A0A3Q0KVJ4_SCHMA Loading...

NADH dehydrogenase subunit 6 (mitochondrion)

AlphaFold DB , UniProt , Accession A0A3Q0KVJ4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 148 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	62.7	Low	66.5	Low	128 Å²	128	74.9 Å²	74.9	63%	0.631	39%	0.392	S	S	*	.				0	-52.4	0	-165	153.7	154.6	0	0	112.9	L3 V4 L5 D97	M1-L3 PolarHBondContact O-N 3.34Å; M1-V4 WeakPolarHBondContact O-CB 3.39Å; M1-V4 PolarHBondContact O-N 3.46Å; M1-V4 VanDerWaalsContact O-N 3.12Å; M1-L5 PolarHBondContact O-N 3.34Å; M1-D97 VanDerWaalsContact SD-OD2 3.4Å
2	M	62.1	Low	66.4	Low	32 Å²	32	70.4 Å²	70.4	16%	0.158	38%	0.377	C	S	.	.	H	α-helix	trans	-64.5	-36.3	-175	-62.7	-151.3	-54.1	0	0	116.4	V4 L5 L6 W36 K39 V94	M2-V4 PolarHBondContact O-N 2.71Å; M2-L5 WeakPolarHBondContact O-CA 3.46Å; M2-L5 WeakPolarHBondContact O-CB 2.84Å; M2-L5 PolarHBondContact O-N 3.13Å; M2-L6 PolarHBondContact O-N 3.4Å; M2-W36 HydrophobicContact CE-CB 3.74Å; M2-W36 HydrophobicContact CE-CG 4.08Å; M2-K39 HydrophobicContact CE-CD 3.8Å; M2-K39 HydrophobicContact CE-CG 4.35Å; M2-K39 HydrophobicContact SD-CD 4.49Å; M2-V94 HydrophobicContact CG-CG1 4.19Å; M2-V94 HydrophobicContact CG-CG2 4.26Å; M2-V94 HydrophobicContact SD-CG1 3.52Å; M2-V94 VanDerWaalsContact SD-CG1 3.52Å; M2-V94 HydrophobicContact SD-CG2 4.45Å
3	L	64.3	Low	66.2	Low	125 Å²	125	68.7 Å²	68.7	65%	0.654	37%	0.365	S	S	*	.	H	α-helix	trans	-60.1	-33.7	173.4	-76.9	169.4	0	0	0	112.5	M1 L5 L6 S7	M1-L3 PolarHBondContact O-N 3.34Å; L3-L5 VanDerWaalsContact C-N 3.33Å; L3-L6 PolarHBondContact O-N 3.11Å; L3-S7 PolarHBondContact O-N 3.25Å; L3-S7 PolarHBondContact O-OG 3.41Å
4	V	67.6	Low	66.1	Low	87 Å²	87	71.7 Å²	71.7	53%	0.527	39%	0.387	S	S	.	.	H	α-helix	trans	-69.1	-35.2	175.1	-177.4	0	0	0	0	110.5	M1 M2 S7 M8	M1-V4 WeakPolarHBondContact O-CB 3.39Å; M1-V4 PolarHBondContact O-N 3.46Å; M1-V4 VanDerWaalsContact O-N 3.12Å; M2-V4 PolarHBondContact O-N 2.71Å; V4-S7 WeakPolarHBondContact CA-OG 2.93Å; V4-S7 PolarHBondContact O-N 3.31Å; V4-S7 PolarHBondContact O-OG 2.93Å; V4-M8 HydrophobicContact CG1-CG 4.48Å; V4-M8 WeakPolarHBondContact O-CB 3.29Å; V4-M8 WeakPolarHBondContact O-CG 2.9Å; V4-M8 PolarHBondContact O-N 2.9Å
5	L	68	Low	66.2	Low	10 Å²	10	74.2 Å²	74.2	5%	0.052	39%	0.393	C	S	.	.	H	α-helix	trans	-66.7	-45.9	173.9	-61.2	176.7	0	0	0	111.2	M1 M2 L3 S7 M8 V9 M32 L90 V94	M1-L5 PolarHBondContact O-N 3.34Å; M2-L5 WeakPolarHBondContact O-CA 3.46Å; M2-L5 WeakPolarHBondContact O-CB 2.84Å; M2-L5 PolarHBondContact O-N 3.13Å; L3-L5 VanDerWaalsContact C-N 3.33Å; L5-S7 VanDerWaalsContact C-N 3.31Å; L5-S7 PolarHBondContact O-N 2.85Å; L5-M8 PolarHBondContact O-N 3.13Å; L5-V9 WeakPolarHBondContact O-CG2 3.47Å; L5-V9 PolarHBondContact O-N 3.45Å; L5-M32 HydrophobicContact CD1-CE 4.5Å; L5-L90 HydrophobicContact CD2-CB 3.76Å; L5-L90 HydrophobicContact CD2-CD1 3.79Å; L5-L90 HydrophobicContact CD2-CD2 3.7Å; L5-L90 HydrophobicContact CD2-CG 3.92Å; L5-V94 HydrophobicContact CD1-CG2 3.04Å
6	L	68.6	Low	65.7	Low	50 Å²	50	82.9 Å²	82.9	26%	0.262	43%	0.426	S	S	.	.	H	α-helix	trans	-57.8	-46.5	175.9	-167.2	92.7	0	0	0	110.7	M2 L3 M8 V9 L10 V29 V33	M2-L6 PolarHBondContact O-N 3.4Å; L3-L6 PolarHBondContact O-N 3.11Å; L6-M8 PolarHBondContact O-N 3.28Å; L6-V9 PolarHBondContact O-N 2.97Å; L6-L10 HydrophobicContact CD2-CD1 4.1Å; L6-L10 HydrophobicContact CG-CD1 4.17Å; L6-L10 WeakPolarHBondContact O-CB 3.29Å; L6-L10 VanDerWaalsContact O-CG 3.26Å; L6-L10 WeakPolarHBondContact O-CG 3.45Å; L6-L10 PolarHBondContact O-N 3.43Å; L6-V29 HydrophobicContact CD1-CG1 3.98Å; L6-V33 HydrophobicContact CD1-CG2 3.54Å
7	S	65.8	Low	65.5	Low	62 Å²	62	79.8 Å²	79.8	43%	0.434	42%	0.42	S	S	.	.	H	α-helix	trans	-65.2	-36.8	178.6	68.5	0	0	0	0	112.6	L3 V4 L5 L10 F11	L3-S7 PolarHBondContact O-N 3.25Å; L3-S7 PolarHBondContact O-OG 3.41Å; V4-S7 WeakPolarHBondContact CA-OG 2.93Å; V4-S7 PolarHBondContact O-N 3.31Å; V4-S7 PolarHBondContact O-OG 2.93Å; L5-S7 VanDerWaalsContact C-N 3.31Å; L5-S7 PolarHBondContact O-N 2.85Å; S7-L10 PolarHBondContact O-N 2.89Å; S7-F11 VanDerWaalsContact O-CB 3.32Å; S7-F11 WeakPolarHBondContact O-CB 3.49Å; S7-F11 PolarHBondContact O-N 3.31Å
8	M	69.6	Low	65.5	Low	118 Å²	118	77.7 Å²	77.7	58%	0.581	41%	0.413	S	S	*	.	H	α-helix	trans	-65	-40.9	174.1	-75.7	-68.7	-132.1	0	0	112.5	V4 L5 L6 F11 G12	V4-M8 HydrophobicContact CG1-CG 4.48Å; V4-M8 WeakPolarHBondContact O-CB 3.29Å; V4-M8 WeakPolarHBondContact O-CG 2.9Å; V4-M8 PolarHBondContact O-N 2.9Å; L5-M8 PolarHBondContact O-N 3.13Å; L6-M8 PolarHBondContact O-N 3.28Å; M8-F11 WeakPolarHBondContact O-CB 3.48Å; M8-F11 PolarHBondContact O-N 3.15Å; M8-G12 PolarHBondContact O-N 3.2Å
9	V	69	Low	65.4	Low	6 Å²	6	74.8 Å²	74.8	4%	0.036	40%	0.399	C	S	.	.	H	α-helix	trans	-69.7	-41.1	176.9	-174.6	0	0	0	0	110.6	L5 L6 F11 G12 F13 L25 V29 L87	L5-V9 WeakPolarHBondContact O-CG2 3.47Å; L5-V9 PolarHBondContact O-N 3.45Å; L6-V9 PolarHBondContact O-N 2.97Å; V9-F11 VanDerWaalsContact C-N 3.3Å; V9-F11 PolarHBondContact O-N 3.39Å; V9-G12 VanDerWaalsContact O-CA 3.3Å; V9-G12 WeakPolarHBondContact O-CA 3.33Å; V9-G12 PolarHBondContact O-N 2.95Å; V9-F13 HydrophobicContact CG1-CE2 4.38Å; V9-F13 WeakPolarHBondContact O-CD2 3.5Å; V9-F13 PolarHBondContact O-N 3.39Å; V9-L25 HydrophobicContact CG1-CB 4.44Å; V9-L25 HydrophobicContact CG1-CD2 3.84Å; V9-V29 HydrophobicContact CB-CG2 3.87Å; V9-V29 HydrophobicContact CG1-CB 4.48Å; V9-V29 HydrophobicContact CG1-CG2 3.22Å; V9-L87 HydrophobicContact CG2-CD2 3.9Å
10	L	66.1	Low	65.4	Low	86 Å²	86	72.6 Å²	72.6	45%	0.45	39%	0.387	S	S	.	.	H	α-helix	trans	-60.3	-38.9	172	-71.4	172	0	0	0	111.9	L6 S7 G12 F13 T14	L6-L10 HydrophobicContact CD2-CD1 4.1Å; L6-L10 HydrophobicContact CG-CD1 4.17Å; L6-L10 WeakPolarHBondContact O-CB 3.29Å; L6-L10 VanDerWaalsContact O-CG 3.26Å; L6-L10 WeakPolarHBondContact O-CG 3.45Å; L6-L10 PolarHBondContact O-N 3.43Å; S7-L10 PolarHBondContact O-N 2.89Å; L10-G12 VanDerWaalsContact C-N 3.26Å; L10-G12 PolarHBondContact O-N 2.96Å; L10-F13 WeakPolarHBondContact O-CB 3.28Å; L10-F13 PolarHBondContact O-N 3.39Å; L10-F13 VanDerWaalsContact O-N 3.12Å; L10-T14 PolarHBondContact O-OG1 2.97Å
11	F	67.2	Low	65.5	Low	120 Å²	120	70.6 Å²	70.6	53%	0.526	38%	0.377	S	S	.	.	H	α-helix	trans	-64.4	-34.5	172.6	-170.4	-106.3	0	0	0	111.8	S7 M8 V9 F13 T14 F15	S7-F11 VanDerWaalsContact O-CB 3.32Å; S7-F11 WeakPolarHBondContact O-CB 3.49Å; S7-F11 PolarHBondContact O-N 3.31Å; M8-F11 WeakPolarHBondContact O-CB 3.48Å; M8-F11 PolarHBondContact O-N 3.15Å; V9-F11 VanDerWaalsContact C-N 3.3Å; V9-F11 PolarHBondContact O-N 3.39Å; F11-F13 VanDerWaalsContact C-N 3.28Å; F11-F13 PolarHBondContact O-N 2.93Å; F11-T14 WeakPolarHBondContact O-CB 3.32Å; F11-T14 PolarHBondContact O-N 3.03Å; F11-T14 VanDerWaalsContact O-N 3.17Å; F11-F15 HydrophobicContact CD1-CD2 4.49Å; F11-F15 AromaticContact CD1-CE2 3.56Å; F11-F15 HydrophobicContact CD1-CE2 3.56Å; F11-F15 HydrophobicContact CD1-CZ 4.13Å; F11-F15 AromaticContact CE1-CE2 3.34Å; F11-F15 HydrophobicContact CE1-CE2 3.34Å; F11-F15 AromaticContact CE1-CZ 3.4Å; F11-F15 HydrophobicContact CE1-CZ 3.4Å; F11-F15 HydrophobicContact CZ-CE2 4.17Å; F11-F15 AromaticContact CZ-CZ 3.92Å; F11-F15 HydrophobicContact CZ-CZ 3.92Å; F11-F15 WeakPolarHBondContact O-CD2 3.34Å
12	G	65.3	Low	65.7	Low	21 Å²	21	69.8 Å²	69.8	22%	0.216	37%	0.367	C	S	.	.	H	α-helix	trans	-56.2	-36.5	169.6	0	0	0	0	0	114	M8 V9 L10 T14 F15	M8-G12 PolarHBondContact O-N 3.2Å; V9-G12 VanDerWaalsContact O-CA 3.3Å; V9-G12 WeakPolarHBondContact O-CA 3.33Å; V9-G12 PolarHBondContact O-N 2.95Å; L10-G12 VanDerWaalsContact C-N 3.26Å; L10-G12 PolarHBondContact O-N 2.96Å; G12-T14 VanDerWaalsContact C-N 3.31Å; G12-T14 PolarHBondContact O-N 3.45Å; G12-F15 PolarHBondContact O-N 3.44Å
13	F	64.9	Low	66.1	Low	48 Å²	48	68.6 Å²	68.6	21%	0.211	36%	0.363	C	S	.	.	H	α-helix	trans	-65.3	-32.7	176	-85.4	-86.8	0	0	0	113.7	V9 L10 F11 F15 R22 L25 L26 V29	V9-F13 HydrophobicContact CG1-CE2 4.38Å; V9-F13 WeakPolarHBondContact O-CD2 3.5Å; V9-F13 PolarHBondContact O-N 3.39Å; L10-F13 WeakPolarHBondContact O-CB 3.28Å; L10-F13 PolarHBondContact O-N 3.39Å; L10-F13 VanDerWaalsContact O-N 3.12Å; F11-F13 VanDerWaalsContact C-N 3.28Å; F11-F13 PolarHBondContact O-N 2.93Å; F13-F15 PolarHBondContact O-N 3.41Å; F13-R22 HydrophobicContact CD1-CB 4.45Å; F13-R22 HydrophobicContact CD1-CG 4.5Å; F13-R22 HydrophobicContact CE1-CB 4.19Å; F13-R22 WeakPolarHBondContact CE1-O 3.41Å; F13-L25 HydrophobicContact CD2-CB 4.22Å; F13-L25 HydrophobicContact CE1-CB 4.24Å; F13-L25 HydrophobicContact CE2-CB 3.61Å; F13-L25 HydrophobicContact CZ-CB 3.63Å; F13-L26 HydrophobicContact CE1-CD2 3.87Å; F13-L26 HydrophobicContact CE1-CG 3.71Å; F13-L26 HydrophobicContact CZ-CB 4.12Å; F13-L26 HydrophobicContact CZ-CD2 3.53Å; F13-L26 HydrophobicContact CZ-CG 3.5Å; F13-L26 VanDerWaalsContact CZ-CG 3.5Å; F13-V29 HydrophobicContact CE2-CG2 3.7Å
14	T	64.3	Low	66.3	Low	111 Å²	111	65.3 Å²	65.3	68%	0.681	35%	0.348	S	S	*	.	H	α-helix	trans	-67.8	-28.6	-177.9	-44.8	0	0	0	0	111.5	L10 F11 G12	L10-T14 PolarHBondContact O-OG1 2.97Å; F11-T14 WeakPolarHBondContact O-CB 3.32Å; F11-T14 PolarHBondContact O-N 3.03Å; F11-T14 VanDerWaalsContact O-N 3.17Å; G12-T14 VanDerWaalsContact C-N 3.31Å; G12-T14 PolarHBondContact O-N 3.45Å
15	F	67.4	Low	66.4	Low	109 Å²	109	62.4 Å²	62.4	48%	0.478	33%	0.329	S	S	.	.	S	Bend	trans	-66.6	141	174.8	-69.8	-67	0	0	0	111.2	F11 G12 F13 G17	F11-F15 HydrophobicContact CD1-CD2 4.49Å; F11-F15 AromaticContact CD1-CE2 3.56Å; F11-F15 HydrophobicContact CD1-CE2 3.56Å; F11-F15 HydrophobicContact CD1-CZ 4.13Å; F11-F15 AromaticContact CE1-CE2 3.34Å; F11-F15 HydrophobicContact CE1-CE2 3.34Å; F11-F15 AromaticContact CE1-CZ 3.4Å; F11-F15 HydrophobicContact CE1-CZ 3.4Å; F11-F15 HydrophobicContact CZ-CE2 4.17Å; F11-F15 AromaticContact CZ-CZ 3.92Å; F11-F15 HydrophobicContact CZ-CZ 3.92Å; F11-F15 WeakPolarHBondContact O-CD2 3.34Å; G12-F15 PolarHBondContact O-N 3.44Å; F13-F15 PolarHBondContact O-N 3.41Å; F15-G17 PolarHBondContact O-N 3.5Å
16	K	57.8	Low	66.4	Low	213 Å²	213	65.5 Å²	65.5	93%	0.926	35%	0.345	S	S	*	.			trans	-62.6	82.5	171.7	-80.6	-176.1	176	178	0	110
17	G	63.6	Low	66.5	Low	30 Å²	30	65.2 Å²	65.2	31%	0.309	35%	0.345	S	S	.	.			trans	-95.2	160.4	171.6	0	0	0	0	0	111.9	F15 T21	F15-G17 PolarHBondContact O-N 3.5Å; G17-T21 WeakPolarHBondContact CA-OG1 3.44Å
18	S	64.9	Low	66.6	Low	43 Å²	43	63.4 Å²	63.4	30%	0.301	33%	0.331	S	S	.	.			trans	-61.1	149	164.2	62.4	0	0	0	0	109.1	L20 T21 R22	S18-L20 PolarHBondContact O-N 3.27Å; S18-L20 VanDerWaalsContact O-N 3.12Å; S18-T21 PolarHBondContact N-OG1 3.36Å; S18-T21 WeakPolarHBondContact O-CA 3.46Å; S18-T21 PolarHBondContact O-N 3.09Å; S18-T21 PolarHBondContact O-OG1 3.14Å; S18-T21 WeakPolarHBondContact OG-CG2 3.44Å; S18-T21 PolarHBondContact OG-N 2.85Å; S18-T21 PolarHBondContact OG-OG1 2.88Å; S18-R22 PolarHBondContact O-N 2.99Å
19	P	63.3	Low	66.7	Low	23 Å²	23	58.5 Å²	58.5	15%	0.149	31%	0.308	C	S	.	.	H	α-helix	trans	-60.5	-23.1	176.7	29.7	-38	0	0	0	112	R22 A23 V64 F68 F71	P19-R22 WeakPolarHBondContact O-CB 3.23Å; P19-R22 PolarHBondContact O-N 2.99Å; P19-A23 VanDerWaalsContact O-CB 3.32Å; P19-A23 WeakPolarHBondContact O-CB 3.39Å; P19-A23 PolarHBondContact O-N 3.25Å; P19-V64 HydrophobicContact CB-CG1 3.86Å; P19-V64 HydrophobicContact CG-CG1 4.43Å; P19-F68 HydrophobicContact CB-CD2 4.22Å; P19-F68 HydrophobicContact CB-CE2 4.33Å; P19-F68 HydrophobicContact CG-CB 4.49Å; P19-F68 HydrophobicContact CG-CD2 3.97Å; P19-F68 HydrophobicContact CG-CE2 4.39Å; P19-F68 HydrophobicContact CG-CG 4.22Å; P19-F71 HydrophobicContact CB-CE2 4.35Å; P19-F71 VanDerWaalsContact CD-CE1 3.46Å; P19-F71 HydrophobicContact CG-CD2 3.88Å; P19-F71 HydrophobicContact CG-CE1 3.92Å; P19-F71 HydrophobicContact CG-CE2 2.94Å; P19-F71 HydrophobicContact CG-CZ 3.03Å
20	L	65.4	Low	66.6	Low	29 Å²	29	58.6 Å²	58.6	15%	0.152	31%	0.308	C	S	.	.	H	α-helix	trans	-65	-44.9	168.6	-164.7	115	0	0	0	112.2	S18 R22 A23 V24 L73 F76	S18-L20 PolarHBondContact O-N 3.27Å; S18-L20 VanDerWaalsContact O-N 3.12Å; L20-R22 VanDerWaalsContact C-N 3.26Å; L20-R22 PolarHBondContact O-N 3.02Å; L20-A23 WeakPolarHBondContact O-CB 3.46Å; L20-A23 PolarHBondContact O-N 3.46Å; L20-V24 WeakPolarHBondContact O-CG2 3.34Å; L20-V24 PolarHBondContact O-N 3.38Å; L20-L73 HydrophobicContact CD1-CD2 3.59Å; L20-L73 HydrophobicContact CD2-CD2 3.68Å; L20-L73 HydrophobicContact CG-CD2 4.29Å; L20-F76 HydrophobicContact CD2-CE2 4.33Å
21	T	67	Low	66.8	Low	31 Å²	31	58.6 Å²	58.6	19%	0.19	31%	0.305	C	S	.	.	H	α-helix	trans	-61.8	-36.6	173.4	56.1	0	0	0	0	111.6	G17 S18 V24 L25 F76	G17-T21 WeakPolarHBondContact CA-OG1 3.44Å; S18-T21 PolarHBondContact N-OG1 3.36Å; S18-T21 WeakPolarHBondContact O-CA 3.46Å; S18-T21 PolarHBondContact O-N 3.09Å; S18-T21 PolarHBondContact O-OG1 3.14Å; S18-T21 WeakPolarHBondContact OG-CG2 3.44Å; S18-T21 PolarHBondContact OG-N 2.85Å; S18-T21 PolarHBondContact OG-OG1 2.88Å; T21-V24 PolarHBondContact O-N 2.94Å; T21-L25 WeakPolarHBondContact O-CB 3.42Å; T21-L25 WeakPolarHBondContact O-CD1 3.38Å; T21-L25 WeakPolarHBondContact O-CG 3.22Å; T21-L25 PolarHBondContact O-N 2.93Å; T21-F76 HydrophobicContact CG2-CE2 3.8Å; T21-F76 HydrophobicContact CG2-CZ 4.07Å
22	R	68.2	Low	66.9	Low	111 Å²	111	53.6 Å²	53.6	42%	0.419	28%	0.283	S	S	.	.	H	α-helix	trans	-66	-40.4	174.2	-64.9	179	173.9	177.1	-3.8	112.3	F13 S18 P19 L20 L25 L26	F13-R22 HydrophobicContact CD1-CB 4.45Å; F13-R22 HydrophobicContact CD1-CG 4.5Å; F13-R22 HydrophobicContact CE1-CB 4.19Å; F13-R22 WeakPolarHBondContact CE1-O 3.41Å; S18-R22 PolarHBondContact O-N 2.99Å; P19-R22 WeakPolarHBondContact O-CB 3.23Å; P19-R22 PolarHBondContact O-N 2.99Å; L20-R22 VanDerWaalsContact C-N 3.26Å; L20-R22 PolarHBondContact O-N 3.02Å; R22-L25 PolarHBondContact O-N 3.41Å; R22-L26 WeakPolarHBondContact O-CG 3.47Å; R22-L26 PolarHBondContact O-N 3.28Å
23	A	69.8	Low	67.1	Low	8 Å²	8	53.9 Å²	53.9	7%	0.066	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-47.8	174.3	0	0	0	0	0	111.8	P19 L20 L25 L26 V27 L61	P19-A23 VanDerWaalsContact O-CB 3.32Å; P19-A23 WeakPolarHBondContact O-CB 3.39Å; P19-A23 PolarHBondContact O-N 3.25Å; L20-A23 WeakPolarHBondContact O-CB 3.46Å; L20-A23 PolarHBondContact O-N 3.46Å; A23-L25 VanDerWaalsContact C-N 3.34Å; A23-L25 PolarHBondContact O-N 2.88Å; A23-L26 WeakPolarHBondContact O-CB 3.42Å; A23-L26 PolarHBondContact O-N 3.34Å; A23-L26 VanDerWaalsContact O-N 3.15Å; A23-V27 WeakPolarHBondContact O-CG2 3.2Å; A23-V27 PolarHBondContact O-N 3.12Å; A23-V27 VanDerWaalsContact O-N 3.1Å; A23-L61 HydrophobicContact CB-CD2 3.32Å
24	V	68.6	Low	67.3	Low	55 Å²	55	51.9 Å²	51.9	33%	0.333	27%	0.273	S	S	.	.	H	α-helix	trans	-62.8	-41.8	175.1	175.2	0	0	0	0	110.9	L20 T21 L26 V27 L28	L20-V24 WeakPolarHBondContact O-CG2 3.34Å; L20-V24 PolarHBondContact O-N 3.38Å; T21-V24 PolarHBondContact O-N 2.94Å; V24-L26 VanDerWaalsContact C-N 3.29Å; V24-L26 PolarHBondContact O-N 3.38Å; V24-V27 PolarHBondContact O-N 3.42Å; V24-L28 HydrophobicContact CG1-CD1 4.29Å; V24-L28 WeakPolarHBondContact O-CG 3.31Å; V24-L28 PolarHBondContact O-N 2.76Å
25	L	68.8	Low	67.5	Low	26 Å²	26	47.6 Å²	47.6	14%	0.136	25%	0.246	C	C	.	.	H	α-helix	trans	-61.8	-35.9	174.4	-72.3	165.1	0	0	0	112	V9 F13 T21 R22 A23 L28 V29 L87	V9-L25 HydrophobicContact CG1-CB 4.44Å; V9-L25 HydrophobicContact CG1-CD2 3.84Å; F13-L25 HydrophobicContact CD2-CB 4.22Å; F13-L25 HydrophobicContact CE1-CB 4.24Å; F13-L25 HydrophobicContact CE2-CB 3.61Å; F13-L25 HydrophobicContact CZ-CB 3.63Å; T21-L25 WeakPolarHBondContact O-CB 3.42Å; T21-L25 WeakPolarHBondContact O-CD1 3.38Å; T21-L25 WeakPolarHBondContact O-CG 3.22Å; T21-L25 PolarHBondContact O-N 2.93Å; R22-L25 PolarHBondContact O-N 3.41Å; A23-L25 VanDerWaalsContact C-N 3.34Å; A23-L25 PolarHBondContact O-N 2.88Å; L25-L28 PolarHBondContact O-N 3.35Å; L25-V29 WeakPolarHBondContact O-CG2 3.44Å; L25-V29 PolarHBondContact O-N 3.37Å; L25-L87 HydrophobicContact CD2-CD1 4.34Å
26	L	69.2	Low	67.4	Low	75 Å²	75	48.4 Å²	48.4	39%	0.393	25%	0.246	S	C	.	.	H	α-helix	trans	-63.9	-45.3	176.4	-81.8	173.3	0	0	0	111.1	F13 R22 A23 V24 L28 V29 S30	F13-L26 HydrophobicContact CE1-CD2 3.87Å; F13-L26 HydrophobicContact CE1-CG 3.71Å; F13-L26 HydrophobicContact CZ-CB 4.12Å; F13-L26 HydrophobicContact CZ-CD2 3.53Å; F13-L26 HydrophobicContact CZ-CG 3.5Å; F13-L26 VanDerWaalsContact CZ-CG 3.5Å; R22-L26 WeakPolarHBondContact O-CG 3.47Å; R22-L26 PolarHBondContact O-N 3.28Å; A23-L26 WeakPolarHBondContact O-CB 3.42Å; A23-L26 PolarHBondContact O-N 3.34Å; A23-L26 VanDerWaalsContact O-N 3.15Å; V24-L26 VanDerWaalsContact C-N 3.29Å; V24-L26 PolarHBondContact O-N 3.38Å; L26-L28 PolarHBondContact O-N 2.97Å; L26-V29 PolarHBondContact O-N 2.93Å; L26-S30 WeakPolarHBondContact O-CB 3.46Å; L26-S30 PolarHBondContact O-N 2.91Å; L26-S30 PolarHBondContact O-OG 3.3Å
27	V	69.9	Low	67.7	Low	44 Å²	44	40.4 Å²	40.4	27%	0.267	21%	0.212	S	C	.	.	H	α-helix	trans	-59.5	-37	174	178.1	0	0	0	0	111.3	A23 V24 S30 F31 I57 L61	A23-V27 WeakPolarHBondContact O-CG2 3.2Å; A23-V27 PolarHBondContact O-N 3.12Å; A23-V27 VanDerWaalsContact O-N 3.1Å; V24-V27 PolarHBondContact O-N 3.42Å; V27-S30 VanDerWaalsContact C-OG 3.28Å; V27-S30 WeakPolarHBondContact CA-OG 3.42Å; V27-S30 PolarHBondContact O-OG 2.86Å; V27-F31 VanDerWaalsContact O-CB 3.3Å; V27-F31 WeakPolarHBondContact O-CB 3.32Å; V27-F31 PolarHBondContact O-N 3.17Å; V27-I57 HydrophobicContact CG2-CD1 4.41Å; V27-I57 HydrophobicContact CG2-CG2 3.5Å; V27-L61 HydrophobicContact CG2-CD1 4.33Å
28	L	69.3	Low	67.7	Low	24 Å²	24	42.1 Å²	42.1	13%	0.126	21%	0.211	C	C	.	.	H	α-helix	trans	-74	-43	178.2	-70	175.2	0	0	0	112.4	V24 L25 L26 S30 F31 M32 L87 L91	V24-L28 HydrophobicContact CG1-CD1 4.29Å; V24-L28 WeakPolarHBondContact O-CG 3.31Å; V24-L28 PolarHBondContact O-N 2.76Å; L25-L28 PolarHBondContact O-N 3.35Å; L26-L28 PolarHBondContact O-N 2.97Å; L28-S30 VanDerWaalsContact C-N 3.29Å; L28-S30 PolarHBondContact O-N 3.47Å; L28-F31 PolarHBondContact O-N 3.22Å; L28-M32 VanDerWaalsContact O-CG 3.27Å; L28-M32 WeakPolarHBondContact O-CG 3.37Å; L28-M32 PolarHBondContact O-N 2.95Å; L28-L87 HydrophobicContact CD1-CB 4.37Å; L28-L87 HydrophobicContact CD1-CD1 3.7Å; L28-L87 HydrophobicContact CD1-CG 4.42Å; L28-L91 HydrophobicContact CD2-CD1 4.27Å
29	V	70.6	Confident	67.7	Low	16 Å²	16	43 Å²	43	10%	0.097	21%	0.209	C	C	.	.	H	α-helix	trans	-58.6	-46.1	174.3	172.7	0	0	0	0	110.2	L6 V9 F13 L25 L26 F31 M32 V33	L6-V29 HydrophobicContact CD1-CG1 3.98Å; V9-V29 HydrophobicContact CB-CG2 3.87Å; V9-V29 HydrophobicContact CG1-CB 4.48Å; V9-V29 HydrophobicContact CG1-CG2 3.22Å; F13-V29 HydrophobicContact CE2-CG2 3.7Å; L25-V29 WeakPolarHBondContact O-CG2 3.44Å; L25-V29 PolarHBondContact O-N 3.37Å; L26-V29 PolarHBondContact O-N 2.93Å; V29-F31 VanDerWaalsContact C-N 3.31Å; V29-F31 PolarHBondContact O-N 3.15Å; V29-M32 PolarHBondContact O-N 3.16Å; V29-V33 HydrophobicContact CG1-CG2 4.16Å; V29-V33 VanDerWaalsContact O-CG2 3.32Å; V29-V33 WeakPolarHBondContact O-CG2 3.49Å; V29-V33 PolarHBondContact O-N 2.88Å
30	S	68.2	Low	67.8	Low	7 Å²	7	45.7 Å²	45.7	5%	0.049	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-42.1	-179.8	63.4	0	0	0	0	113.1	L26 V27 L28 M32 V33 S34 I57	L26-S30 WeakPolarHBondContact O-CB 3.46Å; L26-S30 PolarHBondContact O-N 2.91Å; L26-S30 PolarHBondContact O-OG 3.3Å; V27-S30 VanDerWaalsContact C-OG 3.28Å; V27-S30 WeakPolarHBondContact CA-OG 3.42Å; V27-S30 PolarHBondContact O-OG 2.86Å; L28-S30 VanDerWaalsContact C-N 3.29Å; L28-S30 PolarHBondContact O-N 3.47Å; S30-M32 VanDerWaalsContact C-N 3.33Å; S30-V33 PolarHBondContact O-N 3.35Å; S30-S34 WeakPolarHBondContact O-CB 3.17Å; S30-S34 PolarHBondContact O-N 3.01Å; S30-S34 PolarHBondContact O-OG 3.2Å; S30-I57 VanDerWaalsContact CB-CD1 3.41Å; S30-I57 WeakPolarHBondContact OG-CD1 3.32Å
31	F	69.7	Low	67.4	Low	87 Å²	87	49.2 Å²	49.2	38%	0.382	24%	0.24	S	C	.	.	H	α-helix	trans	-62.2	-44.7	177	-173.4	-103.7	0	0	0	110.4	V27 L28 V29 V33 S34 L35 L91	V27-F31 VanDerWaalsContact O-CB 3.3Å; V27-F31 WeakPolarHBondContact O-CB 3.32Å; V27-F31 PolarHBondContact O-N 3.17Å; L28-F31 PolarHBondContact O-N 3.22Å; V29-F31 VanDerWaalsContact C-N 3.31Å; V29-F31 PolarHBondContact O-N 3.15Å; F31-V33 PolarHBondContact O-N 3.48Å; F31-S34 PolarHBondContact O-N 3.49Å; F31-S34 PolarHBondContact O-OG 3.1Å; F31-L35 HydrophobicContact CD1-CD1 3.93Å; F31-L35 HydrophobicContact CD1-CG 4.43Å; F31-L35 HydrophobicContact CE1-CD1 3.51Å; F31-L35 HydrophobicContact CE1-CG 4.12Å; F31-L35 HydrophobicContact CZ-CD1 4.12Å; F31-L35 HydrophobicContact CZ-CD2 4.41Å; F31-L35 HydrophobicContact CZ-CG 4.34Å; F31-L35 WeakPolarHBondContact O-CG 3.35Å; F31-L35 PolarHBondContact O-N 3.42Å; F31-L91 HydrophobicContact CD1-CD2 3.74Å; F31-L91 HydrophobicContact CE1-CD2 3.68Å
32	M	68.9	Low	66.8	Low	14 Å²	14	48.7 Å²	48.7	7%	0.069	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-42.1	176.2	-67.8	-64.1	-170.8	0	0	113	L5 L28 V29 S30 S34 L35 W36 L91	L5-M32 HydrophobicContact CD1-CE 4.5Å; L28-M32 VanDerWaalsContact O-CG 3.27Å; L28-M32 WeakPolarHBondContact O-CG 3.37Å; L28-M32 PolarHBondContact O-N 2.95Å; V29-M32 PolarHBondContact O-N 3.16Å; S30-M32 VanDerWaalsContact C-N 3.33Å; M32-S34 VanDerWaalsContact C-N 3.32Å; M32-L35 PolarHBondContact O-N 3.43Å; M32-W36 PolarHBondContact O-N 2.79Å; M32-L91 HydrophobicContact CE-CD2 3.18Å; M32-L91 HydrophobicContact CE-CG 3.52Å; M32-L91 HydrophobicContact SD-CD2 3.74Å
33	V	69.3	Low	66.3	Low	28 Å²	28	46.7 Å²	46.7	17%	0.17	23%	0.232	C	C	.	.	H	α-helix	trans	-64	-40.4	175.7	172.8	0	0	0	0	110.5	L6 V29 S30 F31 W36 M37 F49	L6-V33 HydrophobicContact CD1-CG2 3.54Å; V29-V33 HydrophobicContact CG1-CG2 4.16Å; V29-V33 VanDerWaalsContact O-CG2 3.32Å; V29-V33 WeakPolarHBondContact O-CG2 3.49Å; V29-V33 PolarHBondContact O-N 2.88Å; S30-V33 PolarHBondContact O-N 3.35Å; F31-V33 PolarHBondContact O-N 3.48Å; V33-W36 WeakPolarHBondContact O-CB 3.49Å; V33-W36 PolarHBondContact O-N 3.5Å; V33-W36 VanDerWaalsContact O-N 3.14Å; V33-M37 HydrophobicContact CG1-CG 4.49Å; V33-M37 WeakPolarHBondContact O-CG 3.39Å; V33-M37 PolarHBondContact O-N 3.23Å; V33-F49 HydrophobicContact CG1-CE1 4.06Å; V33-F49 HydrophobicContact CG1-CZ 4.5Å
34	S	68.7	Low	65.7	Low	5 Å²	5	47.5 Å²	47.5	4%	0.035	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-45.6	175.8	74.6	0	0	0	0	111.2	S30 F31 M32 W36 M37 F38 F46	S30-S34 WeakPolarHBondContact O-CB 3.17Å; S30-S34 PolarHBondContact O-N 3.01Å; S30-S34 PolarHBondContact O-OG 3.2Å; F31-S34 PolarHBondContact O-N 3.49Å; F31-S34 PolarHBondContact O-OG 3.1Å; M32-S34 VanDerWaalsContact C-N 3.32Å; S34-W36 PolarHBondContact O-N 3.25Å; S34-M37 PolarHBondContact O-N 3.29Å; S34-M37 VanDerWaalsContact O-N 3.16Å; S34-F38 PolarHBondContact O-N 3.48Å; S34-F46 VanDerWaalsContact C-CE2 3.43Å; S34-F46 WeakPolarHBondContact O-CD2 3.33Å; S34-F46 VanDerWaalsContact O-CE2 3.28Å; S34-F46 WeakPolarHBondContact O-CE2 3.34Å
35	L	68.3	Low	65	Low	22 Å²	22	52 Å²	52	12%	0.115	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-28.8	175.3	-70	178	0	0	0	112.5	F31 M32 F38 K39	F31-L35 HydrophobicContact CD1-CD1 3.93Å; F31-L35 HydrophobicContact CD1-CG 4.43Å; F31-L35 HydrophobicContact CE1-CD1 3.51Å; F31-L35 HydrophobicContact CE1-CG 4.12Å; F31-L35 HydrophobicContact CZ-CD1 4.12Å; F31-L35 HydrophobicContact CZ-CD2 4.41Å; F31-L35 HydrophobicContact CZ-CG 4.34Å; F31-L35 WeakPolarHBondContact O-CG 3.35Å; F31-L35 PolarHBondContact O-N 3.42Å; M32-L35 PolarHBondContact O-N 3.43Å; L35-F38 WeakPolarHBondContact O-CB 3.34Å; L35-K39 PolarHBondContact O-N 3.02Å
36	W	66.6	Low	64.6	Low	126 Å²	126	52.3 Å²	52.3	48%	0.477	25%	0.249	S	C	.	.	H	α-helix	trans	-72.2	-45.7	172.9	-177.7	43.4	0	0	0	112.3	M2 M32 V33 S34 F38 K39 V40	M2-W36 HydrophobicContact CE-CB 3.74Å; M2-W36 HydrophobicContact CE-CG 4.08Å; M32-W36 PolarHBondContact O-N 2.79Å; V33-W36 WeakPolarHBondContact O-CB 3.49Å; V33-W36 PolarHBondContact O-N 3.5Å; V33-W36 VanDerWaalsContact O-N 3.14Å; S34-W36 PolarHBondContact O-N 3.25Å; W36-F38 PolarHBondContact O-N 2.8Å; W36-K39 PolarHBondContact O-N 2.82Å; W36-V40 HydrophobicContact CG-CG2 4.49Å; W36-V40 HydrophobicContact CZ2-CG2 4.45Å; W36-V40 VanDerWaalsContact NE1-CG2 3.32Å; W36-V40 WeakPolarHBondContact O-CG2 3.36Å; W36-V40 PolarHBondContact O-N 3.36Å
37	M	63.4	Low	64.1	Low	44 Å²	44	49 Å²	49	22%	0.217	23%	0.232	C	C	.	.	H	α-helix	trans	-58.3	-36.1	172.8	-68.2	-59.7	-68.2	0	0	111.1	V33 S34 K39 V40 F41	V33-M37 HydrophobicContact CG1-CG 4.49Å; V33-M37 WeakPolarHBondContact O-CG 3.39Å; V33-M37 PolarHBondContact O-N 3.23Å; S34-M37 PolarHBondContact O-N 3.29Å; S34-M37 VanDerWaalsContact O-N 3.16Å; M37-K39 VanDerWaalsContact C-N 3.34Å; M37-K39 PolarHBondContact O-N 3.33Å; M37-V40 PolarHBondContact O-N 3.25Å; M37-F41 HydrophobicContact CE-CD2 3.35Å; M37-F41 HydrophobicContact CE-CE2 3.56Å; M37-F41 HydrophobicContact CE-CG 4.27Å; M37-F41 WeakPolarHBondContact O-CA 3.48Å; M37-F41 WeakPolarHBondContact O-CB 3.36Å; M37-F41 PolarHBondContact O-N 3.12Å; M37-F41 VanDerWaalsContact O-O 3.08Å; M37-F41 HydrophobicContact SD-CD2 4.04Å; M37-F41 HydrophobicContact SD-CE2 4.19Å
38	F	65	Low	63.5	Low	66 Å²	66	52.5 Å²	52.5	29%	0.289	25%	0.248	S	C	.	.	H	α-helix	trans	-61.2	-36.9	172.4	-178.5	-103.5	0	0	0	114.1	S34 L35 W36 F41 F43 F46	S34-F38 PolarHBondContact O-N 3.48Å; L35-F38 WeakPolarHBondContact O-CB 3.34Å; W36-F38 PolarHBondContact O-N 2.8Å; F38-F41 CarbonylContact C-O 3.57Å; F38-F43 HydrophobicContact CD2-CD2 4.43Å; F38-F43 HydrophobicContact CE2-CB 4.45Å; F38-F43 AromaticContact CE2-CD2 3.3Å; F38-F43 HydrophobicContact CE2-CD2 3.3Å; F38-F43 AromaticContact CE2-CE2 3.55Å; F38-F43 HydrophobicContact CE2-CE2 3.55Å; F38-F43 AromaticContact CE2-CG 3.98Å; F38-F43 HydrophobicContact CE2-CG 3.98Å; F38-F43 HydrophobicContact CE2-CZ 4.45Å; F38-F43 AromaticContact CZ-CD2 3.82Å; F38-F43 HydrophobicContact CZ-CD2 3.82Å; F38-F43 AromaticContact CZ-CE2 3.89Å; F38-F43 HydrophobicContact CZ-CE2 3.89Å; F38-F46 HydrophobicContact CB-CB 4.25Å; F38-F46 HydrophobicContact CB-CD2 3.58Å; F38-F46 HydrophobicContact CB-CE2 3.98Å; F38-F46 HydrophobicContact CB-CG 3.94Å; F38-F46 HydrophobicContact CD2-CB 3.93Å; F38-F46 AromaticContact CD2-CD1 3.88Å; F38-F46 HydrophobicContact CD2-CD1 3.88Å; F38-F46 HydrophobicContact CD2-CD2 4.25Å; F38-F46 HydrophobicContact CD2-CE1 4.43Å; F38-F46 AromaticContact CD2-CG 3.76Å; F38-F46 HydrophobicContact CD2-CG 3.76Å; F38-F46 HydrophobicContact CG-CD2 4.34Å; F38-F46 HydrophobicContact CG-CG 4.3Å
39	K	64.6	Low	63.1	Low	61 Å²	61	54.9 Å²	54.9	27%	0.265	26%	0.258	S	S	.	.	H	α-helix	trans	-77.1	-34.8	178.3	-73.6	-162.7	-179.4	-166.3	0	112.6	M2 L35 W36 M37 M101	M2-K39 HydrophobicContact CE-CD 3.8Å; M2-K39 HydrophobicContact CE-CG 4.35Å; M2-K39 HydrophobicContact SD-CD 4.49Å; L35-K39 PolarHBondContact O-N 3.02Å; W36-K39 PolarHBondContact O-N 2.82Å; M37-K39 VanDerWaalsContact C-N 3.34Å; M37-K39 PolarHBondContact O-N 3.33Å; K39-M101 HydrophobicContact CD-SD 4.06Å
40	V	64.4	Low	63	Low	81 Å²	81	55.1 Å²	55.1	49%	0.491	26%	0.259	S	S	.	.	H	α-helix	trans	-86.9	-35.9	-175.6	178	0	0	0	0	111.6	W36 M37	W36-V40 HydrophobicContact CG-CG2 4.49Å; W36-V40 HydrophobicContact CZ2-CG2 4.45Å; W36-V40 VanDerWaalsContact NE1-CG2 3.32Å; W36-V40 WeakPolarHBondContact O-CG2 3.36Å; W36-V40 PolarHBondContact O-N 3.36Å; M37-V40 PolarHBondContact O-N 3.25Å
41	F	57.3	Low	62.6	Low	103 Å²	103	59.1 Å²	59.1	45%	0.452	28%	0.28	S	S	.	.	S	Bend	trans	-121	149.4	-178.3	-68.3	-84.5	0	0	0	110.8	M37 F38	M37-F41 HydrophobicContact CE-CD2 3.35Å; M37-F41 HydrophobicContact CE-CE2 3.56Å; M37-F41 HydrophobicContact CE-CG 4.27Å; M37-F41 WeakPolarHBondContact O-CA 3.48Å; M37-F41 WeakPolarHBondContact O-CB 3.36Å; M37-F41 PolarHBondContact O-N 3.12Å; M37-F41 VanDerWaalsContact O-O 3.08Å; M37-F41 HydrophobicContact SD-CD2 4.04Å; M37-F41 HydrophobicContact SD-CE2 4.19Å; F38-F41 CarbonylContact C-O 3.57Å
42	S	55.2	Low	62.1	Low	20 Å²	20	59.8 Å²	59.8	14%	0.14	29%	0.291	C	S	.	.			trans	-57.3	156	179.6	-49.5	0	0	0	0	113.9	S44 Y45 E107	S42-S44 PolarHBondContact O-N 3.04Å; S42-Y45 PolarHBondContact O-N 2.92Å; S42-Y45 VanDerWaalsContact O-N 3.13Å; S42-E107 WeakPolarHBondContact CB-OE2 3.45Å; S42-E107 PolarHBondContact OG-OE2 3.33Å
43	F	58	Low	61.9	Low	68 Å²	68	63.2 Å²	63.2	30%	0.298	30%	0.304	S	S	.	.	H	α-helix	trans	-45.4	-33.6	-170.6	-153.5	-79	0	0	0	115.4	F38 F46 L47 V118	F38-F43 HydrophobicContact CD2-CD2 4.43Å; F38-F43 HydrophobicContact CE2-CB 4.45Å; F38-F43 AromaticContact CE2-CD2 3.3Å; F38-F43 HydrophobicContact CE2-CD2 3.3Å; F38-F43 AromaticContact CE2-CE2 3.55Å; F38-F43 HydrophobicContact CE2-CE2 3.55Å; F38-F43 AromaticContact CE2-CG 3.98Å; F38-F43 HydrophobicContact CE2-CG 3.98Å; F38-F43 HydrophobicContact CE2-CZ 4.45Å; F38-F43 AromaticContact CZ-CD2 3.82Å; F38-F43 HydrophobicContact CZ-CD2 3.82Å; F38-F43 AromaticContact CZ-CE2 3.89Å; F38-F43 HydrophobicContact CZ-CE2 3.89Å; F43-F46 WeakPolarHBondContact O-CB 3.41Å; F43-L47 HydrophobicContact CD1-CD1 4.14Å; F43-L47 HydrophobicContact CD1-CG 4.49Å; F43-L47 HydrophobicContact CE1-CD1 4.2Å; F43-L47 HydrophobicContact CE1-CG 4.49Å; F43-V118 HydrophobicContact CE1-CG2 4.11Å; F43-V118 HydrophobicContact CZ-CG2 3.83Å
44	S	56.3	Low	61.8	Low	25 Å²	25	63.9 Å²	63.9	18%	0.175	31%	0.307	C	S	.	.	H	α-helix	trans	-70.8	-38.5	-175.8	53.8	0	0	0	0	113.9	S42 F46 L47	S42-S44 PolarHBondContact O-N 3.04Å; S44-F46 VanDerWaalsContact C-N 3.32Å; S44-L47 PolarHBondContact O-N 2.62Å
45	Y	54.4	Low	61.5	Low	150 Å²	150	65 Å²	65	59%	0.588	32%	0.319	S	S	*	.	H	α-helix	trans	-73.5	-27.7	179.5	-70	-81.4	0	0	0	112.2	S42 F49	S42-Y45 PolarHBondContact O-N 2.92Å; S42-Y45 VanDerWaalsContact O-N 3.13Å; Y45-F49 WeakPolarHBondContact O-CB 3.37Å; Y45-F49 PolarHBondContact O-N 3.42Å
46	F	59.1	Low	61.3	Low	33 Å²	33	65.7 Å²	65.7	15%	0.145	33%	0.333	C	S	.	.	H	α-helix	trans	-60.2	-44.9	173.4	170.9	-109.8	0	0	0	111.9	S34 F38 F43 S44 F49 V50	S34-F46 VanDerWaalsContact C-CE2 3.43Å; S34-F46 WeakPolarHBondContact O-CD2 3.33Å; S34-F46 VanDerWaalsContact O-CE2 3.28Å; S34-F46 WeakPolarHBondContact O-CE2 3.34Å; F38-F46 HydrophobicContact CB-CB 4.25Å; F38-F46 HydrophobicContact CB-CD2 3.58Å; F38-F46 HydrophobicContact CB-CE2 3.98Å; F38-F46 HydrophobicContact CB-CG 3.94Å; F38-F46 HydrophobicContact CD2-CB 3.93Å; F38-F46 AromaticContact CD2-CD1 3.88Å; F38-F46 HydrophobicContact CD2-CD1 3.88Å; F38-F46 HydrophobicContact CD2-CD2 4.25Å; F38-F46 HydrophobicContact CD2-CE1 4.43Å; F38-F46 AromaticContact CD2-CG 3.76Å; F38-F46 HydrophobicContact CD2-CG 3.76Å; F38-F46 HydrophobicContact CG-CD2 4.34Å; F38-F46 HydrophobicContact CG-CG 4.3Å; F43-F46 WeakPolarHBondContact O-CB 3.41Å; S44-F46 VanDerWaalsContact C-N 3.32Å; F46-F49 PolarHBondContact O-N 3.36Å; F46-V50 HydrophobicContact CD1-CG2 4.33Å; F46-V50 HydrophobicContact CD2-CG2 3.91Å; F46-V50 HydrophobicContact CE1-CG2 4Å; F46-V50 HydrophobicContact CE2-CG2 3.58Å; F46-V50 HydrophobicContact CG-CG2 4.3Å; F46-V50 HydrophobicContact CZ-CG2 3.64Å; F46-V50 VanDerWaalsContact O-CG2 3.25Å; F46-V50 WeakPolarHBondContact O-CG2 3.49Å; F46-V50 PolarHBondContact O-N 3.32Å
47	L	58.6	Low	61.2	Low	5 Å²	5	60.4 Å²	60.4	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-64.9	-46.9	-175	-72.6	173	0	0	0	113.2	F43 S44 F49 V50 L51 L112 Y121	F43-L47 HydrophobicContact CD1-CD1 4.14Å; F43-L47 HydrophobicContact CD1-CG 4.49Å; F43-L47 HydrophobicContact CE1-CD1 4.2Å; F43-L47 HydrophobicContact CE1-CG 4.49Å; S44-L47 PolarHBondContact O-N 2.62Å; L47-F49 VanDerWaalsContact C-N 3.29Å; L47-F49 PolarHBondContact O-N 3.48Å; L47-V50 PolarHBondContact O-N 3.04Å; L47-L51 PolarHBondContact O-N 2.96Å; L47-L112 VanDerWaalsContact CD1-O 3.24Å; L47-L112 WeakPolarHBondContact CD1-O 3.49Å; L47-Y121 HydrophobicContact CB-CE2 4.35Å; L47-Y121 HydrophobicContact CD1-CE2 3.91Å; L47-Y121 HydrophobicContact CD2-CD2 3.32Å; L47-Y121 HydrophobicContact CD2-CE1 4.46Å; L47-Y121 HydrophobicContact CD2-CE2 3.22Å; L47-Y121 HydrophobicContact CD2-CG 4.06Å; L47-Y121 HydrophobicContact CG-CE2 4Å
48	L	58.3	Low	61.4	Low	117 Å²	117	61.8 Å²	61.8	61%	0.613	32%	0.317	S	S	*	.	H	α-helix	trans	-62	-40.9	176.2	-101.7	166.8	0	0	0	111.4	L51 V52	L48-L51 PolarHBondContact O-N 2.87Å; L48-V52 WeakPolarHBondContact O-CG2 3.3Å; L48-V52 PolarHBondContact O-N 3.26Å; L48-V52 VanDerWaalsContact O-N 3.08Å
49	F	60.3	Low	61.3	Low	75 Å²	75	63.2 Å²	63.2	33%	0.329	33%	0.33	S	S	.	.	H	α-helix	trans	-66.3	-44	178.2	-157.5	-95.3	0	0	0	111.1	V33 Y45 F46 L47 L51 Y53	V33-F49 HydrophobicContact CG1-CE1 4.06Å; V33-F49 HydrophobicContact CG1-CZ 4.5Å; Y45-F49 WeakPolarHBondContact O-CB 3.37Å; Y45-F49 PolarHBondContact O-N 3.42Å; F46-F49 PolarHBondContact O-N 3.36Å; L47-F49 VanDerWaalsContact C-N 3.29Å; L47-F49 PolarHBondContact O-N 3.48Å; F49-L51 VanDerWaalsContact C-N 3.33Å; F49-L51 PolarHBondContact O-N 2.94Å; F49-Y53 HydrophobicContact CD1-CD2 4.12Å; F49-Y53 AromaticContact CE1-CD2 3.38Å; F49-Y53 HydrophobicContact CE1-CD2 3.38Å; F49-Y53 AromaticContact CE1-CE2 3.88Å; F49-Y53 HydrophobicContact CE1-CE2 3.88Å; F49-Y53 HydrophobicContact CE1-CG 4.23Å; F49-Y53 AromaticContact CZ-CD2 3.65Å; F49-Y53 HydrophobicContact CZ-CD2 3.65Å; F49-Y53 AromaticContact CZ-CE2 3.97Å; F49-Y53 HydrophobicContact CZ-CE2 3.97Å; F49-Y53 WeakPolarHBondContact O-CB 3.48Å; F49-Y53 PolarHBondContact O-N 2.85Å
50	V	68.3	Low	61.3	Low	20 Å²	20	65.9 Å²	65.9	12%	0.121	35%	0.345	C	S	.	.	H	α-helix	trans	-57.2	-45.9	174.9	170.4	0	0	0	0	110.9	F46 L47 Y53 V54	F46-V50 HydrophobicContact CD1-CG2 4.33Å; F46-V50 HydrophobicContact CD2-CG2 3.91Å; F46-V50 HydrophobicContact CE1-CG2 4Å; F46-V50 HydrophobicContact CE2-CG2 3.58Å; F46-V50 HydrophobicContact CG-CG2 4.3Å; F46-V50 HydrophobicContact CZ-CG2 3.64Å; F46-V50 VanDerWaalsContact O-CG2 3.25Å; F46-V50 WeakPolarHBondContact O-CG2 3.49Å; F46-V50 PolarHBondContact O-N 3.32Å; L47-V50 PolarHBondContact O-N 3.04Å; V50-Y53 PolarHBondContact O-N 3.23Å; V50-V54 HydrophobicContact CG1-CG2 4Å; V50-V54 VanDerWaalsContact O-CB 3.3Å; V50-V54 WeakPolarHBondContact O-CB 3.14Å; V50-V54 WeakPolarHBondContact O-CG2 3.44Å; V50-V54 PolarHBondContact O-N 3.23Å
51	L	60.2	Low	61.4	Low	91 Å²	91	63.2 Å²	63.2	48%	0.476	33%	0.328	S	S	.	.	H	α-helix	trans	-68.7	-46.8	-175.4	-163.9	139.3	0	0	0	112.9	L47 L48 F49 Y53 G55 Y121 L124	L47-L51 PolarHBondContact O-N 2.96Å; L48-L51 PolarHBondContact O-N 2.87Å; F49-L51 VanDerWaalsContact C-N 3.33Å; F49-L51 PolarHBondContact O-N 2.94Å; L51-Y53 VanDerWaalsContact C-N 3.29Å; L51-Y53 PolarHBondContact O-N 3.37Å; L51-G55 PolarHBondContact O-N 3.3Å; L51-Y121 HydrophobicContact CD1-CD1 4.25Å; L51-Y121 HydrophobicContact CD1-CE1 3.76Å; L51-L124 HydrophobicContact CD1-CD1 4.44Å
52	V	59.3	Low	61.8	Low	101 Å²	101	59.9 Å²	59.9	61%	0.612	32%	0.315	S	S	*	.	H	α-helix	trans	-64.6	-37.8	176.6	175.1	0	0	0	0	110.7	L48 G56	L48-V52 WeakPolarHBondContact O-CG2 3.3Å; L48-V52 PolarHBondContact O-N 3.26Å; L48-V52 VanDerWaalsContact O-N 3.08Å; V52-G56 PolarHBondContact O-N 3.21Å
53	Y	65.3	Low	62.2	Low	87 Å²	87	66.7 Å²	66.7	34%	0.341	34%	0.339	S	S	.	.	H	α-helix	trans	-79.2	-42.7	-174.7	-149.1	-63.2	0	0	0	112	F49 V50 L51 G55 G56 I57	F49-Y53 HydrophobicContact CD1-CD2 4.12Å; F49-Y53 AromaticContact CE1-CD2 3.38Å; F49-Y53 HydrophobicContact CE1-CD2 3.38Å; F49-Y53 AromaticContact CE1-CE2 3.88Å; F49-Y53 HydrophobicContact CE1-CE2 3.88Å; F49-Y53 HydrophobicContact CE1-CG 4.23Å; F49-Y53 AromaticContact CZ-CD2 3.65Å; F49-Y53 HydrophobicContact CZ-CD2 3.65Å; F49-Y53 AromaticContact CZ-CE2 3.97Å; F49-Y53 HydrophobicContact CZ-CE2 3.97Å; F49-Y53 WeakPolarHBondContact O-CB 3.48Å; F49-Y53 PolarHBondContact O-N 2.85Å; V50-Y53 PolarHBondContact O-N 3.23Å; L51-Y53 VanDerWaalsContact C-N 3.29Å; L51-Y53 PolarHBondContact O-N 3.37Å; Y53-G55 VanDerWaalsContact C-N 3.33Å; Y53-G55 PolarHBondContact O-N 2.85Å; Y53-G56 PolarHBondContact O-N 2.74Å; Y53-I57 HydrophobicContact CD1-CD1 3.6Å; Y53-I57 HydrophobicContact CD1-CG1 3.91Å; Y53-I57 HydrophobicContact CE1-CD1 3.72Å; Y53-I57 HydrophobicContact CE1-CG1 3.99Å; Y53-I57 VanDerWaalsContact O-CG1 3.25Å; Y53-I57 WeakPolarHBondContact O-CG1 3.45Å; Y53-I57 PolarHBondContact O-N 3.45Å
54	V	65.9	Low	62.6	Low	41 Å²	41	65.3 Å²	65.3	25%	0.248	34%	0.335	C	S	.	.	H	α-helix	trans	-65.8	-38.6	174.2	-178	0	0	0	0	110.4	V50 I57 Y58 L128	V50-V54 HydrophobicContact CG1-CG2 4Å; V50-V54 VanDerWaalsContact O-CB 3.3Å; V50-V54 WeakPolarHBondContact O-CB 3.14Å; V50-V54 WeakPolarHBondContact O-CG2 3.44Å; V50-V54 PolarHBondContact O-N 3.23Å; V54-I57 PolarHBondContact O-N 2.83Å; V54-Y58 PolarHBondContact O-N 2.95Å; V54-L128 HydrophobicContact CG1-CD1 3.56Å
55	G	63.3	Low	62.9	Low	28 Å²	28	64.6 Å²	64.6	29%	0.289	33%	0.33	S	S	.	.	H	α-helix	trans	-63.4	-42.5	171.9	0	0	0	0	0	113.3	L51 Y53 I57 Y58 V59	L51-G55 PolarHBondContact O-N 3.3Å; Y53-G55 VanDerWaalsContact C-N 3.33Å; Y53-G55 PolarHBondContact O-N 2.85Å; G55-I57 PolarHBondContact O-N 3.39Å; G55-Y58 WeakPolarHBondContact O-CB 2.98Å; G55-Y58 PolarHBondContact O-N 3.15Å; G55-V59 PolarHBondContact O-N 2.92Å
56	G	64.6	Low	63.3	Low	38 Å²	38	63.4 Å²	63.4	39%	0.392	33%	0.332	S	S	.	.	H	α-helix	trans	-64.5	-37.8	176.2	0	0	0	0	0	113	V52 Y53 V59 M60	V52-G56 PolarHBondContact O-N 3.21Å; Y53-G56 PolarHBondContact O-N 2.74Å; G56-V59 PolarHBondContact O-N 3.29Å; G56-M60 WeakPolarHBondContact O-CG 3.25Å; G56-M60 PolarHBondContact O-N 3.02Å
57	I	64.8	Low	63.4	Low	14 Å²	14	64.2 Å²	64.2	7%	0.072	35%	0.345	C	S	.	.	H	α-helix	trans	-68.7	-36.8	174.5	-64.6	170.4	0	0	0	111.2	V27 S30 Y53 V54 G55 V59 M60 L61	V27-I57 HydrophobicContact CG2-CD1 4.41Å; V27-I57 HydrophobicContact CG2-CG2 3.5Å; S30-I57 VanDerWaalsContact CB-CD1 3.41Å; S30-I57 WeakPolarHBondContact OG-CD1 3.32Å; Y53-I57 HydrophobicContact CD1-CD1 3.6Å; Y53-I57 HydrophobicContact CD1-CG1 3.91Å; Y53-I57 HydrophobicContact CE1-CD1 3.72Å; Y53-I57 HydrophobicContact CE1-CG1 3.99Å; Y53-I57 VanDerWaalsContact O-CG1 3.25Å; Y53-I57 WeakPolarHBondContact O-CG1 3.45Å; Y53-I57 PolarHBondContact O-N 3.45Å; V54-I57 PolarHBondContact O-N 2.83Å; G55-I57 PolarHBondContact O-N 3.39Å; I57-V59 VanDerWaalsContact C-N 3.3Å; I57-V59 PolarHBondContact O-N 3.44Å; I57-M60 CarbonylContact O-C 3.42Å; I57-M60 WeakPolarHBondContact O-CB 2.89Å; I57-M60 PolarHBondContact O-N 3.5Å; I57-M60 VanDerWaalsContact O-N 3.1Å; I57-L61 HydrophobicContact CG2-CD1 3.5Å; I57-L61 HydrophobicContact CG2-CG 3.83Å; I57-L61 WeakPolarHBondContact O-CB 3.42Å; I57-L61 WeakPolarHBondContact O-CD1 3.47Å; I57-L61 WeakPolarHBondContact O-CG 3.44Å; I57-L61 PolarHBondContact O-N 3.08Å
58	Y	65.9	Low	63.4	Low	74 Å²	74	69.3 Å²	69.3	29%	0.29	37%	0.367	S	S	.	.	H	α-helix	trans	-56.2	-44.4	174.8	174.1	-103.4	0	0	0	112.4	V54 G55 M60 L61 I62 L128	V54-Y58 PolarHBondContact O-N 2.95Å; G55-Y58 WeakPolarHBondContact O-CB 2.98Å; G55-Y58 PolarHBondContact O-N 3.15Å; Y58-M60 PolarHBondContact O-N 2.82Å; Y58-L61 PolarHBondContact O-N 2.85Å; Y58-I62 HydrophobicContact CD1-CD1 3.7Å; Y58-I62 HydrophobicContact CD2-CD1 4.4Å; Y58-I62 HydrophobicContact CE1-CD1 3.21Å; Y58-I62 HydrophobicContact CE1-CG1 4.35Å; Y58-I62 HydrophobicContact CE2-CD1 3.99Å; Y58-I62 HydrophobicContact CE2-CG1 4.35Å; Y58-I62 HydrophobicContact CG-CD1 4.28Å; Y58-I62 WeakPolarHBondContact O-CG1 3.42Å; Y58-I62 PolarHBondContact O-N 3.42Å; Y58-L128 HydrophobicContact CD1-CD2 4.19Å; Y58-L128 HydrophobicContact CD2-CD2 3.47Å; Y58-L128 VanDerWaalsContact CD2-CD2 3.47Å; Y58-L128 HydrophobicContact CE2-CD2 4.05Å; Y58-L128 HydrophobicContact CG-CD2 3.55Å
59	V	63.2	Low	63.3	Low	95 Å²	95	66.2 Å²	66.2	58%	0.576	35%	0.354	S	S	*	.	H	α-helix	trans	-62.5	-43.4	175	-179.2	0	0	0	0	111.3	G55 G56 I57 L61 I62 Y63	G55-V59 PolarHBondContact O-N 2.92Å; G56-V59 PolarHBondContact O-N 3.29Å; I57-V59 VanDerWaalsContact C-N 3.3Å; I57-V59 PolarHBondContact O-N 3.44Å; V59-L61 VanDerWaalsContact C-N 3.31Å; V59-L61 PolarHBondContact O-N 2.93Å; V59-I62 PolarHBondContact O-N 3.1Å; V59-Y63 WeakPolarHBondContact O-CB 3.48Å; V59-Y63 PolarHBondContact O-N 3.15Å
60	M	65.1	Low	63	Low	117 Å²	117	70.5 Å²	70.5	58%	0.576	37%	0.372	S	S	*	.	H	α-helix	trans	-62.5	-37.1	176	-71.7	-72.2	-172	0	0	112.6	G56 I57 Y58 Y63 V64	G56-M60 WeakPolarHBondContact O-CG 3.25Å; G56-M60 PolarHBondContact O-N 3.02Å; I57-M60 CarbonylContact O-C 3.42Å; I57-M60 WeakPolarHBondContact O-CB 2.89Å; I57-M60 PolarHBondContact O-N 3.5Å; I57-M60 VanDerWaalsContact O-N 3.1Å; Y58-M60 PolarHBondContact O-N 2.82Å; M60-Y63 PolarHBondContact O-N 2.84Å; M60-V64 VanDerWaalsContact O-CG2 3.31Å; M60-V64 WeakPolarHBondContact O-CG2 3.39Å; M60-V64 PolarHBondContact O-N 3.4Å
61	L	65.5	Low	62.2	Low	25 Å²	25	73.3 Å²	73.3	13%	0.131	38%	0.383	C	S	.	.	H	α-helix	trans	-70.4	-40	178.7	-71.2	163.4	0	0	0	112	A23 V27 I57 Y58 V59 Y63 V64 S65 L132	A23-L61 HydrophobicContact CB-CD2 3.32Å; V27-L61 HydrophobicContact CG2-CD1 4.33Å; I57-L61 HydrophobicContact CG2-CD1 3.5Å; I57-L61 HydrophobicContact CG2-CG 3.83Å; I57-L61 WeakPolarHBondContact O-CB 3.42Å; I57-L61 WeakPolarHBondContact O-CD1 3.47Å; I57-L61 WeakPolarHBondContact O-CG 3.44Å; I57-L61 PolarHBondContact O-N 3.08Å; Y58-L61 PolarHBondContact O-N 2.85Å; V59-L61 VanDerWaalsContact C-N 3.31Å; V59-L61 PolarHBondContact O-N 2.93Å; L61-Y63 VanDerWaalsContact C-N 3.32Å; L61-V64 PolarHBondContact O-N 3.2Å; L61-S65 WeakPolarHBondContact O-CB 3.21Å; L61-S65 PolarHBondContact O-N 3.45Å; L61-S65 PolarHBondContact O-OG 3.38Å; L61-L132 HydrophobicContact CB-CD1 3.95Å; L61-L132 HydrophobicContact CD1-CD1 3.39Å; L61-L132 HydrophobicContact CD2-CD1 3.57Å; L61-L132 HydrophobicContact CG-CD1 3.79Å
62	I	65.8	Low	61.8	Low	34 Å²	34	72.9 Å²	72.9	17%	0.174	39%	0.388	C	S	.	.	H	α-helix	trans	-60.6	-46.7	170.2	-66.8	163.6	0	0	0	109.5	Y58 V59 V64 S65 M66	Y58-I62 HydrophobicContact CD1-CD1 3.7Å; Y58-I62 HydrophobicContact CD2-CD1 4.4Å; Y58-I62 HydrophobicContact CE1-CD1 3.21Å; Y58-I62 HydrophobicContact CE1-CG1 4.35Å; Y58-I62 HydrophobicContact CE2-CD1 3.99Å; Y58-I62 HydrophobicContact CE2-CG1 4.35Å; Y58-I62 HydrophobicContact CG-CD1 4.28Å; Y58-I62 WeakPolarHBondContact O-CG1 3.42Å; Y58-I62 PolarHBondContact O-N 3.42Å; V59-I62 PolarHBondContact O-N 3.1Å; I62-V64 PolarHBondContact O-N 3.31Å; I62-S65 WeakPolarHBondContact CA-OG 3.48Å; I62-S65 PolarHBondContact O-N 3.3Å; I62-S65 PolarHBondContact O-OG 2.72Å; I62-M66 HydrophobicContact CG2-CE 3.49Å; I62-M66 VanDerWaalsContact CG2-CE 3.49Å; I62-M66 HydrophobicContact CG2-CG 4.35Å; I62-M66 HydrophobicContact CG2-SD 3.87Å; I62-M66 WeakPolarHBondContact O-CB 3.41Å; I62-M66 WeakPolarHBondContact O-CG 3.44Å; I62-M66 PolarHBondContact O-N 3.48Å
63	Y	65.3	Low	61.3	Low	163 Å²	163	72.6 Å²	72.6	64%	0.639	38%	0.382	S	S	*	.	H	α-helix	trans	-60.5	-44	179.5	-173.2	-97.7	0	0	0	112.4	V59 M60 L61 M66 A67	V59-Y63 WeakPolarHBondContact O-CB 3.48Å; V59-Y63 PolarHBondContact O-N 3.15Å; M60-Y63 PolarHBondContact O-N 2.84Å; L61-Y63 VanDerWaalsContact C-N 3.32Å; Y63-M66 PolarHBondContact O-N 3.42Å; Y63-A67 VanDerWaalsContact O-CB 3.23Å; Y63-A67 WeakPolarHBondContact O-CB 3.44Å; Y63-A67 PolarHBondContact O-N 3.01Å
64	V	64.9	Low	60.4	Low	38 Å²	38	77.9 Å²	77.9	23%	0.23	41%	0.407	C	S	.	.	H	α-helix	trans	-66.9	-40.4	177.7	169.8	0	0	0	0	112	P19 M60 L61 I62 M66 A67 F68	P19-V64 HydrophobicContact CB-CG1 3.86Å; P19-V64 HydrophobicContact CG-CG1 4.43Å; M60-V64 VanDerWaalsContact O-CG2 3.31Å; M60-V64 WeakPolarHBondContact O-CG2 3.39Å; M60-V64 PolarHBondContact O-N 3.4Å; L61-V64 PolarHBondContact O-N 3.2Å; I62-V64 PolarHBondContact O-N 3.31Å; V64-M66 VanDerWaalsContact C-N 3.33Å; V64-A67 PolarHBondContact O-N 2.92Å; V64-F68 PolarHBondContact O-N 3.44Å; V64-F68 VanDerWaalsContact O-N 3.12Å
65	S	62.5	Low	59.6	Low	10 Å²	10	80 Å²	80	7%	0.07	42%	0.424	C	S	.	.	H	α-helix	trans	-67	-35.3	177.7	60.5	0	0	0	0	111.9	L61 I62	L61-S65 WeakPolarHBondContact O-CB 3.21Å; L61-S65 PolarHBondContact O-N 3.45Å; L61-S65 PolarHBondContact O-OG 3.38Å; I62-S65 WeakPolarHBondContact CA-OG 3.48Å; I62-S65 PolarHBondContact O-N 3.3Å; I62-S65 PolarHBondContact O-OG 2.72Å
66	M	62.7	Low	58.9	Low	126 Å²	126	82.7 Å²	82.7	62%	0.621	43%	0.428	S	S	*	.	H	α-helix	trans	-70.3	-42.4	171.6	-70.5	178.5	176.8	0	0	112.9	I62 Y63 V64 F68	I62-M66 HydrophobicContact CG2-CE 3.49Å; I62-M66 VanDerWaalsContact CG2-CE 3.49Å; I62-M66 HydrophobicContact CG2-CG 4.35Å; I62-M66 HydrophobicContact CG2-SD 3.87Å; I62-M66 WeakPolarHBondContact O-CB 3.41Å; I62-M66 WeakPolarHBondContact O-CG 3.44Å; I62-M66 PolarHBondContact O-N 3.48Å; Y63-M66 PolarHBondContact O-N 3.42Å; V64-M66 VanDerWaalsContact C-N 3.33Å; M66-F68 VanDerWaalsContact C-N 3.3Å; M66-F68 PolarHBondContact O-N 3.22Å
67	A	61.4	Low	58.3	Low	50 Å²	50	88.6 Å²	88.6	41%	0.413	44%	0.443	S	S	.	.	H	α-helix	trans	-69.8	-25.8	-175.9	0	0	0	0	0	113.4	Y63 V64	Y63-A67 VanDerWaalsContact O-CB 3.23Å; Y63-A67 WeakPolarHBondContact O-CB 3.44Å; Y63-A67 PolarHBondContact O-N 3.01Å; V64-A67 PolarHBondContact O-N 2.92Å
68	F	59	Low	57.7	Low	111 Å²	111	95 Å²	95	49%	0.487	48%	0.476	S	S	.	.			trans	-139.6	90	-177	-61.7	-80	0	0	0	111.6	P19 V64 M66 K70 F71	P19-F68 HydrophobicContact CB-CD2 4.22Å; P19-F68 HydrophobicContact CB-CE2 4.33Å; P19-F68 HydrophobicContact CG-CB 4.49Å; P19-F68 HydrophobicContact CG-CD2 3.97Å; P19-F68 HydrophobicContact CG-CE2 4.39Å; P19-F68 HydrophobicContact CG-CG 4.22Å; V64-F68 PolarHBondContact O-N 3.44Å; V64-F68 VanDerWaalsContact O-N 3.12Å; M66-F68 VanDerWaalsContact C-N 3.3Å; M66-F68 PolarHBondContact O-N 3.22Å; F68-K70 PolarHBondContact O-N 2.9Å; F68-F71 HydrophobicContact CB-CD2 4.03Å; F68-F71 HydrophobicContact CB-CE2 3.18Å; F68-F71 HydrophobicContact CB-CZ 3.9Å; F68-F71 HydrophobicContact CD1-CE2 4.48Å; F68-F71 HydrophobicContact CD1-CZ 4.44Å; F68-F71 HydrophobicContact CD2-CE2 4.46Å; F68-F71 AromaticContact CG-CE2 3.86Å; F68-F71 HydrophobicContact CG-CE2 3.86Å; F68-F71 HydrophobicContact CG-CZ 4.24Å
69	P	56.4	Low	57.2	Low	52 Å²	52	101.3 Å²	101.3	34%	0.338	50%	0.5	S	S	.	.			trans	-82.1	-2.8	-168.7	38.2	-42.2	0	0	0	112.9	V139 T143	P69-V139 HydrophobicContact CB-CG1 3.66Å; P69-T143 HydrophobicContact CB-CG2 3.42Å; P69-T143 VanDerWaalsContact CB-CG2 3.42Å; P69-T143 HydrophobicContact CG-CG2 3.86Å
70	K	53	Low	56.9	Low	166 Å²	166	98 Å²	98	72%	0.722	49%	0.485	S	S	*	.			trans	-107.8	74.6	179.8	-66.3	-174.2	178.5	-179.5	0	111.8	F68	F68-K70 PolarHBondContact O-N 2.9Å
71	F	51.8	Low	56.7	Low	79 Å²	79	100.4 Å²	100.4	35%	0.346	49%	0.487	S	S	.	.			trans	-123.6	108.5	159.7	-68.2	-64.3	0	0	0	111.1	P19 F68 L73	P19-F71 HydrophobicContact CB-CE2 4.35Å; P19-F71 VanDerWaalsContact CD-CE1 3.46Å; P19-F71 HydrophobicContact CG-CD2 3.88Å; P19-F71 HydrophobicContact CG-CE1 3.92Å; P19-F71 HydrophobicContact CG-CE2 2.94Å; P19-F71 HydrophobicContact CG-CZ 3.03Å; F68-F71 HydrophobicContact CB-CD2 4.03Å; F68-F71 HydrophobicContact CB-CE2 3.18Å; F68-F71 HydrophobicContact CB-CZ 3.9Å; F68-F71 HydrophobicContact CD1-CE2 4.48Å; F68-F71 HydrophobicContact CD1-CZ 4.44Å; F68-F71 HydrophobicContact CD2-CE2 4.46Å; F68-F71 AromaticContact CG-CE2 3.86Å; F68-F71 HydrophobicContact CG-CE2 3.86Å; F68-F71 HydrophobicContact CG-CZ 4.24Å; F71-L73 PolarHBondContact O-N 3.3Å
72	S	51.9	Low	56.6	Low	82 Å²	82	101.7 Å²	101.7	57%	0.573	50%	0.502	S	S	*	.			trans	-60.8	105.6	157.5	171.6	0	0	0	0	107.8	F74 S75	S72-F74 PolarHBondContact O-N 2.92Å; S72-F74 VanDerWaalsContact O-N 3.15Å; S72-F74 WeakPolarHBondContact OG-CB 3.46Å; S72-F74 PolarHBondContact OG-N 2.96Å; S72-S75 PolarHBondContact O-N 3.16Å; S72-S75 VanDerWaalsContact O-N 3.16Å; S72-S75 PolarHBondContact OG-N 3.39Å
73	L	49.6	Very low	56.4	Low	95 Å²	95	101.6 Å²	101.6	50%	0.497	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-52.2	-27	165.6	-71.4	169.2	0	0	0	111	L20 F71 S75 F76 N136	L20-L73 HydrophobicContact CD1-CD2 3.59Å; L20-L73 HydrophobicContact CD2-CD2 3.68Å; L20-L73 HydrophobicContact CG-CD2 4.29Å; F71-L73 PolarHBondContact O-N 3.3Å; L73-S75 PolarHBondContact O-N 3.38Å; L73-F76 PolarHBondContact O-N 3.37Å; L73-N136 HydrophobicContact CD1-CB 4.46Å
74	F	46.7	Very low	56.5	Low	197 Å²	197	98.1 Å²	98.1	86%	0.864	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-78.4	-15.6	-176.7	-144	-98.7	0	0	0	114.1	S72 F76	S72-F74 PolarHBondContact O-N 2.92Å; S72-F74 VanDerWaalsContact O-N 3.15Å; S72-F74 WeakPolarHBondContact OG-CB 3.46Å; S72-F74 PolarHBondContact OG-N 2.96Å; F74-F76 PolarHBondContact O-N 3.46Å
75	S	48.1	Very low	56.7	Low	86 Å²	86	99.5 Å²	99.5	60%	0.601	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-85.8	27.2	172	-120.9	0	0	0	0	112.6	S72 L73 K77	S72-S75 PolarHBondContact O-N 3.16Å; S72-S75 VanDerWaalsContact O-N 3.16Å; S72-S75 PolarHBondContact OG-N 3.39Å; L73-S75 PolarHBondContact O-N 3.38Å; S75-K77 PolarHBondContact O-N 2.92Å
76	F	48.6	Very low	57.1	Low	84 Å²	84	103.2 Å²	103.2	37%	0.368	53%	0.528	S	S	.	.			trans	-63.5	85.7	157.8	-128.3	-99.7	0	0	0	107.2	L20 T21 L73 F74 G80	L20-F76 HydrophobicContact CD2-CE2 4.33Å; T21-F76 HydrophobicContact CG2-CE2 3.8Å; T21-F76 HydrophobicContact CG2-CZ 4.07Å; L73-F76 PolarHBondContact O-N 3.37Å; F74-F76 PolarHBondContact O-N 3.46Å; F76-G80 WeakPolarHBondContact CE1-O 3.46Å
77	K	52.4	Low	57.2	Low	162 Å²	162	98.8 Å²	98.8	70%	0.704	51%	0.507	S	S	*	.			trans	-51.5	146.6	172.4	-71.9	-177.2	176.5	-179.3	0	107.9	S75 R79 G80	S75-K77 PolarHBondContact O-N 2.92Å; K77-R79 PolarHBondContact O-N 2.95Å; K77-G80 PolarHBondContact O-N 3.47Å
78	L	53.1	Low	57.3	Low	148 Å²	148	100.3 Å²	100.3	78%	0.775	51%	0.507	S	S	*	.	H	α-helix	trans	-42.5	-32.4	177.2	-129.4	103.5	0	0	0	113.5	G80 W81 A82	L78-G80 PolarHBondContact O-N 3.08Å; L78-W81 PolarHBondContact O-N 3.24Å; L78-A82 PolarHBondContact O-N 3.43Å
79	R	54.2	Low	57.8	Low	208 Å²	208	102.6 Å²	102.6	79%	0.785	52%	0.517	S	S	*	.	H	α-helix	trans	-59.3	-37.9	174.6	-164.7	175.5	-170.7	-154.2	1.1	114.3	K77 G83	K77-R79 PolarHBondContact O-N 2.95Å; R79-G83 PolarHBondContact O-N 3.14Å; R79-G83 VanDerWaalsContact O-N 3.14Å
80	G	58.2	Low	58.2	Low	26 Å²	26	102.7 Å²	102.7	27%	0.268	52%	0.515	S	S	.	.	H	α-helix	trans	-69.6	-39	174.1	0	0	0	0	0	112	F76 K77 L78 G83 F84	F76-G80 WeakPolarHBondContact CE1-O 3.46Å; K77-G80 PolarHBondContact O-N 3.47Å; L78-G80 PolarHBondContact O-N 3.08Å; G80-G83 PolarHBondContact O-N 2.92Å; G80-F84 PolarHBondContact O-N 3.01Å
81	W	58.9	Low	58.6	Low	166 Å²	166	96 Å²	96	63%	0.629	49%	0.487	S	S	*	.	H	α-helix	trans	-65.7	-43.2	176.4	-175	62.6	0	0	0	111.7	L78 G83 F84 V85	L78-W81 PolarHBondContact O-N 3.24Å; W81-G83 VanDerWaalsContact C-N 3.28Å; W81-G83 PolarHBondContact O-N 3.28Å; W81-F84 WeakPolarHBondContact O-CB 3.43Å; W81-F84 PolarHBondContact O-N 3.44Å; W81-F84 VanDerWaalsContact O-N 3.08Å; W81-V85 HydrophobicContact CD2-CG2 4.3Å; W81-V85 HydrophobicContact CZ2-CG2 4.24Å; W81-V85 WeakPolarHBondContact O-CG2 3.31Å; W81-V85 PolarHBondContact O-N 3.03Å
82	A	64	Low	59.1	Low	52 Å²	52	97.5 Å²	97.5	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-57.5	-42.4	172.2	0	0	0	0	0	111.7	L78 F84 V85 V86	L78-A82 PolarHBondContact O-N 3.43Å; A82-F84 VanDerWaalsContact C-N 3.35Å; A82-F84 PolarHBondContact O-N 3.24Å; A82-V85 PolarHBondContact O-N 3.33Å; A82-V86 VanDerWaalsContact O-CG2 3.31Å; A82-V86 WeakPolarHBondContact O-CG2 3.45Å; A82-V86 PolarHBondContact O-N 3.37Å
83	G	63	Low	59.4	Low	32 Å²	32	94.4 Å²	94.4	33%	0.33	48%	0.479	S	S	.	.	H	α-helix	trans	-59.4	-43	173.4	0	0	0	0	0	112.9	R79 G80 W81 V86 L87	R79-G83 PolarHBondContact O-N 3.14Å; R79-G83 VanDerWaalsContact O-N 3.14Å; G80-G83 PolarHBondContact O-N 2.92Å; W81-G83 VanDerWaalsContact C-N 3.28Å; W81-G83 PolarHBondContact O-N 3.28Å; G83-V86 PolarHBondContact O-N 3.39Å; G83-L87 WeakPolarHBondContact O-CB 3.01Å; G83-L87 VanDerWaalsContact O-CD1 3.3Å; G83-L87 WeakPolarHBondContact O-CD1 3.44Å; G83-L87 WeakPolarHBondContact O-CG 3.38Å; G83-L87 PolarHBondContact O-N 2.93Å
84	F	66.2	Low	59.8	Low	91 Å²	91	90 Å²	90	40%	0.399	46%	0.456	S	S	.	.	H	α-helix	trans	-64.9	-42.3	177.8	-173.9	-101.5	0	0	0	112.8	G80 W81 A82 L87 L88	G80-F84 PolarHBondContact O-N 3.01Å; W81-F84 WeakPolarHBondContact O-CB 3.43Å; W81-F84 PolarHBondContact O-N 3.44Å; W81-F84 VanDerWaalsContact O-N 3.08Å; A82-F84 VanDerWaalsContact C-N 3.35Å; A82-F84 PolarHBondContact O-N 3.24Å; F84-L87 PolarHBondContact O-N 3.3Å; F84-L88 HydrophobicContact CD1-CD1 3.95Å; F84-L88 HydrophobicContact CE1-CD1 3.43Å; F84-L88 VanDerWaalsContact CE1-CD1 3.43Å; F84-L88 HydrophobicContact CE1-CG 4.08Å; F84-L88 HydrophobicContact CZ-CD1 4.05Å; F84-L88 HydrophobicContact CZ-CG 4.3Å; F84-L88 PolarHBondContact O-N 3.4Å
85	V	69.6	Low	60.3	Low	66 Å²	66	89 Å²	89	40%	0.4	45%	0.447	S	S	.	.	H	α-helix	trans	-64.4	-43.9	177.2	174.6	0	0	0	0	111.1	W81 A82 L87 L88 F89	W81-V85 HydrophobicContact CD2-CG2 4.3Å; W81-V85 HydrophobicContact CZ2-CG2 4.24Å; W81-V85 WeakPolarHBondContact O-CG2 3.31Å; W81-V85 PolarHBondContact O-N 3.03Å; A82-V85 PolarHBondContact O-N 3.33Å; V85-L87 VanDerWaalsContact C-N 3.31Å; V85-L87 PolarHBondContact O-N 3.39Å; V85-L88 PolarHBondContact O-N 3.26Å; V85-F89 PolarHBondContact O-N 3.4Å
86	V	70.4	Confident	60.8	Low	89 Å²	89	88.3 Å²	88.3	54%	0.539	44%	0.442	S	S	.	.	H	α-helix	trans	-60.8	-42.9	175	172.4	0	0	0	0	110.6	A82 G83 L88 F89 L90	A82-V86 VanDerWaalsContact O-CG2 3.31Å; A82-V86 WeakPolarHBondContact O-CG2 3.45Å; A82-V86 PolarHBondContact O-N 3.37Å; G83-V86 PolarHBondContact O-N 3.39Å; V86-L88 PolarHBondContact O-N 2.94Å; V86-F89 PolarHBondContact O-N 3.12Å; V86-L90 HydrophobicContact CG1-CD1 4.06Å; V86-L90 HydrophobicContact CG1-CG 4.45Å; V86-L90 VanDerWaalsContact O-CG 3.28Å; V86-L90 WeakPolarHBondContact O-CG 3.41Å; V86-L90 PolarHBondContact O-N 2.91Å
87	L	64.1	Low	61.1	Low	33 Å²	33	87.3 Å²	87.3	17%	0.173	44%	0.44	C	S	.	.	H	α-helix	trans	-64.3	-40.4	178.5	-73.4	161.5	0	0	0	112.7	V9 L25 L28 G83 F84 V85 F89 L90 L91	V9-L87 HydrophobicContact CG2-CD2 3.9Å; L25-L87 HydrophobicContact CD2-CD1 4.34Å; L28-L87 HydrophobicContact CD1-CB 4.37Å; L28-L87 HydrophobicContact CD1-CD1 3.7Å; L28-L87 HydrophobicContact CD1-CG 4.42Å; G83-L87 WeakPolarHBondContact O-CB 3.01Å; G83-L87 VanDerWaalsContact O-CD1 3.3Å; G83-L87 WeakPolarHBondContact O-CD1 3.44Å; G83-L87 WeakPolarHBondContact O-CG 3.38Å; G83-L87 PolarHBondContact O-N 2.93Å; F84-L87 PolarHBondContact O-N 3.3Å; V85-L87 VanDerWaalsContact C-N 3.31Å; V85-L87 PolarHBondContact O-N 3.39Å; L87-F89 VanDerWaalsContact C-N 3.35Å; L87-L90 PolarHBondContact O-N 2.85Å; L87-L91 WeakPolarHBondContact O-CG 3.34Å; L87-L91 PolarHBondContact O-N 2.7Å
88	L	65.1	Low	61.3	Low	81 Å²	81	82.1 Å²	82.1	42%	0.424	42%	0.422	S	S	.	.	H	α-helix	trans	-61.6	-42.7	172.9	-89	174.7	0	0	0	112	F84 V85 V86 L90 L91 L92	F84-L88 HydrophobicContact CD1-CD1 3.95Å; F84-L88 HydrophobicContact CE1-CD1 3.43Å; F84-L88 VanDerWaalsContact CE1-CD1 3.43Å; F84-L88 HydrophobicContact CE1-CG 4.08Å; F84-L88 HydrophobicContact CZ-CD1 4.05Å; F84-L88 HydrophobicContact CZ-CG 4.3Å; F84-L88 PolarHBondContact O-N 3.4Å; V85-L88 PolarHBondContact O-N 3.26Å; V86-L88 PolarHBondContact O-N 2.94Å; L88-L90 VanDerWaalsContact C-N 3.29Å; L88-L90 PolarHBondContact O-N 3.43Å; L88-L91 WeakPolarHBondContact O-CB 3.37Å; L88-L91 PolarHBondContact O-N 3.36Å; L88-L92 WeakPolarHBondContact O-CG 3.42Å; L88-L92 PolarHBondContact O-N 3.39Å
89	F	69	Low	61.2	Low	159 Å²	159	80.1 Å²	80.1	70%	0.697	42%	0.42	S	S	*	.	H	α-helix	trans	-64.3	-37.6	178	-154.5	-91.1	0	0	0	111.7	V85 V86 L87 L92 G93	V85-F89 PolarHBondContact O-N 3.4Å; V86-F89 PolarHBondContact O-N 3.12Å; L87-F89 VanDerWaalsContact C-N 3.35Å; F89-L92 PolarHBondContact O-N 3.19Å; F89-G93 PolarHBondContact O-N 3.45Å
90	L	64.3	Low	61	Low	54 Å²	54	75.5 Å²	75.5	28%	0.283	42%	0.415	S	S	.	.	H	α-helix	trans	-67.7	-38.3	175.2	-66.9	171.2	0	0	0	112.3	L5 V86 L87 L88 L92 G93 V94	L5-L90 HydrophobicContact CD2-CB 3.76Å; L5-L90 HydrophobicContact CD2-CD1 3.79Å; L5-L90 HydrophobicContact CD2-CD2 3.7Å; L5-L90 HydrophobicContact CD2-CG 3.92Å; V86-L90 HydrophobicContact CG1-CD1 4.06Å; V86-L90 HydrophobicContact CG1-CG 4.45Å; V86-L90 VanDerWaalsContact O-CG 3.28Å; V86-L90 WeakPolarHBondContact O-CG 3.41Å; V86-L90 PolarHBondContact O-N 2.91Å; L87-L90 PolarHBondContact O-N 2.85Å; L88-L90 VanDerWaalsContact C-N 3.29Å; L88-L90 PolarHBondContact O-N 3.43Å; L90-L92 VanDerWaalsContact C-N 3.35Å; L90-G93 PolarHBondContact O-N 3.17Å; L90-V94 WeakPolarHBondContact O-CG2 3.48Å; L90-V94 PolarHBondContact O-N 3.31Å
91	L	60.9	Low	60.4	Low	27 Å²	27	79.6 Å²	79.6	14%	0.141	43%	0.428	C	S	.	.	H	α-helix	trans	-60.9	-43.6	173.3	-80.7	166.5	0	0	0	111.9	L28 F31 M32 L87 L88 G93 V94 W95	L28-L91 HydrophobicContact CD2-CD1 4.27Å; F31-L91 HydrophobicContact CD1-CD2 3.74Å; F31-L91 HydrophobicContact CE1-CD2 3.68Å; M32-L91 HydrophobicContact CE-CD2 3.18Å; M32-L91 HydrophobicContact CE-CG 3.52Å; M32-L91 HydrophobicContact SD-CD2 3.74Å; L87-L91 WeakPolarHBondContact O-CG 3.34Å; L87-L91 PolarHBondContact O-N 2.7Å; L88-L91 WeakPolarHBondContact O-CB 3.37Å; L88-L91 PolarHBondContact O-N 3.36Å; L91-G93 VanDerWaalsContact C-N 3.32Å; L91-G93 PolarHBondContact O-N 3.49Å; L91-V94 PolarHBondContact O-N 3.07Å; L91-W95 PolarHBondContact O-N 2.87Å; L91-W95 VanDerWaalsContact O-N 3.13Å
92	L	61.9	Low	59.6	Low	110 Å²	110	78.5 Å²	78.5	58%	0.576	44%	0.435	S	S	*	.	H	α-helix	trans	-62	-40.3	173.9	-73.4	161.4	0	0	0	111.6	L88 F89 L90 V94 W95 S96	L88-L92 WeakPolarHBondContact O-CG 3.42Å; L88-L92 PolarHBondContact O-N 3.39Å; F89-L92 PolarHBondContact O-N 3.19Å; L90-L92 VanDerWaalsContact C-N 3.35Å; L92-V94 VanDerWaalsContact C-N 3.33Å; L92-V94 PolarHBondContact O-N 2.86Å; L92-W95 WeakPolarHBondContact O-CB 3.24Å; L92-W95 PolarHBondContact O-N 2.96Å; L92-S96 PolarHBondContact O-N 3.37Å; L92-S96 PolarHBondContact O-OG 3.42Å
93	G	59.6	Low	58.8	Low	17 Å²	17	85 Å²	85	18%	0.175	46%	0.456	C	S	.	.	H	α-helix	trans	-62.6	-35.1	174.9	0	0	0	0	0	113.8	F89 L90 L91 S96 D97	F89-G93 PolarHBondContact O-N 3.45Å; L90-G93 PolarHBondContact O-N 3.17Å; L91-G93 VanDerWaalsContact C-N 3.32Å; L91-G93 PolarHBondContact O-N 3.49Å; G93-S96 WeakPolarHBondContact CA-OG 3.42Å; G93-S96 PolarHBondContact O-N 2.65Å; G93-S96 PolarHBondContact O-OG 3.42Å; G93-D97 PolarHBondContact O-N 3.02Å
94	V	58.5	Low	57.9	Low	1 Å²	1	85.8 Å²	85.8	1%	0.006	47%	0.465	C	S	.	.	H	α-helix	trans	-67.4	-39.9	172.8	175.8	0	0	0	0	111.3	M2 L5 L90 L91 L92 S96 D97 V98	M2-V94 HydrophobicContact CG-CG1 4.19Å; M2-V94 HydrophobicContact CG-CG2 4.26Å; M2-V94 HydrophobicContact SD-CG1 3.52Å; M2-V94 VanDerWaalsContact SD-CG1 3.52Å; M2-V94 HydrophobicContact SD-CG2 4.45Å; L5-V94 HydrophobicContact CD1-CG2 3.04Å; L90-V94 WeakPolarHBondContact O-CG2 3.48Å; L90-V94 PolarHBondContact O-N 3.31Å; L91-V94 PolarHBondContact O-N 3.07Å; L92-V94 VanDerWaalsContact C-N 3.33Å; L92-V94 PolarHBondContact O-N 2.86Å; V94-S96 VanDerWaalsContact C-N 3.33Å; V94-S96 PolarHBondContact O-N 3.36Å; V94-D97 PolarHBondContact O-N 2.97Å; V94-D97 VanDerWaalsContact O-N 3.16Å; V94-V98 WeakPolarHBondContact O-CG2 3.43Å; V94-V98 PolarHBondContact O-N 3.46Å
95	W	55.4	Low	56.8	Low	178 Å²	178	88.3 Å²	88.3	67%	0.674	48%	0.482	S	S	*	.	H	α-helix	trans	-62.9	-38.4	177.1	-93.2	33.7	0	0	0	112.4	L91 L92 D97 V98	L91-W95 PolarHBondContact O-N 2.87Å; L91-W95 VanDerWaalsContact O-N 3.13Å; L92-W95 WeakPolarHBondContact O-CB 3.24Å; L92-W95 PolarHBondContact O-N 2.96Å; W95-D97 PolarHBondContact O-N 3.46Å; W95-V98 WeakPolarHBondContact O-CB 3.25Å; W95-V98 PolarHBondContact O-N 2.97Å
96	S	58.6	Low	55.6	Low	71 Å²	71	93.2 Å²	93.2	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-64.1	-26.9	174.2	46.9	0	0	0	0	113.6	L92 G93 V94 S99	L92-S96 PolarHBondContact O-N 3.37Å; L92-S96 PolarHBondContact O-OG 3.42Å; G93-S96 WeakPolarHBondContact CA-OG 3.42Å; G93-S96 PolarHBondContact O-N 2.65Å; G93-S96 PolarHBondContact O-OG 3.42Å; V94-S96 VanDerWaalsContact C-N 3.33Å; V94-S96 PolarHBondContact O-N 3.36Å; S96-S99 PolarHBondContact O-OG 3.44Å
97	D	56.3	Low	54.3	Low	62 Å²	62	94.4 Å²	94.4	33%	0.332	50%	0.502	S	S	.	.	H	α-helix	trans	-78.1	-20.5	173.1	-73.9	-24.9	0	0	0	112.6	M1 G93 V94 W95 V100	M1-D97 VanDerWaalsContact SD-OD2 3.4Å; G93-D97 PolarHBondContact O-N 3.02Å; V94-D97 PolarHBondContact O-N 2.97Å; V94-D97 VanDerWaalsContact O-N 3.16Å; W95-D97 PolarHBondContact O-N 3.46Å; D97-V100 PolarHBondContact O-N 3.16Å
98	V	55	Low	53.6	Low	53 Å²	53	98.5 Å²	98.5	32%	0.321	52%	0.524	S	S	.	.	H	α-helix	trans	-72.7	-29.3	-179.6	175	0	0	0	0	111.3	V94 W95 V100 M101	V94-V98 WeakPolarHBondContact O-CG2 3.43Å; V94-V98 PolarHBondContact O-N 3.46Å; W95-V98 WeakPolarHBondContact O-CB 3.25Å; W95-V98 PolarHBondContact O-N 2.97Å; V98-V100 PolarHBondContact O-N 3.01Å; V98-M101 WeakPolarHBondContact O-CB 3.3Å; V98-M101 PolarHBondContact O-N 3.26Å
99	S	51.1	Low	53	Low	106 Å²	106	96.2 Å²	96.2	74%	0.741	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-7	175.5	52.6	0	0	0	0	114.2	S96	S96-S99 PolarHBondContact O-OG 3.44Å
100	V	50.2	Low	52.1	Low	111 Å²	111	96.3 Å²	96.3	67%	0.673	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-1.8	175	-168.2	0	0	0	0	111.8	D97 V98 D102	D97-V100 PolarHBondContact O-N 3.16Å; V98-V100 PolarHBondContact O-N 3.01Å; V100-D102 VanDerWaalsContact C-N 3.32Å; V100-D102 PolarHBondContact O-N 3.24Å
101	M	45.3	Very low	51.5	Low	112 Å²	112	104 Å²	104	55%	0.552	54%	0.542	S	S	*	.	S	Bend	trans	-79.2	87.8	175.5	-62.3	-79.5	96.3	0	0	109.6	K39 V98	K39-M101 HydrophobicContact CD-SD 4.06Å; V98-M101 WeakPolarHBondContact O-CB 3.3Å; V98-M101 PolarHBondContact O-N 3.26Å
102	D	43.4	Very low	50.9	Low	144 Å²	144	106.2 Å²	106.2	77%	0.77	55%	0.554	S	S	*	*			trans	8.1	126.4	149	-156	15.6	0	0	0	117.1	V100 G104	V100-D102 VanDerWaalsContact C-N 3.32Å; V100-D102 PolarHBondContact O-N 3.24Å; D102-G104 PolarHBondContact O-N 3Å
103	E	46.5	Very low	50.5	Low	187 Å²	187	104 Å²	104	87%	0.874	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	15.6	176.6	-59.4	-171.5	156.1	0	0	113.7
104	G	43.5	Very low	50.5	Low	50 Å²	50	104.5 Å²	104.5	52%	0.515	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93	-6.4	-159.3	0	0	0	0	0	118	D102	D102-G104 PolarHBondContact O-N 3Å
105	L	45.1	Very low	50.8	Low	143 Å²	143	110.5 Å²	110.5	75%	0.749	59%	0.588	S	S	*	*			trans	-122	61.4	179.6	-68.4	171.6	0	0	0	111.7	E107	L105-E107 PolarHBondContact O-N 3.5Å
106	M	42.8	Very low	51.3	Low	170 Å²	170	105.7 Å²	105.7	84%	0.837	58%	0.582	S	S	*	*			trans	-66.2	75.4	161.9	-77.2	-97	172	0	0	109.9	N108	M106-N108 PolarHBondContact O-N 3.32Å
107	E	43.9	Very low	51.6	Low	114 Å²	114	104.9 Å²	104.9	53%	0.533	57%	0.57	S	S	.	*			trans	-82.2	108.9	163.7	-74.3	-167.6	179.5	0	0	109.7	S42 L105 S109	S42-E107 WeakPolarHBondContact CB-OE2 3.45Å; S42-E107 PolarHBondContact OG-OE2 3.33Å; L105-E107 PolarHBondContact O-N 3.5Å; E107-S109 PolarHBondContact O-N 2.98Å
108	N	49	Very low	52	Low	118 Å²	118	104.6 Å²	104.6	63%	0.631	57%	0.57	S	S	*	*			trans	-65.5	54.8	177.6	-102.3	-9.4	0	0	0	113.4	M106 F110	M106-N108 PolarHBondContact O-N 3.32Å; N108-F110 HydrophobicContact CB-CD2 3.91Å; N108-F110 HydrophobicContact CB-CE2 3.73Å; N108-F110 VanDerWaalsContact ND2-CE2 3.33Å; N108-F110 WeakPolarHBondContact ND2-CE2 3.3Å; N108-F110 PolarHBondContact O-N 3.44Å; N108-F110 WeakPolarHBondContact OD1-CE2 3.5Å
109	S	52.5	Low	52.5	Low	34 Å²	34	107.5 Å²	107.5	24%	0.238	58%	0.584	C	S	.	*			trans	-78.1	73.2	163	48.4	0	0	0	0	109.1	E107 Y111 L112 C113	E107-S109 PolarHBondContact O-N 2.98Å; S109-Y111 PolarHBondContact O-N 2.97Å; S109-L112 PolarHBondContact O-N 3.13Å; S109-C113 WeakPolarHBondContact O-CB 3.27Å
110	F	50.6	Low	53.4	Low	161 Å²	161	107.1 Å²	107.1	71%	0.706	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	-18.6	179.3	-84.4	-82.2	0	0	0	114.6	N108	N108-F110 HydrophobicContact CB-CD2 3.91Å; N108-F110 HydrophobicContact CB-CE2 3.73Å; N108-F110 VanDerWaalsContact ND2-CE2 3.33Å; N108-F110 WeakPolarHBondContact ND2-CE2 3.3Å; N108-F110 PolarHBondContact O-N 3.44Å; N108-F110 WeakPolarHBondContact OD1-CE2 3.5Å
111	Y	51.5	Low	54.2	Low	216 Å²	216	104 Å²	104	85%	0.847	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-13.1	-171.1	-75.1	-79.5	0	0	0	115.6	S109	S109-Y111 PolarHBondContact O-N 2.97Å
112	L	49.3	Very low	55.2	Low	72 Å²	72	103.4 Å²	103.4	38%	0.377	55%	0.547	S	S	.	.	S	Bend	trans	-140.8	19.9	-178.3	-78.7	106.9	0	0	0	114.4	L47 S109	L47-L112 VanDerWaalsContact CD1-O 3.24Å; L47-L112 WeakPolarHBondContact CD1-O 3.49Å; S109-L112 PolarHBondContact O-N 3.13Å
113	C	53.1	Low	56.6	Low	63 Å²	63	102.9 Å²	102.9	43%	0.426	54%	0.538	S	S	.	.			trans	-116.6	36.6	-167.7	-143.1	0	0	0	0	113.7	S109	S109-C113 WeakPolarHBondContact O-CB 3.27Å
114	G	59.6	Low	57.6	Low	28 Å²	28	97.4 Å²	97.4	29%	0.289	52%	0.515	S	S	.	.			trans	-87.5	137.3	176	0	0	0	0	0	112.6	S116 E117	G114-S116 PolarHBondContact O-N 3.45Å; G114-S116 VanDerWaalsContact O-N 3.16Å; G114-E117 PolarHBondContact O-N 3.44Å
115	V	64.3	Low	58.8	Low	127 Å²	127	96.9 Å²	96.9	77%	0.77	50%	0.503	S	S	*	.	H	α-helix	trans	-54	-33	170.9	178.7	0	0	0	0	111.7	E117 V118	V115-E117 VanDerWaalsContact C-N 3.28Å; V115-E117 PolarHBondContact O-N 3.43Å; V115-V118 PolarHBondContact O-N 3.43Å
116	S	65.9	Low	60.1	Low	77 Å²	77	95 Å²	95	54%	0.538	49%	0.493	S	S	.	.	H	α-helix	trans	-62.7	-31.4	176	50.3	0	0	0	0	113.3	G114 L119 I120	G114-S116 PolarHBondContact O-N 3.45Å; G114-S116 VanDerWaalsContact O-N 3.16Å; S116-L119 WeakPolarHBondContact O-CB 3.3Å; S116-L119 PolarHBondContact O-N 3.36Å; S116-I120 WeakPolarHBondContact O-CG1 3.46Å; S116-I120 PolarHBondContact O-N 2.82Å
117	E	64.5	Low	61.6	Low	54 Å²	54	89.6 Å²	89.6	25%	0.252	47%	0.47	S	S	.	.	H	α-helix	trans	-73.1	-38.6	-178.4	-59.8	-164.8	173.3	0	0	111.4	G114 V115 L119 I120 Y121	G114-E117 PolarHBondContact O-N 3.44Å; V115-E117 VanDerWaalsContact C-N 3.28Å; V115-E117 PolarHBondContact O-N 3.43Å; E117-L119 PolarHBondContact O-N 3.47Å; E117-L119 VanDerWaalsContact O-N 3.16Å; E117-I120 WeakPolarHBondContact O-CA 3.18Å; E117-I120 WeakPolarHBondContact O-CB 3.46Å; E117-I120 PolarHBondContact O-N 3.45Å; E117-Y121 VanDerWaalsContact C-CD2 3.44Å; E117-Y121 HydrophobicContact CB-CD2 4.25Å; E117-Y121 HydrophobicContact CB-CE2 3.76Å; E117-Y121 WeakPolarHBondContact O-CD2 3.28Å; E117-Y121 PolarHBondContact O-N 2.9Å
118	V	66	Low	62.6	Low	56 Å²	56	86.3 Å²	86.3	34%	0.339	46%	0.455	S	S	.	.	H	α-helix	trans	-53.3	-38.2	173.9	-179.2	0	0	0	0	111.2	F43 V115 Y121 L122	F43-V118 HydrophobicContact CE1-CG2 4.11Å; F43-V118 HydrophobicContact CZ-CG2 3.83Å; V115-V118 PolarHBondContact O-N 3.43Å; V118-Y121 PolarHBondContact O-N 2.96Å; V118-L122 HydrophobicContact CG1-CD1 4.4Å; V118-L122 WeakPolarHBondContact O-CB 3.41Å; V118-L122 PolarHBondContact O-N 2.85Å
119	L	65.4	Low	63.5	Low	115 Å²	115	85.4 Å²	85.4	60%	0.602	45%	0.448	S	S	*	.	H	α-helix	trans	-66.6	-42	174.7	-71.3	167.7	0	0	0	112.5	S116 E117 Y121 L122 F123	S116-L119 WeakPolarHBondContact O-CB 3.3Å; S116-L119 PolarHBondContact O-N 3.36Å; E117-L119 PolarHBondContact O-N 3.47Å; E117-L119 VanDerWaalsContact O-N 3.16Å; L119-Y121 VanDerWaalsContact C-N 3.3Å; L119-Y121 PolarHBondContact O-N 2.94Å; L119-L122 PolarHBondContact O-N 3.16Å; L119-F123 WeakPolarHBondContact O-CB 3.32Å; L119-F123 PolarHBondContact O-N 3.26Å
120	I	69.1	Low	64.4	Low	97 Å²	97	88.1 Å²	88.1	50%	0.497	46%	0.46	S	S	.	.	H	α-helix	trans	-62	-40.8	175.8	-61.5	168	0	0	0	110.1	S116 E117 F123 L124	S116-I120 WeakPolarHBondContact O-CG1 3.46Å; S116-I120 PolarHBondContact O-N 2.82Å; E117-I120 WeakPolarHBondContact O-CA 3.18Å; E117-I120 WeakPolarHBondContact O-CB 3.46Å; E117-I120 PolarHBondContact O-N 3.45Å; I120-F123 WeakPolarHBondContact O-CB 3.26Å; I120-F123 PolarHBondContact O-N 3.34Å; I120-L124 HydrophobicContact CG2-CD1 4.26Å; I120-L124 WeakPolarHBondContact O-CG 3.42Å; I120-L124 PolarHBondContact O-N 3.24Å
121	Y	67.1	Low	65.2	Low	45 Å²	45	82.1 Å²	82.1	18%	0.176	44%	0.438	C	S	.	.	H	α-helix	trans	-68.1	-43.1	176.8	-65.7	-67.4	0	0	0	112.5	L47 L51 E117 V118 L119 F123 L124 C125	L47-Y121 HydrophobicContact CB-CE2 4.35Å; L47-Y121 HydrophobicContact CD1-CE2 3.91Å; L47-Y121 HydrophobicContact CD2-CD2 3.32Å; L47-Y121 HydrophobicContact CD2-CE1 4.46Å; L47-Y121 HydrophobicContact CD2-CE2 3.22Å; L47-Y121 HydrophobicContact CD2-CG 4.06Å; L47-Y121 HydrophobicContact CG-CE2 4Å; L51-Y121 HydrophobicContact CD1-CD1 4.25Å; L51-Y121 HydrophobicContact CD1-CE1 3.76Å; E117-Y121 VanDerWaalsContact C-CD2 3.44Å; E117-Y121 HydrophobicContact CB-CD2 4.25Å; E117-Y121 HydrophobicContact CB-CE2 3.76Å; E117-Y121 WeakPolarHBondContact O-CD2 3.28Å; E117-Y121 PolarHBondContact O-N 2.9Å; V118-Y121 PolarHBondContact O-N 2.96Å; L119-Y121 VanDerWaalsContact C-N 3.3Å; L119-Y121 PolarHBondContact O-N 2.94Å; Y121-F123 PolarHBondContact O-N 2.96Å; Y121-L124 HydrophobicContact CD1-CD1 4.39Å; Y121-L124 PolarHBondContact O-N 2.88Å; Y121-C125 WeakPolarHBondContact O-CB 3.44Å; Y121-C125 PolarHBondContact O-N 2.86Å; Y121-C125 PolarHBondContact O-SG 3.46Å; Y121-C125 VanDerWaalsContact O-SG 3.42Å
122	L	67.1	Low	66	Low	101 Å²	101	73.5 Å²	73.5	53%	0.529	41%	0.406	S	S	.	.	H	α-helix	trans	-56.7	-43	171.2	-96.4	160.6	0	0	0	111.1	V118 L119 C125 L126	V118-L122 HydrophobicContact CG1-CD1 4.4Å; V118-L122 WeakPolarHBondContact O-CB 3.41Å; V118-L122 PolarHBondContact O-N 2.85Å; L119-L122 PolarHBondContact O-N 3.16Å; L122-C125 WeakPolarHBondContact O-CB 3.39Å; L122-C125 PolarHBondContact O-N 2.97Å; L122-L126 WeakPolarHBondContact O-CG 3.45Å; L122-L126 PolarHBondContact O-N 3.43Å
123	F	71.7	Confident	66.9	Low	132 Å²	132	74.2 Å²	74.2	58%	0.579	41%	0.413	S	S	*	.	H	α-helix	trans	-62.2	-46.9	175.8	180	-100.6	0	0	0	112	L119 I120 Y121 C125 L126 V127	L119-F123 WeakPolarHBondContact O-CB 3.32Å; L119-F123 PolarHBondContact O-N 3.26Å; I120-F123 WeakPolarHBondContact O-CB 3.26Å; I120-F123 PolarHBondContact O-N 3.34Å; Y121-F123 PolarHBondContact O-N 2.96Å; F123-C125 VanDerWaalsContact C-N 3.33Å; F123-C125 PolarHBondContact O-N 3.22Å; F123-L126 WeakPolarHBondContact O-CB 3.28Å; F123-L126 PolarHBondContact O-N 2.94Å; F123-L126 VanDerWaalsContact O-N 3.15Å; F123-V127 HydrophobicContact CD1-CG2 4.17Å; F123-V127 HydrophobicContact CE1-CG2 3.77Å; F123-V127 HydrophobicContact CE2-CG2 4.25Å; F123-V127 HydrophobicContact CZ-CG2 3.81Å; F123-V127 WeakPolarHBondContact O-CG2 3.5Å; F123-V127 PolarHBondContact O-N 3.42Å
124	L	68.4	Low	67.6	Low	72 Å²	72	77.3 Å²	77.3	38%	0.377	42%	0.419	S	S	.	.	H	α-helix	trans	-59.4	-42.9	175.3	-73.9	168.8	0	0	0	111.8	L51 I120 Y121 L126 V127 L128	L51-L124 HydrophobicContact CD1-CD1 4.44Å; I120-L124 HydrophobicContact CG2-CD1 4.26Å; I120-L124 WeakPolarHBondContact O-CG 3.42Å; I120-L124 PolarHBondContact O-N 3.24Å; Y121-L124 HydrophobicContact CD1-CD1 4.39Å; Y121-L124 PolarHBondContact O-N 2.88Å; L124-L126 PolarHBondContact O-N 3.14Å; L124-V127 PolarHBondContact O-N 3.48Å; L124-L128 WeakPolarHBondContact O-CB 3.32Å; L124-L128 WeakPolarHBondContact O-CD1 3.42Å; L124-L128 WeakPolarHBondContact O-CG 3.38Å; L124-L128 PolarHBondContact O-N 2.94Å
125	C	69.2	Low	68	Low	40 Å²	40	78.7 Å²	78.7	27%	0.27	42%	0.419	S	S	.	.	H	α-helix	trans	-60.4	-43.3	174.2	-76.6	0	0	0	0	112	Y121 L122 F123 L128 M129	Y121-C125 WeakPolarHBondContact O-CB 3.44Å; Y121-C125 PolarHBondContact O-N 2.86Å; Y121-C125 PolarHBondContact O-SG 3.46Å; Y121-C125 VanDerWaalsContact O-SG 3.42Å; L122-C125 WeakPolarHBondContact O-CB 3.39Å; L122-C125 PolarHBondContact O-N 2.97Å; F123-C125 VanDerWaalsContact C-N 3.33Å; F123-C125 PolarHBondContact O-N 3.22Å; C125-L128 PolarHBondContact O-N 3.17Å; C125-M129 WeakPolarHBondContact O-CG 3.47Å; C125-M129 PolarHBondContact O-N 3.3Å
126	L	71.3	Confident	68.1	Low	102 Å²	102	74.3 Å²	74.3	53%	0.534	39%	0.391	S	S	.	.	H	α-helix	trans	-63.5	-44.8	175.8	-72.5	175.6	0	0	0	111.7	L122 F123 L124 L128 M129 I130	L122-L126 WeakPolarHBondContact O-CG 3.45Å; L122-L126 PolarHBondContact O-N 3.43Å; F123-L126 WeakPolarHBondContact O-CB 3.28Å; F123-L126 PolarHBondContact O-N 2.94Å; F123-L126 VanDerWaalsContact O-N 3.15Å; L124-L126 PolarHBondContact O-N 3.14Å; L126-L128 VanDerWaalsContact C-N 3.27Å; L126-L128 PolarHBondContact O-N 3.13Å; L126-M129 PolarHBondContact O-N 3.26Å; L126-I130 WeakPolarHBondContact O-CB 3.1Å; L126-I130 WeakPolarHBondContact O-CD1 3.44Å; L126-I130 VanDerWaalsContact O-CG1 3.22Å; L126-I130 WeakPolarHBondContact O-CG1 3.42Å; L126-I130 PolarHBondContact O-N 3.44Å
127	V	73.4	Confident	68.2	Low	58 Å²	58	77.6 Å²	77.6	35%	0.352	40%	0.396	S	S	.	.	H	α-helix	trans	-59.4	-40.3	176.7	171.3	0	0	0	0	111.1	F123 L124 I130 S131	F123-V127 HydrophobicContact CD1-CG2 4.17Å; F123-V127 HydrophobicContact CE1-CG2 3.77Å; F123-V127 HydrophobicContact CE2-CG2 4.25Å; F123-V127 HydrophobicContact CZ-CG2 3.81Å; F123-V127 WeakPolarHBondContact O-CG2 3.5Å; F123-V127 PolarHBondContact O-N 3.42Å; L124-V127 PolarHBondContact O-N 3.48Å; V127-I130 PolarHBondContact O-N 2.95Å; V127-S131 WeakPolarHBondContact O-CB 3.33Å; V127-S131 PolarHBondContact O-N 3.22Å; V127-S131 PolarHBondContact O-OG 3.47Å
128	L	66.4	Low	68.4	Low	44 Å²	44	79.7 Å²	79.7	23%	0.23	41%	0.408	C	S	.	.	H	α-helix	trans	-66.6	-43.6	176.6	-75.1	158.2	0	0	0	112.1	V54 Y58 L124 C125 L126 S131 L132	V54-L128 HydrophobicContact CG1-CD1 3.56Å; Y58-L128 HydrophobicContact CD1-CD2 4.19Å; Y58-L128 HydrophobicContact CD2-CD2 3.47Å; Y58-L128 VanDerWaalsContact CD2-CD2 3.47Å; Y58-L128 HydrophobicContact CE2-CD2 4.05Å; Y58-L128 HydrophobicContact CG-CD2 3.55Å; L124-L128 WeakPolarHBondContact O-CB 3.32Å; L124-L128 WeakPolarHBondContact O-CD1 3.42Å; L124-L128 WeakPolarHBondContact O-CG 3.38Å; L124-L128 PolarHBondContact O-N 2.94Å; C125-L128 PolarHBondContact O-N 3.17Å; L126-L128 VanDerWaalsContact C-N 3.27Å; L126-L128 PolarHBondContact O-N 3.13Å; L128-S131 PolarHBondContact O-N 2.96Å; L128-L132 PolarHBondContact O-N 3.06Å
129	M	67.6	Low	68.3	Low	99 Å²	99	78.5 Å²	78.5	49%	0.488	40%	0.401	S	S	.	.	H	α-helix	trans	-62.9	-41.6	175.2	-72.4	-62.5	-67	0	0	112.2	C125 L126 L132 V133	C125-M129 WeakPolarHBondContact O-CG 3.47Å; C125-M129 PolarHBondContact O-N 3.3Å; L126-M129 PolarHBondContact O-N 3.26Å; M129-L132 PolarHBondContact O-N 2.95Å; M129-V133 WeakPolarHBondContact O-CG2 3.46Å; M129-V133 PolarHBondContact O-N 3.01Å
130	I	71.1	Confident	68.1	Low	92 Å²	92	74.8 Å²	74.8	47%	0.472	39%	0.39	S	S	.	.	H	α-helix	trans	-61.7	-46	175	-71.5	162	0	0	0	110.3	L126 V127 L132 V133 F134	L126-I130 WeakPolarHBondContact O-CB 3.1Å; L126-I130 WeakPolarHBondContact O-CD1 3.44Å; L126-I130 VanDerWaalsContact O-CG1 3.22Å; L126-I130 WeakPolarHBondContact O-CG1 3.42Å; L126-I130 PolarHBondContact O-N 3.44Å; V127-I130 PolarHBondContact O-N 2.95Å; I130-L132 VanDerWaalsContact C-N 3.29Å; I130-L132 PolarHBondContact O-N 3.49Å; I130-V133 PolarHBondContact O-N 3.23Å; I130-V133 VanDerWaalsContact O-N 3.09Å; I130-F134 HydrophobicContact CG2-CD2 3.64Å; I130-F134 HydrophobicContact CG2-CE2 3.55Å; I130-F134 WeakPolarHBondContact O-CD2 3.4Å; I130-F134 PolarHBondContact O-N 2.78Å
131	S	66.9	Low	67.8	Low	35 Å²	35	76.6 Å²	76.6	25%	0.245	40%	0.395	C	S	.	.	H	α-helix	trans	-59.8	-39.6	178.6	-59.7	0	0	0	0	111.9	V127 L128 V133 F134 M135	V127-S131 WeakPolarHBondContact O-CB 3.33Å; V127-S131 PolarHBondContact O-N 3.22Å; V127-S131 PolarHBondContact O-OG 3.47Å; L128-S131 PolarHBondContact O-N 2.96Å; S131-V133 PolarHBondContact O-N 3.4Å; S131-F134 PolarHBondContact O-N 2.78Å; S131-M135 WeakPolarHBondContact O-CB 3.35Å; S131-M135 VanDerWaalsContact O-CG 3.28Å; S131-M135 WeakPolarHBondContact O-CG 3.43Å; S131-M135 PolarHBondContact O-N 3.46Å
132	L	67.8	Low	67.5	Low	35 Å²	35	77 Å²	77	18%	0.183	40%	0.404	C	S	.	.	H	α-helix	trans	-61.2	-43.4	173.9	171	152.8	0	0	0	112.1	L61 L128 M129 I130 F134 M135 N136	L61-L132 HydrophobicContact CB-CD1 3.95Å; L61-L132 HydrophobicContact CD1-CD1 3.39Å; L61-L132 HydrophobicContact CD2-CD1 3.57Å; L61-L132 HydrophobicContact CG-CD1 3.79Å; L128-L132 PolarHBondContact O-N 3.06Å; M129-L132 PolarHBondContact O-N 2.95Å; I130-L132 VanDerWaalsContact C-N 3.29Å; I130-L132 PolarHBondContact O-N 3.49Å; L132-F134 VanDerWaalsContact C-N 3.34Å; L132-M135 PolarHBondContact O-N 3.24Å; L132-N136 WeakPolarHBondContact CD2-ND2 3.37Å; L132-N136 WeakPolarHBondContact O-CB 3.15Å; L132-N136 PolarHBondContact O-N 3.3Å; L132-N136 PolarHBondContact O-ND2 3.41Å
133	V	68.2	Low	67.1	Low	86 Å²	86	73.3 Å²	73.3	52%	0.521	39%	0.386	S	S	.	.	H	α-helix	trans	-63.7	-43.9	-179.8	173.3	0	0	0	0	110.1	M129 I130 S131 N136 F137	M129-V133 WeakPolarHBondContact O-CG2 3.46Å; M129-V133 PolarHBondContact O-N 3.01Å; I130-V133 PolarHBondContact O-N 3.23Å; I130-V133 VanDerWaalsContact O-N 3.09Å; S131-V133 PolarHBondContact O-N 3.4Å; V133-N136 PolarHBondContact O-N 3.41Å; V133-F137 WeakPolarHBondContact O-CB 3.48Å; V133-F137 PolarHBondContact O-N 3.04Å
134	F	68.9	Low	66.3	Low	128 Å²	128	70.5 Å²	70.5	56%	0.561	38%	0.382	S	S	*	.	H	α-helix	trans	-62.2	-46	175.4	-83.5	-69.4	0	0	0	112.6	I130 S131 L132 N136 F137 I138	I130-F134 HydrophobicContact CG2-CD2 3.64Å; I130-F134 HydrophobicContact CG2-CE2 3.55Å; I130-F134 WeakPolarHBondContact O-CD2 3.4Å; I130-F134 PolarHBondContact O-N 2.78Å; S131-F134 PolarHBondContact O-N 2.78Å; L132-F134 VanDerWaalsContact C-N 3.34Å; F134-N136 PolarHBondContact O-N 3Å; F134-F137 WeakPolarHBondContact O-CB 3.49Å; F134-F137 PolarHBondContact O-N 3.3Å; F134-F137 VanDerWaalsContact O-N 3.14Å; F134-I138 VanDerWaalsContact O-CG1 3.29Å; F134-I138 WeakPolarHBondContact O-CG1 3.35Å; F134-I138 PolarHBondContact O-N 3.5Å
135	M	67.5	Low	65.7	Low	58 Å²	58	70.4 Å²	70.4	29%	0.286	39%	0.388	S	S	.	.	H	α-helix	trans	-62.4	-42.6	178.7	-70.6	-64.2	-83.1	0	0	111.8	S131 L132 F137 I138 V139	S131-M135 WeakPolarHBondContact O-CB 3.35Å; S131-M135 VanDerWaalsContact O-CG 3.28Å; S131-M135 WeakPolarHBondContact O-CG 3.43Å; S131-M135 PolarHBondContact O-N 3.46Å; L132-M135 PolarHBondContact O-N 3.24Å; M135-F137 VanDerWaalsContact C-N 3.29Å; M135-F137 PolarHBondContact O-N 3Å; M135-I138 PolarHBondContact O-N 2.96Å; M135-I138 HydrophobicContact SD-CD1 4.47Å; M135-V139 WeakPolarHBondContact O-CG2 3.17Å; M135-V139 PolarHBondContact O-N 3.12Å
136	N	67.1	Low	65	Low	35 Å²	35	74.3 Å²	74.3	19%	0.187	40%	0.398	C	S	.	.	H	α-helix	trans	-61.8	-37.4	174.4	-77.5	-36.9	0	0	0	112.3	L73 L132 V133 F134 G140	L73-N136 HydrophobicContact CD1-CB 4.46Å; L132-N136 WeakPolarHBondContact CD2-ND2 3.37Å; L132-N136 WeakPolarHBondContact O-CB 3.15Å; L132-N136 PolarHBondContact O-N 3.3Å; L132-N136 PolarHBondContact O-ND2 3.41Å; V133-N136 PolarHBondContact O-N 3.41Å; F134-N136 PolarHBondContact O-N 3Å; N136-G140 PolarHBondContact O-N 3.26Å
137	F	67.8	Low	63.8	Low	145 Å²	145	78 Å²	78	64%	0.636	41%	0.41	S	S	*	.	H	α-helix	trans	-66.9	-45.4	176	-173.8	-98.1	0	0	0	112	V133 F134 M135 G140 F141	V133-F137 WeakPolarHBondContact O-CB 3.48Å; V133-F137 PolarHBondContact O-N 3.04Å; F134-F137 WeakPolarHBondContact O-CB 3.49Å; F134-F137 PolarHBondContact O-N 3.3Å; F134-F137 VanDerWaalsContact O-N 3.14Å; M135-F137 VanDerWaalsContact C-N 3.29Å; M135-F137 PolarHBondContact O-N 3Å; F137-G140 PolarHBondContact O-N 2.96Å; F137-F141 PolarHBondContact O-N 3.27Å
138	I	67.6	Low	62.3	Low	98 Å²	98	89.4 Å²	89.4	50%	0.503	45%	0.447	S	S	.	.	H	α-helix	trans	-62.2	-46.3	179	-66.3	162.8	0	0	0	110.9	F134 M135 F141 S142	F134-I138 VanDerWaalsContact O-CG1 3.29Å; F134-I138 WeakPolarHBondContact O-CG1 3.35Å; F134-I138 PolarHBondContact O-N 3.5Å; M135-I138 PolarHBondContact O-N 2.96Å; M135-I138 HydrophobicContact SD-CD1 4.47Å; I138-F141 PolarHBondContact O-N 2.92Å; I138-S142 WeakPolarHBondContact O-CB 3.43Å; I138-S142 PolarHBondContact O-N 3.5Å
139	V	63.7	Low	62.1	Low	32 Å²	32	91.7 Å²	91.7	19%	0.194	46%	0.457	C	S	.	.	H	α-helix	trans	-65.3	-40.5	177.5	174.7	0	0	0	0	111.3	P69 M135 F141 S142 T143	P69-V139 HydrophobicContact CB-CG1 3.66Å; M135-V139 WeakPolarHBondContact O-CG2 3.17Å; M135-V139 PolarHBondContact O-N 3.12Å; V139-F141 VanDerWaalsContact C-N 3.3Å; V139-F141 PolarHBondContact O-N 3.03Å; V139-S142 PolarHBondContact O-N 2.74Å; V139-T143 PolarHBondContact O-N 2.56Å; V139-T143 VanDerWaalsContact O-N 3.11Å; V139-T143 PolarHBondContact O-OG1 3.38Å
140	G	61.4	Low	61.8	Low	36 Å²	36	91.3 Å²	91.3	37%	0.371	46%	0.456	S	S	.	.	H	α-helix	trans	-61	-37.3	173.9	0	0	0	0	0	112.9	N136 F137 T143 S144	N136-G140 PolarHBondContact O-N 3.26Å; F137-G140 PolarHBondContact O-N 2.96Å; G140-T143 PolarHBondContact O-OG1 3.02Å; G140-S144 PolarHBondContact O-N 2.84Å
141	F	63.9	Low	61.3	Low	135 Å²	135	91.2 Å²	91.2	59%	0.592	46%	0.455	S	S	*	.	H	α-helix	trans	-72.7	-46.6	177.3	-168.1	-96.5	0	0	0	112.1	F137 I138 V139 T143 S144 S145	F137-F141 PolarHBondContact O-N 3.27Å; I138-F141 PolarHBondContact O-N 2.92Å; V139-F141 VanDerWaalsContact C-N 3.3Å; V139-F141 PolarHBondContact O-N 3.03Å; F141-T143 VanDerWaalsContact C-N 3.25Å; F141-T143 PolarHBondContact O-N 3.38Å; F141-S144 PolarHBondContact O-N 3.16Å; F141-S144 VanDerWaalsContact O-N 3.13Å; F141-S144 PolarHBondContact O-OG 3.32Å; F141-S145 PolarHBondContact O-N 3.44Å
142	S	61.5	Low	60.9	Low	55 Å²	55	94.5 Å²	94.5	39%	0.385	47%	0.467	S	S	.	.	H	α-helix	trans	-51.2	-48.8	176.9	-167.5	0	0	0	0	109.8	I138 V139 S144 S145 Y146	I138-S142 WeakPolarHBondContact O-CB 3.43Å; I138-S142 PolarHBondContact O-N 3.5Å; V139-S142 PolarHBondContact O-N 2.74Å; S142-S144 PolarHBondContact O-N 3.5Å; S142-S145 PolarHBondContact O-N 2.94Å; S142-S145 VanDerWaalsContact O-N 3.13Å; S142-S145 PolarHBondContact O-OG 2.95Å; S142-Y146 WeakPolarHBondContact O-CD1 3.33Å; S142-Y146 WeakPolarHBondContact O-CE1 3.36Å; S142-Y146 WeakPolarHBondContact OG-CE1 3.44Å
143	T	57.3	Low	60.5	Low	23 Å²	23	98.3 Å²	98.3	14%	0.141	49%	0.485	C	S	.	.	H	α-helix	trans	-59.4	-38.3	177.4	47.2	0	0	0	0	118.1	P69 V139 G140 F141 S145 Y146	P69-T143 HydrophobicContact CB-CG2 3.42Å; P69-T143 VanDerWaalsContact CB-CG2 3.42Å; P69-T143 HydrophobicContact CG-CG2 3.86Å; V139-T143 PolarHBondContact O-N 2.56Å; V139-T143 VanDerWaalsContact O-N 3.11Å; V139-T143 PolarHBondContact O-OG1 3.38Å; G140-T143 PolarHBondContact O-OG1 3.02Å; F141-T143 VanDerWaalsContact C-N 3.25Å; F141-T143 PolarHBondContact O-N 3.38Å; T143-S145 PolarHBondContact O-N 2.9Å; T143-Y146 VanDerWaalsContact CA-OH 3.29Å; T143-Y146 WeakPolarHBondContact CA-OH 3.44Å; T143-Y146 HydrophobicContact CG2-CE2 3.75Å; T143-Y146 WeakPolarHBondContact CG2-OH 3.46Å; T143-Y146 PolarHBondContact N-OH 3.4Å; T143-Y146 WeakPolarHBondContact O-CD2 3.4Å
144	S	56	Low	60	Low	72 Å²	72	99.1 Å²	99.1	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-69.6	-25.3	179.6	72.6	0	0	0	0	112.5	G140 F141 S142	G140-S144 PolarHBondContact O-N 2.84Å; F141-S144 PolarHBondContact O-N 3.16Å; F141-S144 VanDerWaalsContact O-N 3.13Å; F141-S144 PolarHBondContact O-OG 3.32Å; S142-S144 PolarHBondContact O-N 3.5Å
145	S	55.6	Low	59.4	Low	70 Å²	70	97 Å²	97	49%	0.49	48%	0.477	S	S	.	.	H	α-helix	trans	-81.7	-22.2	-173	69.8	0	0	0	0	114.6	F141 S142 T143	F141-S145 PolarHBondContact O-N 3.44Å; S142-S145 PolarHBondContact O-N 2.94Å; S142-S145 VanDerWaalsContact O-N 3.13Å; S142-S145 PolarHBondContact O-OG 2.95Å; T143-S145 PolarHBondContact O-N 2.9Å
146	Y	53	Low	58.7	Low	123 Å²	123	100 Å²	100	48%	0.482	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-1.4	179	31.4	-101.8	0	0	0	115.5	S142 T143	S142-Y146 WeakPolarHBondContact O-CD1 3.33Å; S142-Y146 WeakPolarHBondContact O-CE1 3.36Å; S142-Y146 WeakPolarHBondContact OG-CE1 3.44Å; T143-Y146 VanDerWaalsContact CA-OH 3.29Å; T143-Y146 WeakPolarHBondContact CA-OH 3.44Å; T143-Y146 HydrophobicContact CG2-CE2 3.75Å; T143-Y146 WeakPolarHBondContact CG2-OH 3.46Å; T143-Y146 PolarHBondContact N-OH 3.4Å; T143-Y146 WeakPolarHBondContact O-CD2 3.4Å
147	F	47.6	Very low	58	Low	180 Å²	180	105.4 Å²	105.4	79%	0.789	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.8	43.1	171.3	-87.6	-80.4	0	0	0	112.1
148	R	41	Very low	57.1	Low	296 Å²	296	101.8 Å²	101.8	100%	1.117	51%	0.506	S	S	*	.			trans	-121.9	0	150.1	-100.2	-174.3	174.5	174.7	-1.2	108.1

Retrieved 148 of 148 residues in 181.2 ms (Link to these results)

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