A0A075XDP0_HUMAN Loading...

NADH-ubiquinone oxidoreductase chain 1

AlphaFold DB , UniProt , Accession A0A075XDP0, Species HUMAN (Homo sapiens, Human), Gene ND1, Length 191 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	65.8	Low	89.5	Confident	192 Å²	192	92.6 Å²	92.6	95%	0.946	51%	0.509	S	S	*	.				0	75.8	0	-69.7	-64.1	-170.7	0	0	109.9	M3 A4 N5	M1-M3 VanDerWaalsContact C-N 3.33Å; M1-M3 PolarHBondContact O-N 3.33Å; M1-A4 HydrophobicContact CB-CB 3.84Å; M1-A4 PolarHBondContact O-N 3.42Å; M1-N5 PolarHBondContact O-N 3.42Å
2	P	82.9	Confident	90	Very high	113 Å²	113	90.7 Å²	90.7	73%	0.734	50%	0.504	S	S	*	.	H	α-helix	trans	-64.4	-36.7	-175.5	26.1	-33.7	0	0	0	112.6	A4 N5 L6	P2-A4 VanDerWaalsContact C-N 3.34Å; P2-A4 PolarHBondContact O-N 3.49Å; P2-N5 PolarHBondContact O-N 3.34Å; P2-L6 PolarHBondContact O-N 3.23Å
3	M	88.6	Confident	90.4	Very high	121 Å²	121	85.8 Å²	85.8	60%	0.596	48%	0.476	S	S	*	.	H	α-helix	trans	-64.8	-37	177.6	-170.9	61.5	-173.1	0	0	112.7	M1 L6 L7	M1-M3 VanDerWaalsContact C-N 3.33Å; M1-M3 PolarHBondContact O-N 3.33Å; M3-L6 HydrophobicContact CE-CD2 4.48Å; M3-L6 PolarHBondContact O-N 3.3Å; M3-L6 HydrophobicContact SD-CD2 4.39Å; M3-L7 HydrophobicContact CE-CD1 4.38Å; M3-L7 HydrophobicContact CE-CD2 4.39Å; M3-L7 HydrophobicContact CE-CG 4.25Å; M3-L7 WeakPolarHBondContact O-CG 3.36Å; M3-L7 PolarHBondContact O-N 2.67Å
4	A	92.4	Very high	90.7	Very high	51 Å²	51	85.3 Å²	85.3	42%	0.421	47%	0.472	S	S	.	.	H	α-helix	trans	-65.5	-42.5	176.9	0	0	0	0	0	111.4	M1 P2 L6 L7 L8	M1-A4 HydrophobicContact CB-CB 3.84Å; M1-A4 PolarHBondContact O-N 3.42Å; P2-A4 VanDerWaalsContact C-N 3.34Å; P2-A4 PolarHBondContact O-N 3.49Å; A4-L6 VanDerWaalsContact C-N 3.32Å; A4-L6 PolarHBondContact O-N 3.17Å; A4-L7 PolarHBondContact O-N 3.12Å; A4-L8 WeakPolarHBondContact O-CB 3.44Å; A4-L8 PolarHBondContact O-N 3.38Å
5	N	91.9	Very high	91	Very high	100 Å²	100	84.9 Å²	84.9	54%	0.535	47%	0.468	S	S	.	.	H	α-helix	trans	-62.7	-39.4	175.5	-73.9	7.9	0	0	0	111.9	M1 P2 L8 L9 L95	M1-N5 PolarHBondContact O-N 3.42Å; P2-N5 PolarHBondContact O-N 3.34Å; N5-L8 PolarHBondContact O-N 3.49Å; N5-L9 PolarHBondContact O-N 2.92Å; N5-L95 HydrophobicContact CB-CD1 3.8Å
6	L	92.1	Very high	91.3	Very high	63 Å²	63	83.3 Å²	83.3	33%	0.33	47%	0.468	S	S	.	.	H	α-helix	trans	-64.1	-43.5	177	-177.5	148.7	0	0	0	111.7	P2 M3 A4 L9 I10	P2-L6 PolarHBondContact O-N 3.23Å; M3-L6 HydrophobicContact CE-CD2 4.48Å; M3-L6 PolarHBondContact O-N 3.3Å; M3-L6 HydrophobicContact SD-CD2 4.39Å; A4-L6 VanDerWaalsContact C-N 3.32Å; A4-L6 PolarHBondContact O-N 3.17Å; L6-L9 PolarHBondContact O-N 3.41Å; L6-I10 HydrophobicContact CD2-CD1 3.41Å; L6-I10 VanDerWaalsContact CD2-CD1 3.41Å; L6-I10 HydrophobicContact CD2-CG1 4.36Å; L6-I10 HydrophobicContact CG-CD1 3.95Å; L6-I10 WeakPolarHBondContact O-CG1 3.47Å; L6-I10 PolarHBondContact O-N 3.3Å
7	L	93.1	Very high	91.5	Very high	89 Å²	89	85.5 Å²	85.5	47%	0.466	48%	0.476	S	S	.	.	H	α-helix	trans	-64.7	-41	175.1	-72.4	169.9	0	0	0	111.9	M3 A4 L9 I10 V11	M3-L7 HydrophobicContact CE-CD1 4.38Å; M3-L7 HydrophobicContact CE-CD2 4.39Å; M3-L7 HydrophobicContact CE-CG 4.25Å; M3-L7 WeakPolarHBondContact O-CG 3.36Å; M3-L7 PolarHBondContact O-N 2.67Å; A4-L7 PolarHBondContact O-N 3.12Å; L7-L9 PolarHBondContact O-N 3.06Å; L7-I10 PolarHBondContact O-N 3.3Å; L7-V11 WeakPolarHBondContact O-CB 3.19Å; L7-V11 WeakPolarHBondContact O-CG2 3.47Å; L7-V11 PolarHBondContact O-N 3.36Å
8	L	94.1	Very high	91.6	Very high	135 Å²	135	82.6 Å²	82.6	71%	0.707	47%	0.465	S	S	*	.	H	α-helix	trans	-65.3	-23.2	176.1	-159	96.5	0	0	0	112.5	A4 N5 P12	A4-L8 WeakPolarHBondContact O-CB 3.44Å; A4-L8 PolarHBondContact O-N 3.38Å; N5-L8 PolarHBondContact O-N 3.49Å; L8-P12 WeakPolarHBondContact O-CD 3.36Å; L8-P12 WeakPolarHBondContact O-CG 3.14Å
9	L	93.4	Very high	91.8	Very high	36 Å²	36	81.7 Å²	81.7	19%	0.188	46%	0.455	C	S	.	.	H	α-helix	trans	-80.4	-53.8	172.2	-176.6	70.3	0	0	0	111	N5 L6 L7 P12 I13 W86 L95	N5-L9 PolarHBondContact O-N 2.92Å; L6-L9 PolarHBondContact O-N 3.41Å; L7-L9 PolarHBondContact O-N 3.06Å; L9-P12 WeakPolarHBondContact O-CD 3.4Å; L9-I13 HydrophobicContact CD1-CD1 3.92Å; L9-I13 HydrophobicContact CG-CD1 3.73Å; L9-I13 VanDerWaalsContact O-CD1 3.23Å; L9-I13 WeakPolarHBondContact O-CD1 3.44Å; L9-I13 WeakPolarHBondContact O-CG1 3.45Å; L9-I13 PolarHBondContact O-N 3.06Å; L9-W86 HydrophobicContact CD2-CB 4.41Å; L9-L95 HydrophobicContact CD2-CB 4.25Å; L9-L95 HydrophobicContact CD2-CD2 3.96Å; L9-L95 HydrophobicContact CD2-CG 4.46Å
10	I	94.4	Very high	91.9	Very high	44 Å²	44	82.7 Å²	82.7	23%	0.226	46%	0.459	C	S	.	.	H	α-helix	trans	-69	-43.3	-170.1	-65.6	175.6	0	0	0	112.3	L6 L7 I13 L14 L83	L6-I10 HydrophobicContact CD2-CD1 3.41Å; L6-I10 VanDerWaalsContact CD2-CD1 3.41Å; L6-I10 HydrophobicContact CD2-CG1 4.36Å; L6-I10 HydrophobicContact CG-CD1 3.95Å; L6-I10 WeakPolarHBondContact O-CG1 3.47Å; L6-I10 PolarHBondContact O-N 3.3Å; L7-I10 PolarHBondContact O-N 3.3Å; I10-I13 PolarHBondContact O-N 3.06Å; I10-L14 HydrophobicContact CG2-CD1 4.04Å; I10-L14 HydrophobicContact CG2-CG 4.36Å; I10-L14 PolarHBondContact O-N 3.42Å; I10-L14 VanDerWaalsContact O-N 3.08Å; I10-L83 HydrophobicContact CG2-CD1 4.19Å; I10-L83 HydrophobicContact CG2-CD2 4.07Å
11	V	95.4	Very high	92	Very high	75 Å²	75	82.8 Å²	82.8	46%	0.455	46%	0.457	S	S	.	.	H	α-helix	trans	-62.5	-49.6	-174.5	172.3	0	0	0	0	111.5	L7 I13 L14 I15	L7-V11 WeakPolarHBondContact O-CB 3.19Å; L7-V11 WeakPolarHBondContact O-CG2 3.47Å; L7-V11 PolarHBondContact O-N 3.36Å; V11-I13 VanDerWaalsContact C-N 3.32Å; V11-I13 PolarHBondContact O-N 2.72Å; V11-L14 PolarHBondContact O-N 3.4Å; V11-I15 HydrophobicContact CG1-CD1 3.83Å; V11-I15 WeakPolarHBondContact O-CG1 3.44Å; V11-I15 PolarHBondContact O-N 3.41Å; V11-I15 VanDerWaalsContact O-N 3.13Å
12	P	95.4	Very high	93.4	Very high	69 Å²	69	74.1 Å²	74.1	45%	0.448	42%	0.415	S	S	.	.	H	α-helix	trans	-62	-34.9	174.6	-26.9	38.7	0	0	0	113.9	L8 L9 I15 A16	L8-P12 WeakPolarHBondContact O-CD 3.36Å; L8-P12 WeakPolarHBondContact O-CG 3.14Å; L9-P12 WeakPolarHBondContact O-CD 3.4Å; P12-I15 PolarHBondContact O-N 3.34Å; P12-A16 VanDerWaalsContact O-CB 3.25Å; P12-A16 WeakPolarHBondContact O-CB 3.37Å; P12-A16 PolarHBondContact O-N 3.45Å
13	I	95.5	Very high	94	Very high	27 Å²	27	71.8 Å²	71.8	14%	0.138	40%	0.399	C	S	.	.	H	α-helix	trans	-61.7	-45.6	177.1	-69	164.5	0	0	0	110.8	L9 I10 V11 I15 A16 M17 L83 W86	L9-I13 HydrophobicContact CD1-CD1 3.92Å; L9-I13 HydrophobicContact CG-CD1 3.73Å; L9-I13 VanDerWaalsContact O-CD1 3.23Å; L9-I13 WeakPolarHBondContact O-CD1 3.44Å; L9-I13 WeakPolarHBondContact O-CG1 3.45Å; L9-I13 PolarHBondContact O-N 3.06Å; I10-I13 PolarHBondContact O-N 3.06Å; V11-I13 VanDerWaalsContact C-N 3.32Å; V11-I13 PolarHBondContact O-N 2.72Å; I13-I15 VanDerWaalsContact C-N 3.35Å; I13-I15 PolarHBondContact O-N 3.03Å; I13-A16 PolarHBondContact O-N 3.45Å; I13-M17 WeakPolarHBondContact O-CB 3.01Å; I13-M17 PolarHBondContact O-N 3.35Å; I13-L83 HydrophobicContact CG2-CD2 4.43Å; I13-W86 HydrophobicContact CD1-CB 3.78Å; I13-W86 HydrophobicContact CD1-CD2 3.75Å; I13-W86 HydrophobicContact CD1-CE3 4.14Å; I13-W86 HydrophobicContact CD1-CG 3.57Å; I13-W86 HydrophobicContact CG1-CD2 4.27Å; I13-W86 HydrophobicContact CG1-CE3 4.45Å
14	L	94.4	Very high	94.3	Very high	79 Å²	79	70.3 Å²	70.3	41%	0.414	39%	0.39	S	S	.	.	H	α-helix	trans	-64.7	-39.7	178.1	-67.8	175.6	0	0	0	112	I10 V11 M17 A18	I10-L14 HydrophobicContact CG2-CD1 4.04Å; I10-L14 HydrophobicContact CG2-CG 4.36Å; I10-L14 PolarHBondContact O-N 3.42Å; I10-L14 VanDerWaalsContact O-N 3.08Å; V11-L14 PolarHBondContact O-N 3.4Å; L14-M17 PolarHBondContact O-N 3.07Å; L14-A18 PolarHBondContact O-N 3.03Å; L14-A18 VanDerWaalsContact O-N 3.07Å
15	I	94.9	Very high	94.5	Very high	80 Å²	80	72.7 Å²	72.7	41%	0.41	39%	0.388	S	S	.	.	H	α-helix	trans	-65.2	-44.5	175.4	-65	167.6	0	0	0	110.3	V11 P12 I13 M17 A18 F19	V11-I15 HydrophobicContact CG1-CD1 3.83Å; V11-I15 WeakPolarHBondContact O-CG1 3.44Å; V11-I15 PolarHBondContact O-N 3.41Å; V11-I15 VanDerWaalsContact O-N 3.13Å; P12-I15 PolarHBondContact O-N 3.34Å; I13-I15 VanDerWaalsContact C-N 3.35Å; I13-I15 PolarHBondContact O-N 3.03Å; I15-M17 VanDerWaalsContact C-N 3.34Å; I15-M17 PolarHBondContact O-N 3.33Å; I15-A18 WeakPolarHBondContact O-CB 3.14Å; I15-A18 PolarHBondContact O-N 3.4Å; I15-F19 HydrophobicContact CG2-CD2 3.78Å; I15-F19 HydrophobicContact CG2-CE2 3.73Å; I15-F19 VanDerWaalsContact O-CD2 3.31Å; I15-F19 WeakPolarHBondContact O-CD2 3.34Å; I15-F19 PolarHBondContact O-N 2.92Å
16	A	95.6	Very high	94.5	Very high	58 Å²	58	69.7 Å²	69.7	48%	0.479	37%	0.37	S	S	.	.	H	α-helix	trans	-61	-42.8	177.5	0	0	0	0	0	111.3	P12 I13 A18 F19 L20	P12-A16 VanDerWaalsContact O-CB 3.25Å; P12-A16 WeakPolarHBondContact O-CB 3.37Å; P12-A16 PolarHBondContact O-N 3.45Å; I13-A16 PolarHBondContact O-N 3.45Å; A16-A18 VanDerWaalsContact C-N 3.33Å; A16-A18 PolarHBondContact O-N 2.97Å; A16-F19 PolarHBondContact O-N 3.32Å; A16-L20 WeakPolarHBondContact O-CB 3.23Å; A16-L20 PolarHBondContact O-N 3.36Å
17	M	94.9	Very high	94.8	Very high	122 Å²	122	71 Å²	71	60%	0.601	38%	0.377	S	S	*	.	H	α-helix	trans	-60.4	-41.4	174.8	-174.8	177.9	177.1	0	0	112	I13 L14 I15 L20 M21	I13-M17 WeakPolarHBondContact O-CB 3.01Å; I13-M17 PolarHBondContact O-N 3.35Å; L14-M17 PolarHBondContact O-N 3.07Å; I15-M17 VanDerWaalsContact C-N 3.34Å; I15-M17 PolarHBondContact O-N 3.33Å; M17-L20 WeakPolarHBondContact O-CB 3.19Å; M17-L20 PolarHBondContact O-N 3.14Å; M17-M21 PolarHBondContact O-N 3.32Å
18	A	93.2	Very high	94.9	Very high	33 Å²	33	70.2 Å²	70.2	27%	0.273	37%	0.373	S	S	.	.	H	α-helix	trans	-63	-43.6	176.7	0	0	0	0	0	112.1	L14 I15 A16 P48	L14-A18 PolarHBondContact O-N 3.03Å; L14-A18 VanDerWaalsContact O-N 3.07Å; I15-A18 WeakPolarHBondContact O-CB 3.14Å; I15-A18 PolarHBondContact O-N 3.4Å; A16-A18 VanDerWaalsContact C-N 3.33Å; A16-A18 PolarHBondContact O-N 2.97Å; A18-P48 HydrophobicContact CB-CB 3.91Å; A18-P48 WeakPolarHBondContact O-CB 3.45Å; A18-P48 WeakPolarHBondContact O-CG 3.35Å
19	F	95.1	Very high	95	Very high	65 Å²	65	63.8 Å²	63.8	29%	0.285	34%	0.339	S	S	.	.	H	α-helix	trans	-72.6	-29.4	176.7	-78.3	-70.8	0	0	0	113.3	I15 A16 M21 L22 T23 L45 P48 F49	I15-F19 HydrophobicContact CG2-CD2 3.78Å; I15-F19 HydrophobicContact CG2-CE2 3.73Å; I15-F19 VanDerWaalsContact O-CD2 3.31Å; I15-F19 WeakPolarHBondContact O-CD2 3.34Å; I15-F19 PolarHBondContact O-N 2.92Å; A16-F19 PolarHBondContact O-N 3.32Å; F19-M21 VanDerWaalsContact C-N 3.26Å; F19-M21 PolarHBondContact O-N 3.49Å; F19-L22 WeakPolarHBondContact O-CB 3.38Å; F19-L22 PolarHBondContact O-N 3.16Å; F19-T23 WeakPolarHBondContact O-CG2 3.39Å; F19-T23 PolarHBondContact O-N 3.22Å; F19-T23 PolarHBondContact O-OG1 2.96Å; F19-L45 HydrophobicContact CE1-CD2 4.1Å; F19-P48 HydrophobicContact CD1-CG 4.31Å; F19-F49 HydrophobicContact CE2-CE2 4.5Å; F19-F49 HydrophobicContact CZ-CE2 4.04Å
20	L	95.4	Very high	95.1	Very high	102 Å²	102	68.6 Å²	68.6	53%	0.534	36%	0.356	S	S	.	.	H	α-helix	trans	-55.4	-44	174.6	-174.6	139.4	0	0	0	110.6	A16 M17 L22 T23 E24	A16-L20 WeakPolarHBondContact O-CB 3.23Å; A16-L20 PolarHBondContact O-N 3.36Å; M17-L20 WeakPolarHBondContact O-CB 3.19Å; M17-L20 PolarHBondContact O-N 3.14Å; L20-L22 VanDerWaalsContact C-N 3.31Å; L20-L22 PolarHBondContact O-N 3.24Å; L20-T23 WeakPolarHBondContact CA-OG1 3.48Å; L20-T23 PolarHBondContact O-N 3.4Å; L20-T23 VanDerWaalsContact O-N 3.15Å; L20-T23 PolarHBondContact O-OG1 3.25Å; L20-E24 WeakPolarHBondContact O-CB 3.25Å; L20-E24 PolarHBondContact O-N 3.24Å
21	M	94	Very high	95.2	Very high	84 Å²	84	73.2 Å²	73.2	41%	0.414	38%	0.378	S	S	.	.	H	α-helix	trans	-59	-38.2	175.4	-59.5	-54.6	-58.1	0	0	113.4	M17 F19 R25	M17-M21 PolarHBondContact O-N 3.32Å; F19-M21 VanDerWaalsContact C-N 3.26Å; F19-M21 PolarHBondContact O-N 3.49Å; M21-R25 WeakPolarHBondContact O-CG 3.48Å; M21-R25 PolarHBondContact O-N 3.45Å
22	L	94.5	Very high	95.3	Very high	10 Å²	10	75 Å²	75	5%	0.052	38%	0.381	C	S	.	.	H	α-helix	trans	-69.9	-44.2	175.7	171.5	147	0	0	0	111.4	F19 L20 E24 R25 K26 G44 Q47 P48	F19-L22 WeakPolarHBondContact O-CB 3.38Å; F19-L22 PolarHBondContact O-N 3.16Å; L20-L22 VanDerWaalsContact C-N 3.31Å; L20-L22 PolarHBondContact O-N 3.24Å; L22-E24 VanDerWaalsContact C-N 3.32Å; L22-E24 PolarHBondContact O-N 3.13Å; L22-R25 PolarHBondContact O-N 3.11Å; L22-K26 HydrophobicContact CD2-CD 3.99Å; L22-K26 PolarHBondContact O-N 3.33Å; L22-G44 WeakPolarHBondContact CD1-O 3.42Å; L22-Q47 HydrophobicContact CD1-CB 4.18Å; L22-P48 HydrophobicContact CB-CG 3.84Å; L22-P48 HydrophobicContact CD1-CG 4.17Å
23	T	95.1	Very high	95.3	Very high	65 Å²	65	79.9 Å²	79.9	40%	0.399	40%	0.403	S	S	.	.	H	α-helix	trans	-62.9	-41.8	179.5	58.7	0	0	0	0	111	F19 L20 K26 I27	F19-T23 WeakPolarHBondContact O-CG2 3.39Å; F19-T23 PolarHBondContact O-N 3.22Å; F19-T23 PolarHBondContact O-OG1 2.96Å; L20-T23 WeakPolarHBondContact CA-OG1 3.48Å; L20-T23 PolarHBondContact O-N 3.4Å; L20-T23 VanDerWaalsContact O-N 3.15Å; L20-T23 PolarHBondContact O-OG1 3.25Å; T23-K26 PolarHBondContact O-N 3.38Å; T23-I27 WeakPolarHBondContact O-CB 3.43Å; T23-I27 VanDerWaalsContact O-CG1 3.26Å; T23-I27 WeakPolarHBondContact O-CG1 3.31Å; T23-I27 PolarHBondContact O-N 3.23Å
24	E	95.9	Very high	95.3	Very high	90 Å²	90	86.2 Å²	86.2	42%	0.421	43%	0.425	S	S	.	.	H	α-helix	trans	-56.8	-53.2	175	-172.1	-166.4	163.8	0	0	111	L20 L22 K26 I27 L28	L20-E24 WeakPolarHBondContact O-CB 3.25Å; L20-E24 PolarHBondContact O-N 3.24Å; L22-E24 VanDerWaalsContact C-N 3.32Å; L22-E24 PolarHBondContact O-N 3.13Å; E24-K26 VanDerWaalsContact C-N 3.27Å; E24-K26 PolarHBondContact O-N 2.79Å; E24-I27 PolarHBondContact O-N 3.48Å; E24-L28 HydrophobicContact CG-CD1 3.89Å; E24-L28 HydrophobicContact CG-CG 4.46Å; E24-L28 WeakPolarHBondContact O-CB 3.26Å; E24-L28 WeakPolarHBondContact O-CG 3.44Å; E24-L28 PolarHBondContact O-N 2.78Å
25	R	95.1	Very high	95.1	Very high	101 Å²	101	90.4 Å²	90.4	38%	0.381	44%	0.44	S	S	.	.	H	α-helix	trans	-60.1	-35.6	178.8	-71.3	179.9	-175.1	169.8	10.3	113	M21 L22 G29 P37 D51	M21-R25 WeakPolarHBondContact O-CG 3.48Å; M21-R25 PolarHBondContact O-N 3.45Å; L22-R25 PolarHBondContact O-N 3.11Å; R25-G29 PolarHBondContact O-N 2.79Å; R25-P37 HydrophobicContact CB-CG 4.02Å; R25-D51 IonicContact CZ-OD2 3.24Å; R25-D51 VanDerWaalsContact CZ-OD2 3.24Å; R25-D51 IonicContact NH1-OD2 2.74Å; R25-D51 PolarHBondContact NH1-OD2 3.31Å; R25-D51 IonicContact NH2-OD2 2.88Å; R25-D51 PolarHBondContact NH2-OD2 3.27Å
26	K	93.8	Very high	95	Very high	36 Å²	36	87.2 Å²	87.2	16%	0.157	43%	0.427	C	S	.	.	H	α-helix	trans	-71.6	-50.8	177.1	-79	-171	173.7	-175.8	0	111.9	L22 T23 E24 L28 G29 Y30 P37 Y43	L22-K26 HydrophobicContact CD2-CD 3.99Å; L22-K26 PolarHBondContact O-N 3.33Å; T23-K26 PolarHBondContact O-N 3.38Å; E24-K26 VanDerWaalsContact C-N 3.27Å; E24-K26 PolarHBondContact O-N 2.79Å; K26-L28 VanDerWaalsContact C-N 3.35Å; K26-L28 PolarHBondContact O-N 3.31Å; K26-G29 WeakPolarHBondContact O-CA 3.48Å; K26-G29 PolarHBondContact O-N 3.11Å; K26-G29 VanDerWaalsContact O-N 3.12Å; K26-Y30 HydrophobicContact CB-CD2 4.49Å; K26-Y30 HydrophobicContact CB-CE2 4.3Å; K26-Y30 WeakPolarHBondContact O-CD2 3.08Å; K26-Y30 PolarHBondContact O-N 3.21Å; K26-P37 WeakPolarHBondContact CE-O 3.13Å; K26-Y43 WeakPolarHBondContact CE-O 3.33Å; K26-Y43 PolarHBondContact NZ-O 2.77Å
27	I	96.7	Very high	94.8	Very high	92 Å²	92	85.9 Å²	85.9	47%	0.472	41%	0.414	S	S	.	.	H	α-helix	trans	-59.8	-47.7	-179.3	-67.3	166.1	0	0	0	109.8	T23 E24 G29 Y30 M31	T23-I27 WeakPolarHBondContact O-CB 3.43Å; T23-I27 VanDerWaalsContact O-CG1 3.26Å; T23-I27 WeakPolarHBondContact O-CG1 3.31Å; T23-I27 PolarHBondContact O-N 3.23Å; E24-I27 PolarHBondContact O-N 3.48Å; I27-G29 VanDerWaalsContact C-N 3.31Å; I27-G29 PolarHBondContact O-N 3.35Å; I27-Y30 PolarHBondContact O-N 3.17Å; I27-M31 HydrophobicContact CG2-CE 3.57Å; I27-M31 HydrophobicContact CG2-CG 4.47Å; I27-M31 HydrophobicContact CG2-SD 4.01Å; I27-M31 WeakPolarHBondContact O-CG 3.49Å; I27-M31 PolarHBondContact O-N 3.31Å
28	L	96.1	Very high	94.6	Very high	71 Å²	71	82.5 Å²	82.5	37%	0.372	40%	0.398	S	S	.	.	H	α-helix	trans	-61.7	-38.5	175.1	-70.6	175.6	0	0	0	112.3	E24 K26 M31 Q32	E24-L28 HydrophobicContact CG-CD1 3.89Å; E24-L28 HydrophobicContact CG-CG 4.46Å; E24-L28 WeakPolarHBondContact O-CB 3.26Å; E24-L28 WeakPolarHBondContact O-CG 3.44Å; E24-L28 PolarHBondContact O-N 2.78Å; K26-L28 VanDerWaalsContact C-N 3.35Å; K26-L28 PolarHBondContact O-N 3.31Å; L28-M31 PolarHBondContact O-N 3.02Å; L28-Q32 VanDerWaalsContact O-CB 3.31Å; L28-Q32 WeakPolarHBondContact O-CB 3.42Å; L28-Q32 WeakPolarHBondContact O-CG 3.39Å; L28-Q32 PolarHBondContact O-N 3.31Å
29	G	95.6	Very high	94.5	Very high	1 Å²	1	87.6 Å²	87.6	1%	0.01	43%	0.426	C	S	.	.	H	α-helix	trans	-57.2	-53.4	173.4	0	0	0	0	0	111.4	R25 K26 I27 M31 Q32 L33 R34	R25-G29 PolarHBondContact O-N 2.79Å; K26-G29 WeakPolarHBondContact O-CA 3.48Å; K26-G29 PolarHBondContact O-N 3.11Å; K26-G29 VanDerWaalsContact O-N 3.12Å; I27-G29 VanDerWaalsContact C-N 3.31Å; I27-G29 PolarHBondContact O-N 3.35Å; G29-M31 PolarHBondContact O-N 3.11Å; G29-Q32 CarbonylContact O-C 3.51Å; G29-Q32 WeakPolarHBondContact O-CA 3.49Å; G29-Q32 PolarHBondContact O-N 3.05Å; G29-L33 PolarHBondContact O-N 3Å; G29-R34 CarbonylContact C-O 2.86Å; G29-R34 WeakPolarHBondContact CA-O 3.01Å; G29-R34 CarbonylContact O-C 3.54Å; G29-R34 WeakPolarHBondContact O-CG 3.44Å; G29-R34 PolarHBondContact O-N 2.94Å
30	Y	95.8	Very high	94.1	Very high	136 Å²	136	87.1 Å²	87.1	53%	0.533	43%	0.428	S	S	.	.	H	α-helix	trans	-63.6	-40.1	-179	-71.9	-64.5	0	0	0	112.7	K26 I27 Q32 L33 R34	K26-Y30 HydrophobicContact CB-CD2 4.49Å; K26-Y30 HydrophobicContact CB-CE2 4.3Å; K26-Y30 WeakPolarHBondContact O-CD2 3.08Å; K26-Y30 PolarHBondContact O-N 3.21Å; I27-Y30 PolarHBondContact O-N 3.17Å; Y30-Q32 PolarHBondContact O-N 2.87Å; Y30-L33 PolarHBondContact O-N 3Å; Y30-L33 VanDerWaalsContact O-N 3.11Å; Y30-R34 PolarHBondContact N-O 3.27Å
31	M	97.6	Very high	93.9	Very high	142 Å²	142	83.6 Å²	83.6	70%	0.7	42%	0.416	S	S	*	.	H	α-helix	trans	-60	-33.4	172.7	-71.8	175.1	173.6	0	0	112.2	I27 L28 G29 L33	I27-M31 HydrophobicContact CG2-CE 3.57Å; I27-M31 HydrophobicContact CG2-CG 4.47Å; I27-M31 HydrophobicContact CG2-SD 4.01Å; I27-M31 WeakPolarHBondContact O-CG 3.49Å; I27-M31 PolarHBondContact O-N 3.31Å; L28-M31 PolarHBondContact O-N 3.02Å; G29-M31 PolarHBondContact O-N 3.11Å; M31-L33 VanDerWaalsContact C-N 3.32Å
32	Q	96.8	Very high	93.7	Very high	111 Å²	111	83.8 Å²	83.8	52%	0.519	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	13.7	177.8	-67.2	170.9	-2.3	0	0	113.5	L28 G29 Y30 R34	L28-Q32 VanDerWaalsContact O-CB 3.31Å; L28-Q32 WeakPolarHBondContact O-CB 3.42Å; L28-Q32 WeakPolarHBondContact O-CG 3.39Å; L28-Q32 PolarHBondContact O-N 3.31Å; G29-Q32 CarbonylContact O-C 3.51Å; G29-Q32 WeakPolarHBondContact O-CA 3.49Å; G29-Q32 PolarHBondContact O-N 3.05Å; Y30-Q32 PolarHBondContact O-N 2.87Å; Q32-R34 HydrophobicContact CB-CG 4.16Å; Q32-R34 PolarHBondContact O-N 3.17Å; Q32-R34 VanDerWaalsContact O-N 3.16Å
33	L	96	Very high	93.5	Very high	173 Å²	173	91.9 Å²	91.9	91%	0.906	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	28.2	-177.4	-60.9	171	0	0	0	114.3	G29 Y30 M31	G29-L33 PolarHBondContact O-N 3Å; Y30-L33 PolarHBondContact O-N 3Å; Y30-L33 VanDerWaalsContact O-N 3.11Å; M31-L33 VanDerWaalsContact C-N 3.32Å
34	R	95.1	Very high	93.2	Very high	159 Å²	159	88.8 Å²	88.8	60%	0.6	44%	0.436	S	S	*	.	S	Bend	trans	-124.6	162.9	173.2	65.7	178.2	178.7	137.3	-1.2	111.4	G29 Y30 Q32	G29-R34 CarbonylContact C-O 2.86Å; G29-R34 WeakPolarHBondContact CA-O 3.01Å; G29-R34 CarbonylContact O-C 3.54Å; G29-R34 WeakPolarHBondContact O-CG 3.44Å; G29-R34 PolarHBondContact O-N 2.94Å; Y30-R34 PolarHBondContact N-O 3.27Å; Q32-R34 HydrophobicContact CB-CG 4.16Å; Q32-R34 PolarHBondContact O-N 3.17Å; Q32-R34 VanDerWaalsContact O-N 3.16Å
35	K	90.6	Very high	93.1	Very high	167 Å²	167	88.5 Å²	88.5	73%	0.726	44%	0.437	S	S	*	.			trans	-81.5	139.3	174.5	-66.5	-179.9	-176.8	177.2	0	109.9
36	G	93.1	Very high	93	Very high	14 Å²	14	88.1 Å²	88.1	14%	0.144	44%	0.442	C	S	.	.			trans	-71.5	-172.8	165.7	0	0	0	0	0	112.5	N38	G36-N38 PolarHBondContact O-N 2.65Å; G36-N38 VanDerWaalsContact O-N 3.09Å
37	P	90.7	Very high	93	Very high	29 Å²	29	87.9 Å²	87.9	19%	0.188	44%	0.441	C	S	.	.	S	Bend	trans	-58.5	115.4	177.6	-20	31.4	0	0	0	110.8	R25 K26 G44 Q47	R25-P37 HydrophobicContact CB-CG 4.02Å; K26-P37 WeakPolarHBondContact CE-O 3.13Å; P37-G44 WeakPolarHBondContact O-CA 3.28Å; P37-Q47 HydrophobicContact CB-CB 4.45Å; P37-Q47 HydrophobicContact CB-CG 4.09Å; P37-Q47 HydrophobicContact CG-CG 4.47Å
38	N	91.2	Very high	92.8	Very high	52 Å²	52	84.1 Å²	84.1	28%	0.278	42%	0.423	S	S	.	.			trans	-128.9	-3.7	-178.6	-76.6	-13.6	0	0	0	113.5	G36	G36-N38 PolarHBondContact O-N 2.65Å; G36-N38 VanDerWaalsContact O-N 3.09Å
39	V	89.5	Confident	92.6	Very high	140 Å²	140	86.2 Å²	86.2	85%	0.848	43%	0.429	S	S	*	.	S	Bend	trans	-92.8	-40.9	-172.7	-177.9	0	0	0	0	112.5	G41	V39-G41 PolarHBondContact O-N 3.05Å
40	V	88.6	Confident	92.5	Very high	54 Å²	54	88.1 Å²	88.1	33%	0.327	45%	0.445	S	S	.	.	S	Bend	trans	-78.5	90.1	-177.8	-176.2	0	0	0	0	110	G44 L46 Q47 A50	V40-G44 CarbonylContact O-C 3.17Å; V40-G44 WeakPolarHBondContact O-CA 3.18Å; V40-L46 HydrophobicContact CG1-CB 4.1Å; V40-L46 PolarHBondContact O-N 3.36Å; V40-Q47 HydrophobicContact CB-CB 4.47Å; V40-A50 HydrophobicContact CG1-CB 3.98Å
41	G	90.6	Very high	92.4	Very high	28 Å²	28	83.5 Å²	83.5	29%	0.289	43%	0.429	S	S	.	.	S	Bend	trans	80.6	176.2	-176	0	0	0	0	0	113.9	V39 Y43 G44	V39-G41 PolarHBondContact O-N 3.05Å; G41-Y43 PolarHBondContact O-N 2.63Å; G41-G44 PolarHBondContact O-N 3.18Å
42	P	89.6	Confident	92.2	Very high	89 Å²	89	78.7 Å²	78.7	58%	0.578	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-61	121.3	-179.3	25.7	-33.1	0	0	0	109.9	G44 L45	P42-G44 PolarHBondContact O-N 3.48Å; P42-L45 WeakPolarHBondContact O-CG 3.49Å; P42-L45 PolarHBondContact O-N 3.33Å; P42-L45 VanDerWaalsContact O-N 3.11Å
43	Y	89.3	Confident	92.1	Very high	179 Å²	179	79.9 Å²	79.9	70%	0.702	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	49.3	30.5	-173.3	-58.9	-81.3	0	0	0	113.7	K26 G41 L45	K26-Y43 WeakPolarHBondContact CE-O 3.33Å; K26-Y43 PolarHBondContact NZ-O 2.77Å; G41-Y43 PolarHBondContact O-N 2.63Å; Y43-L45 VanDerWaalsContact C-N 3.29Å; Y43-L45 PolarHBondContact O-N 3.48Å
44	G	90.1	Very high	92	Very high	0 Å²	0	78.4 Å²	78.4	0%	0	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	75.7	5.6	178.3	0	0	0	0	0	115.9	L22 P37 V40 G41 P42 L46 Q47	L22-G44 WeakPolarHBondContact CD1-O 3.42Å; P37-G44 WeakPolarHBondContact O-CA 3.28Å; V40-G44 CarbonylContact O-C 3.17Å; V40-G44 WeakPolarHBondContact O-CA 3.18Å; G41-G44 PolarHBondContact O-N 3.18Å; P42-G44 PolarHBondContact O-N 3.48Å; G44-L46 PolarHBondContact O-N 3.08Å; G44-Q47 WeakPolarHBondContact O-CB 3.48Å; G44-Q47 PolarHBondContact O-N 3.29Å
45	L	92.6	Very high	91.9	Very high	84 Å²	84	77 Å²	77	44%	0.44	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-26.4	-174.8	-76.4	170.8	0	0	0	114.3	F19 P42 Y43 Q47 P48	F19-L45 HydrophobicContact CE1-CD2 4.1Å; P42-L45 WeakPolarHBondContact O-CG 3.49Å; P42-L45 PolarHBondContact O-N 3.33Å; P42-L45 VanDerWaalsContact O-N 3.11Å; Y43-L45 VanDerWaalsContact C-N 3.29Å; Y43-L45 PolarHBondContact O-N 3.48Å; L45-Q47 VanDerWaalsContact C-N 3.33Å; L45-P48 WeakPolarHBondContact O-CD 3.48Å
46	L	94.1	Very high	92	Very high	93 Å²	93	77.9 Å²	77.9	49%	0.487	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-3.7	179.1	-63.9	175.9	0	0	0	113.3	V40 G44 F49 A50	V40-L46 HydrophobicContact CG1-CB 4.1Å; V40-L46 PolarHBondContact O-N 3.36Å; G44-L46 PolarHBondContact O-N 3.08Å; L46-F49 HydrophobicContact CD2-CD2 4.32Å; L46-F49 PolarHBondContact O-N 3.11Å; L46-A50 PolarHBondContact O-N 3.39Å; L46-A50 VanDerWaalsContact O-N 3.11Å
47	Q	92.6	Very high	92.2	Very high	32 Å²	32	82.2 Å²	82.2	15%	0.15	44%	0.437	C	S	.	.	H	α-helix	trans	-57.1	-45	-179.1	-172.8	73.5	44.2	0	0	113.7	L22 P37 V40 G44 L45 F49 A50 D51	L22-Q47 HydrophobicContact CD1-CB 4.18Å; P37-Q47 HydrophobicContact CB-CB 4.45Å; P37-Q47 HydrophobicContact CB-CG 4.09Å; P37-Q47 HydrophobicContact CG-CG 4.47Å; V40-Q47 HydrophobicContact CB-CB 4.47Å; G44-Q47 WeakPolarHBondContact O-CB 3.48Å; G44-Q47 PolarHBondContact O-N 3.29Å; L45-Q47 VanDerWaalsContact C-N 3.33Å; Q47-F49 VanDerWaalsContact C-N 3.29Å; Q47-F49 PolarHBondContact O-N 3.42Å; Q47-A50 PolarHBondContact O-N 3.05Å; Q47-D51 PolarHBondContact NE2-OD1 3.19Å; Q47-D51 PolarHBondContact O-N 3.17Å
48	P	92.8	Very high	92.4	Very high	13 Å²	13	87.2 Å²	87.2	8%	0.084	46%	0.456	C	S	.	.	H	α-helix	trans	-62.5	-37.2	-179.2	-23.5	35.9	0	0	0	112.8	A18 F19 L22 L45 D51 A52	A18-P48 HydrophobicContact CB-CB 3.91Å; A18-P48 WeakPolarHBondContact O-CB 3.45Å; A18-P48 WeakPolarHBondContact O-CG 3.35Å; F19-P48 HydrophobicContact CD1-CG 4.31Å; L22-P48 HydrophobicContact CB-CG 3.84Å; L22-P48 HydrophobicContact CD1-CG 4.17Å; L45-P48 WeakPolarHBondContact O-CD 3.48Å; P48-D51 PolarHBondContact O-N 3.38Å; P48-A52 WeakPolarHBondContact O-CB 3.45Å; P48-A52 PolarHBondContact O-N 3.11Å
49	F	92.8	Very high	92.4	Very high	115 Å²	115	92 Å²	92	50%	0.504	48%	0.477	S	S	.	.	H	α-helix	trans	-68	-40.5	176.6	-63.8	-72.7	0	0	0	111.7	F19 L46 Q47 A52 M53	F19-F49 HydrophobicContact CE2-CE2 4.5Å; F19-F49 HydrophobicContact CZ-CE2 4.04Å; L46-F49 HydrophobicContact CD2-CD2 4.32Å; L46-F49 PolarHBondContact O-N 3.11Å; Q47-F49 VanDerWaalsContact C-N 3.29Å; Q47-F49 PolarHBondContact O-N 3.42Å; F49-A52 PolarHBondContact O-N 3.22Å; F49-M53 WeakPolarHBondContact O-CB 3.39Å; F49-M53 PolarHBondContact O-N 3.07Å
50	A	94	Very high	92.3	Very high	41 Å²	41	90.8 Å²	90.8	34%	0.339	47%	0.472	S	S	.	.	H	α-helix	trans	-64.1	-42.7	175	0	0	0	0	0	112.1	V40 L46 Q47 K54	V40-A50 HydrophobicContact CG1-CB 3.98Å; L46-A50 PolarHBondContact O-N 3.39Å; L46-A50 VanDerWaalsContact O-N 3.11Å; Q47-A50 PolarHBondContact O-N 3.05Å; A50-K54 VanDerWaalsContact O-CB 3.26Å; A50-K54 WeakPolarHBondContact O-CB 3.46Å; A50-K54 PolarHBondContact O-N 3.46Å
51	D	93.6	Very high	92.1	Very high	39 Å²	39	94.3 Å²	94.3	21%	0.209	49%	0.488	C	S	.	.	H	α-helix	trans	-64.5	-42.5	176.6	-76	4.4	0	0	0	111.1	R25 Q47 P48 K54 L55	R25-D51 IonicContact CZ-OD2 3.24Å; R25-D51 VanDerWaalsContact CZ-OD2 3.24Å; R25-D51 IonicContact NH1-OD2 2.74Å; R25-D51 PolarHBondContact NH1-OD2 3.31Å; R25-D51 IonicContact NH2-OD2 2.88Å; R25-D51 PolarHBondContact NH2-OD2 3.27Å; Q47-D51 PolarHBondContact NE2-OD1 3.19Å; Q47-D51 PolarHBondContact O-N 3.17Å; P48-D51 PolarHBondContact O-N 3.38Å; D51-K54 PolarHBondContact O-N 3.46Å; D51-L55 WeakPolarHBondContact O-CG 3.46Å; D51-L55 PolarHBondContact O-N 3.22Å
52	A	93.3	Very high	91.8	Very high	41 Å²	41	97.9 Å²	97.9	34%	0.339	50%	0.496	S	S	.	.	H	α-helix	trans	-63.1	-49.1	176.2	0	0	0	0	0	112	P48 F49 K54 L55 F56	P48-A52 WeakPolarHBondContact O-CB 3.45Å; P48-A52 PolarHBondContact O-N 3.11Å; F49-A52 PolarHBondContact O-N 3.22Å; A52-K54 VanDerWaalsContact C-N 3.29Å; A52-K54 PolarHBondContact O-N 3.3Å; A52-L55 PolarHBondContact O-N 3.36Å; A52-L55 VanDerWaalsContact O-N 3.16Å; A52-F56 HydrophobicContact CB-CE2 4.46Å; A52-F56 WeakPolarHBondContact O-CD2 3.13Å; A52-F56 PolarHBondContact O-N 3.19Å
53	M	94.1	Very high	91.4	Very high	136 Å²	136	96 Å²	96	67%	0.67	48%	0.483	S	S	*	.	H	α-helix	trans	-59.4	-42.9	177.7	-170.5	178.5	-172.8	0	0	111	F49 L55 F56 T57	F49-M53 WeakPolarHBondContact O-CB 3.39Å; F49-M53 PolarHBondContact O-N 3.07Å; M53-L55 PolarHBondContact O-N 3.44Å; M53-F56 PolarHBondContact O-N 2.89Å; M53-T57 HydrophobicContact CG-CG2 4.44Å; M53-T57 WeakPolarHBondContact O-CG2 2.91Å; M53-T57 PolarHBondContact O-N 3.05Å; M53-T57 PolarHBondContact O-OG1 2.88Å; M53-T57 VanDerWaalsContact O-OG1 3.09Å
54	K	94.7	Very high	90.8	Very high	142 Å²	142	92.6 Å²	92.6	62%	0.617	49%	0.492	S	S	*	.	H	α-helix	trans	-57.7	-46.7	175.1	179.8	-178.8	178.6	-180	0	111.8	A50 D51 A52 T57 K58	A50-K54 VanDerWaalsContact O-CB 3.26Å; A50-K54 WeakPolarHBondContact O-CB 3.46Å; A50-K54 PolarHBondContact O-N 3.46Å; D51-K54 PolarHBondContact O-N 3.46Å; A52-K54 VanDerWaalsContact C-N 3.29Å; A52-K54 PolarHBondContact O-N 3.3Å; K54-T57 PolarHBondContact O-N 3.09Å; K54-T57 PolarHBondContact O-OG1 3.31Å; K54-T57 VanDerWaalsContact O-OG1 3.08Å; K54-K58 WeakPolarHBondContact O-CB 3.35Å; K54-K58 PolarHBondContact O-N 3.03Å; K54-K58 VanDerWaalsContact O-N 3.15Å
55	L	93.2	Very high	90.3	Very high	129 Å²	129	96.9 Å²	96.9	68%	0.675	52%	0.518	S	S	*	.	H	α-helix	trans	-65	-38	179.5	-71.5	173.2	0	0	0	112.4	D51 A52 M53 K58	D51-L55 WeakPolarHBondContact O-CG 3.46Å; D51-L55 PolarHBondContact O-N 3.22Å; A52-L55 PolarHBondContact O-N 3.36Å; A52-L55 VanDerWaalsContact O-N 3.16Å; M53-L55 PolarHBondContact O-N 3.44Å; L55-K58 PolarHBondContact O-N 3.33Å
56	F	92.9	Very high	89.9	Confident	186 Å²	186	93.5 Å²	93.5	82%	0.816	50%	0.502	S	S	*	.	H	α-helix	trans	-72.2	-33.2	177.9	-72.2	-55.2	0	0	0	114	A52 M53 K58	A52-F56 HydrophobicContact CB-CE2 4.46Å; A52-F56 WeakPolarHBondContact O-CD2 3.13Å; A52-F56 PolarHBondContact O-N 3.19Å; M53-F56 PolarHBondContact O-N 2.89Å; F56-K58 VanDerWaalsContact C-N 3.33Å
57	T	95.5	Very high	89.6	Confident	105 Å²	105	91.7 Å²	91.7	64%	0.644	50%	0.495	S	S	*	.	H	α-helix	trans	-80.1	-15.5	177.1	58.3	0	0	0	0	113.5	M53 K54	M53-T57 HydrophobicContact CG-CG2 4.44Å; M53-T57 WeakPolarHBondContact O-CG2 2.91Å; M53-T57 PolarHBondContact O-N 3.05Å; M53-T57 PolarHBondContact O-OG1 2.88Å; M53-T57 VanDerWaalsContact O-OG1 3.09Å; K54-T57 PolarHBondContact O-N 3.09Å; K54-T57 PolarHBondContact O-OG1 3.31Å; K54-T57 VanDerWaalsContact O-OG1 3.08Å
58	K	95.9	Very high	89.3	Confident	133 Å²	133	94.5 Å²	94.5	58%	0.578	51%	0.51	S	S	*	.	S	Bend	trans	-74.2	139.8	-177.8	-169.1	174.2	-179.5	-175.2	0	110	K54 L55 F56	K54-K58 WeakPolarHBondContact O-CB 3.35Å; K54-K58 PolarHBondContact O-N 3.03Å; K54-K58 VanDerWaalsContact O-N 3.15Å; L55-K58 PolarHBondContact O-N 3.33Å; F56-K58 VanDerWaalsContact C-N 3.33Å
59	E	91.6	Very high	89.1	Confident	154 Å²	154	98.7 Å²	98.7	72%	0.72	54%	0.536	S	S	*	.			trans	-55.7	126.9	175.5	-172.4	-179.7	175.3	0	0	110.7	L61	E59-L61 PolarHBondContact O-N 3.42Å; E59-L61 VanDerWaalsContact O-N 3.1Å
60	P	86.6	Confident	88.9	Confident	114 Å²	114	94.9 Å²	94.9	74%	0.74	52%	0.52	S	S	*	.			trans	-70.6	107.2	177.5	27.9	-32.8	0	0	0	109.7	K62	P60-K62 PolarHBondContact O-N 3.34Å; P60-K62 VanDerWaalsContact O-N 3.11Å
61	L	85	Confident	88.7	Confident	127 Å²	127	97.1 Å²	97.1	67%	0.665	52%	0.52	S	S	*	.			trans	-73.7	103.2	177	-67	173.7	0	0	0	110.2	E59 Y71	E59-L61 PolarHBondContact O-N 3.42Å; E59-L61 VanDerWaalsContact O-N 3.1Å; L61-Y71 PolarHBondContact O-OH 3.22Å
62	K	83.6	Confident	88.6	Confident	104 Å²	104	99.9 Å²	99.9	45%	0.452	53%	0.534	S	S	.	.			trans	-104.5	116.3	175.3	-173.9	177.2	177.6	-176.9	0	110.3	P60 I68	P60-K62 PolarHBondContact O-N 3.34Å; P60-K62 VanDerWaalsContact O-N 3.11Å; K62-I68 VanDerWaalsContact CE-CG1 3.41Å; K62-I68 VanDerWaalsContact NZ-CD1 3.33Å; K62-I68 VanDerWaalsContact NZ-CG1 3.33Å
63	P	80.6	Confident	88.6	Confident	48 Å²	48	100.7 Å²	100.7	31%	0.312	54%	0.535	S	S	.	.			trans	-65.1	136.5	178.8	-16.7	28.6	0	0	0	111.4	T65 S66	P63-T65 PolarHBondContact O-N 2.82Å; P63-S66 WeakPolarHBondContact O-CB 3.48Å; P63-S66 PolarHBondContact O-N 3.45Å; P63-S66 PolarHBondContact O-OG 2.91Å
64	A	77.7	Confident	88.5	Confident	109 Å²	109	94.3 Å²	94.3	90%	0.901	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-28.2	179.8	0	0	0	0	0	113.5	S66	A64-S66 VanDerWaalsContact C-N 3.33Å
65	T	80.5	Confident	88.4	Confident	89 Å²	89	91.3 Å²	91.3	55%	0.546	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	0.9	-178.7	53	0	0	0	0	113.8	P63 N124	P63-T65 PolarHBondContact O-N 2.82Å; T65-N124 WeakPolarHBondContact O-CB 3.48Å; T65-N124 PolarHBondContact O-ND2 2.95Å
66	S	83.3	Confident	88.5	Confident	13 Å²	13	88.9 Å²	88.9	9%	0.091	49%	0.49	C	S	.	.	S	Bend	trans	-82.7	149	-172.4	65.5	0	0	0	0	114.3	P63 A64 I68 A122	P63-S66 WeakPolarHBondContact O-CB 3.48Å; P63-S66 PolarHBondContact O-N 3.45Å; P63-S66 PolarHBondContact O-OG 2.91Å; A64-S66 VanDerWaalsContact C-N 3.33Å; S66-I68 PolarHBondContact O-N 2.97Å; S66-A122 CarbonylContact C-O 3.35Å; S66-A122 WeakPolarHBondContact CA-O 3.39Å; S66-A122 WeakPolarHBondContact CB-O 3.3Å
67	T	88.2	Confident	88.6	Confident	55 Å²	55	81.8 Å²	81.8	34%	0.337	46%	0.46	S	S	.	.			trans	-79.5	109.7	168.8	56.9	0	0	0	0	109.7	T69 L70 Y71 A122	T67-T69 VanDerWaalsContact C-N 3.35Å; T67-T69 PolarHBondContact O-N 3.28Å; T67-L70 PolarHBondContact O-N 3.17Å; T67-Y71 WeakPolarHBondContact O-CB 3.38Å; T67-Y71 PolarHBondContact O-N 2.74Å; T67-A122 PolarHBondContact N-O 2.88Å; T67-A122 WeakPolarHBondContact OG1-CA 3.18Å; T67-A122 WeakPolarHBondContact OG1-CB 3.45Å
68	I	85.4	Confident	88.6	Confident	91 Å²	91	78.7 Å²	78.7	47%	0.467	45%	0.445	S	S	.	.	H	α-helix	trans	-62.1	-40.9	-166.5	-64.7	176.6	0	0	0	112.8	K62 S66 I72	K62-I68 VanDerWaalsContact CE-CG1 3.41Å; K62-I68 VanDerWaalsContact NZ-CD1 3.33Å; K62-I68 VanDerWaalsContact NZ-CG1 3.33Å; S66-I68 PolarHBondContact O-N 2.97Å; I68-I72 HydrophobicContact CG2-CD1 4.03Å; I68-I72 WeakPolarHBondContact O-CG1 3.38Å; I68-I72 PolarHBondContact O-N 3.37Å
69	T	89.1	Confident	88.6	Confident	102 Å²	102	76.9 Å²	76.9	63%	0.626	44%	0.441	S	S	*	.	H	α-helix	trans	-61.9	-53.7	-178.7	50.3	0	0	0	0	110.5	T67 Y71 I72 T73	T67-T69 VanDerWaalsContact C-N 3.35Å; T67-T69 PolarHBondContact O-N 3.28Å; T69-Y71 PolarHBondContact O-N 3.46Å; T69-I72 PolarHBondContact O-N 3.19Å; T69-T73 VanDerWaalsContact O-CG2 3.28Å; T69-T73 WeakPolarHBondContact O-CG2 3.47Å; T69-T73 PolarHBondContact O-N 3.44Å; T69-T73 PolarHBondContact O-OG1 3.37Å; T69-T73 VanDerWaalsContact O-OG1 3.11Å
70	L	89.2	Confident	88.8	Confident	35 Å²	35	73 Å²	73	18%	0.183	43%	0.428	C	S	.	.	H	α-helix	trans	-68.9	-34.3	-178.7	-67.6	176.1	0	0	0	113.1	T67 I72 T73 A74 W118 W121 A122	T67-L70 PolarHBondContact O-N 3.17Å; L70-I72 VanDerWaalsContact C-N 3.27Å; L70-I72 PolarHBondContact O-N 3.44Å; L70-T73 WeakPolarHBondContact CA-OG1 3.38Å; L70-T73 PolarHBondContact O-N 3.09Å; L70-T73 PolarHBondContact O-OG1 3.22Å; L70-A74 WeakPolarHBondContact O-CB 3.4Å; L70-A74 PolarHBondContact O-N 3.15Å; L70-W118 HydrophobicContact CD2-CB 4.4Å; L70-W118 HydrophobicContact CD2-CD2 4Å; L70-W118 HydrophobicContact CD2-CE3 4.18Å; L70-W118 HydrophobicContact CD2-CG 4.1Å; L70-W121 HydrophobicContact CD1-CE3 3.35Å; L70-W121 HydrophobicContact CD1-CZ3 3.34Å; L70-A122 HydrophobicContact CB-CB 3.7Å
71	Y	89.4	Confident	89.2	Confident	87 Å²	87	67.7 Å²	67.7	34%	0.341	39%	0.394	S	S	.	.	H	α-helix	trans	-63.1	-34.6	177.7	-170.8	-97.6	0	0	0	112.5	L61 T67 T69 P75	L61-Y71 PolarHBondContact O-OH 3.22Å; T67-Y71 WeakPolarHBondContact O-CB 3.38Å; T67-Y71 PolarHBondContact O-N 2.74Å; T69-Y71 PolarHBondContact O-N 3.46Å; Y71-P75 WeakPolarHBondContact O-CD 3.44Å
72	I	90.9	Very high	89.7	Confident	98 Å²	98	63.9 Å²	63.9	50%	0.503	38%	0.38	S	S	.	.	H	α-helix	trans	-85	-40.9	177.3	-63.2	169.9	0	0	0	110.8	I68 T69 L70 P75 T76	I68-I72 HydrophobicContact CG2-CD1 4.03Å; I68-I72 WeakPolarHBondContact O-CG1 3.38Å; I68-I72 PolarHBondContact O-N 3.37Å; T69-I72 PolarHBondContact O-N 3.19Å; L70-I72 VanDerWaalsContact C-N 3.27Å; L70-I72 PolarHBondContact O-N 3.44Å; I72-P75 WeakPolarHBondContact O-CD 3.46Å; I72-P75 WeakPolarHBondContact O-CG 3.36Å; I72-T76 WeakPolarHBondContact O-CG2 3.26Å
73	T	92.9	Very high	90.2	Very high	57 Å²	57	60.7 Å²	60.7	35%	0.35	37%	0.368	S	S	.	.	H	α-helix	trans	-71.6	-34	-176.6	59.1	0	0	0	0	112.8	T69 L70 T76 L77	T69-T73 VanDerWaalsContact O-CG2 3.28Å; T69-T73 WeakPolarHBondContact O-CG2 3.47Å; T69-T73 PolarHBondContact O-N 3.44Å; T69-T73 PolarHBondContact O-OG1 3.37Å; T69-T73 VanDerWaalsContact O-OG1 3.11Å; L70-T73 WeakPolarHBondContact CA-OG1 3.38Å; L70-T73 PolarHBondContact O-N 3.09Å; L70-T73 PolarHBondContact O-OG1 3.22Å; T73-T76 WeakPolarHBondContact CA-OG1 3.47Å; T73-T76 PolarHBondContact O-N 3.02Å; T73-T76 PolarHBondContact O-OG1 3.23Å; T73-L77 WeakPolarHBondContact O-CB 3.46Å; T73-L77 PolarHBondContact O-N 3.06Å
74	A	93	Very high	90.9	Very high	3 Å²	3	62.2 Å²	62.2	3%	0.025	37%	0.373	C	S	.	.	H	α-helix	trans	-55.5	-53.6	-179	0	0	0	0	0	114.2	L70 T76 L77 A78 W118	L70-A74 WeakPolarHBondContact O-CB 3.4Å; L70-A74 PolarHBondContact O-N 3.15Å; A74-T76 VanDerWaalsContact C-N 3.33Å; A74-T76 PolarHBondContact O-N 3.49Å; A74-L77 PolarHBondContact O-N 3.12Å; A74-A78 PolarHBondContact O-N 3.04Å; A74-W118 HydrophobicContact CB-CB 4.08Å
75	P	92.8	Very high	91.7	Very high	78 Å²	78	59.1 Å²	59.1	51%	0.506	34%	0.341	S	S	.	.	H	α-helix	trans	-66.7	-32.3	177.5	25	-34.1	0	0	0	112.9	Y71 I72 A78 L79	Y71-P75 WeakPolarHBondContact O-CD 3.44Å; I72-P75 WeakPolarHBondContact O-CD 3.46Å; I72-P75 WeakPolarHBondContact O-CG 3.36Å; P75-A78 PolarHBondContact O-N 3.4Å; P75-L79 PolarHBondContact O-N 3.33Å; P75-L79 VanDerWaalsContact O-N 3.12Å
76	T	94.4	Very high	92.4	Very high	79 Å²	79	59.7 Å²	59.7	49%	0.485	33%	0.333	S	S	.	.	H	α-helix	trans	-66	-42.4	174.5	62.9	0	0	0	0	111.5	I72 T73 A74 L79 T80	I72-T76 WeakPolarHBondContact O-CG2 3.26Å; T73-T76 WeakPolarHBondContact CA-OG1 3.47Å; T73-T76 PolarHBondContact O-N 3.02Å; T73-T76 PolarHBondContact O-OG1 3.23Å; A74-T76 VanDerWaalsContact C-N 3.33Å; A74-T76 PolarHBondContact O-N 3.49Å; T76-L79 PolarHBondContact O-N 2.86Å; T76-T80 VanDerWaalsContact O-CG2 3.25Å; T76-T80 WeakPolarHBondContact O-CG2 3.32Å; T76-T80 PolarHBondContact O-N 2.75Å; T76-T80 PolarHBondContact O-OG1 2.85Å
77	L	95.6	Very high	92.8	Very high	37 Å²	37	60.1 Å²	60.1	19%	0.194	34%	0.336	C	S	.	.	H	α-helix	trans	-60.4	-48.8	176.2	-171.9	79.5	0	0	0	110.3	T73 A74 L79 T80 I81 W118	T73-L77 WeakPolarHBondContact O-CB 3.46Å; T73-L77 PolarHBondContact O-N 3.06Å; A74-L77 PolarHBondContact O-N 3.12Å; L77-L79 PolarHBondContact O-N 2.92Å; L77-T80 WeakPolarHBondContact CA-OG1 3.33Å; L77-T80 PolarHBondContact O-N 2.9Å; L77-T80 PolarHBondContact O-OG1 3.46Å; L77-I81 HydrophobicContact CD1-CD1 4.2Å; L77-I81 HydrophobicContact CD2-CD1 4.07Å; L77-I81 HydrophobicContact CG-CD1 3.69Å; L77-I81 HydrophobicContact CG-CG1 4.36Å; L77-I81 WeakPolarHBondContact O-CG1 3.46Å; L77-I81 PolarHBondContact O-N 3.41Å; L77-W118 HydrophobicContact CD2-CE3 4.09Å; L77-W118 HydrophobicContact CD2-CH2 4.44Å; L77-W118 HydrophobicContact CD2-CZ3 3.81Å
78	A	95.1	Very high	93.1	Very high	39 Å²	39	57.8 Å²	57.8	32%	0.322	32%	0.321	S	S	.	.	H	α-helix	trans	-55.2	-48.5	178.6	0	0	0	0	0	112.2	A74 P75 I81 A82	A74-A78 PolarHBondContact O-N 3.04Å; P75-A78 PolarHBondContact O-N 3.4Å; A78-I81 PolarHBondContact O-N 3.02Å; A78-A82 VanDerWaalsContact O-CB 3.31Å; A78-A82 WeakPolarHBondContact O-CB 3.46Å; A78-A82 PolarHBondContact O-N 2.93Å
79	L	95.3	Very high	93.5	Very high	96 Å²	96	56.1 Å²	56.1	50%	0.503	31%	0.313	S	S	.	.	H	α-helix	trans	-64.3	-42.4	178.3	-173.1	72.5	0	0	0	111.8	P75 T76 L77 A82 L83	P75-L79 PolarHBondContact O-N 3.33Å; P75-L79 VanDerWaalsContact O-N 3.12Å; T76-L79 PolarHBondContact O-N 2.86Å; L77-L79 PolarHBondContact O-N 2.92Å; L79-A82 PolarHBondContact O-N 3.48Å; L79-L83 HydrophobicContact CG-CD1 4.27Å; L79-L83 WeakPolarHBondContact O-CG 3.49Å; L79-L83 PolarHBondContact O-N 3.27Å
80	T	95.2	Very high	93.6	Very high	71 Å²	71	52.7 Å²	52.7	44%	0.436	29%	0.292	S	S	.	.	H	α-helix	trans	-63.3	-44.2	179.3	57.2	0	0	0	0	112.2	T76 L77 L83 L84	T76-T80 VanDerWaalsContact O-CG2 3.25Å; T76-T80 WeakPolarHBondContact O-CG2 3.32Å; T76-T80 PolarHBondContact O-N 2.75Å; T76-T80 PolarHBondContact O-OG1 2.85Å; L77-T80 WeakPolarHBondContact CA-OG1 3.33Å; L77-T80 PolarHBondContact O-N 2.9Å; L77-T80 PolarHBondContact O-OG1 3.46Å; T80-L83 PolarHBondContact O-N 2.9Å; T80-L84 WeakPolarHBondContact O-CB 3.48Å; T80-L84 VanDerWaalsContact O-CG 3.25Å; T80-L84 WeakPolarHBondContact O-CG 3.44Å; T80-L84 PolarHBondContact O-N 2.96Å
81	I	95.9	Very high	93.6	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.021	31%	0.309	C	S	.	.	H	α-helix	trans	-65	-44.4	177.7	-64.2	169.6	0	0	0	110.2	L77 A78 L83 L84 L85 T108 L111 A112	L77-I81 HydrophobicContact CD1-CD1 4.2Å; L77-I81 HydrophobicContact CD2-CD1 4.07Å; L77-I81 HydrophobicContact CG-CD1 3.69Å; L77-I81 HydrophobicContact CG-CG1 4.36Å; L77-I81 WeakPolarHBondContact O-CG1 3.46Å; L77-I81 PolarHBondContact O-N 3.41Å; A78-I81 PolarHBondContact O-N 3.02Å; I81-L83 VanDerWaalsContact C-N 3.29Å; I81-L83 PolarHBondContact O-N 2.8Å; I81-L84 PolarHBondContact O-N 3.33Å; I81-L85 HydrophobicContact CG2-CD1 4.44Å; I81-L85 PolarHBondContact O-N 3.45Å; I81-L85 VanDerWaalsContact O-N 3.12Å; I81-T108 VanDerWaalsContact CG2-O 3.26Å; I81-T108 WeakPolarHBondContact CG2-O 3.36Å; I81-L111 HydrophobicContact CD1-CB 4.02Å; I81-L111 HydrophobicContact CD1-CD2 3.85Å; I81-L111 HydrophobicContact CD1-CG 3.74Å; I81-L111 HydrophobicContact CG1-CD2 4.14Å; I81-A112 HydrophobicContact CG2-CB 4.06Å
82	A	95.1	Very high	93.4	Very high	47 Å²	47	57.2 Å²	57.2	39%	0.388	33%	0.327	S	S	.	.	H	α-helix	trans	-57.7	-40.9	178.1	0	0	0	0	0	112.2	A78 L79 W86	A78-A82 VanDerWaalsContact O-CB 3.31Å; A78-A82 WeakPolarHBondContact O-CB 3.46Å; A78-A82 PolarHBondContact O-N 2.93Å; L79-A82 PolarHBondContact O-N 3.48Å; A82-W86 PolarHBondContact O-NE1 3.38Å
83	L	94.6	Very high	93.4	Very high	37 Å²	37	59 Å²	59	19%	0.194	34%	0.337	C	S	.	.	H	α-helix	trans	-74.2	-35.8	177	-68	174.7	0	0	0	112.9	I10 I13 L79 T80 I81 L85 W86	I10-L83 HydrophobicContact CG2-CD1 4.19Å; I10-L83 HydrophobicContact CG2-CD2 4.07Å; I13-L83 HydrophobicContact CG2-CD2 4.43Å; L79-L83 HydrophobicContact CG-CD1 4.27Å; L79-L83 WeakPolarHBondContact O-CG 3.49Å; L79-L83 PolarHBondContact O-N 3.27Å; T80-L83 PolarHBondContact O-N 2.9Å; I81-L83 VanDerWaalsContact C-N 3.29Å; I81-L83 PolarHBondContact O-N 2.8Å; L83-L85 VanDerWaalsContact C-N 3.31Å; L83-L85 PolarHBondContact O-N 3.37Å; L83-W86 PolarHBondContact O-N 3.16Å
84	L	94.7	Very high	93.4	Very high	80 Å²	80	57.5 Å²	57.5	42%	0.419	33%	0.328	S	S	.	.	H	α-helix	trans	-63.1	-36.1	178.3	-77.9	169.1	0	0	0	112.7	T80 I81 W86 T87	T80-L84 WeakPolarHBondContact O-CB 3.48Å; T80-L84 VanDerWaalsContact O-CG 3.25Å; T80-L84 WeakPolarHBondContact O-CG 3.44Å; T80-L84 PolarHBondContact O-N 2.96Å; I81-L84 PolarHBondContact O-N 3.33Å; L84-W86 PolarHBondContact O-N 2.89Å; L84-W86 VanDerWaalsContact O-N 3.11Å; L84-T87 WeakPolarHBondContact O-CB 3.46Å; L84-T87 WeakPolarHBondContact O-CG2 3.18Å; L84-T87 PolarHBondContact O-N 3.33Å; L84-T87 PolarHBondContact O-OG1 3.04Å
85	L	95.2	Very high	93.3	Very high	44 Å²	44	60.4 Å²	60.4	23%	0.23	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-23.6	178.3	-79.5	166.9	0	0	0	113.6	I81 L83 P88 I105 T108	I81-L85 HydrophobicContact CG2-CD1 4.44Å; I81-L85 PolarHBondContact O-N 3.45Å; I81-L85 VanDerWaalsContact O-N 3.12Å; L83-L85 VanDerWaalsContact C-N 3.31Å; L83-L85 PolarHBondContact O-N 3.37Å; L85-P88 WeakPolarHBondContact O-CD 3.4Å; L85-I105 HydrophobicContact CD2-CB 4.4Å; L85-I105 HydrophobicContact CD2-CG2 3.95Å; L85-T108 WeakPolarHBondContact CD2-OG1 3.32Å
86	W	94.6	Very high	93.3	Very high	101 Å²	101	59.8 Å²	59.8	38%	0.383	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-17.5	178.8	-67.3	89.5	0	0	0	114.1	L9 I13 A82 L83 L84 L89 M91	L9-W86 HydrophobicContact CD2-CB 4.41Å; I13-W86 HydrophobicContact CD1-CB 3.78Å; I13-W86 HydrophobicContact CD1-CD2 3.75Å; I13-W86 HydrophobicContact CD1-CE3 4.14Å; I13-W86 HydrophobicContact CD1-CG 3.57Å; I13-W86 HydrophobicContact CG1-CD2 4.27Å; I13-W86 HydrophobicContact CG1-CE3 4.45Å; A82-W86 PolarHBondContact O-NE1 3.38Å; L83-W86 PolarHBondContact O-N 3.16Å; L84-W86 PolarHBondContact O-N 2.89Å; L84-W86 VanDerWaalsContact O-N 3.11Å; W86-L89 HydrophobicContact CD2-CD1 4.15Å; W86-L89 HydrophobicContact CE3-CD1 3.68Å; W86-L89 HydrophobicContact CZ3-CD1 4.16Å; W86-L89 PolarHBondContact O-N 3.02Å; W86-M91 HydrophobicContact CE3-CE 3.53Å; W86-M91 HydrophobicContact CZ3-CE 3.54Å
87	T	92.3	Very high	93.2	Very high	22 Å²	22	61 Å²	61	14%	0.135	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-38.9	-173.1	63.2	0	0	0	0	115.3	L84 L95 V96	L84-T87 WeakPolarHBondContact O-CB 3.46Å; L84-T87 WeakPolarHBondContact O-CG2 3.18Å; L84-T87 PolarHBondContact O-N 3.33Å; L84-T87 PolarHBondContact O-OG1 3.04Å; T87-L95 HydrophobicContact CG2-CD2 4.07Å; T87-L95 PolarHBondContact O-N 3.11Å; T87-V96 PolarHBondContact O-N 3.23Å; T87-V96 VanDerWaalsContact O-N 3.14Å
88	P	93.8	Very high	93.1	Very high	5 Å²	5	62 Å²	62	3%	0.032	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-8.4	178.7	39.2	-40.9	0	0	0	113.2	L85 P90 P94 L98 F104 I105 L162	L85-P88 WeakPolarHBondContact O-CD 3.4Å; P88-P90 WeakPolarHBondContact O-CD 3.31Å; P88-P94 WeakPolarHBondContact O-CB 3.25Å; P88-L98 HydrophobicContact CB-CD1 4.4Å; P88-F104 HydrophobicContact CB-CD1 4.45Å; P88-F104 HydrophobicContact CG-CD1 3.86Å; P88-F104 HydrophobicContact CG-CE1 4.2Å; P88-I105 HydrophobicContact CG-CD1 4.1Å; P88-I105 HydrophobicContact CG-CG1 3.82Å; P88-L162 HydrophobicContact CB-CD1 4.07Å; P88-L162 HydrophobicContact CG-CD1 4.29Å; P88-L162 WeakPolarHBondContact O-CD1 3.33Å
89	L	93.9	Very high	93	Very high	57 Å²	57	65.9 Å²	65.9	30%	0.298	36%	0.362	S	S	.	.			trans	-66.2	123.4	-175.6	-71.7	176.9	0	0	0	110.2	W86 M91 I105	W86-L89 HydrophobicContact CD2-CD1 4.15Å; W86-L89 HydrophobicContact CE3-CD1 3.68Å; W86-L89 HydrophobicContact CZ3-CD1 4.16Å; W86-L89 PolarHBondContact O-N 3.02Å; L89-M91 HydrophobicContact CB-CE 4.37Å; L89-M91 HydrophobicContact CD1-CE 4.49Å; L89-M91 PolarHBondContact O-N 3.46Å; L89-I105 HydrophobicContact CD2-CD1 3.92Å
90	P	91.3	Very high	92.9	Very high	29 Å²	29	65.7 Å²	65.7	19%	0.188	36%	0.361	C	S	.	.			trans	-80.4	117.9	-178.3	32.9	-35	0	0	0	110	P88 L162 I166	P88-P90 WeakPolarHBondContact O-CD 3.31Å; P90-L162 HydrophobicContact CG-CB 3.79Å; P90-I166 HydrophobicContact CB-CD1 3.65Å; P90-I166 HydrophobicContact CG-CD1 3.77Å; P90-I166 HydrophobicContact CG-CG1 4.28Å
91	M	88.8	Confident	92.9	Very high	108 Å²	108	62.3 Å²	62.3	53%	0.532	34%	0.34	S	S	.	.	S	Bend	trans	-132.4	94.2	174.1	-60.8	-178.3	-162	0	0	111	W86 L89 N93	W86-M91 HydrophobicContact CE3-CE 3.53Å; W86-M91 HydrophobicContact CZ3-CE 3.54Å; L89-M91 HydrophobicContact CB-CE 4.37Å; L89-M91 HydrophobicContact CD1-CE 4.49Å; L89-M91 PolarHBondContact O-N 3.46Å; M91-N93 PolarHBondContact N-O 2.91Å; M91-N93 PolarHBondContact O-N 3.5Å
92	P	86.4	Confident	92.7	Very high	110 Å²	110	62.9 Å²	62.9	71%	0.714	34%	0.343	S	S	*	.	S	Bend		-41.9	-19.3	-67.2	27.5	-38.4	0	0	0	116.1
93	N	90.3	Very high	92.7	Very high	134 Å²	134	64.1 Å²	64.1	72%	0.717	34%	0.343	S	S	*	.	S	Bend	trans	-107.1	132.5	173.4	-69.4	-32.2	0	0	0	109.6	M91	M91-N93 PolarHBondContact N-O 2.91Å; M91-N93 PolarHBondContact O-N 3.5Å
94	P	93.1	Very high	92.7	Very high	26 Å²	26	65.4 Å²	65.4	17%	0.169	35%	0.347	C	S	.	.			trans	-73.6	155.7	176	31.3	-35.1	0	0	0	111.5	P88 V96 N97	P88-P94 WeakPolarHBondContact O-CB 3.25Å; P94-V96 VanDerWaalsContact C-N 3.33Å; P94-N97 HydrophobicContact CG-CB 3.89Å
95	L	91.9	Very high	92.7	Very high	65 Å²	65	63.3 Å²	63.3	34%	0.34	34%	0.336	S	S	.	.	S	Bend	trans	-63.1	-44.3	172	-174.3	86.8	0	0	0	110.3	N5 L9 T87	N5-L95 HydrophobicContact CB-CD1 3.8Å; L9-L95 HydrophobicContact CD2-CB 4.25Å; L9-L95 HydrophobicContact CD2-CD2 3.96Å; L9-L95 HydrophobicContact CD2-CG 4.46Å; T87-L95 HydrophobicContact CG2-CD2 4.07Å; T87-L95 PolarHBondContact O-N 3.11Å
96	V	91.9	Very high	92.7	Very high	64 Å²	64	62.7 Å²	62.7	39%	0.388	33%	0.333	S	S	.	.	S	Bend	trans	-124.9	111.1	175.2	-174.6	0	0	0	0	108.3	T87 P94 L98	T87-V96 PolarHBondContact O-N 3.23Å; T87-V96 VanDerWaalsContact O-N 3.14Å; P94-V96 VanDerWaalsContact C-N 3.33Å; V96-L98 HydrophobicContact CG1-CD2 3.68Å; V96-L98 HydrophobicContact CG1-CG 3.89Å; V96-L98 PolarHBondContact O-N 3.19Å
97	N	92.3	Very high	92.6	Very high	105 Å²	105	60.7 Å²	60.7	56%	0.561	34%	0.338	S	S	*	.			trans	-78.3	105.8	175.3	-169.7	0.5	0	0	0	109.7	P94 N161	P94-N97 HydrophobicContact CG-CB 3.89Å; N97-N161 PolarHBondContact OD1-ND2 2.92Å; N97-N161 VanDerWaalsContact OD1-ND2 3.16Å; N97-N161 PolarHBondContact OD1-OD1 3.01Å
98	L	93.3	Very high	92.8	Very high	57 Å²	57	60.5 Å²	60.5	30%	0.298	34%	0.336	S	S	.	.			trans	-107.5	130.6	178.7	-63.4	177.6	0	0	0	110	P88 V96 L100 G101 F104 N161	P88-L98 HydrophobicContact CB-CD1 4.4Å; V96-L98 HydrophobicContact CG1-CD2 3.68Å; V96-L98 HydrophobicContact CG1-CG 3.89Å; V96-L98 PolarHBondContact O-N 3.19Å; L98-L100 PolarHBondContact O-N 3.16Å; L98-G101 PolarHBondContact O-N 3.4Å; L98-F104 HydrophobicContact CD1-CB 4.1Å; L98-F104 HydrophobicContact CD1-CD1 4.26Å; L98-F104 HydrophobicContact CD1-CD2 4.08Å; L98-F104 HydrophobicContact CD1-CG 3.88Å; L98-N161 PolarHBondContact O-OD1 2.95Å
99	N	93.4	Very high	92.7	Very high	121 Å²	121	61.5 Å²	61.5	65%	0.647	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-33.8	175.3	-167.9	21.2	0	0	0	112.2	F160 N161	N99-F160 CarbonylContact O-C 3.38Å; N99-N161 PolarHBondContact O-N 3.48Å
100	L	94	Very high	92.7	Very high	92 Å²	92	61 Å²	61	48%	0.482	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	42.5	177.3	-57	-178.9	0	0	0	111.6	L98 L102 L103 F104 F160	L98-L100 PolarHBondContact O-N 3.16Å; L100-L102 VanDerWaalsContact C-N 3.34Å; L100-L102 PolarHBondContact O-N 3.37Å; L100-L103 HydrophobicContact CB-CB 4.33Å; L100-L103 HydrophobicContact CB-CD1 4.23Å; L100-L103 HydrophobicContact CD1-CD1 4.29Å; L100-L103 HydrophobicContact CD2-CD1 4.11Å; L100-L103 HydrophobicContact CG-CD1 4.43Å; L100-L103 PolarHBondContact O-N 3.04Å; L100-F104 PolarHBondContact O-N 3.12Å; L100-F160 HydrophobicContact CD2-CB 3.95Å; L100-F160 HydrophobicContact CD2-CD2 4.09Å; L100-F160 HydrophobicContact CD2-CG 4.24Å
101	G	93.5	Very high	92.8	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-56.4	-41.4	-174.8	0	0	0	0	0	114.1	L98 F104 I105 F160	L98-G101 PolarHBondContact O-N 3.4Å; G101-F104 WeakPolarHBondContact O-CB 3.46Å; G101-F104 PolarHBondContact O-N 2.97Å; G101-I105 PolarHBondContact O-N 3.32Å; G101-F160 PolarHBondContact N-O 3.18Å
102	L	93.3	Very high	93	Very high	15 Å²	15	59.8 Å²	59.8	8%	0.079	34%	0.343	C	S	.	.	H	α-helix	trans	-69.9	-40.5	179	-165.8	78.2	0	0	0	112.9	L100 F104 I105 L106 L150 L154 F160 L162	L100-L102 VanDerWaalsContact C-N 3.34Å; L100-L102 PolarHBondContact O-N 3.37Å; L102-F104 PolarHBondContact O-N 3.1Å; L102-I105 WeakPolarHBondContact O-CB 3.4Å; L102-I105 PolarHBondContact O-N 2.92Å; L102-I105 VanDerWaalsContact O-N 3.14Å; L102-L106 PolarHBondContact O-N 2.87Å; L102-L150 HydrophobicContact CD1-CD1 4.33Å; L102-L150 HydrophobicContact CD1-CD2 4.21Å; L102-L150 HydrophobicContact CD2-CB 3.96Å; L102-L150 HydrophobicContact CD2-CD1 4.34Å; L102-L150 HydrophobicContact CD2-CD2 4.23Å; L102-L150 HydrophobicContact CD2-CG 4.41Å; L102-L150 HydrophobicContact CG-CD1 4.47Å; L102-L154 HydrophobicContact CB-CD1 4.44Å; L102-L154 HydrophobicContact CD2-CD1 3.2Å; L102-L154 HydrophobicContact CD2-CD2 3.88Å; L102-L154 HydrophobicContact CD2-CG 3.55Å; L102-L154 HydrophobicContact CG-CD1 4.41Å; L102-F160 PolarHBondContact N-O 3.37Å; L102-F160 VanDerWaalsContact N-O 3.09Å; L102-L162 HydrophobicContact CB-CD2 4.4Å; L102-L162 HydrophobicContact CD1-CD2 3.82Å
103	L	93.9	Very high	93.4	Very high	74 Å²	74	55.3 Å²	55.3	39%	0.387	31%	0.313	S	S	.	.	H	α-helix	trans	-63.5	-35.1	176.2	-71.8	169.4	0	0	0	111	L100 L106 A107 F160	L100-L103 HydrophobicContact CB-CB 4.33Å; L100-L103 HydrophobicContact CB-CD1 4.23Å; L100-L103 HydrophobicContact CD1-CD1 4.29Å; L100-L103 HydrophobicContact CD2-CD1 4.11Å; L100-L103 HydrophobicContact CG-CD1 4.43Å; L100-L103 PolarHBondContact O-N 3.04Å; L103-L106 PolarHBondContact O-N 3.49Å; L103-A107 WeakPolarHBondContact O-CB 3.14Å; L103-A107 PolarHBondContact O-N 2.98Å; L103-F160 HydrophobicContact CD1-CD1 3.96Å; L103-F160 HydrophobicContact CD1-CE1 4.14Å; L103-F160 HydrophobicContact CD1-CG 4.17Å; L103-F160 HydrophobicContact CD2-CD1 4.39Å; L103-F160 HydrophobicContact CD2-CE1 4.21Å; L103-F160 HydrophobicContact CG-CD1 3.77Å; L103-F160 HydrophobicContact CG-CE1 4.05Å; L103-F160 HydrophobicContact CG-CG 4.38Å
104	F	95.3	Very high	93.5	Very high	64 Å²	64	54.6 Å²	54.6	28%	0.281	30%	0.302	S	S	.	.	H	α-helix	trans	-61.5	-43.3	172.6	176.3	-90.1	0	0	0	111.9	P88 L98 L100 G101 L102 A107 T108	P88-F104 HydrophobicContact CB-CD1 4.45Å; P88-F104 HydrophobicContact CG-CD1 3.86Å; P88-F104 HydrophobicContact CG-CE1 4.2Å; L98-F104 HydrophobicContact CD1-CB 4.1Å; L98-F104 HydrophobicContact CD1-CD1 4.26Å; L98-F104 HydrophobicContact CD1-CD2 4.08Å; L98-F104 HydrophobicContact CD1-CG 3.88Å; L100-F104 PolarHBondContact O-N 3.12Å; G101-F104 WeakPolarHBondContact O-CB 3.46Å; G101-F104 PolarHBondContact O-N 2.97Å; L102-F104 PolarHBondContact O-N 3.1Å; F104-A107 PolarHBondContact O-N 2.73Å; F104-T108 HydrophobicContact CD1-CG2 4.27Å; F104-T108 HydrophobicContact CD2-CG2 4.26Å; F104-T108 HydrophobicContact CE1-CG2 3.88Å; F104-T108 HydrophobicContact CE2-CG2 3.86Å; F104-T108 HydrophobicContact CG-CG2 4.47Å; F104-T108 HydrophobicContact CZ-CG2 3.66Å; F104-T108 WeakPolarHBondContact O-CB 3.39Å; F104-T108 WeakPolarHBondContact O-CG2 3.42Å; F104-T108 PolarHBondContact O-N 3.14Å; F104-T108 PolarHBondContact O-OG1 3.43Å
105	I	94.8	Very high	93.6	Very high	36 Å²	36	54 Å²	54	19%	0.185	30%	0.298	C	S	.	.	H	α-helix	trans	-60.4	-47.2	175.3	-68.5	176.8	0	0	0	110.7	L85 P88 L89 G101 L102 A107 T108 S109 L162	L85-I105 HydrophobicContact CD2-CB 4.4Å; L85-I105 HydrophobicContact CD2-CG2 3.95Å; P88-I105 HydrophobicContact CG-CD1 4.1Å; P88-I105 HydrophobicContact CG-CG1 3.82Å; L89-I105 HydrophobicContact CD2-CD1 3.92Å; G101-I105 PolarHBondContact O-N 3.32Å; L102-I105 WeakPolarHBondContact O-CB 3.4Å; L102-I105 PolarHBondContact O-N 2.92Å; L102-I105 VanDerWaalsContact O-N 3.14Å; I105-A107 PolarHBondContact O-N 3.4Å; I105-T108 PolarHBondContact O-N 3.34Å; I105-T108 PolarHBondContact O-OG1 2.93Å; I105-T108 VanDerWaalsContact O-OG1 3.1Å; I105-S109 WeakPolarHBondContact O-CB 3.31Å; I105-S109 PolarHBondContact O-N 3.39Å; I105-S109 PolarHBondContact O-OG 3.02Å; I105-L162 HydrophobicContact CD1-CD1 3.59Å
106	L	93.8	Very high	93.7	Very high	31 Å²	31	53.8 Å²	53.8	16%	0.162	30%	0.296	C	S	.	.	H	α-helix	trans	-62.9	-40.5	178.2	-80.2	169.5	0	0	0	113.2	L102 L103 S109 S110 L146 A147 L150	L102-L106 PolarHBondContact O-N 2.87Å; L103-L106 PolarHBondContact O-N 3.49Å; L106-S109 WeakPolarHBondContact CA-OG 3.12Å; L106-S109 PolarHBondContact O-OG 3.47Å; L106-S110 PolarHBondContact O-N 2.92Å; L106-S110 PolarHBondContact O-OG 3.03Å; L106-L146 HydrophobicContact CD2-CD2 4.01Å; L106-L146 HydrophobicContact CD2-CG 4.26Å; L106-A147 HydrophobicContact CD1-CB 4.5Å; L106-A147 HydrophobicContact CD2-CB 4.38Å; L106-L150 HydrophobicContact CD1-CD1 4.12Å; L106-L150 HydrophobicContact CD2-CD1 3.83Å; L106-L150 HydrophobicContact CG-CD1 4Å
107	A	94.3	Very high	93.8	Very high	59 Å²	59	53.2 Å²	53.2	49%	0.488	29%	0.291	S	S	.	.	H	α-helix	trans	-70.1	-38.7	178.4	0	0	0	0	0	111.8	L103 F104 I105 S110 L111	L103-A107 WeakPolarHBondContact O-CB 3.14Å; L103-A107 PolarHBondContact O-N 2.98Å; F104-A107 PolarHBondContact O-N 2.73Å; I105-A107 PolarHBondContact O-N 3.4Å; A107-S110 PolarHBondContact O-OG 3.37Å; A107-L111 PolarHBondContact O-N 3.26Å
108	T	94.8	Very high	93.9	Very high	17 Å²	17	52.6 Å²	52.6	10%	0.104	28%	0.281	C	S	.	.	H	α-helix	trans	-75	-33.1	178.7	49.9	0	0	0	0	112.4	I81 L85 F104 I105 L111 A112	I81-T108 VanDerWaalsContact CG2-O 3.26Å; I81-T108 WeakPolarHBondContact CG2-O 3.36Å; L85-T108 WeakPolarHBondContact CD2-OG1 3.32Å; F104-T108 HydrophobicContact CD1-CG2 4.27Å; F104-T108 HydrophobicContact CD2-CG2 4.26Å; F104-T108 HydrophobicContact CE1-CG2 3.88Å; F104-T108 HydrophobicContact CE2-CG2 3.86Å; F104-T108 HydrophobicContact CG-CG2 4.47Å; F104-T108 HydrophobicContact CZ-CG2 3.66Å; F104-T108 WeakPolarHBondContact O-CB 3.39Å; F104-T108 WeakPolarHBondContact O-CG2 3.42Å; F104-T108 PolarHBondContact O-N 3.14Å; F104-T108 PolarHBondContact O-OG1 3.43Å; I105-T108 PolarHBondContact O-N 3.34Å; I105-T108 PolarHBondContact O-OG1 2.93Å; I105-T108 VanDerWaalsContact O-OG1 3.1Å; T108-L111 WeakPolarHBondContact O-CB 3.38Å; T108-L111 PolarHBondContact O-N 3.43Å; T108-A112 PolarHBondContact O-N 2.95Å
109	S	92.9	Very high	93.9	Very high	27 Å²	27	52.5 Å²	52.5	19%	0.189	29%	0.285	C	S	.	.	H	α-helix	trans	-63.9	-42.3	172.9	64.5	0	0	0	0	111.9	I105 L106 L111 A112	I105-S109 WeakPolarHBondContact O-CB 3.31Å; I105-S109 PolarHBondContact O-N 3.39Å; I105-S109 PolarHBondContact O-OG 3.02Å; L106-S109 WeakPolarHBondContact CA-OG 3.12Å; L106-S109 PolarHBondContact O-OG 3.47Å; S109-L111 PolarHBondContact O-N 3.48Å; S109-A112 WeakPolarHBondContact O-CB 3.35Å; S109-A112 PolarHBondContact O-N 3.01Å
110	S	92.7	Very high	93.8	Very high	46 Å²	46	47 Å²	47	32%	0.322	26%	0.257	S	S	.	.	H	α-helix	trans	-65.3	-26.9	176.2	59.3	0	0	0	0	113.5	L106 A107 A112 E143	L106-S110 PolarHBondContact O-N 2.92Å; L106-S110 PolarHBondContact O-OG 3.03Å; A107-S110 PolarHBondContact O-OG 3.37Å; S110-A112 VanDerWaalsContact C-N 3.29Å; S110-A112 PolarHBondContact O-N 2.74Å; S110-E143 VanDerWaalsContact CA-OE1 3.28Å; S110-E143 WeakPolarHBondContact CA-OE1 3.37Å; S110-E143 VanDerWaalsContact CB-OE2 3.25Å; S110-E143 WeakPolarHBondContact CB-OE2 3.26Å
111	L	93.8	Very high	93.7	Very high	80 Å²	80	49.9 Å²	49.9	42%	0.419	26%	0.261	S	S	.	.	H	α-helix	trans	-68.8	-27.5	171.9	-165.7	70.8	0	0	0	112.5	I81 A107 T108 S109 V113 Y114	I81-L111 HydrophobicContact CD1-CB 4.02Å; I81-L111 HydrophobicContact CD1-CD2 3.85Å; I81-L111 HydrophobicContact CD1-CG 3.74Å; I81-L111 HydrophobicContact CG1-CD2 4.14Å; A107-L111 PolarHBondContact O-N 3.26Å; T108-L111 WeakPolarHBondContact O-CB 3.38Å; T108-L111 PolarHBondContact O-N 3.43Å; S109-L111 PolarHBondContact O-N 3.48Å; L111-V113 PolarHBondContact O-N 3.23Å; L111-Y114 HydrophobicContact CD1-CD2 3.81Å; L111-Y114 HydrophobicContact CD1-CE2 4.15Å; L111-Y114 WeakPolarHBondContact O-CD2 3.33Å; L111-Y114 PolarHBondContact O-N 2.88Å
112	A	93.1	Very high	93.6	Very high	32 Å²	32	49.8 Å²	49.8	26%	0.264	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-29.3	-178.1	0	0	0	0	0	112.4	I81 T108 S109 S110 Y114 S115	I81-A112 HydrophobicContact CG2-CB 4.06Å; T108-A112 PolarHBondContact O-N 2.95Å; S109-A112 WeakPolarHBondContact O-CB 3.35Å; S109-A112 PolarHBondContact O-N 3.01Å; S110-A112 VanDerWaalsContact C-N 3.29Å; S110-A112 PolarHBondContact O-N 2.74Å; A112-Y114 PolarHBondContact O-N 2.88Å; A112-S115 WeakPolarHBondContact O-CB 3.25Å; A112-S115 PolarHBondContact O-N 3.41Å; A112-S115 VanDerWaalsContact O-N 3.07Å; A112-S115 PolarHBondContact O-OG 3.32Å
113	V	94.9	Very high	93.2	Very high	15 Å²	15	50 Å²	50	9%	0.091	26%	0.263	C	S	.	.	H	α-helix	trans	-57.4	-34.9	177.9	-176	0	0	0	0	112.2	L111 S115 I116 L117 V136 T139 E143	L111-V113 PolarHBondContact O-N 3.23Å; V113-S115 VanDerWaalsContact C-N 3.3Å; V113-S115 PolarHBondContact O-N 3.35Å; V113-I116 PolarHBondContact O-N 3.17Å; V113-L117 PolarHBondContact O-N 2.9Å; V113-L117 VanDerWaalsContact O-N 3.1Å; V113-V136 HydrophobicContact CG1-CB 4.08Å; V113-V136 HydrophobicContact CG1-CG1 3.81Å; V113-V136 HydrophobicContact CG1-CG2 3.73Å; V113-T139 WeakPolarHBondContact CG1-OG1 3.49Å; V113-T139 HydrophobicContact CG2-CG2 4.38Å; V113-T139 VanDerWaalsContact CG2-OG1 3.26Å; V113-T139 WeakPolarHBondContact CG2-OG1 3.41Å; V113-E143 WeakPolarHBondContact CG2-OE1 3.5Å
114	Y	93.3	Very high	93	Very high	120 Å²	120	51.6 Å²	51.6	47%	0.471	27%	0.272	S	S	.	.	H	α-helix	trans	-65.4	-32.8	178.4	-68.9	-76.7	0	0	0	112.8	L111 A112 I116 L117 W118	L111-Y114 HydrophobicContact CD1-CD2 3.81Å; L111-Y114 HydrophobicContact CD1-CE2 4.15Å; L111-Y114 WeakPolarHBondContact O-CD2 3.33Å; L111-Y114 PolarHBondContact O-N 2.88Å; A112-Y114 PolarHBondContact O-N 2.88Å; Y114-I116 VanDerWaalsContact C-N 3.29Å; Y114-I116 PolarHBondContact O-N 2.91Å; Y114-L117 PolarHBondContact O-N 3.48Å; Y114-W118 WeakPolarHBondContact O-CB 3.31Å; Y114-W118 PolarHBondContact O-N 2.93Å
115	S	94.8	Very high	92.7	Very high	13 Å²	13	51.1 Å²	51.1	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-39.7	177.5	73.3	0	0	0	0	111.5	A112 V113 S119	A112-S115 WeakPolarHBondContact O-CB 3.25Å; A112-S115 PolarHBondContact O-N 3.41Å; A112-S115 VanDerWaalsContact O-N 3.07Å; A112-S115 PolarHBondContact O-OG 3.32Å; V113-S115 VanDerWaalsContact C-N 3.3Å; V113-S115 PolarHBondContact O-N 3.35Å; S115-S119 WeakPolarHBondContact O-CB 3.36Å; S115-S119 PolarHBondContact O-N 3.34Å; S115-S119 VanDerWaalsContact O-N 3.08Å; S115-S119 PolarHBondContact O-OG 3.32Å
116	I	94.1	Very high	92.5	Very high	60 Å²	60	55.5 Å²	55.5	31%	0.308	30%	0.301	S	S	.	.	H	α-helix	trans	-68.6	-48.9	177.5	-58	170.7	0	0	0	109.8	V113 Y114 W118 S119 G120 A135	V113-I116 PolarHBondContact O-N 3.17Å; Y114-I116 VanDerWaalsContact C-N 3.29Å; Y114-I116 PolarHBondContact O-N 2.91Å; I116-W118 PolarHBondContact O-N 3.13Å; I116-S119 PolarHBondContact O-N 3.24Å; I116-S119 PolarHBondContact O-OG 2.64Å; I116-G120 PolarHBondContact O-N 3.14Å; I116-A135 HydrophobicContact CG2-CB 3.82Å
117	L	94.3	Very high	92.5	Very high	53 Å²	53	64 Å²	64	28%	0.277	33%	0.332	S	S	.	.	H	α-helix	trans	-59.7	-47.5	-179.8	-177.2	65.3	0	0	0	112	V113 Y114 S119 G120 W121 L133 V136	V113-L117 PolarHBondContact O-N 2.9Å; V113-L117 VanDerWaalsContact O-N 3.1Å; Y114-L117 PolarHBondContact O-N 3.48Å; L117-S119 VanDerWaalsContact C-N 3.35Å; L117-S119 PolarHBondContact O-N 3.46Å; L117-G120 PolarHBondContact O-N 2.92Å; L117-W121 PolarHBondContact O-N 2.95Å; L117-L133 HydrophobicContact CD1-CD2 4.38Å; L117-V136 HydrophobicContact CB-CG2 3.97Å; L117-V136 HydrophobicContact CD1-CG2 4.22Å
118	W	93.8	Very high	92.4	Very high	91 Å²	91	62.8 Å²	62.8	35%	0.345	32%	0.322	S	S	.	.	H	α-helix	trans	-64.1	-39.8	179.2	-68.7	-5.2	0	0	0	111.7	L70 A74 L77 Y114 I116 G120 A122	L70-W118 HydrophobicContact CD2-CB 4.4Å; L70-W118 HydrophobicContact CD2-CD2 4Å; L70-W118 HydrophobicContact CD2-CE3 4.18Å; L70-W118 HydrophobicContact CD2-CG 4.1Å; A74-W118 HydrophobicContact CB-CB 4.08Å; L77-W118 HydrophobicContact CD2-CE3 4.09Å; L77-W118 HydrophobicContact CD2-CH2 4.44Å; L77-W118 HydrophobicContact CD2-CZ3 3.81Å; Y114-W118 WeakPolarHBondContact O-CB 3.31Å; Y114-W118 PolarHBondContact O-N 2.93Å; I116-W118 PolarHBondContact O-N 3.13Å; W118-G120 PolarHBondContact O-N 2.92Å; W118-A122 WeakPolarHBondContact O-CB 3.35Å; W118-A122 PolarHBondContact O-N 3.45Å
119	S	92.3	Very high	92.3	Very high	55 Å²	55	64.8 Å²	64.8	39%	0.385	33%	0.332	S	S	.	.	H	α-helix	trans	-62.9	-41.6	176.7	75.5	0	0	0	0	112.5	S115 I116 L117 S123	S115-S119 WeakPolarHBondContact O-CB 3.36Å; S115-S119 PolarHBondContact O-N 3.34Å; S115-S119 VanDerWaalsContact O-N 3.08Å; S115-S119 PolarHBondContact O-OG 3.32Å; I116-S119 PolarHBondContact O-N 3.24Å; I116-S119 PolarHBondContact O-OG 2.64Å; L117-S119 VanDerWaalsContact C-N 3.35Å; L117-S119 PolarHBondContact O-N 3.46Å; S119-S123 PolarHBondContact O-N 2.85Å
120	G	91.8	Very high	92.4	Very high	5 Å²	5	68.2 Å²	68.2	5%	0.052	35%	0.347	C	S	.	.	H	α-helix	trans	-66.3	-49.6	178.3	0	0	0	0	0	112.3	I116 L117 W118 S123	I116-G120 PolarHBondContact O-N 3.14Å; L117-G120 PolarHBondContact O-N 2.92Å; W118-G120 PolarHBondContact O-N 2.92Å; G120-S123 PolarHBondContact O-N 3.11Å; G120-S123 PolarHBondContact O-OG 3.48Å
121	W	91.7	Very high	92.5	Very high	153 Å²	153	67.7 Å²	67.7	58%	0.58	35%	0.35	S	S	*	.	H	α-helix	trans	-65.4	-40.3	178.9	-168.6	69.6	0	0	0	112.2	L70 L117 S123 N124 L129	L70-W121 HydrophobicContact CD1-CE3 3.35Å; L70-W121 HydrophobicContact CD1-CZ3 3.34Å; L117-W121 PolarHBondContact O-N 2.95Å; W121-S123 VanDerWaalsContact C-N 3.27Å; W121-S123 PolarHBondContact O-N 2.97Å; W121-N124 PolarHBondContact O-N 3.47Å; W121-L129 HydrophobicContact CB-CD1 4.39Å
122	A	91.3	Very high	92.6	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-64.5	-29.7	-179.2	0	0	0	0	0	113.6	S66 T67 L70 W118 N124	S66-A122 CarbonylContact C-O 3.35Å; S66-A122 WeakPolarHBondContact CA-O 3.39Å; S66-A122 WeakPolarHBondContact CB-O 3.3Å; T67-A122 PolarHBondContact N-O 2.88Å; T67-A122 WeakPolarHBondContact OG1-CA 3.18Å; T67-A122 WeakPolarHBondContact OG1-CB 3.45Å; L70-A122 HydrophobicContact CB-CB 3.7Å; W118-A122 WeakPolarHBondContact O-CB 3.35Å; W118-A122 PolarHBondContact O-N 3.45Å; A122-N124 PolarHBondContact O-N 3.31Å
123	S	86.7	Confident	92.7	Very high	19 Å²	19	67.2 Å²	67.2	13%	0.133	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-13.4	-178.4	74	0	0	0	0	114.7	S119 G120 W121 S125 A128	S119-S123 PolarHBondContact O-N 2.85Å; G120-S123 PolarHBondContact O-N 3.11Å; G120-S123 PolarHBondContact O-OG 3.48Å; W121-S123 VanDerWaalsContact C-N 3.27Å; W121-S123 PolarHBondContact O-N 2.97Å; S123-S125 PolarHBondContact O-N 3.36Å; S123-S125 VanDerWaalsContact O-N 3.15Å; S123-S125 PolarHBondContact OG-OG 3.01Å; S123-A128 WeakPolarHBondContact OG-CB 3.22Å
124	N	88.5	Confident	92.8	Very high	107 Å²	107	75.3 Å²	75.3	57%	0.572	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	41.1	-179.6	-160.5	14.9	0	0	0	114.1	T65 W121 A122	T65-N124 WeakPolarHBondContact O-CB 3.48Å; T65-N124 PolarHBondContact O-ND2 2.95Å; W121-N124 PolarHBondContact O-N 3.47Å; A122-N124 PolarHBondContact O-N 3.31Å
125	S	89.7	Confident	92.9	Very high	54 Å²	54	71 Å²	71	38%	0.378	36%	0.361	S	S	.	.			trans	-124.7	134.7	172.9	70.9	0	0	0	0	110	S123 Y127 A128 L129	S123-S125 PolarHBondContact O-N 3.36Å; S123-S125 VanDerWaalsContact O-N 3.15Å; S123-S125 PolarHBondContact OG-OG 3.01Å; S125-Y127 VanDerWaalsContact C-N 3.26Å; S125-Y127 PolarHBondContact O-N 3.21Å; S125-A128 PolarHBondContact O-N 3.08Å; S125-A128 WeakPolarHBondContact OG-CB 3.4Å; S125-A128 PolarHBondContact OG-N 3.38Å; S125-L129 PolarHBondContact O-N 3.49Å
126	N	90.3	Very high	92.9	Very high	128 Å²	128	71.4 Å²	71.4	68%	0.684	36%	0.363	S	S	*	.	H	α-helix	trans	-59.5	-37.9	-175.1	-69.2	-21.9	0	0	0	112.2	L129 I130	N126-L129 PolarHBondContact O-N 3.15Å; N126-I130 WeakPolarHBondContact O-CD1 3.4Å; N126-I130 VanDerWaalsContact O-CG1 3.26Å; N126-I130 WeakPolarHBondContact O-CG1 3.48Å; N126-I130 PolarHBondContact O-N 3.46Å
127	Y	93.5	Very high	92.9	Very high	209 Å²	209	71.5 Å²	71.5	82%	0.82	37%	0.373	S	S	*	.	H	α-helix	trans	-67.3	-41.9	178.3	-72.1	-74.1	0	0	0	113	S125 L129 I130 G131	S125-Y127 VanDerWaalsContact C-N 3.26Å; S125-Y127 PolarHBondContact O-N 3.21Å; Y127-L129 VanDerWaalsContact C-N 3.33Å; Y127-I130 PolarHBondContact O-N 3.28Å; Y127-G131 PolarHBondContact O-N 2.74Å
128	A	91.8	Very high	93	Very high	35 Å²	35	73.5 Å²	73.5	29%	0.289	38%	0.381	S	S	.	.	H	α-helix	trans	-67.5	-37	177	0	0	0	0	0	111.5	S123 S125 G131 A132	S123-A128 WeakPolarHBondContact OG-CB 3.22Å; S125-A128 PolarHBondContact O-N 3.08Å; S125-A128 WeakPolarHBondContact OG-CB 3.4Å; S125-A128 PolarHBondContact OG-N 3.38Å; A128-G131 PolarHBondContact O-N 3.09Å; A128-A132 WeakPolarHBondContact O-CB 3.25Å; A128-A132 PolarHBondContact O-N 3.12Å
129	L	93.1	Very high	93.1	Very high	59 Å²	59	70.7 Å²	70.7	31%	0.309	37%	0.374	S	S	.	.	H	α-helix	trans	-65.3	-46.2	175.9	-175.3	63.6	0	0	0	111.8	W121 S125 N126 Y127 G131 A132 L133	W121-L129 HydrophobicContact CB-CD1 4.39Å; S125-L129 PolarHBondContact O-N 3.49Å; N126-L129 PolarHBondContact O-N 3.15Å; Y127-L129 VanDerWaalsContact C-N 3.33Å; L129-G131 VanDerWaalsContact C-N 3.31Å; L129-G131 PolarHBondContact O-N 2.98Å; L129-A132 PolarHBondContact O-N 3.37Å; L129-L133 HydrophobicContact CG-CD1 4.39Å; L129-L133 WeakPolarHBondContact O-CG 3.26Å; L129-L133 PolarHBondContact O-N 3.49Å
130	I	95.1	Very high	93.1	Very high	98 Å²	98	72.3 Å²	72.3	50%	0.503	38%	0.377	S	S	.	.	H	α-helix	trans	-60.9	-42.6	175.3	-67.9	164.7	0	0	0	110.4	N126 Y127 L133 R134	N126-I130 WeakPolarHBondContact O-CD1 3.4Å; N126-I130 VanDerWaalsContact O-CG1 3.26Å; N126-I130 WeakPolarHBondContact O-CG1 3.48Å; N126-I130 PolarHBondContact O-N 3.46Å; Y127-I130 PolarHBondContact O-N 3.28Å; I130-L133 PolarHBondContact O-N 2.93Å; I130-R134 VanDerWaalsContact O-CG 3.31Å; I130-R134 WeakPolarHBondContact O-CG 3.33Å; I130-R134 PolarHBondContact O-N 3.38Å
131	G	95.8	Very high	93.2	Very high	36 Å²	36	75.2 Å²	75.2	37%	0.371	40%	0.396	S	S	.	.	H	α-helix	trans	-60.5	-44.7	176	0	0	0	0	0	112.7	Y127 A128 L129 R134 A135	Y127-G131 PolarHBondContact O-N 2.74Å; A128-G131 PolarHBondContact O-N 3.09Å; L129-G131 VanDerWaalsContact C-N 3.31Å; L129-G131 PolarHBondContact O-N 2.98Å; G131-R134 PolarHBondContact O-N 3.43Å; G131-A135 PolarHBondContact O-N 3.17Å
132	A	95	Very high	93.3	Very high	4 Å²	4	72.1 Å²	72.1	3%	0.033	39%	0.385	C	S	.	.	H	α-helix	trans	-65.4	-44.1	177.9	0	0	0	0	0	112.3	A128 L129 R134 A135 V136	A128-A132 WeakPolarHBondContact O-CB 3.25Å; A128-A132 PolarHBondContact O-N 3.12Å; L129-A132 PolarHBondContact O-N 3.37Å; A132-R134 VanDerWaalsContact C-N 3.29Å; A132-R134 PolarHBondContact O-N 3.49Å; A132-A135 PolarHBondContact O-N 3.01Å; A132-V136 WeakPolarHBondContact O-CB 3.37Å; A132-V136 WeakPolarHBondContact O-CG2 3.29Å; A132-V136 PolarHBondContact O-N 2.92Å
133	L	95.1	Very high	93.5	Very high	98 Å²	98	74.3 Å²	74.3	51%	0.513	40%	0.395	S	S	.	.	H	α-helix	trans	-61.7	-37.9	176.5	-71.4	173	0	0	0	112.2	L117 L129 I130 A137	L117-L133 HydrophobicContact CD1-CD2 4.38Å; L129-L133 HydrophobicContact CG-CD1 4.39Å; L129-L133 WeakPolarHBondContact O-CG 3.26Å; L129-L133 PolarHBondContact O-N 3.49Å; I130-L133 PolarHBondContact O-N 2.93Å; L133-A137 WeakPolarHBondContact O-CB 3.36Å; L133-A137 PolarHBondContact O-N 3.28Å
134	R	96.3	Very high	93.8	Very high	185 Å²	185	77.5 Å²	77.5	70%	0.698	41%	0.414	S	S	*	.	H	α-helix	trans	-65	-46	174.6	-73.9	177.5	64	173.9	0.2	112.1	I130 G131 A132 V136 A137 Q138	I130-R134 VanDerWaalsContact O-CG 3.31Å; I130-R134 WeakPolarHBondContact O-CG 3.33Å; I130-R134 PolarHBondContact O-N 3.38Å; G131-R134 PolarHBondContact O-N 3.43Å; A132-R134 VanDerWaalsContact C-N 3.29Å; A132-R134 PolarHBondContact O-N 3.49Å; R134-V136 VanDerWaalsContact C-N 3.34Å; R134-A137 PolarHBondContact O-N 2.92Å; R134-Q138 WeakPolarHBondContact O-CB 3.42Å; R134-Q138 PolarHBondContact O-N 3.37Å
135	A	95.2	Very high	94.1	Very high	28 Å²	28	75.3 Å²	75.3	23%	0.231	40%	0.404	C	S	.	.	H	α-helix	trans	-62.1	-42.5	177.5	0	0	0	0	0	111.5	I116 G131 A132 Q138 T139	I116-A135 HydrophobicContact CG2-CB 3.82Å; G131-A135 PolarHBondContact O-N 3.17Å; A132-A135 PolarHBondContact O-N 3.01Å; A135-Q138 WeakPolarHBondContact O-CB 3.46Å; A135-Q138 PolarHBondContact O-N 2.89Å; A135-T139 WeakPolarHBondContact O-CG2 3.18Å; A135-T139 PolarHBondContact O-N 3.32Å; A135-T139 PolarHBondContact O-OG1 3.21Å
136	V	95.6	Very high	94.3	Very high	22 Å²	22	74 Å²	74	13%	0.133	39%	0.393	C	S	.	.	H	α-helix	trans	-64	-43.9	177.2	171.4	0	0	0	0	111.7	V113 L117 A132 R134 Q138 T139 I140	V113-V136 HydrophobicContact CG1-CB 4.08Å; V113-V136 HydrophobicContact CG1-CG1 3.81Å; V113-V136 HydrophobicContact CG1-CG2 3.73Å; L117-V136 HydrophobicContact CB-CG2 3.97Å; L117-V136 HydrophobicContact CD1-CG2 4.22Å; A132-V136 WeakPolarHBondContact O-CB 3.37Å; A132-V136 WeakPolarHBondContact O-CG2 3.29Å; A132-V136 PolarHBondContact O-N 2.92Å; R134-V136 VanDerWaalsContact C-N 3.34Å; V136-Q138 VanDerWaalsContact C-N 3.27Å; V136-Q138 PolarHBondContact O-N 2.98Å; V136-T139 PolarHBondContact O-N 3.27Å; V136-T139 PolarHBondContact O-OG1 3.48Å; V136-T139 VanDerWaalsContact O-OG1 3.07Å; V136-I140 HydrophobicContact CG1-CD1 3.64Å; V136-I140 HydrophobicContact CG1-CG1 4.42Å; V136-I140 VanDerWaalsContact O-CG1 3.29Å; V136-I140 WeakPolarHBondContact O-CG1 3.34Å; V136-I140 PolarHBondContact O-N 2.9Å; V136-I140 VanDerWaalsContact O-N 3.09Å
137	A	94.8	Very high	94.5	Very high	63 Å²	63	69.8 Å²	69.8	52%	0.521	38%	0.376	S	S	.	.	H	α-helix	trans	-61.2	-39.5	176.1	0	0	0	0	0	111.6	L133 R134 S141	L133-A137 WeakPolarHBondContact O-CB 3.36Å; L133-A137 PolarHBondContact O-N 3.28Å; R134-A137 PolarHBondContact O-N 2.92Å; A137-S141 WeakPolarHBondContact O-CB 3.37Å; A137-S141 PolarHBondContact O-N 2.85Å; A137-S141 PolarHBondContact O-OG 2.78Å
138	Q	96	Very high	94.5	Very high	95 Å²	95	65.1 Å²	65.1	44%	0.444	36%	0.364	S	S	.	.	H	α-helix	trans	-63.1	-56.3	174.9	178.7	171.8	-13.7	0	0	111.2	R134 A135 V136 I140 S141 Y142 A191	R134-Q138 WeakPolarHBondContact O-CB 3.42Å; R134-Q138 PolarHBondContact O-N 3.37Å; A135-Q138 WeakPolarHBondContact O-CB 3.46Å; A135-Q138 PolarHBondContact O-N 2.89Å; V136-Q138 VanDerWaalsContact C-N 3.27Å; V136-Q138 PolarHBondContact O-N 2.98Å; Q138-I140 VanDerWaalsContact C-N 3.35Å; Q138-I140 PolarHBondContact O-N 2.69Å; Q138-S141 PolarHBondContact O-N 3.43Å; Q138-S141 VanDerWaalsContact O-N 3.1Å; Q138-S141 PolarHBondContact O-OG 3.18Å; Q138-Y142 HydrophobicContact CG-CD2 3.86Å; Q138-Y142 HydrophobicContact CG-CE2 3.87Å; Q138-Y142 VanDerWaalsContact O-CD2 3.24Å; Q138-Y142 WeakPolarHBondContact O-CD2 3.47Å; Q138-Y142 PolarHBondContact O-N 3.47Å; Q138-Y142 VanDerWaalsContact O-N 3.15Å; Q138-A191 PolarHBondContact NE2-O 3.03Å
139	T	94.8	Very high	94.7	Very high	32 Å²	32	64.1 Å²	64.1	20%	0.196	35%	0.354	C	S	.	.	H	α-helix	trans	-59.1	-44	-175.6	55.3	0	0	0	0	112.4	V113 A135 V136 S141 Y142 E143	V113-T139 WeakPolarHBondContact CG1-OG1 3.49Å; V113-T139 HydrophobicContact CG2-CG2 4.38Å; V113-T139 VanDerWaalsContact CG2-OG1 3.26Å; V113-T139 WeakPolarHBondContact CG2-OG1 3.41Å; A135-T139 WeakPolarHBondContact O-CG2 3.18Å; A135-T139 PolarHBondContact O-N 3.32Å; A135-T139 PolarHBondContact O-OG1 3.21Å; V136-T139 PolarHBondContact O-N 3.27Å; V136-T139 PolarHBondContact O-OG1 3.48Å; V136-T139 VanDerWaalsContact O-OG1 3.07Å; T139-S141 VanDerWaalsContact C-N 3.33Å; T139-S141 PolarHBondContact O-N 3.34Å; T139-Y142 PolarHBondContact O-N 3.49Å; T139-E143 WeakPolarHBondContact O-CB 3.4Å; T139-E143 VanDerWaalsContact O-CG 3.29Å; T139-E143 WeakPolarHBondContact O-CG 3.34Å; T139-E143 PolarHBondContact O-N 3.29Å
140	I	92.8	Very high	94.6	Very high	89 Å²	89	62.3 Å²	62.3	46%	0.456	34%	0.344	S	S	.	.	H	α-helix	trans	-63.4	-40.2	178.9	-64	168.8	0	0	0	111	V136 Q138 Y142 E143 V144	V136-I140 HydrophobicContact CG1-CD1 3.64Å; V136-I140 HydrophobicContact CG1-CG1 4.42Å; V136-I140 VanDerWaalsContact O-CG1 3.29Å; V136-I140 WeakPolarHBondContact O-CG1 3.34Å; V136-I140 PolarHBondContact O-N 2.9Å; V136-I140 VanDerWaalsContact O-N 3.09Å; Q138-I140 VanDerWaalsContact C-N 3.35Å; Q138-I140 PolarHBondContact O-N 2.69Å; I140-Y142 VanDerWaalsContact C-N 3.35Å; I140-Y142 PolarHBondContact O-N 3.28Å; I140-E143 PolarHBondContact O-N 3.27Å; I140-V144 PolarHBondContact O-N 2.71Å
141	S	94.6	Very high	94.6	Very high	65 Å²	65	62.1 Å²	62.1	46%	0.455	34%	0.343	S	S	.	.	H	α-helix	trans	-63.2	-40.4	179.5	71.1	0	0	0	0	112.6	A137 Q138 T139	A137-S141 WeakPolarHBondContact O-CB 3.37Å; A137-S141 PolarHBondContact O-N 2.85Å; A137-S141 PolarHBondContact O-OG 2.78Å; Q138-S141 PolarHBondContact O-N 3.43Å; Q138-S141 VanDerWaalsContact O-N 3.1Å; Q138-S141 PolarHBondContact O-OG 3.18Å; T139-S141 VanDerWaalsContact C-N 3.33Å; T139-S141 PolarHBondContact O-N 3.34Å
142	Y	94.3	Very high	94.4	Very high	89 Å²	89	62 Å²	62	35%	0.349	34%	0.337	S	S	.	.	H	α-helix	trans	-80.3	-30.7	-180	-73.2	-74.8	0	0	0	112.8	Q138 T139 I140 V144 T145 L146 A191	Q138-Y142 HydrophobicContact CG-CD2 3.86Å; Q138-Y142 HydrophobicContact CG-CE2 3.87Å; Q138-Y142 VanDerWaalsContact O-CD2 3.24Å; Q138-Y142 WeakPolarHBondContact O-CD2 3.47Å; Q138-Y142 PolarHBondContact O-N 3.47Å; Q138-Y142 VanDerWaalsContact O-N 3.15Å; T139-Y142 PolarHBondContact O-N 3.49Å; I140-Y142 VanDerWaalsContact C-N 3.35Å; I140-Y142 PolarHBondContact O-N 3.28Å; Y142-V144 VanDerWaalsContact C-N 3.3Å; Y142-V144 PolarHBondContact O-N 3.22Å; Y142-T145 PolarHBondContact O-N 3.43Å; Y142-T145 PolarHBondContact O-OG1 3.1Å; Y142-L146 WeakPolarHBondContact O-CB 3.4Å; Y142-L146 PolarHBondContact O-N 2.95Å; Y142-A191 HydrophobicContact CD1-CB 3.68Å; Y142-A191 HydrophobicContact CD2-CB 3.49Å; Y142-A191 VanDerWaalsContact CD2-CB 3.49Å; Y142-A191 HydrophobicContact CE1-CB 3.56Å; Y142-A191 HydrophobicContact CE2-CB 3.41Å; Y142-A191 VanDerWaalsContact CE2-CB 3.41Å; Y142-A191 HydrophobicContact CG-CB 3.64Å; Y142-A191 VanDerWaalsContact CZ-CB 3.42Å
143	E	93.8	Very high	94.2	Very high	46 Å²	46	62.8 Å²	62.8	22%	0.215	34%	0.341	C	S	.	.	H	α-helix	trans	-58.1	-39.4	174.7	-84.9	177	-162.4	0	0	113.1	S110 V113 T139 I140 T145 L146 A147	S110-E143 VanDerWaalsContact CA-OE1 3.28Å; S110-E143 WeakPolarHBondContact CA-OE1 3.37Å; S110-E143 VanDerWaalsContact CB-OE2 3.25Å; S110-E143 WeakPolarHBondContact CB-OE2 3.26Å; V113-E143 WeakPolarHBondContact CG2-OE1 3.5Å; T139-E143 WeakPolarHBondContact O-CB 3.4Å; T139-E143 VanDerWaalsContact O-CG 3.29Å; T139-E143 WeakPolarHBondContact O-CG 3.34Å; T139-E143 PolarHBondContact O-N 3.29Å; I140-E143 PolarHBondContact O-N 3.27Å; E143-T145 PolarHBondContact O-N 2.83Å; E143-L146 PolarHBondContact O-N 3.3Å; E143-A147 WeakPolarHBondContact O-CB 3.39Å; E143-A147 PolarHBondContact O-N 3.18Å
144	V	93.9	Very high	94.1	Very high	86 Å²	86	58.7 Å²	58.7	52%	0.521	32%	0.32	S	S	.	.	H	α-helix	trans	-61.2	-47.4	177.2	176.9	0	0	0	0	110.5	I140 Y142 A147 I148	I140-V144 PolarHBondContact O-N 2.71Å; Y142-V144 VanDerWaalsContact C-N 3.3Å; Y142-V144 PolarHBondContact O-N 3.22Å; V144-A147 PolarHBondContact O-N 3.21Å; V144-I148 HydrophobicContact CG1-CD1 4.16Å; V144-I148 WeakPolarHBondContact O-CG1 3.42Å; V144-I148 PolarHBondContact O-N 3.26Å
145	T	94.2	Very high	93.9	Very high	60 Å²	60	56.6 Å²	56.6	37%	0.368	32%	0.322	S	S	.	.	H	α-helix	trans	-66.6	-40.4	178.1	61.9	0	0	0	0	112	Y142 E143 A147 I148 I149	Y142-T145 PolarHBondContact O-N 3.43Å; Y142-T145 PolarHBondContact O-OG1 3.1Å; E143-T145 PolarHBondContact O-N 2.83Å; T145-A147 VanDerWaalsContact C-N 3.34Å; T145-A147 PolarHBondContact O-N 3.3Å; T145-I148 PolarHBondContact O-N 2.65Å; T145-I149 WeakPolarHBondContact O-CB 3.49Å; T145-I149 WeakPolarHBondContact O-CD1 3.26Å; T145-I149 VanDerWaalsContact O-CG1 3.22Å; T145-I149 WeakPolarHBondContact O-CG1 3.34Å; T145-I149 PolarHBondContact O-N 3.25Å
146	L	93.7	Very high	93.6	Very high	28 Å²	28	60 Å²	60	15%	0.147	34%	0.335	C	S	.	.	H	α-helix	trans	-59.2	-45.2	177.9	-175.8	73.8	0	0	0	111	L106 Y142 E143 I149 L150 T189	L106-L146 HydrophobicContact CD2-CD2 4.01Å; L106-L146 HydrophobicContact CD2-CG 4.26Å; Y142-L146 WeakPolarHBondContact O-CB 3.4Å; Y142-L146 PolarHBondContact O-N 2.95Å; E143-L146 PolarHBondContact O-N 3.3Å; L146-I149 PolarHBondContact O-N 3.37Å; L146-L150 HydrophobicContact CD1-CD1 4.35Å; L146-L150 HydrophobicContact CG-CD1 4.04Å; L146-L150 VanDerWaalsContact O-CB 3.25Å; L146-L150 WeakPolarHBondContact O-CB 3.43Å; L146-L150 WeakPolarHBondContact O-CG 3.43Å; L146-L150 PolarHBondContact O-N 3.07Å; L146-T189 HydrophobicContact CD1-CG2 3.95Å
147	A	94.2	Very high	93.4	Very high	39 Å²	39	59.9 Å²	59.9	32%	0.322	33%	0.334	S	S	.	.	H	α-helix	trans	-62.6	-43.2	179.1	0	0	0	0	0	112.3	L106 E143 V144 T145 L151	L106-A147 HydrophobicContact CD1-CB 4.5Å; L106-A147 HydrophobicContact CD2-CB 4.38Å; E143-A147 WeakPolarHBondContact O-CB 3.39Å; E143-A147 PolarHBondContact O-N 3.18Å; V144-A147 PolarHBondContact O-N 3.21Å; T145-A147 VanDerWaalsContact C-N 3.34Å; T145-A147 PolarHBondContact O-N 3.3Å; A147-L151 VanDerWaalsContact O-CB 3.31Å; A147-L151 WeakPolarHBondContact O-CB 3.15Å; A147-L151 PolarHBondContact O-N 3.29Å
148	I	94.3	Very high	93.2	Very high	110 Å²	110	60.2 Å²	60.2	56%	0.564	34%	0.344	S	S	*	.	H	α-helix	trans	-69.1	-43.6	179.7	-63.3	165.8	0	0	0	111	V144 T145 L151 S152	V144-I148 HydrophobicContact CG1-CD1 4.16Å; V144-I148 WeakPolarHBondContact O-CG1 3.42Å; V144-I148 PolarHBondContact O-N 3.26Å; T145-I148 PolarHBondContact O-N 2.65Å; I148-L151 PolarHBondContact O-N 3.09Å; I148-S152 PolarHBondContact O-N 3.1Å
149	I	95	Very high	93	Very high	15 Å²	15	57.4 Å²	57.4	8%	0.077	34%	0.335	C	S	.	.	H	α-helix	trans	-62.7	-47.9	177.9	-65.8	162.7	0	0	0	109.8	T145 L146 L151 S152 T153 L181 M184 W185	T145-I149 WeakPolarHBondContact O-CB 3.49Å; T145-I149 WeakPolarHBondContact O-CD1 3.26Å; T145-I149 VanDerWaalsContact O-CG1 3.22Å; T145-I149 WeakPolarHBondContact O-CG1 3.34Å; T145-I149 PolarHBondContact O-N 3.25Å; L146-I149 PolarHBondContact O-N 3.37Å; I149-L151 VanDerWaalsContact C-N 3.34Å; I149-L151 PolarHBondContact O-N 3.31Å; I149-S152 PolarHBondContact O-N 3.46Å; I149-S152 VanDerWaalsContact O-N 3.14Å; I149-S152 PolarHBondContact O-OG 3.32Å; I149-T153 PolarHBondContact O-N 3.4Å; I149-L181 HydrophobicContact CG2-CB 4.22Å; I149-L181 HydrophobicContact CG2-CD2 4.35Å; I149-M184 HydrophobicContact CD1-CB 3.78Å; I149-W185 HydrophobicContact CG2-CB 3.86Å; I149-W185 HydrophobicContact CG2-CG 4.46Å
150	L	92.9	Very high	92.9	Very high	21 Å²	21	59.4 Å²	59.4	11%	0.11	34%	0.341	C	S	.	.	H	α-helix	trans	-59.9	-44	176.9	-80.5	177.3	0	0	0	111.9	L102 L106 L146 S152 T153 L154	L102-L150 HydrophobicContact CD1-CD1 4.33Å; L102-L150 HydrophobicContact CD1-CD2 4.21Å; L102-L150 HydrophobicContact CD2-CB 3.96Å; L102-L150 HydrophobicContact CD2-CD1 4.34Å; L102-L150 HydrophobicContact CD2-CD2 4.23Å; L102-L150 HydrophobicContact CD2-CG 4.41Å; L102-L150 HydrophobicContact CG-CD1 4.47Å; L106-L150 HydrophobicContact CD1-CD1 4.12Å; L106-L150 HydrophobicContact CD2-CD1 3.83Å; L106-L150 HydrophobicContact CG-CD1 4Å; L146-L150 HydrophobicContact CD1-CD1 4.35Å; L146-L150 HydrophobicContact CG-CD1 4.04Å; L146-L150 VanDerWaalsContact O-CB 3.25Å; L146-L150 WeakPolarHBondContact O-CB 3.43Å; L146-L150 WeakPolarHBondContact O-CG 3.43Å; L146-L150 PolarHBondContact O-N 3.07Å; L150-S152 VanDerWaalsContact C-N 3.31Å; L150-S152 PolarHBondContact O-N 3.26Å; L150-T153 PolarHBondContact O-N 2.89Å; L150-T153 PolarHBondContact O-OG1 3.34Å; L150-L154 WeakPolarHBondContact O-CG 3.39Å; L150-L154 PolarHBondContact O-N 3.46Å
151	L	93.4	Very high	93	Very high	93 Å²	93	56.1 Å²	56.1	49%	0.487	33%	0.325	S	S	.	.	H	α-helix	trans	-57.6	-44	175	-176.3	67.1	0	0	0	111.7	A147 I148 I149 T153 L154 L155 F160	A147-L151 VanDerWaalsContact O-CB 3.31Å; A147-L151 WeakPolarHBondContact O-CB 3.15Å; A147-L151 PolarHBondContact O-N 3.29Å; I148-L151 PolarHBondContact O-N 3.09Å; I149-L151 VanDerWaalsContact C-N 3.34Å; I149-L151 PolarHBondContact O-N 3.31Å; L151-T153 VanDerWaalsContact C-N 3.35Å; L151-T153 PolarHBondContact O-N 3.07Å; L151-L154 WeakPolarHBondContact O-CB 3.39Å; L151-L154 PolarHBondContact O-N 2.68Å; L151-L155 PolarHBondContact O-N 3.37Å; L151-F160 HydrophobicContact CD1-CE1 4.43Å; L151-F160 HydrophobicContact CD1-CZ 4.37Å
152	S	92.5	Very high	92.9	Very high	35 Å²	35	53.9 Å²	53.9	25%	0.245	31%	0.307	C	S	.	.	H	α-helix	trans	-63.4	-38.7	178.8	72.4	0	0	0	0	112.8	I148 I149 L150 L154 L155 L181	I148-S152 PolarHBondContact O-N 3.1Å; I149-S152 PolarHBondContact O-N 3.46Å; I149-S152 VanDerWaalsContact O-N 3.14Å; I149-S152 PolarHBondContact O-OG 3.32Å; L150-S152 VanDerWaalsContact C-N 3.31Å; L150-S152 PolarHBondContact O-N 3.26Å; S152-L154 VanDerWaalsContact C-N 3.33Å; S152-L155 PolarHBondContact O-N 3.15Å; S152-L181 VanDerWaalsContact OG-CD1 3.3Å; S152-L181 WeakPolarHBondContact OG-CD1 3.28Å; S152-L181 WeakPolarHBondContact OG-CD2 3.25Å
153	T	91.5	Very high	92.8	Very high	19 Å²	19	51.3 Å²	51.3	12%	0.117	30%	0.302	C	S	.	.	H	α-helix	trans	-68.6	-33.1	174.8	61.7	0	0	0	0	112.2	I149 L150 L151 L155 M156 L181	I149-T153 PolarHBondContact O-N 3.4Å; L150-T153 PolarHBondContact O-N 2.89Å; L150-T153 PolarHBondContact O-OG1 3.34Å; L151-T153 VanDerWaalsContact C-N 3.35Å; L151-T153 PolarHBondContact O-N 3.07Å; T153-L155 VanDerWaalsContact C-N 3.33Å; T153-L155 PolarHBondContact O-N 3.44Å; T153-M156 WeakPolarHBondContact O-CB 3.43Å; T153-M156 PolarHBondContact O-N 3.1Å; T153-L181 HydrophobicContact CG2-CB 4.48Å; T153-L181 HydrophobicContact CG2-CD1 4.49Å
154	L	91.4	Very high	92.7	Very high	12 Å²	12	50.9 Å²	50.9	6%	0.063	30%	0.303	C	S	.	.	H	α-helix	trans	-70.4	-26.5	178.5	-78	-178	0	0	0	113.8	L102 L150 L151 S152 M156 S157 G158 S159 F160 L165	L102-L154 HydrophobicContact CB-CD1 4.44Å; L102-L154 HydrophobicContact CD2-CD1 3.2Å; L102-L154 HydrophobicContact CD2-CD2 3.88Å; L102-L154 HydrophobicContact CD2-CG 3.55Å; L102-L154 HydrophobicContact CG-CD1 4.41Å; L150-L154 WeakPolarHBondContact O-CG 3.39Å; L150-L154 PolarHBondContact O-N 3.46Å; L151-L154 WeakPolarHBondContact O-CB 3.39Å; L151-L154 PolarHBondContact O-N 2.68Å; S152-L154 VanDerWaalsContact C-N 3.33Å; L154-M156 PolarHBondContact O-N 3.24Å; L154-M156 VanDerWaalsContact O-N 3.17Å; L154-S157 WeakPolarHBondContact O-CA 3.24Å; L154-S157 PolarHBondContact O-N 3.25Å; L154-G158 PolarHBondContact O-N 3.36Å; L154-S159 WeakPolarHBondContact CD2-O 3.45Å; L154-F160 HydrophobicContact CD1-CD1 3.24Å; L154-F160 HydrophobicContact CD1-CE1 3.38Å; L154-F160 HydrophobicContact CD1-CG 4.19Å; L154-F160 HydrophobicContact CD1-CZ 4.42Å; L154-L165 HydrophobicContact CD2-CD1 4.47Å
155	L	92.4	Very high	92.6	Very high	141 Å²	141	48.9 Å²	48.9	74%	0.738	29%	0.289	S	S	*	.	H	α-helix	trans	-58.1	-28.1	174	-67.6	174.7	0	0	0	111.9	L151 S152 T153	L151-L155 PolarHBondContact O-N 3.37Å; S152-L155 PolarHBondContact O-N 3.15Å; T153-L155 VanDerWaalsContact C-N 3.33Å; T153-L155 PolarHBondContact O-N 3.44Å
156	M	89.8	Confident	92.6	Very high	101 Å²	101	49.5 Å²	49.5	50%	0.498	29%	0.29	S	S	.	.	H	α-helix	trans	-78.1	-29.3	174.1	-59.1	-179.4	72.5	0	0	113	T153 L154 L174 P177	T153-M156 WeakPolarHBondContact O-CB 3.43Å; T153-M156 PolarHBondContact O-N 3.1Å; L154-M156 PolarHBondContact O-N 3.24Å; L154-M156 VanDerWaalsContact O-N 3.17Å; M156-L174 HydrophobicContact CB-CD1 4.1Å; M156-L174 HydrophobicContact CE-CD1 3.79Å; M156-L174 HydrophobicContact SD-CD1 3.71Å; M156-P177 HydrophobicContact CE-CB 3.79Å; M156-P177 HydrophobicContact CE-CG 3.65Å
157	S	90.7	Very high	92.5	Very high	18 Å²	18	51.8 Å²	51.8	13%	0.126	31%	0.305	C	S	.	.	H	α-helix	trans	-79.6	-34.8	177.8	161.2	0	0	0	0	112.8	L154 S159	L154-S157 WeakPolarHBondContact O-CA 3.24Å; L154-S157 PolarHBondContact O-N 3.25Å; S157-S159 VanDerWaalsContact C-N 3.26Å; S157-S159 PolarHBondContact O-N 3.11Å; S157-S159 PolarHBondContact OG-O 3.37Å; S157-S159 VanDerWaalsContact OG-O 3.11Å
158	G	90.6	Very high	92.4	Very high	71 Å²	71	52.4 Å²	52.4	73%	0.732	30%	0.304	S	S	*	.	S	Bend	trans	80.3	-7.5	-178.1	0	0	0	0	0	115.1	L154	L154-G158 PolarHBondContact O-N 3.36Å
159	S	92.9	Very high	92.3	Very high	36 Å²	36	50.3 Å²	50.3	25%	0.252	29%	0.292	S	S	.	.	S	Bend	trans	-148.5	160.9	174.3	75.8	0	0	0	0	113.1	L154 S157 N161 T164	L154-S159 WeakPolarHBondContact CD2-O 3.45Å; S157-S159 VanDerWaalsContact C-N 3.26Å; S157-S159 PolarHBondContact O-N 3.11Å; S157-S159 PolarHBondContact OG-O 3.37Å; S157-S159 VanDerWaalsContact OG-O 3.11Å; S159-N161 VanDerWaalsContact C-N 3.32Å; S159-T164 WeakPolarHBondContact OG-CB 3.42Å; S159-T164 WeakPolarHBondContact OG-CG2 3.28Å; S159-T164 PolarHBondContact OG-OG1 3.48Å
160	F	92.6	Very high	92.2	Very high	73 Å²	73	56.1 Å²	56.1	32%	0.32	32%	0.319	S	S	.	.	S	Bend	trans	-85.2	-0.8	-179.4	-68.3	-83.7	0	0	0	114.2	N99 L100 G101 L102 L103 L151 L154	N99-F160 CarbonylContact O-C 3.38Å; L100-F160 HydrophobicContact CD2-CB 3.95Å; L100-F160 HydrophobicContact CD2-CD2 4.09Å; L100-F160 HydrophobicContact CD2-CG 4.24Å; G101-F160 PolarHBondContact N-O 3.18Å; L102-F160 PolarHBondContact N-O 3.37Å; L102-F160 VanDerWaalsContact N-O 3.09Å; L103-F160 HydrophobicContact CD1-CD1 3.96Å; L103-F160 HydrophobicContact CD1-CE1 4.14Å; L103-F160 HydrophobicContact CD1-CG 4.17Å; L103-F160 HydrophobicContact CD2-CD1 4.39Å; L103-F160 HydrophobicContact CD2-CE1 4.21Å; L103-F160 HydrophobicContact CG-CD1 3.77Å; L103-F160 HydrophobicContact CG-CE1 4.05Å; L103-F160 HydrophobicContact CG-CG 4.38Å; L151-F160 HydrophobicContact CD1-CE1 4.43Å; L151-F160 HydrophobicContact CD1-CZ 4.37Å; L154-F160 HydrophobicContact CD1-CD1 3.24Å; L154-F160 HydrophobicContact CD1-CE1 3.38Å; L154-F160 HydrophobicContact CD1-CG 4.19Å; L154-F160 HydrophobicContact CD1-CZ 4.42Å
161	N	94.3	Very high	92.1	Very high	21 Å²	21	63.6 Å²	63.6	11%	0.112	35%	0.353	C	S	.	.			trans	-74.5	138.2	176.8	-165.5	-16.6	0	0	0	109.2	N97 L98 N99 S159 S163 T164	N97-N161 PolarHBondContact OD1-ND2 2.92Å; N97-N161 VanDerWaalsContact OD1-ND2 3.16Å; N97-N161 PolarHBondContact OD1-OD1 3.01Å; L98-N161 PolarHBondContact O-OD1 2.95Å; N99-N161 PolarHBondContact O-N 3.48Å; S159-N161 VanDerWaalsContact C-N 3.32Å; N161-S163 PolarHBondContact ND2-OG 3.11Å; N161-S163 PolarHBondContact OD1-N 3.45Å; N161-S163 VanDerWaalsContact OD1-N 3.11Å; N161-S163 PolarHBondContact OD1-OG 3.24Å; N161-T164 HydrophobicContact CB-CG2 4.16Å; N161-T164 PolarHBondContact O-OG1 2.88Å
162	L	91.9	Very high	92.1	Very high	17 Å²	17	64.9 Å²	64.9	9%	0.089	36%	0.36	C	S	.	.	H	α-helix	trans	-76.3	-26.8	178	-67.7	165.1	0	0	0	111.7	P88 P90 L102 I105 T164 L165	P88-L162 HydrophobicContact CB-CD1 4.07Å; P88-L162 HydrophobicContact CG-CD1 4.29Å; P88-L162 WeakPolarHBondContact O-CD1 3.33Å; P90-L162 HydrophobicContact CG-CB 3.79Å; L102-L162 HydrophobicContact CB-CD2 4.4Å; L102-L162 HydrophobicContact CD1-CD2 3.82Å; I105-L162 HydrophobicContact CD1-CD1 3.59Å; L162-T164 VanDerWaalsContact C-N 3.33Å; L162-T164 PolarHBondContact O-N 3.49Å; L162-L165 VanDerWaalsContact O-CB 3.26Å; L162-L165 WeakPolarHBondContact O-CB 3.43Å; L162-L165 PolarHBondContact O-N 2.97Å
163	S	92.9	Very high	92.2	Very high	35 Å²	35	72.5 Å²	72.5	25%	0.245	38%	0.383	C	S	.	.	H	α-helix	trans	-67.7	-34.3	177.8	66.9	0	0	0	0	112.3	N161 L165 I166 T167	N161-S163 PolarHBondContact ND2-OG 3.11Å; N161-S163 PolarHBondContact OD1-N 3.45Å; N161-S163 VanDerWaalsContact OD1-N 3.11Å; N161-S163 PolarHBondContact OD1-OG 3.24Å; S163-L165 PolarHBondContact O-N 3.39Å; S163-I166 WeakPolarHBondContact O-CB 3.06Å; S163-I166 PolarHBondContact O-N 3.36Å; S163-T167 PolarHBondContact O-N 2.76Å
164	T	91.9	Very high	92.3	Very high	38 Å²	38	72.7 Å²	72.7	23%	0.233	38%	0.384	C	S	.	.	H	α-helix	trans	-68.3	-27.9	175.7	55.9	0	0	0	0	111.4	S159 N161 L162 I166 T167 T168	S159-T164 WeakPolarHBondContact OG-CB 3.42Å; S159-T164 WeakPolarHBondContact OG-CG2 3.28Å; S159-T164 PolarHBondContact OG-OG1 3.48Å; N161-T164 HydrophobicContact CB-CG2 4.16Å; N161-T164 PolarHBondContact O-OG1 2.88Å; L162-T164 VanDerWaalsContact C-N 3.33Å; L162-T164 PolarHBondContact O-N 3.49Å; T164-I166 PolarHBondContact O-N 3.41Å; T164-T167 WeakPolarHBondContact CA-OG1 3.19Å; T164-T167 PolarHBondContact O-N 3.43Å; T164-T167 VanDerWaalsContact O-N 3.12Å; T164-T167 PolarHBondContact O-OG1 3.31Å; T164-T168 WeakPolarHBondContact O-CG2 3.4Å; T164-T168 PolarHBondContact O-N 2.86Å
165	L	92.3	Very high	92.4	Very high	43 Å²	43	77.1 Å²	77.1	23%	0.225	41%	0.407	C	S	.	.	H	α-helix	trans	-60.9	-36.2	174.4	-160.7	114.1	0	0	0	111.5	L154 L162 S163 T168 Q169	L154-L165 HydrophobicContact CD2-CD1 4.47Å; L162-L165 VanDerWaalsContact O-CB 3.26Å; L162-L165 WeakPolarHBondContact O-CB 3.43Å; L162-L165 PolarHBondContact O-N 2.97Å; S163-L165 PolarHBondContact O-N 3.39Å; L165-T168 WeakPolarHBondContact CA-OG1 3.32Å; L165-T168 PolarHBondContact O-N 3.28Å; L165-T168 PolarHBondContact O-OG1 3.08Å; L165-Q169 WeakPolarHBondContact O-CG 3.19Å; L165-Q169 PolarHBondContact O-N 3.48Å
166	I	93.3	Very high	92.4	Very high	74 Å²	74	75.7 Å²	75.7	38%	0.379	40%	0.399	S	S	.	.	H	α-helix	trans	-63.1	-48.3	173.6	-60.9	176.5	0	0	0	110.1	P90 S163 T164 T168 Q169	P90-I166 HydrophobicContact CB-CD1 3.65Å; P90-I166 HydrophobicContact CG-CD1 3.77Å; P90-I166 HydrophobicContact CG-CG1 4.28Å; S163-I166 WeakPolarHBondContact O-CB 3.06Å; S163-I166 PolarHBondContact O-N 3.36Å; T164-I166 PolarHBondContact O-N 3.41Å; I166-T168 VanDerWaalsContact C-N 3.26Å; I166-T168 PolarHBondContact O-N 3.05Å; I166-Q169 PolarHBondContact O-N 3.33Å
167	T	91.9	Very high	92.5	Very high	76 Å²	76	74.5 Å²	74.5	47%	0.466	40%	0.399	S	S	.	.	H	α-helix	trans	-62.4	-33.8	179.7	59.7	0	0	0	0	112.5	S163 T164 Q169 E170	S163-T167 PolarHBondContact O-N 2.76Å; T164-T167 WeakPolarHBondContact CA-OG1 3.19Å; T164-T167 PolarHBondContact O-N 3.43Å; T164-T167 VanDerWaalsContact O-N 3.12Å; T164-T167 PolarHBondContact O-OG1 3.31Å; T167-Q169 PolarHBondContact O-N 3.45Å; T167-E170 WeakPolarHBondContact O-CG 3.38Å; T167-E170 PolarHBondContact O-N 2.99Å
168	T	92.2	Very high	92.6	Very high	51 Å²	51	74 Å²	74	31%	0.313	40%	0.396	S	S	.	.	H	α-helix	trans	-69.4	-21	177.9	65.2	0	0	0	0	113	T164 L165 I166	T164-T168 WeakPolarHBondContact O-CG2 3.4Å; T164-T168 PolarHBondContact O-N 2.86Å; L165-T168 WeakPolarHBondContact CA-OG1 3.32Å; L165-T168 PolarHBondContact O-N 3.28Å; L165-T168 PolarHBondContact O-OG1 3.08Å; I166-T168 VanDerWaalsContact C-N 3.26Å; I166-T168 PolarHBondContact O-N 3.05Å
169	Q	92.5	Very high	92.8	Very high	67 Å²	67	78.4 Å²	78.4	31%	0.313	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	7.2	-177.5	-67.4	-179.5	7.8	0	0	113.6	L165 I166 T167 H171 L172 L174	L165-Q169 WeakPolarHBondContact O-CG 3.19Å; L165-Q169 PolarHBondContact O-N 3.48Å; I166-Q169 PolarHBondContact O-N 3.33Å; T167-Q169 PolarHBondContact O-N 3.45Å; Q169-H171 PolarHBondContact O-N 2.87Å; Q169-L172 WeakPolarHBondContact CA-O 3.37Å; Q169-L174 HydrophobicContact CG-CB 4.01Å
170	E	92.3	Very high	92.9	Very high	137 Å²	137	79.4 Å²	79.4	64%	0.64	40%	0.396	S	S	*	.	S	Bend	trans	-62	-40.7	-177.3	-75.9	-179.5	-171.5	0	0	113.1	T167	T167-E170 WeakPolarHBondContact O-CG 3.38Å; T167-E170 PolarHBondContact O-N 2.99Å
171	H	91.3	Very high	93.1	Very high	177 Å²	177	78.1 Å²	78.1	82%	0.819	39%	0.392	S	S	*	.	S	Bend	trans	-91.1	-39.6	-177.2	-63.8	-49.1	0	0	0	113.5	Q169	Q169-H171 PolarHBondContact O-N 2.87Å
172	L	93.8	Very high	93.1	Very high	120 Å²	120	78.1 Å²	78.1	63%	0.628	40%	0.395	S	S	*	.	S	Bend	trans	-143	139.5	-176.7	-72	171	0	0	0	109.6	Q169 L174	Q169-L172 WeakPolarHBondContact CA-O 3.37Å; L172-L174 PolarHBondContact O-N 2.97Å
173	W	93.4	Very high	93.3	Very high	196 Å²	196	83 Å²	83	74%	0.742	42%	0.418	S	S	*	.			trans	-65.7	131.1	172.5	-64	-7.5	0	0	0	110.2	L175 L176 P177	W173-L175 PolarHBondContact O-N 3.28Å; W173-L176 PolarHBondContact O-N 2.89Å; W173-P177 WeakPolarHBondContact O-CD 3.46Å
174	L	93.9	Very high	93.4	Very high	23 Å²	23	85.9 Å²	85.9	12%	0.12	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.5	-179.7	-163.2	69.6	0	0	0	112.8	M156 Q169 L172 L176 P177 S178	M156-L174 HydrophobicContact CB-CD1 4.1Å; M156-L174 HydrophobicContact CE-CD1 3.79Å; M156-L174 HydrophobicContact SD-CD1 3.71Å; Q169-L174 HydrophobicContact CG-CB 4.01Å; L172-L174 PolarHBondContact O-N 2.97Å; L174-L176 VanDerWaalsContact C-N 3.27Å; L174-L176 PolarHBondContact O-N 3.38Å; L174-P177 VanDerWaalsContact O-CD 3.28Å; L174-P177 WeakPolarHBondContact O-CD 3.09Å; L174-P177 WeakPolarHBondContact O-CG 3.41Å; L174-S178 WeakPolarHBondContact O-CB 3.38Å; L174-S178 PolarHBondContact O-N 2.98Å; L174-S178 PolarHBondContact O-OG 3.38Å
175	L	93	Very high	93.6	Very high	105 Å²	105	89.3 Å²	89.3	55%	0.55	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-31.2	176	-170.8	143.4	0	0	0	112.9	W173 W179 A182	W173-L175 PolarHBondContact O-N 3.28Å; L175-W179 WeakPolarHBondContact O-CA 3.29Å; L175-W179 WeakPolarHBondContact O-CB 3.34Å; L175-W179 PolarHBondContact O-N 3.25Å; L175-A182 HydrophobicContact CD1-CB 4.36Å; L175-A182 HydrophobicContact CG-CB 4.14Å
176	L	92.3	Very high	93.8	Very high	110 Å²	110	93.3 Å²	93.3	58%	0.576	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-55.4	179.8	-68.5	170.7	0	0	0	113	W173 L174 S178	W173-L176 PolarHBondContact O-N 2.89Å; L174-L176 VanDerWaalsContact C-N 3.27Å; L174-L176 PolarHBondContact O-N 3.38Å; L176-S178 VanDerWaalsContact C-N 3.33Å; L176-S178 PolarHBondContact O-N 3.37Å
177	P	92.4	Very high	93.9	Very high	76 Å²	76	95 Å²	95	49%	0.494	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-29.1	178.8	27.1	-35.2	0	0	0	113	M156 W173 L174	M156-P177 HydrophobicContact CE-CB 3.79Å; M156-P177 HydrophobicContact CE-CG 3.65Å; W173-P177 WeakPolarHBondContact O-CD 3.46Å; L174-P177 VanDerWaalsContact O-CD 3.28Å; L174-P177 WeakPolarHBondContact O-CD 3.09Å; L174-P177 WeakPolarHBondContact O-CG 3.41Å
178	S	94.1	Very high	94	Very high	8 Å²	8	91.7 Å²	91.7	6%	0.056	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	27.2	-175	72.6	0	0	0	0	113.9	L174 L176 P180 L181 A182	L174-S178 WeakPolarHBondContact O-CB 3.38Å; L174-S178 PolarHBondContact O-N 2.98Å; L174-S178 PolarHBondContact O-OG 3.38Å; L176-S178 VanDerWaalsContact C-N 3.33Å; L176-S178 PolarHBondContact O-N 3.37Å; S178-P180 VanDerWaalsContact C-N 3.34Å; S178-P180 WeakPolarHBondContact O-CD 3.06Å; S178-P180 VanDerWaalsContact O-N 3.12Å; S178-L181 WeakPolarHBondContact O-CA 3.49Å; S178-L181 WeakPolarHBondContact O-CB 3.33Å; S178-L181 PolarHBondContact O-N 3.41Å; S178-A182 PolarHBondContact O-N 3.04Å
179	W	94.6	Very high	94.1	Very high	164 Å²	164	92.6 Å²	92.6	62%	0.621	45%	0.448	S	S	*	.	H	α-helix	trans	-52.1	-37.6	-173	77.9	-94.3	0	0	0	115.5	L175 A182 M183	L175-W179 WeakPolarHBondContact O-CA 3.29Å; L175-W179 WeakPolarHBondContact O-CB 3.34Å; L175-W179 PolarHBondContact O-N 3.25Å; W179-A182 PolarHBondContact O-N 3.33Å; W179-M183 HydrophobicContact CE3-CG 4.41Å; W179-M183 WeakPolarHBondContact O-CG 3.07Å; W179-M183 PolarHBondContact O-N 3.22Å
180	P	95.1	Very high	94.1	Very high	57 Å²	57	95.9 Å²	95.9	37%	0.37	47%	0.467	S	S	.	.	H	α-helix	trans	-69	-38.4	177.9	-14.7	30.4	0	0	0	111.3	S178 M183 M184	S178-P180 VanDerWaalsContact C-N 3.34Å; S178-P180 WeakPolarHBondContact O-CD 3.06Å; S178-P180 VanDerWaalsContact O-N 3.12Å; P180-M183 PolarHBondContact O-N 2.66Å; P180-M184 WeakPolarHBondContact O-CG 3.42Å; P180-M184 PolarHBondContact O-N 3.31Å
181	L	95.1	Very high	94	Very high	46 Å²	46	91.6 Å²	91.6	24%	0.241	46%	0.455	C	S	.	.	H	α-helix	trans	-65.9	-41.9	176.1	-65.9	168.9	0	0	0	110.3	I149 S152 T153 S178 M183 M184 W185	I149-L181 HydrophobicContact CG2-CB 4.22Å; I149-L181 HydrophobicContact CG2-CD2 4.35Å; S152-L181 VanDerWaalsContact OG-CD1 3.3Å; S152-L181 WeakPolarHBondContact OG-CD1 3.28Å; S152-L181 WeakPolarHBondContact OG-CD2 3.25Å; T153-L181 HydrophobicContact CG2-CB 4.48Å; T153-L181 HydrophobicContact CG2-CD1 4.49Å; S178-L181 WeakPolarHBondContact O-CA 3.49Å; S178-L181 WeakPolarHBondContact O-CB 3.33Å; S178-L181 PolarHBondContact O-N 3.41Å; L181-M183 VanDerWaalsContact C-N 3.34Å; L181-M183 PolarHBondContact O-N 3.04Å; L181-M184 HydrophobicContact CD2-CE 3.81Å; L181-M184 PolarHBondContact O-N 3.43Å; L181-W185 WeakPolarHBondContact O-CB 3.31Å; L181-W185 PolarHBondContact O-N 3Å
182	A	94.9	Very high	94.2	Very high	21 Å²	21	87.3 Å²	87.3	17%	0.174	44%	0.437	C	S	.	.	H	α-helix	trans	-61.9	-40.8	176.5	0	0	0	0	0	112.2	L175 S178 W179 W185 F186	L175-A182 HydrophobicContact CD1-CB 4.36Å; L175-A182 HydrophobicContact CG-CB 4.14Å; S178-A182 PolarHBondContact O-N 3.04Å; W179-A182 PolarHBondContact O-N 3.33Å; A182-W185 PolarHBondContact O-N 3.33Å; A182-F186 WeakPolarHBondContact O-CB 3.17Å; A182-F186 PolarHBondContact O-N 3.28Å
183	M	95.6	Very high	94.2	Very high	118 Å²	118	85.6 Å²	85.6	58%	0.581	43%	0.427	S	S	*	.	H	α-helix	trans	-66.8	-45	176.1	-71.8	-63.7	-178.2	0	0	112.2	W179 P180 L181 W185 F186 I187	W179-M183 HydrophobicContact CE3-CG 4.41Å; W179-M183 WeakPolarHBondContact O-CG 3.07Å; W179-M183 PolarHBondContact O-N 3.22Å; P180-M183 PolarHBondContact O-N 2.66Å; L181-M183 VanDerWaalsContact C-N 3.34Å; L181-M183 PolarHBondContact O-N 3.04Å; M183-W185 VanDerWaalsContact C-N 3.32Å; M183-W185 PolarHBondContact O-N 3.31Å; M183-F186 PolarHBondContact O-N 3.15Å; M183-I187 WeakPolarHBondContact O-CG1 3.06Å; M183-I187 PolarHBondContact O-N 3.44Å; M183-I187 VanDerWaalsContact O-N 3.11Å
184	M	96.3	Very high	94.2	Very high	96 Å²	96	79.4 Å²	79.4	47%	0.473	41%	0.409	S	S	.	.	H	α-helix	trans	-63.8	-39.5	175.4	-69.9	-171.6	-63.2	0	0	111.7	I149 P180 L181 I187 S188	I149-M184 HydrophobicContact CD1-CB 3.78Å; P180-M184 WeakPolarHBondContact O-CG 3.42Å; P180-M184 PolarHBondContact O-N 3.31Å; L181-M184 HydrophobicContact CD2-CE 3.81Å; L181-M184 PolarHBondContact O-N 3.43Å; M184-I187 PolarHBondContact O-N 3.26Å; M184-S188 PolarHBondContact O-N 3.47Å; M184-S188 PolarHBondContact O-OG 2.97Å
185	W	95.4	Very high	94.3	Very high	111 Å²	111	82.8 Å²	82.8	42%	0.42	43%	0.426	S	S	.	.	H	α-helix	trans	-61.4	-44.4	176.1	-178.7	65.2	0	0	0	111.8	I149 L181 A182 M183 I187 S188 T189	I149-W185 HydrophobicContact CG2-CB 3.86Å; I149-W185 HydrophobicContact CG2-CG 4.46Å; L181-W185 WeakPolarHBondContact O-CB 3.31Å; L181-W185 PolarHBondContact O-N 3Å; A182-W185 PolarHBondContact O-N 3.33Å; M183-W185 VanDerWaalsContact C-N 3.32Å; M183-W185 PolarHBondContact O-N 3.31Å; W185-I187 PolarHBondContact O-N 3.29Å; W185-S188 WeakPolarHBondContact CA-OG 3.5Å; W185-S188 PolarHBondContact O-N 3.45Å; W185-S188 PolarHBondContact O-OG 2.78Å; W185-T189 HydrophobicContact CD2-CG2 4.35Å; W185-T189 HydrophobicContact CZ2-CG2 4.22Å; W185-T189 WeakPolarHBondContact O-CG2 3.26Å; W185-T189 PolarHBondContact O-N 3.01Å; W185-T189 PolarHBondContact O-OG1 3.2Å; W185-T189 VanDerWaalsContact O-OG1 3.13Å
186	F	96.2	Very high	94.3	Very high	126 Å²	126	81.4 Å²	81.4	55%	0.553	42%	0.419	S	S	*	.	H	α-helix	trans	-60.1	-45.5	176.1	-178.3	-104.8	0	0	0	111.5	A182 M183 S188 T189 L190	A182-F186 WeakPolarHBondContact O-CB 3.17Å; A182-F186 PolarHBondContact O-N 3.28Å; M183-F186 PolarHBondContact O-N 3.15Å; F186-S188 PolarHBondContact O-N 3.48Å; F186-T189 PolarHBondContact O-N 3.43Å; F186-T189 PolarHBondContact O-OG1 2.91Å; F186-L190 HydrophobicContact CE1-CD1 4.48Å; F186-L190 HydrophobicContact CZ-CD1 4.48Å; F186-L190 PolarHBondContact O-N 2.95Å; F186-L190 VanDerWaalsContact O-N 3.17Å
187	I	96.1	Very high	94.5	Very high	109 Å²	109	79.5 Å²	79.5	56%	0.559	41%	0.408	S	S	*	.	H	α-helix	trans	-63.3	-41.7	176.5	-64	165.7	0	0	0	111.1	M183 M184 W185 T189 L190 A191	M183-I187 WeakPolarHBondContact O-CG1 3.06Å; M183-I187 PolarHBondContact O-N 3.44Å; M183-I187 VanDerWaalsContact O-N 3.11Å; M184-I187 PolarHBondContact O-N 3.26Å; W185-I187 PolarHBondContact O-N 3.29Å; I187-T189 VanDerWaalsContact C-N 3.33Å; I187-T189 PolarHBondContact O-N 3.39Å; I187-L190 PolarHBondContact O-N 3.46Å; I187-A191 PolarHBondContact O-N 3.45Å
188	S	94.3	Very high	94.6	Very high	7 Å²	7	79.7 Å²	79.7	5%	0.049	40%	0.402	C	S	.	.	H	α-helix	trans	-69	-29.1	179.7	64	0	0	0	0	113.6	M184 W185 F186	M184-S188 PolarHBondContact O-N 3.47Å; M184-S188 PolarHBondContact O-OG 2.97Å; W185-S188 WeakPolarHBondContact CA-OG 3.5Å; W185-S188 PolarHBondContact O-N 3.45Å; W185-S188 PolarHBondContact O-OG 2.78Å; F186-S188 PolarHBondContact O-N 3.48Å
189	T	93.8	Very high	94.7	Very high	70 Å²	70	85.2 Å²	85.2	43%	0.429	43%	0.429	S	S	.	.	H	α-helix	trans	-80.4	-20	176.5	55.3	0	0	0	0	113.2	L146 W185 F186 I187	L146-T189 HydrophobicContact CD1-CG2 3.95Å; W185-T189 HydrophobicContact CD2-CG2 4.35Å; W185-T189 HydrophobicContact CZ2-CG2 4.22Å; W185-T189 WeakPolarHBondContact O-CG2 3.26Å; W185-T189 PolarHBondContact O-N 3.01Å; W185-T189 PolarHBondContact O-OG1 3.2Å; W185-T189 VanDerWaalsContact O-OG1 3.13Å; F186-T189 PolarHBondContact O-N 3.43Å; F186-T189 PolarHBondContact O-OG1 2.91Å; I187-T189 VanDerWaalsContact C-N 3.33Å; I187-T189 PolarHBondContact O-N 3.39Å
190	L	93.3	Very high	94.7	Very high	136 Å²	136	78.7 Å²	78.7	71%	0.712	41%	0.412	S	S	*	.	H	α-helix	trans	-81.2	-26.9	175.1	-172.2	140	0	0	0	112.5	F186 I187	F186-L190 HydrophobicContact CE1-CD1 4.48Å; F186-L190 HydrophobicContact CZ-CD1 4.48Å; F186-L190 PolarHBondContact O-N 2.95Å; F186-L190 VanDerWaalsContact O-N 3.17Å; I187-L190 PolarHBondContact O-N 3.46Å
191	A	90.3	Very high	94.6	Very high	47 Å²	47	80.6 Å²	80.6	39%	0.388	42%	0.416	S	S	.	.			trans	-83	0	177.7	0	0	0	0	0	112.3	Q138 Y142 I187	Q138-A191 PolarHBondContact NE2-O 3.03Å; Y142-A191 HydrophobicContact CD1-CB 3.68Å; Y142-A191 HydrophobicContact CD2-CB 3.49Å; Y142-A191 VanDerWaalsContact CD2-CB 3.49Å; Y142-A191 HydrophobicContact CE1-CB 3.56Å; Y142-A191 HydrophobicContact CE2-CB 3.41Å; Y142-A191 VanDerWaalsContact CE2-CB 3.41Å; Y142-A191 HydrophobicContact CG-CB 3.64Å; Y142-A191 VanDerWaalsContact CZ-CB 3.42Å; I187-A191 PolarHBondContact O-N 3.45Å

Retrieved 191 of 191 residues in 232.2 ms (Link to these results)

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