 3.5Å; I25-Q29 PolarHBondContact O-N 2.79Å
26	H	73	Confident	75.1	Confident	115 Å²	115	109.5 Å²	109.5	53%	0.532	53%	0.528	S	S	.	.	H	α-helix	trans	-67	-37.1	-178.9	-148.1	-33.6	0	0	0	112	E22 D23 S24 Q29 L30	E22-H26 WeakPolarHBondContact O-CB 3.39Å; E22-H26 PolarHBondContact O-N 3.42Å; D23-H26 PolarHBondContact O-N 3.38Å; S24-H26 VanDerWaalsContact C-N 3.35Å; H26-Q29 PolarHBondContact O-N 3.1Å; H26-L30 VanDerWaalsContact O-CB 3.28Å; H26-L30 WeakPolarHBondContact O-CB 3.49Å; H26-L30 PolarHBondContact O-N 2.97Å
27	Q	78	Confident	73.9	Confident	126 Å²	126	112.5 Å²	112.5	59%	0.589	54%	0.538	S	S	*	.	H	α-helix	trans	-66.9	-41.7	172.7	-71.1	-66	-40.2	0	0	111.8	D23 I25 Q29 L30 Q31	D23-Q27 VanDerWaalsContact O-CG 3.31Å; D23-Q27 WeakPolarHBondContact O-CG 3.2Å; D23-Q27 PolarHBondContact O-N 2.82Å; I25-Q27 PolarHBondContact O-N 3.45Å; Q27-Q29 VanDerWaalsContact C-N 3.34Å; Q27-Q29 PolarHBondContact O-N 3.49Å; Q27-L30 PolarHBondContact O-N 3.4Å; Q27-Q31 WeakPolarHBondContact O-CB 3.31Å; Q27-Q31 PolarHBondContact O-N 3.01Å
28	L	74.1	Confident	72.8	Confident	107 Å²	107	112 Å²	112	56%	0.56	54%	0.538	S	S	*	.	H	α-helix	trans	-62.4	-40.6	173.7	-91.8	158.8	0	0	0	112	S24 I25 K32	S24-L28 PolarHBondContact O-N 3.46Å; I25-L28 WeakPolarHBondContact O-CB 3.41Å; I25-L28 PolarHBondContact O-N 3.36Å; L28-K32 WeakPolarHBondContact O-CG 3.34Å; L28-K32 PolarHBondContact O-N 3.4Å
29	Q	77.5	Confident	72	Confident	101 Å²	101	115.3 Å²	115.3	47%	0.472	55%	0.551	S	S	.	*	H	α-helix	trans	-67.3	-46	174.3	-75.1	174.7	-33.7	0	0	111.3	I25 H26 Q27 Q31 K32 D33	I25-Q29 HydrophobicContact CG2-CG 4.44Å; I25-Q29 WeakPolarHBondContact O-CB 3.27Å; I25-Q29 WeakPolarHBondContact O-CG 3.5Å; I25-Q29 PolarHBondContact O-N 2.79Å; H26-Q29 PolarHBondContact O-N 3.1Å; Q27-Q29 VanDerWaalsContact C-N 3.34Å; Q27-Q29 PolarHBondContact O-N 3.49Å; Q29-Q31 VanDerWaalsContact C-N 3.3Å; Q29-Q31 PolarHBondContact O-N 2.88Å; Q29-K32 CarbonylContact O-C 3.55Å; Q29-K32 WeakPolarHBondContact O-CA 3.45Å; Q29-K32 WeakPolarHBondContact O-CB 3.25Å; Q29-K32 PolarHBondContact O-N 2.88Å; Q29-K32 VanDerWaalsContact O-N 3.11Å; Q29-D33 WeakPolarHBondContact O-CB 3.15Å; Q29-D33 PolarHBondContact O-N 3.17Å
30	L	74.6	Confident	71.4	Confident	79 Å²	79	114 Å²	114	41%	0.414	54%	0.541	S	S	.	.	H	α-helix	trans	-60.3	-41	176.4	-173.4	72	0	0	0	111.1	H26 Q27 D33 L34	H26-L30 VanDerWaalsContact O-CB 3.28Å; H26-L30 WeakPolarHBondContact O-CB 3.49Å; H26-L30 PolarHBondContact O-N 2.97Å; Q27-L30 PolarHBondContact O-N 3.4Å; L30-D33 PolarHBondContact O-N 3.15Å; L30-L34 HydrophobicContact CD2-CD1 4.37Å; L30-L34 HydrophobicContact CG-CD1 3.97Å; L30-L34 HydrophobicContact CG-CG 4.28Å; L30-L34 VanDerWaalsContact O-CB 3.24Å; L30-L34 WeakPolarHBondContact O-CB 3.29Å; L30-L34 WeakPolarHBondContact O-CG 3.3Å; L30-L34 PolarHBondContact O-N 2.68Å
31	Q	74.4	Confident	71.5	Confident	127 Å²	127	113.7 Å²	113.7	59%	0.593	54%	0.54	S	S	*	.	H	α-helix	trans	-66.3	-38.6	176	-170.8	179.5	-25.8	0	0	111.8	Q27 Q29 R35	Q27-Q31 WeakPolarHBondContact O-CB 3.31Å; Q27-Q31 PolarHBondContact O-N 3.01Å; Q29-Q31 VanDerWaalsContact C-N 3.3Å; Q29-Q31 PolarHBondContact O-N 2.88Å; Q31-R35 VanDerWaalsContact O-CB 3.3Å; Q31-R35 WeakPolarHBondContact O-CB 3.49Å; Q31-R35 WeakPolarHBondContact O-CG 3.46Å; Q31-R35 PolarHBondContact O-N 3.11Å
32	K	66.6	Low	72.3	Confident	153 Å²	153	114.1 Å²	114.1	67%	0.665	54%	0.544	S	S	*	.	H	α-helix	trans	-63.8	-41.1	171.4	-79.5	179.6	178.9	179.6	0	111.8	L28 Q29 R35 R36	L28-K32 WeakPolarHBondContact O-CG 3.34Å; L28-K32 PolarHBondContact O-N 3.4Å; Q29-K32 CarbonylContact O-C 3.55Å; Q29-K32 WeakPolarHBondContact O-CA 3.45Å; Q29-K32 WeakPolarHBondContact O-CB 3.25Å; Q29-K32 PolarHBondContact O-N 2.88Å; Q29-K32 VanDerWaalsContact O-N 3.11Å; K32-R35 WeakPolarHBondContact O-CB 3.17Å; K32-R35 PolarHBondContact O-N 2.9Å; K32-R36 VanDerWaalsContact O-CB 3.29Å; K32-R36 WeakPolarHBondContact O-CB 3.42Å; K32-R36 PolarHBondContact O-N 2.95Å
33	D	65.7	Low	72.9	Confident	80 Å²	80	116.4 Å²	116.4	43%	0.428	55%	0.548	S	S	.	.	H	α-helix	trans	-71.9	-38.3	178.7	-73.6	-24.6	0	0	0	112.2	Q29 L30 R36 R37	Q29-D33 WeakPolarHBondContact O-CB 3.15Å; Q29-D33 PolarHBondContact O-N 3.17Å; L30-D33 PolarHBondContact O-N 3.15Å; D33-R36 CarbonylContact O-C 3.52Å; D33-R36 PolarHBondContact O-N 3.01Å; D33-R37 WeakPolarHBondContact O-CB 3.35Å; D33-R37 WeakPolarHBondContact O-CG 3.3Å; D33-R37 PolarHBondContact O-N 2.9Å
34	L	64.9	Low	73.6	Confident	102 Å²	102	115.6 Å²	115.6	53%	0.534	54%	0.541	S	S	.	.	H	α-helix	trans	-65.3	-41.4	172.6	-75.5	170.7	0	0	0	110.8	L30 R37 S38	L30-L34 HydrophobicContact CD2-CD1 4.37Å; L30-L34 HydrophobicContact CG-CD1 3.97Å; L30-L34 HydrophobicContact CG-CG 4.28Å; L30-L34 VanDerWaalsContact O-CB 3.24Å; L30-L34 WeakPolarHBondContact O-CB 3.29Å; L30-L34 WeakPolarHBondContact O-CG 3.3Å; L30-L34 PolarHBondContact O-N 2.68Å; L34-R37 PolarHBondContact O-N 2.94Å; L34-S38 WeakPolarHBondContact O-CB 3.28Å; L34-S38 PolarHBondContact O-N 2.9Å
35	R	60.3	Low	74.4	Confident	163 Å²	163	113.5 Å²	113.5	62%	0.615	53%	0.526	S	S	*	.	H	α-helix	trans	-59.6	-47	169.6	-91.2	-101.3	-144.1	162.7	6.4	111.6	Q31 K32 R37 S38	Q31-R35 VanDerWaalsContact O-CB 3.3Å; Q31-R35 WeakPolarHBondContact O-CB 3.49Å; Q31-R35 WeakPolarHBondContact O-CG 3.46Å; Q31-R35 PolarHBondContact O-N 3.11Å; K32-R35 WeakPolarHBondContact O-CB 3.17Å; K32-R35 PolarHBondContact O-N 2.9Å; R35-R37 VanDerWaalsContact C-N 3.29Å; R35-R37 PolarHBondContact O-N 3.3Å; R35-S38 PolarHBondContact O-N 3.37Å; R35-S38 PolarHBondContact O-OG 3.32Å
36	R	60.3	Low	75.3	Confident	191 Å²	191	113.5 Å²	113.5	72%	0.721	53%	0.526	S	S	*	.	H	α-helix	trans	-63.3	-33.8	177.8	-176.9	-177.5	-91.3	-170.4	-8.3	112.2	K32 D33	K32-R36 VanDerWaalsContact O-CB 3.29Å; K32-R36 WeakPolarHBondContact O-CB 3.42Å; K32-R36 PolarHBondContact O-N 2.95Å; D33-R36 CarbonylContact O-C 3.52Å; D33-R36 PolarHBondContact O-N 3.01Å
37	R	62.9	Low	76.4	Confident	215 Å²	215	111 Å²	111	81%	0.811	53%	0.526	S	S	*	.	H	α-helix	trans	-80.2	-27.8	173.8	-76.8	-172.1	-165.7	-167.9	5.5	113.2	D33 L34 R35 Q39	D33-R37 WeakPolarHBondContact O-CB 3.35Å; D33-R37 WeakPolarHBondContact O-CG 3.3Å; D33-R37 PolarHBondContact O-N 2.9Å; L34-R37 PolarHBondContact O-N 2.94Å; R35-R37 VanDerWaalsContact C-N 3.29Å; R35-R37 PolarHBondContact O-N 3.3Å; R37-Q39 PolarHBondContact O-N 3.49Å
38	S	63.9	Low	77.3	Confident	68 Å²	68	106.2 Å²	106.2	48%	0.476	51%	0.505	S	S	.	.	S	Bend	trans	-66.4	121.2	177.3	71	0	0	0	0	108.4	L34 R35 P40	L34-S38 WeakPolarHBondContact O-CB 3.28Å; L34-S38 PolarHBondContact O-N 2.9Å; R35-S38 PolarHBondContact O-N 3.37Å; R35-S38 PolarHBondContact O-OG 3.32Å; S38-P40 WeakPolarHBondContact O-CD 3.36Å
39	Q	65.8	Low	78.4	Confident	153 Å²	153	107 Å²	107	72%	0.715	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-52.4	126.1	174.8	-70.2	-155	-34.1	0	0	109.3	R37 N41 Y117	R37-Q39 PolarHBondContact O-N 3.49Å; Q39-N41 PolarHBondContact O-N 3.15Å; Q39-N41 VanDerWaalsContact O-N 3.12Å; Q39-Y117 WeakPolarHBondContact CA-OH 3.36Å; Q39-Y117 WeakPolarHBondContact CB-OH 3.39Å; Q39-Y117 WeakPolarHBondContact CG-OH 3.25Å; Q39-Y117 PolarHBondContact NE2-OH 2.05Å
40	P	70.8	Confident	79.4	Confident	26 Å²	26	105.1 Å²	105.1	17%	0.169	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-49.2	125.6	170.8	-15.4	11.8	0	0	0	109.5	S38 L42 F115 Y117	S38-P40 WeakPolarHBondContact O-CD 3.36Å; P40-L42 PolarHBondContact O-N 2.9Å; P40-F115 WeakPolarHBondContact CB-O 3.35Å; P40-Y117 HydrophobicContact CG-CD1 4.17Å; P40-Y117 HydrophobicContact CG-CD2 4Å; P40-Y117 HydrophobicContact CG-CE1 4.17Å; P40-Y117 HydrophobicContact CG-CE2 3.99Å; P40-Y117 HydrophobicContact CG-CG 4.11Å
41	N	83.8	Confident	80.5	Confident	76 Å²	76	103 Å²	103	41%	0.406	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-62.8	127	177.4	178.3	-23.8	0	0	0	108.2	Q39 Y43 Q44 C45	Q39-N41 PolarHBondContact O-N 3.15Å; Q39-N41 VanDerWaalsContact O-N 3.12Å; N41-Y43 PolarHBondContact O-N 3.4Å; N41-Y43 VanDerWaalsContact O-N 3.1Å; N41-Y43 WeakPolarHBondContact OD1-CB 3.43Å; N41-Y43 WeakPolarHBondContact OD1-CD2 3.45Å; N41-Y43 PolarHBondContact OD1-N 3.48Å; N41-Q44 HydrophobicContact CB-CB 4.2Å; N41-Q44 HydrophobicContact CB-CG 3.92Å; N41-Q44 WeakPolarHBondContact O-CA 3.43Å; N41-Q44 WeakPolarHBondContact O-CB 3.36Å; N41-Q44 PolarHBondContact O-N 3Å; N41-C45 PolarHBondContact O-N 3.45Å
42	L	89.5	Confident	81.6	Confident	119 Å²	119	98.2 Å²	98.2	62%	0.623	48%	0.476	S	S	*	.	H	α-helix	trans	-48.3	-41.3	178.3	178.4	61.7	0	0	0	112.2	P40 C45 I46	P40-L42 PolarHBondContact O-N 2.9Å; L42-C45 PolarHBondContact O-N 2.85Å; L42-I46 HydrophobicContact CD1-CD1 3.96Å; L42-I46 HydrophobicContact CD1-CG1 4.3Å; L42-I46 HydrophobicContact CG-CD1 3.85Å; L42-I46 VanDerWaalsContact O-CG1 3.26Å; L42-I46 WeakPolarHBondContact O-CG1 3.09Å; L42-I46 PolarHBondContact O-N 2.85Å
43	Y	93.1	Very high	83	Confident	184 Å²	184	91.9 Å²	91.9	72%	0.722	45%	0.454	S	S	*	.	H	α-helix	trans	-66.6	-37	178	-65.4	-73.8	0	0	0	112.9	N41 A47	N41-Y43 PolarHBondContact O-N 3.4Å; N41-Y43 VanDerWaalsContact O-N 3.1Å; N41-Y43 WeakPolarHBondContact OD1-CB 3.43Å; N41-Y43 WeakPolarHBondContact OD1-CD2 3.45Å; N41-Y43 PolarHBondContact OD1-N 3.48Å; Y43-A47 VanDerWaalsContact O-CB 3.25Å; Y43-A47 WeakPolarHBondContact O-CB 3.08Å; Y43-A47 PolarHBondContact O-N 3.23Å
44	Q	93	Very high	84.5	Confident	94 Å²	94	93.5 Å²	93.5	44%	0.439	46%	0.459	S	S	.	.	H	α-helix	trans	-66.7	-42.5	175.1	-70.2	174.7	-9.4	0	0	111	N41 A47 C48 F115	N41-Q44 HydrophobicContact CB-CB 4.2Å; N41-Q44 HydrophobicContact CB-CG 3.92Å; N41-Q44 WeakPolarHBondContact O-CA 3.43Å; N41-Q44 WeakPolarHBondContact O-CB 3.36Å; N41-Q44 PolarHBondContact O-N 3Å; Q44-A47 PolarHBondContact O-N 2.88Å; Q44-C48 VanDerWaalsContact O-CB 3.29Å; Q44-C48 WeakPolarHBondContact O-CB 3.35Å; Q44-C48 PolarHBondContact O-N 3.08Å; Q44-F115 HydrophobicContact CB-CD1 4.35Å
45	C	94.6	Very high	86	Confident	15 Å²	15	90.8 Å²	90.8	10%	0.101	45%	0.451	C	S	.	.	H	α-helix	trans	-61.6	-47.4	176.1	-176.3	0	0	0	0	111.4	N41 L42 C48 R49 F115 C116	N41-C45 PolarHBondContact O-N 3.45Å; L42-C45 PolarHBondContact O-N 2.85Å; C45-C48 PolarHBondContact O-N 3.33Å; C45-R49 WeakPolarHBondContact O-CB 3.36Å; C45-R49 VanDerWaalsContact O-CG 3.25Å; C45-R49 WeakPolarHBondContact O-CG 3.02Å; C45-R49 PolarHBondContact O-N 2.96Å; C45-F115 WeakPolarHBondContact CA-O 3.3Å; C45-F115 WeakPolarHBondContact CB-O 3.23Å; C45-F115 PolarHBondContact N-O 3.33Å; C45-C116 WeakPolarHBondContact CA-SG 3.07Å; C45-C116 HydrophobicContact CB-CB 4.07Å; C45-C116 WeakPolarHBondContact CB-SG 3.21Å; C45-C116 WeakPolarHBondContact SG-CB 3.41Å; C45-C116 CovalentContact SG-SG 2.05Å; C45-C116 PolarHBondContact SG-SG 3.49Å
46	I	95.3	Very high	87.8	Confident	89 Å²	89	85.1 Å²	85.1	46%	0.456	43%	0.431	S	S	.	.	H	α-helix	trans	-60.5	-47.9	177.9	-69.7	167.5	0	0	0	110.7	L42 C48 R49 S50	L42-I46 HydrophobicContact CD1-CD1 3.96Å; L42-I46 HydrophobicContact CD1-CG1 4.3Å; L42-I46 HydrophobicContact CG-CD1 3.85Å; L42-I46 VanDerWaalsContact O-CG1 3.26Å; L42-I46 WeakPolarHBondContact O-CG1 3.09Å; L42-I46 PolarHBondContact O-N 2.85Å; I46-C48 PolarHBondContact O-N 3.21Å; I46-R49 PolarHBondContact O-N 3.43Å; I46-S50 WeakPolarHBondContact O-CB 3.4Å; I46-S50 PolarHBondContact O-N 2.94Å
47	A	96.3	Very high	89.5	Confident	64 Å²	64	81.5 Å²	81.5	53%	0.529	43%	0.426	S	S	.	.	H	α-helix	trans	-61.4	-45.6	179.2	0	0	0	0	0	111.6	Y43 Q44 S50 G51	Y43-A47 VanDerWaalsContact O-CB 3.25Å; Y43-A47 WeakPolarHBondContact O-CB 3.08Å; Y43-A47 PolarHBondContact O-N 3.23Å; Q44-A47 PolarHBondContact O-N 2.88Å; A47-S50 PolarHBondContact O-N 3.39Å; A47-G51 PolarHBondContact O-N 2.95Å
48	C	97.1	Very high	91.1	Very high	24 Å²	24	76.3 Å²	76.3	16%	0.162	41%	0.413	C	S	.	.	H	α-helix	trans	-61.7	-49	177.2	179.8	0	0	0	0	111.4	Q44 C45 I46 S50 G51 V52 C110 F115	Q44-C48 VanDerWaalsContact O-CB 3.29Å; Q44-C48 WeakPolarHBondContact O-CB 3.35Å; Q44-C48 PolarHBondContact O-N 3.08Å; C45-C48 PolarHBondContact O-N 3.33Å; I46-C48 PolarHBondContact O-N 3.21Å; C48-S50 VanDerWaalsContact C-N 3.32Å; C48-S50 PolarHBondContact O-N 3.48Å; C48-G51 PolarHBondContact O-N 2.88Å; C48-V52 WeakPolarHBondContact O-CB 3.48Å; C48-V52 WeakPolarHBondContact O-CG2 3.3Å; C48-V52 PolarHBondContact O-N 3.15Å; C48-C110 HydrophobicContact CB-CB 3.87Å; C48-C110 WeakPolarHBondContact CB-SG 3.23Å; C48-C110 VanDerWaalsContact SG-CA 3.52Å; C48-C110 WeakPolarHBondContact SG-CB 3.44Å; C48-C110 CovalentContact SG-SG 2.03Å; C48-C110 PolarHBondContact SG-SG 2.93Å; C48-F115 HydrophobicContact CB-CB 3.86Å; C48-F115 HydrophobicContact CB-CD2 4.12Å; C48-F115 HydrophobicContact CB-CG 4.09Å
49	R	96.5	Very high	92.6	Very high	123 Å²	123	76 Å²	76	46%	0.464	41%	0.406	S	S	.	.	H	α-helix	trans	-60.5	-42.9	-180	-73.3	172	66.5	-166.7	-4.6	112	C45 I46 G53 P106 Q107 C110	C45-R49 WeakPolarHBondContact O-CB 3.36Å; C45-R49 VanDerWaalsContact O-CG 3.25Å; C45-R49 WeakPolarHBondContact O-CG 3.02Å; C45-R49 PolarHBondContact O-N 2.96Å; I46-R49 PolarHBondContact O-N 3.43Å; R49-G53 PolarHBondContact O-N 3.18Å; R49-P106 HydrophobicContact CB-CB 4.23Å; R49-P106 HydrophobicContact CG-CB 4.33Å; R49-Q107 VanDerWaalsContact CD-OE1 3.27Å; R49-C110 PolarHBondContact N-SG 2.86Å; R49-C110 VanDerWaalsContact N-SG 3.4Å
50	S	97.3	Very high	94.1	Very high	62 Å²	62	71.7 Å²	71.7	43%	0.434	39%	0.387	S	S	.	.	H	α-helix	trans	-62.8	-47.4	175.8	-178.9	0	0	0	0	111.1	I46 A47 C48 G53 Q54	I46-S50 WeakPolarHBondContact O-CB 3.4Å; I46-S50 PolarHBondContact O-N 2.94Å; A47-S50 PolarHBondContact O-N 3.39Å; C48-S50 VanDerWaalsContact C-N 3.32Å; C48-S50 PolarHBondContact O-N 3.48Å; S50-G53 PolarHBondContact O-N 3.45Å; S50-Q54 WeakPolarHBondContact O-CB 3.48Å; S50-Q54 WeakPolarHBondContact O-CG 3.28Å; S50-Q54 PolarHBondContact O-N 3.41Å; S50-Q54 PolarHBondContact OG-NE2 3.42Å
51	G	97.9	Very high	95.3	Very high	36 Å²	36	72 Å²	72	37%	0.371	39%	0.39	S	S	.	.	H	α-helix	trans	-61.6	-47	178.3	0	0	0	0	0	112.8	A47 C48 G53 Q54 A55	A47-G51 PolarHBondContact O-N 2.95Å; C48-G51 PolarHBondContact O-N 2.88Å; G51-G53 PolarHBondContact O-N 3.06Å; G51-Q54 PolarHBondContact O-N 3.23Å; G51-A55 VanDerWaalsContact O-CB 3.31Å; G51-A55 WeakPolarHBondContact O-CB 3.44Å; G51-A55 PolarHBondContact O-N 3Å
52	V	97.2	Very high	95.8	Very high	26 Å²	26	73.4 Å²	73.4	16%	0.158	41%	0.406	C	S	.	.	H	α-helix	trans	-62.9	-42.3	175.8	172.2	0	0	0	0	111	C48 A55 K56 V104 P106 L109	C48-V52 WeakPolarHBondContact O-CB 3.48Å; C48-V52 WeakPolarHBondContact O-CG2 3.3Å; C48-V52 PolarHBondContact O-N 3.15Å; V52-A55 PolarHBondContact O-N 2.96Å; V52-K56 VanDerWaalsContact O-CB 3.23Å; V52-K56 WeakPolarHBondContact O-CB 3.27Å; V52-K56 PolarHBondContact O-N 3.16Å; V52-V104 HydrophobicContact CG1-CG1 4.12Å; V52-P106 HydrophobicContact CB-CB 4.06Å; V52-P106 HydrophobicContact CG1-CB 3.89Å; V52-P106 HydrophobicContact CG1-CG 4.05Å; V52-L109 HydrophobicContact CG1-CD2 3.76Å; V52-L109 HydrophobicContact CG2-CD2 3.92Å
53	G	97.2	Very high	96.1	Very high	19 Å²	19	71.6 Å²	71.6	20%	0.196	40%	0.403	C	S	.	.	H	α-helix	trans	-60.9	-45.7	176.3	0	0	0	0	0	112.5	R49 S50 G51 K56 N57	R49-G53 PolarHBondContact O-N 3.18Å; S50-G53 PolarHBondContact O-N 3.45Å; G51-G53 PolarHBondContact O-N 3.06Å; G53-K56 PolarHBondContact O-N 2.91Å; G53-N57 VanDerWaalsContact O-CG 3.26Å; G53-N57 PolarHBondContact O-N 3.37Å; G53-N57 PolarHBondContact O-ND2 3.45Å
54	Q	97.3	Very high	96.2	Very high	115 Å²	115	64.5 Å²	64.5	54%	0.537	38%	0.379	S	S	.	.	H	α-helix	trans	-65.2	-46.4	176.5	-72.9	-179.4	79	0	0	111.9	S50 G51 K56 N57 I58	S50-Q54 WeakPolarHBondContact O-CB 3.48Å; S50-Q54 WeakPolarHBondContact O-CG 3.28Å; S50-Q54 PolarHBondContact O-N 3.41Å; S50-Q54 PolarHBondContact OG-NE2 3.42Å; G51-Q54 PolarHBondContact O-N 3.23Å; Q54-K56 VanDerWaalsContact C-N 3.32Å; Q54-K56 PolarHBondContact O-N 3.36Å; Q54-N57 PolarHBondContact O-N 2.93Å; Q54-N57 VanDerWaalsContact O-N 3.17Å; Q54-I58 WeakPolarHBondContact O-CG1 3.31Å; Q54-I58 PolarHBondContact O-N 3.18Å
55	A	97.1	Very high	96.3	Very high	44 Å²	44	63.6 Å²	63.6	36%	0.364	38%	0.377	S	S	.	.	H	α-helix	trans	-58.6	-44.8	176.7	0	0	0	0	0	111.3	G51 V52 N57 I58 I59	G51-A55 VanDerWaalsContact O-CB 3.31Å; G51-A55 WeakPolarHBondContact O-CB 3.44Å; G51-A55 PolarHBondContact O-N 3Å; V52-A55 PolarHBondContact O-N 2.96Å; A55-N57 PolarHBondContact O-N 2.82Å; A55-I58 PolarHBondContact O-N 2.94Å; A55-I59 WeakPolarHBondContact O-CB 3.23Å; A55-I59 WeakPolarHBondContact O-CD1 3.45Å; A55-I59 WeakPolarHBondContact O-CG1 3.29Å; A55-I59 PolarHBondContact O-N 3.38Å
56	K	96.1	Very high	96.4	Very high	45 Å²	45	69.2 Å²	69.2	20%	0.196	40%	0.399	C	S	.	.	H	α-helix	trans	-57.4	-47.3	174.7	179.4	179	178.3	178.7	0	111.5	V52 G53 Q54 I58 I59 L60 I101 Q102 V104	V52-K56 VanDerWaalsContact O-CB 3.23Å; V52-K56 WeakPolarHBondContact O-CB 3.27Å; V52-K56 PolarHBondContact O-N 3.16Å; G53-K56 PolarHBondContact O-N 2.91Å; Q54-K56 VanDerWaalsContact C-N 3.32Å; Q54-K56 PolarHBondContact O-N 3.36Å; K56-I58 PolarHBondContact O-N 2.9Å; K56-I59 PolarHBondContact O-N 2.88Å; K56-L60 HydrophobicContact CD-CD1 4.43Å; K56-L60 HydrophobicContact CG-CD1 3.65Å; K56-L60 HydrophobicContact CG-CG 4.4Å; K56-L60 WeakPolarHBondContact O-CB 3.3Å; K56-L60 VanDerWaalsContact O-CG 3.24Å; K56-L60 WeakPolarHBondContact O-CG 3.38Å; K56-L60 PolarHBondContact O-N 3.39Å; K56-I101 VanDerWaalsContact CE-O 3.23Å; K56-I101 WeakPolarHBondContact CE-O 3.24Å; K56-I101 HydrophobicContact CG-CG2 4.14Å; K56-Q102 WeakPolarHBondContact CE-O 3.39Å; K56-Q102 PolarHBondContact NZ-O 3.49Å; K56-V104 PolarHBondContact NZ-O 3.18Å
57	N	96.5	Very high	96.4	Very high	114 Å²	114	67.5 Å²	67.5	61%	0.61	40%	0.395	S	S	*	.	H	α-helix	trans	-64.1	-39.7	179	-70	-15	0	0	0	112.4	G53 Q54 A55 S61	G53-N57 VanDerWaalsContact O-CG 3.26Å; G53-N57 PolarHBondContact O-N 3.37Å; G53-N57 PolarHBondContact O-ND2 3.45Å; Q54-N57 PolarHBondContact O-N 2.93Å; Q54-N57 VanDerWaalsContact O-N 3.17Å; A55-N57 PolarHBondContact O-N 2.82Å; N57-S61 PolarHBondContact O-N 2.89Å; N57-S61 VanDerWaalsContact O-N 3.1Å
58	I	96.8	Very high	96.5	Very high	107 Å²	107	66.6 Å²	66.6	55%	0.549	38%	0.381	S	S	.	.	H	α-helix	trans	-65	-47.3	176	-68.2	165.7	0	0	0	110.2	Q54 A55 K56 L60 S61 T64	Q54-I58 WeakPolarHBondContact O-CG1 3.31Å; Q54-I58 PolarHBondContact O-N 3.18Å; A55-I58 PolarHBondContact O-N 2.94Å; K56-I58 PolarHBondContact O-N 2.9Å; I58-L60 VanDerWaalsContact C-N 3.33Å; I58-L60 PolarHBondContact O-N 3.39Å; I58-S61 WeakPolarHBondContact O-CB 3.27Å; I58-S61 PolarHBondContact O-N 3.01Å; I58-S61 PolarHBondContact O-OG 2.81Å; I58-T64 VanDerWaalsContact O-CB 3.28Å; I58-T64 WeakPolarHBondContact O-CB 3.46Å; I58-T64 PolarHBondContact O-OG1 2.83Å
59	I	96.3	Very high	96.4	Very high	62 Å²	62	67 Å²	67	32%	0.318	39%	0.385	S	S	.	.	H	α-helix	trans	-63.8	-40.7	-178.3	-67.5	163.4	0	0	0	111.3	A55 K56 S61 T64 L98 I101	A55-I59 WeakPolarHBondContact O-CB 3.23Å; A55-I59 WeakPolarHBondContact O-CD1 3.45Å; A55-I59 WeakPolarHBondContact O-CG1 3.29Å; A55-I59 PolarHBondContact O-N 3.38Å; K56-I59 PolarHBondContact O-N 2.88Å; I59-S61 VanDerWaalsContact C-N 3.27Å; I59-S61 PolarHBondContact O-N 3.23Å; I59-T64 WeakPolarHBondContact O-CB 3.19Å; I59-T64 WeakPolarHBondContact O-CG2 3.33Å; I59-L98 HydrophobicContact CG2-CD2 3.86Å; I59-I101 HydrophobicContact CD1-CD1 4.48Å; I59-I101 HydrophobicContact CG2-CD1 3.69Å; I59-I101 HydrophobicContact CG2-CG2 4.23Å
60	L	96	Very high	96.5	Very high	62 Å²	62	64.3 Å²	64.3	33%	0.325	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	0.2	180	-61.4	174.9	0	0	0	113.7	K56 I58 L98 I101 Q102	K56-L60 HydrophobicContact CD-CD1 4.43Å; K56-L60 HydrophobicContact CG-CD1 3.65Å; K56-L60 HydrophobicContact CG-CG 4.4Å; K56-L60 WeakPolarHBondContact O-CB 3.3Å; K56-L60 VanDerWaalsContact O-CG 3.24Å; K56-L60 WeakPolarHBondContact O-CG 3.38Å; K56-L60 PolarHBondContact O-N 3.39Å; I58-L60 VanDerWaalsContact C-N 3.33Å; I58-L60 PolarHBondContact O-N 3.39Å; L60-L98 HydrophobicContact CD2-CB 4.3Å; L60-L98 HydrophobicContact CD2-CD2 4.19Å; L60-L98 WeakPolarHBondContact CD2-O 3.36Å; L60-I101 HydrophobicContact CD1-CG2 4.4Å; L60-I101 HydrophobicContact CD2-CB 4.38Å; L60-I101 HydrophobicContact CD2-CG2 4.1Å; L60-I101 HydrophobicContact CG-CG2 4.13Å; L60-Q102 HydrophobicContact CD1-CB 4.13Å; L60-Q102 HydrophobicContact CD1-CG 4.37Å; L60-Q102 HydrophobicContact CD2-CB 4.41Å
61	S	96.6	Very high	96.5	Very high	32 Å²	32	69.6 Å²	69.6	22%	0.224	39%	0.39	C	S	.	.	S	Bend	trans	-67.8	150.6	178	70.1	0	0	0	0	111.6	N57 I58 I59 S63 T64 N65	N57-S61 PolarHBondContact O-N 2.89Å; N57-S61 VanDerWaalsContact O-N 3.1Å; I58-S61 WeakPolarHBondContact O-CB 3.27Å; I58-S61 PolarHBondContact O-N 3.01Å; I58-S61 PolarHBondContact O-OG 2.81Å; I59-S61 VanDerWaalsContact C-N 3.27Å; I59-S61 PolarHBondContact O-N 3.23Å; S61-S63 PolarHBondContact O-N 3.19Å; S61-S63 PolarHBondContact OG-OG 3.06Å; S61-S63 VanDerWaalsContact OG-OG 3.09Å; S61-T64 PolarHBondContact O-N 3.46Å; S61-T64 PolarHBondContact OG-N 2.84Å; S61-T64 PolarHBondContact OG-OG1 3.31Å; S61-N65 PolarHBondContact O-N 3.43Å
62	S	95	Very high	96.5	Very high	106 Å²	106	68.6 Å²	68.6	74%	0.741	38%	0.376	S	S	*	.	H	α-helix	trans	-60	-33	177.4	54.6	0	0	0	0	112.9	N65 K66	S62-N65 PolarHBondContact O-N 2.9Å; S62-K66 WeakPolarHBondContact O-CB 3.33Å; S62-K66 PolarHBondContact O-N 3.43Å
63	S	95.7	Very high	96.5	Very high	80 Å²	80	71.6 Å²	71.6	56%	0.559	39%	0.388	S	S	*	.	H	α-helix	trans	-67.6	-43.3	176.4	55.3	0	0	0	0	112.1	S61 K66 S67	S61-S63 PolarHBondContact O-N 3.19Å; S61-S63 PolarHBondContact OG-OG 3.06Å; S61-S63 VanDerWaalsContact OG-OG 3.09Å; S63-K66 PolarHBondContact O-N 3.12Å; S63-S67 PolarHBondContact O-N 3.17Å
64	T	95.6	Very high	96.5	Very high	36 Å²	36	74.9 Å²	74.9	22%	0.221	40%	0.401	C	S	.	.	H	α-helix	trans	-65.5	-41.8	174	-61.8	0	0	0	0	111.2	I58 I59 S61 K66 S67 I68	I58-T64 VanDerWaalsContact O-CB 3.28Å; I58-T64 WeakPolarHBondContact O-CB 3.46Å; I58-T64 PolarHBondContact O-OG1 2.83Å; I59-T64 WeakPolarHBondContact O-CB 3.19Å; I59-T64 WeakPolarHBondContact O-CG2 3.33Å; S61-T64 PolarHBondContact O-N 3.46Å; S61-T64 PolarHBondContact OG-N 2.84Å; S61-T64 PolarHBondContact OG-OG1 3.31Å; T64-K66 VanDerWaalsContact C-N 3.33Å; T64-K66 PolarHBondContact O-N 2.89Å; T64-S67 WeakPolarHBondContact O-CB 3.47Å; T64-S67 PolarHBondContact O-N 2.7Å; T64-S67 VanDerWaalsContact O-N 3.15Å; T64-I68 HydrophobicContact CG2-CD1 3.94Å; T64-I68 HydrophobicContact CG2-CG1 4.35Å; T64-I68 WeakPolarHBondContact O-CG1 3.14Å; T64-I68 PolarHBondContact O-N 3.31Å
65	N	94.4	Very high	96.5	Very high	74 Å²	74	75.1 Å²	75.1	40%	0.396	41%	0.406	S	S	.	.	H	α-helix	trans	-58.3	-45.7	176	-169.5	42.9	0	0	0	111.6	S61 S62 S67 I68 S69	S61-N65 PolarHBondContact O-N 3.43Å; S62-N65 PolarHBondContact O-N 2.9Å; N65-S67 PolarHBondContact O-N 3.09Å; N65-I68 PolarHBondContact O-N 2.96Å; N65-S69 PolarHBondContact O-N 3.21Å; N65-S69 PolarHBondContact O-OG 3.47Å
66	K	96	Very high	96.5	Very high	133 Å²	133	73.1 Å²	73.1	58%	0.578	39%	0.389	S	S	*	.	H	α-helix	trans	-58.5	-46.3	174	-174.4	-175	173.6	72.9	0	111.8	S62 S63 T64 I68 S69 D70	S62-K66 WeakPolarHBondContact O-CB 3.33Å; S62-K66 PolarHBondContact O-N 3.43Å; S63-K66 PolarHBondContact O-N 3.12Å; T64-K66 VanDerWaalsContact C-N 3.33Å; T64-K66 PolarHBondContact O-N 2.89Å; K66-I68 VanDerWaalsContact C-N 3.31Å; K66-I68 PolarHBondContact O-N 3.47Å; K66-S69 PolarHBondContact O-N 3.29Å; K66-D70 VanDerWaalsContact O-CG 3.26Å; K66-D70 PolarHBondContact O-N 2.89Å
67	S	96.6	Very high	96.5	Very high	53 Å²	53	75.6 Å²	75.6	37%	0.371	40%	0.402	S	S	.	.	H	α-helix	trans	-61	-38.3	177.8	-176.1	0	0	0	0	112.7	S63 T64 N65 R71	S63-S67 PolarHBondContact O-N 3.17Å; T64-S67 WeakPolarHBondContact O-CB 3.47Å; T64-S67 PolarHBondContact O-N 2.7Å; T64-S67 VanDerWaalsContact O-N 3.15Å; N65-S67 PolarHBondContact O-N 3.09Å; S67-R71 WeakPolarHBondContact O-CB 3.47Å; S67-R71 VanDerWaalsContact O-CG 3.25Å; S67-R71 WeakPolarHBondContact O-CG 3.23Å; S67-R71 PolarHBondContact O-N 2.66Å; S67-R71 VanDerWaalsContact O-N 3.08Å
68	I	96.7	Very high	96.4	Very high	46 Å²	46	80.6 Å²	80.6	24%	0.236	41%	0.413	C	S	.	.	H	α-helix	trans	-63.9	-48.5	173.5	-68.9	166.8	0	0	0	110	T64 N65 K66 D70 R71 I72 L98	T64-I68 HydrophobicContact CG2-CD1 3.94Å; T64-I68 HydrophobicContact CG2-CG1 4.35Å; T64-I68 WeakPolarHBondContact O-CG1 3.14Å; T64-I68 PolarHBondContact O-N 3.31Å; N65-I68 PolarHBondContact O-N 2.96Å; K66-I68 VanDerWaalsContact C-N 3.31Å; K66-I68 PolarHBondContact O-N 3.47Å; I68-D70 PolarHBondContact O-N 3.49Å; I68-R71 PolarHBondContact O-N 2.9Å; I68-I72 HydrophobicContact CG2-CD1 3.81Å; I68-I72 HydrophobicContact CG2-CG1 4.4Å; I68-I72 WeakPolarHBondContact O-CG1 3.2Å; I68-I72 PolarHBondContact O-N 3.41Å; I68-L98 HydrophobicContact CD1-CD2 4.27Å
69	S	96.7	Very high	96.2	Very high	33 Å²	33	78 Å²	78	23%	0.231	40%	0.401	C	S	.	.	H	α-helix	trans	-59.8	-46.3	178.5	-56.9	0	0	0	0	112.6	N65 K66 R71 I72 Q73	N65-S69 PolarHBondContact O-N 3.21Å; N65-S69 PolarHBondContact O-OG 3.47Å; K66-S69 PolarHBondContact O-N 3.29Å; S69-R71 VanDerWaalsContact C-N 3.26Å; S69-R71 PolarHBondContact O-N 2.92Å; S69-I72 PolarHBondContact O-N 2.81Å; S69-Q73 PolarHBondContact O-N 3.45Å
70	D	97.5	Very high	95.9	Very high	66 Å²	66	77.2 Å²	77.2	35%	0.353	41%	0.409	S	S	.	.	H	α-helix	trans	-61.2	-37.6	178.2	-66.1	-16.4	0	0	0	110.9	K66 I68 N74	K66-D70 VanDerWaalsContact O-CG 3.26Å; K66-D70 PolarHBondContact O-N 2.89Å; I68-D70 PolarHBondContact O-N 3.49Å; D70-N74 WeakPolarHBondContact O-CB 3.46Å; D70-N74 VanDerWaalsContact O-CG 3.28Å; D70-N74 PolarHBondContact O-N 2.97Å; D70-N74 PolarHBondContact O-ND2 3.5Å
71	R	97.4	Very high	95.6	Very high	172 Å²	172	77.1 Å²	77.1	65%	0.649	41%	0.412	S	S	*	.	H	α-helix	trans	-68.4	-42.9	174.9	-75.6	174.9	178.4	-147	-1	112.4	S67 I68 S69 Q73 N74 L75	S67-R71 WeakPolarHBondContact O-CB 3.47Å; S67-R71 VanDerWaalsContact O-CG 3.25Å; S67-R71 WeakPolarHBondContact O-CG 3.23Å; S67-R71 PolarHBondContact O-N 2.66Å; S67-R71 VanDerWaalsContact O-N 3.08Å; I68-R71 PolarHBondContact O-N 2.9Å; S69-R71 VanDerWaalsContact C-N 3.26Å; S69-R71 PolarHBondContact O-N 2.92Å; R71-Q73 VanDerWaalsContact C-N 3.34Å; R71-N74 PolarHBondContact O-N 3.31Å; R71-L75 WeakPolarHBondContact O-CB 3.28Å; R71-L75 VanDerWaalsContact O-CG 3.28Å; R71-L75 WeakPolarHBondContact O-CG 3.25Å; R71-L75 PolarHBondContact O-N 3.41Å
72	I	97.8	Very high	95.4	Very high	16 Å²	16	78.6 Å²	78.6	8%	0.082	41%	0.414	C	S	.	.	H	α-helix	trans	-58.3	-49.4	175.9	-72.3	171	0	0	0	109.8	I68 S69 N74 L75 C76 Q87 A90 Y91	I68-I72 HydrophobicContact CG2-CD1 3.81Å; I68-I72 HydrophobicContact CG2-CG1 4.4Å; I68-I72 WeakPolarHBondContact O-CG1 3.2Å; I68-I72 PolarHBondContact O-N 3.41Å; S69-I72 PolarHBondContact O-N 2.81Å; I72-N74 PolarHBondContact O-N 3.26Å; I72-L75 PolarHBondContact O-N 2.95Å; I72-C76 WeakPolarHBondContact O-CB 3.41Å; I72-C76 PolarHBondContact O-N 3.28Å; I72-C76 PolarHBondContact O-SG 3.28Å; I72-C76 VanDerWaalsContact O-SG 3.37Å; I72-Q87 HydrophobicContact CG2-CG 4.38Å; I72-A90 HydrophobicContact CB-CB 4.41Å; I72-A90 HydrophobicContact CD1-CB 4.05Å; I72-A90 HydrophobicContact CG1-CB 3.97Å; I72-A90 HydrophobicContact CG2-CB 3.63Å; I72-Y91 HydrophobicContact CB-CE1 4.12Å; I72-Y91 HydrophobicContact CD1-CD1 3.73Å; I72-Y91 HydrophobicContact CD1-CE1 3.91Å; I72-Y91 HydrophobicContact CG2-CD1 4.24Å; I72-Y91 HydrophobicContact CG2-CD2 4.4Å; I72-Y91 HydrophobicContact CG2-CE1 3.9Å; I72-Y91 HydrophobicContact CG2-CE2 4.09Å; I72-Y91 HydrophobicContact CG2-CG 4.46Å
73	Q	97.2	Very high	95.3	Very high	88 Å²	88	75.8 Å²	75.8	41%	0.411	39%	0.391	S	S	.	.	H	α-helix	trans	-58	-48.7	178.5	-172.6	179.6	5.8	0	0	111.3	S69 R71 L75 C76 M77	S69-Q73 PolarHBondContact O-N 3.45Å; R71-Q73 VanDerWaalsContact C-N 3.34Å; Q73-L75 PolarHBondContact O-N 3.01Å; Q73-C76 PolarHBondContact O-N 3.44Å; Q73-M77 HydrophobicContact CG-CE 4.34Å; Q73-M77 HydrophobicContact CG-SD 4.48Å; Q73-M77 WeakPolarHBondContact O-CB 3.34Å; Q73-M77 VanDerWaalsContact O-CG 3.27Å; Q73-M77 WeakPolarHBondContact O-CG 3.5Å; Q73-M77 PolarHBondContact O-N 3.46Å
74	N	97.1	Very high	95.3	Very high	89 Å²	89	75.1 Å²	75.1	48%	0.476	38%	0.384	S	S	.	.	H	α-helix	trans	-63.4	-37.4	-179.7	-76.5	-45.8	0	0	0	113.9	D70 R71 I72 M77	D70-N74 WeakPolarHBondContact O-CB 3.46Å; D70-N74 VanDerWaalsContact O-CG 3.28Å; D70-N74 PolarHBondContact O-N 2.97Å; D70-N74 PolarHBondContact O-ND2 3.5Å; R71-N74 PolarHBondContact O-N 3.31Å; I72-N74 PolarHBondContact O-N 3.26Å; N74-M77 HydrophobicContact CB-CE 4.47Å; N74-M77 WeakPolarHBondContact OD1-CE 3.41Å
75	L	97.2	Very high	95.1	Very high	120 Å²	120	73.6 Å²	73.6	63%	0.628	38%	0.375	S	S	*	.	H	α-helix	trans	-70.4	-46.4	176.6	-72.2	169.6	0	0	0	111	R71 I72 Q73 R78	R71-L75 WeakPolarHBondContact O-CB 3.28Å; R71-L75 VanDerWaalsContact O-CG 3.28Å; R71-L75 WeakPolarHBondContact O-CG 3.25Å; R71-L75 PolarHBondContact O-N 3.41Å; I72-L75 PolarHBondContact O-N 2.95Å; Q73-L75 PolarHBondContact O-N 3.01Å; L75-R78 WeakPolarHBondContact O-CB 3.33Å; L75-R78 PolarHBondContact O-N 3.45Å
76	C	97.5	Very high	95.2	Very high	2 Å²	2	71.7 Å²	71.7	1%	0.014	37%	0.367	C	S	.	.	H	α-helix	trans	-72.9	-27.4	-177	-66.3	0	0	0	0	113.4	I72 Q73 R78 T79 N83 C86 Q87	I72-C76 WeakPolarHBondContact O-CB 3.41Å; I72-C76 PolarHBondContact O-N 3.28Å; I72-C76 PolarHBondContact O-SG 3.28Å; I72-C76 VanDerWaalsContact O-SG 3.37Å; Q73-C76 PolarHBondContact O-N 3.44Å; C76-R78 PolarHBondContact O-N 2.79Å; C76-R78 VanDerWaalsContact O-N 3.08Å; C76-T79 PolarHBondContact O-N 3.06Å; C76-T79 PolarHBondContact O-OG1 3.42Å; C76-N83 WeakPolarHBondContact CB-OD1 3.35Å; C76-N83 WeakPolarHBondContact O-CA 3.27Å; C76-N83 PolarHBondContact O-OD1 2.92Å; C76-C86 WeakPolarHBondContact CA-SG 3.29Å; C76-C86 HydrophobicContact CB-CB 3.64Å; C76-C86 WeakPolarHBondContact CB-SG 3.35Å; C76-C86 WeakPolarHBondContact SG-CB 3.45Å; C76-C86 CovalentContact SG-SG 2.05Å; C76-C86 PolarHBondContact SG-SG 2.95Å; C76-Q87 HydrophobicContact CB-CG 3.51Å; C76-Q87 PolarHBondContact SG-N 3.1Å
77	M	96.2	Very high	95.3	Very high	97 Å²	97	67.5 Å²	67.5	48%	0.478	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-58.1	-25.6	171.8	-79.1	-171.1	-61.7	0	0	112.9	Q73 N74 T79 N83	Q73-M77 HydrophobicContact CG-CE 4.34Å; Q73-M77 HydrophobicContact CG-SD 4.48Å; Q73-M77 WeakPolarHBondContact O-CB 3.34Å; Q73-M77 VanDerWaalsContact O-CG 3.27Å; Q73-M77 WeakPolarHBondContact O-CG 3.5Å; Q73-M77 PolarHBondContact O-N 3.46Å; N74-M77 HydrophobicContact CB-CE 4.47Å; N74-M77 WeakPolarHBondContact OD1-CE 3.41Å; M77-T79 VanDerWaalsContact C-N 3.34Å; M77-N83 PolarHBondContact N-OD1 2.9Å
78	R	94.3	Very high	95.2	Very high	219 Å²	219	68 Å²	68	83%	0.826	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-83.1	-7.6	178.9	-58.9	179.9	-177.5	-155.5	-1.4	113.6	L75 C76 G80	L75-R78 WeakPolarHBondContact O-CB 3.33Å; L75-R78 PolarHBondContact O-N 3.45Å; C76-R78 PolarHBondContact O-N 2.79Å; C76-R78 VanDerWaalsContact O-N 3.08Å; R78-G80 VanDerWaalsContact C-N 3.25Å; R78-G80 PolarHBondContact O-N 3.24Å
79	T	93.1	Very high	95.1	Very high	51 Å²	51	68.5 Å²	68.5	31%	0.313	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-86.2	3.8	-178.4	67.6	0	0	0	0	113	C76 M77 P81 F82 N83 C86	C76-T79 PolarHBondContact O-N 3.06Å; C76-T79 PolarHBondContact O-OG1 3.42Å; M77-T79 VanDerWaalsContact C-N 3.34Å; T79-P81 WeakPolarHBondContact O-CD 3.33Å; T79-F82 PolarHBondContact O-N 3.36Å; T79-F82 PolarHBondContact OG1-O 2.78Å; T79-F82 VanDerWaalsContact OG1-O 3.1Å; T79-N83 VanDerWaalsContact OG1-CA 3.3Å; T79-N83 WeakPolarHBondContact OG1-CA 3.39Å; T79-N83 PolarHBondContact OG1-N 3.16Å; T79-N83 VanDerWaalsContact OG1-N 3.15Å; T79-C86 HydrophobicContact CG2-CB 4.24Å
80	G	89.5	Confident	95.1	Very high	46 Å²	46	68 Å²	68	47%	0.474	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	61.8	-119.7	174.6	0	0	0	0	0	111.8	R78 F82 N83	R78-G80 VanDerWaalsContact C-N 3.25Å; R78-G80 PolarHBondContact O-N 3.24Å; G80-F82 PolarHBondContact O-N 3.22Å; G80-F82 VanDerWaalsContact O-N 3.09Å; G80-N83 WeakPolarHBondContact O-CB 3.31Å; G80-N83 PolarHBondContact O-N 3.44Å
81	P	88.5	Confident	95	Very high	60 Å²	60	68.6 Å²	68.6	39%	0.39	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-61.5	-19	-179.4	27.2	-34.6	0	0	0	112.9	T79 N151 M155	T79-P81 WeakPolarHBondContact O-CD 3.33Å; P81-N151 VanDerWaalsContact O-CB 3.25Å; P81-N151 WeakPolarHBondContact O-CB 3.21Å; P81-N151 PolarHBondContact O-ND2 3.04Å; P81-N151 PolarHBondContact O-OD1 2.87Å; P81-N151 VanDerWaalsContact O-OD1 3.07Å; P81-M155 HydrophobicContact CG-CG 4.3Å
82	F	92.7	Very high	94.8	Very high	63 Å²	63	64.9 Å²	64.9	28%	0.276	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-94.1	15.3	-179.1	-53.1	-68.3	0	0	0	113.7	T79 G80 T84 S85 C86 L148 N151 M155	T79-F82 PolarHBondContact O-N 3.36Å; T79-F82 PolarHBondContact OG1-O 2.78Å; T79-F82 VanDerWaalsContact OG1-O 3.1Å; G80-F82 PolarHBondContact O-N 3.22Å; G80-F82 VanDerWaalsContact O-N 3.09Å; F82-T84 PolarHBondContact O-N 2.95Å; F82-S85 PolarHBondContact O-OG 3.19Å; F82-C86 WeakPolarHBondContact O-CB 3.32Å; F82-C86 PolarHBondContact O-N 2.86Å; F82-L148 HydrophobicContact CD1-CD1 3.73Å; F82-L148 HydrophobicContact CE1-CD1 4.01Å; F82-N151 HydrophobicContact CD1-CB 4.02Å; F82-N151 HydrophobicContact CE1-CB 4.34Å; F82-M155 HydrophobicContact CE2-SD 4.37Å; F82-M155 HydrophobicContact CZ-SD 3.77Å
83	N	94.6	Very high	94.6	Very high	47 Å²	47	66.3 Å²	66.3	25%	0.251	34%	0.34	S	S	.	.	H	α-helix	trans	-56.9	-50.3	-176.5	179.1	23.5	0	0	0	111.5	C76 M77 T79 G80 C86 Q87	C76-N83 WeakPolarHBondContact CB-OD1 3.35Å; C76-N83 WeakPolarHBondContact O-CA 3.27Å; C76-N83 PolarHBondContact O-OD1 2.92Å; M77-N83 PolarHBondContact N-OD1 2.9Å; T79-N83 VanDerWaalsContact OG1-CA 3.3Å; T79-N83 WeakPolarHBondContact OG1-CA 3.39Å; T79-N83 PolarHBondContact OG1-N 3.16Å; T79-N83 VanDerWaalsContact OG1-N 3.15Å; G80-N83 WeakPolarHBondContact O-CB 3.31Å; G80-N83 PolarHBondContact O-N 3.44Å; N83-C86 PolarHBondContact O-N 3.29Å; N83-Q87 WeakPolarHBondContact O-CG 3.4Å; N83-Q87 PolarHBondContact O-N 3.22Å; N83-Q87 PolarHBondContact OD1-NE2 3.48Å
84	T	93.8	Very high	94.5	Very high	66 Å²	66	63.1 Å²	63.1	41%	0.405	33%	0.327	S	S	.	.	H	α-helix	trans	-65	-50	-178.4	-49.6	0	0	0	0	112.2	F82 C86 Q87 M88 E147	F82-T84 PolarHBondContact O-N 2.95Å; T84-C86 VanDerWaalsContact C-N 3.32Å; T84-C86 PolarHBondContact O-N 3.29Å; T84-Q87 PolarHBondContact O-N 3.33Å; T84-Q87 VanDerWaalsContact O-N 3.15Å; T84-M88 HydrophobicContact CG2-SD 4.27Å; T84-M88 WeakPolarHBondContact O-CG 3.41Å; T84-M88 PolarHBondContact O-N 3.46Å; T84-E147 WeakPolarHBondContact CB-OE1 3.35Å; T84-E147 HydrophobicContact CG2-CG 3.9Å; T84-E147 VanDerWaalsContact CG2-OE1 3.3Å; T84-E147 WeakPolarHBondContact CG2-OE1 3.34Å
85	S	93.2	Very high	94.4	Very high	4 Å²	4	61.3 Å²	61.3	3%	0.028	32%	0.322	C	S	.	.	H	α-helix	trans	-62.9	-39.1	179.3	55.9	0	0	0	0	111.8	F82 Q87 M88 F89 F144	F82-S85 PolarHBondContact O-OG 3.19Å; S85-Q87 PolarHBondContact O-N 3.19Å; S85-M88 PolarHBondContact O-N 3.44Å; S85-F89 PolarHBondContact O-N 3.49Å; S85-F144 VanDerWaalsContact O-CE2 3.31Å; S85-F144 WeakPolarHBondContact O-CE2 3.19Å
86	C	96	Very high	94.1	Very high	34 Å²	34	57.4 Å²	57.4	23%	0.23	30%	0.302	C	S	.	.	H	α-helix	trans	-57	-49	172.2	174.6	0	0	0	0	111.7	C76 T79 F82 N83 T84 F89 A90	C76-C86 WeakPolarHBondContact CA-SG 3.29Å; C76-C86 HydrophobicContact CB-CB 3.64Å; C76-C86 WeakPolarHBondContact CB-SG 3.35Å; C76-C86 WeakPolarHBondContact SG-CB 3.45Å; C76-C86 CovalentContact SG-SG 2.05Å; C76-C86 PolarHBondContact SG-SG 2.95Å; T79-C86 HydrophobicContact CG2-CB 4.24Å; F82-C86 WeakPolarHBondContact O-CB 3.32Å; F82-C86 PolarHBondContact O-N 2.86Å; N83-C86 PolarHBondContact O-N 3.29Å; T84-C86 VanDerWaalsContact C-N 3.32Å; T84-C86 PolarHBondContact O-N 3.29Å; C86-F89 PolarHBondContact O-N 2.87Å; C86-A90 VanDerWaalsContact O-CB 3.27Å; C86-A90 WeakPolarHBondContact O-CB 3.44Å; C86-A90 PolarHBondContact O-N 2.88Å
87	Q	97.1	Very high	93.9	Very high	46 Å²	46	61.3 Å²	61.3	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-45.6	179.9	-74	-175.5	33.6	0	0	111.2	I72 C76 N83 T84 S85 F89 A90 Y91	I72-Q87 HydrophobicContact CG2-CG 4.38Å; C76-Q87 HydrophobicContact CB-CG 3.51Å; C76-Q87 PolarHBondContact SG-N 3.1Å; N83-Q87 WeakPolarHBondContact O-CG 3.4Å; N83-Q87 PolarHBondContact O-N 3.22Å; N83-Q87 PolarHBondContact OD1-NE2 3.48Å; T84-Q87 PolarHBondContact O-N 3.33Å; T84-Q87 VanDerWaalsContact O-N 3.15Å; S85-Q87 PolarHBondContact O-N 3.19Å; Q87-F89 PolarHBondContact O-N 3.31Å; Q87-A90 PolarHBondContact O-N 2.96Å; Q87-Y91 HydrophobicContact CB-CD2 4.01Å; Q87-Y91 HydrophobicContact CB-CE2 3.83Å; Q87-Y91 HydrophobicContact CG-CE2 4.28Å; Q87-Y91 WeakPolarHBondContact O-CB 3.37Å; Q87-Y91 WeakPolarHBondContact O-CD2 3.33Å; Q87-Y91 PolarHBondContact O-N 3.4Å
88	M	94.8	Very high	93.8	Very high	64 Å²	64	57.8 Å²	57.8	32%	0.315	31%	0.305	S	S	.	.	H	α-helix	trans	-56.2	-49.8	177.4	-71.6	174.1	60.2	0	0	111.8	T84 S85 E92 N143 E147	T84-M88 HydrophobicContact CG2-SD 4.27Å; T84-M88 WeakPolarHBondContact O-CG 3.41Å; T84-M88 PolarHBondContact O-N 3.46Å; S85-M88 PolarHBondContact O-N 3.44Å; M88-E92 WeakPolarHBondContact O-CB 2.98Å; M88-E92 PolarHBondContact O-N 2.74Å; M88-N143 HydrophobicContact CE-CB 3.75Å; M88-E147 HydrophobicContact SD-CB 4Å; M88-E147 HydrophobicContact SD-CG 3.84Å
89	F	94.3	Very high	93.8	Very high	55 Å²	55	50.5 Å²	50.5	24%	0.241	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-48.5	177.9	174.7	-101.1	0	0	0	112.1	S85 C86 Q87 E92 L93 I138 L139 F144	S85-F89 PolarHBondContact O-N 3.49Å; C86-F89 PolarHBondContact O-N 2.87Å; Q87-F89 PolarHBondContact O-N 3.31Å; F89-E92 PolarHBondContact O-N 3Å; F89-L93 HydrophobicContact CE1-CD2 3.98Å; F89-L93 HydrophobicContact CZ-CD2 4.02Å; F89-L93 VanDerWaalsContact O-CB 3.27Å; F89-L93 WeakPolarHBondContact O-CB 3.43Å; F89-L93 PolarHBondContact O-N 3.3Å; F89-I138 HydrophobicContact CD2-CB 4.42Å; F89-I138 HydrophobicContact CD2-CG2 3.59Å; F89-I138 HydrophobicContact CE2-CG2 4.14Å; F89-L139 HydrophobicContact CD2-CD2 3.7Å; F89-L139 HydrophobicContact CD2-CG 4.33Å; F89-L139 HydrophobicContact CE2-CD2 3.72Å; F89-L139 HydrophobicContact CE2-CG 4Å; F89-F144 HydrophobicContact CB-CD2 4.14Å; F89-F144 HydrophobicContact CB-CE2 3.64Å; F89-F144 HydrophobicContact CB-CZ 4.43Å; F89-F144 HydrophobicContact CG-CE2 4.47Å
90	A	96.2	Very high	93.7	Very high	22 Å²	22	51.9 Å²	51.9	18%	0.182	29%	0.291	C	S	.	.	H	α-helix	trans	-66.3	-40.4	-176.6	0	0	0	0	0	112.2	I72 C86 Q87 S94	I72-A90 HydrophobicContact CB-CB 4.41Å; I72-A90 HydrophobicContact CD1-CB 4.05Å; I72-A90 HydrophobicContact CG1-CB 3.97Å; I72-A90 HydrophobicContact CG2-CB 3.63Å; C86-A90 VanDerWaalsContact O-CB 3.27Å; C86-A90 WeakPolarHBondContact O-CB 3.44Å; C86-A90 PolarHBondContact O-N 2.88Å; Q87-A90 PolarHBondContact O-N 2.96Å; A90-S94 WeakPolarHBondContact O-CB 3.38Å; A90-S94 PolarHBondContact O-N 3.41Å; A90-S94 PolarHBondContact O-OG 2.84Å
91	Y	96.2	Very high	93.9	Very high	80 Å²	80	51.5 Å²	51.5	31%	0.314	28%	0.277	S	S	.	.	H	α-helix	trans	-65.4	-47.6	176.3	-74.8	-51.6	0	0	0	111.5	I72 Q87 L93 S94 S95	I72-Y91 HydrophobicContact CB-CE1 4.12Å; I72-Y91 HydrophobicContact CD1-CD1 3.73Å; I72-Y91 HydrophobicContact CD1-CE1 3.91Å; I72-Y91 HydrophobicContact CG2-CD1 4.24Å; I72-Y91 HydrophobicContact CG2-CD2 4.4Å; I72-Y91 HydrophobicContact CG2-CE1 3.9Å; I72-Y91 HydrophobicContact CG2-CE2 4.09Å; I72-Y91 HydrophobicContact CG2-CG 4.46Å; Q87-Y91 HydrophobicContact CB-CD2 4.01Å; Q87-Y91 HydrophobicContact CB-CE2 3.83Å; Q87-Y91 HydrophobicContact CG-CE2 4.28Å; Q87-Y91 WeakPolarHBondContact O-CB 3.37Å; Q87-Y91 WeakPolarHBondContact O-CD2 3.33Å; Q87-Y91 PolarHBondContact O-N 3.4Å; Y91-L93 PolarHBondContact O-N 3.44Å; Y91-S94 WeakPolarHBondContact CA-OG 3.34Å; Y91-S94 PolarHBondContact O-N 2.81Å; Y91-S94 PolarHBondContact O-OG 3.18Å; Y91-S95 WeakPolarHBondContact O-CB 3.31Å; Y91-S95 PolarHBondContact O-N 2.89Å
92	E	94.1	Very high	94.2	Very high	93 Å²	93	54.3 Å²	54.3	44%	0.435	29%	0.285	S	S	.	.	H	α-helix	trans	-60.2	-46.3	177.7	-173.3	58	-144.4	0	0	111.2	M88 F89 S94 S95 N96 I138	M88-E92 WeakPolarHBondContact O-CB 2.98Å; M88-E92 PolarHBondContact O-N 2.74Å; F89-E92 PolarHBondContact O-N 3Å; E92-S94 PolarHBondContact O-N 3.39Å; E92-S95 PolarHBondContact O-N 3.39Å; E92-N96 PolarHBondContact O-N 2.9Å; E92-N96 PolarHBondContact O-ND2 3.34Å; E92-N96 PolarHBondContact OE1-ND2 3.4Å; E92-I138 HydrophobicContact CB-CD1 4.36Å; E92-I138 HydrophobicContact CB-CG2 4.16Å; E92-I138 HydrophobicContact CG-CB 4.48Å; E92-I138 HydrophobicContact CG-CD1 3.74Å; E92-I138 HydrophobicContact CG-CG1 3.67Å; E92-I138 HydrophobicContact CG-CG2 3.99Å
93	L	92.7	Very high	94.3	Very high	47 Å²	47	59.2 Å²	59.2	25%	0.246	31%	0.307	C	S	.	.	H	α-helix	trans	-62.5	-45.6	176.5	-178.6	60.2	0	0	0	111.7	F89 Y91 S95 N96 I97	F89-L93 HydrophobicContact CE1-CD2 3.98Å; F89-L93 HydrophobicContact CZ-CD2 4.02Å; F89-L93 VanDerWaalsContact O-CB 3.27Å; F89-L93 WeakPolarHBondContact O-CB 3.43Å; F89-L93 PolarHBondContact O-N 3.3Å; Y91-L93 PolarHBondContact O-N 3.44Å; L93-S95 PolarHBondContact O-N 3.41Å; L93-N96 PolarHBondContact O-N 3.24Å; L93-I97 HydrophobicContact CD1-CD1 4.23Å; L93-I97 HydrophobicContact CD1-CG1 4.47Å; L93-I97 HydrophobicContact CG-CD1 3.99Å; L93-I97 WeakPolarHBondContact O-CG1 3.42Å; L93-I97 PolarHBondContact O-N 3.03Å
94	S	94.9	Very high	94.1	Very high	20 Å²	20	59 Å²	59	14%	0.14	31%	0.306	C	S	.	.	H	α-helix	trans	-62.5	-41.5	179.5	73	0	0	0	0	112.1	A90 Y91 E92 N96 I97 L98	A90-S94 WeakPolarHBondContact O-CB 3.38Å; A90-S94 PolarHBondContact O-N 3.41Å; A90-S94 PolarHBondContact O-OG 2.84Å; Y91-S94 WeakPolarHBondContact CA-OG 3.34Å; Y91-S94 PolarHBondContact O-N 2.81Å; Y91-S94 PolarHBondContact O-OG 3.18Å; E92-S94 PolarHBondContact O-N 3.39Å; S94-N96 PolarHBondContact O-N 3.41Å; S94-I97 PolarHBondContact O-N 2.87Å; S94-L98 WeakPolarHBondContact O-CG 3.23Å; S94-L98 PolarHBondContact O-N 3.21Å
95	S	94.4	Very high	94.1	Very high	52 Å²	52	59.2 Å²	59.2	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-59.8	-46.8	175.3	179.3	0	0	0	0	111.1	Y91 E92 L93 I97 L98 N99	Y91-S95 WeakPolarHBondContact O-CB 3.31Å; Y91-S95 PolarHBondContact O-N 2.89Å; E92-S95 PolarHBondContact O-N 3.39Å; L93-S95 PolarHBondContact O-N 3.41Å; S95-I97 VanDerWaalsContact C-N 3.34Å; S95-I97 PolarHBondContact O-N 3.46Å; S95-L98 PolarHBondContact O-N 3.46Å; S95-N99 WeakPolarHBondContact O-CB 3.46Å; S95-N99 PolarHBondContact O-N 3.17Å; S95-N99 PolarHBondContact O-ND2 3.02Å
96	N	91.8	Very high	94.1	Very high	37 Å²	37	60.6 Å²	60.6	20%	0.198	32%	0.316	C	S	.	.	H	α-helix	trans	-63.7	-36.6	176.8	-77.8	-65.8	0	0	0	113.2	E92 L93 S94 T100 L134	E92-N96 PolarHBondContact O-N 2.9Å; E92-N96 PolarHBondContact O-ND2 3.34Å; E92-N96 PolarHBondContact OE1-ND2 3.4Å; L93-N96 PolarHBondContact O-N 3.24Å; S94-N96 PolarHBondContact O-N 3.41Å; N96-T100 WeakPolarHBondContact O-CB 3.36Å; N96-T100 PolarHBondContact O-N 3.4Å; N96-T100 PolarHBondContact O-OG1 3.46Å; N96-L134 HydrophobicContact CB-CD2 3.8Å
97	I	93.1	Very high	93.9	Very high	84 Å²	84	61.5 Å²	61.5	43%	0.431	32%	0.317	S	S	.	.	H	α-helix	trans	-65.7	-48.7	173.7	-69.4	166.6	0	0	0	110.5	L93 S94 S95 N99 T100 I101	L93-I97 HydrophobicContact CD1-CD1 4.23Å; L93-I97 HydrophobicContact CD1-CG1 4.47Å; L93-I97 HydrophobicContact CG-CD1 3.99Å; L93-I97 WeakPolarHBondContact O-CG1 3.42Å; L93-I97 PolarHBondContact O-N 3.03Å; S94-I97 PolarHBondContact O-N 2.87Å; S95-I97 VanDerWaalsContact C-N 3.34Å; S95-I97 PolarHBondContact O-N 3.46Å; I97-N99 VanDerWaalsContact C-N 3.33Å; I97-N99 PolarHBondContact O-N 3.46Å; I97-T100 WeakPolarHBondContact O-CA 3.46Å; I97-T100 WeakPolarHBondContact O-CB 3.35Å; I97-T100 PolarHBondContact O-N 3.49Å; I97-T100 VanDerWaalsContact O-N 3.11Å; I97-I101 HydrophobicContact CG2-CD1 3.87Å; I97-I101 HydrophobicContact CG2-CG1 4.44Å; I97-I101 WeakPolarHBondContact O-CG1 3.36Å; I97-I101 PolarHBondContact O-N 3.43Å
98	L	94.9	Very high	93.6	Very high	24 Å²	24	64.3 Å²	64.3	13%	0.126	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-41.1	178.6	-68.3	174.1	0	0	0	111.5	I59 L60 I68 S94 S95 T100 I101 Q102	I59-L98 HydrophobicContact CG2-CD2 3.86Å; L60-L98 HydrophobicContact CD2-CB 4.3Å; L60-L98 HydrophobicContact CD2-CD2 4.19Å; L60-L98 WeakPolarHBondContact CD2-O 3.36Å; I68-L98 HydrophobicContact CD1-CD2 4.27Å; S94-L98 WeakPolarHBondContact O-CG 3.23Å; S94-L98 PolarHBondContact O-N 3.21Å; S95-L98 PolarHBondContact O-N 3.46Å; L98-T100 VanDerWaalsContact C-N 3.31Å; L98-T100 PolarHBondContact O-N 3.21Å; L98-I101 PolarHBondContact O-N 3.11Å; L98-Q102 WeakPolarHBondContact O-CB 3.47Å; L98-Q102 PolarHBondContact O-N 2.84Å
99	N	93.8	Very high	93.5	Very high	65 Å²	65	64.4 Å²	64.4	35%	0.348	33%	0.33	S	S	.	.	H	α-helix	trans	-62.5	-37.8	173.8	-72.9	-27.5	0	0	0	112.2	S95 I97 Q102 K103	S95-N99 WeakPolarHBondContact O-CB 3.46Å; S95-N99 PolarHBondContact O-N 3.17Å; S95-N99 PolarHBondContact O-ND2 3.02Å; I97-N99 VanDerWaalsContact C-N 3.33Å; I97-N99 PolarHBondContact O-N 3.46Å; N99-Q102 PolarHBondContact O-N 2.84Å; N99-K103 WeakPolarHBondContact O-CG 3.47Å; N99-K103 PolarHBondContact O-N 2.83Å
100	T	91.5	Very high	93.4	Very high	81 Å²	81	61.8 Å²	61.8	50%	0.497	32%	0.319	S	S	.	.	H	α-helix	trans	-64.4	-46.2	173.1	-61.9	0	0	0	0	111	N96 I97 L98 Q102 K103 V104	N96-T100 WeakPolarHBondContact O-CB 3.36Å; N96-T100 PolarHBondContact O-N 3.4Å; N96-T100 PolarHBondContact O-OG1 3.46Å; I97-T100 WeakPolarHBondContact O-CA 3.46Å; I97-T100 WeakPolarHBondContact O-CB 3.35Å; I97-T100 PolarHBondContact O-N 3.49Å; I97-T100 VanDerWaalsContact O-N 3.11Å; L98-T100 VanDerWaalsContact C-N 3.31Å; L98-T100 PolarHBondContact O-N 3.21Å; T100-Q102 VanDerWaalsContact C-N 3.3Å; T100-Q102 PolarHBondContact O-N 3.03Å; T100-K103 PolarHBondContact O-N 2.87Å; T100-V104 PolarHBondContact O-N 2.79Å
101	I	94.2	Very high	93.2	Very high	38 Å²	38	60.7 Å²	60.7	20%	0.195	31%	0.31	C	S	.	.	H	α-helix	trans	-62.5	-38.2	177.8	-68.3	173.5	0	0	0	111.1	K56 I59 L60 I97 L98 K103 V104	K56-I101 VanDerWaalsContact CE-O 3.23Å; K56-I101 WeakPolarHBondContact CE-O 3.24Å; K56-I101 HydrophobicContact CG-CG2 4.14Å; I59-I101 HydrophobicContact CD1-CD1 4.48Å; I59-I101 HydrophobicContact CG2-CD1 3.69Å; I59-I101 HydrophobicContact CG2-CG2 4.23Å; L60-I101 HydrophobicContact CD1-CG2 4.4Å; L60-I101 HydrophobicContact CD2-CB 4.38Å; L60-I101 HydrophobicContact CD2-CG2 4.1Å; L60-I101 HydrophobicContact CG-CG2 4.13Å; I97-I101 HydrophobicContact CG2-CD1 3.87Å; I97-I101 HydrophobicContact CG2-CG1 4.44Å; I97-I101 WeakPolarHBondContact O-CG1 3.36Å; I97-I101 PolarHBondContact O-N 3.43Å; L98-I101 PolarHBondContact O-N 3.11Å; I101-K103 PolarHBondContact O-N 2.97Å; I101-V104 VanDerWaalsContact O-CB 3.3Å; I101-V104 WeakPolarHBondContact O-CB 3.49Å; I101-V104 PolarHBondContact O-N 3.42Å
102	Q	94.9	Very high	92.7	Very high	119 Å²	119	59.5 Å²	59.5	56%	0.556	31%	0.311	S	S	*	.	H	α-helix	trans	-58.7	-32.3	174.4	-169.9	-178.7	5.5	0	0	112.5	K56 L60 L98 N99 T100	K56-Q102 WeakPolarHBondContact CE-O 3.39Å; K56-Q102 PolarHBondContact NZ-O 3.49Å; L60-Q102 HydrophobicContact CD1-CB 4.13Å; L60-Q102 HydrophobicContact CD1-CG 4.37Å; L60-Q102 HydrophobicContact CD2-CB 4.41Å; L98-Q102 WeakPolarHBondContact O-CB 3.47Å; L98-Q102 PolarHBondContact O-N 2.84Å; N99-Q102 PolarHBondContact O-N 2.84Å; T100-Q102 VanDerWaalsContact C-N 3.3Å; T100-Q102 PolarHBondContact O-N 3.03Å
103	K	92.9	Very high	92.4	Very high	166 Å²	166	61.1 Å²	61.1	72%	0.722	32%	0.317	S	S	*	.	H	α-helix	trans	-84.9	-8.5	178.3	-64.6	170	-172.2	175.9	0	113.6	N99 T100 I101 V105	N99-K103 WeakPolarHBondContact O-CG 3.47Å; N99-K103 PolarHBondContact O-N 2.83Å; T100-K103 PolarHBondContact O-N 2.87Å; I101-K103 PolarHBondContact O-N 2.97Å; K103-V105 PolarHBondContact O-N 2.86Å
104	V	92.3	Very high	92.1	Very high	41 Å²	41	63 Å²	63	25%	0.248	33%	0.327	C	S	.	.			trans	-61.1	125.8	177	171	0	0	0	0	110.1	V52 K56 T100 I101 L109	V52-V104 HydrophobicContact CG1-CG1 4.12Å; K56-V104 PolarHBondContact NZ-O 3.18Å; T100-V104 PolarHBondContact O-N 2.79Å; I101-V104 VanDerWaalsContact O-CB 3.3Å; I101-V104 WeakPolarHBondContact O-CB 3.49Å; I101-V104 PolarHBondContact O-N 3.42Å; V104-L109 HydrophobicContact CG1-CB 4.18Å; V104-L109 HydrophobicContact CG1-CD2 3.95Å
105	V	92.4	Very high	91.9	Very high	72 Å²	72	65.9 Å²	65.9	44%	0.436	34%	0.337	S	S	.	.			trans	-99.2	115.7	171.5	178.7	0	0	0	0	108	K103 Q107 K108 L109	K103-V105 PolarHBondContact O-N 2.86Å; V105-Q107 VanDerWaalsContact C-N 3.28Å; V105-Q107 HydrophobicContact CG1-CB 4.3Å; V105-Q107 PolarHBondContact O-N 3.47Å; V105-K108 HydrophobicContact CB-CB 4.27Å; V105-K108 HydrophobicContact CB-CD 4.33Å; V105-K108 HydrophobicContact CB-CG 4.21Å; V105-K108 HydrophobicContact CG1-CG 4.23Å; V105-K108 PolarHBondContact O-N 3.47Å; V105-L109 PolarHBondContact O-N 2.9Å; V105-L109 VanDerWaalsContact O-N 3.11Å
106	P	93.8	Very high	91.8	Very high	32 Å²	32	63.6 Å²	63.6	21%	0.208	32%	0.321	C	S	.	.	H	α-helix	trans	-52.9	-40.7	-175.5	-29.9	35	0	0	0	114.7	R49 V52 K108 L109 C110	R49-P106 HydrophobicContact CB-CB 4.23Å; R49-P106 HydrophobicContact CG-CB 4.33Å; V52-P106 HydrophobicContact CB-CB 4.06Å; V52-P106 HydrophobicContact CG1-CB 3.89Å; V52-P106 HydrophobicContact CG1-CG 4.05Å; P106-K108 PolarHBondContact O-N 3.35Å; P106-L109 PolarHBondContact O-N 3.44Å; P106-C110 VanDerWaalsContact O-CB 3.28Å; P106-C110 WeakPolarHBondContact O-CB 3.35Å; P106-C110 PolarHBondContact O-N 3.49Å; P106-C110 PolarHBondContact O-SG 3.44Å
107	Q	92.6	Very high	91.6	Very high	53 Å²	53	67.4 Å²	67.4	25%	0.248	33%	0.334	C	S	.	.	H	α-helix	trans	-56	-52.5	176.1	178.5	70.9	22.5	0	0	111.7	R49 V105 C110 A111 Y117	R49-Q107 VanDerWaalsContact CD-OE1 3.27Å; V105-Q107 VanDerWaalsContact C-N 3.28Å; V105-Q107 HydrophobicContact CG1-CB 4.3Å; V105-Q107 PolarHBondContact O-N 3.47Å; Q107-C110 PolarHBondContact O-N 2.85Å; Q107-A111 WeakPolarHBondContact O-CB 3.44Å; Q107-A111 PolarHBondContact O-N 2.97Å; Q107-Y117 PolarHBondContact NE2-O 2.9Å
108	K	91.1	Very high	90.9	Very high	106 Å²	106	68.8 Å²	68.8	46%	0.461	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-43.8	-176.3	-69.1	-171.1	173.9	-171	0	111.4	V105 P106 A111 T112 P120	V105-K108 HydrophobicContact CB-CB 4.27Å; V105-K108 HydrophobicContact CB-CD 4.33Å; V105-K108 HydrophobicContact CB-CG 4.21Å; V105-K108 HydrophobicContact CG1-CG 4.23Å; V105-K108 PolarHBondContact O-N 3.47Å; P106-K108 PolarHBondContact O-N 3.35Å; K108-A111 PolarHBondContact O-N 3.31Å; K108-T112 PolarHBondContact O-N 2.94Å; K108-T112 PolarHBondContact O-OG1 2.91Å; K108-T112 VanDerWaalsContact O-OG1 3.07Å; K108-P120 HydrophobicContact CB-CG 4.07Å; K108-P120 WeakPolarHBondContact O-CD 3.39Å
109	L	91.3	Very high	89.7	Confident	65 Å²	65	71.4 Å²	71.4	34%	0.34	36%	0.36	S	S	.	.	H	α-helix	trans	-63	-44.3	176.9	-175.8	63.5	0	0	0	111.5	V52 V104 V105 P106 A111 T112 F113	V52-L109 HydrophobicContact CG1-CD2 3.76Å; V52-L109 HydrophobicContact CG2-CD2 3.92Å; V104-L109 HydrophobicContact CG1-CB 4.18Å; V104-L109 HydrophobicContact CG1-CD2 3.95Å; V105-L109 PolarHBondContact O-N 2.9Å; V105-L109 VanDerWaalsContact O-N 3.11Å; P106-L109 PolarHBondContact O-N 3.44Å; L109-A111 VanDerWaalsContact C-N 3.29Å; L109-A111 PolarHBondContact O-N 2.81Å; L109-T112 WeakPolarHBondContact O-CB 3.38Å; L109-T112 PolarHBondContact O-N 3.36Å; L109-F113 HydrophobicContact CD1-CE2 3.89Å; L109-F113 HydrophobicContact CG-CE2 4.33Å; L109-F113 VanDerWaalsContact O-CD2 3.25Å; L109-F113 WeakPolarHBondContact O-CD2 3.19Å
110	C	93	Very high	88.6	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-65.5	-34	177.3	-69.8	0	0	0	0	112.6	C48 R49 P106 Q107 F113 D114 F115 C116	C48-C110 HydrophobicContact CB-CB 3.87Å; C48-C110 WeakPolarHBondContact CB-SG 3.23Å; C48-C110 VanDerWaalsContact SG-CA 3.52Å; C48-C110 WeakPolarHBondContact SG-CB 3.44Å; C48-C110 CovalentContact SG-SG 2.03Å; C48-C110 PolarHBondContact SG-SG 2.93Å; R49-C110 PolarHBondContact N-SG 2.86Å; R49-C110 VanDerWaalsContact N-SG 3.4Å; P106-C110 VanDerWaalsContact O-CB 3.28Å; P106-C110 WeakPolarHBondContact O-CB 3.35Å; P106-C110 PolarHBondContact O-N 3.49Å; P106-C110 PolarHBondContact O-SG 3.44Å; Q107-C110 PolarHBondContact O-N 2.85Å; C110-F113 CarbonylContact O-C 3.58Å; C110-F113 PolarHBondContact O-N 2.83Å; C110-D114 PolarHBondContact O-N 3.05Å; C110-F115 HydrophobicContact CB-CB 4.18Å; C110-F115 WeakPolarHBondContact O-CB 3.34Å; C110-F115 PolarHBondContact O-N 3.05Å; C110-C116 HydrophobicContact CB-CB 4.02Å; C110-C116 WeakPolarHBondContact CB-SG 3.49Å; C110-C116 PolarHBondContact O-N 2.71Å
111	A	90.9	Very high	87.7	Confident	0 Å²	0	76 Å²	76	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-70.9	-32.5	176.2	0	0	0	0	0	112.6	Q107 K108 L109 F113 D114 C116 Y117 D118 P119	Q107-A111 WeakPolarHBondContact O-CB 3.44Å; Q107-A111 PolarHBondContact O-N 2.97Å; K108-A111 PolarHBondContact O-N 3.31Å; L109-A111 VanDerWaalsContact C-N 3.29Å; L109-A111 PolarHBondContact O-N 2.81Å; A111-F113 PolarHBondContact O-N 3.24Å; A111-F113 VanDerWaalsContact O-N 3.15Å; A111-D114 PolarHBondContact O-N 3.29Å; A111-C116 VanDerWaalsContact CA-O 3.3Å; A111-C116 WeakPolarHBondContact CA-O 3.44Å; A111-C116 HydrophobicContact CB-CB 4.12Å; A111-C116 WeakPolarHBondContact CB-O 3.19Å; A111-Y117 WeakPolarHBondContact CB-O 3.42Å; A111-D118 VanDerWaalsContact CB-C 3.42Å; A111-D118 VanDerWaalsContact CB-O 3.23Å; A111-D118 WeakPolarHBondContact CB-O 3.44Å; A111-P119 HydrophobicContact CB-CB 4.36Å
112	T	86.6	Confident	86.7	Confident	54 Å²	54	78.6 Å²	78.6	33%	0.331	39%	0.391	S	S	.	.	H	α-helix	trans	-55.5	-28.6	168.8	-56.7	0	0	0	0	113	K108 L109 I122	K108-T112 PolarHBondContact O-N 2.94Å; K108-T112 PolarHBondContact O-OG1 2.91Å; K108-T112 VanDerWaalsContact O-OG1 3.07Å; L109-T112 WeakPolarHBondContact O-CB 3.38Å; L109-T112 PolarHBondContact O-N 3.36Å; T112-I122 HydrophobicContact CG2-CD1 3.71Å; T112-I122 VanDerWaalsContact OG1-CD1 3.23Å; T112-I122 WeakPolarHBondContact OG1-CD1 3.38Å
113	F	87.2	Confident	86.2	Confident	128 Å²	128	75.4 Å²	75.4	56%	0.561	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	18.8	178.2	-63.8	-71.8	0	0	0	113.3	L109 C110 A111 F115	L109-F113 HydrophobicContact CD1-CE2 3.89Å; L109-F113 HydrophobicContact CG-CE2 4.33Å; L109-F113 VanDerWaalsContact O-CD2 3.25Å; L109-F113 WeakPolarHBondContact O-CD2 3.19Å; C110-F113 CarbonylContact O-C 3.58Å; C110-F113 PolarHBondContact O-N 2.83Å; A111-F113 PolarHBondContact O-N 3.24Å; A111-F113 VanDerWaalsContact O-N 3.15Å; F113-F115 HydrophobicContact CB-CD2 3.64Å; F113-F115 HydrophobicContact CB-CE2 3.69Å; F113-F115 PolarHBondContact O-N 3.35Å
114	D	87.2	Confident	85.9	Confident	87 Å²	87	71.3 Å²	71.3	47%	0.465	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	15.2	-179.8	-57.3	-44.6	0	0	0	115	C110 A111 C116	C110-D114 PolarHBondContact O-N 3.05Å; A111-D114 PolarHBondContact O-N 3.29Å; D114-C116 VanDerWaalsContact C-N 3.33Å
115	F	91.1	Very high	85.9	Confident	80 Å²	80	70.7 Å²	70.7	35%	0.351	37%	0.367	S	S	.	.	S	Bend	trans	-78.1	-22.4	174	-65.5	-57.9	0	0	0	112.5	P40 Q44 C45 C48 C110 F113	P40-F115 WeakPolarHBondContact CB-O 3.35Å; Q44-F115 HydrophobicContact CB-CD1 4.35Å; C45-F115 WeakPolarHBondContact CA-O 3.3Å; C45-F115 WeakPolarHBondContact CB-O 3.23Å; C45-F115 PolarHBondContact N-O 3.33Å; C48-F115 HydrophobicContact CB-CB 3.86Å; C48-F115 HydrophobicContact CB-CD2 4.12Å; C48-F115 HydrophobicContact CB-CG 4.09Å; C110-F115 HydrophobicContact CB-CB 4.18Å; C110-F115 WeakPolarHBondContact O-CB 3.34Å; C110-F115 PolarHBondContact O-N 3.05Å; F113-F115 HydrophobicContact CB-CD2 3.64Å; F113-F115 HydrophobicContact CB-CE2 3.69Å; F113-F115 PolarHBondContact O-N 3.35Å
116	C	91.1	Very high	85.9	Confident	3 Å²	3	71.5 Å²	71.5	2%	0.02	37%	0.366	C	S	.	.	S	Bend	trans	-134.9	161.5	180	-69.7	0	0	0	0	110.2	C45 C110 A111 D114	C45-C116 WeakPolarHBondContact CA-SG 3.07Å; C45-C116 HydrophobicContact CB-CB 4.07Å; C45-C116 WeakPolarHBondContact CB-SG 3.21Å; C45-C116 WeakPolarHBondContact SG-CB 3.41Å; C45-C116 CovalentContact SG-SG 2.05Å; C45-C116 PolarHBondContact SG-SG 3.49Å; C110-C116 HydrophobicContact CB-CB 4.02Å; C110-C116 WeakPolarHBondContact CB-SG 3.49Å; C110-C116 PolarHBondContact O-N 2.71Å; A111-C116 VanDerWaalsContact CA-O 3.3Å; A111-C116 WeakPolarHBondContact CA-O 3.44Å; A111-C116 HydrophobicContact CB-CB 4.12Å; A111-C116 WeakPolarHBondContact CB-O 3.19Å; D114-C116 VanDerWaalsContact C-N 3.33Å
117	Y	87.5	Confident	85.7	Confident	118 Å²	118	77.2 Å²	77.2	46%	0.463	39%	0.385	S	S	.	.	S	Bend	trans	-72.2	162.3	167.7	-69.5	-79.8	0	0	0	112.2	Q39 P40 Q107 A111	Q39-Y117 WeakPolarHBondContact CA-OH 3.36Å; Q39-Y117 WeakPolarHBondContact CB-OH 3.39Å; Q39-Y117 WeakPolarHBondContact CG-OH 3.25Å; Q39-Y117 PolarHBondContact NE2-OH 2.05Å; P40-Y117 HydrophobicContact CG-CD1 4.17Å; P40-Y117 HydrophobicContact CG-CD2 4Å; P40-Y117 HydrophobicContact CG-CE1 4.17Å; P40-Y117 HydrophobicContact CG-CE2 3.99Å; P40-Y117 HydrophobicContact CG-CG 4.11Å; Q107-Y117 PolarHBondContact NE2-O 2.9Å; A111-Y117 WeakPolarHBondContact CB-O 3.42Å
118	D	78.2	Confident	85.7	Confident	112 Å²	112	75.2 Å²	75.2	60%	0.599	38%	0.377	S	S	*	.			trans	72.3	61.8	176.9	-167.3	38	0	0	0	114	A111	A111-D118 VanDerWaalsContact CB-C 3.42Å; A111-D118 VanDerWaalsContact CB-O 3.23Å; A111-D118 WeakPolarHBondContact CB-O 3.44Å
119	P	69.4	Low	85.8	Confident	80 Å²	80	72.1 Å²	72.1	52%	0.519	37%	0.365	S	S	.	.			trans	-62.6	128.2	173.7	26.8	-32.5	0	0	0	108.9	A111	A111-P119 HydrophobicContact CB-CB 4.36Å
120	P	71.8	Confident	85.9	Confident	40 Å²	40	75 Å²	75	26%	0.26	38%	0.375	S	S	.	.			trans	-60.1	143.3	169.3	26.3	-34	0	0	0	109.5	K108 I122	K108-P120 HydrophobicContact CB-CG 4.07Å; K108-P120 WeakPolarHBondContact O-CD 3.39Å; P120-I122 VanDerWaalsContact C-N 3.31Å; P120-I122 HydrophobicContact CB-CG1 4.1Å; P120-I122 HydrophobicContact CG-CD1 3.77Å; P120-I122 HydrophobicContact CG-CG1 3.77Å; P120-I122 PolarHBondContact O-N 3.44Å
121	E	72.7	Confident	85.7	Confident	201 Å²	201	76.8 Å²	76.8	94%	0.939	39%	0.387	S	S	*	.			trans	-63.6	96.5	162	-70.8	-174.9	178.1	0	0	108.1
122	I	72.9	Confident	85.8	Confident	93 Å²	93	77.3 Å²	77.3	48%	0.477	39%	0.393	S	S	.	.			trans	-97.6	104.8	173.3	-61.3	172.9	0	0	0	107.3	T112 P120 V124	T112-I122 HydrophobicContact CG2-CD1 3.71Å; T112-I122 VanDerWaalsContact OG1-CD1 3.23Å; T112-I122 WeakPolarHBondContact OG1-CD1 3.38Å; P120-I122 VanDerWaalsContact C-N 3.31Å; P120-I122 HydrophobicContact CB-CG1 4.1Å; P120-I122 HydrophobicContact CG-CD1 3.77Å; P120-I122 HydrophobicContact CG-CG1 3.77Å; P120-I122 PolarHBondContact O-N 3.44Å; I122-V124 PolarHBondContact O-N 3.48Å
123	S	84.7	Confident	86.1	Confident	52 Å²	52	79.7 Å²	79.7	36%	0.364	40%	0.403	S	S	.	.			trans	-74.5	107.5	164.6	174.4	0	0	0	0	108.9	C125 E126 Y127	S123-C125 PolarHBondContact O-N 3.25Å; S123-E126 PolarHBondContact O-N 3.39Å; S123-E126 VanDerWaalsContact O-N 3.12Å; S123-E126 WeakPolarHBondContact OG-CB 3.44Å; S123-E126 PolarHBondContact OG-N 2.86Å; S123-E126 VanDerWaalsContact OG-N 3.08Å; S123-Y127 PolarHBondContact O-N 3.44Å
124	V	86.9	Confident	86.3	Confident	80 Å²	80	76.1 Å²	76.1	49%	0.485	39%	0.389	S	S	.	.	H	α-helix	trans	-57.2	-36.6	173.9	-178.7	0	0	0	0	110.5	I122 Y127 C128 F196	I122-V124 PolarHBondContact O-N 3.48Å; V124-Y127 PolarHBondContact O-N 2.87Å; V124-C128 WeakPolarHBondContact O-CB 3.47Å; V124-C128 PolarHBondContact O-N 3.03Å; V124-F196 HydrophobicContact CG1-CB 4.02Å; V124-F196 HydrophobicContact CG1-CD1 3.58Å; V124-F196 HydrophobicContact CG1-CE1 4.28Å; V124-F196 HydrophobicContact CG1-CG 3.94Å
125	C	92.3	Very high	86.5	Confident	28 Å²	28	74.9 Å²	74.9	19%	0.189	38%	0.382	C	S	.	.	H	α-helix	trans	-58.4	-54.3	172.4	-179.8	0	0	0	0	111.4	S123 Y127 C128 L129 F196 C197	S123-C125 PolarHBondContact O-N 3.25Å; C125-Y127 VanDerWaalsContact C-N 3.27Å; C125-Y127 PolarHBondContact O-N 3.48Å; C125-C128 WeakPolarHBondContact O-CB 3.49Å; C125-C128 PolarHBondContact O-N 2.9Å; C125-C128 VanDerWaalsContact O-N 3.11Å; C125-L129 VanDerWaalsContact O-CG 3.31Å; C125-L129 WeakPolarHBondContact O-CG 3.25Å; C125-L129 PolarHBondContact O-N 3.34Å; C125-F196 VanDerWaalsContact CA-O 3.31Å; C125-F196 WeakPolarHBondContact CA-O 3.39Å; C125-F196 WeakPolarHBondContact CB-O 3.26Å; C125-F196 PolarHBondContact N-O 3.47Å; C125-C197 WeakPolarHBondContact CA-SG 3.26Å; C125-C197 HydrophobicContact CB-CB 3.92Å; C125-C197 WeakPolarHBondContact CB-SG 3.16Å; C125-C197 WeakPolarHBondContact SG-CB 3.41Å; C125-C197 CovalentContact SG-SG 2.04Å; C125-C197 PolarHBondContact SG-SG 2.97Å
126	E	91.3	Very high	86.5	Confident	89 Å²	89	72.7 Å²	72.7	42%	0.416	37%	0.373	S	S	.	.	H	α-helix	trans	-58.8	-41.2	-179.4	-172.8	-172	162	0	0	111.8	S123 L129 K130	S123-E126 PolarHBondContact O-N 3.39Å; S123-E126 VanDerWaalsContact O-N 3.12Å; S123-E126 WeakPolarHBondContact OG-CB 3.44Å; S123-E126 PolarHBondContact OG-N 2.86Å; S123-E126 VanDerWaalsContact OG-N 3.08Å; E126-L129 PolarHBondContact O-N 3.21Å; E126-K130 HydrophobicContact CG-CD 4.08Å; E126-K130 WeakPolarHBondContact O-CB 3.04Å; E126-K130 WeakPolarHBondContact O-CG 3.03Å; E126-K130 PolarHBondContact O-N 3.42Å; E126-K130 WeakPolarHBondContact OE1-CE 3.31Å; E126-K130 IonicContact OE1-NZ 2.58Å; E126-K130 PolarHBondContact OE1-NZ 3.5Å
127	Y	88.9	Confident	86.6	Confident	152 Å²	152	75.8 Å²	75.8	60%	0.596	39%	0.394	S	S	*	.	H	α-helix	trans	-59.8	-50.1	174.7	-179.7	-97.2	0	0	0	111.4	S123 V124 C125 L129 K130 S131	S123-Y127 PolarHBondContact O-N 3.44Å; V124-Y127 PolarHBondContact O-N 2.87Å; C125-Y127 VanDerWaalsContact C-N 3.27Å; C125-Y127 PolarHBondContact O-N 3.48Å; Y127-L129 VanDerWaalsContact C-N 3.33Å; Y127-L129 PolarHBondContact O-N 2.87Å; Y127-K130 PolarHBondContact O-N 3.22Å; Y127-S131 WeakPolarHBondContact O-CB 3.35Å; Y127-S131 PolarHBondContact O-N 2.03Å; Y127-S131 PolarHBondContact O-OG 2.88Å
128	C	93.2	Very high	86.8	Confident	12 Å²	12	70.6 Å²	70.6	8%	0.081	38%	0.375	C	S	.	.	H	α-helix	trans	-57.8	-45.9	177.4	179.2	0	0	0	0	112	V124 C125 S131 G132 C191 F196	V124-C128 WeakPolarHBondContact O-CB 3.47Å; V124-C128 PolarHBondContact O-N 3.03Å; C125-C128 WeakPolarHBondContact O-CB 3.49Å; C125-C128 PolarHBondContact O-N 2.9Å; C125-C128 VanDerWaalsContact O-N 3.11Å; C128-S131 PolarHBondContact O-N 3.17Å; C128-G132 PolarHBondContact O-N 3.46Å; C128-C191 HydrophobicContact CB-CB 3.84Å; C128-C191 WeakPolarHBondContact CB-SG 3.41Å; C128-C191 VanDerWaalsContact SG-CA 3.51Å; C128-C191 WeakPolarHBondContact SG-CB 3.19Å; C128-C191 CovalentContact SG-SG 2.03Å; C128-C191 PolarHBondContact SG-SG 3.35Å; C128-F196 HydrophobicContact CB-CB 4.11Å; C128-F196 HydrophobicContact CB-CD2 3.79Å; C128-F196 HydrophobicContact CB-CG 4.31Å; C128-F196 VanDerWaalsContact SG-CD2 3.58Å
129	L	93.8	Very high	87.4	Confident	40 Å²	40	67.3 Å²	67.3	21%	0.209	36%	0.357	C	S	.	.	H	α-helix	trans	-61.1	-48.6	179.1	-65.7	176.2	0	0	0	111.4	C125 E126 Y127 G132 L133 I187 Q188 C191	C125-L129 VanDerWaalsContact O-CG 3.31Å; C125-L129 WeakPolarHBondContact O-CG 3.25Å; C125-L129 PolarHBondContact O-N 3.34Å; E126-L129 PolarHBondContact O-N 3.21Å; Y127-L129 VanDerWaalsContact C-N 3.33Å; Y127-L129 PolarHBondContact O-N 2.87Å; L129-G132 PolarHBondContact O-N 3.07Å; L129-L133 VanDerWaalsContact O-CB 3.3Å; L129-L133 WeakPolarHBondContact O-CB 3.5Å; L129-L133 WeakPolarHBondContact O-CG 3.39Å; L129-L133 PolarHBondContact O-N 3.18Å; L129-I187 HydrophobicContact CD2-CG2 4.15Å; L129-Q188 HydrophobicContact CD2-CB 4.33Å; L129-C191 HydrophobicContact CD2-CB 4.23Å
130	K	92.2	Very high	88.5	Confident	127 Å²	127	66 Å²	66	55%	0.552	35%	0.345	S	S	*	.	H	α-helix	trans	-63.2	-45.8	179.4	-75.4	178.2	172.4	177.3	0	112.1	E126 Y127 L133 L134	E126-K130 HydrophobicContact CG-CD 4.08Å; E126-K130 WeakPolarHBondContact O-CB 3.04Å; E126-K130 WeakPolarHBondContact O-CG 3.03Å; E126-K130 PolarHBondContact O-N 3.42Å; E126-K130 WeakPolarHBondContact OE1-CE 3.31Å; E126-K130 IonicContact OE1-NZ 2.58Å; E126-K130 PolarHBondContact OE1-NZ 3.5Å; Y127-K130 PolarHBondContact O-N 3.22Å; K130-L133 PolarHBondContact O-N 3.45Å; K130-L134 WeakPolarHBondContact O-CB 3.3Å; K130-L134 PolarHBondContact O-N 3.06Å
131	S	90.7	Very high	89.5	Confident	36 Å²	36	66.2 Å²	66.2	25%	0.252	35%	0.348	S	S	.	.	H	α-helix	trans	-64.8	-43.6	178.4	-67.8	0	0	0	0	112.1	Y127 C128 L134 I135	Y127-S131 WeakPolarHBondContact O-CB 3.35Å; Y127-S131 PolarHBondContact O-N 2.03Å; Y127-S131 PolarHBondContact O-OG 2.88Å; C128-S131 PolarHBondContact O-N 3.17Å; S131-L134 PolarHBondContact O-N 3.22Å; S131-I135 WeakPolarHBondContact O-CG1 3.25Å; S131-I135 PolarHBondContact O-N 2.96Å
132	G	92.7	Very high	90.6	Very high	12 Å²	12	64.9 Å²	64.9	12%	0.124	34%	0.341	C	S	.	.	H	α-helix	trans	-66.4	-38.8	177.3	0	0	0	0	0	112.6	C128 L129 I135 K136 I187	C128-G132 PolarHBondContact O-N 3.46Å; L129-G132 PolarHBondContact O-N 3.07Å; G132-I135 PolarHBondContact O-N 3.31Å; G132-K136 WeakPolarHBondContact O-CB 2.99Å; G132-K136 PolarHBondContact O-N 2.91Å; G132-I187 WeakPolarHBondContact O-CD1 3.48Å
133	L	92.3	Very high	91.5	Very high	103 Å²	103	66.4 Å²	66.4	54%	0.539	35%	0.35	S	S	.	.	H	α-helix	trans	-63.2	-41.9	174	-75.9	172.4	0	0	0	111.9	L129 K130 K136 S137 I187	L129-L133 VanDerWaalsContact O-CB 3.3Å; L129-L133 WeakPolarHBondContact O-CB 3.5Å; L129-L133 WeakPolarHBondContact O-CG 3.39Å; L129-L133 PolarHBondContact O-N 3.18Å; K130-L133 PolarHBondContact O-N 3.45Å; L133-K136 PolarHBondContact O-N 3.4Å; L133-S137 PolarHBondContact O-N 2.89Å; L133-S137 PolarHBondContact O-OG 2.92Å; L133-I187 HydrophobicContact CD2-CG1 4.25Å; L133-I187 HydrophobicContact CG-CG1 4.44Å
134	L	91.3	Very high	92	Very high	53 Å²	53	64.8 Å²	64.8	28%	0.277	34%	0.337	S	S	.	.	H	α-helix	trans	-60.1	-49.2	174.5	174.7	66.6	0	0	0	111.5	N96 K130 S131 K136 S137 I138	N96-L134 HydrophobicContact CB-CD2 3.8Å; K130-L134 WeakPolarHBondContact O-CB 3.3Å; K130-L134 PolarHBondContact O-N 3.06Å; S131-L134 PolarHBondContact O-N 3.22Å; L134-K136 VanDerWaalsContact C-N 3.29Å; L134-K136 PolarHBondContact O-N 3.4Å; L134-S137 PolarHBondContact O-N 3.11Å; L134-S137 PolarHBondContact O-OG 2.03Å; L134-I138 HydrophobicContact CD1-CD1 4.23Å; L134-I138 HydrophobicContact CD1-CG1 4.46Å; L134-I138 HydrophobicContact CG-CD1 4.18Å; L134-I138 VanDerWaalsContact O-CG1 3.31Å; L134-I138 WeakPolarHBondContact O-CG1 3.29Å; L134-I138 PolarHBondContact O-N 3.19Å
135	I	91.5	Very high	92.3	Very high	62 Å²	62	62.6 Å²	62.6	32%	0.318	32%	0.323	S	S	.	.	H	α-helix	trans	-59.8	-44.9	178.1	-69.1	165.9	0	0	0	110.1	S131 G132 S137 I138 L139	S131-I135 WeakPolarHBondContact O-CG1 3.25Å; S131-I135 PolarHBondContact O-N 2.96Å; G132-I135 PolarHBondContact O-N 3.31Å; I135-S137 VanDerWaalsContact C-N 3.34Å; I135-S137 PolarHBondContact O-N 2.95Å; I135-I138 PolarHBondContact O-N 3.32Å; I135-L139 HydrophobicContact CG2-CD1 3.76Å; I135-L139 HydrophobicContact CG2-CG 4.34Å; I135-L139 WeakPolarHBondContact O-CB 3.03Å; I135-L139 WeakPolarHBondContact O-CG 3.28Å; I135-L139 PolarHBondContact O-N 3.4Å
136	K	91.5	Very high	92.5	Very high	33 Å²	33	64.2 Å²	64.2	14%	0.143	34%	0.335	C	S	.	.	H	α-helix	trans	-60.6	-41.3	177.3	-174.5	172.9	-176	170.9	0	111.9	G132 L133 L134 L139 L140 F181 N182 F185 I187	G132-K136 WeakPolarHBondContact O-CB 2.99Å; G132-K136 PolarHBondContact O-N 2.91Å; L133-K136 PolarHBondContact O-N 3.4Å; L134-K136 VanDerWaalsContact C-N 3.29Å; L134-K136 PolarHBondContact O-N 3.4Å; K136-L139 PolarHBondContact O-N 3.5Å; K136-L140 HydrophobicContact CD-CD1 4.4Å; K136-L140 HydrophobicContact CG-CD1 3.76Å; K136-L140 HydrophobicContact CG-CG 4.41Å; K136-L140 WeakPolarHBondContact O-CB 3.46Å; K136-L140 WeakPolarHBondContact O-CG 3.2Å; K136-L140 PolarHBondContact O-N 3.42Å; K136-F181 HydrophobicContact CG-CE1 4.3Å; K136-N182 PolarHBondContact NZ-O 3.25Å; K136-F185 PolarHBondContact NZ-O 3.37Å; K136-I187 HydrophobicContact CB-CD1 4.37Å; K136-I187 HydrophobicContact CD-CD1 4.49Å; K136-I187 HydrophobicContact CD-CG1 4.44Å
137	S	92.2	Very high	92.6	Very high	68 Å²	68	62.2 Å²	62.2	48%	0.476	33%	0.326	S	S	.	.	H	α-helix	trans	-67.6	-36.2	178.7	63.9	0	0	0	0	112.7	L133 L134 I135 S141	L133-S137 PolarHBondContact O-N 2.89Å; L133-S137 PolarHBondContact O-OG 2.92Å; L134-S137 PolarHBondContact O-N 3.11Å; L134-S137 PolarHBondContact O-OG 2.03Å; I135-S137 VanDerWaalsContact C-N 3.34Å; I135-S137 PolarHBondContact O-N 2.95Å; S137-S141 PolarHBondContact O-N 3.4Å
138	I	91.7	Very high	92.9	Very high	10 Å²	10	57.2 Å²	57.2	5%	0.051	31%	0.309	C	S	.	.	H	α-helix	trans	-65.6	-49.8	175	-61.5	168.2	0	0	0	109.7	F89 E92 L134 I135 L140 S141 F144	F89-I138 HydrophobicContact CD2-CB 4.42Å; F89-I138 HydrophobicContact CD2-CG2 3.59Å; F89-I138 HydrophobicContact CE2-CG2 4.14Å; E92-I138 HydrophobicContact CB-CD1 4.36Å; E92-I138 HydrophobicContact CB-CG2 4.16Å; E92-I138 HydrophobicContact CG-CB 4.48Å; E92-I138 HydrophobicContact CG-CD1 3.74Å; E92-I138 HydrophobicContact CG-CG1 3.67Å; E92-I138 HydrophobicContact CG-CG2 3.99Å; L134-I138 HydrophobicContact CD1-CD1 4.23Å; L134-I138 HydrophobicContact CD1-CG1 4.46Å; L134-I138 HydrophobicContact CG-CD1 4.18Å; L134-I138 VanDerWaalsContact O-CG1 3.31Å; L134-I138 WeakPolarHBondContact O-CG1 3.29Å; L134-I138 PolarHBondContact O-N 3.19Å; I135-I138 PolarHBondContact O-N 3.32Å; I138-L140 VanDerWaalsContact C-N 3.26Å; I138-L140 PolarHBondContact O-N 3.13Å; I138-S141 WeakPolarHBondContact O-CB 3.46Å; I138-S141 PolarHBondContact O-N 3.37Å; I138-S141 VanDerWaalsContact O-N 3.16Å; I138-S141 PolarHBondContact O-OG 2.86Å; I138-F144 WeakPolarHBondContact O-CB 3.46Å
139	L	91.6	Very high	93	Very high	43 Å²	43	59.5 Å²	59.5	23%	0.225	32%	0.317	C	S	.	.	H	α-helix	trans	-67	-23.6	-177.6	-68.8	175.3	0	0	0	113.9	F89 I135 K136 F144 V145 F181	F89-L139 HydrophobicContact CD2-CD2 3.7Å; F89-L139 HydrophobicContact CD2-CG 4.33Å; F89-L139 HydrophobicContact CE2-CD2 3.72Å; F89-L139 HydrophobicContact CE2-CG 4Å; I135-L139 HydrophobicContact CG2-CD1 3.76Å; I135-L139 HydrophobicContact CG2-CG 4.34Å; I135-L139 WeakPolarHBondContact O-CB 3.03Å; I135-L139 WeakPolarHBondContact O-CG 3.28Å; I135-L139 PolarHBondContact O-N 3.4Å; K136-L139 PolarHBondContact O-N 3.5Å; L139-F144 HydrophobicContact CB-CE1 4.45Å; L139-F144 HydrophobicContact CD2-CD1 4.35Å; L139-F144 HydrophobicContact CD2-CE1 3.55Å; L139-F144 HydrophobicContact CD2-CZ 3.7Å; L139-F144 VanDerWaalsContact O-CD1 3.29Å; L139-F144 WeakPolarHBondContact O-CD1 3.31Å; L139-V145 WeakPolarHBondContact O-CG2 3.06Å; L139-F181 HydrophobicContact CB-CE1 4.01Å; L139-F181 HydrophobicContact CB-CZ 4.5Å; L139-F181 HydrophobicContact CD1-CE1 3.92Å; L139-F181 HydrophobicContact CD1-CE2 4.41Å; L139-F181 HydrophobicContact CD1-CZ 3.54Å
140	L	92.3	Very high	93	Very high	53 Å²	53	60.9 Å²	60.9	28%	0.277	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	7.3	176.4	-64.8	179	0	0	0	113.2	K136 I138 T178 F181 N182	K136-L140 HydrophobicContact CD-CD1 4.4Å; K136-L140 HydrophobicContact CG-CD1 3.76Å; K136-L140 HydrophobicContact CG-CG 4.41Å; K136-L140 WeakPolarHBondContact O-CB 3.46Å; K136-L140 WeakPolarHBondContact O-CG 3.2Å; K136-L140 PolarHBondContact O-N 3.42Å; I138-L140 VanDerWaalsContact C-N 3.26Å; I138-L140 PolarHBondContact O-N 3.13Å; L140-T178 HydrophobicContact CD2-CG2 4.18Å; L140-F181 HydrophobicContact CD2-CD1 4.07Å; L140-F181 HydrophobicContact CG-CD1 4.29Å; L140-F181 HydrophobicContact CG-CE1 4.47Å; L140-N182 HydrophobicContact CD1-CB 4Å; L140-N182 WeakPolarHBondContact CD1-OD1 3.25Å; L140-N182 HydrophobicContact CD2-CB 4.38Å
141	S	93.8	Very high	93	Very high	44 Å²	44	55.5 Å²	55.5	31%	0.308	30%	0.301	S	S	.	.			trans	-65.4	141.4	174.7	67.5	0	0	0	0	110.4	S137 I138 N143 F144 V145	S137-S141 PolarHBondContact O-N 3.4Å; I138-S141 WeakPolarHBondContact O-CB 3.46Å; I138-S141 PolarHBondContact O-N 3.37Å; I138-S141 VanDerWaalsContact O-N 3.16Å; I138-S141 PolarHBondContact O-OG 2.86Å; S141-N143 VanDerWaalsContact C-N 3.26Å; S141-N143 PolarHBondContact O-N 3.31Å; S141-F144 PolarHBondContact O-N 3.44Å; S141-F144 VanDerWaalsContact O-N 3.12Å; S141-F144 WeakPolarHBondContact OG-CB 3.32Å; S141-F144 PolarHBondContact OG-N 3.29Å; S141-V145 WeakPolarHBondContact O-CG2 3.43Å; S141-V145 PolarHBondContact O-N 3.11Å
142	E	94.1	Very high	93.1	Very high	173 Å²	173	54.7 Å²	54.7	81%	0.808	30%	0.295	S	S	*	.	H	α-helix	trans	-54.2	-44.1	-177.3	-66	-179	173.5	0	0	112	S146	E142-S146 WeakPolarHBondContact O-CB 3.41Å; E142-S146 PolarHBondContact O-N 2.94Å
143	N	93.1	Very high	93.1	Very high	124 Å²	124	56.3 Å²	56.3	66%	0.663	30%	0.301	S	S	*	.	H	α-helix	trans	-62.1	-47.1	178.9	-67.7	-17.3	0	0	0	111.8	M88 S141 E147	M88-N143 HydrophobicContact CE-CB 3.75Å; S141-N143 VanDerWaalsContact C-N 3.26Å; S141-N143 PolarHBondContact O-N 3.31Å; N143-E147 VanDerWaalsContact O-CB 3.3Å; N143-E147 WeakPolarHBondContact O-CB 3.05Å; N143-E147 PolarHBondContact O-N 3.48Å
144	F	94	Very high	92.9	Very high	18 Å²	18	55 Å²	55	8%	0.079	29%	0.294	C	S	.	.	H	α-helix	trans	-68	-44.2	-179.5	179.4	-94.8	0	0	0	111.7	S85 F89 I138 L139 S141 E147 L148	S85-F144 VanDerWaalsContact O-CE2 3.31Å; S85-F144 WeakPolarHBondContact O-CE2 3.19Å; F89-F144 HydrophobicContact CB-CD2 4.14Å; F89-F144 HydrophobicContact CB-CE2 3.64Å; F89-F144 HydrophobicContact CB-CZ 4.43Å; F89-F144 HydrophobicContact CG-CE2 4.47Å; I138-F144 WeakPolarHBondContact O-CB 3.46Å; L139-F144 HydrophobicContact CB-CE1 4.45Å; L139-F144 HydrophobicContact CD2-CD1 4.35Å; L139-F144 HydrophobicContact CD2-CE1 3.55Å; L139-F144 HydrophobicContact CD2-CZ 3.7Å; L139-F144 VanDerWaalsContact O-CD1 3.29Å; L139-F144 WeakPolarHBondContact O-CD1 3.31Å; S141-F144 PolarHBondContact O-N 3.44Å; S141-F144 VanDerWaalsContact O-N 3.12Å; S141-F144 WeakPolarHBondContact OG-CB 3.32Å; S141-F144 PolarHBondContact OG-N 3.29Å; F144-E147 PolarHBondContact O-N 2.58Å; F144-L148 HydrophobicContact CE1-CB 4.49Å; F144-L148 HydrophobicContact CE1-CD2 3.89Å; F144-L148 HydrophobicContact CZ-CD2 4.25Å; F144-L148 VanDerWaalsContact O-CB 3.23Å; F144-L148 WeakPolarHBondContact O-CB 3.49Å; F144-L148 PolarHBondContact O-N 2.9Å
145	V	94.8	Very high	92.8	Very high	34 Å²	34	56.2 Å²	56.2	21%	0.206	30%	0.299	C	S	.	.	H	α-helix	trans	-64.6	-44	179.9	173.7	0	0	0	0	110.9	L139 S141 L148 Y149 F174 T178	L139-V145 WeakPolarHBondContact O-CG2 3.06Å; S141-V145 WeakPolarHBondContact O-CG2 3.43Å; S141-V145 PolarHBondContact O-N 3.11Å; V145-L148 PolarHBondContact O-N 3.18Å; V145-Y149 VanDerWaalsContact O-CB 3.23Å; V145-Y149 WeakPolarHBondContact O-CB 3.35Å; V145-Y149 PolarHBondContact O-N 3.49Å; V145-F174 HydrophobicContact CG1-CE1 3.86Å; V145-F174 HydrophobicContact CG1-CZ 3.89Å; V145-F174 WeakPolarHBondContact O-CZ 3.43Å; V145-T178 HydrophobicContact CG1-CG2 4.48Å
146	S	95.3	Very high	92.8	Very high	63 Å²	63	53.8 Å²	53.8	44%	0.441	29%	0.288	S	S	.	.	H	α-helix	trans	-61.4	-47.1	177.1	-177.9	0	0	0	0	111.7	E142 Y149 N150	E142-S146 WeakPolarHBondContact O-CB 3.41Å; E142-S146 PolarHBondContact O-N 2.94Å; S146-Y149 WeakPolarHBondContact O-CB 3.42Å; S146-Y149 PolarHBondContact O-N 3.07Å; S146-N150 VanDerWaalsContact O-CG 3.27Å; S146-N150 PolarHBondContact O-N 3.1Å; S146-N150 PolarHBondContact O-ND2 3.26Å
147	E	94	Very high	92.5	Very high	46 Å²	46	58.1 Å²	58.1	22%	0.215	31%	0.313	C	S	.	.	H	α-helix	trans	-64.6	-44.2	178.1	-176.1	59.4	-154.9	0	0	111.6	T84 M88 N143 F144 Y149 N150 N151	T84-E147 WeakPolarHBondContact CB-OE1 3.35Å; T84-E147 HydrophobicContact CG2-CG 3.9Å; T84-E147 VanDerWaalsContact CG2-OE1 3.3Å; T84-E147 WeakPolarHBondContact CG2-OE1 3.34Å; M88-E147 HydrophobicContact SD-CB 4Å; M88-E147 HydrophobicContact SD-CG 3.84Å; N143-E147 VanDerWaalsContact O-CB 3.3Å; N143-E147 WeakPolarHBondContact O-CB 3.05Å; N143-E147 PolarHBondContact O-N 3.48Å; F144-E147 PolarHBondContact O-N 2.58Å; E147-Y149 VanDerWaalsContact C-N 3.32Å; E147-Y149 PolarHBondContact O-N 3.27Å; E147-N150 PolarHBondContact O-N 3.39Å; E147-N151 WeakPolarHBondContact O-CB 3.39Å; E147-N151 VanDerWaalsContact O-CG 3.23Å; E147-N151 PolarHBondContact O-N 2.04Å; E147-N151 PolarHBondContact O-ND2 3.37Å; E147-N151 PolarHBondContact OE1-ND2 3.15Å
148	L	94.8	Very high	92.1	Very high	47 Å²	47	60.4 Å²	60.4	25%	0.246	32%	0.324	C	S	.	.	H	α-helix	trans	-63.4	-39.5	177.1	-171.9	66.4	0	0	0	111.7	F82 F144 V145 N151 T152 F174	F82-L148 HydrophobicContact CD1-CD1 3.73Å; F82-L148 HydrophobicContact CE1-CD1 4.01Å; F144-L148 HydrophobicContact CE1-CB 4.49Å; F144-L148 HydrophobicContact CE1-CD2 3.89Å; F144-L148 HydrophobicContact CZ-CD2 4.25Å; F144-L148 VanDerWaalsContact O-CB 3.23Å; F144-L148 WeakPolarHBondContact O-CB 3.49Å; F144-L148 PolarHBondContact O-N 2.9Å; V145-L148 PolarHBondContact O-N 3.18Å; L148-N151 PolarHBondContact O-N 2.94Å; L148-T152 WeakPolarHBondContact O-CB 3.46Å; L148-T152 PolarHBondContact O-N 3.22Å; L148-T152 PolarHBondContact O-OG1 3.08Å; L148-F174 HydrophobicContact CB-CE2 4.16Å; L148-F174 HydrophobicContact CB-CZ 4.42Å; L148-F174 HydrophobicContact CD2-CE2 3.97Å; L148-F174 HydrophobicContact CG-CE2 3.86Å
149	Y	95.3	Very high	91.5	Very high	61 Å²	61	64 Å²	64	24%	0.239	34%	0.34	C	S	.	.	H	α-helix	trans	-61.5	-50.3	175.3	175.1	-104.9	0	0	0	111.6	V145 S146 E147 N151 T152 L153 H171 F174	V145-Y149 VanDerWaalsContact O-CB 3.23Å; V145-Y149 WeakPolarHBondContact O-CB 3.35Å; V145-Y149 PolarHBondContact O-N 3.49Å; S146-Y149 WeakPolarHBondContact O-CB 3.42Å; S146-Y149 PolarHBondContact O-N 3.07Å; E147-Y149 VanDerWaalsContact C-N 3.32Å; E147-Y149 PolarHBondContact O-N 3.27Å; Y149-N151 VanDerWaalsContact C-N 3.33Å; Y149-N151 PolarHBondContact O-N 3.06Å; Y149-T152 WeakPolarHBondContact O-CB 3.12Å; Y149-T152 PolarHBondContact O-N 3.25Å; Y149-T152 VanDerWaalsContact O-N 3.11Å; Y149-L153 HydrophobicContact CD1-CD1 4.26Å; Y149-L153 HydrophobicContact CE1-CD1 3.51Å; Y149-L153 HydrophobicContact CE1-CG 4.26Å; Y149-L153 HydrophobicContact CE2-CD1 4.15Å; Y149-L153 HydrophobicContact CE2-CG 4.23Å; Y149-L153 VanDerWaalsContact CZ-CD1 3.46Å; Y149-L153 PolarHBondContact O-N 3.12Å; Y149-H171 AromaticContact CE2-ND1 3.54Å; Y149-H171 AromaticContact CZ-ND1 3.63Å; Y149-H171 PolarHBondContact OH-ND1 3.43Å; Y149-F174 HydrophobicContact CD2-CB 4.27Å; Y149-F174 AromaticContact CD2-CD1 3.52Å; Y149-F174 HydrophobicContact CD2-CD1 3.52Å; Y149-F174 HydrophobicContact CD2-CD2 4.38Å; Y149-F174 AromaticContact CD2-CE1 3.89Å; Y149-F174 HydrophobicContact CD2-CE1 3.89Å; Y149-F174 AromaticContact CD2-CG 3.79Å; Y149-F174 HydrophobicContact CD2-CG 3.79Å; Y149-F174 HydrophobicContact CD2-CZ 4.46Å; Y149-F174 HydrophobicContact CE2-CD1 4.35Å; Y149-F174 HydrophobicContact CG-CD1 4.33Å; Y149-F174 HydrophobicContact CG-CE1 4.26Å
150	N	94.5	Very high	90.6	Very high	69 Å²	69	66.1 Å²	66.1	37%	0.369	36%	0.357	S	S	.	.	H	α-helix	trans	-60.4	-44.2	178.3	-69.2	-27.6	0	0	0	111.3	S146 E147 T152 L153 N154	S146-N150 VanDerWaalsContact O-CG 3.27Å; S146-N150 PolarHBondContact O-N 3.1Å; S146-N150 PolarHBondContact O-ND2 3.26Å; E147-N150 PolarHBondContact O-N 3.39Å; N150-T152 VanDerWaalsContact C-N 3.29Å; N150-T152 PolarHBondContact O-N 3.31Å; N150-L153 PolarHBondContact O-N 2.88Å; N150-N154 WeakPolarHBondContact O-CB 3.34Å; N150-N154 PolarHBondContact O-N 3.02Å; N150-N154 PolarHBondContact O-ND2 3.1Å
151	N	91.8	Very high	90.1	Very high	13 Å²	13	70.3 Å²	70.3	7%	0.07	38%	0.379	C	S	.	.	H	α-helix	trans	-63.7	-34.6	175.9	-72.3	-31.8	0	0	0	112.8	P81 F82 E147 L148 Y149 N154	P81-N151 VanDerWaalsContact O-CB 3.25Å; P81-N151 WeakPolarHBondContact O-CB 3.21Å; P81-N151 PolarHBondContact O-ND2 3.04Å; P81-N151 PolarHBondContact O-OD1 2.87Å; P81-N151 VanDerWaalsContact O-OD1 3.07Å; F82-N151 HydrophobicContact CD1-CB 4.02Å; F82-N151 HydrophobicContact CE1-CB 4.34Å; E147-N151 WeakPolarHBondContact O-CB 3.39Å; E147-N151 VanDerWaalsContact O-CG 3.23Å; E147-N151 PolarHBondContact O-N 2.04Å; E147-N151 PolarHBondContact O-ND2 3.37Å; E147-N151 PolarHBondContact OE1-ND2 3.15Å; L148-N151 PolarHBondContact O-N 2.94Å; Y149-N151 VanDerWaalsContact C-N 3.33Å; Y149-N151 PolarHBondContact O-N 3.06Å; N151-N154 PolarHBondContact O-N 3.02Å
152	T	92.7	Very high	89.4	Confident	20 Å²	20	73.3 Å²	73.3	12%	0.123	39%	0.388	C	S	.	.	H	α-helix	trans	-65	-49.5	173.6	-57.8	0	0	0	0	110.6	L148 Y149 N150 N154 M155 L170 F174	L148-T152 WeakPolarHBondContact O-CB 3.46Å; L148-T152 PolarHBondContact O-N 3.22Å; L148-T152 PolarHBondContact O-OG1 3.08Å; Y149-T152 WeakPolarHBondContact O-CB 3.12Å; Y149-T152 PolarHBondContact O-N 3.25Å; Y149-T152 VanDerWaalsContact O-N 3.11Å; N150-T152 VanDerWaalsContact C-N 3.29Å; N150-T152 PolarHBondContact O-N 3.31Å; T152-N154 VanDerWaalsContact C-N 3.28Å; T152-N154 PolarHBondContact O-N 3.37Å; T152-M155 VanDerWaalsContact O-CB 3.22Å; T152-M155 WeakPolarHBondContact O-CB 3.47Å; T152-M155 VanDerWaalsContact O-CG 3.31Å; T152-M155 WeakPolarHBondContact O-CG 3.34Å; T152-M155 PolarHBondContact O-N 3.5Å; T152-M155 VanDerWaalsContact O-N 3.11Å; T152-L170 HydrophobicContact CG2-CB 4.19Å; T152-L170 HydrophobicContact CG2-CD1 4.24Å; T152-L170 WeakPolarHBondContact O-CD1 3.45Å; T152-F174 HydrophobicContact CG2-CD2 4.4Å
153	L	91.7	Very high	88.5	Confident	46 Å²	46	68.3 Å²	68.3	24%	0.241	37%	0.372	C	S	.	.	H	α-helix	trans	-64.3	-32.7	177.5	-69.8	-172.9	0	0	0	113	Y149 N150 M155 C156 L170	Y149-L153 HydrophobicContact CD1-CD1 4.26Å; Y149-L153 HydrophobicContact CE1-CD1 3.51Å; Y149-L153 HydrophobicContact CE1-CG 4.26Å; Y149-L153 HydrophobicContact CE2-CD1 4.15Å; Y149-L153 HydrophobicContact CE2-CG 4.23Å; Y149-L153 VanDerWaalsContact CZ-CD1 3.46Å; Y149-L153 PolarHBondContact O-N 3.12Å; N150-L153 PolarHBondContact O-N 2.88Å; L153-M155 PolarHBondContact O-N 2.87Å; L153-M155 VanDerWaalsContact O-N 3.13Å; L153-C156 VanDerWaalsContact O-CB 3.26Å; L153-C156 WeakPolarHBondContact O-CB 3.09Å; L153-C156 PolarHBondContact O-N 3Å; L153-L170 HydrophobicContact CD2-CB 4.13Å
154	N	89.3	Confident	88.1	Confident	76 Å²	76	70 Å²	70	41%	0.406	38%	0.38	S	S	.	.	H	α-helix	trans	-61.4	-19.9	175.7	-75.2	-24.2	0	0	0	113	N150 N151 T152 C156 N157	N150-N154 WeakPolarHBondContact O-CB 3.34Å; N150-N154 PolarHBondContact O-N 3.02Å; N150-N154 PolarHBondContact O-ND2 3.1Å; N151-N154 PolarHBondContact O-N 3.02Å; T152-N154 VanDerWaalsContact C-N 3.28Å; T152-N154 PolarHBondContact O-N 3.37Å; N154-C156 PolarHBondContact O-N 3.23Å; N154-N157 VanDerWaalsContact O-CB 3.32Å; N154-N157 WeakPolarHBondContact O-CB 3.08Å; N154-N157 PolarHBondContact O-N 2.88Å; N154-N157 PolarHBondContact OD1-ND2 2.96Å
155	M	89	Confident	87.9	Confident	78 Å²	78	75.2 Å²	75.2	38%	0.384	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-59.8	-29.5	171.1	-60.8	179.2	65.2	0	0	111.7	P81 F82 T152 L153 N157 T158 L170	P81-M155 HydrophobicContact CG-CG 4.3Å; F82-M155 HydrophobicContact CE2-SD 4.37Å; F82-M155 HydrophobicContact CZ-SD 3.77Å; T152-M155 VanDerWaalsContact O-CB 3.22Å; T152-M155 WeakPolarHBondContact O-CB 3.47Å; T152-M155 VanDerWaalsContact O-CG 3.31Å; T152-M155 WeakPolarHBondContact O-CG 3.34Å; T152-M155 PolarHBondContact O-N 3.5Å; T152-M155 VanDerWaalsContact O-N 3.11Å; L153-M155 PolarHBondContact O-N 2.87Å; L153-M155 VanDerWaalsContact O-N 3.13Å; M155-N157 PolarHBondContact O-N 3.29Å; M155-T158 PolarHBondContact O-N 3.07Å; M155-T158 VanDerWaalsContact O-N 3.13Å; M155-T158 PolarHBondContact O-OG1 2.05Å; M155-L170 HydrophobicContact CB-CD1 4.12Å
156	C	90.5	Very high	87.8	Confident	11 Å²	11	74.8 Å²	74.8	7%	0.074	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-66.3	-23.6	176.3	-60.5	0	0	0	0	113.5	L153 N154 T158 Q159 C166 G167 L170	L153-C156 VanDerWaalsContact O-CB 3.26Å; L153-C156 WeakPolarHBondContact O-CB 3.09Å; L153-C156 PolarHBondContact O-N 3Å; N154-C156 PolarHBondContact O-N 3.23Å; C156-T158 PolarHBondContact O-N 2.88Å; C156-Q159 CarbonylContact O-C 3.55Å; C156-Q159 PolarHBondContact O-N 2.85Å; C156-C166 WeakPolarHBondContact CA-SG 3.26Å; C156-C166 HydrophobicContact CB-CB 3.75Å; C156-C166 WeakPolarHBondContact CB-SG 3.08Å; C156-C166 WeakPolarHBondContact SG-CB 3.3Å; C156-C166 CovalentContact SG-SG 2.04Å; C156-C166 PolarHBondContact SG-SG 3.17Å; C156-G167 PolarHBondContact SG-N 3.04Å; C156-L170 VanDerWaalsContact SG-CD1 3.56Å
157	N	85.9	Confident	87.7	Confident	124 Å²	124	72.9 Å²	72.9	66%	0.663	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-68.4	-22.7	175.8	-60.5	-28.3	0	0	0	112	N154 M155 Q159	N154-N157 VanDerWaalsContact O-CB 3.32Å; N154-N157 WeakPolarHBondContact O-CB 3.08Å; N154-N157 PolarHBondContact O-N 2.88Å; N154-N157 PolarHBondContact OD1-ND2 2.96Å; M155-N157 PolarHBondContact O-N 3.29Å; N157-Q159 VanDerWaalsContact C-N 3.28Å; N157-Q159 PolarHBondContact O-N 2.69Å
158	T	82.9	Confident	87.7	Confident	115 Å²	115	74.4 Å²	74.4	71%	0.706	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-76.6	-16.6	177.8	68.6	0	0	0	0	113.1	M155 C156	M155-T158 PolarHBondContact O-N 3.07Å; M155-T158 VanDerWaalsContact O-N 3.13Å; M155-T158 PolarHBondContact O-OG1 2.05Å; C156-T158 PolarHBondContact O-N 2.88Å
159	Q	79.5	Confident	87.6	Confident	85 Å²	85	78.1 Å²	78.1	40%	0.397	42%	0.424	S	S	.	.			trans	-130.6	74.6	-176.9	-167.7	63.9	25.4	0	0	111	C156 N157 N161 H162	C156-Q159 CarbonylContact O-C 3.55Å; C156-Q159 PolarHBondContact O-N 2.85Å; N157-Q159 VanDerWaalsContact C-N 3.28Å; N157-Q159 PolarHBondContact O-N 2.69Å; Q159-N161 PolarHBondContact O-N 2.91Å; Q159-N161 VanDerWaalsContact O-N 3.15Å; Q159-H162 HydrophobicContact CG-CB 4.03Å; Q159-H162 WeakPolarHBondContact CG-ND1 3.33Å; Q159-H162 PolarHBondContact NE2-ND1 3.27Å; Q159-H162 PolarHBondContact O-N 3.06Å
160	P	73.5	Confident	87.6	Confident	89 Å²	89	76.2 Å²	76.2	58%	0.578	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-59.6	-32.9	-171.5	21.3	-32.3	0	0	0	113.4	H162 S163	P160-H162 PolarHBondContact O-N 3.11Å; P160-H162 VanDerWaalsContact O-N 3.17Å; P160-S163 WeakPolarHBondContact O-CB 3.38Å; P160-S163 PolarHBondContact O-N 3.01Å; P160-S163 PolarHBondContact O-OG 2.73Å; P160-S163 VanDerWaalsContact O-OG 3.06Å
161	N	81.5	Confident	87.6	Confident	140 Å²	140	76.4 Å²	76.4	75%	0.749	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-66.7	-14.7	-179.9	-66.9	-7.9	0	0	0	113.9	Q159	Q159-N161 PolarHBondContact O-N 2.91Å; Q159-N161 VanDerWaalsContact O-N 3.15Å
162	H	78.7	Confident	87.8	Confident	107 Å²	107	80.8 Å²	80.8	50%	0.495	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-118.1	11.2	-179.3	-56.9	140	0	0	0	113	Q159 P160 L164 I165 C166	Q159-H162 HydrophobicContact CG-CB 4.03Å; Q159-H162 WeakPolarHBondContact CG-ND1 3.33Å; Q159-H162 PolarHBondContact NE2-ND1 3.27Å; Q159-H162 PolarHBondContact O-N 3.06Å; P160-H162 PolarHBondContact O-N 3.11Å; P160-H162 VanDerWaalsContact O-N 3.17Å; H162-L164 VanDerWaalsContact C-N 3.27Å; H162-L164 PolarHBondContact O-N 3.19Å; H162-I165 PolarHBondContact O-N 3.43Å; H162-I165 VanDerWaalsContact O-N 3.11Å; H162-C166 WeakPolarHBondContact O-CB 3.35Å; H162-C166 PolarHBondContact O-N 2.83Å
163	S	76.4	Confident	88	Confident	68 Å²	68	83.8 Å²	83.8	48%	0.476	46%	0.455	S	S	.	.	H	α-helix	trans	-53.5	-40.1	-174.5	55.8	0	0	0	0	113.8	P160 I165 G167	P160-S163 WeakPolarHBondContact O-CB 3.38Å; P160-S163 PolarHBondContact O-N 3.01Å; P160-S163 PolarHBondContact O-OG 2.73Å; P160-S163 VanDerWaalsContact O-OG 3.06Å; S163-I165 VanDerWaalsContact C-N 3.33Å; S163-I165 PolarHBondContact O-N 3.45Å; S163-G167 PolarHBondContact O-N 3.12Å
164	L	83.7	Confident	88.2	Confident	159 Å²	159	82.6 Å²	82.6	83%	0.832	45%	0.448	S	S	*	.	H	α-helix	trans	-58.7	-37.7	178.9	-79.2	157.2	0	0	0	114	H162 P168	H162-L164 VanDerWaalsContact C-N 3.27Å; H162-L164 PolarHBondContact O-N 3.19Å; L164-P168 WeakPolarHBondContact O-CD 3.38Å
165	I	90.5	Very high	88.5	Confident	129 Å²	129	81.8 Å²	81.8	66%	0.662	45%	0.446	S	S	*	.	H	α-helix	trans	-96.7	-32.5	-177.3	-58.7	173.7	0	0	0	110.5	H162 S163 G167 F169	H162-I165 PolarHBondContact O-N 3.43Å; H162-I165 VanDerWaalsContact O-N 3.11Å; S163-I165 VanDerWaalsContact C-N 3.33Å; S163-I165 PolarHBondContact O-N 3.45Å; I165-G167 PolarHBondContact O-N 3.33Å; I165-F169 VanDerWaalsContact O-CB 3.25Å; I165-F169 WeakPolarHBondContact O-CB 3.23Å; I165-F169 PolarHBondContact O-N 3.41Å; I165-F169 VanDerWaalsContact O-N 3.11Å
166	C	92.4	Very high	88.8	Confident	25 Å²	25	80.7 Å²	80.7	17%	0.169	45%	0.449	C	S	.	.	H	α-helix	trans	-61.7	-47.4	-173.9	-178.9	0	0	0	0	112.8	C156 H162 F169 L170	C156-C166 WeakPolarHBondContact CA-SG 3.26Å; C156-C166 HydrophobicContact CB-CB 3.75Å; C156-C166 WeakPolarHBondContact CB-SG 3.08Å; C156-C166 WeakPolarHBondContact SG-CB 3.3Å; C156-C166 CovalentContact SG-SG 2.04Å; C156-C166 PolarHBondContact SG-SG 3.17Å; H162-C166 WeakPolarHBondContact O-CB 3.35Å; H162-C166 PolarHBondContact O-N 2.83Å; C166-F169 PolarHBondContact O-N 3.24Å; C166-L170 WeakPolarHBondContact O-CB 3.22Å; C166-L170 WeakPolarHBondContact O-CG 3.23Å; C166-L170 PolarHBondContact O-N 3.41Å
167	G	92.5	Very high	89	Confident	22 Å²	22	84.3 Å²	84.3	23%	0.227	47%	0.471	C	S	.	.	H	α-helix	trans	-58.5	-58.1	-177.7	0	0	0	0	0	112.8	C156 S163 I165 F169 L170 H171	C156-G167 PolarHBondContact SG-N 3.04Å; S163-G167 PolarHBondContact O-N 3.12Å; I165-G167 PolarHBondContact O-N 3.33Å; G167-F169 VanDerWaalsContact C-N 3.34Å; G167-F169 PolarHBondContact O-N 3.3Å; G167-L170 PolarHBondContact O-N 2.94Å; G167-H171 WeakPolarHBondContact O-CB 3.3Å; G167-H171 PolarHBondContact O-N 3.27Å
168	P	93.6	Very high	89.3	Confident	78 Å²	78	80.1 Å²	80.1	51%	0.506	45%	0.45	S	S	.	.	H	α-helix	trans	-56.7	-43.9	176.1	-27.1	35.6	0	0	0	113.2	L164 H171 D172	L164-P168 WeakPolarHBondContact O-CD 3.38Å; P168-H171 PolarHBondContact O-N 3.01Å; P168-D172 PolarHBondContact O-N 2.97Å
169	F	94.6	Very high	89.7	Confident	125 Å²	125	78.8 Å²	78.8	55%	0.548	44%	0.438	S	S	.	.	H	α-helix	trans	-61.4	-48.8	179.2	172.4	-103.2	0	0	0	112.7	I165 C166 G167 H171 D172 L173	I165-F169 VanDerWaalsContact O-CB 3.25Å; I165-F169 WeakPolarHBondContact O-CB 3.23Å; I165-F169 PolarHBondContact O-N 3.41Å; I165-F169 VanDerWaalsContact O-N 3.11Å; C166-F169 PolarHBondContact O-N 3.24Å; G167-F169 VanDerWaalsContact C-N 3.34Å; G167-F169 PolarHBondContact O-N 3.3Å; F169-H171 VanDerWaalsContact C-N 3.32Å; F169-H171 PolarHBondContact O-N 3.48Å; F169-D172 PolarHBondContact O-N 3.36Å; F169-L173 HydrophobicContact CE1-CD2 4.18Å; F169-L173 HydrophobicContact CZ-CD2 4.26Å; F169-L173 VanDerWaalsContact O-CB 3.29Å; F169-L173 WeakPolarHBondContact O-CB 3.35Å; F169-L173 PolarHBondContact O-N 3.4Å
170	L	94.1	Very high	90.3	Very high	21 Å²	21	76.8 Å²	76.8	11%	0.11	43%	0.433	C	S	.	.	H	α-helix	trans	-68.9	-32.3	179.8	-70.7	-170.5	0	0	0	112.2	T152 L153 M155 C156 C166 G167 L173 F174	T152-L170 HydrophobicContact CG2-CB 4.19Å; T152-L170 HydrophobicContact CG2-CD1 4.24Å; T152-L170 WeakPolarHBondContact O-CD1 3.45Å; L153-L170 HydrophobicContact CD2-CB 4.13Å; M155-L170 HydrophobicContact CB-CD1 4.12Å; C156-L170 VanDerWaalsContact SG-CD1 3.56Å; C166-L170 WeakPolarHBondContact O-CB 3.22Å; C166-L170 WeakPolarHBondContact O-CG 3.23Å; C166-L170 PolarHBondContact O-N 3.41Å; G167-L170 PolarHBondContact O-N 2.94Å; L170-L173 HydrophobicContact CD2-CD2 4.34Å; L170-F174 WeakPolarHBondContact O-CB 3.49Å; L170-F174 PolarHBondContact O-N 2.93Å
171	H	95.2	Very high	90.9	Very high	73 Å²	73	75.3 Å²	75.3	34%	0.338	42%	0.418	S	S	.	.	H	α-helix	trans	-60	-55.7	171.8	174.6	79.9	0	0	0	111.4	Y149 G167 P168 F169 L173 F174 V175	Y149-H171 AromaticContact CE2-ND1 3.54Å; Y149-H171 AromaticContact CZ-ND1 3.63Å; Y149-H171 PolarHBondContact OH-ND1 3.43Å; G167-H171 WeakPolarHBondContact O-CB 3.3Å; G167-H171 PolarHBondContact O-N 3.27Å; P168-H171 PolarHBondContact O-N 3.01Å; F169-H171 VanDerWaalsContact C-N 3.32Å; F169-H171 PolarHBondContact O-N 3.48Å; H171-L173 VanDerWaalsContact C-N 3.29Å; H171-L173 PolarHBondContact O-N 3.44Å; H171-F174 PolarHBondContact O-N 2.91Å; H171-V175 WeakPolarHBondContact O-CG2 3.42Å; H171-V175 PolarHBondContact O-N 3.38Å
172	D	96.4	Very high	91.3	Very high	106 Å²	106	72.3 Å²	72.3	57%	0.567	40%	0.402	S	S	*	.	H	α-helix	trans	-60.4	-42.1	-178.8	-72.1	-16.7	0	0	0	111.2	P168 F169 A176	P168-D172 PolarHBondContact O-N 2.97Å; F169-D172 PolarHBondContact O-N 3.36Å; D172-A176 VanDerWaalsContact O-CB 3.27Å; D172-A176 WeakPolarHBondContact O-CB 3.4Å; D172-A176 PolarHBondContact O-N 2.99Å
173	L	96	Very high	91.7	Very high	82 Å²	82	74.7 Å²	74.7	43%	0.429	41%	0.411	S	S	.	.	H	α-helix	trans	-61.7	-47.6	176	180	61.1	0	0	0	111.6	F169 L170 H171 V175 A176 V177	F169-L173 HydrophobicContact CE1-CD2 4.18Å; F169-L173 HydrophobicContact CZ-CD2 4.26Å; F169-L173 VanDerWaalsContact O-CB 3.29Å; F169-L173 WeakPolarHBondContact O-CB 3.35Å; F169-L173 PolarHBondContact O-N 3.4Å; L170-L173 HydrophobicContact CD2-CD2 4.34Å; H171-L173 VanDerWaalsContact C-N 3.29Å; H171-L173 PolarHBondContact O-N 3.44Å; L173-V175 PolarHBondContact O-N 3.27Å; L173-A176 PolarHBondContact O-N 3.48Å; L173-V177 HydrophobicContact CD1-CG2 4.08Å; L173-V177 HydrophobicContact CG-CG2 4.49Å; L173-V177 WeakPolarHBondContact O-CB 3.42Å; L173-V177 VanDerWaalsContact O-CG2 3.28Å; L173-V177 WeakPolarHBondContact O-CG2 3.3Å; L173-V177 PolarHBondContact O-N 3.4Å
174	F	95.8	Very high	91.8	Very high	22 Å²	22	78.4 Å²	78.4	10%	0.096	42%	0.421	C	S	.	.	H	α-helix	trans	-61.9	-45	-179.6	-177.2	-86.9	0	0	0	111.7	V145 L148 Y149 T152 L170 H171 V177 T178	V145-F174 HydrophobicContact CG1-CE1 3.86Å; V145-F174 HydrophobicContact CG1-CZ 3.89Å; V145-F174 WeakPolarHBondContact O-CZ 3.43Å; L148-F174 HydrophobicContact CB-CE2 4.16Å; L148-F174 HydrophobicContact CB-CZ 4.42Å; L148-F174 HydrophobicContact CD2-CE2 3.97Å; L148-F174 HydrophobicContact CG-CE2 3.86Å; Y149-F174 HydrophobicContact CD2-CB 4.27Å; Y149-F174 AromaticContact CD2-CD1 3.52Å; Y149-F174 HydrophobicContact CD2-CD1 3.52Å; Y149-F174 HydrophobicContact CD2-CD2 4.38Å; Y149-F174 AromaticContact CD2-CE1 3.89Å; Y149-F174 HydrophobicContact CD2-CE1 3.89Å; Y149-F174 AromaticContact CD2-CG 3.79Å; Y149-F174 HydrophobicContact CD2-CG 3.79Å; Y149-F174 HydrophobicContact CD2-CZ 4.46Å; Y149-F174 HydrophobicContact CE2-CD1 4.35Å; Y149-F174 HydrophobicContact CG-CD1 4.33Å; Y149-F174 HydrophobicContact CG-CE1 4.26Å; T152-F174 HydrophobicContact CG2-CD2 4.4Å; L170-F174 WeakPolarHBondContact O-CB 3.49Å; L170-F174 PolarHBondContact O-N 2.93Å; H171-F174 PolarHBondContact O-N 2.91Å; F174-V177 PolarHBondContact O-N 3.06Å; F174-T178 WeakPolarHBondContact CE1-OG1 3.39Å; F174-T178 VanDerWaalsContact O-CB 3.3Å; F174-T178 WeakPolarHBondContact O-CB 3.49Å; F174-T178 PolarHBondContact O-N 2.94Å; F174-T178 PolarHBondContact O-OG1 3.31Å
175	V	95.6	Very high	91.6	Very high	58 Å²	58	74 Å²	74	35%	0.352	40%	0.395	S	S	.	.	H	α-helix	trans	-63	-46.5	177.7	170.5	0	0	0	0	110.4	H171 L173 V177 T178 L179	H171-V175 WeakPolarHBondContact O-CG2 3.42Å; H171-V175 PolarHBondContact O-N 3.38Å; L173-V175 PolarHBondContact O-N 3.27Å; V175-V177 PolarHBondContact O-N 3.42Å; V175-T178 PolarHBondContact O-N 3.44Å; V175-L179 HydrophobicContact CG1-CD1 3.75Å; V175-L179 HydrophobicContact CG1-CG 4.31Å; V175-L179 VanDerWaalsContact O-CB 3.29Å; V175-L179 WeakPolarHBondContact O-CB 3.29Å; V175-L179 VanDerWaalsContact O-CG 3.25Å; V175-L179 WeakPolarHBondContact O-CG 3.36Å; V175-L179 PolarHBondContact O-N 3.34Å
176	A	95.8	Very high	91.3	Very high	56 Å²	56	71.7 Å²	71.7	46%	0.463	38%	0.383	S	S	.	.	H	α-helix	trans	-60.6	-45.4	177.9	0	0	0	0	0	112.3	D172 L173 S180	D172-A176 VanDerWaalsContact O-CB 3.27Å; D172-A176 WeakPolarHBondContact O-CB 3.4Å; D172-A176 PolarHBondContact O-N 2.99Å; L173-A176 PolarHBondContact O-N 3.48Å; A176-S180 VanDerWaalsContact O-CB 3.23Å; A176-S180 WeakPolarHBondContact O-CB 3.48Å; A176-S180 PolarHBondContact O-N 2.81Å
177	V	93.7	Very high	91.3	Very high	86 Å²	86	70.9 Å²	70.9	52%	0.521	38%	0.378	S	S	.	.	H	α-helix	trans	-64.9	-46.5	178.3	170.3	0	0	0	0	111.1	L173 F174 V175 L179 S180 F181	L173-V177 HydrophobicContact CD1-CG2 4.08Å; L173-V177 HydrophobicContact CG-CG2 4.49Å; L173-V177 WeakPolarHBondContact O-CB 3.42Å; L173-V177 VanDerWaalsContact O-CG2 3.28Å; L173-V177 WeakPolarHBondContact O-CG2 3.3Å; L173-V177 PolarHBondContact O-N 3.4Å; F174-V177 PolarHBondContact O-N 3.06Å; V175-V177 PolarHBondContact O-N 3.42Å; V177-L179 PolarHBondContact O-N 2.97Å; V177-S180 PolarHBondContact O-N 3.39Å; V177-F181 WeakPolarHBondContact O-CB 3.46Å; V177-F181 PolarHBondContact O-N 2.93Å
178	T	93.1	Very high	91.2	Very high	36 Å²	36	73.7 Å²	73.7	22%	0.221	39%	0.385	C	S	.	.	H	α-helix	trans	-64.4	-42.5	-179.5	-57.8	0	0	0	0	111.4	L140 V145 F174 V175 F181 N182	L140-T178 HydrophobicContact CD2-CG2 4.18Å; V145-T178 HydrophobicContact CG1-CG2 4.48Å; F174-T178 WeakPolarHBondContact CE1-OG1 3.39Å; F174-T178 VanDerWaalsContact O-CB 3.3Å; F174-T178 WeakPolarHBondContact O-CB 3.49Å; F174-T178 PolarHBondContact O-N 2.94Å; F174-T178 PolarHBondContact O-OG1 3.31Å; V175-T178 PolarHBondContact O-N 3.44Å; T178-F181 PolarHBondContact O-N 3.42Å; T178-N182 WeakPolarHBondContact O-CB 3.41Å; T178-N182 PolarHBondContact O-N 2.89Å
179	L	91.9	Very high	91.1	Very high	87 Å²	87	77.7 Å²	77.7	46%	0.455	39%	0.39	S	S	.	.	H	α-helix	trans	-64.6	-42.2	174.8	-74.8	175.2	0	0	0	112.1	V175 V177 N182 K183	V175-L179 HydrophobicContact CG1-CD1 3.75Å; V175-L179 HydrophobicContact CG1-CG 4.31Å; V175-L179 VanDerWaalsContact O-CB 3.29Å; V175-L179 WeakPolarHBondContact O-CB 3.29Å; V175-L179 VanDerWaalsContact O-CG 3.25Å; V175-L179 WeakPolarHBondContact O-CG 3.36Å; V175-L179 PolarHBondContact O-N 3.34Å; V177-L179 PolarHBondContact O-N 2.97Å; L179-N182 PolarHBondContact O-N 2.84Å; L179-K183 WeakPolarHBondContact O-CB 3.48Å; L179-K183 WeakPolarHBondContact O-CG 3.36Å; L179-K183 PolarHBondContact O-N 2.96Å
180	S	90.4	Very high	90.9	Very high	44 Å²	44	77.1 Å²	77.1	31%	0.308	39%	0.387	S	S	.	.	H	α-helix	trans	-61.5	-47.3	175.5	-175.7	0	0	0	0	110.7	A176 V177 N182 K183 Q184	A176-S180 VanDerWaalsContact O-CB 3.23Å; A176-S180 WeakPolarHBondContact O-CB 3.48Å; A176-S180 PolarHBondContact O-N 2.81Å; V177-S180 PolarHBondContact O-N 3.39Å; S180-N182 PolarHBondContact O-N 3.49Å; S180-K183 PolarHBondContact O-N 3.4Å; S180-Q184 WeakPolarHBondContact O-CA 3.31Å; S180-Q184 WeakPolarHBondContact O-CB 3.36Å; S180-Q184 WeakPolarHBondContact O-CG 3.28Å; S180-Q184 PolarHBondContact O-N 3.43Å; S180-Q184 PolarHBondContact OG-NE2 2.85Å; S180-Q184 PolarHBondContact OG-OE1 2.83Å
181	F	87.8	Confident	90.8	Very high	57 Å²	57	76.1 Å²	76.1	25%	0.25	38%	0.382	C	S	.	.	H	α-helix	trans	-59.8	-45.7	177	-171.5	-100.1	0	0	0	111.3	K136 L139 L140 V177 T178 K183 F185	K136-F181 HydrophobicContact CG-CE1 4.3Å; L139-F181 HydrophobicContact CB-CE1 4.01Å; L139-F181 HydrophobicContact CB-CZ 4.5Å; L139-F181 HydrophobicContact CD1-CE1 3.92Å; L139-F181 HydrophobicContact CD1-CE2 4.41Å; L139-F181 HydrophobicContact CD1-CZ 3.54Å; L140-F181 HydrophobicContact CD2-CD1 4.07Å; L140-F181 HydrophobicContact CG-CD1 4.29Å; L140-F181 HydrophobicContact CG-CE1 4.47Å; V177-F181 WeakPolarHBondContact O-CB 3.46Å; V177-F181 PolarHBondContact O-N 2.93Å; T178-F181 PolarHBondContact O-N 3.42Å; F181-K183 PolarHBondContact O-N 2.95Å; F181-F185 HydrophobicContact CD2-CB 4.03Å; F181-F185 HydrophobicContact CD2-CG 4.15Å; F181-F185 HydrophobicContact CE1-CD1 4.38Å; F181-F185 HydrophobicContact CE2-CB 4.06Å; F181-F185 AromaticContact CE2-CD1 3.79Å; F181-F185 HydrophobicContact CE2-CD1 3.79Å; F181-F185 HydrophobicContact CE2-CD2 4.03Å; F181-F185 HydrophobicContact CE2-CE1 4.19Å; F181-F185 HydrophobicContact CE2-CE2 4.43Å; F181-F185 AromaticContact CE2-CG 3.7Å; F181-F185 HydrophobicContact CE2-CG 3.7Å; F181-F185 HydrophobicContact CG-CB 4.39Å; F181-F185 HydrophobicContact CZ-CB 4.45Å; F181-F185 AromaticContact CZ-CD1 3.66Å; F181-F185 HydrophobicContact CZ-CD1 3.66Å; F181-F185 HydrophobicContact CZ-CE1 4.01Å; F181-F185 HydrophobicContact CZ-CG 4.05Å; F181-F185 WeakPolarHBondContact O-CB 3.32Å; F181-F185 PolarHBondContact O-N 3.22Å
182	N	88.4	Confident	90.7	Very high	78 Å²	78	74.6 Å²	74.6	42%	0.417	38%	0.375	S	S	.	.	H	α-helix	trans	-62.5	-45	178.5	-173.3	26.1	0	0	0	112.7	K136 L140 T178 L179 S180	K136-N182 PolarHBondContact NZ-O 3.25Å; L140-N182 HydrophobicContact CD1-CB 4Å; L140-N182 WeakPolarHBondContact CD1-OD1 3.25Å; L140-N182 HydrophobicContact CD2-CB 4.38Å; T178-N182 WeakPolarHBondContact O-CB 3.41Å; T178-N182 PolarHBondContact O-N 2.89Å; L179-N182 PolarHBondContact O-N 2.84Å; S180-N182 PolarHBondContact O-N 3.49Å
183	K	87.1	Confident	90.5	Very high	156 Å²	156	76.4 Å²	76.4	68%	0.678	39%	0.385	S	S	*	.	H	α-helix	trans	-83.8	-43.3	-174	-68.8	-177.2	177.8	-178.9	0	113.9	L179 S180 F181	L179-K183 WeakPolarHBondContact O-CB 3.48Å; L179-K183 WeakPolarHBondContact O-CG 3.36Å; L179-K183 PolarHBondContact O-N 2.96Å; S180-K183 PolarHBondContact O-N 3.4Å; F181-K183 PolarHBondContact O-N 2.95Å
184	Q	79.5	Confident	90.2	Very high	146 Å²	146	74.7 Å²	74.7	68%	0.682	38%	0.383	S	S	*	.	H	α-helix	trans	-91.7	-27.9	-170.5	-55	-175.3	10.5	0	0	112.6	S180 L186	S180-Q184 WeakPolarHBondContact O-CA 3.31Å; S180-Q184 WeakPolarHBondContact O-CB 3.36Å; S180-Q184 WeakPolarHBondContact O-CG 3.28Å; S180-Q184 PolarHBondContact O-N 3.43Å; S180-Q184 PolarHBondContact OG-NE2 2.85Å; S180-Q184 PolarHBondContact OG-OE1 2.83Å; Q184-L186 PolarHBondContact O-N 3.21Å
185	F	77.9	Confident	90	Very high	66 Å²	66	76.7 Å²	76.7	29%	0.289	41%	0.409	S	S	.	.			trans	-76.4	78.7	175.3	-159.3	-109.8	0	0	0	110.1	K136 F181 I187 F190	K136-F185 PolarHBondContact NZ-O 3.37Å; F181-F185 HydrophobicContact CD2-CB 4.03Å; F181-F185 HydrophobicContact CD2-CG 4.15Å; F181-F185 HydrophobicContact CE1-CD1 4.38Å; F181-F185 HydrophobicContact CE2-CB 4.06Å; F181-F185 AromaticContact CE2-CD1 3.79Å; F181-F185 HydrophobicContact CE2-CD1 3.79Å; F181-F185 HydrophobicContact CE2-CD2 4.03Å; F181-F185 HydrophobicContact CE2-CE1 4.19Å; F181-F185 HydrophobicContact CE2-CE2 4.43Å; F181-F185 AromaticContact CE2-CG 3.7Å; F181-F185 HydrophobicContact CE2-CG 3.7Å; F181-F185 HydrophobicContact CG-CB 4.39Å; F181-F185 HydrophobicContact CZ-CB 4.45Å; F181-F185 AromaticContact CZ-CD1 3.66Å; F181-F185 HydrophobicContact CZ-CD1 3.66Å; F181-F185 HydrophobicContact CZ-CE1 4.01Å; F181-F185 HydrophobicContact CZ-CG 4.05Å; F181-F185 WeakPolarHBondContact O-CB 3.32Å; F181-F185 PolarHBondContact O-N 3.22Å; F185-I187 HydrophobicContact CD1-CD1 3.44Å; F185-I187 VanDerWaalsContact CD1-CD1 3.44Å; F185-I187 HydrophobicContact CE1-CD1 3.2Å; F185-I187 HydrophobicContact CZ-CD1 4.2Å; F185-F190 HydrophobicContact CE2-CD2 4.43Å
186	L	86.1	Confident	89.8	Confident	81 Å²	81	78.8 Å²	78.8	42%	0.424	41%	0.414	S	S	.	.			trans	-84.6	107.4	171.6	-66	178.9	0	0	0	108.6	Q184 Q188 R189 F190	Q184-L186 PolarHBondContact O-N 3.21Å; L186-Q188 PolarHBondContact O-N 3.5Å; L186-R189 HydrophobicContact CB-CB 4.26Å; L186-R189 HydrophobicContact CB-CG 4.44Å; L186-R189 PolarHBondContact O-N 3.44Å; L186-F190 PolarHBondContact O-N 2.8Å
187	I	90.7	Very high	89.6	Confident	9 Å²	9	76.6 Å²	76.6	5%	0.046	40%	0.395	C	S	.	.	H	α-helix	trans	-54.5	-37.4	178	-53	-54.3	0	0	0	111.1	L129 G132 L133 K136 F185 R189 F190 C191	L129-I187 HydrophobicContact CD2-CG2 4.15Å; G132-I187 WeakPolarHBondContact O-CD1 3.48Å; L133-I187 HydrophobicContact CD2-CG1 4.25Å; L133-I187 HydrophobicContact CG-CG1 4.44Å; K136-I187 HydrophobicContact CB-CD1 4.37Å; K136-I187 HydrophobicContact CD-CD1 4.49Å; K136-I187 HydrophobicContact CD-CG1 4.44Å; F185-I187 HydrophobicContact CD1-CD1 3.44Å; F185-I187 VanDerWaalsContact CD1-CD1 3.44Å; F185-I187 HydrophobicContact CE1-CD1 3.2Å; F185-I187 HydrophobicContact CZ-CD1 4.2Å; I187-R189 PolarHBondContact O-N 2.86Å; I187-F190 WeakPolarHBondContact O-CB 3.37Å; I187-F190 PolarHBondContact O-N 3.37Å; I187-C191 PolarHBondContact O-N 3.29Å; I187-C191 PolarHBondContact O-SG 2.79Å
188	Q	91.8	Very high	89.3	Confident	81 Å²	81	77.4 Å²	77.4	38%	0.379	40%	0.404	S	S	.	.	H	α-helix	trans	-54.2	-53.7	174.9	-174.4	68.7	23.8	0	0	112.5	L129 L186 F190 C191 Q192	L129-Q188 HydrophobicContact CD2-CB 4.33Å; L186-Q188 PolarHBondContact O-N 3.5Å; Q188-F190 VanDerWaalsContact C-N 3.3Å; Q188-F190 PolarHBondContact O-N 2.73Å; Q188-C191 PolarHBondContact O-N 2.77Å; Q188-Q192 WeakPolarHBondContact O-CG 3.36Å; Q188-Q192 PolarHBondContact O-N 3.23Å
189	R	90.4	Very high	88.5	Confident	162 Å²	162	83.8 Å²	83.8	61%	0.611	43%	0.432	S	S	*	.	H	α-helix	trans	-63.9	-38.4	179.1	-81.2	-173.4	-179.1	168.7	-0.5	111.8	L186 I187 C191 Q192 N193	L186-R189 HydrophobicContact CB-CB 4.26Å; L186-R189 HydrophobicContact CB-CG 4.44Å; L186-R189 PolarHBondContact O-N 3.44Å; I187-R189 PolarHBondContact O-N 2.86Å; R189-C191 VanDerWaalsContact C-N 3.34Å; R189-C191 PolarHBondContact O-N 3.49Å; R189-Q192 PolarHBondContact O-N 3.18Å; R189-N193 WeakPolarHBondContact O-CB 3.42Å; R189-N193 PolarHBondContact O-N 3.26Å; R189-N193 PolarHBondContact O-OD1 3.49Å
190	F	90.4	Very high	87.2	Confident	113 Å²	113	87 Å²	87	50%	0.496	47%	0.471	S	S	.	.	H	α-helix	trans	-59.1	-47.7	175.3	-179.5	-92.4	0	0	0	111.1	F185 L186 I187 Q188 Q192 N193 A194	F185-F190 HydrophobicContact CE2-CD2 4.43Å; L186-F190 PolarHBondContact O-N 2.8Å; I187-F190 WeakPolarHBondContact O-CB 3.37Å; I187-F190 PolarHBondContact O-N 3.37Å; Q188-F190 VanDerWaalsContact C-N 3.3Å; Q188-F190 PolarHBondContact O-N 2.73Å; F190-Q192 PolarHBondContact O-N 2.96Å; F190-N193 PolarHBondContact O-N 3.24Å; F190-A194 WeakPolarHBondContact O-CB 2.93Å; F190-A194 PolarHBondContact O-N 3.09Å
191	C	93.4	Very high	87	Confident	0 Å²	0	89.2 Å²	89.2	0%	0	48%	0.479	C	S	.	.	H	α-helix	trans	-67.7	-33.1	178.4	-60.7	0	0	0	0	113.1	C128 L129 I187 Q188 R189 G195 F196 C197	C128-C191 HydrophobicContact CB-CB 3.84Å; C128-C191 WeakPolarHBondContact CB-SG 3.41Å; C128-C191 VanDerWaalsContact SG-CA 3.51Å; C128-C191 WeakPolarHBondContact SG-CB 3.19Å; C128-C191 CovalentContact SG-SG 2.03Å; C128-C191 PolarHBondContact SG-SG 3.35Å; L129-C191 HydrophobicContact CD2-CB 4.23Å; I187-C191 PolarHBondContact O-N 3.29Å; I187-C191 PolarHBondContact O-SG 2.79Å; Q188-C191 PolarHBondContact O-N 2.77Å; R189-C191 VanDerWaalsContact C-N 3.34Å; R189-C191 PolarHBondContact O-N 3.49Å; C191-G195 PolarHBondContact O-N 3.07Å; C191-F196 HydrophobicContact CB-CB 4.42Å; C191-F196 WeakPolarHBondContact O-CB 3.45Å; C191-F196 PolarHBondContact O-N 3.3Å; C191-C197 HydrophobicContact CB-CB 4.32Å; C191-C197 WeakPolarHBondContact CB-SG 3.24Å; C191-C197 PolarHBondContact O-N 2.78Å
192	Q	93.4	Very high	86.9	Confident	40 Å²	40	90.8 Å²	90.8	19%	0.187	49%	0.491	C	S	.	.	H	α-helix	trans	-67.3	-49.2	173.4	-73.9	171.1	-34.5	0	0	111.7	Q188 R189 F190 A194 G195 C197 S198	Q188-Q192 WeakPolarHBondContact O-CG 3.36Å; Q188-Q192 PolarHBondContact O-N 3.23Å; R189-Q192 PolarHBondContact O-N 3.18Å; F190-Q192 PolarHBondContact O-N 2.96Å; Q192-A194 PolarHBondContact O-N 3.16Å; Q192-G195 WeakPolarHBondContact O-CA 3Å; Q192-G195 PolarHBondContact O-N 2.91Å; Q192-C197 HydrophobicContact CG-CB 3.83Å; Q192-S198 PolarHBondContact NE2-O 3.2Å; Q192-S198 VanDerWaalsContact NE2-O 3.1Å
193	N	91.9	Very high	86.9	Confident	144 Å²	144	91.6 Å²	91.6	77%	0.77	50%	0.495	S	S	*	.	H	α-helix	trans	-62.8	-29.4	178.3	-69.8	-3.8	0	0	0	112.5	R189 F190 G195	R189-N193 WeakPolarHBondContact O-CB 3.42Å; R189-N193 PolarHBondContact O-N 3.26Å; R189-N193 PolarHBondContact O-OD1 3.49Å; F190-N193 PolarHBondContact O-N 3.24Å; N193-G195 PolarHBondContact O-N 3.31Å
194	A	90.2	Very high	86.9	Confident	47 Å²	47	87.8 Å²	87.8	39%	0.388	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-4.4	173.3	0	0	0	0	0	113.7	F190 Q192 F196	F190-A194 WeakPolarHBondContact O-CB 2.93Å; F190-A194 PolarHBondContact O-N 3.09Å; Q192-A194 PolarHBondContact O-N 3.16Å; A194-F196 VanDerWaalsContact C-N 3.3Å; A194-F196 HydrophobicContact CB-CD2 3.58Å; A194-F196 HydrophobicContact CB-CE2 3.6Å; A194-F196 HydrophobicContact CB-CG 4.17Å; A194-F196 HydrophobicContact CB-CZ 4.18Å; A194-F196 PolarHBondContact O-N 3.13Å
195	G	91.1	Very high	87.3	Confident	64 Å²	64	84.1 Å²	84.1	66%	0.66	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	14	-177.7	0	0	0	0	0	114.5	C191 Q192 N193	C191-G195 PolarHBondContact O-N 3.07Å; Q192-G195 WeakPolarHBondContact O-CA 3Å; Q192-G195 PolarHBondContact O-N 2.91Å; N193-G195 PolarHBondContact O-N 3.31Å
196	F	90.9	Very high	87.9	Confident	102 Å²	102	85.3 Å²	85.3	45%	0.447	48%	0.484	S	S	.	.	S	Bend	trans	-85	-31	-179.8	-60.5	-34.5	0	0	0	113.1	V124 C125 C128 C191 A194	V124-F196 HydrophobicContact CG1-CB 4.02Å; V124-F196 HydrophobicContact CG1-CD1 3.58Å; V124-F196 HydrophobicContact CG1-CE1 4.28Å; V124-F196 HydrophobicContact CG1-CG 3.94Å; C125-F196 VanDerWaalsContact CA-O 3.31Å; C125-F196 WeakPolarHBondContact CA-O 3.39Å; C125-F196 WeakPolarHBondContact CB-O 3.26Å; C125-F196 PolarHBondContact N-O 3.47Å; C128-F196 HydrophobicContact CB-CB 4.11Å; C128-F196 HydrophobicContact CB-CD2 3.79Å; C128-F196 HydrophobicContact CB-CG 4.31Å; C128-F196 VanDerWaalsContact SG-CD2 3.58Å; C191-F196 HydrophobicContact CB-CB 4.42Å; C191-F196 WeakPolarHBondContact O-CB 3.45Å; C191-F196 PolarHBondContact O-N 3.3Å; A194-F196 VanDerWaalsContact C-N 3.3Å; A194-F196 HydrophobicContact CB-CD2 3.58Å; A194-F196 HydrophobicContact CB-CE2 3.6Å; A194-F196 HydrophobicContact CB-CG 4.17Å; A194-F196 HydrophobicContact CB-CZ 4.18Å; A194-F196 PolarHBondContact O-N 3.13Å
197	C	91.8	Very high	88.1	Confident	9 Å²	9	85.6 Å²	85.6	6%	0.061	49%	0.488	C	S	.	.	S	Bend	trans	-115.1	144.7	175	-62	0	0	0	0	109.4	C125 C191 Q192	C125-C197 WeakPolarHBondContact CA-SG 3.26Å; C125-C197 HydrophobicContact CB-CB 3.92Å; C125-C197 WeakPolarHBondContact CB-SG 3.16Å; C125-C197 WeakPolarHBondContact SG-CB 3.41Å; C125-C197 CovalentContact SG-SG 2.04Å; C125-C197 PolarHBondContact SG-SG 2.97Å; C191-C197 HydrophobicContact CB-CB 4.32Å; C191-C197 WeakPolarHBondContact CB-SG 3.24Å; C191-C197 PolarHBondContact O-N 2.78Å; Q192-C197 HydrophobicContact CG-CB 3.83Å
198	S	87.9	Confident	87.9	Confident	103 Å²	103	91.5 Å²	91.5	72%	0.72	52%	0.522	S	S	*	.			trans	-63	149.9	167.5	55.8	0	0	0	0	110.4	Q192 A200	Q192-S198 PolarHBondContact NE2-O 3.2Å; Q192-S198 VanDerWaalsContact NE2-O 3.1Å; S198-A200 PolarHBondContact O-N 3.35Å
199	E	75	Confident	87.5	Confident	171 Å²	171	92.4 Å²	92.4	80%	0.799	53%	0.534	S	S	*	.			trans	-57	135.9	162.4	-64.4	-175.7	171.9	0	0	108
200	A	64.2	Low	87.3	Confident	154 Å²	154	86.1 Å²	86.1	100%	1.273	53%	0.527	S	S	*	.			trans	-79.4	0	177.9	0	0	0	0	0	109.8	S198	S198-A200 PolarHBondContact O-N 3.35Å

Retrieved 200 of 200 residues in 382.1 ms (Link to these results)

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