A0A077ZJ97_TRITR Loading...

BPD transp 1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZJ97, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 177 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	58.3	Low	78.3	Confident	216 Å²	216	88.9 Å²	88.9	100%	1.064	51%	0.505	S	S	*	.				0	-34.2	0	-64.7	-174.5	83.6	0	0	113.2	T3 A4	M1-T3 PolarHBondContact O-N 3.11Å; M1-A4 PolarHBondContact O-N 3.45Å
2	I	66.8	Low	79.6	Confident	112 Å²	112	88.6 Å²	88.6	57%	0.574	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.5	-178.9	-61	169.1	0	0	0	113.6	A4 P5 A52	I2-A4 VanDerWaalsContact C-N 3.34Å; I2-A4 PolarHBondContact O-N 3.3Å; I2-P5 WeakPolarHBondContact O-CD 3.42Å; I2-A52 HydrophobicContact CG2-CB 3.75Å
3	T	75.1	Confident	80.5	Confident	87 Å²	87	83 Å²	83	53%	0.534	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-4.2	-176.6	52.1	0	0	0	0	115	M1 L6	M1-T3 PolarHBondContact O-N 3.11Å; T3-L6 WeakPolarHBondContact O-CB 3.33Å; T3-L6 PolarHBondContact O-N 3.31Å; T3-L6 VanDerWaalsContact O-N 3.11Å
4	A	72.3	Confident	81.4	Confident	51 Å²	51	77.1 Å²	77.1	42%	0.421	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-58.6	-44.3	-174.8	0	0	0	0	0	113.4	M1 I2 L6 V7 M8	M1-A4 PolarHBondContact O-N 3.45Å; I2-A4 VanDerWaalsContact C-N 3.34Å; I2-A4 PolarHBondContact O-N 3.3Å; A4-L6 PolarHBondContact O-N 2.94Å; A4-V7 PolarHBondContact O-N 3.48Å; A4-M8 WeakPolarHBondContact O-CG 3.37Å; A4-M8 PolarHBondContact O-N 3.47Å
5	P	71.4	Confident	82.3	Confident	30 Å²	30	77.2 Å²	77.2	20%	0.195	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-65.1	-21.6	178.2	-24	37.6	0	0	0	114.2	I2 V7 A49	I2-P5 WeakPolarHBondContact O-CD 3.42Å; P5-V7 PolarHBondContact O-N 3.31Å; P5-A49 HydrophobicContact CB-CB 3.72Å; P5-A49 HydrophobicContact CG-CB 3.68Å
6	L	76.1	Confident	83	Confident	66 Å²	66	75.9 Å²	75.9	35%	0.346	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-73.8	-16.3	179.1	-72.5	93.8	0	0	0	113	T3 A4 A49 Y50 V53	T3-L6 WeakPolarHBondContact O-CB 3.33Å; T3-L6 PolarHBondContact O-N 3.31Å; T3-L6 VanDerWaalsContact O-N 3.11Å; A4-L6 PolarHBondContact O-N 2.94Å; L6-A49 HydrophobicContact CD1-CB 3.99Å; L6-Y50 HydrophobicContact CD2-CD1 4.13Å; L6-Y50 HydrophobicContact CD2-CE1 4.15Å; L6-Y50 HydrophobicContact CG-CD1 4.26Å; L6-Y50 HydrophobicContact CG-CE1 4.05Å; L6-V53 HydrophobicContact CD1-CG2 4.01Å; L6-V53 HydrophobicContact CD2-CG2 4.11Å
7	V	83.6	Confident	83.7	Confident	124 Å²	124	72.6 Å²	72.6	75%	0.752	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-18.8	-178.8	-171.1	0	0	0	0	111.4	A4 P5	A4-V7 PolarHBondContact O-N 3.48Å; P5-V7 PolarHBondContact O-N 3.31Å
8	M	84.8	Confident	84.3	Confident	74 Å²	74	70.5 Å²	70.5	37%	0.365	40%	0.399	S	S	.	.	S	Bend	trans	-77	133.2	-179.4	-72.1	178.5	67.7	0	0	110.9	A4 I12	A4-M8 WeakPolarHBondContact O-CG 3.37Å; A4-M8 PolarHBondContact O-N 3.47Å; M8-I12 HydrophobicContact CE-CB 4.47Å; M8-I12 HydrophobicContact CE-CG2 3.73Å
9	P	90.5	Very high	84.8	Confident	75 Å²	75	72.3 Å²	72.3	49%	0.487	41%	0.407	S	S	.	.			trans	-59	138.9	168.5	-20.3	30.2	0	0	0	111.3	V11 I12 T13	P9-V11 PolarHBondContact O-N 3.13Å; P9-V11 VanDerWaalsContact O-N 3.11Å; P9-I12 HydrophobicContact CB-CD1 4.42Å; P9-I12 HydrophobicContact CB-CG1 4.17Å; P9-I12 HydrophobicContact CG-CD1 3.88Å; P9-I12 HydrophobicContact CG-CG1 4.19Å; P9-I12 WeakPolarHBondContact O-CB 3.43Å; P9-I12 PolarHBondContact O-N 2.93Å; P9-T13 PolarHBondContact O-N 2.99Å; P9-T13 VanDerWaalsContact O-N 3.15Å
10	D	90.1	Very high	85.3	Confident	63 Å²	63	72.9 Å²	72.9	34%	0.337	41%	0.409	S	S	.	.	H	α-helix	trans	-56.5	-33.5	-177.8	-58.6	-27	0	0	0	112.7	I12 T13 G14 V109 I110	D10-I12 VanDerWaalsContact C-N 3.35Å; D10-I12 PolarHBondContact O-N 3.31Å; D10-T13 PolarHBondContact O-N 3.45Å; D10-G14 PolarHBondContact O-N 3.01Å; D10-V109 HydrophobicContact CB-CB 4.11Å; D10-V109 HydrophobicContact CB-CG1 3.97Å; D10-I110 HydrophobicContact CB-CG1 4.27Å
11	V	92.7	Very high	85.8	Confident	80 Å²	80	69.9 Å²	69.9	49%	0.485	39%	0.391	S	S	.	.	H	α-helix	trans	-61.7	-41.9	175.4	179.8	0	0	0	0	111.5	P9 L15 V109 F113	P9-V11 PolarHBondContact O-N 3.13Å; P9-V11 VanDerWaalsContact O-N 3.11Å; V11-L15 VanDerWaalsContact O-CB 3.24Å; V11-L15 WeakPolarHBondContact O-CB 3.48Å; V11-L15 PolarHBondContact O-N 3.19Å; V11-V109 HydrophobicContact CB-CG1 4.32Å; V11-V109 HydrophobicContact CG2-CG1 3.69Å; V11-F113 HydrophobicContact CB-CE2 4.47Å; V11-F113 HydrophobicContact CG1-CE2 3.97Å; V11-F113 HydrophobicContact CG1-CZ 3.97Å
12	I	93.4	Very high	87.4	Confident	85 Å²	85	62.3 Å²	62.3	44%	0.436	36%	0.357	S	S	.	.	H	α-helix	trans	-68.8	-43.5	179.1	-59.6	-172.4	0	0	0	109.4	M8 P9 D10 S16	M8-I12 HydrophobicContact CE-CB 4.47Å; M8-I12 HydrophobicContact CE-CG2 3.73Å; P9-I12 HydrophobicContact CB-CD1 4.42Å; P9-I12 HydrophobicContact CB-CG1 4.17Å; P9-I12 HydrophobicContact CG-CD1 3.88Å; P9-I12 HydrophobicContact CG-CG1 4.19Å; P9-I12 WeakPolarHBondContact O-CB 3.43Å; P9-I12 PolarHBondContact O-N 2.93Å; D10-I12 VanDerWaalsContact C-N 3.35Å; D10-I12 PolarHBondContact O-N 3.31Å; I12-S16 WeakPolarHBondContact O-CB 3.48Å; I12-S16 PolarHBondContact O-N 3.37Å; I12-S16 PolarHBondContact O-OG 2.85Å
13	T	91.8	Very high	88.7	Confident	16 Å²	16	59.6 Å²	59.6	10%	0.098	35%	0.352	C	S	.	.	H	α-helix	trans	-61.1	-48.4	176.8	-57.4	0	0	0	0	111.3	P9 D10 S16 L17 I110	P9-T13 PolarHBondContact O-N 2.99Å; P9-T13 VanDerWaalsContact O-N 3.15Å; D10-T13 PolarHBondContact O-N 3.45Å; T13-S16 PolarHBondContact O-N 2.87Å; T13-L17 HydrophobicContact CG2-CD1 3.99Å; T13-L17 WeakPolarHBondContact O-CB 3.42Å; T13-L17 WeakPolarHBondContact O-CG 3.25Å; T13-L17 PolarHBondContact O-N 3.27Å; T13-I110 HydrophobicContact CG2-CD1 4.2Å
14	G	93.3	Very high	89.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61.8	-47.4	178	0	0	0	0	0	112.8	D10 S16 L17 L18 F113	D10-G14 PolarHBondContact O-N 3.01Å; G14-S16 VanDerWaalsContact C-N 3.35Å; G14-S16 PolarHBondContact O-N 3.34Å; G14-L17 PolarHBondContact O-N 3.03Å; G14-L18 WeakPolarHBondContact O-CB 3.45Å; G14-L18 PolarHBondContact O-N 3.48Å; G14-F113 WeakPolarHBondContact O-CB 3.41Å
15	L	94.4	Very high	90.5	Very high	79 Å²	79	57 Å²	57	41%	0.414	33%	0.331	S	S	.	.	H	α-helix	trans	-61.9	-42.9	175.6	-178.7	61.9	0	0	0	111.6	V11 L17 L18 L19 F113	V11-L15 VanDerWaalsContact O-CB 3.24Å; V11-L15 WeakPolarHBondContact O-CB 3.48Å; V11-L15 PolarHBondContact O-N 3.19Å; L15-L17 PolarHBondContact O-N 3.36Å; L15-L18 HydrophobicContact CD1-CD2 4.49Å; L15-L18 WeakPolarHBondContact O-CB 3.36Å; L15-L18 PolarHBondContact O-N 2.89Å; L15-L19 HydrophobicContact CD1-CD1 4.44Å; L15-L19 HydrophobicContact CD1-CG 4.37Å; L15-L19 HydrophobicContact CG-CD1 4.21Å; L15-L19 VanDerWaalsContact O-CG 3.31Å; L15-L19 WeakPolarHBondContact O-CG 3.34Å; L15-L19 PolarHBondContact O-N 2.98Å; L15-F113 HydrophobicContact CB-CE1 4.44Å; L15-F113 HydrophobicContact CD1-CE1 4.36Å
16	S	94	Very high	91.5	Very high	57 Å²	57	63.1 Å²	63.1	40%	0.399	36%	0.357	S	S	.	.	H	α-helix	trans	-63.7	-41.7	179.3	-59.3	0	0	0	0	111.7	I12 T13 G14 L19 L20	I12-S16 WeakPolarHBondContact O-CB 3.48Å; I12-S16 PolarHBondContact O-N 3.37Å; I12-S16 PolarHBondContact O-OG 2.85Å; T13-S16 PolarHBondContact O-N 2.87Å; G14-S16 VanDerWaalsContact C-N 3.35Å; G14-S16 PolarHBondContact O-N 3.34Å; S16-L19 PolarHBondContact O-N 2.99Å; S16-L20 WeakPolarHBondContact O-CB 3.48Å; S16-L20 PolarHBondContact O-N 3.26Å
17	L	94.1	Very high	92.3	Very high	19 Å²	19	63.8 Å²	63.8	10%	0.099	37%	0.373	C	S	.	.	H	α-helix	trans	-68.2	-39.2	175.8	-73.4	168.5	0	0	0	112.2	T13 G14 L15 L20 F21 A42 I110 V114	T13-L17 HydrophobicContact CG2-CD1 3.99Å; T13-L17 WeakPolarHBondContact O-CB 3.42Å; T13-L17 WeakPolarHBondContact O-CG 3.25Å; T13-L17 PolarHBondContact O-N 3.27Å; G14-L17 PolarHBondContact O-N 3.03Å; L15-L17 PolarHBondContact O-N 3.36Å; L17-L20 HydrophobicContact CD2-CD2 4.29Å; L17-L20 WeakPolarHBondContact O-CB 3.24Å; L17-L20 PolarHBondContact O-N 3.18Å; L17-F21 HydrophobicContact CB-CE2 4.32Å; L17-F21 WeakPolarHBondContact O-CD2 3.45Å; L17-F21 WeakPolarHBondContact O-CG 3.27Å; L17-F21 PolarHBondContact O-N 3.49Å; L17-A42 HydrophobicContact CD1-CB 3.76Å; L17-I110 HydrophobicContact CD1-CG2 4.1Å; L17-V114 HydrophobicContact CB-CG1 3.82Å
18	L	94.4	Very high	92.7	Very high	35 Å²	35	64.2 Å²	64.2	18%	0.183	37%	0.369	C	S	.	.	H	α-helix	trans	-58	-52.5	171.5	168.2	59.3	0	0	0	110.8	G14 L15 L20 F21 V22 F113	G14-L18 WeakPolarHBondContact O-CB 3.45Å; G14-L18 PolarHBondContact O-N 3.48Å; L15-L18 HydrophobicContact CD1-CD2 4.49Å; L15-L18 WeakPolarHBondContact O-CB 3.36Å; L15-L18 PolarHBondContact O-N 2.89Å; L18-L20 VanDerWaalsContact C-N 3.26Å; L18-L20 PolarHBondContact O-N 2.87Å; L18-F21 PolarHBondContact O-N 2.91Å; L18-V22 HydrophobicContact CD1-CG2 3.92Å; L18-V22 WeakPolarHBondContact O-CG2 3.48Å; L18-V22 PolarHBondContact O-N 3.15Å; L18-F113 HydrophobicContact CB-CB 4.28Å; L18-F113 WeakPolarHBondContact CD1-O 3.35Å; L18-F113 HydrophobicContact CD2-CD1 4.04Å
19	L	94.8	Very high	92.8	Very high	105 Å²	105	62.9 Å²	62.9	55%	0.55	37%	0.374	S	S	.	.	H	α-helix	trans	-60.5	-37.5	178.8	-69.4	175.2	0	0	0	111.6	L15 S16 V22 A23	L15-L19 HydrophobicContact CD1-CD1 4.44Å; L15-L19 HydrophobicContact CD1-CG 4.37Å; L15-L19 HydrophobicContact CG-CD1 4.21Å; L15-L19 VanDerWaalsContact O-CG 3.31Å; L15-L19 WeakPolarHBondContact O-CG 3.34Å; L15-L19 PolarHBondContact O-N 2.98Å; S16-L19 PolarHBondContact O-N 2.99Å; L19-V22 PolarHBondContact O-N 3.5Å; L19-A23 VanDerWaalsContact O-CB 3.28Å; L19-A23 WeakPolarHBondContact O-CB 3.46Å; L19-A23 PolarHBondContact O-N 3.35Å
20	L	94.7	Very high	92.7	Very high	84 Å²	84	64.8 Å²	64.8	44%	0.44	37%	0.372	S	S	.	.	H	α-helix	trans	-61.5	-50.9	173	176.3	65.7	0	0	0	111.8	S16 L17 L18 V22 A23 L24	S16-L20 WeakPolarHBondContact O-CB 3.48Å; S16-L20 PolarHBondContact O-N 3.26Å; L17-L20 HydrophobicContact CD2-CD2 4.29Å; L17-L20 WeakPolarHBondContact O-CB 3.24Å; L17-L20 PolarHBondContact O-N 3.18Å; L18-L20 VanDerWaalsContact C-N 3.26Å; L18-L20 PolarHBondContact O-N 2.87Å; L20-V22 VanDerWaalsContact C-N 3.3Å; L20-V22 PolarHBondContact O-N 2.88Å; L20-A23 PolarHBondContact O-N 3.25Å; L20-L24 HydrophobicContact CD1-CD1 4.03Å; L20-L24 HydrophobicContact CD1-CG 4.12Å; L20-L24 HydrophobicContact CG-CD1 3.97Å; L20-L24 HydrophobicContact CG-CG 4.44Å; L20-L24 WeakPolarHBondContact O-CB 3.25Å; L20-L24 WeakPolarHBondContact O-CG 3.18Å; L20-L24 PolarHBondContact O-N 3.37Å
21	F	94.7	Very high	92.4	Very high	10 Å²	10	62.3 Å²	62.3	4%	0.044	36%	0.359	C	S	.	.	H	α-helix	trans	-63.1	-37.8	179	-66.2	-41.6	0	0	0	111.9	L17 L18 A25 P31 T38 L41 V114	L17-F21 HydrophobicContact CB-CE2 4.32Å; L17-F21 WeakPolarHBondContact O-CD2 3.45Å; L17-F21 WeakPolarHBondContact O-CG 3.27Å; L17-F21 PolarHBondContact O-N 3.49Å; L18-F21 PolarHBondContact O-N 2.91Å; F21-A25 VanDerWaalsContact O-CB 3.3Å; F21-A25 WeakPolarHBondContact O-CB 3.3Å; F21-A25 PolarHBondContact O-N 3.41Å; F21-P31 HydrophobicContact CB-CG 4.12Å; F21-P31 HydrophobicContact CD1-CG 4.4Å; F21-P31 HydrophobicContact CG-CG 4.45Å; F21-T38 HydrophobicContact CD1-CG2 4.22Å; F21-T38 HydrophobicContact CD2-CG2 3.93Å; F21-T38 HydrophobicContact CE1-CG2 4.37Å; F21-T38 HydrophobicContact CE2-CG2 4.08Å; F21-T38 HydrophobicContact CG-CG2 4.02Å; F21-T38 HydrophobicContact CZ-CG2 4.3Å; F21-L41 HydrophobicContact CE1-CD1 4.37Å; F21-L41 HydrophobicContact CZ-CB 4.17Å; F21-V114 HydrophobicContact CD2-CB 4.2Å; F21-V114 HydrophobicContact CD2-CG1 4.13Å; F21-V114 HydrophobicContact CE2-CB 3.91Å; F21-V114 HydrophobicContact CE2-CG1 3.82Å
22	V	93	Very high	91.7	Very high	57 Å²	57	62.6 Å²	62.6	35%	0.345	37%	0.37	S	S	.	.	H	α-helix	trans	-64	-46.3	173.2	172.5	0	0	0	0	110.6	L18 L19 L20 L24 A25 H26	L18-V22 HydrophobicContact CD1-CG2 3.92Å; L18-V22 WeakPolarHBondContact O-CG2 3.48Å; L18-V22 PolarHBondContact O-N 3.15Å; L19-V22 PolarHBondContact O-N 3.5Å; L20-V22 VanDerWaalsContact C-N 3.3Å; L20-V22 PolarHBondContact O-N 2.88Å; V22-L24 PolarHBondContact O-N 3.25Å; V22-A25 PolarHBondContact O-N 3.47Å; V22-H26 PolarHBondContact O-N 2.85Å; V22-H26 VanDerWaalsContact O-N 3.09Å; V22-H26 PolarHBondContact O-ND1 3.49Å
23	A	93.8	Very high	91.3	Very high	55 Å²	55	65.1 Å²	65.1	46%	0.455	38%	0.384	S	S	.	.	H	α-helix	trans	-63.3	-42.2	179	0	0	0	0	0	112.3	L19 L20 H26 A27	L19-A23 VanDerWaalsContact O-CB 3.28Å; L19-A23 WeakPolarHBondContact O-CB 3.46Å; L19-A23 PolarHBondContact O-N 3.35Å; L20-A23 PolarHBondContact O-N 3.25Å; A23-H26 PolarHBondContact O-N 2.81Å; A23-A27 WeakPolarHBondContact O-CB 3.46Å; A23-A27 PolarHBondContact O-N 2.9Å
24	L	93.8	Very high	91.1	Very high	48 Å²	48	68.2 Å²	68.2	25%	0.251	39%	0.394	S	S	.	.	H	α-helix	trans	-65.1	-38.9	175.9	-70.6	172.4	0	0	0	111.8	L20 V22 H26 A27 I28 G29 W30	L20-L24 HydrophobicContact CD1-CD1 4.03Å; L20-L24 HydrophobicContact CD1-CG 4.12Å; L20-L24 HydrophobicContact CG-CD1 3.97Å; L20-L24 HydrophobicContact CG-CG 4.44Å; L20-L24 WeakPolarHBondContact O-CB 3.25Å; L20-L24 WeakPolarHBondContact O-CG 3.18Å; L20-L24 PolarHBondContact O-N 3.37Å; V22-L24 PolarHBondContact O-N 3.25Å; L24-H26 VanDerWaalsContact C-N 3.29Å; L24-H26 PolarHBondContact O-N 3.4Å; L24-A27 PolarHBondContact O-N 2.86Å; L24-I28 HydrophobicContact CD2-CD1 4.17Å; L24-I28 PolarHBondContact O-N 3.35Å; L24-G29 PolarHBondContact O-N 2.86Å; L24-W30 CarbonylContact C-O 3.6Å; L24-W30 WeakPolarHBondContact CB-O 3.4Å; L24-W30 HydrophobicContact CD1-CE3 4.43Å; L24-W30 HydrophobicContact CD1-CZ3 4.22Å
25	A	92.2	Very high	91	Very high	34 Å²	34	69 Å²	69	28%	0.281	40%	0.402	S	S	.	.	H	α-helix	trans	-61	-39.7	175.3	0	0	0	0	0	111.3	F21 V22 G29 W30 P31	F21-A25 VanDerWaalsContact O-CB 3.3Å; F21-A25 WeakPolarHBondContact O-CB 3.3Å; F21-A25 PolarHBondContact O-N 3.41Å; V22-A25 PolarHBondContact O-N 3.47Å; A25-G29 WeakPolarHBondContact O-CA 3.38Å; A25-G29 PolarHBondContact O-N 3.48Å; A25-W30 WeakPolarHBondContact CA-O 3.23Å; A25-W30 PolarHBondContact N-O 3.31Å; A25-P31 WeakPolarHBondContact CB-O 3.46Å
26	H	91.2	Very high	90.8	Very high	159 Å²	159	71.1 Å²	71.1	74%	0.736	41%	0.411	S	S	*	.	H	α-helix	trans	-73.6	-35.3	175.8	-71.3	85.4	0	0	0	113.4	V22 A23 L24	V22-H26 PolarHBondContact O-N 2.85Å; V22-H26 VanDerWaalsContact O-N 3.09Å; V22-H26 PolarHBondContact O-ND1 3.49Å; A23-H26 PolarHBondContact O-N 2.81Å; L24-H26 VanDerWaalsContact C-N 3.29Å; L24-H26 PolarHBondContact O-N 3.4Å
27	A	92.7	Very high	90.7	Very high	81 Å²	81	72.7 Å²	72.7	67%	0.669	42%	0.415	S	S	*	.	H	α-helix	trans	-83.1	-41.5	-174.2	0	0	0	0	0	113.7	A23 L24	A23-A27 WeakPolarHBondContact O-CB 3.46Å; A23-A27 PolarHBondContact O-N 2.9Å; L24-A27 PolarHBondContact O-N 2.86Å
28	I	93.1	Very high	90.7	Very high	132 Å²	132	71.8 Å²	71.8	68%	0.677	41%	0.41	S	S	*	.	H	α-helix	trans	-122.5	-9.7	-171.1	-52.3	173.8	0	0	0	111.1	L24 W30	L24-I28 HydrophobicContact CD2-CD1 4.17Å; L24-I28 PolarHBondContact O-N 3.35Å; I28-W30 VanDerWaalsContact C-N 3.31Å
29	G	86.9	Confident	90.7	Very high	46 Å²	46	70.5 Å²	70.5	47%	0.474	40%	0.403	S	S	.	.			trans	80.7	11.6	-174.3	0	0	0	0	0	113.6	L24 A25	L24-G29 PolarHBondContact O-N 2.86Å; A25-G29 WeakPolarHBondContact O-CA 3.38Å; A25-G29 PolarHBondContact O-N 3.48Å
30	W	87.5	Confident	90.7	Very high	115 Å²	115	73.2 Å²	73.2	44%	0.436	41%	0.406	S	S	.	.			trans	-130.8	135.9	-176.9	-176.5	95.2	0	0	0	111.4	L24 A25 I28 L37 L41	L24-W30 CarbonylContact C-O 3.6Å; L24-W30 WeakPolarHBondContact CB-O 3.4Å; L24-W30 HydrophobicContact CD1-CE3 4.43Å; L24-W30 HydrophobicContact CD1-CZ3 4.22Å; A25-W30 WeakPolarHBondContact CA-O 3.23Å; A25-W30 PolarHBondContact N-O 3.31Å; I28-W30 VanDerWaalsContact C-N 3.31Å; W30-L37 HydrophobicContact CH2-CD2 4.18Å; W30-L37 HydrophobicContact CZ2-CD2 3.62Å; W30-L41 HydrophobicContact CH2-CD1 3.41Å; W30-L41 VanDerWaalsContact CH2-CD1 3.41Å; W30-L41 HydrophobicContact CZ2-CD1 4.02Å; W30-L41 HydrophobicContact CZ3-CD1 4.45Å
31	P	84.5	Confident	90.7	Very high	11 Å²	11	71.3 Å²	71.3	7%	0.071	40%	0.396	C	S	.	.	S	Bend	cis	-72.7	139.8	-6.2	31.2	-34.7	0	0	0	110.9	F21 A25 D33 T38	F21-P31 HydrophobicContact CB-CG 4.12Å; F21-P31 HydrophobicContact CD1-CG 4.4Å; F21-P31 HydrophobicContact CG-CG 4.45Å; A25-P31 WeakPolarHBondContact CB-O 3.46Å; P31-D33 VanDerWaalsContact C-N 3.3Å; P31-D33 PolarHBondContact O-N 2.83Å; P31-T38 HydrophobicContact CB-CG2 3.99Å; P31-T38 HydrophobicContact CG-CG2 3.58Å
32	A	78.3	Confident	90.7	Very high	86 Å²	86	70.9 Å²	70.9	71%	0.711	39%	0.394	S	S	*	.	S	Bend	trans	-60.5	-42.9	178.7	0	0	0	0	0	111.5
33	D	84.3	Confident	90.8	Very high	138 Å²	138	68.8 Å²	68.8	74%	0.738	38%	0.381	S	S	*	.	S	Bend	trans	-132.5	142.4	171.2	-70.2	-58.8	0	0	0	109.6	P31	P31-D33 VanDerWaalsContact C-N 3.3Å; P31-D33 PolarHBondContact O-N 2.83Å
34	R	88.4	Confident	90.8	Very high	82 Å²	82	68.9 Å²	68.9	31%	0.309	38%	0.376	S	S	.	.			trans	-69.5	140.5	168.4	-66.5	-177.2	-64	121.7	15.4	108.7	T38 F113 S115 G116	R34-T38 HydrophobicContact CB-CG2 4.44Å; R34-T38 HydrophobicContact CG-CG2 4.34Å; R34-F113 PolarHBondContact NH1-O 3.5Å; R34-S115 VanDerWaalsContact CZ-O 3.24Å; R34-S115 PolarHBondContact NH1-O 3.06Å; R34-G116 WeakPolarHBondContact O-CA 3.43Å; R34-G116 PolarHBondContact O-N 2.94Å
35	G	90.7	Very high	90.8	Very high	15 Å²	15	70.6 Å²	70.6	16%	0.155	39%	0.388	C	S	.	.	S	Bend	trans	-171.4	-153.8	-173.4	0	0	0	0	0	113	L37 T38 I39	G35-L37 PolarHBondContact O-N 3.1Å; G35-T38 PolarHBondContact N-OG1 2.93Å; G35-T38 PolarHBondContact O-N 3.49Å; G35-T38 PolarHBondContact O-OG1 3.27Å; G35-I39 WeakPolarHBondContact O-CG1 3.21Å; G35-I39 PolarHBondContact O-N 2.84Å
36	M	90.4	Very high	90.8	Very high	124 Å²	124	69.4 Å²	69.4	61%	0.611	38%	0.377	S	S	*	.	H	α-helix	trans	-58.7	-34.3	179.2	-173.1	60.5	72.7	0	0	112.5	I39 W40	M36-I39 PolarHBondContact O-N 2.87Å; M36-W40 WeakPolarHBondContact O-CB 3.36Å; M36-W40 PolarHBondContact O-N 3.41Å
37	L	91.9	Very high	90.9	Very high	90 Å²	90	62.3 Å²	62.3	47%	0.471	35%	0.345	S	S	.	.	H	α-helix	trans	-66.4	-44.4	-179.8	-167.1	158	0	0	0	111.9	W30 G35 I39 W40 L41	W30-L37 HydrophobicContact CH2-CD2 4.18Å; W30-L37 HydrophobicContact CZ2-CD2 3.62Å; G35-L37 PolarHBondContact O-N 3.1Å; L37-I39 VanDerWaalsContact C-N 3.31Å; L37-I39 PolarHBondContact O-N 3.42Å; L37-W40 PolarHBondContact O-N 3.19Å; L37-L41 HydrophobicContact CD2-CD1 3.41Å; L37-L41 VanDerWaalsContact CD2-CD1 3.41Å; L37-L41 HydrophobicContact CD2-CG 3.94Å; L37-L41 WeakPolarHBondContact O-CG 3.22Å; L37-L41 PolarHBondContact O-N 3.37Å
38	T	94.3	Very high	90.9	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.006	34%	0.336	C	S	.	.	H	α-helix	trans	-66.5	-36.4	178.3	48.9	0	0	0	0	111.6	F21 P31 R34 G35 A42 V114	F21-T38 HydrophobicContact CD1-CG2 4.22Å; F21-T38 HydrophobicContact CD2-CG2 3.93Å; F21-T38 HydrophobicContact CE1-CG2 4.37Å; F21-T38 HydrophobicContact CE2-CG2 4.08Å; F21-T38 HydrophobicContact CG-CG2 4.02Å; F21-T38 HydrophobicContact CZ-CG2 4.3Å; P31-T38 HydrophobicContact CB-CG2 3.99Å; P31-T38 HydrophobicContact CG-CG2 3.58Å; R34-T38 HydrophobicContact CB-CG2 4.44Å; R34-T38 HydrophobicContact CG-CG2 4.34Å; G35-T38 PolarHBondContact N-OG1 2.93Å; G35-T38 PolarHBondContact O-N 3.49Å; G35-T38 PolarHBondContact O-OG1 3.27Å; T38-A42 VanDerWaalsContact O-CB 3.24Å; T38-A42 WeakPolarHBondContact O-CB 3.25Å; T38-A42 PolarHBondContact O-N 3.34Å; T38-V114 WeakPolarHBondContact CB-O 3.14Å; T38-V114 PolarHBondContact OG1-O 2.85Å
39	I	94.7	Very high	90.9	Very high	7 Å²	7	56.3 Å²	56.3	4%	0.036	31%	0.307	C	S	.	.	H	α-helix	trans	-61	-51.5	170.8	-61.7	166.1	0	0	0	110	G35 M36 L37 L41 A42 H43 V114 A119 T121	G35-I39 WeakPolarHBondContact O-CG1 3.21Å; G35-I39 PolarHBondContact O-N 2.84Å; M36-I39 PolarHBondContact O-N 2.87Å; L37-I39 VanDerWaalsContact C-N 3.31Å; L37-I39 PolarHBondContact O-N 3.42Å; I39-L41 PolarHBondContact O-N 2.89Å; I39-A42 PolarHBondContact O-N 3.47Å; I39-H43 WeakPolarHBondContact O-CB 3.33Å; I39-H43 PolarHBondContact O-CD2 3.29Å; I39-H43 PolarHBondContact O-N 3.31Å; I39-V114 HydrophobicContact CB-CG2 4.32Å; I39-V114 HydrophobicContact CG1-CG2 3.9Å; I39-A119 HydrophobicContact CD1-CB 3.96Å; I39-A119 WeakPolarHBondContact CD1-O 3.4Å; I39-T121 HydrophobicContact CD1-CG2 4.05Å; I39-T121 HydrophobicContact CG2-CG2 4.17Å
40	W	94.1	Very high	91.1	Very high	162 Å²	162	56.6 Å²	56.6	61%	0.614	29%	0.294	S	S	*	.	H	α-helix	trans	-57.8	-47	179.8	179.3	73.7	0	0	0	112.3	M36 L37 A42 H43 V44	M36-W40 WeakPolarHBondContact O-CB 3.36Å; M36-W40 PolarHBondContact O-N 3.41Å; L37-W40 PolarHBondContact O-N 3.19Å; W40-A42 PolarHBondContact O-N 3.13Å; W40-H43 PolarHBondContact O-N 3.45Å; W40-V44 HydrophobicContact CD2-CG2 4.12Å; W40-V44 HydrophobicContact CG-CG2 4.44Å; W40-V44 HydrophobicContact CZ2-CG2 4Å; W40-V44 WeakPolarHBondContact O-CB 3.47Å; W40-V44 VanDerWaalsContact O-CG2 3.25Å; W40-V44 WeakPolarHBondContact O-CG2 3.3Å; W40-V44 PolarHBondContact O-N 3.09Å
41	L	94.5	Very high	91.5	Very high	45 Å²	45	52.7 Å²	52.7	24%	0.236	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-41.1	177.8	-73.3	177.6	0	0	0	113.1	F21 W30 L37 I39 V44 T45	F21-L41 HydrophobicContact CE1-CD1 4.37Å; F21-L41 HydrophobicContact CZ-CB 4.17Å; W30-L41 HydrophobicContact CH2-CD1 3.41Å; W30-L41 VanDerWaalsContact CH2-CD1 3.41Å; W30-L41 HydrophobicContact CZ2-CD1 4.02Å; W30-L41 HydrophobicContact CZ3-CD1 4.45Å; L37-L41 HydrophobicContact CD2-CD1 3.41Å; L37-L41 VanDerWaalsContact CD2-CD1 3.41Å; L37-L41 HydrophobicContact CD2-CG 3.94Å; L37-L41 WeakPolarHBondContact O-CG 3.22Å; L37-L41 PolarHBondContact O-N 3.37Å; I39-L41 PolarHBondContact O-N 2.89Å; L41-V44 PolarHBondContact O-N 3.4Å; L41-T45 WeakPolarHBondContact O-CB 3.41Å; L41-T45 PolarHBondContact O-N 2.91Å; L41-T45 PolarHBondContact O-OG1 3.42Å
42	A	94.5	Very high	91.9	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-47.2	176.6	0	0	0	0	0	111	L17 T38 I39 W40 T45 F46 I110 V114	L17-A42 HydrophobicContact CD1-CB 3.76Å; T38-A42 VanDerWaalsContact O-CB 3.24Å; T38-A42 WeakPolarHBondContact O-CB 3.25Å; T38-A42 PolarHBondContact O-N 3.34Å; I39-A42 PolarHBondContact O-N 3.47Å; W40-A42 PolarHBondContact O-N 3.13Å; A42-T45 PolarHBondContact O-N 3.36Å; A42-F46 WeakPolarHBondContact O-CB 3.46Å; A42-F46 PolarHBondContact O-N 3.12Å; A42-I110 HydrophobicContact CB-CG2 3.79Å; A42-V114 HydrophobicContact CB-CB 4.27Å; A42-V114 HydrophobicContact CB-CG1 3.98Å; A42-V114 HydrophobicContact CB-CG2 3.76Å
43	H	94.8	Very high	92.6	Very high	13 Å²	13	52 Å²	52	6%	0.06	27%	0.273	C	S	.	.	H	α-helix	trans	-68	-39.4	179.8	-74.6	-130.3	0	0	0	111.7	I39 W40 F46 C47 S104 D107	I39-H43 WeakPolarHBondContact O-CB 3.33Å; I39-H43 PolarHBondContact O-CD2 3.29Å; I39-H43 PolarHBondContact O-N 3.31Å; W40-H43 PolarHBondContact O-N 3.45Å; H43-F46 PolarHBondContact O-N 3.25Å; H43-C47 WeakPolarHBondContact O-CB 3.38Å; H43-C47 PolarHBondContact O-N 3.21Å; H43-C47 PolarHBondContact O-SG 3.48Å; H43-S104 PolarHBondContact CE1-O 3.43Å; H43-S104 PolarHBondContact ND1-O 3.4Å; H43-S104 PolarHBondContact ND1-OG 2.89Å; H43-D107 IonicContact CE1-OD2 3.62Å; H43-D107 IonicContact NE2-OD2 3.38Å; H43-D107 PolarHBondContact NE2-OD2 2.82Å
44	V	94.8	Very high	93	Very high	58 Å²	58	47.4 Å²	47.4	35%	0.352	25%	0.25	S	C	.	.	H	α-helix	trans	-59.9	-48	172.9	167.6	0	0	0	0	110.3	W40 L41 F46 T48	W40-V44 HydrophobicContact CD2-CG2 4.12Å; W40-V44 HydrophobicContact CG-CG2 4.44Å; W40-V44 HydrophobicContact CZ2-CG2 4Å; W40-V44 WeakPolarHBondContact O-CB 3.47Å; W40-V44 VanDerWaalsContact O-CG2 3.25Å; W40-V44 WeakPolarHBondContact O-CG2 3.3Å; W40-V44 PolarHBondContact O-N 3.09Å; L41-V44 PolarHBondContact O-N 3.4Å; V44-F46 PolarHBondContact O-N 2.91Å; V44-T48 WeakPolarHBondContact O-CB 3.49Å; V44-T48 PolarHBondContact O-N 2.81Å; V44-T48 PolarHBondContact O-OG1 3.22Å
45	T	92.6	Very high	93.3	Very high	83 Å²	83	45.4 Å²	45.4	51%	0.509	24%	0.244	S	C	.	.	H	α-helix	trans	-60.5	-47.8	179.8	-57.1	0	0	0	0	111.2	L41 A42	L41-T45 WeakPolarHBondContact O-CB 3.41Å; L41-T45 PolarHBondContact O-N 2.91Å; L41-T45 PolarHBondContact O-OG1 3.42Å; A42-T45 PolarHBondContact O-N 3.36Å
46	F	92.1	Very high	93.4	Very high	10 Å²	10	47.1 Å²	47.1	4%	0.044	25%	0.254	C	S	.	.	H	α-helix	trans	-63.6	-54.6	178.8	176.9	-109.3	0	0	0	112	A42 H43 V44 T48 A49 Y50 L103 I110	A42-F46 WeakPolarHBondContact O-CB 3.46Å; A42-F46 PolarHBondContact O-N 3.12Å; H43-F46 PolarHBondContact O-N 3.25Å; V44-F46 PolarHBondContact O-N 2.91Å; F46-T48 VanDerWaalsContact C-N 3.32Å; F46-T48 PolarHBondContact O-N 2.81Å; F46-A49 WeakPolarHBondContact O-CB 3.27Å; F46-A49 PolarHBondContact O-N 3.36Å; F46-Y50 HydrophobicContact CD1-CE2 4.4Å; F46-Y50 HydrophobicContact CD2-CE2 4.14Å; F46-Y50 AromaticContact CE1-CE2 3.93Å; F46-Y50 HydrophobicContact CE1-CE2 3.93Å; F46-Y50 AromaticContact CE2-CE2 3.64Å; F46-Y50 HydrophobicContact CE2-CE2 3.64Å; F46-Y50 AromaticContact CZ-CE2 3.53Å; F46-Y50 HydrophobicContact CZ-CE2 3.53Å; F46-Y50 WeakPolarHBondContact O-CD2 3.46Å; F46-L103 HydrophobicContact CE1-CB 4.3Å; F46-I110 HydrophobicContact CB-CD1 4.1Å; F46-I110 HydrophobicContact CD1-CD1 4.09Å; F46-I110 HydrophobicContact CD2-CD1 3.54Å; F46-I110 HydrophobicContact CE1-CD1 4.38Å; F46-I110 HydrophobicContact CE2-CD1 3.86Å; F46-I110 HydrophobicContact CG-CD1 3.65Å; F46-I110 HydrophobicContact CZ-CD1 4.26Å
47	C	93.9	Very high	93.5	Very high	10 Å²	10	44.1 Å²	44.1	7%	0.068	25%	0.245	C	C	.	.	H	α-helix	trans	-65.5	-33.8	-176.2	-67	0	0	0	0	112.6	H43 A49 Y50 V51 A100	H43-C47 WeakPolarHBondContact O-CB 3.38Å; H43-C47 PolarHBondContact O-N 3.21Å; H43-C47 PolarHBondContact O-SG 3.48Å; C47-A49 PolarHBondContact O-N 2.84Å; C47-Y50 PolarHBondContact O-N 3.39Å; C47-Y50 VanDerWaalsContact O-N 3.1Å; C47-V51 WeakPolarHBondContact O-CG2 3.48Å; C47-V51 PolarHBondContact O-N 2.96Å; C47-A100 HydrophobicContact CB-CB 3.7Å; C47-A100 PolarHBondContact SG-O 2.85Å
48	T	93.7	Very high	93.5	Very high	78 Å²	78	44.2 Å²	44.2	48%	0.479	24%	0.239	S	C	.	.	H	α-helix	trans	-59.3	-33.6	179.5	-62.5	0	0	0	0	111.7	V44 F46 Y50 V51 A52	V44-T48 WeakPolarHBondContact O-CB 3.49Å; V44-T48 PolarHBondContact O-N 2.81Å; V44-T48 PolarHBondContact O-OG1 3.22Å; F46-T48 VanDerWaalsContact C-N 3.32Å; F46-T48 PolarHBondContact O-N 2.81Å; T48-Y50 PolarHBondContact O-N 3.29Å; T48-V51 PolarHBondContact O-N 3.2Å; T48-A52 WeakPolarHBondContact O-CB 3.49Å; T48-A52 PolarHBondContact O-N 3.39Å
49	A	92	Very high	93.4	Very high	8 Å²	8	48 Å²	48	7%	0.066	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-44.4	176.3	0	0	0	0	0	112	P5 L6 F46 C47 V53	P5-A49 HydrophobicContact CB-CB 3.72Å; P5-A49 HydrophobicContact CG-CB 3.68Å; L6-A49 HydrophobicContact CD1-CB 3.99Å; F46-A49 WeakPolarHBondContact O-CB 3.27Å; F46-A49 PolarHBondContact O-N 3.36Å; C47-A49 PolarHBondContact O-N 2.84Å; A49-V53 WeakPolarHBondContact O-CG2 3.23Å; A49-V53 PolarHBondContact O-N 3.05Å
50	Y	92	Very high	93.2	Very high	53 Å²	53	58.1 Å²	58.1	21%	0.208	30%	0.297	C	S	.	.	H	α-helix	trans	-67.9	-46.5	176.4	-68.2	-89.8	0	0	0	111.8	L6 F46 C47 T48 A52 V53 V54 L103	L6-Y50 HydrophobicContact CD2-CD1 4.13Å; L6-Y50 HydrophobicContact CD2-CE1 4.15Å; L6-Y50 HydrophobicContact CG-CD1 4.26Å; L6-Y50 HydrophobicContact CG-CE1 4.05Å; F46-Y50 HydrophobicContact CD1-CE2 4.4Å; F46-Y50 HydrophobicContact CD2-CE2 4.14Å; F46-Y50 AromaticContact CE1-CE2 3.93Å; F46-Y50 HydrophobicContact CE1-CE2 3.93Å; F46-Y50 AromaticContact CE2-CE2 3.64Å; F46-Y50 HydrophobicContact CE2-CE2 3.64Å; F46-Y50 AromaticContact CZ-CE2 3.53Å; F46-Y50 HydrophobicContact CZ-CE2 3.53Å; F46-Y50 WeakPolarHBondContact O-CD2 3.46Å; C47-Y50 PolarHBondContact O-N 3.39Å; C47-Y50 VanDerWaalsContact O-N 3.1Å; T48-Y50 PolarHBondContact O-N 3.29Å; Y50-A52 VanDerWaalsContact C-N 3.32Å; Y50-A52 PolarHBondContact O-N 3.46Å; Y50-V53 PolarHBondContact O-N 2.66Å; Y50-V54 PolarHBondContact O-N 3.44Å; Y50-V54 VanDerWaalsContact O-N 3.11Å; Y50-L103 HydrophobicContact CD1-CD1 3.99Å; Y50-L103 HydrophobicContact CD2-CD1 3.8Å; Y50-L103 HydrophobicContact CE1-CD1 4.38Å; Y50-L103 HydrophobicContact CE2-CD1 4.22Å; Y50-L103 HydrophobicContact CG-CD1 3.68Å
51	V	94.6	Very high	93	Very high	32 Å²	32	56.1 Å²	56.1	19%	0.194	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-40.9	179.1	175.6	0	0	0	0	111.2	C47 T48 V53 V54 I55 G96 A100	C47-V51 WeakPolarHBondContact O-CG2 3.48Å; C47-V51 PolarHBondContact O-N 2.96Å; T48-V51 PolarHBondContact O-N 3.2Å; V51-V53 VanDerWaalsContact C-N 3.3Å; V51-V53 PolarHBondContact O-N 2.68Å; V51-V54 PolarHBondContact O-N 3.25Å; V51-I55 HydrophobicContact CG1-CD1 3.54Å; V51-I55 HydrophobicContact CG1-CG1 4.14Å; V51-I55 WeakPolarHBondContact O-CG1 3.19Å; V51-I55 PolarHBondContact O-N 2.95Å; V51-G96 WeakPolarHBondContact CG2-O 3.35Å; V51-A100 HydrophobicContact CG2-CB 3.7Å
52	A	93.9	Very high	92.8	Very high	30 Å²	30	55.3 Å²	55.3	25%	0.248	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-38	177	0	0	0	0	0	111.9	I2 T48 Y50 S56	I2-A52 HydrophobicContact CG2-CB 3.75Å; T48-A52 WeakPolarHBondContact O-CB 3.49Å; T48-A52 PolarHBondContact O-N 3.39Å; Y50-A52 VanDerWaalsContact C-N 3.32Å; Y50-A52 PolarHBondContact O-N 3.46Å; A52-S56 WeakPolarHBondContact O-CB 3.23Å; A52-S56 PolarHBondContact O-N 2.95Å; A52-S56 PolarHBondContact O-OG 3.41Å
53	V	92.7	Very high	92.6	Very high	53 Å²	53	59.7 Å²	59.7	32%	0.321	31%	0.314	S	S	.	.	H	α-helix	trans	-63.4	-48.2	174.1	172.6	0	0	0	0	110.6	L6 A49 Y50 V51 I55 S56 S57	L6-V53 HydrophobicContact CD1-CG2 4.01Å; L6-V53 HydrophobicContact CD2-CG2 4.11Å; A49-V53 WeakPolarHBondContact O-CG2 3.23Å; A49-V53 PolarHBondContact O-N 3.05Å; Y50-V53 PolarHBondContact O-N 2.66Å; V51-V53 VanDerWaalsContact C-N 3.3Å; V51-V53 PolarHBondContact O-N 2.68Å; V53-I55 PolarHBondContact O-N 3.38Å; V53-S56 PolarHBondContact O-N 3.48Å; V53-S56 PolarHBondContact O-OG 3.47Å; V53-S57 PolarHBondContact O-N 2.77Å
54	V	93.1	Very high	92.3	Very high	42 Å²	42	62.4 Å²	62.4	26%	0.255	33%	0.334	S	S	.	.	H	α-helix	trans	-59.7	-48.8	178.8	175	0	0	0	0	111.7	Y50 V51 S57 R58 A92 L99	Y50-V54 PolarHBondContact O-N 3.44Å; Y50-V54 VanDerWaalsContact O-N 3.11Å; V51-V54 PolarHBondContact O-N 3.25Å; V54-S57 PolarHBondContact O-N 3.18Å; V54-R58 PolarHBondContact O-N 2.94Å; V54-A92 HydrophobicContact CG1-CB 4.45Å; V54-L99 HydrophobicContact CG2-CD2 3.9Å
55	I	94.5	Very high	92.2	Very high	39 Å²	39	62.2 Å²	62.2	20%	0.2	34%	0.335	C	S	.	.	H	α-helix	trans	-68.1	-42.4	-179	-65.4	175.4	0	0	0	111	V51 V53 S57 R58 L59 I89 I93	V51-I55 HydrophobicContact CG1-CD1 3.54Å; V51-I55 HydrophobicContact CG1-CG1 4.14Å; V51-I55 WeakPolarHBondContact O-CG1 3.19Å; V51-I55 PolarHBondContact O-N 2.95Å; V53-I55 PolarHBondContact O-N 3.38Å; I55-S57 VanDerWaalsContact C-N 3.31Å; I55-S57 PolarHBondContact O-N 3.12Å; I55-R58 PolarHBondContact O-N 3.05Å; I55-R58 VanDerWaalsContact O-N 3.07Å; I55-L59 HydrophobicContact CG2-CD1 3.91Å; I55-L59 HydrophobicContact CG2-CG 4.29Å; I55-L59 PolarHBondContact O-N 3.48Å; I55-I89 HydrophobicContact CG2-CD1 4.49Å; I55-I93 HydrophobicContact CD1-CG1 4.08Å; I55-I93 HydrophobicContact CG1-CG1 4.42Å
56	S	92.8	Very high	92.2	Very high	51 Å²	51	61.7 Å²	61.7	36%	0.357	33%	0.329	S	S	.	.	H	α-helix	trans	-64.5	-34.5	179.7	67.8	0	0	0	0	112.8	A52 V53 R58 R60	A52-S56 WeakPolarHBondContact O-CB 3.23Å; A52-S56 PolarHBondContact O-N 2.95Å; A52-S56 PolarHBondContact O-OG 3.41Å; V53-S56 PolarHBondContact O-N 3.48Å; V53-S56 PolarHBondContact O-OG 3.47Å; S56-R58 VanDerWaalsContact C-N 3.32Å; S56-R60 VanDerWaalsContact O-CG 3.32Å; S56-R60 WeakPolarHBondContact O-CG 3.43Å; S56-R60 PolarHBondContact O-N 2.86Å
57	S	91.8	Very high	92.2	Very high	61 Å²	61	63.9 Å²	63.9	43%	0.427	34%	0.339	S	S	.	.	H	α-helix	trans	-59.9	-45.3	170.9	-168.3	0	0	0	0	110.6	V53 V54 I55 R60	V53-S57 PolarHBondContact O-N 2.77Å; V54-S57 PolarHBondContact O-N 3.18Å; I55-S57 VanDerWaalsContact C-N 3.31Å; I55-S57 PolarHBondContact O-N 3.12Å; S57-R60 PolarHBondContact O-N 3.1Å
58	R	92.5	Very high	92.1	Very high	93 Å²	93	68.4 Å²	68.4	35%	0.351	36%	0.359	S	S	.	.	H	α-helix	trans	-70.8	-38.2	-177.7	-168.2	47.4	168.5	158.7	-16.3	113.2	V54 I55 S56 R60 E61 L62 A92	V54-R58 PolarHBondContact O-N 2.94Å; I55-R58 PolarHBondContact O-N 3.05Å; I55-R58 VanDerWaalsContact O-N 3.07Å; S56-R58 VanDerWaalsContact C-N 3.32Å; R58-R60 VanDerWaalsContact C-N 3.26Å; R58-R60 PolarHBondContact O-N 2.84Å; R58-E61 IonicContact CZ-OE2 3.89Å; R58-E61 IonicContact NE-OE2 3.49Å; R58-E61 VanDerWaalsContact NH1-CB 3.35Å; R58-E61 IonicContact NH1-OE2 2.68Å; R58-E61 PolarHBondContact NH1-OE2 2.94Å; R58-E61 PolarHBondContact O-N 3.27Å; R58-E61 VanDerWaalsContact O-N 3.15Å; R58-L62 WeakPolarHBondContact O-CG 3.21Å; R58-L62 PolarHBondContact O-N 2.9Å; R58-A92 HydrophobicContact CB-CB 3.46Å; R58-A92 VanDerWaalsContact CB-CB 3.46Å; R58-A92 HydrophobicContact CG-CB 3.69Å
59	L	91.5	Very high	92.1	Very high	79 Å²	79	67 Å²	67	41%	0.414	36%	0.355	S	S	.	.	H	α-helix	trans	-60.1	-36.7	175.1	-77.2	169.1	0	0	0	112.2	I55 E61 L62 T85 I89	I55-L59 HydrophobicContact CG2-CD1 3.91Å; I55-L59 HydrophobicContact CG2-CG 4.29Å; I55-L59 PolarHBondContact O-N 3.48Å; L59-E61 PolarHBondContact O-N 3.35Å; L59-L62 HydrophobicContact CD2-CD1 4.23Å; L59-L62 PolarHBondContact O-N 3.17Å; L59-T85 HydrophobicContact CD2-CG2 4.18Å; L59-I89 HydrophobicContact CD2-CG2 3.61Å; L59-I89 HydrophobicContact CG-CG2 4.08Å
60	R	91	Very high	92.2	Very high	220 Å²	220	67.2 Å²	67.2	83%	0.83	36%	0.357	S	S	*	.	H	α-helix	trans	-67.9	-22.2	177.3	-73.5	173.5	180	-148.9	-0.6	114.1	S56 S57 R58	S56-R60 VanDerWaalsContact O-CG 3.32Å; S56-R60 WeakPolarHBondContact O-CG 3.43Å; S56-R60 PolarHBondContact O-N 2.86Å; S57-R60 PolarHBondContact O-N 3.1Å; R58-R60 VanDerWaalsContact C-N 3.26Å; R58-R60 PolarHBondContact O-N 2.84Å
61	E	90.1	Very high	92.3	Very high	120 Å²	120	68.7 Å²	68.7	56%	0.561	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-9	178.1	-66.1	170.3	-163.5	0	0	112.7	R58 L59	R58-E61 IonicContact CZ-OE2 3.89Å; R58-E61 IonicContact NE-OE2 3.49Å; R58-E61 VanDerWaalsContact NH1-CB 3.35Å; R58-E61 IonicContact NH1-OE2 2.68Å; R58-E61 PolarHBondContact NH1-OE2 2.94Å; R58-E61 PolarHBondContact O-N 3.27Å; R58-E61 VanDerWaalsContact O-N 3.15Å; L59-E61 PolarHBondContact O-N 3.35Å
62	L	89.5	Confident	92.3	Very high	28 Å²	28	74 Å²	74	15%	0.147	39%	0.394	C	S	.	.	S	Bend	trans	-76	138.9	176.9	-61.4	-167.4	0	0	0	110.4	R58 L59 S64 M88 I89	R58-L62 WeakPolarHBondContact O-CG 3.21Å; R58-L62 PolarHBondContact O-N 2.9Å; L59-L62 HydrophobicContact CD2-CD1 4.23Å; L59-L62 PolarHBondContact O-N 3.17Å; L62-S64 PolarHBondContact O-N 3.13Å; L62-M88 HydrophobicContact CD1-CB 3.97Å; L62-M88 HydrophobicContact CD2-CB 4.02Å; L62-M88 HydrophobicContact CD2-CE 3.79Å; L62-I89 HydrophobicContact CD1-CG2 3.65Å; L62-I89 HydrophobicContact CG-CG2 4.5Å
63	D	90.6	Very high	92.3	Very high	93 Å²	93	80.2 Å²	80.2	50%	0.497	42%	0.423	S	S	.	.			trans	-77.9	111.2	172.8	-172	-15.1	0	0	0	109.6	S65 I66	D63-S65 PolarHBondContact O-N 2.9Å; D63-S65 WeakPolarHBondContact OD1-CB 3.47Å; D63-S65 PolarHBondContact OD1-N 3.31Å; D63-S65 PolarHBondContact OD1-OG 2.86Å; D63-S65 PolarHBondContact OD2-OG 2.89Å; D63-S65 VanDerWaalsContact OD2-OG 3.1Å; D63-I66 HydrophobicContact CB-CD1 4.38Å; D63-I66 HydrophobicContact CB-CG1 4.41Å; D63-I66 PolarHBondContact O-N 2.97Å
64	S	89.8	Confident	92.4	Very high	70 Å²	70	80.8 Å²	80.8	49%	0.49	44%	0.439	S	S	.	.	H	α-helix	trans	-63.3	-20.2	-180	61.4	0	0	0	0	112.9	L62 I66 E67 E68	L62-S64 PolarHBondContact O-N 3.13Å; S64-I66 PolarHBondContact O-N 2.62Å; S64-E67 PolarHBondContact O-N 3.05Å; S64-E67 VanDerWaalsContact O-N 3.12Å; S64-E68 WeakPolarHBondContact O-CG 3.24Å; S64-E68 PolarHBondContact O-N 3.42Å
65	S	92.8	Very high	92.5	Very high	53 Å²	53	80 Å²	80	37%	0.371	44%	0.437	S	S	.	.	H	α-helix	trans	-62.6	-26.4	178.7	70.1	0	0	0	0	113	D63 A69	D63-S65 PolarHBondContact O-N 2.9Å; D63-S65 WeakPolarHBondContact OD1-CB 3.47Å; D63-S65 PolarHBondContact OD1-N 3.31Å; D63-S65 PolarHBondContact OD1-OG 2.86Å; D63-S65 PolarHBondContact OD2-OG 2.89Å; D63-S65 VanDerWaalsContact OD2-OG 3.1Å; S65-A69 VanDerWaalsContact O-CB 3.23Å; S65-A69 WeakPolarHBondContact O-CB 3.46Å; S65-A69 PolarHBondContact O-N 2.81Å
66	I	91.3	Very high	92.5	Very high	73 Å²	73	82.2 Å²	82.2	37%	0.374	45%	0.452	S	S	.	.	H	α-helix	trans	-69.2	-40.2	177	-56.8	177.4	0	0	0	110.4	D63 S64 A70 I84 M88	D63-I66 HydrophobicContact CB-CD1 4.38Å; D63-I66 HydrophobicContact CB-CG1 4.41Å; D63-I66 PolarHBondContact O-N 2.97Å; S64-I66 PolarHBondContact O-N 2.62Å; I66-A70 WeakPolarHBondContact O-CB 3.38Å; I66-A70 PolarHBondContact O-N 2.73Å; I66-I84 HydrophobicContact CG2-CG2 3.74Å; I66-M88 HydrophobicContact CD1-CE 3.8Å; I66-M88 HydrophobicContact CD1-SD 4.49Å
67	E	92.4	Very high	92.5	Very high	56 Å²	56	84.2 Å²	84.2	26%	0.262	46%	0.464	S	S	.	.	H	α-helix	trans	-71.1	-42.6	177.6	-63.5	-174	-179.1	0	0	111.1	S64 A70 M71 V80 T85	S64-E67 PolarHBondContact O-N 3.05Å; S64-E67 VanDerWaalsContact O-N 3.12Å; E67-A70 PolarHBondContact O-N 3Å; E67-M71 WeakPolarHBondContact O-CG 3.43Å; E67-M71 PolarHBondContact O-N 3.05Å; E67-V80 HydrophobicContact CB-CG1 3.85Å; E67-V80 HydrophobicContact CG-CG1 3.93Å; E67-T85 VanDerWaalsContact CD-OG1 3.23Å; E67-T85 WeakPolarHBondContact OE1-CB 3.41Å; E67-T85 VanDerWaalsContact OE1-CG2 3.25Å; E67-T85 WeakPolarHBondContact OE1-CG2 3.41Å; E67-T85 PolarHBondContact OE1-OG1 3.34Å
68	E	92.3	Very high	92.7	Very high	104 Å²	104	87 Å²	87	49%	0.486	47%	0.474	S	S	.	.	H	α-helix	trans	-59.5	-49.1	175.1	-70.3	169.9	-165.1	0	0	111.4	S64 A70 M71 D72	S64-E68 WeakPolarHBondContact O-CG 3.24Å; S64-E68 PolarHBondContact O-N 3.42Å; E68-A70 VanDerWaalsContact C-N 3.28Å; E68-A70 PolarHBondContact O-N 3.41Å; E68-M71 PolarHBondContact O-N 2.92Å; E68-M71 VanDerWaalsContact O-N 3.1Å; E68-D72 PolarHBondContact O-N 3.49Å
69	A	93.6	Very high	92.9	Very high	48 Å²	48	88.6 Å²	88.6	40%	0.397	48%	0.483	S	S	.	.	H	α-helix	trans	-61.4	-35.5	178	0	0	0	0	0	112.8	S65 D72 L73	S65-A69 VanDerWaalsContact O-CB 3.23Å; S65-A69 WeakPolarHBondContact O-CB 3.46Å; S65-A69 PolarHBondContact O-N 2.81Å; A69-D72 PolarHBondContact O-N 2.86Å; A69-L73 WeakPolarHBondContact O-CG 3.13Å; A69-L73 PolarHBondContact O-N 2.79Å; A69-L73 VanDerWaalsContact O-N 3.13Å
70	A	93.1	Very high	93	Very high	14 Å²	14	85 Å²	85	12%	0.116	47%	0.465	C	S	.	.	H	α-helix	trans	-68.7	-38.4	175.9	0	0	0	0	0	112.2	I66 E67 E68 L73 A75 V80 I84	I66-A70 WeakPolarHBondContact O-CB 3.38Å; I66-A70 PolarHBondContact O-N 2.73Å; E67-A70 PolarHBondContact O-N 3Å; E68-A70 VanDerWaalsContact C-N 3.28Å; E68-A70 PolarHBondContact O-N 3.41Å; A70-L73 PolarHBondContact O-N 3.37Å; A70-A75 HydrophobicContact CB-CB 4.48Å; A70-A75 WeakPolarHBondContact O-CB 3.22Å; A70-A75 PolarHBondContact O-N 3.35Å; A70-V80 HydrophobicContact CB-CG1 4.47Å; A70-V80 HydrophobicContact CB-CG2 3.81Å; A70-I84 HydrophobicContact CB-CD1 3.27Å
71	M	94.3	Very high	93.2	Very high	83 Å²	83	78.7 Å²	78.7	41%	0.409	44%	0.443	S	S	.	.	H	α-helix	trans	-66.6	-38.7	173.6	-70	-172.8	-72.1	0	0	111.7	E67 E68 L73 G74 P77 V80	E67-M71 WeakPolarHBondContact O-CG 3.43Å; E67-M71 PolarHBondContact O-N 3.05Å; E68-M71 PolarHBondContact O-N 2.92Å; E68-M71 VanDerWaalsContact O-N 3.1Å; M71-L73 VanDerWaalsContact C-N 3.28Å; M71-L73 PolarHBondContact O-N 3.29Å; M71-G74 WeakPolarHBondContact O-CA 3.44Å; M71-G74 PolarHBondContact O-N 3.15Å; M71-P77 HydrophobicContact SD-CG 4.34Å; M71-V80 HydrophobicContact CG-CG2 3.88Å
72	D	95.3	Very high	93.5	Very high	144 Å²	144	78.6 Å²	78.6	77%	0.77	44%	0.441	S	S	*	.	H	α-helix	trans	-63	-33	175.6	-73.5	-16.7	0	0	0	112.7	E68 A69 G74	E68-D72 PolarHBondContact O-N 3.49Å; A69-D72 PolarHBondContact O-N 2.86Å; D72-G74 PolarHBondContact O-N 3.38Å
73	L	94.3	Very high	93.8	Very high	161 Å²	161	81.7 Å²	81.7	84%	0.843	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	4.6	172.1	-69.3	172	0	0	0	113.7	A69 A70 M71	A69-L73 WeakPolarHBondContact O-CG 3.13Å; A69-L73 PolarHBondContact O-N 2.79Å; A69-L73 VanDerWaalsContact O-N 3.13Å; A70-L73 PolarHBondContact O-N 3.37Å; M71-L73 VanDerWaalsContact C-N 3.28Å; M71-L73 PolarHBondContact O-N 3.29Å
74	G	94.4	Very high	93.9	Very high	65 Å²	65	79 Å²	79	67%	0.67	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	14.6	175.7	0	0	0	0	0	115	M71 D72	M71-G74 WeakPolarHBondContact O-CA 3.44Å; M71-G74 PolarHBondContact O-N 3.15Å; D72-G74 PolarHBondContact O-N 3.38Å
75	A	94.2	Very high	94.1	Very high	26 Å²	26	76.1 Å²	76.1	22%	0.215	43%	0.426	C	S	.	.			trans	-72.9	134.3	171.5	0	0	0	0	0	110.7	A70 K79 V80	A70-A75 HydrophobicContact CB-CB 4.48Å; A70-A75 WeakPolarHBondContact O-CB 3.22Å; A70-A75 PolarHBondContact O-N 3.35Å; A75-K79 HydrophobicContact CB-CD 4.49Å; A75-V80 HydrophobicContact CB-CG2 3.63Å
76	T	95.2	Very high	94.1	Very high	84 Å²	84	75.8 Å²	75.8	52%	0.515	42%	0.42	S	S	.	.			trans	-69.3	150.1	173.5	58.3	0	0	0	0	110.5	L78 K79 V80	T76-L78 PolarHBondContact O-N 3.35Å; T76-L78 VanDerWaalsContact O-N 3.12Å; T76-K79 WeakPolarHBondContact O-CA 3.38Å; T76-K79 WeakPolarHBondContact O-CB 3.32Å; T76-K79 PolarHBondContact O-N 3.49Å; T76-K79 WeakPolarHBondContact OG1-CB 3.16Å; T76-V80 PolarHBondContact O-N 3.28Å
77	P	93.5	Very high	94.3	Very high	94 Å²	94	75.5 Å²	75.5	61%	0.61	42%	0.423	S	S	*	.	H	α-helix	trans	-54.1	-36.8	-179	-28.5	34.8	0	0	0	113.7	M71 V80 F81	M71-P77 HydrophobicContact SD-CG 4.34Å; P77-V80 PolarHBondContact O-N 2.9Å; P77-F81 PolarHBondContact O-N 3.41Å
78	L	96	Very high	94.3	Very high	119 Å²	119	75.7 Å²	75.7	62%	0.623	42%	0.424	S	S	*	.	H	α-helix	trans	-65.3	-39.1	176.2	-167.7	66.1	0	0	0	112.1	T76 F81 F82	T76-L78 PolarHBondContact O-N 3.35Å; T76-L78 VanDerWaalsContact O-N 3.12Å; L78-F81 PolarHBondContact O-N 3.19Å; L78-F82 HydrophobicContact CD1-CD2 4.15Å; L78-F82 HydrophobicContact CD1-CE2 3.67Å; L78-F82 HydrophobicContact CG-CD2 4.13Å; L78-F82 HydrophobicContact CG-CE2 4.02Å; L78-F82 VanDerWaalsContact O-CD2 3.28Å; L78-F82 WeakPolarHBondContact O-CD2 3.46Å; L78-F82 PolarHBondContact O-N 3.2Å
79	K	95	Very high	94.5	Very high	127 Å²	127	71.3 Å²	71.3	55%	0.552	40%	0.404	S	S	*	.	H	α-helix	trans	-68.1	-42.8	175.8	-173.7	175.9	-179.2	-178.9	0	110.9	A75 T76 F81 F82 V83	A75-K79 HydrophobicContact CB-CD 4.49Å; T76-K79 WeakPolarHBondContact O-CA 3.38Å; T76-K79 WeakPolarHBondContact O-CB 3.32Å; T76-K79 PolarHBondContact O-N 3.49Å; T76-K79 WeakPolarHBondContact OG1-CB 3.16Å; K79-F81 VanDerWaalsContact C-N 3.32Å; K79-F81 PolarHBondContact O-N 2.88Å; K79-F82 PolarHBondContact O-N 2.92Å; K79-V83 HydrophobicContact CG-CG2 4Å; K79-V83 WeakPolarHBondContact O-CB 3.4Å; K79-V83 VanDerWaalsContact O-CG2 3.24Å; K79-V83 WeakPolarHBondContact O-CG2 3.27Å; K79-V83 PolarHBondContact O-N 3.37Å
80	V	95.3	Very high	94.5	Very high	4 Å²	4	72.5 Å²	72.5	2%	0.024	40%	0.402	C	S	.	.	H	α-helix	trans	-57.9	-46.1	174.9	175	0	0	0	0	110.5	E67 A70 M71 A75 T76 P77 F82 V83 I84 T85	E67-V80 HydrophobicContact CB-CG1 3.85Å; E67-V80 HydrophobicContact CG-CG1 3.93Å; A70-V80 HydrophobicContact CB-CG1 4.47Å; A70-V80 HydrophobicContact CB-CG2 3.81Å; M71-V80 HydrophobicContact CG-CG2 3.88Å; A75-V80 HydrophobicContact CB-CG2 3.63Å; T76-V80 PolarHBondContact O-N 3.28Å; P77-V80 PolarHBondContact O-N 2.9Å; V80-F82 PolarHBondContact O-N 2.85Å; V80-V83 PolarHBondContact O-N 3.35Å; V80-I84 HydrophobicContact CG1-CB 4.41Å; V80-I84 HydrophobicContact CG1-CD1 4.35Å; V80-I84 WeakPolarHBondContact O-CA 3.43Å; V80-I84 VanDerWaalsContact O-CB 3.3Å; V80-I84 WeakPolarHBondContact O-CB 3.35Å; V80-I84 PolarHBondContact O-N 3.44Å; V80-T85 PolarHBondContact O-N 2.91Å
81	F	94.8	Very high	94.6	Very high	87 Å²	87	75.6 Å²	75.6	38%	0.382	42%	0.421	S	S	.	.	I	π-helix	trans	-57.5	-52.3	177.5	175.9	-101	0	0	0	113	P77 L78 K79 T85 L86	P77-F81 PolarHBondContact O-N 3.41Å; L78-F81 PolarHBondContact O-N 3.19Å; K79-F81 VanDerWaalsContact C-N 3.32Å; K79-F81 PolarHBondContact O-N 2.88Å; F81-T85 HydrophobicContact CD2-CG2 4.25Å; F81-T85 PolarHBondContact O-N 3.43Å; F81-L86 WeakPolarHBondContact O-CB 3.3Å; F81-L86 PolarHBondContact O-N 3.28Å
82	F	96.3	Very high	94.7	Very high	117 Å²	117	72.1 Å²	72.1	51%	0.513	41%	0.406	S	S	.	.	I	π-helix	trans	-75.2	-28.2	-176.3	-76.5	-70.4	0	0	0	114.2	L78 K79 V80 L86 P87	L78-F82 HydrophobicContact CD1-CD2 4.15Å; L78-F82 HydrophobicContact CD1-CE2 3.67Å; L78-F82 HydrophobicContact CG-CD2 4.13Å; L78-F82 HydrophobicContact CG-CE2 4.02Å; L78-F82 VanDerWaalsContact O-CD2 3.28Å; L78-F82 WeakPolarHBondContact O-CD2 3.46Å; L78-F82 PolarHBondContact O-N 3.2Å; K79-F82 PolarHBondContact O-N 2.92Å; V80-F82 PolarHBondContact O-N 2.85Å; F82-L86 HydrophobicContact CD1-CD2 3.78Å; F82-L86 HydrophobicContact CE1-CD2 4.29Å; F82-P87 WeakPolarHBondContact O-CD 3.37Å
83	V	95	Very high	94.7	Very high	93 Å²	93	67.7 Å²	67.7	56%	0.564	38%	0.381	S	S	*	.	I	π-helix	trans	-95.8	-28.3	-174.1	178.9	0	0	0	0	112.5	K79 V80 P87	K79-V83 HydrophobicContact CG-CG2 4Å; K79-V83 WeakPolarHBondContact O-CB 3.4Å; K79-V83 VanDerWaalsContact O-CG2 3.24Å; K79-V83 WeakPolarHBondContact O-CG2 3.27Å; K79-V83 PolarHBondContact O-N 3.37Å; V80-V83 PolarHBondContact O-N 3.35Å; V83-P87 WeakPolarHBondContact O-CG 3.25Å
84	I	93.2	Very high	94.8	Very high	37 Å²	37	64.2 Å²	64.2	19%	0.19	36%	0.363	C	S	.	.	I	π-helix	trans	-118.1	-68.6	-174.1	-58	-179.2	0	0	0	109.8	I66 A70 V80 L86 P87 M88	I66-I84 HydrophobicContact CG2-CG2 3.74Å; A70-I84 HydrophobicContact CB-CD1 3.27Å; V80-I84 HydrophobicContact CG1-CB 4.41Å; V80-I84 HydrophobicContact CG1-CD1 4.35Å; V80-I84 WeakPolarHBondContact O-CA 3.43Å; V80-I84 VanDerWaalsContact O-CB 3.3Å; V80-I84 WeakPolarHBondContact O-CB 3.35Å; V80-I84 PolarHBondContact O-N 3.44Å; I84-L86 PolarHBondContact O-N 2.81Å; I84-P87 WeakPolarHBondContact O-CD 3.32Å; I84-M88 HydrophobicContact CG2-SD 3.66Å; I84-M88 WeakPolarHBondContact O-CB 3.29Å; I84-M88 VanDerWaalsContact O-CG 3.23Å; I84-M88 WeakPolarHBondContact O-CG 3.42Å; I84-M88 PolarHBondContact O-N 2.75Å; I84-M88 VanDerWaalsContact O-N 3.09Å
85	T	93	Very high	94.9	Very high	10 Å²	10	64.2 Å²	64.2	6%	0.061	35%	0.353	C	S	.	.	I	π-helix	trans	-58	-50.1	-171.9	-45.1	0	0	0	0	111.7	L59 E67 V80 F81 M88 I89	L59-T85 HydrophobicContact CD2-CG2 4.18Å; E67-T85 VanDerWaalsContact CD-OG1 3.23Å; E67-T85 WeakPolarHBondContact OE1-CB 3.41Å; E67-T85 VanDerWaalsContact OE1-CG2 3.25Å; E67-T85 WeakPolarHBondContact OE1-CG2 3.41Å; E67-T85 PolarHBondContact OE1-OG1 3.34Å; V80-T85 PolarHBondContact O-N 2.91Å; F81-T85 HydrophobicContact CD2-CG2 4.25Å; F81-T85 PolarHBondContact O-N 3.43Å; T85-M88 PolarHBondContact O-N 2.94Å; T85-I89 WeakPolarHBondContact O-CG1 3.49Å; T85-I89 PolarHBondContact O-N 2.85Å
86	L	94.6	Very high	94.9	Very high	45 Å²	45	63 Å²	63	24%	0.236	34%	0.343	C	S	.	.	H	α-helix	trans	-61.3	-55.2	-176.2	179.9	69.7	0	0	0	111.2	F81 F82 I84 M88 I89 M90 I93	F81-L86 WeakPolarHBondContact O-CB 3.3Å; F81-L86 PolarHBondContact O-N 3.28Å; F82-L86 HydrophobicContact CD1-CD2 3.78Å; F82-L86 HydrophobicContact CE1-CD2 4.29Å; I84-L86 PolarHBondContact O-N 2.81Å; L86-M88 VanDerWaalsContact C-N 3.26Å; L86-M88 PolarHBondContact O-N 2.96Å; L86-I89 HydrophobicContact CD1-CD1 4.49Å; L86-I89 HydrophobicContact CD1-CG1 4.46Å; L86-I89 CarbonylContact O-C 2.94Å; L86-I89 VanDerWaalsContact O-CG1 3.3Å; L86-I89 WeakPolarHBondContact O-CG1 3.28Å; L86-I89 PolarHBondContact O-N 2.79Å; L86-I89 VanDerWaalsContact O-N 3.13Å; L86-M90 HydrophobicContact CD1-SD 3.95Å; L86-M90 HydrophobicContact CG-SD 4.03Å; L86-M90 VanDerWaalsContact O-CG 3.22Å; L86-M90 WeakPolarHBondContact O-CG 3.4Å; L86-M90 PolarHBondContact O-N 3.01Å; L86-I93 HydrophobicContact CD1-CD1 3.58Å
87	P	94.4	Very high	95	Very high	68 Å²	68	66.4 Å²	66.4	44%	0.442	35%	0.346	S	S	.	.	H	α-helix	trans	-51.7	-39.2	172.1	-31.7	38.3	0	0	0	114.6	F82 V83 I84 M90	F82-P87 WeakPolarHBondContact O-CD 3.37Å; V83-P87 WeakPolarHBondContact O-CG 3.25Å; I84-P87 WeakPolarHBondContact O-CD 3.32Å; P87-M90 WeakPolarHBondContact O-CB 3.39Å; P87-M90 PolarHBondContact O-N 3.48Å
88	M	93.2	Very high	95.1	Very high	60 Å²	60	66 Å²	66	30%	0.296	34%	0.338	S	S	.	.	H	α-helix	trans	-68.9	-35.9	179.2	-70.2	176.6	78.6	0	0	112.8	L62 I66 I84 T85 L86	L62-M88 HydrophobicContact CD1-CB 3.97Å; L62-M88 HydrophobicContact CD2-CB 4.02Å; L62-M88 HydrophobicContact CD2-CE 3.79Å; I66-M88 HydrophobicContact CD1-CE 3.8Å; I66-M88 HydrophobicContact CD1-SD 4.49Å; I84-M88 HydrophobicContact CG2-SD 3.66Å; I84-M88 WeakPolarHBondContact O-CB 3.29Å; I84-M88 VanDerWaalsContact O-CG 3.23Å; I84-M88 WeakPolarHBondContact O-CG 3.42Å; I84-M88 PolarHBondContact O-N 2.75Å; I84-M88 VanDerWaalsContact O-N 3.09Å; T85-M88 PolarHBondContact O-N 2.94Å; L86-M88 VanDerWaalsContact C-N 3.26Å; L86-M88 PolarHBondContact O-N 2.96Å
89	I	94.9	Very high	95.1	Very high	11 Å²	11	63.5 Å²	63.5	6%	0.056	33%	0.325	C	S	.	.	H	α-helix	trans	-88.2	-9.2	175.2	67.5	176.3	0	0	0	113.8	I55 L59 L62 T85 L86 P91 A92 I93	I55-I89 HydrophobicContact CG2-CD1 4.49Å; L59-I89 HydrophobicContact CD2-CG2 3.61Å; L59-I89 HydrophobicContact CG-CG2 4.08Å; L62-I89 HydrophobicContact CD1-CG2 3.65Å; L62-I89 HydrophobicContact CG-CG2 4.5Å; T85-I89 WeakPolarHBondContact O-CG1 3.49Å; T85-I89 PolarHBondContact O-N 2.85Å; L86-I89 HydrophobicContact CD1-CD1 4.49Å; L86-I89 HydrophobicContact CD1-CG1 4.46Å; L86-I89 CarbonylContact O-C 2.94Å; L86-I89 VanDerWaalsContact O-CG1 3.3Å; L86-I89 WeakPolarHBondContact O-CG1 3.28Å; L86-I89 PolarHBondContact O-N 2.79Å; L86-I89 VanDerWaalsContact O-N 3.13Å; I89-P91 VanDerWaalsContact C-CD 3.44Å; I89-P91 VanDerWaalsContact C-N 3.33Å; I89-A92 CarbonylContact O-C 3.58Å; I89-A92 WeakPolarHBondContact O-CA 3.48Å; I89-A92 WeakPolarHBondContact O-CB 3.39Å; I89-A92 PolarHBondContact O-N 3.19Å; I89-I93 HydrophobicContact CD1-CD1 3.85Å; I89-I93 HydrophobicContact CD1-CG1 4.36Å; I89-I93 HydrophobicContact CG1-CD1 3.72Å; I89-I93 HydrophobicContact CG1-CG1 4.18Å; I89-I93 PolarHBondContact O-N 2.87Å
90	M	95.6	Very high	95.1	Very high	73 Å²	73	58.2 Å²	58.2	36%	0.36	31%	0.305	S	S	.	.	H	α-helix	trans	-50.2	-43.2	-179.2	-79	-50.3	-66.4	0	0	113.7	L86 P87 A92 I93 I94	L86-M90 HydrophobicContact CD1-SD 3.95Å; L86-M90 HydrophobicContact CG-SD 4.03Å; L86-M90 VanDerWaalsContact O-CG 3.22Å; L86-M90 WeakPolarHBondContact O-CG 3.4Å; L86-M90 PolarHBondContact O-N 3.01Å; P87-M90 WeakPolarHBondContact O-CB 3.39Å; P87-M90 PolarHBondContact O-N 3.48Å; M90-A92 VanDerWaalsContact C-N 3.26Å; M90-A92 PolarHBondContact O-N 3.4Å; M90-I93 PolarHBondContact O-N 2.95Å; M90-I93 VanDerWaalsContact O-N 3.17Å; M90-I93 HydrophobicContact SD-CD1 3.99Å; M90-I94 WeakPolarHBondContact O-CG1 3.29Å; M90-I94 PolarHBondContact O-N 3.4Å
91	P	94.5	Very high	95.1	Very high	79 Å²	79	63 Å²	63	51%	0.513	33%	0.326	S	S	.	.	H	α-helix	trans	-59.2	-37	175.9	-24.7	35.3	0	0	0	113	I89 S95	I89-P91 VanDerWaalsContact C-CD 3.44Å; I89-P91 VanDerWaalsContact C-N 3.33Å; P91-S95 WeakPolarHBondContact O-CB 3.28Å; P91-S95 PolarHBondContact O-N 3.07Å; P91-S95 PolarHBondContact O-OG 3.42Å
92	A	95.2	Very high	95.1	Very high	10 Å²	10	62.6 Å²	62.6	8%	0.083	33%	0.331	C	S	.	.	H	α-helix	trans	-74.7	-35.5	175.8	0	0	0	0	0	112.3	V54 R58 I89 M90 S95 G96	V54-A92 HydrophobicContact CG1-CB 4.45Å; R58-A92 HydrophobicContact CB-CB 3.46Å; R58-A92 VanDerWaalsContact CB-CB 3.46Å; R58-A92 HydrophobicContact CG-CB 3.69Å; I89-A92 CarbonylContact O-C 3.58Å; I89-A92 WeakPolarHBondContact O-CA 3.48Å; I89-A92 WeakPolarHBondContact O-CB 3.39Å; I89-A92 PolarHBondContact O-N 3.19Å; M90-A92 VanDerWaalsContact C-N 3.26Å; M90-A92 PolarHBondContact O-N 3.4Å; A92-S95 PolarHBondContact O-N 3.11Å; A92-G96 PolarHBondContact O-N 2.89Å
93	I	96.6	Very high	95	Very high	51 Å²	51	58.7 Å²	58.7	26%	0.262	32%	0.315	S	S	.	.	H	α-helix	trans	-61	-47.3	172.9	-67.4	175.1	0	0	0	110.4	I55 L86 I89 M90 S95 G96 W97	I55-I93 HydrophobicContact CD1-CG1 4.08Å; I55-I93 HydrophobicContact CG1-CG1 4.42Å; L86-I93 HydrophobicContact CD1-CD1 3.58Å; I89-I93 HydrophobicContact CD1-CD1 3.85Å; I89-I93 HydrophobicContact CD1-CG1 4.36Å; I89-I93 HydrophobicContact CG1-CD1 3.72Å; I89-I93 HydrophobicContact CG1-CG1 4.18Å; I89-I93 PolarHBondContact O-N 2.87Å; M90-I93 PolarHBondContact O-N 2.95Å; M90-I93 VanDerWaalsContact O-N 3.17Å; M90-I93 HydrophobicContact SD-CD1 3.99Å; I93-S95 VanDerWaalsContact C-N 3.34Å; I93-S95 PolarHBondContact O-N 3.33Å; I93-G96 PolarHBondContact O-N 2.88Å; I93-W97 WeakPolarHBondContact O-CB 3.32Å; I93-W97 PolarHBondContact O-N 3.48Å
94	I	96.8	Very high	94.9	Very high	88 Å²	88	56.4 Å²	56.4	45%	0.451	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-43	178.1	-65.7	166.9	0	0	0	110.5	M90 W97 L98	M90-I94 WeakPolarHBondContact O-CG1 3.29Å; M90-I94 PolarHBondContact O-N 3.4Å; I94-W97 PolarHBondContact O-N 3.22Å; I94-L98 HydrophobicContact CG2-CD1 4.34Å; I94-L98 WeakPolarHBondContact O-CG 3.47Å; I94-L98 PolarHBondContact O-N 3.4Å
95	S	95	Very high	94.9	Very high	66 Å²	66	59.1 Å²	59.1	46%	0.462	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-44.1	176.9	-58	0	0	0	0	111.9	P91 A92 I93 L98 L99	P91-S95 WeakPolarHBondContact O-CB 3.28Å; P91-S95 PolarHBondContact O-N 3.07Å; P91-S95 PolarHBondContact O-OG 3.42Å; A92-S95 PolarHBondContact O-N 3.11Å; I93-S95 VanDerWaalsContact C-N 3.34Å; I93-S95 PolarHBondContact O-N 3.33Å; S95-L98 PolarHBondContact O-N 3.02Å; S95-L99 WeakPolarHBondContact O-CB 3.33Å; S95-L99 PolarHBondContact O-N 2.98Å
96	G	95.9	Very high	94.8	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-64.1	-41	175.5	0	0	0	0	0	112.1	V51 A92 I93 L99 A100	V51-G96 WeakPolarHBondContact CG2-O 3.35Å; A92-G96 PolarHBondContact O-N 2.89Å; I93-G96 PolarHBondContact O-N 2.88Å; G96-L99 PolarHBondContact O-N 3.43Å; G96-A100 WeakPolarHBondContact O-CB 3.29Å; G96-A100 PolarHBondContact O-N 3.44Å
97	W	96.5	Very high	94.7	Very high	156 Å²	156	62.2 Å²	62.2	59%	0.591	33%	0.334	S	S	*	.	H	α-helix	trans	-61.6	-46.1	174.8	172.6	79.4	0	0	0	112	I93 I94 L99 A100 F101	I93-W97 WeakPolarHBondContact O-CB 3.32Å; I93-W97 PolarHBondContact O-N 3.48Å; I94-W97 PolarHBondContact O-N 3.22Å; W97-L99 VanDerWaalsContact C-N 3.32Å; W97-L99 PolarHBondContact O-N 2.85Å; W97-A100 PolarHBondContact O-N 3.18Å; W97-F101 VanDerWaalsContact O-CB 3.28Å; W97-F101 WeakPolarHBondContact O-CB 3.39Å; W97-F101 PolarHBondContact O-N 3Å
98	L	96.1	Very high	94.6	Very high	85 Å²	85	61.1 Å²	61.1	45%	0.445	32%	0.324	S	S	.	.	H	α-helix	trans	-60.6	-41.7	175.8	-76.3	171.9	0	0	0	112.1	I94 S95 T102	I94-L98 HydrophobicContact CG2-CD1 4.34Å; I94-L98 WeakPolarHBondContact O-CG 3.47Å; I94-L98 PolarHBondContact O-N 3.4Å; S95-L98 PolarHBondContact O-N 3.02Å; L98-T102 WeakPolarHBondContact O-CB 3.36Å; L98-T102 PolarHBondContact O-N 3.44Å; L98-T102 PolarHBondContact O-OG1 3.48Å
99	L	95.2	Very high	94.7	Very high	67 Å²	67	60.6 Å²	60.6	35%	0.351	32%	0.324	S	S	.	.	H	α-helix	trans	-62.1	-51.8	175.7	177.1	63.1	0	0	0	111.1	V54 S95 G96 W97 F101 T102 L103	V54-L99 HydrophobicContact CG2-CD2 3.9Å; S95-L99 WeakPolarHBondContact O-CB 3.33Å; S95-L99 PolarHBondContact O-N 2.98Å; G96-L99 PolarHBondContact O-N 3.43Å; W97-L99 VanDerWaalsContact C-N 3.32Å; W97-L99 PolarHBondContact O-N 2.85Å; L99-F101 VanDerWaalsContact C-N 3.31Å; L99-F101 PolarHBondContact O-N 3.45Å; L99-T102 PolarHBondContact O-N 3.13Å; L99-L103 HydrophobicContact CD1-CD1 4.09Å; L99-L103 HydrophobicContact CD1-CG 4.23Å; L99-L103 HydrophobicContact CG-CD1 3.99Å; L99-L103 WeakPolarHBondContact O-CG 3.35Å; L99-L103 PolarHBondContact O-N 2.88Å
100	A	95.8	Very high	94.6	Very high	16 Å²	16	60.1 Å²	60.1	13%	0.132	32%	0.322	C	S	.	.	H	α-helix	trans	-58.9	-42.1	178.2	0	0	0	0	0	112.3	C47 V51 G96 W97 S104	C47-A100 HydrophobicContact CB-CB 3.7Å; C47-A100 PolarHBondContact SG-O 2.85Å; V51-A100 HydrophobicContact CG2-CB 3.7Å; G96-A100 WeakPolarHBondContact O-CB 3.29Å; G96-A100 PolarHBondContact O-N 3.44Å; W97-A100 PolarHBondContact O-N 3.18Å; A100-S104 WeakPolarHBondContact O-CB 3.11Å; A100-S104 PolarHBondContact O-N 2.95Å
101	F	95.2	Very high	94.5	Very high	104 Å²	104	56.7 Å²	56.7	46%	0.456	31%	0.305	S	S	.	.	H	α-helix	trans	-61.1	-45.3	176.5	177.3	-104	0	0	0	111.6	W97 L99 S104 L105	W97-F101 VanDerWaalsContact O-CB 3.28Å; W97-F101 WeakPolarHBondContact O-CB 3.39Å; W97-F101 PolarHBondContact O-N 3Å; L99-F101 VanDerWaalsContact C-N 3.31Å; L99-F101 PolarHBondContact O-N 3.45Å; F101-S104 PolarHBondContact O-N 3.39Å; F101-L105 HydrophobicContact CD1-CD1 3.89Å; F101-L105 HydrophobicContact CD1-CG 4.48Å; F101-L105 HydrophobicContact CD2-CG 4.46Å; F101-L105 HydrophobicContact CE1-CD1 3.26Å; F101-L105 HydrophobicContact CE1-CG 4.17Å; F101-L105 HydrophobicContact CE2-CD1 3.97Å; F101-L105 HydrophobicContact CE2-CD2 4.48Å; F101-L105 HydrophobicContact CE2-CG 4.12Å; F101-L105 HydrophobicContact CG-CD1 4.49Å; F101-L105 HydrophobicContact CZ-CD1 3.32Å; F101-L105 HydrophobicContact CZ-CD2 4.46Å; F101-L105 HydrophobicContact CZ-CG 3.99Å; F101-L105 WeakPolarHBondContact O-CB 3.32Å; F101-L105 WeakPolarHBondContact O-CG 3.37Å; F101-L105 PolarHBondContact O-N 3.15Å
102	T	94	Very high	94.4	Very high	79 Å²	79	55.6 Å²	55.6	49%	0.485	30%	0.299	S	S	.	.	H	α-helix	trans	-63.1	-50.2	178.7	-55	0	0	0	0	111.2	L98 L99 S104 L105 D106	L98-T102 WeakPolarHBondContact O-CB 3.36Å; L98-T102 PolarHBondContact O-N 3.44Å; L98-T102 PolarHBondContact O-OG1 3.48Å; L99-T102 PolarHBondContact O-N 3.13Å; T102-S104 VanDerWaalsContact C-N 3.32Å; T102-S104 PolarHBondContact O-N 3.47Å; T102-L105 PolarHBondContact O-N 3.46Å; T102-D106 PolarHBondContact O-N 2.93Å; T102-D106 VanDerWaalsContact O-N 3.13Å
103	L	93.4	Very high	94.4	Very high	34 Å²	34	57.8 Å²	57.8	18%	0.178	31%	0.307	C	S	.	.	H	α-helix	trans	-58.9	-43	177.4	-69.9	172.3	0	0	0	111.9	F46 Y50 L99 L105 D107	F46-L103 HydrophobicContact CE1-CB 4.3Å; Y50-L103 HydrophobicContact CD1-CD1 3.99Å; Y50-L103 HydrophobicContact CD2-CD1 3.8Å; Y50-L103 HydrophobicContact CE1-CD1 4.38Å; Y50-L103 HydrophobicContact CE2-CD1 4.22Å; Y50-L103 HydrophobicContact CG-CD1 3.68Å; L99-L103 HydrophobicContact CD1-CD1 4.09Å; L99-L103 HydrophobicContact CD1-CG 4.23Å; L99-L103 HydrophobicContact CG-CD1 3.99Å; L99-L103 WeakPolarHBondContact O-CG 3.35Å; L99-L103 PolarHBondContact O-N 2.88Å; L103-L105 VanDerWaalsContact C-N 3.33Å; L103-L105 PolarHBondContact O-N 3.14Å; L103-D107 WeakPolarHBondContact O-CB 3.37Å; L103-D107 PolarHBondContact O-N 3.19Å; L103-D107 VanDerWaalsContact O-N 3.15Å
104	S	94.4	Very high	94.3	Very high	45 Å²	45	55.4 Å²	55.4	32%	0.315	30%	0.295	S	S	.	.	H	α-helix	trans	-68.4	-32.4	179.4	-176.6	0	0	0	0	112.8	H43 A100 F101 T102	H43-S104 PolarHBondContact CE1-O 3.43Å; H43-S104 PolarHBondContact ND1-O 3.4Å; H43-S104 PolarHBondContact ND1-OG 2.89Å; A100-S104 WeakPolarHBondContact O-CB 3.11Å; A100-S104 PolarHBondContact O-N 2.95Å; F101-S104 PolarHBondContact O-N 3.39Å; T102-S104 VanDerWaalsContact C-N 3.32Å; T102-S104 PolarHBondContact O-N 3.47Å
105	L	92.5	Very high	94	Very high	94 Å²	94	52 Å²	52	49%	0.492	28%	0.278	S	S	.	.	H	α-helix	trans	-75.2	-33	178.6	-83.8	-174.3	0	0	0	113.3	F101 T102 L103 P123	F101-L105 HydrophobicContact CD1-CD1 3.89Å; F101-L105 HydrophobicContact CD1-CG 4.48Å; F101-L105 HydrophobicContact CD2-CG 4.46Å; F101-L105 HydrophobicContact CE1-CD1 3.26Å; F101-L105 HydrophobicContact CE1-CG 4.17Å; F101-L105 HydrophobicContact CE2-CD1 3.97Å; F101-L105 HydrophobicContact CE2-CD2 4.48Å; F101-L105 HydrophobicContact CE2-CG 4.12Å; F101-L105 HydrophobicContact CG-CD1 4.49Å; F101-L105 HydrophobicContact CZ-CD1 3.32Å; F101-L105 HydrophobicContact CZ-CD2 4.46Å; F101-L105 HydrophobicContact CZ-CG 3.99Å; F101-L105 WeakPolarHBondContact O-CB 3.32Å; F101-L105 WeakPolarHBondContact O-CG 3.37Å; F101-L105 PolarHBondContact O-N 3.15Å; T102-L105 PolarHBondContact O-N 3.46Å; L103-L105 VanDerWaalsContact C-N 3.33Å; L103-L105 PolarHBondContact O-N 3.14Å; L105-P123 WeakPolarHBondContact O-CG 3.43Å
106	D	91	Very high	93.7	Very high	111 Å²	111	49.3 Å²	49.3	59%	0.594	26%	0.262	S	S	*	.	H	α-helix	trans	-88.4	-17.5	179.5	86.3	35	0	0	0	113.6	T102 L108	T102-D106 PolarHBondContact O-N 2.93Å; T102-D106 VanDerWaalsContact O-N 3.13Å; D106-L108 PolarHBondContact O-N 3.45Å
107	D	93.1	Very high	93	Very high	10 Å²	10	55.2 Å²	55.2	5%	0.053	30%	0.3	C	S	.	.			trans	-66.4	109.7	-174.7	177.7	69.8	0	0	0	112	H43 L103 V109 I110 A111	H43-D107 IonicContact CE1-OD2 3.62Å; H43-D107 IonicContact NE2-OD2 3.38Å; H43-D107 PolarHBondContact NE2-OD2 2.82Å; L103-D107 WeakPolarHBondContact O-CB 3.37Å; L103-D107 PolarHBondContact O-N 3.19Å; L103-D107 VanDerWaalsContact O-N 3.15Å; D107-V109 PolarHBondContact OD1-N 3.23Å; D107-I110 PolarHBondContact OD1-N 3.1Å; D107-I110 WeakPolarHBondContact OD2-CA 3.38Å; D107-I110 WeakPolarHBondContact OD2-CB 2.98Å; D107-I110 PolarHBondContact OD2-N 3.41Å; D107-I110 VanDerWaalsContact OD2-N 3.08Å; D107-A111 PolarHBondContact OD2-N 3.49Å
108	L	92.6	Very high	92.3	Very high	45 Å²	45	51.9 Å²	51.9	24%	0.236	31%	0.314	C	S	.	.			trans	-95	-32.3	169.1	177.4	64.9	0	0	0	111.2	D106 S112 M124 F127	D106-L108 PolarHBondContact O-N 3.45Å; L108-S112 WeakPolarHBondContact O-CB 3.13Å; L108-S112 PolarHBondContact O-N 3.35Å; L108-S112 PolarHBondContact O-OG 3.29Å; L108-M124 HydrophobicContact CD1-CB 3.93Å; L108-M124 HydrophobicContact CD1-CG 4.16Å; L108-F127 HydrophobicContact CD1-CB 4.02Å; L108-F127 HydrophobicContact CD1-CD1 4.41Å; L108-F127 HydrophobicContact CD1-CG 4.33Å; L108-F127 HydrophobicContact CD2-CB 3.78Å; L108-F127 HydrophobicContact CD2-CD1 3.81Å; L108-F127 HydrophobicContact CD2-CD2 3.59Å; L108-F127 HydrophobicContact CD2-CE1 4.27Å; L108-F127 HydrophobicContact CD2-CE2 4.07Å; L108-F127 HydrophobicContact CD2-CG 3.43Å; L108-F127 VanDerWaalsContact CD2-CG 3.43Å; L108-F127 HydrophobicContact CD2-CZ 4.39Å
109	V	93.5	Very high	91.9	Very high	49 Å²	49	48.1 Å²	48.1	30%	0.297	30%	0.296	S	S	.	.	H	α-helix	trans	-74	-58.4	-166.4	179	0	0	0	0	110	D10 V11 D107 A111 S112 F113	D10-V109 HydrophobicContact CB-CB 4.11Å; D10-V109 HydrophobicContact CB-CG1 3.97Å; V11-V109 HydrophobicContact CB-CG1 4.32Å; V11-V109 HydrophobicContact CG2-CG1 3.69Å; D107-V109 PolarHBondContact OD1-N 3.23Å; V109-A111 PolarHBondContact O-N 2.88Å; V109-S112 PolarHBondContact O-N 2.94Å; V109-S112 PolarHBondContact O-OG 2.99Å; V109-F113 HydrophobicContact CG1-CD2 4.28Å; V109-F113 HydrophobicContact CG1-CE2 4.05Å; V109-F113 VanDerWaalsContact O-CD2 3.23Å; V109-F113 WeakPolarHBondContact O-CD2 3.38Å; V109-F113 PolarHBondContact O-N 3.39Å
110	I	93.9	Very high	91.5	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-64.3	-46	-177.8	-58.1	170.6	0	0	0	109.1	D10 T13 L17 A42 F46 D107 S112 F113 V114	D10-I110 HydrophobicContact CB-CG1 4.27Å; T13-I110 HydrophobicContact CG2-CD1 4.2Å; L17-I110 HydrophobicContact CD1-CG2 4.1Å; A42-I110 HydrophobicContact CB-CG2 3.79Å; F46-I110 HydrophobicContact CB-CD1 4.1Å; F46-I110 HydrophobicContact CD1-CD1 4.09Å; F46-I110 HydrophobicContact CD2-CD1 3.54Å; F46-I110 HydrophobicContact CE1-CD1 4.38Å; F46-I110 HydrophobicContact CE2-CD1 3.86Å; F46-I110 HydrophobicContact CG-CD1 3.65Å; F46-I110 HydrophobicContact CZ-CD1 4.26Å; D107-I110 PolarHBondContact OD1-N 3.1Å; D107-I110 WeakPolarHBondContact OD2-CA 3.38Å; D107-I110 WeakPolarHBondContact OD2-CB 2.98Å; D107-I110 PolarHBondContact OD2-N 3.41Å; D107-I110 VanDerWaalsContact OD2-N 3.08Å; I110-S112 VanDerWaalsContact C-N 3.28Å; I110-S112 PolarHBondContact O-N 2.63Å; I110-F113 PolarHBondContact O-N 3Å; I110-F113 VanDerWaalsContact O-N 3.07Å; I110-V114 HydrophobicContact CG2-CG1 4.37Å; I110-V114 WeakPolarHBondContact O-CG2 3.13Å; I110-V114 PolarHBondContact O-N 3.28Å
111	A	94.3	Very high	91.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-51.8	-44	174.9	0	0	0	0	0	112.4	D107 V109 F113 V114 S115 T121 M124	D107-A111 PolarHBondContact OD2-N 3.49Å; V109-A111 PolarHBondContact O-N 2.88Å; A111-F113 VanDerWaalsContact C-N 3.34Å; A111-F113 PolarHBondContact O-N 3.16Å; A111-V114 PolarHBondContact O-N 2.85Å; A111-S115 WeakPolarHBondContact O-CB 3.3Å; A111-S115 PolarHBondContact O-N 3.5Å; A111-S115 PolarHBondContact O-OG 3.48Å; A111-T121 HydrophobicContact CB-CG2 4.44Å; A111-M124 HydrophobicContact CB-CE 4.09Å
112	S	92.6	Very high	90.8	Very high	57 Å²	57	50.7 Å²	50.7	40%	0.399	32%	0.315	S	S	.	.	H	α-helix	trans	-63.8	-35.7	179.3	73.4	0	0	0	0	113.4	L108 V109 I110 S115	L108-S112 WeakPolarHBondContact O-CB 3.13Å; L108-S112 PolarHBondContact O-N 3.35Å; L108-S112 PolarHBondContact O-OG 3.29Å; V109-S112 PolarHBondContact O-N 2.94Å; V109-S112 PolarHBondContact O-OG 2.99Å; I110-S112 VanDerWaalsContact C-N 3.28Å; I110-S112 PolarHBondContact O-N 2.63Å; S112-S115 PolarHBondContact O-OG 3.39Å
113	F	94.2	Very high	90.4	Very high	56 Å²	56	48.8 Å²	48.8	25%	0.246	30%	0.304	C	S	.	.	H	α-helix	trans	-75.2	-37.7	178	-77.9	-71.3	0	0	0	112.6	V11 G14 L15 L18 R34 V109 I110 A111	V11-F113 HydrophobicContact CB-CE2 4.47Å; V11-F113 HydrophobicContact CG1-CE2 3.97Å; V11-F113 HydrophobicContact CG1-CZ 3.97Å; G14-F113 WeakPolarHBondContact O-CB 3.41Å; L15-F113 HydrophobicContact CB-CE1 4.44Å; L15-F113 HydrophobicContact CD1-CE1 4.36Å; L18-F113 HydrophobicContact CB-CB 4.28Å; L18-F113 WeakPolarHBondContact CD1-O 3.35Å; L18-F113 HydrophobicContact CD2-CD1 4.04Å; R34-F113 PolarHBondContact NH1-O 3.5Å; V109-F113 HydrophobicContact CG1-CD2 4.28Å; V109-F113 HydrophobicContact CG1-CE2 4.05Å; V109-F113 VanDerWaalsContact O-CD2 3.23Å; V109-F113 WeakPolarHBondContact O-CD2 3.38Å; V109-F113 PolarHBondContact O-N 3.39Å; I110-F113 PolarHBondContact O-N 3Å; I110-F113 VanDerWaalsContact O-N 3.07Å; A111-F113 VanDerWaalsContact C-N 3.34Å; A111-F113 PolarHBondContact O-N 3.16Å
114	V	93.9	Very high	90.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-98.4	-9.5	-172	-54	0	0	0	0	114	L17 F21 T38 I39 A42 I110 A111	L17-V114 HydrophobicContact CB-CG1 3.82Å; F21-V114 HydrophobicContact CD2-CB 4.2Å; F21-V114 HydrophobicContact CD2-CG1 4.13Å; F21-V114 HydrophobicContact CE2-CB 3.91Å; F21-V114 HydrophobicContact CE2-CG1 3.82Å; T38-V114 WeakPolarHBondContact CB-O 3.14Å; T38-V114 PolarHBondContact OG1-O 2.85Å; I39-V114 HydrophobicContact CB-CG2 4.32Å; I39-V114 HydrophobicContact CG1-CG2 3.9Å; A42-V114 HydrophobicContact CB-CB 4.27Å; A42-V114 HydrophobicContact CB-CG1 3.98Å; A42-V114 HydrophobicContact CB-CG2 3.76Å; I110-V114 HydrophobicContact CG2-CG1 4.37Å; I110-V114 WeakPolarHBondContact O-CG2 3.13Å; I110-V114 PolarHBondContact O-N 3.28Å; A111-V114 PolarHBondContact O-N 2.85Å
115	S	92.1	Very high	89.7	Confident	16 Å²	16	50.7 Å²	50.7	11%	0.112	31%	0.31	C	S	.	.			trans	-69.9	148.2	173.5	62.6	0	0	0	0	112.2	R34 A111 S112 A119 M124	R34-S115 VanDerWaalsContact CZ-O 3.24Å; R34-S115 PolarHBondContact NH1-O 3.06Å; A111-S115 WeakPolarHBondContact O-CB 3.3Å; A111-S115 PolarHBondContact O-N 3.5Å; A111-S115 PolarHBondContact O-OG 3.48Å; S112-S115 PolarHBondContact O-OG 3.39Å; S115-A119 WeakPolarHBondContact CB-O 3.46Å; S115-M124 WeakPolarHBondContact OG-CE 3.42Å
116	G	87.8	Confident	89.3	Confident	11 Å²	11	49.9 Å²	49.9	11%	0.113	31%	0.309	C	S	.	.			trans	-123	-176	168.6	0	0	0	0	0	112.1	R34 G118 A119	R34-G116 WeakPolarHBondContact O-CA 3.43Å; R34-G116 PolarHBondContact O-N 2.94Å; G116-G118 PolarHBondContact O-N 2.92Å; G116-A119 PolarHBondContact O-N 3.5Å; G116-A119 VanDerWaalsContact O-N 3.07Å
117	P	81.6	Confident	88.9	Confident	123 Å²	123	49.9 Å²	49.9	80%	0.799	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	130.3	-178.4	-24.5	34.3	0	0	0	111.7	A119	P117-A119 VanDerWaalsContact C-N 3.32Å; P117-A119 PolarHBondContact O-N 3.24Å
118	G	80.7	Confident	88.3	Confident	86 Å²	86	51.5 Å²	51.5	89%	0.887	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	-3.4	179.9	0	0	0	0	0	115.9	G116	G116-G118 PolarHBondContact O-N 2.92Å
119	A	87.8	Confident	87.7	Confident	7 Å²	7	50.1 Å²	50.1	6%	0.058	31%	0.31	C	S	.	.			trans	-111.3	64.4	178.8	0	0	0	0	0	112.3	I39 S115 G116 P117	I39-A119 HydrophobicContact CD1-CB 3.96Å; I39-A119 WeakPolarHBondContact CD1-O 3.4Å; S115-A119 WeakPolarHBondContact CB-O 3.46Å; G116-A119 PolarHBondContact O-N 3.5Å; G116-A119 VanDerWaalsContact O-N 3.07Å; P117-A119 VanDerWaalsContact C-N 3.32Å; P117-A119 PolarHBondContact O-N 3.24Å
120	T	87.3	Confident	86.9	Confident	82 Å²	82	52 Å²	52	50%	0.503	32%	0.321	S	S	.	.			trans	-92.2	119.9	177.4	-51.7	0	0	0	0	110.4	M124 L125	T120-M124 HydrophobicContact CG2-CB 3.95Å; T120-M124 HydrophobicContact CG2-CG 4.08Å; T120-M124 HydrophobicContact CG2-SD 4.12Å; T120-L125 HydrophobicContact CG2-CB 4.09Å
121	T	89.7	Confident	86	Confident	25 Å²	25	61.7 Å²	61.7	15%	0.153	36%	0.358	C	S	.	.			trans	-77.2	162.1	175.4	59.8	0	0	0	0	111.3	I39 A111 M124 L125	I39-T121 HydrophobicContact CD1-CG2 4.05Å; I39-T121 HydrophobicContact CG2-CG2 4.17Å; A111-T121 HydrophobicContact CB-CG2 4.44Å; T121-M124 PolarHBondContact O-N 3.35Å; T121-M124 VanDerWaalsContact O-N 3.16Å; T121-M124 WeakPolarHBondContact OG1-CB 3.15Å; T121-L125 PolarHBondContact O-N 3.38Å
122	L	86	Confident	84.8	Confident	134 Å²	134	69.9 Å²	69.9	70%	0.702	40%	0.398	S	S	*	.	H	α-helix	trans	-55	-47.3	177.7	-69.9	173.7	0	0	0	113	M124 L125 V126	L122-M124 VanDerWaalsContact C-N 3.29Å; L122-M124 PolarHBondContact O-N 2.83Å; L122-L125 PolarHBondContact O-N 3.08Å; L122-V126 WeakPolarHBondContact O-CG2 3.24Å; L122-V126 PolarHBondContact O-N 3.26Å
123	P	86.3	Confident	83.3	Confident	38 Å²	38	69.6 Å²	69.6	25%	0.247	40%	0.404	C	S	.	.	H	α-helix	trans	-60.5	-39	177.2	-24.6	35.6	0	0	0	112.8	L105 V126 F127	L105-P123 WeakPolarHBondContact O-CG 3.43Å; P123-V126 PolarHBondContact O-N 2.61Å; P123-F127 VanDerWaalsContact O-CB 3.28Å; P123-F127 WeakPolarHBondContact O-CB 3.25Å; P123-F127 PolarHBondContact O-N 3.35Å
124	M	87.9	Confident	81.6	Confident	29 Å²	29	70.4 Å²	70.4	14%	0.143	41%	0.414	C	S	.	.	H	α-helix	trans	-68.7	-38.1	178.7	-165.3	-175.3	-54.5	0	0	112.1	L108 A111 S115 T120 T121 L122 S128	L108-M124 HydrophobicContact CD1-CB 3.93Å; L108-M124 HydrophobicContact CD1-CG 4.16Å; A111-M124 HydrophobicContact CB-CE 4.09Å; S115-M124 WeakPolarHBondContact OG-CE 3.42Å; T120-M124 HydrophobicContact CG2-CB 3.95Å; T120-M124 HydrophobicContact CG2-CG 4.08Å; T120-M124 HydrophobicContact CG2-SD 4.12Å; T121-M124 PolarHBondContact O-N 3.35Å; T121-M124 VanDerWaalsContact O-N 3.16Å; T121-M124 WeakPolarHBondContact OG1-CB 3.15Å; L122-M124 VanDerWaalsContact C-N 3.29Å; L122-M124 PolarHBondContact O-N 2.83Å; M124-S128 VanDerWaalsContact O-CB 3.25Å; M124-S128 WeakPolarHBondContact O-CB 3.43Å; M124-S128 PolarHBondContact O-N 3.31Å; M124-S128 PolarHBondContact O-OG 3.06Å
125	L	85.2	Confident	80.2	Confident	91 Å²	91	75 Å²	75	48%	0.476	44%	0.438	S	S	.	.	H	α-helix	trans	-63.3	-47.7	173.3	-176.5	64.5	0	0	0	110.7	T120 T121 L122 F127 S128 S129	T120-L125 HydrophobicContact CG2-CB 4.09Å; T121-L125 PolarHBondContact O-N 3.38Å; L122-L125 PolarHBondContact O-N 3.08Å; L125-F127 PolarHBondContact O-N 3.48Å; L125-S128 WeakPolarHBondContact CA-OG 3.39Å; L125-S128 PolarHBondContact O-N 2.8Å; L125-S128 PolarHBondContact O-OG 3.45Å; L125-S129 VanDerWaalsContact O-CB 3.24Å; L125-S129 WeakPolarHBondContact O-CB 3.46Å; L125-S129 PolarHBondContact O-N 3.34Å; L125-S129 PolarHBondContact O-OG 3.39Å
126	V	82.8	Confident	79.4	Confident	76 Å²	76	78.9 Å²	78.9	46%	0.461	46%	0.463	S	S	.	.	H	α-helix	trans	-61.5	-47	177.5	173.7	0	0	0	0	110.8	L122 P123 S129 V130	L122-V126 WeakPolarHBondContact O-CG2 3.24Å; L122-V126 PolarHBondContact O-N 3.26Å; P123-V126 PolarHBondContact O-N 2.61Å; V126-S129 WeakPolarHBondContact O-CB 3.28Å; V126-S129 PolarHBondContact O-N 3.45Å; V126-V130 WeakPolarHBondContact O-CG2 3.42Å; V126-V130 PolarHBondContact O-N 2.92Å
127	F	83.8	Confident	78.9	Confident	111 Å²	111	85.6 Å²	85.6	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-63.6	-45.6	179.6	-178.5	-101.5	0	0	0	112.9	L108 P123 L125 S129 V130 R131	L108-F127 HydrophobicContact CD1-CB 4.02Å; L108-F127 HydrophobicContact CD1-CD1 4.41Å; L108-F127 HydrophobicContact CD1-CG 4.33Å; L108-F127 HydrophobicContact CD2-CB 3.78Å; L108-F127 HydrophobicContact CD2-CD1 3.81Å; L108-F127 HydrophobicContact CD2-CD2 3.59Å; L108-F127 HydrophobicContact CD2-CE1 4.27Å; L108-F127 HydrophobicContact CD2-CE2 4.07Å; L108-F127 HydrophobicContact CD2-CG 3.43Å; L108-F127 VanDerWaalsContact CD2-CG 3.43Å; L108-F127 HydrophobicContact CD2-CZ 4.39Å; P123-F127 VanDerWaalsContact O-CB 3.28Å; P123-F127 WeakPolarHBondContact O-CB 3.25Å; P123-F127 PolarHBondContact O-N 3.35Å; L125-F127 PolarHBondContact O-N 3.48Å; F127-S129 VanDerWaalsContact C-N 3.26Å; F127-S129 PolarHBondContact O-N 3.31Å; F127-V130 PolarHBondContact O-N 3.19Å; F127-R131 PolarHBondContact O-N 2.91Å; F127-R131 VanDerWaalsContact O-N 3.1Å
128	S	81	Confident	78.4	Confident	45 Å²	45	82 Å²	82	32%	0.315	47%	0.465	S	S	.	.	H	α-helix	trans	-62.6	-36	176.6	58	0	0	0	0	112	M124 L125 R131 M132	M124-S128 VanDerWaalsContact O-CB 3.25Å; M124-S128 WeakPolarHBondContact O-CB 3.43Å; M124-S128 PolarHBondContact O-N 3.31Å; M124-S128 PolarHBondContact O-OG 3.06Å; L125-S128 WeakPolarHBondContact CA-OG 3.39Å; L125-S128 PolarHBondContact O-N 2.8Å; L125-S128 PolarHBondContact O-OG 3.45Å; S128-R131 PolarHBondContact O-N 3.33Å; S128-M132 WeakPolarHBondContact O-CB 3.47Å; S128-M132 VanDerWaalsContact O-CG 3.24Å; S128-M132 WeakPolarHBondContact O-CG 3.21Å; S128-M132 PolarHBondContact O-N 3.1Å
129	S	78.4	Confident	78.2	Confident	15 Å²	15	81.2 Å²	81.2	11%	0.105	44%	0.44	C	S	.	.	H	α-helix	trans	-67.8	-37.7	177.6	-61.4	0	0	0	0	113.5	L125 V126 F127 R131 G133 I138	L125-S129 VanDerWaalsContact O-CB 3.24Å; L125-S129 WeakPolarHBondContact O-CB 3.46Å; L125-S129 PolarHBondContact O-N 3.34Å; L125-S129 PolarHBondContact O-OG 3.39Å; V126-S129 WeakPolarHBondContact O-CB 3.28Å; V126-S129 PolarHBondContact O-N 3.45Å; F127-S129 VanDerWaalsContact C-N 3.26Å; F127-S129 PolarHBondContact O-N 3.31Å; S129-R131 VanDerWaalsContact C-N 3.32Å; S129-G133 CarbonylContact O-C 3.56Å; S129-I138 WeakPolarHBondContact OG-CD1 3.34Å
130	V	76.7	Confident	78	Confident	89 Å²	89	83.3 Å²	83.3	54%	0.539	46%	0.457	S	S	.	.	H	α-helix	trans	-65.9	-39	172.4	173.2	0	0	0	0	110.5	V126 F127	V126-V130 WeakPolarHBondContact O-CG2 3.42Å; V126-V130 PolarHBondContact O-N 2.92Å; F127-V130 PolarHBondContact O-N 3.19Å
131	R	76.1	Confident	77.8	Confident	205 Å²	205	84.4 Å²	84.4	77%	0.774	46%	0.46	S	S	*	.	H	α-helix	trans	-74.1	-35.1	-177.7	-170	179.2	177.8	-169.5	-0.3	114	F127 S128 S129 G133	F127-R131 PolarHBondContact O-N 2.91Å; F127-R131 VanDerWaalsContact O-N 3.1Å; S128-R131 PolarHBondContact O-N 3.33Å; S129-R131 VanDerWaalsContact C-N 3.32Å; R131-G133 PolarHBondContact O-N 3.21Å
132	M	69	Low	77.1	Confident	172 Å²	172	84.9 Å²	84.9	85%	0.847	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	4.1	-176.1	-69	-70.6	-77.9	0	0	114	S128	S128-M132 WeakPolarHBondContact O-CB 3.47Å; S128-M132 VanDerWaalsContact O-CG 3.24Å; S128-M132 WeakPolarHBondContact O-CG 3.21Å; S128-M132 PolarHBondContact O-N 3.1Å
133	G	61	Low	77	Confident	50 Å²	50	83.1 Å²	83.1	52%	0.515	46%	0.461	S	S	.	.			trans	95.3	116.8	-170.4	0	0	0	0	0	109.6	S129 R131 N135	S129-G133 CarbonylContact O-C 3.56Å; R131-G133 PolarHBondContact O-N 3.21Å; G133-N135 PolarHBondContact O-N 3.11Å
134	V	58.4	Low	77.2	Confident	74 Å²	74	87.3 Å²	87.3	45%	0.448	48%	0.481	S	S	.	.			trans	-57.1	102.5	-176	-85.7	0	0	0	0	111.3	P136 N139	V134-P136 WeakPolarHBondContact O-CD 3.39Å; V134-N139 VanDerWaalsContact CG1-OD1 3.3Å; V134-N139 WeakPolarHBondContact CG1-OD1 3.19Å
135	N	64.9	Low	77	Confident	95 Å²	95	90.4 Å²	90.4	51%	0.508	50%	0.497	S	S	.	.			trans	-60.9	124.8	161.5	-106.2	-33.3	0	0	0	107.4	G133 E137 I138 N139	G133-N135 PolarHBondContact O-N 3.11Å; N135-E137 PolarHBondContact O-N 3.22Å; N135-I138 HydrophobicContact CB-CD1 4.1Å; N135-I138 HydrophobicContact CB-CG1 4.08Å; N135-I138 PolarHBondContact O-N 2.87Å; N135-N139 PolarHBondContact O-N 3.3Å
136	P	75.2	Confident	76.9	Confident	98 Å²	98	92.2 Å²	92.2	64%	0.636	51%	0.507	S	S	*	.	H	α-helix	trans	-51.5	-30.1	178.9	-28.9	35.5	0	0	0	113.3	V134 I138 N139 A140	V134-P136 WeakPolarHBondContact O-CD 3.39Å; P136-I138 VanDerWaalsContact C-N 3.33Å; P136-I138 PolarHBondContact O-N 3.2Å; P136-N139 PolarHBondContact O-N 3.22Å; P136-A140 WeakPolarHBondContact O-CB 3.47Å; P136-A140 PolarHBondContact O-N 3.48Å
137	E	76.9	Confident	77.3	Confident	152 Å²	152	90.2 Å²	90.2	71%	0.71	50%	0.502	S	S	*	.	H	α-helix	trans	-59.9	-38.4	175.5	-61.3	-179.8	178	0	0	113.1	N135 A140 L141	N135-E137 PolarHBondContact O-N 3.22Å; E137-A140 PolarHBondContact O-N 3.44Å; E137-L141 WeakPolarHBondContact O-CB 3.46Å; E137-L141 PolarHBondContact O-N 3.39Å
138	I	71.2	Confident	77.7	Confident	48 Å²	48	87.6 Å²	87.6	25%	0.246	50%	0.5	C	S	.	.	H	α-helix	trans	-78.3	-37.1	-176.4	-57.3	-178.8	0	0	0	110.2	S129 N135 P136 A140 L141 A142	S129-I138 WeakPolarHBondContact OG-CD1 3.34Å; N135-I138 HydrophobicContact CB-CD1 4.1Å; N135-I138 HydrophobicContact CB-CG1 4.08Å; N135-I138 PolarHBondContact O-N 2.87Å; P136-I138 VanDerWaalsContact C-N 3.33Å; P136-I138 PolarHBondContact O-N 3.2Å; I138-A140 VanDerWaalsContact C-N 3.33Å; I138-L141 PolarHBondContact O-N 2.91Å; I138-A142 WeakPolarHBondContact O-CB 3.39Å; I138-A142 PolarHBondContact O-N 3.07Å
139	N	75.5	Confident	78.1	Confident	69 Å²	69	90 Å²	90	37%	0.369	51%	0.513	S	S	.	.	H	α-helix	trans	-64.7	-38.7	171.4	-72.2	-3.3	0	0	0	111.7	V134 N135 P136 T143	V134-N139 VanDerWaalsContact CG1-OD1 3.3Å; V134-N139 WeakPolarHBondContact CG1-OD1 3.19Å; N135-N139 PolarHBondContact O-N 3.3Å; P136-N139 PolarHBondContact O-N 3.22Å; N139-T143 WeakPolarHBondContact O-CB 3.4Å; N139-T143 PolarHBondContact O-N 2.76Å; N139-T143 PolarHBondContact O-OG1 2.94Å
140	A	84.6	Confident	78.7	Confident	51 Å²	51	91.3 Å²	91.3	42%	0.421	53%	0.529	S	S	.	.	H	α-helix	trans	-64.1	-46.3	174.5	0	0	0	0	0	111.2	P136 E137 I138 T143 L144	P136-A140 WeakPolarHBondContact O-CB 3.47Å; P136-A140 PolarHBondContact O-N 3.48Å; E137-A140 PolarHBondContact O-N 3.44Å; I138-A140 VanDerWaalsContact C-N 3.33Å; A140-T143 PolarHBondContact O-N 3.24Å; A140-L144 WeakPolarHBondContact O-CG 3.46Å; A140-L144 PolarHBondContact O-N 2.99Å
141	L	82.7	Confident	79.5	Confident	105 Å²	105	92.1 Å²	92.1	55%	0.55	53%	0.529	S	S	.	.	H	α-helix	trans	-60.9	-46.1	176.3	-173.1	67.6	0	0	0	111.7	E137 I138 T143 L144 I145	E137-L141 WeakPolarHBondContact O-CB 3.46Å; E137-L141 PolarHBondContact O-N 3.39Å; I138-L141 PolarHBondContact O-N 2.91Å; L141-T143 VanDerWaalsContact C-N 3.32Å; L141-T143 PolarHBondContact O-N 3.24Å; L141-L144 PolarHBondContact O-N 2.92Å; L141-I145 HydrophobicContact CD1-CD1 4.33Å; L141-I145 HydrophobicContact CG-CD1 3.93Å; L141-I145 VanDerWaalsContact O-CG1 3.29Å; L141-I145 WeakPolarHBondContact O-CG1 3.5Å; L141-I145 PolarHBondContact O-N 3.24Å
142	A	75	Confident	80.3	Confident	36 Å²	36	87 Å²	87	30%	0.298	52%	0.52	S	S	.	.	H	α-helix	trans	-60.4	-42.2	176.6	0	0	0	0	0	111.7	I138 I145 L146	I138-A142 WeakPolarHBondContact O-CB 3.39Å; I138-A142 PolarHBondContact O-N 3.07Å; A142-I145 PolarHBondContact O-N 2.91Å; A142-L146 VanDerWaalsContact O-CB 3.32Å; A142-L146 WeakPolarHBondContact O-CB 3.24Å; A142-L146 VanDerWaalsContact O-CG 3.29Å; A142-L146 WeakPolarHBondContact O-CG 3.46Å; A142-L146 PolarHBondContact O-N 2.86Å
143	T	84.6	Confident	81.3	Confident	97 Å²	97	80.8 Å²	80.8	60%	0.595	50%	0.5	S	S	*	.	H	α-helix	trans	-65.2	-41.7	177	-57.2	0	0	0	0	111.7	N139 A140 L141 G147	N139-T143 WeakPolarHBondContact O-CB 3.4Å; N139-T143 PolarHBondContact O-N 2.76Å; N139-T143 PolarHBondContact O-OG1 2.94Å; A140-T143 PolarHBondContact O-N 3.24Å; L141-T143 VanDerWaalsContact C-N 3.32Å; L141-T143 PolarHBondContact O-N 3.24Å; T143-G147 PolarHBondContact O-N 2.96Å
144	L	89.5	Confident	82.8	Confident	126 Å²	126	84.4 Å²	84.4	66%	0.66	50%	0.502	S	S	*	.	H	α-helix	trans	-64.1	-43.6	175.7	-75.7	171.7	0	0	0	111.7	A140 L141 G147 A148	A140-L144 WeakPolarHBondContact O-CG 3.46Å; A140-L144 PolarHBondContact O-N 2.99Å; L141-L144 PolarHBondContact O-N 2.92Å; L144-G147 PolarHBondContact O-N 2.82Å; L144-A148 VanDerWaalsContact O-CB 3.27Å; L144-A148 WeakPolarHBondContact O-CB 3.37Å; L144-A148 PolarHBondContact O-N 2.89Å
145	I	83.7	Confident	84.6	Confident	94 Å²	94	85 Å²	85	48%	0.482	50%	0.502	S	S	.	.	H	α-helix	trans	-64.4	-50.2	177.3	-68.5	169.3	0	0	0	110.3	L141 A142 G147 A148 V149	L141-I145 HydrophobicContact CD1-CD1 4.33Å; L141-I145 HydrophobicContact CG-CD1 3.93Å; L141-I145 VanDerWaalsContact O-CG1 3.29Å; L141-I145 WeakPolarHBondContact O-CG1 3.5Å; L141-I145 PolarHBondContact O-N 3.24Å; A142-I145 PolarHBondContact O-N 2.91Å; I145-G147 VanDerWaalsContact C-N 3.31Å; I145-G147 PolarHBondContact O-N 3.21Å; I145-A148 PolarHBondContact O-N 3.4Å; I145-V149 HydrophobicContact CG2-CG2 4.33Å; I145-V149 WeakPolarHBondContact O-CB 3.46Å; I145-V149 VanDerWaalsContact O-CG2 3.29Å; I145-V149 WeakPolarHBondContact O-CG2 3.36Å; I145-V149 PolarHBondContact O-N 3.07Å
146	L	84	Confident	85.8	Confident	129 Å²	129	82.4 Å²	82.4	68%	0.675	49%	0.493	S	S	*	.	H	α-helix	trans	-62.6	-38.6	178.1	-73.6	172.1	0	0	0	111.9	A142 G150	A142-L146 VanDerWaalsContact O-CB 3.32Å; A142-L146 WeakPolarHBondContact O-CB 3.24Å; A142-L146 VanDerWaalsContact O-CG 3.29Å; A142-L146 WeakPolarHBondContact O-CG 3.46Å; A142-L146 PolarHBondContact O-N 2.86Å; L146-G150 WeakPolarHBondContact O-CA 3.24Å; L146-G150 PolarHBondContact O-N 3.07Å
147	G	91.6	Very high	86.7	Confident	34 Å²	34	85.4 Å²	85.4	35%	0.351	49%	0.492	S	S	.	.	H	α-helix	trans	-63.6	-47.7	173.9	0	0	0	0	0	112	T143 L144 I145 G150 I151	T143-G147 PolarHBondContact O-N 2.96Å; L144-G147 PolarHBondContact O-N 2.82Å; I145-G147 VanDerWaalsContact C-N 3.31Å; I145-G147 PolarHBondContact O-N 3.21Å; G147-G150 PolarHBondContact O-N 3.27Å; G147-I151 WeakPolarHBondContact O-CB 3.41Å; G147-I151 WeakPolarHBondContact O-CD1 3.47Å; G147-I151 WeakPolarHBondContact O-CG1 3.25Å; G147-I151 PolarHBondContact O-N 3.02Å
148	A	91.6	Very high	87.6	Confident	55 Å²	55	84.5 Å²	84.5	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-63.3	-48.6	178.3	0	0	0	0	0	111.9	L144 I145 G150 I151 V152	L144-A148 VanDerWaalsContact O-CB 3.27Å; L144-A148 WeakPolarHBondContact O-CB 3.37Å; L144-A148 PolarHBondContact O-N 2.89Å; I145-A148 PolarHBondContact O-N 3.4Å; A148-G150 VanDerWaalsContact C-N 3.33Å; A148-G150 PolarHBondContact O-N 3.4Å; A148-I151 PolarHBondContact O-N 3.48Å; A148-V152 WeakPolarHBondContact O-CB 3.35Å; A148-V152 VanDerWaalsContact O-CG2 3.27Å; A148-V152 WeakPolarHBondContact O-CG2 3.23Å; A148-V152 PolarHBondContact O-N 3.28Å
149	V	88.5	Confident	88.7	Confident	97 Å²	97	87 Å²	87	59%	0.588	50%	0.496	S	S	*	.	H	α-helix	trans	-62.7	-41.7	176.7	173.7	0	0	0	0	110.7	I145 V152 G153	I145-V149 HydrophobicContact CG2-CG2 4.33Å; I145-V149 WeakPolarHBondContact O-CB 3.46Å; I145-V149 VanDerWaalsContact O-CG2 3.29Å; I145-V149 WeakPolarHBondContact O-CG2 3.36Å; I145-V149 PolarHBondContact O-N 3.07Å; V149-V152 PolarHBondContact O-N 2.72Å; V149-G153 PolarHBondContact O-N 3.47Å
150	G	91.1	Very high	89.4	Confident	42 Å²	42	90.2 Å²	90.2	43%	0.433	51%	0.511	S	S	.	.	H	α-helix	trans	-62.4	-44	176.1	0	0	0	0	0	112.8	L146 G147 A148 G153 F154	L146-G150 WeakPolarHBondContact O-CA 3.24Å; L146-G150 PolarHBondContact O-N 3.07Å; G147-G150 PolarHBondContact O-N 3.27Å; A148-G150 VanDerWaalsContact C-N 3.33Å; A148-G150 PolarHBondContact O-N 3.4Å; G150-G153 PolarHBondContact O-N 3.34Å; G150-F154 VanDerWaalsContact O-CB 3.22Å; G150-F154 WeakPolarHBondContact O-CB 3.2Å; G150-F154 PolarHBondContact O-N 3.15Å
151	I	94.4	Very high	89.7	Confident	106 Å²	106	89.4 Å²	89.4	54%	0.544	50%	0.504	S	S	.	.	H	α-helix	trans	-64.2	-47.2	175.8	-71.3	164.7	0	0	0	110.5	G147 A148 G153 F154 I155	G147-I151 WeakPolarHBondContact O-CB 3.41Å; G147-I151 WeakPolarHBondContact O-CD1 3.47Å; G147-I151 WeakPolarHBondContact O-CG1 3.25Å; G147-I151 PolarHBondContact O-N 3.02Å; A148-I151 PolarHBondContact O-N 3.48Å; I151-G153 PolarHBondContact O-N 3.35Å; I151-F154 PolarHBondContact O-N 2.89Å; I151-I155 HydrophobicContact CG2-CD1 3.68Å; I151-I155 HydrophobicContact CG2-CG1 4.39Å; I151-I155 WeakPolarHBondContact O-CB 3.09Å; I151-I155 VanDerWaalsContact O-CG1 3.23Å; I151-I155 WeakPolarHBondContact O-CG1 3.47Å; I151-I155 PolarHBondContact O-N 3.45Å
152	V	92.3	Very high	90.1	Very high	98 Å²	98	91.6 Å²	91.6	59%	0.594	51%	0.505	S	S	*	.	H	α-helix	trans	-61.5	-45.5	177.9	170.8	0	0	0	0	110.8	A148 V149 I155 A156	A148-V152 WeakPolarHBondContact O-CB 3.35Å; A148-V152 VanDerWaalsContact O-CG2 3.27Å; A148-V152 WeakPolarHBondContact O-CG2 3.23Å; A148-V152 PolarHBondContact O-N 3.28Å; V149-V152 PolarHBondContact O-N 2.72Å; V152-I155 PolarHBondContact O-N 2.79Å; V152-A156 WeakPolarHBondContact O-CB 3.17Å; V152-A156 PolarHBondContact O-N 3.11Å
153	G	90.2	Very high	90.8	Very high	41 Å²	41	92.3 Å²	92.3	42%	0.423	51%	0.511	S	S	.	.	H	α-helix	trans	-62.4	-41.6	176.3	0	0	0	0	0	112.6	V149 G150 I151 A156 W157	V149-G153 PolarHBondContact O-N 3.47Å; G150-G153 PolarHBondContact O-N 3.34Å; I151-G153 PolarHBondContact O-N 3.35Å; G153-A156 PolarHBondContact O-N 3.49Å; G153-W157 WeakPolarHBondContact O-CB 3.48Å; G153-W157 PolarHBondContact O-N 2.69Å
154	F	93.5	Very high	91	Very high	126 Å²	126	92 Å²	92	55%	0.553	50%	0.502	S	S	*	.	H	α-helix	trans	-65.3	-42.6	175.8	-175.7	-96.3	0	0	0	112.2	G150 I151 W157 Y158	G150-F154 VanDerWaalsContact O-CB 3.22Å; G150-F154 WeakPolarHBondContact O-CB 3.2Å; G150-F154 PolarHBondContact O-N 3.15Å; I151-F154 PolarHBondContact O-N 2.89Å; F154-W157 HydrophobicContact CD2-CE3 4.07Å; F154-W157 HydrophobicContact CD2-CZ3 4.27Å; F154-W157 AromaticContact CE2-CE3 4Å; F154-W157 HydrophobicContact CE2-CE3 4Å; F154-W157 AromaticContact CE2-CZ3 3.74Å; F154-W157 HydrophobicContact CE2-CZ3 3.74Å; F154-W157 HydrophobicContact CZ-CZ3 4.31Å; F154-W157 PolarHBondContact O-N 3.31Å; F154-Y158 VanDerWaalsContact O-CB 3.25Å; F154-Y158 WeakPolarHBondContact O-CB 3.14Å; F154-Y158 PolarHBondContact O-N 3.27Å
155	I	94.6	Very high	90.9	Very high	87 Å²	87	92.7 Å²	92.7	45%	0.446	50%	0.5	S	S	.	.	H	α-helix	trans	-62.6	-47.3	174.7	-69.2	166.6	0	0	0	110.2	I151 V152 W157 Y158 L159	I151-I155 HydrophobicContact CG2-CD1 3.68Å; I151-I155 HydrophobicContact CG2-CG1 4.39Å; I151-I155 WeakPolarHBondContact O-CB 3.09Å; I151-I155 VanDerWaalsContact O-CG1 3.23Å; I151-I155 WeakPolarHBondContact O-CG1 3.47Å; I151-I155 PolarHBondContact O-N 3.45Å; V152-I155 PolarHBondContact O-N 2.79Å; I155-W157 PolarHBondContact O-N 3.07Å; I155-Y158 PolarHBondContact O-N 3.31Å; I155-L159 HydrophobicContact CG2-CD1 3.84Å; I155-L159 HydrophobicContact CG2-CG 4.27Å; I155-L159 WeakPolarHBondContact O-CB 3.33Å; I155-L159 VanDerWaalsContact O-CG 3.27Å; I155-L159 WeakPolarHBondContact O-CG 3.46Å; I155-L159 PolarHBondContact O-N 2.88Å
156	A	91.8	Very high	91	Very high	39 Å²	39	93.1 Å²	93.1	32%	0.322	50%	0.5	S	S	.	.	H	α-helix	trans	-59.6	-47.9	178.1	0	0	0	0	0	111.3	V152 G153 Y158 L159 M160	V152-A156 WeakPolarHBondContact O-CB 3.17Å; V152-A156 PolarHBondContact O-N 3.11Å; G153-A156 PolarHBondContact O-N 3.49Å; A156-Y158 PolarHBondContact O-N 2.71Å; A156-L159 PolarHBondContact O-N 3.33Å; A156-M160 WeakPolarHBondContact O-CB 3.45Å; A156-M160 VanDerWaalsContact O-CG 3.25Å; A156-M160 WeakPolarHBondContact O-CG 3.33Å; A156-M160 PolarHBondContact O-N 2.9Å
157	W	93.9	Very high	91.1	Very high	162 Å²	162	94.6 Å²	94.6	61%	0.614	50%	0.497	S	S	*	.	H	α-helix	trans	-59.7	-44.9	175	172.4	73	0	0	0	112	G153 F154 I155 L159 M160 A161	G153-W157 WeakPolarHBondContact O-CB 3.48Å; G153-W157 PolarHBondContact O-N 2.69Å; F154-W157 HydrophobicContact CD2-CE3 4.07Å; F154-W157 HydrophobicContact CD2-CZ3 4.27Å; F154-W157 AromaticContact CE2-CE3 4Å; F154-W157 HydrophobicContact CE2-CE3 4Å; F154-W157 AromaticContact CE2-CZ3 3.74Å; F154-W157 HydrophobicContact CE2-CZ3 3.74Å; F154-W157 HydrophobicContact CZ-CZ3 4.31Å; F154-W157 PolarHBondContact O-N 3.31Å; I155-W157 PolarHBondContact O-N 3.07Å; W157-L159 PolarHBondContact O-N 3.33Å; W157-M160 PolarHBondContact O-N 2.83Å; W157-A161 WeakPolarHBondContact O-CB 3.42Å; W157-A161 PolarHBondContact O-N 2.92Å
158	Y	94.5	Very high	90.9	Very high	132 Å²	132	96.6 Å²	96.6	52%	0.518	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-44.2	178.8	-178.4	-95.9	0	0	0	112.1	F154 I155 A156 R162	F154-Y158 VanDerWaalsContact O-CB 3.25Å; F154-Y158 WeakPolarHBondContact O-CB 3.14Å; F154-Y158 PolarHBondContact O-N 3.27Å; I155-Y158 PolarHBondContact O-N 3.31Å; A156-Y158 PolarHBondContact O-N 2.71Å; Y158-R162 WeakPolarHBondContact O-CB 3.21Å; Y158-R162 PolarHBondContact O-N 2.88Å
159	L	94.3	Very high	90.6	Very high	102 Å²	102	101.5 Å²	101.5	53%	0.534	51%	0.506	S	S	.	.	H	α-helix	trans	-65.1	-45.2	176.9	-68.6	175.3	0	0	0	111.6	I155 A156 W157 R162 A163	I155-L159 HydrophobicContact CG2-CD1 3.84Å; I155-L159 HydrophobicContact CG2-CG 4.27Å; I155-L159 WeakPolarHBondContact O-CB 3.33Å; I155-L159 VanDerWaalsContact O-CG 3.27Å; I155-L159 WeakPolarHBondContact O-CG 3.46Å; I155-L159 PolarHBondContact O-N 2.88Å; A156-L159 PolarHBondContact O-N 3.33Å; W157-L159 PolarHBondContact O-N 3.33Å; L159-R162 PolarHBondContact O-N 3.33Å; L159-A163 WeakPolarHBondContact O-CB 3.43Å; L159-A163 PolarHBondContact O-N 3.49Å
160	M	91.5	Very high	90.6	Very high	136 Å²	136	101.1 Å²	101.1	67%	0.67	50%	0.5	S	S	*	.	H	α-helix	trans	-63.8	-43.7	176.6	-71.5	177.7	-174.5	0	0	111.8	A156 W157 R162 A163 E164	A156-M160 WeakPolarHBondContact O-CB 3.45Å; A156-M160 VanDerWaalsContact O-CG 3.25Å; A156-M160 WeakPolarHBondContact O-CG 3.33Å; A156-M160 PolarHBondContact O-N 2.9Å; W157-M160 PolarHBondContact O-N 2.83Å; M160-R162 VanDerWaalsContact C-N 3.26Å; M160-R162 PolarHBondContact O-N 3.38Å; M160-A163 PolarHBondContact O-N 3.48Å; M160-E164 WeakPolarHBondContact O-CB 3.39Å; M160-E164 PolarHBondContact O-N 3.32Å
161	A	91.3	Very high	90.4	Very high	34 Å²	34	103 Å²	103	28%	0.281	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-33	176.3	0	0	0	0	0	112	W157 K165	W157-A161 WeakPolarHBondContact O-CB 3.42Å; W157-A161 PolarHBondContact O-N 2.92Å; A161-K165 WeakPolarHBondContact O-CB 3.24Å; A161-K165 WeakPolarHBondContact O-CG 3.43Å; A161-K165 PolarHBondContact O-N 2.87Å; A161-K165 VanDerWaalsContact O-N 3.15Å
162	R	90.9	Very high	90.1	Very high	150 Å²	150	103.2 Å²	103.2	57%	0.566	50%	0.498	S	S	*	.	H	α-helix	trans	-72.3	-42.4	174.7	-161.6	178.8	-171.5	-151.8	3.2	111.7	Y158 L159 M160 K165 Q166	Y158-R162 WeakPolarHBondContact O-CB 3.21Å; Y158-R162 PolarHBondContact O-N 2.88Å; L159-R162 PolarHBondContact O-N 3.33Å; M160-R162 VanDerWaalsContact C-N 3.26Å; M160-R162 PolarHBondContact O-N 3.38Å; R162-K165 PolarHBondContact O-N 2.92Å; R162-Q166 WeakPolarHBondContact O-CG 3.33Å; R162-Q166 PolarHBondContact O-N 2.67Å
163	A	90.1	Very high	89.8	Confident	52 Å²	52	107.3 Å²	107.3	43%	0.43	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-41.5	176.1	0	0	0	0	0	111.8	L159 M160 Q166 R167	L159-A163 WeakPolarHBondContact O-CB 3.43Å; L159-A163 PolarHBondContact O-N 3.49Å; M160-A163 PolarHBondContact O-N 3.48Å; A163-Q166 WeakPolarHBondContact O-CB 3.3Å; A163-Q166 PolarHBondContact O-N 3.44Å; A163-R167 WeakPolarHBondContact O-CB 3.46Å; A163-R167 PolarHBondContact O-N 2.9Å
164	E	88.5	Confident	89.6	Confident	89 Å²	89	109 Å²	109	42%	0.416	51%	0.513	S	S	.	.	H	α-helix	trans	-67.2	-40.5	177.3	-171.5	59.1	-160.8	0	0	111.5	M160 Q166 R167 I168	M160-E164 WeakPolarHBondContact O-CB 3.39Å; M160-E164 PolarHBondContact O-N 3.32Å; E164-Q166 VanDerWaalsContact C-N 3.29Å; E164-Q166 PolarHBondContact O-N 2.94Å; E164-R167 PolarHBondContact O-N 3.41Å; E164-R167 IonicContact OE2-NH1 3.91Å; E164-I168 HydrophobicContact CG-CD1 4.16Å; E164-I168 VanDerWaalsContact O-CG1 3.3Å; E164-I168 WeakPolarHBondContact O-CG1 3.32Å; E164-I168 PolarHBondContact O-N 3.35Å
165	K	86.3	Confident	89.1	Confident	142 Å²	142	113.1 Å²	113.1	62%	0.617	52%	0.524	S	S	*	.	H	α-helix	trans	-61.3	-36.1	171.9	-78.2	-179.5	-178.1	-178.9	0	112.5	A161 R162 R169	A161-K165 WeakPolarHBondContact O-CB 3.24Å; A161-K165 WeakPolarHBondContact O-CG 3.43Å; A161-K165 PolarHBondContact O-N 2.87Å; A161-K165 VanDerWaalsContact O-N 3.15Å; R162-K165 PolarHBondContact O-N 2.92Å; K165-R169 VanDerWaalsContact O-CG 3.24Å; K165-R169 WeakPolarHBondContact O-CG 3.34Å; K165-R169 PolarHBondContact O-N 2.92Å
166	Q	86.2	Confident	88.3	Confident	103 Å²	103	119.8 Å²	119.8	48%	0.481	54%	0.544	S	S	.	.	H	α-helix	trans	-68.3	-47	174.2	-76.1	176.3	-22.6	0	0	111.1	R162 A163 E164 I168 R169 D170	R162-Q166 WeakPolarHBondContact O-CG 3.33Å; R162-Q166 PolarHBondContact O-N 2.67Å; A163-Q166 WeakPolarHBondContact O-CB 3.3Å; A163-Q166 PolarHBondContact O-N 3.44Å; E164-Q166 VanDerWaalsContact C-N 3.29Å; E164-Q166 PolarHBondContact O-N 2.94Å; Q166-I168 VanDerWaalsContact C-N 3.34Å; Q166-I168 PolarHBondContact O-N 3.03Å; Q166-R169 WeakPolarHBondContact O-CA 3.09Å; Q166-R169 WeakPolarHBondContact O-CB 3.46Å; Q166-R169 PolarHBondContact O-N 3.48Å; Q166-D170 PolarHBondContact O-N 2.91Å
167	R	86.8	Confident	87.3	Confident	159 Å²	159	123.8 Å²	123.8	60%	0.6	59%	0.589	S	S	*	*	H	α-helix	trans	-58	-43.3	177.3	-168.5	179.3	178.7	-145.8	2	112.4	A163 E164 R169 D170 I171	A163-R167 WeakPolarHBondContact O-CB 3.46Å; A163-R167 PolarHBondContact O-N 2.9Å; E164-R167 PolarHBondContact O-N 3.41Å; E164-R167 IonicContact OE2-NH1 3.91Å; R167-R169 PolarHBondContact O-N 2.85Å; R167-D170 PolarHBondContact O-N 3.36Å; R167-I171 HydrophobicContact CG-CD1 4.21Å; R167-I171 VanDerWaalsContact O-CG1 3.25Å; R167-I171 WeakPolarHBondContact O-CG1 3.28Å; R167-I171 PolarHBondContact O-N 3.19Å
168	I	87.1	Confident	86.9	Confident	77 Å²	77	121.9 Å²	121.9	40%	0.395	59%	0.588	S	S	.	*	H	α-helix	trans	-63.2	-40.7	175	-67.3	168.8	0	0	0	111.2	E164 Q166 I171 Q172	E164-I168 HydrophobicContact CG-CD1 4.16Å; E164-I168 VanDerWaalsContact O-CG1 3.3Å; E164-I168 WeakPolarHBondContact O-CG1 3.32Å; E164-I168 PolarHBondContact O-N 3.35Å; Q166-I168 VanDerWaalsContact C-N 3.34Å; Q166-I168 PolarHBondContact O-N 3.03Å; I168-I171 PolarHBondContact O-N 2.88Å; I168-Q172 WeakPolarHBondContact O-CG 3.31Å; I168-Q172 PolarHBondContact O-N 3.4Å
169	R	85.3	Confident	86.6	Confident	157 Å²	157	121.4 Å²	121.4	59%	0.592	59%	0.592	S	S	*	*	H	α-helix	trans	-66.1	-38.7	176.7	-74.8	171.6	-179.9	-171.5	-0.6	112.2	K165 Q166 R167 Q172 R173	K165-R169 VanDerWaalsContact O-CG 3.24Å; K165-R169 WeakPolarHBondContact O-CG 3.34Å; K165-R169 PolarHBondContact O-N 2.92Å; Q166-R169 WeakPolarHBondContact O-CA 3.09Å; Q166-R169 WeakPolarHBondContact O-CB 3.46Å; Q166-R169 PolarHBondContact O-N 3.48Å; R167-R169 PolarHBondContact O-N 2.85Å; R169-Q172 PolarHBondContact O-N 3.19Å; R169-R173 WeakPolarHBondContact O-CG 3.1Å; R169-R173 PolarHBondContact O-N 3.44Å
170	D	88.3	Confident	86.1	Confident	89 Å²	89	122.4 Å²	122.4	48%	0.476	60%	0.595	S	S	.	*	H	α-helix	trans	-69.2	-39.3	178.2	-66.3	-23	0	0	0	111.3	Q166 R167 Q172 R173 A174	Q166-D170 PolarHBondContact O-N 2.91Å; R167-D170 PolarHBondContact O-N 3.36Å; D170-Q172 VanDerWaalsContact C-N 3.34Å; D170-Q172 PolarHBondContact O-N 3.04Å; D170-R173 PolarHBondContact O-N 3.09Å; D170-A174 WeakPolarHBondContact O-CB 3.33Å; D170-A174 PolarHBondContact O-N 3.3Å
171	I	87	Confident	85.8	Confident	81 Å²	81	121.6 Å²	121.6	42%	0.415	59%	0.591	S	S	.	*	H	α-helix	trans	-62.1	-40.7	171.3	-66.8	164.9	0	0	0	111.1	R167 I168 A174 R175	R167-I171 HydrophobicContact CG-CD1 4.21Å; R167-I171 VanDerWaalsContact O-CG1 3.25Å; R167-I171 WeakPolarHBondContact O-CG1 3.28Å; R167-I171 PolarHBondContact O-N 3.19Å; I168-I171 PolarHBondContact O-N 2.88Å; I171-A174 PolarHBondContact O-N 2.85Å; I171-R175 WeakPolarHBondContact O-CG 3.49Å; I171-R175 PolarHBondContact O-N 3.25Å; I171-R175 VanDerWaalsContact O-N 3.13Å
172	Q	87.4	Confident	85.5	Confident	111 Å²	111	127.1 Å²	127.1	52%	0.519	61%	0.61	S	S	.	*	H	α-helix	trans	-68	-36.1	177	-75.3	178.3	-2.5	0	0	113	I168 R169 D170 R175 R176	I168-Q172 WeakPolarHBondContact O-CG 3.31Å; I168-Q172 PolarHBondContact O-N 3.4Å; R169-Q172 PolarHBondContact O-N 3.19Å; D170-Q172 VanDerWaalsContact C-N 3.34Å; D170-Q172 PolarHBondContact O-N 3.04Å; Q172-R175 PolarHBondContact O-N 2.92Å; Q172-R176 PolarHBondContact O-N 2.85Å
173	R	86.2	Confident	85.1	Confident	185 Å²	185	125.6 Å²	125.6	70%	0.698	61%	0.613	S	S	*	*	H	α-helix	trans	-67.3	-43.2	174.3	-75.2	173.3	174.9	-178.2	-4.9	111.4	R169 D170 R175 R176 G177	R169-R173 WeakPolarHBondContact O-CG 3.1Å; R169-R173 PolarHBondContact O-N 3.44Å; D170-R173 PolarHBondContact O-N 3.09Å; R173-R175 PolarHBondContact O-N 3.28Å; R173-R176 PolarHBondContact O-N 3.49Å; R173-R176 VanDerWaalsContact O-N 3.11Å; R173-G177 PolarHBondContact O-N 2.75Å
174	A	85.3	Confident	84.7	Confident	75 Å²	75	130.9 Å²	130.9	62%	0.62	63%	0.626	S	S	*	*	H	α-helix	trans	-65.3	-23.1	176.3	0	0	0	0	0	113.7	D170 I171	D170-A174 WeakPolarHBondContact O-CB 3.33Å; D170-A174 PolarHBondContact O-N 3.3Å; I171-A174 PolarHBondContact O-N 2.85Å
175	R	83.5	Confident	84.5	Confident	213 Å²	213	134.1 Å²	134.1	80%	0.804	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-12.1	173.5	-75.4	-177	179	-173.2	0.2	114.4	I171 Q172 R173	I171-R175 WeakPolarHBondContact O-CG 3.49Å; I171-R175 PolarHBondContact O-N 3.25Å; I171-R175 VanDerWaalsContact O-N 3.13Å; Q172-R175 PolarHBondContact O-N 2.92Å; R173-R175 PolarHBondContact O-N 3.28Å
176	R	78.7	Confident	84.3	Confident	228 Å²	228	133.4 Å²	133.4	86%	0.86	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	-12.6	-175	-75.5	-174	178.3	-171.7	0.4	114.3	Q172 R173	Q172-R176 PolarHBondContact O-N 2.85Å; R173-R176 PolarHBondContact O-N 3.49Å; R173-R176 VanDerWaalsContact O-N 3.11Å
177	G	69.9	Low	84.1	Confident	123 Å²	123	136.2 Å²	136.2	100%	1.268	66%	0.659	S	S	*	*			trans	-100	0	168.6	0	0	0	0	0	110.2	R173	R173-G177 PolarHBondContact O-N 2.75Å

Retrieved 177 of 177 residues in 362.7 ms (Link to these results)

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