A0A077Z7B6_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z7B6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 182 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	35.1	Very low	49.9	Very low	138 Å²	138	96.5 Å²	96.5	68%	0.68	50%	0.502	S	S	*	.				0	-56.7	0	-67.3	-174.4	91.3	0	0	112.3	A3 A4 W5	M1-A3 VanDerWaalsContact C-N 3.31Å; M1-A3 PolarHBondContact O-N 3.43Å; M1-A4 PolarHBondContact O-N 3.42Å; M1-W5 PolarHBondContact O-N 3.09Å
2	L	46.7	Very low	50.4	Low	103 Å²	103	103.4 Å²	103.4	54%	0.539	53%	0.525	S	S	.	.	H	α-helix	trans	-53.1	-43.4	174.7	-86.9	154.8	0	0	0	113.8	A4 W5 F6 Y10	L2-A4 VanDerWaalsContact C-N 3.25Å; L2-A4 PolarHBondContact O-N 3.01Å; L2-W5 PolarHBondContact O-N 2.84Å; L2-F6 HydrophobicContact CD2-CD2 4.17Å; L2-F6 CarbonylContact O-C 3.52Å; L2-F6 PolarHBondContact O-N 3.41Å; L2-Y10 HydrophobicContact CB-CD2 4.11Å
3	A	50.1	Low	50.5	Low	35 Å²	35	103.5 Å²	103.5	29%	0.289	53%	0.527	S	S	.	.	H	α-helix	trans	-60.7	-31.5	175.9	0	0	0	0	0	114.2	M1 Y10	M1-A3 VanDerWaalsContact C-N 3.31Å; M1-A3 PolarHBondContact O-N 3.43Å; A3-Y10 HydrophobicContact CB-CD1 3.62Å; A3-Y10 HydrophobicContact CB-CD2 3.85Å; A3-Y10 HydrophobicContact CB-CE1 3.54Å; A3-Y10 HydrophobicContact CB-CE2 3.78Å; A3-Y10 HydrophobicContact CB-CG 3.77Å
4	A	46.9	Very low	50.9	Low	28 Å²	28	98.2 Å²	98.2	23%	0.231	50%	0.502	C	S	.	.	H	α-helix	trans	-86.2	-27.7	-178	0	0	0	0	0	112.4	M1 L2	M1-A4 PolarHBondContact O-N 3.42Å; L2-A4 VanDerWaalsContact C-N 3.25Å; L2-A4 PolarHBondContact O-N 3.01Å
5	W	49.4	Very low	51.4	Low	169 Å²	169	96 Å²	96	64%	0.64	50%	0.499	S	S	*	.	H	α-helix	trans	-100.6	-27.3	-175.3	-78.7	41.1	0	0	0	113.2	M1 L2	M1-W5 PolarHBondContact O-N 3.09Å; L2-W5 PolarHBondContact O-N 2.84Å
6	F	55.1	Low	52.3	Low	107 Å²	107	94.1 Å²	94.1	47%	0.469	50%	0.502	S	S	.	.			trans	-140.9	69.5	-176.3	-56.4	-77.7	0	0	0	110.6	L2 D8 L9 Y10	L2-F6 HydrophobicContact CD2-CD2 4.17Å; L2-F6 CarbonylContact O-C 3.52Å; L2-F6 PolarHBondContact O-N 3.41Å; F6-D8 PolarHBondContact O-N 3.11Å; F6-L9 HydrophobicContact CB-CB 3.92Å; F6-L9 PolarHBondContact O-N 2.91Å; F6-Y10 WeakPolarHBondContact O-CB 3.35Å; F6-Y10 PolarHBondContact O-N 3.47Å
7	P	52.6	Low	53	Low	79 Å²	79	92.2 Å²	92.2	51%	0.513	49%	0.494	S	S	.	.	H	α-helix	trans	-59.9	-40.7	-172.2	21.5	-31.7	0	0	0	113.2	Y10 A11	P7-Y10 PolarHBondContact O-N 3.46Å; P7-A11 WeakPolarHBondContact O-CB 3.41Å; P7-A11 PolarHBondContact O-N 2.87Å
8	D	54.7	Low	53.5	Low	133 Å²	133	92.7 Å²	92.7	71%	0.711	50%	0.496	S	S	*	.	H	α-helix	trans	-73	-39.6	-179.6	-69.3	-37.8	0	0	0	113.2	F6 Y10 A11 K12	F6-D8 PolarHBondContact O-N 3.11Å; D8-Y10 VanDerWaalsContact C-N 3.34Å; D8-A11 PolarHBondContact O-N 3.2Å; D8-K12 PolarHBondContact O-N 3.45Å; D8-K12 VanDerWaalsContact O-N 3.16Å
9	L	52.8	Low	54.1	Low	105 Å²	105	95.5 Å²	95.5	55%	0.55	50%	0.504	S	S	.	.	H	α-helix	trans	-66.8	-42.4	174.7	-160.8	78	0	0	0	109.6	F6 K12 L13	F6-L9 HydrophobicContact CB-CB 3.92Å; F6-L9 PolarHBondContact O-N 2.91Å; L9-K12 PolarHBondContact O-N 2.88Å; L9-L13 WeakPolarHBondContact O-CB 3.32Å; L9-L13 PolarHBondContact O-N 3.44Å
10	Y	51.6	Low	55	Low	107 Å²	107	96 Å²	96	42%	0.42	51%	0.506	S	S	.	.	H	α-helix	trans	-58.8	-48.9	174.6	-178.6	-102.3	0	0	0	110.7	L2 A3 F6 P7 D8 K12 L13 T14	L2-Y10 HydrophobicContact CB-CD2 4.11Å; A3-Y10 HydrophobicContact CB-CD1 3.62Å; A3-Y10 HydrophobicContact CB-CD2 3.85Å; A3-Y10 HydrophobicContact CB-CE1 3.54Å; A3-Y10 HydrophobicContact CB-CE2 3.78Å; A3-Y10 HydrophobicContact CB-CG 3.77Å; F6-Y10 WeakPolarHBondContact O-CB 3.35Å; F6-Y10 PolarHBondContact O-N 3.47Å; P7-Y10 PolarHBondContact O-N 3.46Å; D8-Y10 VanDerWaalsContact C-N 3.34Å; Y10-K12 PolarHBondContact O-N 3.41Å; Y10-L13 PolarHBondContact O-N 2.87Å; Y10-T14 HydrophobicContact CD1-CG2 4Å; Y10-T14 HydrophobicContact CD2-CG2 3.57Å; Y10-T14 HydrophobicContact CE1-CG2 3.82Å; Y10-T14 HydrophobicContact CE2-CG2 3.35Å; Y10-T14 HydrophobicContact CG-CG2 3.89Å; Y10-T14 VanDerWaalsContact CZ-CG2 3.49Å; Y10-T14 WeakPolarHBondContact O-CB 3.22Å; Y10-T14 WeakPolarHBondContact O-CG2 3.31Å; Y10-T14 PolarHBondContact O-N 3.35Å; Y10-T14 PolarHBondContact O-OG1 2.95Å
11	A	53.9	Low	55.6	Low	58 Å²	58	96.4 Å²	96.4	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-60	-42.5	180	0	0	0	0	0	113.3	P7 D8 T14	P7-A11 WeakPolarHBondContact O-CB 3.41Å; P7-A11 PolarHBondContact O-N 2.87Å; D8-A11 PolarHBondContact O-N 3.2Å; A11-T14 PolarHBondContact O-OG1 2.93Å
12	K	55.5	Low	57	Low	179 Å²	179	92.4 Å²	92.4	78%	0.778	50%	0.497	S	S	*	.	H	α-helix	trans	-72.4	-43.2	178.1	-78.3	-179.4	177.8	175.9	0	112.8	D8 L9 Y10	D8-K12 PolarHBondContact O-N 3.45Å; D8-K12 VanDerWaalsContact O-N 3.16Å; L9-K12 PolarHBondContact O-N 2.88Å; Y10-K12 PolarHBondContact O-N 3.41Å
13	L	52.7	Low	57.9	Low	104 Å²	104	90 Å²	90	55%	0.545	49%	0.488	S	S	.	.	H	α-helix	trans	-69.8	-37.2	-179.4	-145.4	87	0	0	0	111.1	L9 Y10 T17	L9-L13 WeakPolarHBondContact O-CB 3.32Å; L9-L13 PolarHBondContact O-N 3.44Å; Y10-L13 PolarHBondContact O-N 2.87Å; L13-T17 WeakPolarHBondContact O-CB 3.47Å; L13-T17 PolarHBondContact O-N 3.41Å; L13-T17 VanDerWaalsContact O-N 3.14Å; L13-T17 PolarHBondContact O-OG1 3.21Å
14	T	55.5	Low	58.9	Low	30 Å²	30	92.3 Å²	92.3	18%	0.184	50%	0.495	C	S	.	.	H	α-helix	trans	-69.4	-42	-174.9	47.6	0	0	0	0	112.8	Y10 A11 A16 L18	Y10-T14 HydrophobicContact CD1-CG2 4Å; Y10-T14 HydrophobicContact CD2-CG2 3.57Å; Y10-T14 HydrophobicContact CE1-CG2 3.82Å; Y10-T14 HydrophobicContact CE2-CG2 3.35Å; Y10-T14 HydrophobicContact CG-CG2 3.89Å; Y10-T14 VanDerWaalsContact CZ-CG2 3.49Å; Y10-T14 WeakPolarHBondContact O-CB 3.22Å; Y10-T14 WeakPolarHBondContact O-CG2 3.31Å; Y10-T14 PolarHBondContact O-N 3.35Å; Y10-T14 PolarHBondContact O-OG1 2.95Å; A11-T14 PolarHBondContact O-OG1 2.93Å; T14-A16 PolarHBondContact O-N 3.42Å; T14-L18 HydrophobicContact CG2-CD1 4.17Å; T14-L18 WeakPolarHBondContact O-CA 3.44Å; T14-L18 WeakPolarHBondContact O-CB 3.38Å; T14-L18 WeakPolarHBondContact O-CD1 3.22Å; T14-L18 WeakPolarHBondContact O-CG 3.47Å; T14-L18 PolarHBondContact O-N 3.14Å
15	S	58.7	Low	59.8	Low	65 Å²	65	94.3 Å²	94.3	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-60.3	-51.2	-175.8	170.3	0	0	0	0	113.3	K19	S15-K19 WeakPolarHBondContact O-CB 3.44Å; S15-K19 WeakPolarHBondContact O-CD 3.48Å; S15-K19 WeakPolarHBondContact O-CG 3.46Å; S15-K19 PolarHBondContact O-N 2.66Å
16	A	65.9	Low	60.4	Low	66 Å²	66	90 Å²	90	55%	0.545	50%	0.5	S	S	.	.	H	α-helix	trans	-75.6	-45	-178.4	0	0	0	0	0	111.7	T14 K19 L20	T14-A16 PolarHBondContact O-N 3.42Å; A16-K19 PolarHBondContact O-N 2.92Å; A16-L20 WeakPolarHBondContact O-CB 3.5Å; A16-L20 PolarHBondContact O-N 2.62Å
17	T	64.7	Low	61.1	Low	61 Å²	61	90.6 Å²	90.6	37%	0.374	51%	0.507	S	S	.	.	H	α-helix	trans	-70.5	-37.5	-177.6	-51.1	0	0	0	0	111.7	L13 L20 L21	L13-T17 WeakPolarHBondContact O-CB 3.47Å; L13-T17 PolarHBondContact O-N 3.41Å; L13-T17 VanDerWaalsContact O-N 3.14Å; L13-T17 PolarHBondContact O-OG1 3.21Å; T17-L20 PolarHBondContact O-N 2.78Å; T17-L21 HydrophobicContact CG2-CD1 3.92Å; T17-L21 HydrophobicContact CG2-CG 4.27Å; T17-L21 VanDerWaalsContact O-CB 3.29Å; T17-L21 WeakPolarHBondContact O-CB 3.41Å; T17-L21 WeakPolarHBondContact O-CG 3.38Å; T17-L21 PolarHBondContact O-N 2.96Å
18	L	60.9	Low	62	Low	101 Å²	101	90.6 Å²	90.6	53%	0.529	51%	0.505	S	S	.	.	H	α-helix	trans	-65.4	-40.4	173	-73.8	164.2	0	0	0	111.3	T14 L20 L21 A22	T14-L18 HydrophobicContact CG2-CD1 4.17Å; T14-L18 WeakPolarHBondContact O-CA 3.44Å; T14-L18 WeakPolarHBondContact O-CB 3.38Å; T14-L18 WeakPolarHBondContact O-CD1 3.22Å; T14-L18 WeakPolarHBondContact O-CG 3.47Å; T14-L18 PolarHBondContact O-N 3.14Å; L18-L20 VanDerWaalsContact C-N 3.34Å; L18-L21 PolarHBondContact O-N 2.96Å; L18-A22 WeakPolarHBondContact O-CB 3.33Å; L18-A22 PolarHBondContact O-N 2.99Å
19	K	65.5	Low	62.3	Low	147 Å²	147	87.2 Å²	87.2	64%	0.639	49%	0.492	S	S	*	.	H	α-helix	trans	-61.6	-44.8	176.1	-77.8	173.7	-174.3	179.1	0	111.3	S15 A16 A22 S23	S15-K19 WeakPolarHBondContact O-CB 3.44Å; S15-K19 WeakPolarHBondContact O-CD 3.48Å; S15-K19 WeakPolarHBondContact O-CG 3.46Å; S15-K19 PolarHBondContact O-N 2.66Å; A16-K19 PolarHBondContact O-N 2.92Å; K19-A22 PolarHBondContact O-N 3.44Å; K19-S23 WeakPolarHBondContact O-CB 3.45Å; K19-S23 PolarHBondContact O-N 3.18Å; K19-S23 PolarHBondContact O-OG 2.93Å; K19-S23 VanDerWaalsContact O-OG 3.06Å
20	L	72.6	Confident	62.8	Low	105 Å²	105	87.2 Å²	87.2	55%	0.55	49%	0.492	S	S	.	.	H	α-helix	trans	-65.1	-46.2	177.7	-169.5	79.4	0	0	0	111.7	A16 T17 L18 A22 S23 I24	A16-L20 WeakPolarHBondContact O-CB 3.5Å; A16-L20 PolarHBondContact O-N 2.62Å; T17-L20 PolarHBondContact O-N 2.78Å; L18-L20 VanDerWaalsContact C-N 3.34Å; L20-A22 VanDerWaalsContact C-N 3.33Å; L20-A22 PolarHBondContact O-N 3.12Å; L20-S23 WeakPolarHBondContact CA-OG 3.47Å; L20-S23 PolarHBondContact O-N 3.33Å; L20-S23 PolarHBondContact O-OG 3.32Å; L20-I24 HydrophobicContact CD2-CD1 4.32Å; L20-I24 HydrophobicContact CG-CD1 3.93Å; L20-I24 WeakPolarHBondContact O-CB 3.28Å; L20-I24 VanDerWaalsContact O-CG1 3.23Å; L20-I24 WeakPolarHBondContact O-CG1 3.48Å; L20-I24 PolarHBondContact O-N 3.46Å
21	L	67	Low	63.6	Low	104 Å²	104	83.6 Å²	83.6	55%	0.545	49%	0.487	S	S	.	.	H	α-helix	trans	-63.9	-40.5	177.5	-73.8	171.5	0	0	0	111.4	T17 L18 S25	T17-L21 HydrophobicContact CG2-CD1 3.92Å; T17-L21 HydrophobicContact CG2-CG 4.27Å; T17-L21 VanDerWaalsContact O-CB 3.29Å; T17-L21 WeakPolarHBondContact O-CB 3.41Å; T17-L21 WeakPolarHBondContact O-CG 3.38Å; T17-L21 PolarHBondContact O-N 2.96Å; L18-L21 PolarHBondContact O-N 2.96Å; L21-S25 WeakPolarHBondContact O-CB 3.4Å; L21-S25 PolarHBondContact O-N 3.25Å
22	A	65	Low	64.1	Low	54 Å²	54	82.7 Å²	82.7	45%	0.446	47%	0.474	S	S	.	.	H	α-helix	trans	-65.5	-43.2	176.6	0	0	0	0	0	111.6	L18 K19 L20 S25 T26	L18-A22 WeakPolarHBondContact O-CB 3.33Å; L18-A22 PolarHBondContact O-N 2.99Å; K19-A22 PolarHBondContact O-N 3.44Å; L20-A22 VanDerWaalsContact C-N 3.33Å; L20-A22 PolarHBondContact O-N 3.12Å; A22-S25 PolarHBondContact O-N 3.26Å; A22-T26 WeakPolarHBondContact O-CB 3.24Å; A22-T26 PolarHBondContact O-N 2.84Å; A22-T26 PolarHBondContact O-OG1 3.06Å
23	S	64.5	Low	64.3	Low	52 Å²	52	77.7 Å²	77.7	36%	0.364	46%	0.459	S	S	.	.	H	α-helix	trans	-66.4	-44.2	177.6	57.9	0	0	0	0	111.7	K19 L20 S25 T26 I27	K19-S23 WeakPolarHBondContact O-CB 3.45Å; K19-S23 PolarHBondContact O-N 3.18Å; K19-S23 PolarHBondContact O-OG 2.93Å; K19-S23 VanDerWaalsContact O-OG 3.06Å; L20-S23 WeakPolarHBondContact CA-OG 3.47Å; L20-S23 PolarHBondContact O-N 3.33Å; L20-S23 PolarHBondContact O-OG 3.32Å; S23-S25 PolarHBondContact O-N 2.92Å; S23-T26 PolarHBondContact O-N 3.03Å; S23-I27 VanDerWaalsContact O-CG1 3.28Å; S23-I27 WeakPolarHBondContact O-CG1 3.38Å; S23-I27 PolarHBondContact O-N 3.37Å
24	I	70.8	Confident	64.8	Low	84 Å²	84	79.2 Å²	79.2	43%	0.431	46%	0.464	S	S	.	.	H	α-helix	trans	-60	-47.4	173.8	-68.2	168.7	0	0	0	110.4	L20 T26 I27 V28	L20-I24 HydrophobicContact CD2-CD1 4.32Å; L20-I24 HydrophobicContact CG-CD1 3.93Å; L20-I24 WeakPolarHBondContact O-CB 3.28Å; L20-I24 VanDerWaalsContact O-CG1 3.23Å; L20-I24 WeakPolarHBondContact O-CG1 3.48Å; L20-I24 PolarHBondContact O-N 3.46Å; I24-T26 VanDerWaalsContact C-N 3.27Å; I24-T26 PolarHBondContact O-N 3.38Å; I24-I27 PolarHBondContact O-N 2.85Å; I24-V28 HydrophobicContact CG2-CG2 4.2Å; I24-V28 WeakPolarHBondContact O-CB 3.18Å; I24-V28 VanDerWaalsContact O-CG2 3.28Å; I24-V28 WeakPolarHBondContact O-CG2 3.44Å; I24-V28 PolarHBondContact O-N 3.38Å
25	S	66	Low	65.3	Low	70 Å²	70	82.5 Å²	82.5	49%	0.49	48%	0.48	S	S	.	.	H	α-helix	trans	-58.6	-41.6	177.7	-173.2	0	0	0	0	111.4	L21 A22 S23 V28 S29	L21-S25 WeakPolarHBondContact O-CB 3.4Å; L21-S25 PolarHBondContact O-N 3.25Å; A22-S25 PolarHBondContact O-N 3.26Å; S23-S25 PolarHBondContact O-N 2.92Å; S25-V28 PolarHBondContact O-N 3.28Å; S25-S29 WeakPolarHBondContact O-CB 3.45Å; S25-S29 PolarHBondContact O-N 3.23Å; S25-S29 PolarHBondContact O-OG 2.85Å
26	T	62.3	Low	65.3	Low	79 Å²	79	80.5 Å²	80.5	49%	0.485	47%	0.467	S	S	.	.	H	α-helix	trans	-65.7	-45.4	179	-52.3	0	0	0	0	111	A22 S23 I24 S29 L30	A22-T26 WeakPolarHBondContact O-CB 3.24Å; A22-T26 PolarHBondContact O-N 2.84Å; A22-T26 PolarHBondContact O-OG1 3.06Å; S23-T26 PolarHBondContact O-N 3.03Å; I24-T26 VanDerWaalsContact C-N 3.27Å; I24-T26 PolarHBondContact O-N 3.38Å; T26-S29 PolarHBondContact O-N 3.13Å; T26-L30 HydrophobicContact CG2-CD1 4.04Å; T26-L30 WeakPolarHBondContact O-CB 3.42Å; T26-L30 VanDerWaalsContact O-CG 3.32Å; T26-L30 WeakPolarHBondContact O-CG 3.3Å; T26-L30 PolarHBondContact O-N 3.34Å
27	I	71	Confident	64.9	Low	120 Å²	120	85.2 Å²	85.2	62%	0.615	47%	0.47	S	S	*	.	H	α-helix	trans	-62	-45.3	178	-68.4	165.1	0	0	0	110.6	S23 I24 L30 G31	S23-I27 VanDerWaalsContact O-CG1 3.28Å; S23-I27 WeakPolarHBondContact O-CG1 3.38Å; S23-I27 PolarHBondContact O-N 3.37Å; I24-I27 PolarHBondContact O-N 2.85Å; I27-L30 PolarHBondContact O-N 3.11Å; I27-G31 PolarHBondContact O-N 3.5Å
28	V	70	Confident	65	Low	78 Å²	78	85.6 Å²	85.6	47%	0.473	47%	0.473	S	S	.	.	H	α-helix	trans	-64.7	-46.5	178.7	172.2	0	0	0	0	110.9	I24 S25 L30 G31 I32	I24-V28 HydrophobicContact CG2-CG2 4.2Å; I24-V28 WeakPolarHBondContact O-CB 3.18Å; I24-V28 VanDerWaalsContact O-CG2 3.28Å; I24-V28 WeakPolarHBondContact O-CG2 3.44Å; I24-V28 PolarHBondContact O-N 3.38Å; S25-V28 PolarHBondContact O-N 3.28Å; V28-L30 PolarHBondContact O-N 3.29Å; V28-G31 PolarHBondContact O-N 2.99Å; V28-I32 HydrophobicContact CG1-CD1 3.72Å; V28-I32 HydrophobicContact CG1-CG1 4.42Å; V28-I32 VanDerWaalsContact O-CG1 3.3Å; V28-I32 WeakPolarHBondContact O-CG1 3.11Å; V28-I32 PolarHBondContact O-N 3.44Å
29	S	62.2	Low	64.9	Low	62 Å²	62	84.3 Å²	84.3	43%	0.434	46%	0.461	S	S	.	.	H	α-helix	trans	-59	-47.2	176.4	-68.5	0	0	0	0	111.7	S25 T26 G31 I32 T33	S25-S29 WeakPolarHBondContact O-CB 3.45Å; S25-S29 PolarHBondContact O-N 3.23Å; S25-S29 PolarHBondContact O-OG 2.85Å; T26-S29 PolarHBondContact O-N 3.13Å; S29-G31 PolarHBondContact O-N 3.37Å; S29-I32 PolarHBondContact O-N 3.46Å; S29-T33 PolarHBondContact O-N 2.72Å; S29-T33 PolarHBondContact O-OG1 3.28Å
30	L	63.3	Low	64.4	Low	105 Å²	105	80.6 Å²	80.6	55%	0.55	45%	0.447	S	S	.	.	H	α-helix	trans	-61	-44.6	176.2	-75.5	169.3	0	0	0	111.9	T26 I27 V28 I32 T33 M34	T26-L30 HydrophobicContact CG2-CD1 4.04Å; T26-L30 WeakPolarHBondContact O-CB 3.42Å; T26-L30 VanDerWaalsContact O-CG 3.32Å; T26-L30 WeakPolarHBondContact O-CG 3.3Å; T26-L30 PolarHBondContact O-N 3.34Å; I27-L30 PolarHBondContact O-N 3.11Å; V28-L30 PolarHBondContact O-N 3.29Å; L30-I32 PolarHBondContact O-N 2.81Å; L30-T33 PolarHBondContact O-N 3.49Å; L30-M34 WeakPolarHBondContact O-CG 3.14Å; L30-M34 PolarHBondContact O-N 2.9Å
31	G	67.4	Low	63.9	Low	31 Å²	31	81.6 Å²	81.6	32%	0.32	45%	0.452	S	S	.	.	H	α-helix	trans	-59.7	-44.8	177.8	0	0	0	0	0	112.4	I27 V28 S29 M34 L35	I27-G31 PolarHBondContact O-N 3.5Å; V28-G31 PolarHBondContact O-N 2.99Å; S29-G31 PolarHBondContact O-N 3.37Å; G31-M34 PolarHBondContact O-N 3.33Å; G31-L35 WeakPolarHBondContact O-CB 3.16Å; G31-L35 VanDerWaalsContact O-CG 3.3Å; G31-L35 WeakPolarHBondContact O-CG 3.34Å; G31-L35 PolarHBondContact O-N 2.57Å
32	I	64.5	Low	63.8	Low	40 Å²	40	83.4 Å²	83.4	21%	0.205	46%	0.458	C	S	.	.	H	α-helix	trans	-64.7	-43.2	176.2	-67.7	166.6	0	0	0	111	V28 S29 L30 L35 S36 V65 V66	V28-I32 HydrophobicContact CG1-CD1 3.72Å; V28-I32 HydrophobicContact CG1-CG1 4.42Å; V28-I32 VanDerWaalsContact O-CG1 3.3Å; V28-I32 WeakPolarHBondContact O-CG1 3.11Å; V28-I32 PolarHBondContact O-N 3.44Å; S29-I32 PolarHBondContact O-N 3.46Å; L30-I32 PolarHBondContact O-N 2.81Å; I32-L35 PolarHBondContact O-N 2.87Å; I32-S36 WeakPolarHBondContact O-CB 3.43Å; I32-S36 PolarHBondContact O-N 3.48Å; I32-S36 PolarHBondContact O-OG 2.96Å; I32-V65 HydrophobicContact CD1-CG1 3.92Å; I32-V66 HydrophobicContact CG2-CG2 3.49Å; I32-V66 VanDerWaalsContact CG2-CG2 3.49Å
33	T	60.3	Low	63.5	Low	74 Å²	74	84.4 Å²	84.4	45%	0.454	46%	0.456	S	S	.	.	H	α-helix	trans	-61.2	-47.5	176.4	-57.9	0	0	0	0	111	S29 L30 L35 S36 W37	S29-T33 PolarHBondContact O-N 2.72Å; S29-T33 PolarHBondContact O-OG1 3.28Å; L30-T33 PolarHBondContact O-N 3.49Å; T33-L35 PolarHBondContact O-N 2.9Å; T33-S36 WeakPolarHBondContact O-CB 3.15Å; T33-S36 PolarHBondContact O-N 2.92Å; T33-W37 VanDerWaalsContact O-CD1 3.28Å; T33-W37 PolarHBondContact O-N 3.06Å
34	M	62.8	Low	62.9	Low	135 Å²	135	90.7 Å²	90.7	67%	0.665	48%	0.476	S	S	*	.	H	α-helix	trans	-62.3	-44.4	178.2	-71.5	-169.4	102.7	0	0	111.9	L30 G31 S36 W37 V38	L30-M34 WeakPolarHBondContact O-CG 3.14Å; L30-M34 PolarHBondContact O-N 2.9Å; G31-M34 PolarHBondContact O-N 3.33Å; M34-S36 VanDerWaalsContact C-N 3.31Å; M34-S36 PolarHBondContact O-N 3.17Å; M34-W37 PolarHBondContact O-N 2.9Å; M34-V38 WeakPolarHBondContact O-CG2 3.48Å; M34-V38 PolarHBondContact O-N 3.46Å
35	L	65	Low	61.8	Low	99 Å²	99	91.4 Å²	91.4	52%	0.518	48%	0.481	S	S	.	.	H	α-helix	trans	-62.1	-38.9	176.1	-74.6	169.5	0	0	0	112.1	G31 I32 T33 V38 Y39	G31-L35 WeakPolarHBondContact O-CB 3.16Å; G31-L35 VanDerWaalsContact O-CG 3.3Å; G31-L35 WeakPolarHBondContact O-CG 3.34Å; G31-L35 PolarHBondContact O-N 2.57Å; I32-L35 PolarHBondContact O-N 2.87Å; T33-L35 PolarHBondContact O-N 2.9Å; L35-V38 PolarHBondContact O-N 2.77Å; L35-Y39 WeakPolarHBondContact O-CB 3.03Å; L35-Y39 PolarHBondContact O-N 2.82Å
36	S	59	Low	60.6	Low	24 Å²	24	95.9 Å²	95.9	17%	0.168	50%	0.499	C	S	.	.	H	α-helix	trans	-63.9	-44.2	175.9	-56.8	0	0	0	0	111.2	I32 T33 M34 Y39 M40	I32-S36 WeakPolarHBondContact O-CB 3.43Å; I32-S36 PolarHBondContact O-N 3.48Å; I32-S36 PolarHBondContact O-OG 2.96Å; T33-S36 WeakPolarHBondContact O-CB 3.15Å; T33-S36 PolarHBondContact O-N 2.92Å; M34-S36 VanDerWaalsContact C-N 3.31Å; M34-S36 PolarHBondContact O-N 3.17Å; S36-Y39 PolarHBondContact O-N 3.4Å; S36-M40 WeakPolarHBondContact O-CG 3.21Å; S36-M40 PolarHBondContact O-N 3.41Å
37	W	57.6	Low	59.6	Low	164 Å²	164	98.6 Å²	98.6	62%	0.621	51%	0.506	S	S	*	.	H	α-helix	trans	-62.3	-45.9	174.5	-90.1	86.1	0	0	0	112.4	T33 M34 Y39 M40 L41	T33-W37 VanDerWaalsContact O-CD1 3.28Å; T33-W37 PolarHBondContact O-N 3.06Å; M34-W37 PolarHBondContact O-N 2.9Å; W37-Y39 VanDerWaalsContact C-N 3.33Å; W37-Y39 PolarHBondContact O-N 3.32Å; W37-M40 PolarHBondContact O-N 3.28Å; W37-L41 WeakPolarHBondContact O-CB 3.41Å; W37-L41 VanDerWaalsContact O-CG 3.23Å; W37-L41 WeakPolarHBondContact O-CG 3.48Å; W37-L41 PolarHBondContact O-N 3.14Å
38	V	66.5	Low	58.2	Low	70 Å²	70	98.5 Å²	98.5	42%	0.424	51%	0.51	S	S	.	.	H	α-helix	trans	-61	-43.7	177.5	171	0	0	0	0	110.8	M34 L35 L41 Q42	M34-V38 WeakPolarHBondContact O-CG2 3.48Å; M34-V38 PolarHBondContact O-N 3.46Å; L35-V38 PolarHBondContact O-N 2.77Å; V38-L41 PolarHBondContact O-N 2.88Å; V38-Q42 HydrophobicContact CG1-CG 4.34Å; V38-Q42 WeakPolarHBondContact O-CB 3.5Å; V38-Q42 WeakPolarHBondContact O-CG 3.3Å; V38-Q42 PolarHBondContact O-N 3.43Å
39	Y	59.3	Low	56.7	Low	73 Å²	73	97 Å²	97	29%	0.286	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-46	177.6	-173.5	-97.5	0	0	0	111.9	L35 S36 W37 L41 Q42 N43 A59 I62	L35-Y39 WeakPolarHBondContact O-CB 3.03Å; L35-Y39 PolarHBondContact O-N 2.82Å; S36-Y39 PolarHBondContact O-N 3.4Å; W37-Y39 VanDerWaalsContact C-N 3.33Å; W37-Y39 PolarHBondContact O-N 3.32Å; Y39-L41 VanDerWaalsContact C-N 3.34Å; Y39-L41 PolarHBondContact O-N 3.39Å; Y39-Q42 PolarHBondContact O-N 3.16Å; Y39-N43 VanDerWaalsContact CE1-ND2 3.27Å; Y39-N43 WeakPolarHBondContact CE1-ND2 3.47Å; Y39-N43 VanDerWaalsContact CZ-ND2 3.34Å; Y39-N43 PolarHBondContact O-N 2.84Å; Y39-N43 VanDerWaalsContact O-N 3.09Å; Y39-N43 PolarHBondContact OH-ND2 3.46Å; Y39-A59 HydrophobicContact CE1-CB 4.07Å; Y39-A59 HydrophobicContact CE2-CB 4.11Å; Y39-I62 HydrophobicContact CD1-CD1 4.35Å; Y39-I62 HydrophobicContact CG-CD1 4.27Å
40	M	55.9	Low	55.7	Low	70 Å²	70	95.7 Å²	95.7	35%	0.345	50%	0.496	S	S	.	.	H	α-helix	trans	-60.4	-42.5	175.4	-73.5	178.5	66.5	0	0	112.1	S36 W37 V48	S36-M40 WeakPolarHBondContact O-CG 3.21Å; S36-M40 PolarHBondContact O-N 3.41Å; W37-M40 PolarHBondContact O-N 3.28Å; M40-V48 HydrophobicContact CE-CB 4.42Å; M40-V48 HydrophobicContact CE-CG1 4.2Å; M40-V48 HydrophobicContact CE-CG2 3.49Å; M40-V48 VanDerWaalsContact CE-CG2 3.49Å
41	L	61.4	Low	54.5	Low	126 Å²	126	100.3 Å²	100.3	66%	0.66	51%	0.506	S	S	*	.	H	α-helix	trans	-66.3	-36.2	177.6	-72.4	167.3	0	0	0	112.4	W37 V38 Y39	W37-L41 WeakPolarHBondContact O-CB 3.41Å; W37-L41 VanDerWaalsContact O-CG 3.23Å; W37-L41 WeakPolarHBondContact O-CG 3.48Å; W37-L41 PolarHBondContact O-N 3.14Å; V38-L41 PolarHBondContact O-N 2.88Å; Y39-L41 VanDerWaalsContact C-N 3.34Å; Y39-L41 PolarHBondContact O-N 3.39Å
42	Q	65.6	Low	53.6	Low	141 Å²	141	100.9 Å²	100.9	66%	0.659	51%	0.505	S	S	*	.	H	α-helix	trans	-72.2	-33.7	179.5	-78.8	-178.9	-20.1	0	0	113.2	V38 Y39 K44	V38-Q42 HydrophobicContact CG1-CG 4.34Å; V38-Q42 WeakPolarHBondContact O-CB 3.5Å; V38-Q42 WeakPolarHBondContact O-CG 3.3Å; V38-Q42 PolarHBondContact O-N 3.43Å; Y39-Q42 PolarHBondContact O-N 3.16Å; Q42-K44 PolarHBondContact O-N 2.8Å; Q42-K44 VanDerWaalsContact O-N 3.13Å
43	N	59	Low	53	Low	76 Å²	76	101.7 Å²	101.7	41%	0.406	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	4.5	-179.4	-89.3	-2.1	0	0	0	114.8	Y39 D45	Y39-N43 VanDerWaalsContact CE1-ND2 3.27Å; Y39-N43 WeakPolarHBondContact CE1-ND2 3.47Å; Y39-N43 VanDerWaalsContact CZ-ND2 3.34Å; Y39-N43 PolarHBondContact O-N 2.84Å; Y39-N43 VanDerWaalsContact O-N 3.09Å; Y39-N43 PolarHBondContact OH-ND2 3.46Å; N43-D45 PolarHBondContact O-N 3.36Å
44	K	51.3	Low	52.5	Low	183 Å²	183	100.4 Å²	100.4	80%	0.796	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	12.8	177.1	-75.1	-168.4	178.1	-178.1	0	115.9	Q42 L46	Q42-K44 PolarHBondContact O-N 2.8Å; Q42-K44 VanDerWaalsContact O-N 3.13Å; K44-L46 PolarHBondContact O-N 3.34Å
45	D	46.8	Very low	51.8	Low	100 Å²	100	98.9 Å²	98.9	54%	0.535	49%	0.493	S	S	.	.			trans	-76.4	81.1	166.2	-84.2	-35.4	0	0	0	109	N43 H47	N43-D45 PolarHBondContact O-N 3.36Å; D45-H47 CarbonylContact O-C 3.55Å; D45-H47 PolarHBondContact O-N 2.92Å
46	L	42	Very low	51.2	Low	164 Å²	164	101.3 Å²	101.3	86%	0.859	50%	0.502	S	S	*	.			trans	-60.8	4	166	-79.1	158.2	0	0	0	113	K44	K44-L46 PolarHBondContact O-N 3.34Å
47	H	40.3	Very low	50.9	Low	136 Å²	136	101.5 Å²	101.5	63%	0.63	50%	0.503	S	S	*	.			trans	-111.9	82.2	166.4	-65.4	-46.8	0	0	0	108.4	D45 S49	D45-H47 CarbonylContact O-C 3.55Å; D45-H47 PolarHBondContact O-N 2.92Å; H47-S49 PolarHBondContact O-N 3.45Å
48	V	42.3	Very low	50.8	Low	117 Å²	117	94.5 Å²	94.5	71%	0.709	48%	0.478	S	S	*	.			trans	-61.8	66.9	137	-170	0	0	0	0	106.4	M40	M40-V48 HydrophobicContact CE-CB 4.42Å; M40-V48 HydrophobicContact CE-CG1 4.2Å; M40-V48 HydrophobicContact CE-CG2 3.49Å; M40-V48 VanDerWaalsContact CE-CG2 3.49Å
49	S	37.9	Very low	50.4	Low	48 Å²	48	91.4 Å²	91.4	34%	0.336	46%	0.46	S	S	.	.			trans	-111.4	142.3	173	78.3	0	0	0	0	105.2	H47 R51 C52	H47-S49 PolarHBondContact O-N 3.45Å; S49-R51 PolarHBondContact O-N 2.87Å; S49-C52 PolarHBondContact O-N 2.98Å
50	A	40.6	Very low	50.5	Low	33 Å²	33	92 Å²	92	27%	0.273	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-32.3	-24.1	172.5	0	0	0	0	0	116.8	C52 D133 E137	A50-C52 PolarHBondContact O-N 3.39Å; A50-D133 HydrophobicContact CB-CB 4.09Å; A50-D133 VanDerWaalsContact O-CB 3.28Å; A50-D133 WeakPolarHBondContact O-CB 3.24Å; A50-E137 HydrophobicContact CB-CB 4.38Å; A50-E137 WeakPolarHBondContact CB-OE2 3.38Å
51	R	39.8	Very low	50.7	Low	202 Å²	202	95 Å²	95	76%	0.762	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-19.8	-170.5	-69.6	-175.1	173.9	-175.8	-1.3	116.6	S49 D133	S49-R51 PolarHBondContact O-N 2.87Å; R51-D133 WeakPolarHBondContact CA-OD2 3.28Å
52	C	46.9	Very low	50.9	Low	44 Å²	44	89.2 Å²	89.2	30%	0.297	45%	0.45	S	S	.	.	S	Bend	trans	-90.1	116.5	-175.6	-170.9	0	0	0	0	110.1	S49 A50 L54 C57	S49-C52 PolarHBondContact O-N 2.98Å; A50-C52 PolarHBondContact O-N 3.39Å; C52-L54 PolarHBondContact O-N 3.27Å; C52-C57 VanDerWaalsContact CA-SG 3.52Å; C52-C57 HydrophobicContact CB-CB 4.01Å; C52-C57 WeakPolarHBondContact CB-SG 3.44Å; C52-C57 PolarHBondContact O-SG 2.9Å; C52-C57 VanDerWaalsContact O-SG 3.36Å; C52-C57 WeakPolarHBondContact SG-CB 3.47Å; C52-C57 CovalentContact SG-SG 1.99Å; C52-C57 PolarHBondContact SG-SG 3.4Å
53	V	52.1	Low	50.6	Low	57 Å²	57	84.3 Å²	84.3	35%	0.345	43%	0.426	S	S	.	.			trans	-61.7	124.1	177.3	-177.7	0	0	0	0	107	H55 E56 C57	V53-H55 PolarHBondContact O-N 3.3Å; V53-E56 HydrophobicContact CB-CG 4.24Å; V53-E56 WeakPolarHBondContact O-CB 3.24Å; V53-E56 PolarHBondContact O-N 3.21Å; V53-C57 PolarHBondContact O-N 3.45Å; V53-C57 PolarHBondContact O-SG 3.31Å
54	L	50.6	Low	50.8	Low	47 Å²	47	83.7 Å²	83.7	25%	0.246	43%	0.425	C	S	.	.	H	α-helix	trans	-46.2	-31.9	-170	-156.2	81.9	0	0	0	114.3	C52 T58 Y63 Y67 R124	C52-L54 PolarHBondContact O-N 3.27Å; L54-T58 PolarHBondContact O-N 2.83Å; L54-T58 PolarHBondContact O-OG1 2.9Å; L54-Y63 HydrophobicContact CB-CE2 4.44Å; L54-Y63 HydrophobicContact CD2-CD2 3.91Å; L54-Y63 HydrophobicContact CD2-CE2 3.71Å; L54-Y63 HydrophobicContact CG-CD2 4.4Å; L54-Y63 HydrophobicContact CG-CE2 4.46Å; L54-Y67 HydrophobicContact CD2-CD2 3.77Å; L54-Y67 HydrophobicContact CD2-CE1 4.16Å; L54-Y67 HydrophobicContact CD2-CE2 3.24Å; L54-Y67 HydrophobicContact CD2-CG 4.44Å; L54-Y67 VanDerWaalsContact CD2-CZ 3.45Å; L54-Y67 HydrophobicContact CG-CE2 4.07Å; L54-R124 VanDerWaalsContact CD2-NH1 3.29Å
55	H	48.3	Very low	51.4	Low	102 Å²	102	77.8 Å²	77.8	47%	0.472	40%	0.403	S	S	.	.	H	α-helix	trans	-73.2	-24	179.2	-151.3	-21.2	0	0	0	114.5	V53	V53-H55 PolarHBondContact O-N 3.3Å
56	E	51.1	Low	52.3	Low	151 Å²	151	74.9 Å²	74.9	71%	0.706	39%	0.389	S	S	*	.	H	α-helix	trans	-89.2	-31.6	-178.6	-63.2	179.9	167.2	0	0	112	V53	V53-E56 HydrophobicContact CB-CG 4.24Å; V53-E56 WeakPolarHBondContact O-CB 3.24Å; V53-E56 PolarHBondContact O-N 3.21Å
57	C	54	Low	53.3	Low	28 Å²	28	69.2 Å²	69.2	19%	0.189	36%	0.357	C	S	.	.	H	α-helix	trans	-94.1	-17.1	-176.9	-9.9	0	0	0	0	113.5	C52 V53	C52-C57 VanDerWaalsContact CA-SG 3.52Å; C52-C57 HydrophobicContact CB-CB 4.01Å; C52-C57 WeakPolarHBondContact CB-SG 3.44Å; C52-C57 PolarHBondContact O-SG 2.9Å; C52-C57 VanDerWaalsContact O-SG 3.36Å; C52-C57 WeakPolarHBondContact SG-CB 3.47Å; C52-C57 CovalentContact SG-SG 1.99Å; C52-C57 PolarHBondContact SG-SG 3.4Å; V53-C57 PolarHBondContact O-N 3.45Å; V53-C57 PolarHBondContact O-SG 3.31Å
58	T	54.8	Low	54.6	Low	16 Å²	16	67.1 Å²	67.1	10%	0.098	35%	0.349	C	S	.	.	S	Bend	trans	-110.9	137	176	61.4	0	0	0	0	109.4	L54 I62	L54-T58 PolarHBondContact O-N 2.83Å; L54-T58 PolarHBondContact O-OG1 2.9Å; T58-I62 HydrophobicContact CG2-CG2 4.45Å
59	A	58.2	Low	55.8	Low	5 Å²	5	64.3 Å²	64.3	4%	0.041	33%	0.333	C	S	.	.			trans	-53.1	138.5	174.5	0	0	0	0	0	109.2	Y39 W61 I62 Y63	Y39-A59 HydrophobicContact CE1-CB 4.07Å; Y39-A59 HydrophobicContact CE2-CB 4.11Å; A59-W61 VanDerWaalsContact CB-CD1 3.45Å; A59-W61 HydrophobicContact CB-CG 4.33Å; A59-W61 VanDerWaalsContact CB-NE1 3.31Å; A59-W61 PolarHBondContact O-N 3.31Å; A59-I62 HydrophobicContact CB-CD1 4.11Å; A59-I62 HydrophobicContact CB-CG1 4.17Å; A59-I62 WeakPolarHBondContact O-CA 3.37Å; A59-I62 WeakPolarHBondContact O-CB 3.39Å; A59-I62 PolarHBondContact O-N 3.02Å; A59-Y63 PolarHBondContact O-N 3.02Å; A59-Y63 VanDerWaalsContact O-N 3.14Å
60	P	60.8	Low	57.3	Low	86 Å²	86	63.9 Å²	63.9	56%	0.558	33%	0.329	S	S	*	.	H	α-helix	trans	-52.4	-30.5	-174.7	-28.2	33	0	0	0	114	T64	P60-T64 PolarHBondContact O-N 3.46Å; P60-T64 VanDerWaalsContact O-N 3.1Å; P60-T64 PolarHBondContact O-OG1 2.91Å
61	W	61.8	Low	58.5	Low	134 Å²	134	64.2 Å²	64.2	51%	0.508	33%	0.326	S	S	.	.	H	α-helix	trans	-71	-38.3	175.4	72.8	-96.1	0	0	0	112.8	A59 Y63 T64 V65	A59-W61 VanDerWaalsContact CB-CD1 3.45Å; A59-W61 HydrophobicContact CB-CG 4.33Å; A59-W61 VanDerWaalsContact CB-NE1 3.31Å; A59-W61 PolarHBondContact O-N 3.31Å; W61-Y63 VanDerWaalsContact C-N 3.32Å; W61-T64 PolarHBondContact O-N 3.2Å; W61-V65 HydrophobicContact CE3-CG2 4.36Å; W61-V65 WeakPolarHBondContact O-CB 3.29Å; W61-V65 VanDerWaalsContact O-CG2 3.27Å; W61-V65 WeakPolarHBondContact O-CG2 3.39Å; W61-V65 PolarHBondContact O-N 3.49Å
62	I	65	Low	60	Low	4 Å²	4	60.1 Å²	60.1	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-62.9	-44.8	174.6	-65.1	176.2	0	0	0	108.7	Y39 T58 A59 T64 V65 V66	Y39-I62 HydrophobicContact CD1-CD1 4.35Å; Y39-I62 HydrophobicContact CG-CD1 4.27Å; T58-I62 HydrophobicContact CG2-CG2 4.45Å; A59-I62 HydrophobicContact CB-CD1 4.11Å; A59-I62 HydrophobicContact CB-CG1 4.17Å; A59-I62 WeakPolarHBondContact O-CA 3.37Å; A59-I62 WeakPolarHBondContact O-CB 3.39Å; A59-I62 PolarHBondContact O-N 3.02Å; I62-T64 VanDerWaalsContact C-N 3.28Å; I62-T64 PolarHBondContact O-N 3.07Å; I62-V65 PolarHBondContact O-N 3.36Å; I62-V66 HydrophobicContact CG2-CG2 3.82Å; I62-V66 VanDerWaalsContact O-CB 3.27Å; I62-V66 WeakPolarHBondContact O-CB 3.25Å; I62-V66 VanDerWaalsContact O-CG2 3.3Å; I62-V66 WeakPolarHBondContact O-CG2 3.47Å; I62-V66 PolarHBondContact O-N 3.19Å
63	Y	59.3	Low	61.1	Low	38 Å²	38	63.9 Å²	63.9	15%	0.149	33%	0.325	C	S	.	.	H	α-helix	trans	-57.4	-45.2	177.2	-174.9	-91.1	0	0	0	111.6	L54 A59 W61 Y67 I68 R124	L54-Y63 HydrophobicContact CB-CE2 4.44Å; L54-Y63 HydrophobicContact CD2-CD2 3.91Å; L54-Y63 HydrophobicContact CD2-CE2 3.71Å; L54-Y63 HydrophobicContact CG-CD2 4.4Å; L54-Y63 HydrophobicContact CG-CE2 4.46Å; A59-Y63 PolarHBondContact O-N 3.02Å; A59-Y63 VanDerWaalsContact O-N 3.14Å; W61-Y63 VanDerWaalsContact C-N 3.32Å; Y63-Y67 AromaticContact CD2-CD2 3.71Å; Y63-Y67 HydrophobicContact CD2-CD2 3.71Å; Y63-Y67 HydrophobicContact CD2-CE2 4.22Å; Y63-Y67 HydrophobicContact CE2-CD2 4.07Å; Y63-Y67 HydrophobicContact CG-CD2 4.18Å; Y63-Y67 VanDerWaalsContact O-CB 3.31Å; Y63-Y67 WeakPolarHBondContact O-CB 3.35Å; Y63-Y67 WeakPolarHBondContact O-CD2 3.37Å; Y63-Y67 PolarHBondContact O-N 2.86Å; Y63-I68 HydrophobicContact CD1-CD1 4.45Å; Y63-I68 HydrophobicContact CE1-CD1 4.3Å; Y63-I68 HydrophobicContact CE1-CG1 4.3Å; Y63-R124 PolarHBondContact OH-NH1 3.47Å
64	T	63.3	Low	61.9	Low	63 Å²	63	62.5 Å²	62.5	39%	0.387	32%	0.315	S	S	.	.	I	π-helix	trans	-64.8	-47.2	178.5	-55.4	0	0	0	0	112	P60 W61 I62 I68 V69	P60-T64 PolarHBondContact O-N 3.46Å; P60-T64 VanDerWaalsContact O-N 3.1Å; P60-T64 PolarHBondContact O-OG1 2.91Å; W61-T64 PolarHBondContact O-N 3.2Å; I62-T64 VanDerWaalsContact C-N 3.28Å; I62-T64 PolarHBondContact O-N 3.07Å; T64-I68 HydrophobicContact CG2-CB 4.35Å; T64-I68 HydrophobicContact CG2-CD1 4.43Å; T64-I68 WeakPolarHBondContact O-CB 3.41Å; T64-I68 PolarHBondContact O-N 3.38Å; T64-I68 VanDerWaalsContact O-N 3.08Å; T64-V69 WeakPolarHBondContact O-CG2 3.33Å; T64-V69 PolarHBondContact O-N 3.45Å
65	V	64.1	Low	62.9	Low	58 Å²	58	63.2 Å²	63.2	35%	0.352	32%	0.319	S	S	.	.	I	π-helix	trans	-73.8	-35.4	-175.1	172.5	0	0	0	0	112.6	I32 W61 I62 P70	I32-V65 HydrophobicContact CD1-CG1 3.92Å; W61-V65 HydrophobicContact CE3-CG2 4.36Å; W61-V65 WeakPolarHBondContact O-CB 3.29Å; W61-V65 VanDerWaalsContact O-CG2 3.27Å; W61-V65 WeakPolarHBondContact O-CG2 3.39Å; W61-V65 PolarHBondContact O-N 3.49Å; I62-V65 PolarHBondContact O-N 3.36Å; V65-P70 VanDerWaalsContact O-CD 3.24Å; V65-P70 WeakPolarHBondContact O-CD 3.1Å
66	V	64.4	Low	63.9	Low	40 Å²	40	62.2 Å²	62.2	24%	0.242	32%	0.315	C	S	.	.	I	π-helix	trans	-87.3	-28.9	-176.8	179.9	0	0	0	0	112	I32 I62 P70	I32-V66 HydrophobicContact CG2-CG2 3.49Å; I32-V66 VanDerWaalsContact CG2-CG2 3.49Å; I62-V66 HydrophobicContact CG2-CG2 3.82Å; I62-V66 VanDerWaalsContact O-CB 3.27Å; I62-V66 WeakPolarHBondContact O-CB 3.25Å; I62-V66 VanDerWaalsContact O-CG2 3.3Å; I62-V66 WeakPolarHBondContact O-CG2 3.47Å; I62-V66 PolarHBondContact O-N 3.19Å; V66-P70 WeakPolarHBondContact O-CD 3.47Å; V66-P70 VanDerWaalsContact O-CG 3.25Å; V66-P70 WeakPolarHBondContact O-CG 3.41Å
67	Y	63.5	Low	64.8	Low	45 Å²	45	57.8 Å²	57.8	18%	0.176	30%	0.298	C	S	.	.	I	π-helix	trans	-117.9	-44.9	-171.9	-55.1	-66.1	0	0	0	114.1	L54 Y63 L71 R124	L54-Y67 HydrophobicContact CD2-CD2 3.77Å; L54-Y67 HydrophobicContact CD2-CE1 4.16Å; L54-Y67 HydrophobicContact CD2-CE2 3.24Å; L54-Y67 HydrophobicContact CD2-CG 4.44Å; L54-Y67 VanDerWaalsContact CD2-CZ 3.45Å; L54-Y67 HydrophobicContact CG-CE2 4.07Å; Y63-Y67 AromaticContact CD2-CD2 3.71Å; Y63-Y67 HydrophobicContact CD2-CD2 3.71Å; Y63-Y67 HydrophobicContact CD2-CE2 4.22Å; Y63-Y67 HydrophobicContact CE2-CD2 4.07Å; Y63-Y67 HydrophobicContact CG-CD2 4.18Å; Y63-Y67 VanDerWaalsContact O-CB 3.31Å; Y63-Y67 WeakPolarHBondContact O-CB 3.35Å; Y63-Y67 WeakPolarHBondContact O-CD2 3.37Å; Y63-Y67 PolarHBondContact O-N 2.86Å; Y67-L71 VanDerWaalsContact O-CB 3.32Å; Y67-L71 WeakPolarHBondContact O-CB 3.11Å; Y67-L71 PolarHBondContact O-N 3.2Å; Y67-R124 VanDerWaalsContact CG-CZ 3.42Å
68	I	67	Low	65.4	Low	91 Å²	91	58.1 Å²	58.1	47%	0.467	30%	0.298	S	S	.	.	I	π-helix	trans	-76	-49.5	-178.3	-59.6	-174.6	0	0	0	110.9	Y63 T64 L71 F72	Y63-I68 HydrophobicContact CD1-CD1 4.45Å; Y63-I68 HydrophobicContact CE1-CD1 4.3Å; Y63-I68 HydrophobicContact CE1-CG1 4.3Å; T64-I68 HydrophobicContact CG2-CB 4.35Å; T64-I68 HydrophobicContact CG2-CD1 4.43Å; T64-I68 WeakPolarHBondContact O-CB 3.41Å; T64-I68 PolarHBondContact O-N 3.38Å; T64-I68 VanDerWaalsContact O-N 3.08Å; I68-L71 PolarHBondContact O-N 2.93Å; I68-F72 PolarHBondContact O-N 2.81Å
69	V	68.1	Low	66.3	Low	59 Å²	59	62.1 Å²	62.1	36%	0.358	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-46.1	-177.1	173.7	0	0	0	0	111.7	T64 L71 F72 F73	T64-V69 WeakPolarHBondContact O-CG2 3.33Å; T64-V69 PolarHBondContact O-N 3.45Å; V69-L71 PolarHBondContact O-N 2.86Å; V69-F72 WeakPolarHBondContact O-CB 3.42Å; V69-F72 PolarHBondContact O-N 3.38Å; V69-F73 HydrophobicContact CG1-CD2 3.7Å; V69-F73 HydrophobicContact CG1-CE2 3.51Å; V69-F73 VanDerWaalsContact O-CD2 3.23Å; V69-F73 WeakPolarHBondContact O-CD2 3.32Å; V69-F73 PolarHBondContact O-N 2.9Å; V69-F73 VanDerWaalsContact O-N 3.08Å
70	P	68.7	Low	67	Low	39 Å²	39	66 Å²	66	25%	0.253	34%	0.34	S	S	.	.	H	α-helix	trans	-66.5	-36.6	177.9	-27.6	41.9	0	0	0	112.5	V65 V66 F72 F73 I74	V65-P70 VanDerWaalsContact O-CD 3.24Å; V65-P70 WeakPolarHBondContact O-CD 3.1Å; V66-P70 WeakPolarHBondContact O-CD 3.47Å; V66-P70 VanDerWaalsContact O-CG 3.25Å; V66-P70 WeakPolarHBondContact O-CG 3.41Å; P70-F72 VanDerWaalsContact C-N 3.32Å; P70-F72 PolarHBondContact O-N 3.31Å; P70-F73 PolarHBondContact O-N 3.39Å; P70-I74 WeakPolarHBondContact O-CB 3.28Å; P70-I74 WeakPolarHBondContact O-CG1 3.43Å; P70-I74 PolarHBondContact O-N 3.31Å
71	L	66	Low	67.4	Low	40 Å²	40	64 Å²	64	21%	0.209	32%	0.324	C	S	.	.	H	α-helix	trans	-60.5	-43.4	175.1	-166.8	79.4	0	0	0	111.2	Y67 I68 V69 I74 I75 F117 F120	Y67-L71 VanDerWaalsContact O-CB 3.32Å; Y67-L71 WeakPolarHBondContact O-CB 3.11Å; Y67-L71 PolarHBondContact O-N 3.2Å; I68-L71 PolarHBondContact O-N 2.93Å; V69-L71 PolarHBondContact O-N 2.86Å; L71-I74 PolarHBondContact O-N 2.84Å; L71-I75 HydrophobicContact CG-CD1 4.21Å; L71-I75 VanDerWaalsContact O-CG1 3.27Å; L71-I75 WeakPolarHBondContact O-CG1 3.41Å; L71-I75 PolarHBondContact O-N 3.24Å; L71-F117 HydrophobicContact CD1-CE2 4.38Å; L71-F120 HydrophobicContact CD1-CB 3.94Å
72	F	71.4	Confident	67.8	Low	115 Å²	115	61 Å²	61	50%	0.504	32%	0.32	S	S	.	.	H	α-helix	trans	-58.7	-48.5	174.6	175.7	-94.8	0	0	0	111.9	I68 V69 P70 I74 I75 M76	I68-F72 PolarHBondContact O-N 2.81Å; V69-F72 WeakPolarHBondContact O-CB 3.42Å; V69-F72 PolarHBondContact O-N 3.38Å; P70-F72 VanDerWaalsContact C-N 3.32Å; P70-F72 PolarHBondContact O-N 3.31Å; F72-I74 PolarHBondContact O-N 3.2Å; F72-I75 PolarHBondContact O-N 2.93Å; F72-M76 HydrophobicContact CD1-CG 4.31Å; F72-M76 HydrophobicContact CD2-CE 4.38Å; F72-M76 HydrophobicContact CE1-CG 3.87Å; F72-M76 HydrophobicContact CE2-CE 3.68Å; F72-M76 HydrophobicContact CE2-CG 4.16Å; F72-M76 HydrophobicContact CZ-CE 3.99Å; F72-M76 HydrophobicContact CZ-CG 3.79Å; F72-M76 HydrophobicContact CZ-SD 4.39Å; F72-M76 WeakPolarHBondContact O-CG 2.96Å; F72-M76 PolarHBondContact O-N 3.28Å
73	F	70	Confident	68	Low	124 Å²	124	63.6 Å²	63.6	54%	0.544	34%	0.342	S	S	.	.	H	α-helix	trans	-64.7	-38.1	178.4	-79.7	-68.1	0	0	0	112.6	V69 P70 M76 T77	V69-F73 HydrophobicContact CG1-CD2 3.7Å; V69-F73 HydrophobicContact CG1-CE2 3.51Å; V69-F73 VanDerWaalsContact O-CD2 3.23Å; V69-F73 WeakPolarHBondContact O-CD2 3.32Å; V69-F73 PolarHBondContact O-N 2.9Å; V69-F73 VanDerWaalsContact O-N 3.08Å; P70-F73 PolarHBondContact O-N 3.39Å; F73-M76 PolarHBondContact O-N 3.44Å; F73-T77 VanDerWaalsContact O-CB 3.26Å; F73-T77 WeakPolarHBondContact O-CB 3.39Å; F73-T77 PolarHBondContact O-N 3.13Å; F73-T77 PolarHBondContact O-OG1 3.48Å
74	I	69.4	Low	68.5	Low	28 Å²	28	63.5 Å²	63.5	14%	0.144	35%	0.345	C	S	.	.	H	α-helix	trans	-63.3	-44.9	175.7	-69.5	167.1	0	0	0	110.2	P70 L71 F72 T77 M78 I113 F117 F120	P70-I74 WeakPolarHBondContact O-CB 3.28Å; P70-I74 WeakPolarHBondContact O-CG1 3.43Å; P70-I74 PolarHBondContact O-N 3.31Å; L71-I74 PolarHBondContact O-N 2.84Å; F72-I74 PolarHBondContact O-N 3.2Å; I74-T77 PolarHBondContact O-N 3.32Å; I74-M78 WeakPolarHBondContact O-CB 3.23Å; I74-M78 PolarHBondContact O-N 3.47Å; I74-I113 HydrophobicContact CG2-CG2 4.44Å; I74-F117 HydrophobicContact CG2-CB 3.56Å; I74-F117 HydrophobicContact CG2-CD2 3.76Å; I74-F117 HydrophobicContact CG2-CG 4.12Å; I74-F120 HydrophobicContact CD1-CD2 3.78Å; I74-F120 HydrophobicContact CD1-CE2 4.03Å; I74-F120 HydrophobicContact CD1-CG 4.22Å
75	I	71.2	Confident	68.7	Low	61 Å²	61	61.5 Å²	61.5	31%	0.313	34%	0.335	S	S	.	.	H	α-helix	trans	-59.7	-51.1	176.8	-69.9	165.4	0	0	0	110.5	L71 F72 T77 M78 I79 F117	L71-I75 HydrophobicContact CG-CD1 4.21Å; L71-I75 VanDerWaalsContact O-CG1 3.27Å; L71-I75 WeakPolarHBondContact O-CG1 3.41Å; L71-I75 PolarHBondContact O-N 3.24Å; F72-I75 PolarHBondContact O-N 2.93Å; I75-T77 VanDerWaalsContact C-N 3.29Å; I75-T77 PolarHBondContact O-N 2.69Å; I75-M78 WeakPolarHBondContact O-CB 3.22Å; I75-M78 PolarHBondContact O-N 2.79Å; I75-M78 VanDerWaalsContact O-N 3.16Å; I75-I79 HydrophobicContact CG2-CD1 3.94Å; I75-I79 WeakPolarHBondContact O-CG1 3.44Å; I75-I79 PolarHBondContact O-N 3.05Å; I75-F117 HydrophobicContact CD1-CE2 3.99Å; I75-F117 HydrophobicContact CG1-CD2 3.99Å; I75-F117 HydrophobicContact CG1-CE2 3.35Å; I75-F117 HydrophobicContact CG1-CZ 4.16Å
76	M	70.4	Confident	69	Low	81 Å²	81	62.6 Å²	62.6	40%	0.399	34%	0.342	S	S	.	.	H	α-helix	trans	-60.4	-41.2	179	-70.5	-62.6	146.4	0	0	111.5	F72 F73 I79 V80	F72-M76 HydrophobicContact CD1-CG 4.31Å; F72-M76 HydrophobicContact CD2-CE 4.38Å; F72-M76 HydrophobicContact CE1-CG 3.87Å; F72-M76 HydrophobicContact CE2-CE 3.68Å; F72-M76 HydrophobicContact CE2-CG 4.16Å; F72-M76 HydrophobicContact CZ-CE 3.99Å; F72-M76 HydrophobicContact CZ-CG 3.79Å; F72-M76 HydrophobicContact CZ-SD 4.39Å; F72-M76 WeakPolarHBondContact O-CG 2.96Å; F72-M76 PolarHBondContact O-N 3.28Å; F73-M76 PolarHBondContact O-N 3.44Å; M76-I79 HydrophobicContact CE-CD1 4.49Å; M76-I79 PolarHBondContact O-N 3.3Å; M76-I79 HydrophobicContact SD-CD1 4.45Å; M76-V80 VanDerWaalsContact O-CG2 3.31Å; M76-V80 WeakPolarHBondContact O-CG2 3.34Å; M76-V80 PolarHBondContact O-N 3.29Å
77	T	69.2	Low	69.1	Low	58 Å²	58	64.3 Å²	64.3	36%	0.356	35%	0.346	S	S	.	.	H	α-helix	trans	-64.6	-40.9	176.8	-53.5	0	0	0	0	111.3	F73 I74 I75 V80 H81 I113	F73-T77 VanDerWaalsContact O-CB 3.26Å; F73-T77 WeakPolarHBondContact O-CB 3.39Å; F73-T77 PolarHBondContact O-N 3.13Å; F73-T77 PolarHBondContact O-OG1 3.48Å; I74-T77 PolarHBondContact O-N 3.32Å; I75-T77 VanDerWaalsContact C-N 3.29Å; I75-T77 PolarHBondContact O-N 2.69Å; T77-V80 PolarHBondContact O-N 2.88Å; T77-H81 WeakPolarHBondContact O-CB 3.39Å; T77-H81 PolarHBondContact O-N 3.41Å; T77-I113 HydrophobicContact CG2-CD1 3.81Å
78	M	67.5	Low	69.2	Low	36 Å²	36	62.4 Å²	62.4	18%	0.177	34%	0.339	C	S	.	.	H	α-helix	trans	-60	-47.9	174.2	-108.7	-119.3	80.5	0	0	111.5	I74 I75 V80 H81 V82 I113 T114	I74-M78 WeakPolarHBondContact O-CB 3.23Å; I74-M78 PolarHBondContact O-N 3.47Å; I75-M78 WeakPolarHBondContact O-CB 3.22Å; I75-M78 PolarHBondContact O-N 2.79Å; I75-M78 VanDerWaalsContact O-N 3.16Å; M78-V80 PolarHBondContact O-N 3.45Å; M78-H81 PolarHBondContact O-N 3.35Å; M78-V82 HydrophobicContact CE-CG2 3.51Å; M78-V82 WeakPolarHBondContact O-CG2 3.17Å; M78-V82 PolarHBondContact O-N 3.49Å; M78-I113 HydrophobicContact CB-CG2 4.33Å; M78-I113 HydrophobicContact CG-CG2 3.6Å; M78-T114 WeakPolarHBondContact CE-OG1 3.18Å; M78-T114 HydrophobicContact SD-CG2 4.4Å; M78-T114 PolarHBondContact SD-OG1 2.9Å; M78-T114 VanDerWaalsContact SD-OG1 3.38Å
79	I	73.4	Confident	69.3	Low	99 Å²	99	63.9 Å²	63.9	51%	0.508	34%	0.342	S	S	.	.	H	α-helix	trans	-59.1	-49.3	178.6	-66.9	167.6	0	0	0	110.1	I75 M76 H81 V82 A83	I75-I79 HydrophobicContact CG2-CD1 3.94Å; I75-I79 WeakPolarHBondContact O-CG1 3.44Å; I75-I79 PolarHBondContact O-N 3.05Å; M76-I79 HydrophobicContact CE-CD1 4.49Å; M76-I79 PolarHBondContact O-N 3.3Å; M76-I79 HydrophobicContact SD-CD1 4.45Å; I79-H81 VanDerWaalsContact C-N 3.33Å; I79-H81 PolarHBondContact O-N 2.99Å; I79-V82 PolarHBondContact O-N 2.91Å; I79-A83 WeakPolarHBondContact O-CB 3.29Å; I79-A83 PolarHBondContact O-N 2.83Å
80	V	71.6	Confident	69.3	Low	86 Å²	86	65.7 Å²	65.7	52%	0.521	35%	0.349	S	S	.	.	H	α-helix	trans	-62.7	-40.3	178.8	172.7	0	0	0	0	111.3	M76 T77 M78 A83 T84	M76-V80 VanDerWaalsContact O-CG2 3.31Å; M76-V80 WeakPolarHBondContact O-CG2 3.34Å; M76-V80 PolarHBondContact O-N 3.29Å; T77-V80 PolarHBondContact O-N 2.88Å; M78-V80 PolarHBondContact O-N 3.45Å; V80-A83 PolarHBondContact O-N 2.82Å; V80-T84 WeakPolarHBondContact O-CB 3.37Å; V80-T84 PolarHBondContact O-N 2.85Å; V80-T84 PolarHBondContact O-OG1 3.34Å
81	H	69.4	Low	69.2	Low	45 Å²	45	65.3 Å²	65.3	21%	0.208	34%	0.344	C	S	.	.	H	α-helix	trans	-66.6	-44.3	177.9	-98.8	54.6	0	0	0	112.5	T77 M78 I79 T84 A85 V109 I113	T77-H81 WeakPolarHBondContact O-CB 3.39Å; T77-H81 PolarHBondContact O-N 3.41Å; M78-H81 PolarHBondContact O-N 3.35Å; I79-H81 VanDerWaalsContact C-N 3.33Å; I79-H81 PolarHBondContact O-N 2.99Å; H81-T84 PolarHBondContact O-N 2.91Å; H81-A85 WeakPolarHBondContact O-CB 3.48Å; H81-A85 PolarHBondContact O-N 2.86Å; H81-V109 WeakPolarHBondContact NE2-CG1 3.1Å; H81-I113 HydrophobicContact CB-CD1 4.38Å
82	V	71.6	Confident	69.2	Low	72 Å²	72	65.7 Å²	65.7	44%	0.436	35%	0.345	S	S	.	.	H	α-helix	trans	-61.6	-46.3	175.8	171.8	0	0	0	0	110.3	M78 I79 T84 A85 V86	M78-V82 HydrophobicContact CE-CG2 3.51Å; M78-V82 WeakPolarHBondContact O-CG2 3.17Å; M78-V82 PolarHBondContact O-N 3.49Å; I79-V82 PolarHBondContact O-N 2.91Å; V82-T84 VanDerWaalsContact C-N 3.29Å; V82-T84 PolarHBondContact O-N 3.37Å; V82-A85 PolarHBondContact O-N 3.49Å; V82-V86 WeakPolarHBondContact O-CG2 3.44Å; V82-V86 PolarHBondContact O-N 3.4Å
83	A	68.8	Low	69	Low	57 Å²	57	70.6 Å²	70.6	47%	0.471	36%	0.36	S	S	.	.	H	α-helix	trans	-58.6	-42.4	175.6	0	0	0	0	0	111.6	I79 V80 V86 F87	I79-A83 WeakPolarHBondContact O-CB 3.29Å; I79-A83 PolarHBondContact O-N 2.83Å; V80-A83 PolarHBondContact O-N 2.82Å; A83-V86 PolarHBondContact O-N 2.89Å; A83-F87 VanDerWaalsContact O-CB 3.31Å; A83-F87 WeakPolarHBondContact O-CB 3.3Å; A83-F87 PolarHBondContact O-N 3.49Å
84	T	68.8	Low	68.7	Low	36 Å²	36	72.5 Å²	72.5	22%	0.221	37%	0.371	C	S	.	.	H	α-helix	trans	-67.4	-39.4	177.8	-53.4	0	0	0	0	111.7	V80 H81 V82 F87 V88 I106	V80-T84 WeakPolarHBondContact O-CB 3.37Å; V80-T84 PolarHBondContact O-N 2.85Å; V80-T84 PolarHBondContact O-OG1 3.34Å; H81-T84 PolarHBondContact O-N 2.91Å; V82-T84 VanDerWaalsContact C-N 3.29Å; V82-T84 PolarHBondContact O-N 3.37Å; T84-F87 PolarHBondContact O-N 3.24Å; T84-V88 HydrophobicContact CG2-CG2 4.41Å; T84-V88 WeakPolarHBondContact O-CB 3.27Å; T84-V88 WeakPolarHBondContact O-CG2 3.29Å; T84-V88 PolarHBondContact O-N 2.72Å; T84-I106 HydrophobicContact CG2-CD1 4.11Å
85	A	67.7	Low	68.2	Low	21 Å²	21	76.5 Å²	76.5	17%	0.174	39%	0.392	C	S	.	.	H	α-helix	trans	-63.7	-44.9	176.3	0	0	0	0	0	111.7	H81 V82 V88 K89 I106	H81-A85 WeakPolarHBondContact O-CB 3.48Å; H81-A85 PolarHBondContact O-N 2.86Å; V82-A85 PolarHBondContact O-N 3.49Å; A85-V88 PolarHBondContact O-N 3.33Å; A85-K89 VanDerWaalsContact O-CB 3.29Å; A85-K89 WeakPolarHBondContact O-CB 3.43Å; A85-K89 PolarHBondContact O-N 2.89Å; A85-I106 HydrophobicContact CB-CG2 3.59Å
86	V	70.3	Confident	67.8	Low	81 Å²	81	77.5 Å²	77.5	49%	0.491	41%	0.405	S	S	.	.	H	α-helix	trans	-60.6	-47.9	174.8	172.1	0	0	0	0	110	V82 A83 V88 K89 I90	V82-V86 WeakPolarHBondContact O-CG2 3.44Å; V82-V86 PolarHBondContact O-N 3.4Å; A83-V86 PolarHBondContact O-N 2.89Å; V86-V88 PolarHBondContact O-N 2.91Å; V86-K89 PolarHBondContact O-N 2.92Å; V86-I90 HydrophobicContact CG1-CD1 3.86Å; V86-I90 VanDerWaalsContact O-CG1 3.29Å; V86-I90 WeakPolarHBondContact O-CG1 3.48Å; V86-I90 PolarHBondContact O-N 3.02Å
87	F	67.5	Low	67.3	Low	77 Å²	77	79.4 Å²	79.4	34%	0.338	42%	0.421	S	S	.	.	H	α-helix	trans	-62.2	-45.1	-179.7	-167.2	-99.6	0	0	0	112.4	A83 T84 K89 I90 I91	A83-F87 VanDerWaalsContact O-CB 3.31Å; A83-F87 WeakPolarHBondContact O-CB 3.3Å; A83-F87 PolarHBondContact O-N 3.49Å; T84-F87 PolarHBondContact O-N 3.24Å; F87-K89 VanDerWaalsContact C-N 3.34Å; F87-K89 PolarHBondContact O-N 2.99Å; F87-I90 WeakPolarHBondContact O-CB 3.29Å; F87-I90 PolarHBondContact O-N 3.3Å; F87-I91 HydrophobicContact CD1-CD1 3.64Å; F87-I91 HydrophobicContact CD1-CG1 4.38Å; F87-I91 HydrophobicContact CE1-CD1 3.18Å; F87-I91 HydrophobicContact CE1-CG1 4.19Å; F87-I91 HydrophobicContact CZ-CD1 3.82Å; F87-I91 WeakPolarHBondContact O-CG1 3.48Å; F87-I91 PolarHBondContact O-N 3.31Å
88	V	66.2	Low	66.8	Low	4 Å²	4	83.3 Å²	83.3	2%	0.024	44%	0.439	C	S	.	.	H	α-helix	trans	-65.5	-38.1	176.8	168.9	0	0	0	0	111.5	T84 A85 V86 I90 I91 Q92 Y99 L102 L103 I106	T84-V88 HydrophobicContact CG2-CG2 4.41Å; T84-V88 WeakPolarHBondContact O-CB 3.27Å; T84-V88 WeakPolarHBondContact O-CG2 3.29Å; T84-V88 PolarHBondContact O-N 2.72Å; A85-V88 PolarHBondContact O-N 3.33Å; V86-V88 PolarHBondContact O-N 2.91Å; V88-I90 VanDerWaalsContact C-N 3.3Å; V88-I90 PolarHBondContact O-N 3.02Å; V88-I91 PolarHBondContact O-N 2.73Å; V88-Q92 WeakPolarHBondContact O-CB 3.16Å; V88-Q92 PolarHBondContact O-N 3.48Å; V88-Y99 HydrophobicContact CG1-CD1 4.23Å; V88-L102 HydrophobicContact CG1-CD2 4.27Å; V88-L102 HydrophobicContact CG1-CG 4.37Å; V88-L102 HydrophobicContact CG2-CD2 4.09Å; V88-L103 HydrophobicContact CG1-CB 4.22Å; V88-L103 HydrophobicContact CG1-CD1 4.13Å; V88-I106 HydrophobicContact CB-CD1 3.91Å; V88-I106 HydrophobicContact CG1-CD1 4.08Å; V88-I106 HydrophobicContact CG2-CD1 3.49Å; V88-I106 VanDerWaalsContact CG2-CD1 3.49Å
89	K	68.1	Low	66.6	Low	122 Å²	122	83.6 Å²	83.6	53%	0.53	44%	0.438	S	S	.	.	H	α-helix	trans	-63.9	-36.1	174.2	-167.8	175.8	-176.5	178.6	0	112.1	A85 V86 F87 R93 L103	A85-K89 VanDerWaalsContact O-CB 3.29Å; A85-K89 WeakPolarHBondContact O-CB 3.43Å; A85-K89 PolarHBondContact O-N 2.89Å; V86-K89 PolarHBondContact O-N 2.92Å; F87-K89 VanDerWaalsContact C-N 3.34Å; F87-K89 PolarHBondContact O-N 2.99Å; K89-R93 PolarHBondContact O-N 3.29Å; K89-L103 HydrophobicContact CB-CD1 4.17Å
90	I	68.7	Low	66.1	Low	98 Å²	98	80.5 Å²	80.5	50%	0.503	43%	0.427	S	S	.	.	H	α-helix	trans	-66.2	-45.8	174.3	-68.4	164.9	0	0	0	110.4	V86 F87 V88 R93	V86-I90 HydrophobicContact CG1-CD1 3.86Å; V86-I90 VanDerWaalsContact O-CG1 3.29Å; V86-I90 WeakPolarHBondContact O-CG1 3.48Å; V86-I90 PolarHBondContact O-N 3.02Å; F87-I90 WeakPolarHBondContact O-CB 3.29Å; F87-I90 PolarHBondContact O-N 3.3Å; V88-I90 VanDerWaalsContact C-N 3.3Å; V88-I90 PolarHBondContact O-N 3.02Å; I90-R93 WeakPolarHBondContact O-CB 3.42Å; I90-R93 PolarHBondContact O-N 2.97Å
91	I	66.7	Low	65.8	Low	31 Å²	31	82.4 Å²	82.4	16%	0.159	43%	0.431	C	S	.	.	H	α-helix	trans	-68.3	-36	179	-67.3	179.6	0	0	0	112	F87 V88 R93 Q94 N95 Y99	F87-I91 HydrophobicContact CD1-CD1 3.64Å; F87-I91 HydrophobicContact CD1-CG1 4.38Å; F87-I91 HydrophobicContact CE1-CD1 3.18Å; F87-I91 HydrophobicContact CE1-CG1 4.19Å; F87-I91 HydrophobicContact CZ-CD1 3.82Å; F87-I91 WeakPolarHBondContact O-CG1 3.48Å; F87-I91 PolarHBondContact O-N 3.31Å; V88-I91 PolarHBondContact O-N 2.73Å; I91-R93 PolarHBondContact O-N 3.44Å; I91-Q94 WeakPolarHBondContact O-CA 3.38Å; I91-Q94 WeakPolarHBondContact O-CB 3.48Å; I91-Q94 PolarHBondContact O-N 2.96Å; I91-N95 PolarHBondContact O-N 2.84Å; I91-N95 VanDerWaalsContact O-N 3.13Å; I91-Y99 HydrophobicContact CB-CE1 4.41Å; I91-Y99 HydrophobicContact CG2-CD1 4.04Å; I91-Y99 HydrophobicContact CG2-CD2 4.01Å; I91-Y99 HydrophobicContact CG2-CE1 3.59Å; I91-Y99 HydrophobicContact CG2-CE2 3.56Å; I91-Y99 HydrophobicContact CG2-CG 4.23Å
92	Q	65.4	Low	65.7	Low	47 Å²	47	82.9 Å²	82.9	22%	0.22	44%	0.435	C	S	.	.	H	α-helix	trans	-60.4	-30	177.6	-170.2	-171.9	7.4	0	0	112	V88 Q94 N95	V88-Q92 WeakPolarHBondContact O-CB 3.16Å; V88-Q92 PolarHBondContact O-N 3.48Å; Q92-Q94 PolarHBondContact O-N 2.94Å; Q92-N95 CarbonylContact O-C 3.31Å; Q92-N95 VanDerWaalsContact O-C 3.31Å; Q92-N95 PolarHBondContact O-N 3.44Å
93	R	66.4	Low	65.5	Low	219 Å²	219	80.4 Å²	80.4	83%	0.826	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-21.8	172.6	-71.7	-179	171.6	-178.8	-3.3	112.8	K89 I90 I91	K89-R93 PolarHBondContact O-N 3.29Å; I90-R93 WeakPolarHBondContact O-CB 3.42Å; I90-R93 PolarHBondContact O-N 2.97Å; I91-R93 PolarHBondContact O-N 3.44Å
94	Q	65.1	Low	65.5	Low	164 Å²	164	83.2 Å²	83.2	77%	0.766	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-26.3	177.7	-63.6	-170.9	-21.6	0	0	113.3	I91 Q92	I91-Q94 WeakPolarHBondContact O-CA 3.38Å; I91-Q94 WeakPolarHBondContact O-CB 3.48Å; I91-Q94 PolarHBondContact O-N 2.96Å; Q92-Q94 PolarHBondContact O-N 2.94Å
95	N	59.1	Low	65.6	Low	111 Å²	111	84.2 Å²	84.2	59%	0.594	42%	0.424	S	S	*	.	S	Bend	trans	-145	105.3	175.1	-97.8	-34.2	0	0	0	110.6	I91 Q92 Y99	I91-N95 PolarHBondContact O-N 2.84Å; I91-N95 VanDerWaalsContact O-N 3.13Å; Q92-N95 CarbonylContact O-C 3.31Å; Q92-N95 VanDerWaalsContact O-C 3.31Å; Q92-N95 PolarHBondContact O-N 3.44Å; N95-Y99 HydrophobicContact CB-CD2 4Å; N95-Y99 HydrophobicContact CB-CE2 4.04Å; N95-Y99 VanDerWaalsContact O-CD2 3.3Å; N95-Y99 WeakPolarHBondContact O-CD2 3.49Å
96	S	61	Low	65.7	Low	82 Å²	82	83.9 Å²	83.9	57%	0.573	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-33.9	-160.6	55.4	0	0	0	0	115.4
97	T	61	Low	65.6	Low	121 Å²	121	84.8 Å²	84.8	74%	0.742	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-48.9	-167.6	48.6	0	0	0	0	113.6	Y99 A100	T97-Y99 VanDerWaalsContact C-N 3.28Å; T97-Y99 PolarHBondContact O-N 3.42Å; T97-A100 PolarHBondContact O-N 2.88Å
98	L	59.3	Low	65.7	Low	140 Å²	140	84.2 Å²	84.2	73%	0.733	41%	0.414	S	S	*	.	H	α-helix	trans	-66.3	-30.8	-177.5	-154.4	88.7	0	0	0	112.7
99	Y	61.8	Low	65.8	Low	42 Å²	42	86 Å²	86	17%	0.165	42%	0.424	C	S	.	.	H	α-helix	trans	-90.4	-7.7	-174.7	-70.8	-83.8	0	0	0	113.8	V88 I91 N95 T97 L102 L103	V88-Y99 HydrophobicContact CG1-CD1 4.23Å; I91-Y99 HydrophobicContact CB-CE1 4.41Å; I91-Y99 HydrophobicContact CG2-CD1 4.04Å; I91-Y99 HydrophobicContact CG2-CD2 4.01Å; I91-Y99 HydrophobicContact CG2-CE1 3.59Å; I91-Y99 HydrophobicContact CG2-CE2 3.56Å; I91-Y99 HydrophobicContact CG2-CG 4.23Å; N95-Y99 HydrophobicContact CB-CD2 4Å; N95-Y99 HydrophobicContact CB-CE2 4.04Å; N95-Y99 VanDerWaalsContact O-CD2 3.3Å; N95-Y99 WeakPolarHBondContact O-CD2 3.49Å; T97-Y99 VanDerWaalsContact C-N 3.28Å; T97-Y99 PolarHBondContact O-N 3.42Å; Y99-L102 HydrophobicContact CD1-CD2 4Å; Y99-L102 HydrophobicContact CE1-CD2 4.28Å; Y99-L103 VanDerWaalsContact O-CB 3.29Å; Y99-L103 WeakPolarHBondContact O-CB 3.33Å; Y99-L103 PolarHBondContact O-N 3.37Å
100	A	64.2	Low	65.9	Low	34 Å²	34	81 Å²	81	28%	0.281	40%	0.404	S	S	.	.	H	α-helix	trans	-68.4	-46.1	178.5	0	0	0	0	0	112.2	T97 L102 L103 H104	T97-A100 PolarHBondContact O-N 2.88Å; A100-L102 VanDerWaalsContact C-N 3.35Å; A100-L103 PolarHBondContact O-N 3.49Å; A100-H104 PolarHBondContact O-CD2 3.49Å; A100-H104 PolarHBondContact O-N 2.66Å
101	E	65	Low	65.9	Low	127 Å²	127	83.1 Å²	83.1	59%	0.593	41%	0.407	S	S	*	.	H	α-helix	trans	-65.3	-39.1	174.9	-77.4	-168.9	154.5	0	0	111.8	H104 H105	E101-H104 PolarHBondContact O-N 2.93Å; E101-H105 WeakPolarHBondContact O-CB 3.38Å; E101-H105 PolarHBondContact O-N 3.21Å
102	L	66.4	Low	66.1	Low	55 Å²	55	83.1 Å²	83.1	29%	0.288	41%	0.409	S	S	.	.	H	α-helix	trans	-66	-39.3	176.8	-172.1	65.3	0	0	0	111.5	V88 Y99 A100 H105 I106	V88-L102 HydrophobicContact CG1-CD2 4.27Å; V88-L102 HydrophobicContact CG1-CG 4.37Å; V88-L102 HydrophobicContact CG2-CD2 4.09Å; Y99-L102 HydrophobicContact CD1-CD2 4Å; Y99-L102 HydrophobicContact CE1-CD2 4.28Å; A100-L102 VanDerWaalsContact C-N 3.35Å; L102-H105 WeakPolarHBondContact O-CB 3.33Å; L102-H105 PolarHBondContact O-N 2.79Å; L102-I106 HydrophobicContact CD1-CD1 4.32Å; L102-I106 HydrophobicContact CG-CD1 3.9Å; L102-I106 WeakPolarHBondContact O-CB 3.21Å; L102-I106 WeakPolarHBondContact O-CD1 3.29Å; L102-I106 VanDerWaalsContact O-CG1 3.25Å; L102-I106 WeakPolarHBondContact O-CG1 3.28Å; L102-I106 PolarHBondContact O-N 3.2Å
103	L	67.3	Low	66.3	Low	20 Å²	20	81.9 Å²	81.9	11%	0.105	40%	0.404	C	S	.	.	H	α-helix	trans	-65.6	-43.9	175.4	-173.1	72	0	0	0	111.1	V88 K89 Y99 A100 H105 I106 Q107	V88-L103 HydrophobicContact CG1-CB 4.22Å; V88-L103 HydrophobicContact CG1-CD1 4.13Å; K89-L103 HydrophobicContact CB-CD1 4.17Å; Y99-L103 VanDerWaalsContact O-CB 3.29Å; Y99-L103 WeakPolarHBondContact O-CB 3.33Å; Y99-L103 PolarHBondContact O-N 3.37Å; A100-L103 PolarHBondContact O-N 3.49Å; L103-H105 VanDerWaalsContact C-N 3.31Å; L103-H105 PolarHBondContact O-N 2.86Å; L103-I106 PolarHBondContact O-N 2.93Å; L103-Q107 HydrophobicContact CG-CG 4.44Å; L103-Q107 WeakPolarHBondContact O-CB 3.45Å; L103-Q107 WeakPolarHBondContact O-CG 3.4Å; L103-Q107 PolarHBondContact O-N 2.94Å
104	H	69.6	Low	66.5	Low	115 Å²	115	73.7 Å²	73.7	53%	0.532	38%	0.378	S	S	.	.	H	α-helix	trans	-61.3	-39.9	175	-88.7	-54.5	0	0	0	112.3	A100 E101 R108	A100-H104 PolarHBondContact O-CD2 3.49Å; A100-H104 PolarHBondContact O-N 2.66Å; E101-H104 PolarHBondContact O-N 2.93Å; H104-R108 WeakPolarHBondContact O-CG 3.48Å; H104-R108 PolarHBondContact O-N 3.26Å
105	H	71	Confident	66.8	Low	58 Å²	58	67.3 Å²	67.3	27%	0.269	35%	0.35	S	S	.	.	H	α-helix	trans	-58.2	-55.4	172.9	-174.1	66.8	0	0	0	111	E101 L102 L103 Q107 R108 V109 Y158 Y162	E101-H105 WeakPolarHBondContact O-CB 3.38Å; E101-H105 PolarHBondContact O-N 3.21Å; L102-H105 WeakPolarHBondContact O-CB 3.33Å; L102-H105 PolarHBondContact O-N 2.79Å; L103-H105 VanDerWaalsContact C-N 3.31Å; L103-H105 PolarHBondContact O-N 2.86Å; H105-Q107 VanDerWaalsContact C-N 3.34Å; H105-Q107 PolarHBondContact O-N 3.47Å; H105-R108 PolarHBondContact O-N 3.49Å; H105-V109 WeakPolarHBondContact O-CG2 3.33Å; H105-V109 PolarHBondContact O-N 3.48Å; H105-Y158 AromaticContact CE1-CE2 3.59Å; H105-Y158 AromaticContact CE1-CZ 3.65Å; H105-Y158 PolarHBondContact CE1-OH 3.41Å; H105-Y158 AromaticContact ND1-CE2 3.38Å; H105-Y158 WeakPolarHBondContact ND1-CE2 3.37Å; H105-Y158 AromaticContact ND1-CZ 3.57Å; H105-Y158 PolarHBondContact ND1-OH 3.44Å; H105-Y162 WeakPolarHBondContact CA-OH 3.39Å; H105-Y162 WeakPolarHBondContact CB-OH 3.37Å; H105-Y162 PolarHBondContact ND1-OH 2.97Å
106	I	68.4	Low	67.3	Low	13 Å²	13	64.3 Å²	64.3	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-61.9	-41.4	-176.7	-69.5	164.7	0	0	0	111.3	T84 A85 V88 L102 L103 R108 V109 S110	T84-I106 HydrophobicContact CG2-CD1 4.11Å; A85-I106 HydrophobicContact CB-CG2 3.59Å; V88-I106 HydrophobicContact CB-CD1 3.91Å; V88-I106 HydrophobicContact CG1-CD1 4.08Å; V88-I106 HydrophobicContact CG2-CD1 3.49Å; V88-I106 VanDerWaalsContact CG2-CD1 3.49Å; L102-I106 HydrophobicContact CD1-CD1 4.32Å; L102-I106 HydrophobicContact CG-CD1 3.9Å; L102-I106 WeakPolarHBondContact O-CB 3.21Å; L102-I106 WeakPolarHBondContact O-CD1 3.29Å; L102-I106 VanDerWaalsContact O-CG1 3.25Å; L102-I106 WeakPolarHBondContact O-CG1 3.28Å; L102-I106 PolarHBondContact O-N 3.2Å; L103-I106 PolarHBondContact O-N 2.93Å; I106-R108 PolarHBondContact O-N 2.68Å; I106-V109 PolarHBondContact O-N 3.27Å; I106-S110 VanDerWaalsContact O-CB 3.27Å; I106-S110 WeakPolarHBondContact O-CB 3.49Å; I106-S110 PolarHBondContact O-N 2.87Å; I106-S110 PolarHBondContact O-OG 2.93Å
107	Q	69.2	Low	67.7	Low	100 Å²	100	62.9 Å²	62.9	47%	0.467	32%	0.317	S	S	.	.	H	α-helix	trans	-59.4	-44.2	176.7	-79.8	179.2	-18.7	0	0	112.2	L103 H105 S110 Y111	L103-Q107 HydrophobicContact CG-CG 4.44Å; L103-Q107 WeakPolarHBondContact O-CB 3.45Å; L103-Q107 WeakPolarHBondContact O-CG 3.4Å; L103-Q107 PolarHBondContact O-N 2.94Å; H105-Q107 VanDerWaalsContact C-N 3.34Å; H105-Q107 PolarHBondContact O-N 3.47Å; Q107-S110 WeakPolarHBondContact O-CB 3.32Å; Q107-S110 PolarHBondContact O-N 2.91Å; Q107-Y111 PolarHBondContact O-N 3.36Å
108	R	69.1	Low	68.2	Low	66 Å²	66	61.8 Å²	61.8	25%	0.249	31%	0.306	C	S	.	.	H	α-helix	trans	-68.6	-45.7	179.4	-74.2	-179.9	179.9	-161.1	-2	112.5	H104 H105 I106 S110 Y111 T112 L157	H104-R108 WeakPolarHBondContact O-CG 3.48Å; H104-R108 PolarHBondContact O-N 3.26Å; H105-R108 PolarHBondContact O-N 3.49Å; I106-R108 PolarHBondContact O-N 2.68Å; R108-S110 PolarHBondContact O-N 2.85Å; R108-Y111 WeakPolarHBondContact O-CB 3.43Å; R108-Y111 PolarHBondContact O-N 3.26Å; R108-T112 PolarHBondContact O-N 3.47Å; R108-T112 PolarHBondContact O-OG1 2.75Å; R108-L157 PolarHBondContact NH1-O 3.06Å
109	V	69.1	Low	68.8	Low	41 Å²	41	55.5 Å²	55.5	25%	0.248	27%	0.274	C	S	.	.	H	α-helix	trans	-60.9	-39.4	176.5	-178.1	0	0	0	0	110.1	H81 H105 I106 Y111 T112 I113	H81-V109 WeakPolarHBondContact NE2-CG1 3.1Å; H105-V109 WeakPolarHBondContact O-CG2 3.33Å; H105-V109 PolarHBondContact O-N 3.48Å; I106-V109 PolarHBondContact O-N 3.27Å; V109-Y111 VanDerWaalsContact C-N 3.33Å; V109-Y111 PolarHBondContact O-N 3.43Å; V109-T112 PolarHBondContact O-N 3.34Å; V109-I113 HydrophobicContact CG1-CD1 3.8Å; V109-I113 HydrophobicContact CG1-CG1 4.41Å; V109-I113 VanDerWaalsContact O-CG1 3.29Å; V109-I113 WeakPolarHBondContact O-CG1 3.41Å; V109-I113 PolarHBondContact O-N 3.41Å
110	S	69.3	Low	69.2	Low	16 Å²	16	54.9 Å²	54.9	11%	0.112	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-43.3	173.9	-56.8	0	0	0	0	111.4	I106 Q107 R108 T112 I113 T114	I106-S110 VanDerWaalsContact O-CB 3.27Å; I106-S110 WeakPolarHBondContact O-CB 3.49Å; I106-S110 PolarHBondContact O-N 2.87Å; I106-S110 PolarHBondContact O-OG 2.93Å; Q107-S110 WeakPolarHBondContact O-CB 3.32Å; Q107-S110 PolarHBondContact O-N 2.91Å; R108-S110 PolarHBondContact O-N 2.85Å; S110-T112 PolarHBondContact O-N 3.24Å; S110-I113 PolarHBondContact O-N 3.34Å; S110-T114 WeakPolarHBondContact O-CB 3.43Å; S110-T114 PolarHBondContact O-N 3.47Å; S110-T114 PolarHBondContact O-OG1 3.46Å
111	Y	69.4	Low	69.3	Low	143 Å²	143	55.5 Å²	55.5	56%	0.561	27%	0.273	S	S	*	.	H	α-helix	trans	-61.3	-43.7	177.6	-150.2	-86.7	0	0	0	112.4	Q107 R108 V109 T114 T115	Q107-Y111 PolarHBondContact O-N 3.36Å; R108-Y111 WeakPolarHBondContact O-CB 3.43Å; R108-Y111 PolarHBondContact O-N 3.26Å; V109-Y111 VanDerWaalsContact C-N 3.33Å; V109-Y111 PolarHBondContact O-N 3.43Å; Y111-T114 PolarHBondContact O-N 3.04Å; Y111-T115 WeakPolarHBondContact O-CB 3.21Å; Y111-T115 PolarHBondContact O-N 2.88Å; Y111-T115 PolarHBondContact O-OG1 2.89Å
112	T	71.3	Confident	69.5	Low	31 Å²	31	52.1 Å²	52.1	19%	0.19	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-46.8	175.3	-55.1	0	0	0	0	111.4	R108 V109 S110 T115 L116 L151	R108-T112 PolarHBondContact O-N 3.47Å; R108-T112 PolarHBondContact O-OG1 2.75Å; V109-T112 PolarHBondContact O-N 3.34Å; S110-T112 PolarHBondContact O-N 3.24Å; T112-T115 PolarHBondContact O-N 3.48Å; T112-L116 HydrophobicContact CG2-CD1 4.33Å; T112-L116 WeakPolarHBondContact O-CG 3.45Å; T112-L116 PolarHBondContact O-N 2.88Å; T112-L151 HydrophobicContact CG2-CG 4.21Å
113	I	69.4	Low	69.6	Low	22 Å²	22	50.2 Å²	50.2	11%	0.113	25%	0.25	C	S	.	.	H	α-helix	trans	-64.3	-43.7	179	-63.3	162.7	0	0	0	110.8	I74 T77 M78 H81 V109 S110 T115 L116 F117	I74-I113 HydrophobicContact CG2-CG2 4.44Å; T77-I113 HydrophobicContact CG2-CD1 3.81Å; M78-I113 HydrophobicContact CB-CG2 4.33Å; M78-I113 HydrophobicContact CG-CG2 3.6Å; H81-I113 HydrophobicContact CB-CD1 4.38Å; V109-I113 HydrophobicContact CG1-CD1 3.8Å; V109-I113 HydrophobicContact CG1-CG1 4.41Å; V109-I113 VanDerWaalsContact O-CG1 3.29Å; V109-I113 WeakPolarHBondContact O-CG1 3.41Å; V109-I113 PolarHBondContact O-N 3.41Å; S110-I113 PolarHBondContact O-N 3.34Å; I113-T115 VanDerWaalsContact C-N 3.3Å; I113-T115 PolarHBondContact O-N 2.96Å; I113-L116 PolarHBondContact O-N 2.78Å; I113-F117 WeakPolarHBondContact O-CB 3.46Å; I113-F117 PolarHBondContact O-N 3.28Å
114	T	70	Confident	69.5	Low	47 Å²	47	50.4 Å²	50.4	29%	0.288	25%	0.25	S	C	.	.	H	α-helix	trans	-61.6	-39.8	176.9	-59.6	0	0	0	0	111.6	M78 S110 Y111 F117 L118	M78-T114 WeakPolarHBondContact CE-OG1 3.18Å; M78-T114 HydrophobicContact SD-CG2 4.4Å; M78-T114 PolarHBondContact SD-OG1 2.9Å; M78-T114 VanDerWaalsContact SD-OG1 3.38Å; S110-T114 WeakPolarHBondContact O-CB 3.43Å; S110-T114 PolarHBondContact O-N 3.47Å; S110-T114 PolarHBondContact O-OG1 3.46Å; Y111-T114 PolarHBondContact O-N 3.04Å; T114-F117 PolarHBondContact O-N 2.93Å; T114-L118 HydrophobicContact CG2-CD1 4.08Å; T114-L118 HydrophobicContact CG2-CG 4.5Å; T114-L118 WeakPolarHBondContact O-CG 3.37Å; T114-L118 PolarHBondContact O-N 3.48Å
115	T	71.9	Confident	69.3	Low	29 Å²	29	50 Å²	50	18%	0.178	25%	0.25	C	S	.	.	H	α-helix	trans	-66.2	-43.6	178.5	-49.5	0	0	0	0	111	Y111 T112 I113 L118 T119 N150	Y111-T115 WeakPolarHBondContact O-CB 3.21Å; Y111-T115 PolarHBondContact O-N 2.88Å; Y111-T115 PolarHBondContact O-OG1 2.89Å; T112-T115 PolarHBondContact O-N 3.48Å; I113-T115 VanDerWaalsContact C-N 3.3Å; I113-T115 PolarHBondContact O-N 2.96Å; T115-L118 PolarHBondContact O-N 3.22Å; T115-T119 WeakPolarHBondContact O-CB 3.34Å; T115-T119 PolarHBondContact O-N 3.46Å; T115-T119 PolarHBondContact O-OG1 2.85Å; T115-N150 VanDerWaalsContact CB-ND2 3.3Å; T115-N150 WeakPolarHBondContact CB-ND2 3.33Å; T115-N150 HydrophobicContact CG2-CB 4.2Å; T115-N150 WeakPolarHBondContact CG2-ND2 3.41Å; T115-N150 PolarHBondContact OG1-ND2 3.43Å
116	L	69.7	Low	69.1	Low	49 Å²	49	48 Å²	48	26%	0.257	24%	0.242	S	C	.	.	H	α-helix	trans	-60.9	-45.2	174	-75.5	169	0	0	0	111.4	T112 I113 T119 F120 L151	T112-L116 HydrophobicContact CG2-CD1 4.33Å; T112-L116 WeakPolarHBondContact O-CG 3.45Å; T112-L116 PolarHBondContact O-N 2.88Å; I113-L116 PolarHBondContact O-N 2.78Å; L116-T119 PolarHBondContact O-N 2.68Å; L116-F120 WeakPolarHBondContact O-CD2 3.33Å; L116-F120 PolarHBondContact O-N 2.96Å; L116-L151 HydrophobicContact CD1-CD1 4.4Å; L116-L151 HydrophobicContact CD2-CD1 3.88Å; L116-L151 HydrophobicContact CG-CD1 4.28Å
117	F	70	Confident	68.8	Low	52 Å²	52	49.5 Å²	49.5	23%	0.228	25%	0.249	C	C	.	.	H	α-helix	trans	-58.3	-49.5	176.4	177.4	-108.4	0	0	0	112.1	L71 I74 I75 I113 T114 T119 F120 T121	L71-F117 HydrophobicContact CD1-CE2 4.38Å; I74-F117 HydrophobicContact CG2-CB 3.56Å; I74-F117 HydrophobicContact CG2-CD2 3.76Å; I74-F117 HydrophobicContact CG2-CG 4.12Å; I75-F117 HydrophobicContact CD1-CE2 3.99Å; I75-F117 HydrophobicContact CG1-CD2 3.99Å; I75-F117 HydrophobicContact CG1-CE2 3.35Å; I75-F117 HydrophobicContact CG1-CZ 4.16Å; I113-F117 WeakPolarHBondContact O-CB 3.46Å; I113-F117 PolarHBondContact O-N 3.28Å; T114-F117 PolarHBondContact O-N 2.93Å; F117-T119 VanDerWaalsContact C-N 3.33Å; F117-T119 PolarHBondContact O-N 3.35Å; F117-F120 PolarHBondContact O-N 3.31Å; F117-T121 WeakPolarHBondContact CE2-OG1 3.23Å; F117-T121 WeakPolarHBondContact CZ-OG1 3.4Å; F117-T121 WeakPolarHBondContact O-CB 3.33Å; F117-T121 PolarHBondContact O-N 3.38Å; F117-T121 PolarHBondContact O-OG1 3.42Å
118	L	71.5	Confident	68.5	Low	97 Å²	97	51 Å²	51	51%	0.508	26%	0.259	S	S	.	.	H	α-helix	trans	-61.5	-43.5	177.9	-75	169	0	0	0	111	T114 T115 F120 T121 T122	T114-L118 HydrophobicContact CG2-CD1 4.08Å; T114-L118 HydrophobicContact CG2-CG 4.5Å; T114-L118 WeakPolarHBondContact O-CG 3.37Å; T114-L118 PolarHBondContact O-N 3.48Å; T115-L118 PolarHBondContact O-N 3.22Å; L118-F120 PolarHBondContact O-N 3.42Å; L118-T121 PolarHBondContact O-N 3.16Å; L118-T122 VanDerWaalsContact O-CB 3.28Å; L118-T122 WeakPolarHBondContact O-CB 3.49Å; L118-T122 PolarHBondContact O-N 2.84Å; L118-T122 PolarHBondContact O-OG1 3.39Å
119	T	71.5	Confident	68.1	Low	8 Å²	8	52.3 Å²	52.3	5%	0.049	27%	0.27	C	S	.	.	H	α-helix	trans	-57.4	-51.9	178.2	-50.3	0	0	0	0	111	T115 L116 F117 E123 L143 S147	T115-T119 WeakPolarHBondContact O-CB 3.34Å; T115-T119 PolarHBondContact O-N 3.46Å; T115-T119 PolarHBondContact O-OG1 2.85Å; L116-T119 PolarHBondContact O-N 2.68Å; F117-T119 VanDerWaalsContact C-N 3.33Å; F117-T119 PolarHBondContact O-N 3.35Å; T119-E123 WeakPolarHBondContact O-CB 3.26Å; T119-E123 PolarHBondContact O-N 2.88Å; T119-L143 HydrophobicContact CG2-CB 4.11Å; T119-S147 WeakPolarHBondContact OG1-CB 3.25Å; T119-S147 PolarHBondContact OG1-OG 3.35Å
120	F	68.9	Low	67.8	Low	29 Å²	29	59.9 Å²	59.9	13%	0.127	30%	0.303	C	S	.	.	H	α-helix	trans	-62.7	-46	179.2	-95	-87	0	0	0	112.2	L71 I74 L116 F117 L118 E123 R124 W144	L71-F120 HydrophobicContact CD1-CB 3.94Å; I74-F120 HydrophobicContact CD1-CD2 3.78Å; I74-F120 HydrophobicContact CD1-CE2 4.03Å; I74-F120 HydrophobicContact CD1-CG 4.22Å; L116-F120 WeakPolarHBondContact O-CD2 3.33Å; L116-F120 PolarHBondContact O-N 2.96Å; F117-F120 PolarHBondContact O-N 3.31Å; L118-F120 PolarHBondContact O-N 3.42Å; F120-E123 PolarHBondContact O-N 3.21Å; F120-R124 WeakPolarHBondContact O-CG 3.31Å; F120-R124 PolarHBondContact O-N 2.89Å; F120-W144 HydrophobicContact CD2-CH2 4.34Å; F120-W144 HydrophobicContact CE1-CH2 4.33Å; F120-W144 HydrophobicContact CE1-CZ2 4.37Å; F120-W144 AromaticContact CE2-CH2 3.6Å; F120-W144 HydrophobicContact CE2-CH2 3.6Å; F120-W144 HydrophobicContact CE2-CZ2 4.27Å; F120-W144 HydrophobicContact CE2-CZ3 4.42Å; F120-W144 AromaticContact CZ-CH2 3.6Å; F120-W144 HydrophobicContact CZ-CH2 3.6Å; F120-W144 HydrophobicContact CZ-CZ2 4.08Å
121	T	68	Low	67.6	Low	48 Å²	48	61.2 Å²	61.2	29%	0.294	31%	0.31	S	S	.	.	H	α-helix	trans	-67.2	-40.9	-177.6	-39.9	0	0	0	0	111.3	F117 L118 R124 L125	F117-T121 WeakPolarHBondContact CE2-OG1 3.23Å; F117-T121 WeakPolarHBondContact CZ-OG1 3.4Å; F117-T121 WeakPolarHBondContact O-CB 3.33Å; F117-T121 PolarHBondContact O-N 3.38Å; F117-T121 PolarHBondContact O-OG1 3.42Å; L118-T121 PolarHBondContact O-N 3.16Å; T121-R124 PolarHBondContact O-N 3.43Å; T121-L125 WeakPolarHBondContact O-CB 3.32Å; T121-L125 PolarHBondContact O-N 3.47Å
122	T	68.7	Low	67.5	Low	55 Å²	55	59 Å²	59	34%	0.337	31%	0.313	S	S	.	.	H	α-helix	trans	-67.8	-41.5	176.9	-55.8	0	0	0	0	111.4	L118 R124 L125 I126 L143	L118-T122 VanDerWaalsContact O-CB 3.28Å; L118-T122 WeakPolarHBondContact O-CB 3.49Å; L118-T122 PolarHBondContact O-N 2.84Å; L118-T122 PolarHBondContact O-OG1 3.39Å; T122-R124 VanDerWaalsContact C-N 3.33Å; T122-R124 PolarHBondContact O-N 2.94Å; T122-L125 PolarHBondContact O-N 3.5Å; T122-I126 HydrophobicContact CG2-CD1 3.89Å; T122-I126 HydrophobicContact CG2-CG1 4.5Å; T122-I126 WeakPolarHBondContact O-CD1 3.3Å; T122-I126 VanDerWaalsContact O-CG1 3.28Å; T122-I126 WeakPolarHBondContact O-CG1 3.4Å; T122-I126 PolarHBondContact O-N 3.46Å; T122-L143 HydrophobicContact CG2-CD1 3.7Å; T122-L143 HydrophobicContact CG2-CD2 4.09Å
123	E	67.3	Low	67.1	Low	16 Å²	16	59.7 Å²	59.7	8%	0.075	32%	0.316	C	S	.	.	H	α-helix	trans	-57.5	-46.9	173.1	-174.1	-161.9	-133.6	0	0	110.9	T119 F120 L125 I126 Q127 A140 W144	T119-E123 WeakPolarHBondContact O-CB 3.26Å; T119-E123 PolarHBondContact O-N 2.88Å; F120-E123 PolarHBondContact O-N 3.21Å; E123-L125 PolarHBondContact O-N 2.93Å; E123-I126 PolarHBondContact O-N 2.9Å; E123-Q127 WeakPolarHBondContact O-CG 3.3Å; E123-Q127 PolarHBondContact O-N 3.49Å; E123-A140 HydrophobicContact CG-CB 4.26Å; E123-W144 PolarHBondContact OE1-NE1 2.99Å
124	R	66.6	Low	66.8	Low	24 Å²	24	61.8 Å²	61.8	9%	0.091	34%	0.336	C	S	.	.	H	α-helix	trans	-61	-44	175.9	-72.3	-56.1	108.5	169.8	4.6	112.2	L54 Y63 Y67 F120 T121 T122 I126 Q127 L128	L54-R124 VanDerWaalsContact CD2-NH1 3.29Å; Y63-R124 PolarHBondContact OH-NH1 3.47Å; Y67-R124 VanDerWaalsContact CG-CZ 3.42Å; F120-R124 WeakPolarHBondContact O-CG 3.31Å; F120-R124 PolarHBondContact O-N 2.89Å; T121-R124 PolarHBondContact O-N 3.43Å; T122-R124 VanDerWaalsContact C-N 3.33Å; T122-R124 PolarHBondContact O-N 2.94Å; R124-I126 VanDerWaalsContact C-N 3.28Å; R124-I126 PolarHBondContact O-N 2.93Å; R124-Q127 PolarHBondContact O-N 2.98Å; R124-L128 WeakPolarHBondContact O-CG 3.31Å; R124-L128 PolarHBondContact O-N 3.25Å
125	L	65.5	Low	66.6	Low	105 Å²	105	66.1 Å²	66.1	55%	0.55	35%	0.348	S	S	.	.	H	α-helix	trans	-60.2	-42.9	179.2	-155	86.9	0	0	0	110.6	T121 T122 E123 Q127 L128 L129	T121-L125 WeakPolarHBondContact O-CB 3.32Å; T121-L125 PolarHBondContact O-N 3.47Å; T122-L125 PolarHBondContact O-N 3.5Å; E123-L125 PolarHBondContact O-N 2.93Å; L125-Q127 VanDerWaalsContact C-N 3.34Å; L125-Q127 PolarHBondContact O-N 3.37Å; L125-L128 PolarHBondContact O-N 3.33Å; L125-L129 VanDerWaalsContact O-CG 3.27Å; L125-L129 WeakPolarHBondContact O-CG 3.24Å; L125-L129 PolarHBondContact O-N 2.64Å
126	I	65.6	Low	66.2	Low	17 Å²	17	67.1 Å²	67.1	9%	0.087	35%	0.349	C	S	.	.	H	α-helix	trans	-64	-39.6	176.8	-69.1	158.8	0	0	0	111.5	T122 E123 R124 L128 L129 R136 V139 L143	T122-I126 HydrophobicContact CG2-CD1 3.89Å; T122-I126 HydrophobicContact CG2-CG1 4.5Å; T122-I126 WeakPolarHBondContact O-CD1 3.3Å; T122-I126 VanDerWaalsContact O-CG1 3.28Å; T122-I126 WeakPolarHBondContact O-CG1 3.4Å; T122-I126 PolarHBondContact O-N 3.46Å; E123-I126 PolarHBondContact O-N 2.9Å; R124-I126 VanDerWaalsContact C-N 3.28Å; R124-I126 PolarHBondContact O-N 2.93Å; I126-L128 VanDerWaalsContact C-N 3.28Å; I126-L128 PolarHBondContact O-N 3.27Å; I126-L129 PolarHBondContact O-N 3.24Å; I126-R136 HydrophobicContact CG2-CB 4.04Å; I126-R136 HydrophobicContact CG2-CG 3.79Å; I126-R136 WeakPolarHBondContact O-CD 3.37Å; I126-V139 HydrophobicContact CD1-CB 4.03Å; I126-V139 HydrophobicContact CD1-CG1 3.28Å; I126-V139 HydrophobicContact CG1-CG1 4.41Å; I126-L143 HydrophobicContact CD1-CD1 3.5Å
127	Q	62.7	Low	65.9	Low	45 Å²	45	69.5 Å²	69.5	21%	0.21	36%	0.359	C	S	.	.	H	α-helix	trans	-64.8	-32.9	176	-72.5	178	0.6	0	0	112.6	E123 R124 L125 R136	E123-Q127 WeakPolarHBondContact O-CG 3.3Å; E123-Q127 PolarHBondContact O-N 3.49Å; R124-Q127 PolarHBondContact O-N 2.98Å; L125-Q127 VanDerWaalsContact C-N 3.34Å; L125-Q127 PolarHBondContact O-N 3.37Å; Q127-R136 PolarHBondContact O-NH1 2.92Å
128	L	62.8	Low	65.7	Low	132 Å²	132	71 Å²	71	69%	0.691	37%	0.372	S	S	*	.	H	α-helix	trans	-77.5	-22.5	176.5	-68.9	168.9	0	0	0	113.4	R124 L125 I126	R124-L128 WeakPolarHBondContact O-CG 3.31Å; R124-L128 PolarHBondContact O-N 3.25Å; L125-L128 PolarHBondContact O-N 3.33Å; I126-L128 VanDerWaalsContact C-N 3.28Å; I126-L128 PolarHBondContact O-N 3.27Å
129	L	61.7	Low	65.5	Low	92 Å²	92	67.7 Å²	67.7	48%	0.482	36%	0.356	S	S	.	.	S	Bend	trans	-76.3	136.6	177.5	-70.6	165	0	0	0	110.4	L125 I126 V131	L125-L129 VanDerWaalsContact O-CG 3.27Å; L125-L129 WeakPolarHBondContact O-CG 3.24Å; L125-L129 PolarHBondContact O-N 2.64Å; I126-L129 PolarHBondContact O-N 3.24Å; L129-V131 HydrophobicContact CB-CG2 3.69Å; L129-V131 WeakPolarHBondContact O-CG2 3.26Å; L129-V131 PolarHBondContact O-N 3.46Å
130	H	61.8	Low	65.3	Low	201 Å²	201	68.1 Å²	68.1	93%	0.931	36%	0.36	S	S	*	.			trans	-74.8	66.4	172.9	-90	72.8	0	0	0	110.7
131	V	65.4	Low	65.1	Low	43 Å²	43	70.6 Å²	70.6	26%	0.261	38%	0.378	S	S	.	.			trans	-106.4	150.8	174.6	-106	0	0	0	0	110.4	L129 D133 Y135 R136	L129-V131 HydrophobicContact CB-CG2 3.69Å; L129-V131 WeakPolarHBondContact O-CG2 3.26Å; L129-V131 PolarHBondContact O-N 3.46Å; V131-D133 PolarHBondContact O-N 3.37Å; V131-Y135 HydrophobicContact CB-CD1 4.09Å; V131-Y135 HydrophobicContact CG1-CD1 3.93Å; V131-Y135 HydrophobicContact CG1-CE1 4.36Å; V131-Y135 HydrophobicContact CG2-CD1 4.42Å; V131-R136 HydrophobicContact CB-CG 4.33Å; V131-R136 HydrophobicContact CG2-CG 3.77Å; V131-R136 PolarHBondContact O-NE 2.85Å; V131-R136 VanDerWaalsContact O-NE 3.14Å
132	P	67.6	Low	65.1	Low	96 Å²	96	73.3 Å²	73.3	62%	0.623	39%	0.388	S	S	*	.			trans	-52.6	138.1	176.6	-23.8	32.9	0	0	0	111.4	A134 Y135 R136	P132-A134 VanDerWaalsContact C-N 3.29Å; P132-A134 PolarHBondContact O-N 2.84Å; P132-Y135 WeakPolarHBondContact O-CA 3.43Å; P132-Y135 VanDerWaalsContact O-CB 3.27Å; P132-Y135 WeakPolarHBondContact O-CB 3.1Å; P132-Y135 PolarHBondContact O-N 3.41Å; P132-R136 PolarHBondContact O-N 3.44Å
133	D	62.7	Low	65.3	Low	46 Å²	46	72.3 Å²	72.3	25%	0.246	38%	0.381	C	S	.	.	H	α-helix	trans	-55.2	-41.1	-172.7	-68.4	-27.5	0	0	0	114.2	A50 R51 V131 Y135 R136 E137	A50-D133 HydrophobicContact CB-CB 4.09Å; A50-D133 VanDerWaalsContact O-CB 3.28Å; A50-D133 WeakPolarHBondContact O-CB 3.24Å; R51-D133 WeakPolarHBondContact CA-OD2 3.28Å; V131-D133 PolarHBondContact O-N 3.37Å; D133-Y135 PolarHBondContact O-N 3.43Å; D133-R136 WeakPolarHBondContact O-CB 3.32Å; D133-R136 PolarHBondContact O-N 2.88Å; D133-R136 IonicContact OD1-CZ 3.44Å; D133-R136 IonicContact OD1-NE 3.45Å; D133-R136 PolarHBondContact OD1-NE 2.98Å; D133-R136 IonicContact OD1-NH2 2.69Å; D133-R136 PolarHBondContact OD1-NH2 3.42Å; D133-E137 PolarHBondContact O-N 2.92Å
134	A	63.8	Low	65.5	Low	67 Å²	67	76.5 Å²	76.5	55%	0.554	40%	0.396	S	S	*	.	H	α-helix	trans	-59	-35.6	176	0	0	0	0	0	112.3	P132 V138	P132-A134 VanDerWaalsContact C-N 3.29Å; P132-A134 PolarHBondContact O-N 2.84Å; A134-V138 VanDerWaalsContact O-CG2 3.24Å; A134-V138 WeakPolarHBondContact O-CG2 3.4Å; A134-V138 PolarHBondContact O-N 2.87Å; A134-V138 VanDerWaalsContact O-N 3.17Å
135	Y	65.4	Low	65.7	Low	137 Å²	137	79 Å²	79	54%	0.537	41%	0.414	S	S	.	.	H	α-helix	trans	-70.2	-40.6	176.1	-172.3	-98.1	0	0	0	111.1	V131 P132 D133 E137 V138 V139	V131-Y135 HydrophobicContact CB-CD1 4.09Å; V131-Y135 HydrophobicContact CG1-CD1 3.93Å; V131-Y135 HydrophobicContact CG1-CE1 4.36Å; V131-Y135 HydrophobicContact CG2-CD1 4.42Å; P132-Y135 WeakPolarHBondContact O-CA 3.43Å; P132-Y135 VanDerWaalsContact O-CB 3.27Å; P132-Y135 WeakPolarHBondContact O-CB 3.1Å; P132-Y135 PolarHBondContact O-N 3.41Å; D133-Y135 PolarHBondContact O-N 3.43Å; Y135-E137 PolarHBondContact O-N 2.88Å; Y135-V138 PolarHBondContact O-N 3.43Å; Y135-V139 HydrophobicContact CD1-CG2 3.99Å; Y135-V139 HydrophobicContact CD2-CG2 4.34Å; Y135-V139 HydrophobicContact CE1-CG2 3.64Å; Y135-V139 HydrophobicContact CE2-CG2 4.01Å; Y135-V139 HydrophobicContact CG-CG2 4.34Å; Y135-V139 VanDerWaalsContact O-CG2 3.26Å; Y135-V139 WeakPolarHBondContact O-CG2 3.41Å; Y135-V139 PolarHBondContact O-N 2.89Å
136	R	63.8	Low	65.9	Low	50 Å²	50	80.3 Å²	80.3	19%	0.189	42%	0.415	C	S	.	.	H	α-helix	trans	-60.4	-45.9	177.2	-68.3	-166.8	-92.1	-166.7	-2.6	111.6	I126 Q127 V131 P132 D133 A140	I126-R136 HydrophobicContact CG2-CB 4.04Å; I126-R136 HydrophobicContact CG2-CG 3.79Å; I126-R136 WeakPolarHBondContact O-CD 3.37Å; Q127-R136 PolarHBondContact O-NH1 2.92Å; V131-R136 HydrophobicContact CB-CG 4.33Å; V131-R136 HydrophobicContact CG2-CG 3.77Å; V131-R136 PolarHBondContact O-NE 2.85Å; V131-R136 VanDerWaalsContact O-NE 3.14Å; P132-R136 PolarHBondContact O-N 3.44Å; D133-R136 WeakPolarHBondContact O-CB 3.32Å; D133-R136 PolarHBondContact O-N 2.88Å; D133-R136 IonicContact OD1-CZ 3.44Å; D133-R136 IonicContact OD1-NE 3.45Å; D133-R136 PolarHBondContact OD1-NE 2.98Å; D133-R136 IonicContact OD1-NH2 2.69Å; D133-R136 PolarHBondContact OD1-NH2 3.42Å; R136-A140 VanDerWaalsContact O-CB 3.24Å; R136-A140 WeakPolarHBondContact O-CB 3.33Å; R136-A140 PolarHBondContact O-N 3.34Å
137	E	62.1	Low	66.2	Low	99 Å²	99	79.7 Å²	79.7	46%	0.463	41%	0.412	S	S	.	.	H	α-helix	trans	-65.7	-44.1	-179.7	-168.4	177.4	-163.8	0	0	112.4	A50 D133 Y135 A140 T141	A50-E137 HydrophobicContact CB-CB 4.38Å; A50-E137 WeakPolarHBondContact CB-OE2 3.38Å; D133-E137 PolarHBondContact O-N 2.92Å; Y135-E137 PolarHBondContact O-N 2.88Å; E137-A140 PolarHBondContact O-N 3.02Å; E137-T141 WeakPolarHBondContact O-CB 3.27Å; E137-T141 PolarHBondContact O-N 2.9Å; E137-T141 PolarHBondContact O-OG1 3.44Å
138	V	65.5	Low	66.4	Low	83 Å²	83	79.2 Å²	79.2	50%	0.503	42%	0.42	S	S	.	.	H	α-helix	trans	-63.4	-46.7	178.3	171.5	0	0	0	0	111.1	A134 Y135 T141 M142	A134-V138 VanDerWaalsContact O-CG2 3.24Å; A134-V138 WeakPolarHBondContact O-CG2 3.4Å; A134-V138 PolarHBondContact O-N 2.87Å; A134-V138 VanDerWaalsContact O-N 3.17Å; Y135-V138 PolarHBondContact O-N 3.43Å; V138-T141 PolarHBondContact O-N 3.17Å; V138-M142 HydrophobicContact CG1-SD 4.4Å; V138-M142 WeakPolarHBondContact O-CB 3.48Å; V138-M142 WeakPolarHBondContact O-CG 3.44Å; V138-M142 PolarHBondContact O-N 3.01Å
139	V	67.6	Low	66.8	Low	29 Å²	29	77.4 Å²	77.4	18%	0.176	41%	0.41	C	S	.	.	H	α-helix	trans	-69.1	-39.1	-178.8	-175.7	0	0	0	0	111.2	I126 Y135 M142 L143	I126-V139 HydrophobicContact CD1-CB 4.03Å; I126-V139 HydrophobicContact CD1-CG1 3.28Å; I126-V139 HydrophobicContact CG1-CG1 4.41Å; Y135-V139 HydrophobicContact CD1-CG2 3.99Å; Y135-V139 HydrophobicContact CD2-CG2 4.34Å; Y135-V139 HydrophobicContact CE1-CG2 3.64Å; Y135-V139 HydrophobicContact CE2-CG2 4.01Å; Y135-V139 HydrophobicContact CG-CG2 4.34Å; Y135-V139 VanDerWaalsContact O-CG2 3.26Å; Y135-V139 WeakPolarHBondContact O-CG2 3.41Å; Y135-V139 PolarHBondContact O-N 2.89Å; V139-M142 PolarHBondContact O-N 2.95Å; V139-L143 HydrophobicContact CG1-CD1 4.12Å; V139-L143 HydrophobicContact CG1-CG 4.43Å; V139-L143 WeakPolarHBondContact O-CB 3.42Å; V139-L143 WeakPolarHBondContact O-CG 3.32Å; V139-L143 PolarHBondContact O-N 3.36Å
140	A	66.7	Low	67.2	Low	17 Å²	17	74.5 Å²	74.5	14%	0.14	40%	0.395	C	S	.	.	H	α-helix	trans	-59.9	-46.9	173.1	0	0	0	0	0	111.1	E123 R136 E137 M142 L143 W144	E123-A140 HydrophobicContact CG-CB 4.26Å; R136-A140 VanDerWaalsContact O-CB 3.24Å; R136-A140 WeakPolarHBondContact O-CB 3.33Å; R136-A140 PolarHBondContact O-N 3.34Å; E137-A140 PolarHBondContact O-N 3.02Å; A140-M142 VanDerWaalsContact C-N 3.34Å; A140-M142 PolarHBondContact O-N 2.84Å; A140-L143 WeakPolarHBondContact O-CB 3.32Å; A140-L143 PolarHBondContact O-N 3.48Å; A140-W144 PolarHBondContact O-N 2.94Å
141	T	66.6	Low	67.7	Low	80 Å²	80	68.3 Å²	68.3	49%	0.491	37%	0.368	S	S	.	.	H	α-helix	trans	-60.6	-42.9	177.6	-56.8	0	0	0	0	111.6	E137 V138 W144 T145	E137-T141 WeakPolarHBondContact O-CB 3.27Å; E137-T141 PolarHBondContact O-N 2.9Å; E137-T141 PolarHBondContact O-OG1 3.44Å; V138-T141 PolarHBondContact O-N 3.17Å; T141-W144 PolarHBondContact O-N 2.74Å; T141-T145 WeakPolarHBondContact O-CB 3.36Å; T141-T145 PolarHBondContact O-N 3.46Å; T141-T145 PolarHBondContact O-OG1 2.63Å
142	M	67.8	Low	67.9	Low	105 Å²	105	69.7 Å²	69.7	52%	0.517	38%	0.38	S	S	.	.	H	α-helix	trans	-61.5	-46.9	175.1	-80.2	-175.2	150.7	0	0	111.8	V138 V139 A140 W144 T145 F146	V138-M142 HydrophobicContact CG1-SD 4.4Å; V138-M142 WeakPolarHBondContact O-CB 3.48Å; V138-M142 WeakPolarHBondContact O-CG 3.44Å; V138-M142 PolarHBondContact O-N 3.01Å; V139-M142 PolarHBondContact O-N 2.95Å; A140-M142 VanDerWaalsContact C-N 3.34Å; A140-M142 PolarHBondContact O-N 2.84Å; M142-W144 PolarHBondContact O-N 2.9Å; M142-T145 PolarHBondContact O-N 3.39Å; M142-F146 HydrophobicContact CB-CD2 4.43Å; M142-F146 HydrophobicContact CB-CE2 4.18Å; M142-F146 WeakPolarHBondContact O-CD2 3.27Å; M142-F146 WeakPolarHBondContact O-CG 3.3Å; M142-F146 PolarHBondContact O-N 2.94Å
143	L	71.1	Confident	68.1	Low	34 Å²	34	69.7 Å²	69.7	18%	0.178	37%	0.374	C	S	.	.	H	α-helix	trans	-57.9	-48.5	178	-79.3	166.5	0	0	0	111.5	T119 T122 I126 V139 A140 T145 F146 S147	T119-L143 HydrophobicContact CG2-CB 4.11Å; T122-L143 HydrophobicContact CG2-CD1 3.7Å; T122-L143 HydrophobicContact CG2-CD2 4.09Å; I126-L143 HydrophobicContact CD1-CD1 3.5Å; V139-L143 HydrophobicContact CG1-CD1 4.12Å; V139-L143 HydrophobicContact CG1-CG 4.43Å; V139-L143 WeakPolarHBondContact O-CB 3.42Å; V139-L143 WeakPolarHBondContact O-CG 3.32Å; V139-L143 PolarHBondContact O-N 3.36Å; A140-L143 WeakPolarHBondContact O-CB 3.32Å; A140-L143 PolarHBondContact O-N 3.48Å; L143-T145 PolarHBondContact O-N 3.45Å; L143-F146 PolarHBondContact O-N 2.88Å; L143-S147 WeakPolarHBondContact O-CB 3.39Å; L143-S147 PolarHBondContact O-N 3.3Å
144	W	73.1	Confident	68.5	Low	105 Å²	105	68.8 Å²	68.8	40%	0.398	37%	0.368	S	S	.	.	H	α-helix	trans	-64	-40	177.3	-79.5	107.9	0	0	0	112.6	F120 E123 A140 T141 M142 S147 G148	F120-W144 HydrophobicContact CD2-CH2 4.34Å; F120-W144 HydrophobicContact CE1-CH2 4.33Å; F120-W144 HydrophobicContact CE1-CZ2 4.37Å; F120-W144 AromaticContact CE2-CH2 3.6Å; F120-W144 HydrophobicContact CE2-CH2 3.6Å; F120-W144 HydrophobicContact CE2-CZ2 4.27Å; F120-W144 HydrophobicContact CE2-CZ3 4.42Å; F120-W144 AromaticContact CZ-CH2 3.6Å; F120-W144 HydrophobicContact CZ-CH2 3.6Å; F120-W144 HydrophobicContact CZ-CZ2 4.08Å; E123-W144 PolarHBondContact OE1-NE1 2.99Å; A140-W144 PolarHBondContact O-N 2.94Å; T141-W144 PolarHBondContact O-N 2.74Å; M142-W144 PolarHBondContact O-N 2.9Å; W144-S147 PolarHBondContact O-N 2.94Å; W144-G148 PolarHBondContact O-N 2.95Å
145	T	70.7	Confident	68.8	Low	75 Å²	75	68.7 Å²	68.7	46%	0.46	36%	0.364	S	S	.	.	H	α-helix	trans	-62.1	-47.4	176.6	-58	0	0	0	0	111.1	T141 M142 L143 S147 G148 L149	T141-T145 WeakPolarHBondContact O-CB 3.36Å; T141-T145 PolarHBondContact O-N 3.46Å; T141-T145 PolarHBondContact O-OG1 2.63Å; M142-T145 PolarHBondContact O-N 3.39Å; L143-T145 PolarHBondContact O-N 3.45Å; T145-S147 VanDerWaalsContact C-N 3.34Å; T145-S147 PolarHBondContact O-N 3.31Å; T145-G148 PolarHBondContact O-N 3.44Å; T145-L149 HydrophobicContact CG2-CD1 4.24Å; T145-L149 WeakPolarHBondContact O-CB 3.49Å; T145-L149 WeakPolarHBondContact O-CG 3.24Å; T145-L149 PolarHBondContact O-N 2.73Å
146	F	70.3	Confident	68.9	Low	133 Å²	133	68.4 Å²	68.4	58%	0.583	37%	0.369	S	S	*	.	H	α-helix	trans	-66	-37.1	177	-69	-48.4	0	0	0	112.4	M142 L143 L149 N150	M142-F146 HydrophobicContact CB-CD2 4.43Å; M142-F146 HydrophobicContact CB-CE2 4.18Å; M142-F146 WeakPolarHBondContact O-CD2 3.27Å; M142-F146 WeakPolarHBondContact O-CG 3.3Å; M142-F146 PolarHBondContact O-N 2.94Å; L143-F146 PolarHBondContact O-N 2.88Å; F146-L149 HydrophobicContact CD1-CD1 4.38Å; F146-L149 PolarHBondContact O-N 3.04Å; F146-N150 WeakPolarHBondContact O-CB 3.23Å; F146-N150 PolarHBondContact O-N 3.39Å
147	S	71.5	Confident	69.2	Low	4 Å²	4	69.5 Å²	69.5	3%	0.028	38%	0.378	C	S	.	.	H	α-helix	trans	-63.1	-44.9	174.8	-156	0	0	0	0	111.5	T119 L143 W144 T145 N150 L151	T119-S147 WeakPolarHBondContact OG1-CB 3.25Å; T119-S147 PolarHBondContact OG1-OG 3.35Å; L143-S147 WeakPolarHBondContact O-CB 3.39Å; L143-S147 PolarHBondContact O-N 3.3Å; W144-S147 PolarHBondContact O-N 2.94Å; T145-S147 VanDerWaalsContact C-N 3.34Å; T145-S147 PolarHBondContact O-N 3.31Å; S147-N150 PolarHBondContact O-N 3.29Å; S147-L151 PolarHBondContact O-N 3.08Å
148	G	66.5	Low	69.4	Low	35 Å²	35	68.2 Å²	68.2	36%	0.361	37%	0.369	S	S	.	.	H	α-helix	trans	-64.2	-41.1	176.3	0	0	0	0	0	113.3	W144 T145 L151 S152	W144-G148 PolarHBondContact O-N 2.95Å; T145-G148 PolarHBondContact O-N 3.44Å; G148-L151 PolarHBondContact O-N 3.32Å; G148-S152 PolarHBondContact O-N 2.97Å; G148-S152 PolarHBondContact O-OG 3.41Å
149	L	70.7	Confident	69.5	Low	94 Å²	94	66.8 Å²	66.8	49%	0.492	36%	0.358	S	S	.	.	H	α-helix	trans	-61.7	-46	172.6	-80.4	166.5	0	0	0	111.4	T145 F146 L151 S152 I153	T145-L149 HydrophobicContact CG2-CD1 4.24Å; T145-L149 WeakPolarHBondContact O-CB 3.49Å; T145-L149 WeakPolarHBondContact O-CG 3.24Å; T145-L149 PolarHBondContact O-N 2.73Å; F146-L149 HydrophobicContact CD1-CD1 4.38Å; F146-L149 PolarHBondContact O-N 3.04Å; L149-L151 VanDerWaalsContact C-N 3.34Å; L149-L151 PolarHBondContact O-N 2.84Å; L149-S152 WeakPolarHBondContact O-CB 3.35Å; L149-S152 PolarHBondContact O-N 3.45Å; L149-I153 VanDerWaalsContact O-CG1 3.3Å; L149-I153 WeakPolarHBondContact O-CG1 3.27Å; L149-I153 PolarHBondContact O-N 3.33Å
150	N	71.6	Confident	69.6	Low	32 Å²	32	72.8 Å²	72.8	17%	0.171	38%	0.379	C	S	.	.	H	α-helix	trans	-60.9	-44	177	-178.6	58.5	0	0	0	111.3	T115 F146 S147 S152 I153 Q154	T115-N150 VanDerWaalsContact CB-ND2 3.3Å; T115-N150 WeakPolarHBondContact CB-ND2 3.33Å; T115-N150 HydrophobicContact CG2-CB 4.2Å; T115-N150 WeakPolarHBondContact CG2-ND2 3.41Å; T115-N150 PolarHBondContact OG1-ND2 3.43Å; F146-N150 WeakPolarHBondContact O-CB 3.23Å; F146-N150 PolarHBondContact O-N 3.39Å; S147-N150 PolarHBondContact O-N 3.29Å; N150-S152 VanDerWaalsContact C-N 3.31Å; N150-S152 PolarHBondContact O-N 2.83Å; N150-I153 PolarHBondContact O-N 2.96Å; N150-Q154 WeakPolarHBondContact O-CB 3.46Å; N150-Q154 VanDerWaalsContact O-CG 3.24Å; N150-Q154 WeakPolarHBondContact O-CG 3.4Å; N150-Q154 PolarHBondContact O-N 3.24Å
151	L	71.4	Confident	69.5	Low	70 Å²	70	73.9 Å²	73.9	37%	0.366	39%	0.388	S	S	.	.	H	α-helix	trans	-58	-44.9	175.3	-117.9	133.6	0	0	0	111.7	T112 L116 S147 G148 L149 Q154 S155	T112-L151 HydrophobicContact CG2-CG 4.21Å; L116-L151 HydrophobicContact CD1-CD1 4.4Å; L116-L151 HydrophobicContact CD2-CD1 3.88Å; L116-L151 HydrophobicContact CG-CD1 4.28Å; S147-L151 PolarHBondContact O-N 3.08Å; G148-L151 PolarHBondContact O-N 3.32Å; L149-L151 VanDerWaalsContact C-N 3.34Å; L149-L151 PolarHBondContact O-N 2.84Å; L151-Q154 PolarHBondContact O-N 2.9Å; L151-S155 PolarHBondContact O-N 3.09Å; L151-S155 PolarHBondContact O-OG 2.92Å; L151-S155 VanDerWaalsContact O-OG 3.11Å
152	S	69.9	Low	69.4	Low	73 Å²	73	72 Å²	72	51%	0.51	37%	0.372	S	S	.	.	H	α-helix	trans	-62.4	-44.8	177.8	-57.1	0	0	0	0	112	G148 L149 N150 S155 M156	G148-S152 PolarHBondContact O-N 2.97Å; G148-S152 PolarHBondContact O-OG 3.41Å; L149-S152 WeakPolarHBondContact O-CB 3.35Å; L149-S152 PolarHBondContact O-N 3.45Å; N150-S152 VanDerWaalsContact C-N 3.31Å; N150-S152 PolarHBondContact O-N 2.83Å; S152-S155 PolarHBondContact O-N 3.28Å; S152-M156 PolarHBondContact O-N 3.46Å
153	I	72	Confident	69.4	Low	95 Å²	95	70.7 Å²	70.7	49%	0.487	37%	0.371	S	S	.	.	H	α-helix	trans	-62.8	-44.8	176.3	-68.2	165.8	0	0	0	110.3	L149 N150 S155 M156 L157	L149-I153 VanDerWaalsContact O-CG1 3.3Å; L149-I153 WeakPolarHBondContact O-CG1 3.27Å; L149-I153 PolarHBondContact O-N 3.33Å; N150-I153 PolarHBondContact O-N 2.96Å; I153-S155 PolarHBondContact O-N 3.02Å; I153-M156 PolarHBondContact O-N 3.26Å; I153-L157 HydrophobicContact CG2-CD1 3.87Å; I153-L157 HydrophobicContact CG2-CG 4.26Å; I153-L157 WeakPolarHBondContact O-CB 3.44Å; I153-L157 WeakPolarHBondContact O-CG 3.49Å; I153-L157 PolarHBondContact O-N 3.47Å
154	Q	70.7	Confident	69.5	Low	28 Å²	28	75.5 Å²	75.5	13%	0.131	40%	0.397	C	S	.	.	H	α-helix	trans	-63.3	-40.5	178.2	-69.2	-62.2	-17.2	0	0	111.7	N150 L151 M156 L157 Y158	N150-Q154 WeakPolarHBondContact O-CB 3.46Å; N150-Q154 VanDerWaalsContact O-CG 3.24Å; N150-Q154 WeakPolarHBondContact O-CG 3.4Å; N150-Q154 PolarHBondContact O-N 3.24Å; L151-Q154 PolarHBondContact O-N 2.9Å; Q154-M156 PolarHBondContact O-N 2.88Å; Q154-L157 PolarHBondContact O-N 3.47Å; Q154-Y158 VanDerWaalsContact O-CB 3.24Å; Q154-Y158 WeakPolarHBondContact O-CB 3.28Å; Q154-Y158 PolarHBondContact O-N 3.3Å
155	S	69.6	Low	69.2	Low	65 Å²	65	74.2 Å²	74.2	46%	0.455	40%	0.398	S	S	.	.	H	α-helix	trans	-60.5	-43.4	173.8	-63.4	0	0	0	0	112.1	L151 S152 I153 Y158 I159	L151-S155 PolarHBondContact O-N 3.09Å; L151-S155 PolarHBondContact O-OG 2.92Å; L151-S155 VanDerWaalsContact O-OG 3.11Å; S152-S155 PolarHBondContact O-N 3.28Å; I153-S155 PolarHBondContact O-N 3.02Å; S155-Y158 WeakPolarHBondContact O-CB 3.34Å; S155-Y158 PolarHBondContact O-N 3.22Å; S155-I159 WeakPolarHBondContact O-CG1 3.28Å; S155-I159 PolarHBondContact O-N 3.43Å
156	M	68.7	Low	69.3	Low	130 Å²	130	75.8 Å²	75.8	64%	0.64	40%	0.395	S	S	*	.	H	α-helix	trans	-64.2	-46.8	175.7	-79.2	-67.7	150.2	0	0	112.2	S152 I153 Q154 Y158 I159 Y160	S152-M156 PolarHBondContact O-N 3.46Å; I153-M156 PolarHBondContact O-N 3.26Å; Q154-M156 PolarHBondContact O-N 2.88Å; M156-Y158 PolarHBondContact O-N 3.26Å; M156-I159 PolarHBondContact O-N 3.21Å; M156-Y160 WeakPolarHBondContact O-CB 3.41Å; M156-Y160 PolarHBondContact O-N 3.21Å
157	L	69.6	Low	69.5	Low	73 Å²	73	72.7 Å²	72.7	38%	0.382	39%	0.39	S	S	.	.	H	α-helix	trans	-60.1	-36.9	175.2	-72	173.7	0	0	0	111.2	R108 I153 Q154 Y160 A161	R108-L157 PolarHBondContact NH1-O 3.06Å; I153-L157 HydrophobicContact CG2-CD1 3.87Å; I153-L157 HydrophobicContact CG2-CG 4.26Å; I153-L157 WeakPolarHBondContact O-CB 3.44Å; I153-L157 WeakPolarHBondContact O-CG 3.49Å; I153-L157 PolarHBondContact O-N 3.47Å; Q154-L157 PolarHBondContact O-N 3.47Å; L157-Y160 PolarHBondContact O-N 2.93Å; L157-A161 WeakPolarHBondContact O-CB 3.27Å; L157-A161 PolarHBondContact O-N 3.4Å
158	Y	66.9	Low	69.7	Low	73 Å²	73	77.1 Å²	77.1	29%	0.286	41%	0.41	S	S	.	.	H	α-helix	trans	-62.7	-52.6	177.2	-161.8	-84.7	0	0	0	111	H105 Q154 S155 M156 Y160 A161 Y162 L165	H105-Y158 AromaticContact CE1-CE2 3.59Å; H105-Y158 AromaticContact CE1-CZ 3.65Å; H105-Y158 PolarHBondContact CE1-OH 3.41Å; H105-Y158 AromaticContact ND1-CE2 3.38Å; H105-Y158 WeakPolarHBondContact ND1-CE2 3.37Å; H105-Y158 AromaticContact ND1-CZ 3.57Å; H105-Y158 PolarHBondContact ND1-OH 3.44Å; Q154-Y158 VanDerWaalsContact O-CB 3.24Å; Q154-Y158 WeakPolarHBondContact O-CB 3.28Å; Q154-Y158 PolarHBondContact O-N 3.3Å; S155-Y158 WeakPolarHBondContact O-CB 3.34Å; S155-Y158 PolarHBondContact O-N 3.22Å; M156-Y158 PolarHBondContact O-N 3.26Å; Y158-Y160 PolarHBondContact O-N 2.67Å; Y158-A161 PolarHBondContact O-N 3.26Å; Y158-A161 VanDerWaalsContact O-N 3.13Å; Y158-Y162 AromaticContact CD1-CD2 3.84Å; Y158-Y162 HydrophobicContact CD1-CD2 3.84Å; Y158-Y162 HydrophobicContact CD1-CE2 4.04Å; Y158-Y162 HydrophobicContact CD2-CD2 4.49Å; Y158-Y162 AromaticContact CD2-CE2 3.92Å; Y158-Y162 HydrophobicContact CD2-CE2 3.92Å; Y158-Y162 AromaticContact CE1-CD2 3.6Å; Y158-Y162 HydrophobicContact CE1-CD2 3.6Å; Y158-Y162 AromaticContact CE1-CE2 3.63Å; Y158-Y162 HydrophobicContact CE1-CE2 3.63Å; Y158-Y162 HydrophobicContact CE2-CD2 4.29Å; Y158-Y162 AromaticContact CE2-CE2 3.51Å; Y158-Y162 HydrophobicContact CE2-CE2 3.51Å; Y158-Y162 HydrophobicContact CG-CD2 4.27Å; Y158-Y162 HydrophobicContact CG-CE2 4.16Å; Y158-Y162 AromaticContact CZ-CD2 3.82Å; Y158-Y162 AromaticContact CZ-CE2 3.32Å; Y158-Y162 VanDerWaalsContact O-CD2 3.28Å; Y158-Y162 WeakPolarHBondContact O-CD2 3.45Å; Y158-Y162 PolarHBondContact O-N 3.18Å; Y158-L165 HydrophobicContact CE1-CD1 4.32Å
159	I	67.6	Low	69.9	Low	53 Å²	53	76.7 Å²	76.7	27%	0.272	40%	0.403	S	S	.	.	H	α-helix	trans	-56.9	-41.2	174.7	-65.9	160	0	0	0	110.5	S155 M156 L165 A169	S155-I159 WeakPolarHBondContact O-CG1 3.28Å; S155-I159 PolarHBondContact O-N 3.43Å; M156-I159 PolarHBondContact O-N 3.21Å; I159-L165 HydrophobicContact CG1-CD2 3.92Å; I159-A169 HydrophobicContact CG2-CB 4.02Å
160	Y	68.3	Low	70.2	Confident	155 Å²	155	74.6 Å²	74.6	61%	0.608	40%	0.399	S	S	*	.	H	α-helix	trans	-66.4	-38.1	178.6	-166.5	-97.9	0	0	0	112.5	M156 L157 Y158 Y162 R166	M156-Y160 WeakPolarHBondContact O-CB 3.41Å; M156-Y160 PolarHBondContact O-N 3.21Å; L157-Y160 PolarHBondContact O-N 2.93Å; Y158-Y160 PolarHBondContact O-N 2.67Å; Y160-Y162 PolarHBondContact O-N 3.36Å; Y160-R166 PolarHBondContact O-NE 1.99Å; Y160-R166 PolarHBondContact O-NH2 3.13Å
161	A	65.7	Low	70.5	Confident	39 Å²	39	81 Å²	81	32%	0.322	42%	0.421	S	S	.	.	H	α-helix	trans	-72.3	-30.1	-176	0	0	0	0	0	114.4	L157 Y158 P163	L157-A161 WeakPolarHBondContact O-CB 3.27Å; L157-A161 PolarHBondContact O-N 3.4Å; Y158-A161 PolarHBondContact O-N 3.26Å; Y158-A161 VanDerWaalsContact O-N 3.13Å; A161-P163 WeakPolarHBondContact O-CD 2.94Å
162	Y	63.6	Low	70.7	Confident	40 Å²	40	81.7 Å²	81.7	16%	0.157	43%	0.428	C	S	.	.			trans	-98.5	113.2	-175.1	-68.5	-77.5	0	0	0	111.5	H105 Y158 Y160 N164 L165 R166	H105-Y162 WeakPolarHBondContact CA-OH 3.39Å; H105-Y162 WeakPolarHBondContact CB-OH 3.37Å; H105-Y162 PolarHBondContact ND1-OH 2.97Å; Y158-Y162 AromaticContact CD1-CD2 3.84Å; Y158-Y162 HydrophobicContact CD1-CD2 3.84Å; Y158-Y162 HydrophobicContact CD1-CE2 4.04Å; Y158-Y162 HydrophobicContact CD2-CD2 4.49Å; Y158-Y162 AromaticContact CD2-CE2 3.92Å; Y158-Y162 HydrophobicContact CD2-CE2 3.92Å; Y158-Y162 AromaticContact CE1-CD2 3.6Å; Y158-Y162 HydrophobicContact CE1-CD2 3.6Å; Y158-Y162 AromaticContact CE1-CE2 3.63Å; Y158-Y162 HydrophobicContact CE1-CE2 3.63Å; Y158-Y162 HydrophobicContact CE2-CD2 4.29Å; Y158-Y162 AromaticContact CE2-CE2 3.51Å; Y158-Y162 HydrophobicContact CE2-CE2 3.51Å; Y158-Y162 HydrophobicContact CG-CD2 4.27Å; Y158-Y162 HydrophobicContact CG-CE2 4.16Å; Y158-Y162 AromaticContact CZ-CD2 3.82Å; Y158-Y162 AromaticContact CZ-CE2 3.32Å; Y158-Y162 VanDerWaalsContact O-CD2 3.28Å; Y158-Y162 WeakPolarHBondContact O-CD2 3.45Å; Y158-Y162 PolarHBondContact O-N 3.18Å; Y160-Y162 PolarHBondContact O-N 3.36Å; Y162-N164 VanDerWaalsContact C-N 3.3Å; Y162-N164 PolarHBondContact O-N 2.99Å; Y162-L165 PolarHBondContact O-N 3.47Å; Y162-L165 VanDerWaalsContact O-N 3.12Å; Y162-R166 PolarHBondContact O-N 3.03Å
163	P	68	Low	70.7	Confident	78 Å²	78	85.5 Å²	85.5	51%	0.506	44%	0.436	S	S	.	.	H	α-helix	trans	-57.7	-40.2	-175.3	-23	31.9	0	0	0	113.5	A161 R166 S167	A161-P163 WeakPolarHBondContact O-CD 2.94Å; P163-R166 WeakPolarHBondContact O-CB 2.81Å; P163-R166 PolarHBondContact O-N 3.38Å; P163-S167 PolarHBondContact O-N 2.62Å; P163-S167 PolarHBondContact O-OG 2.89Å
164	N	73.4	Confident	70.7	Confident	135 Å²	135	88.4 Å²	88.4	72%	0.722	45%	0.445	S	S	*	.	H	α-helix	trans	-67.4	-35.7	179.8	-64.7	-18.6	0	0	0	112.6	Y162 S167 E168	Y162-N164 VanDerWaalsContact C-N 3.3Å; Y162-N164 PolarHBondContact O-N 2.99Å; N164-S167 PolarHBondContact O-OG 3.3Å; N164-E168 PolarHBondContact O-N 3.32Å
165	L	65.8	Low	70.5	Confident	79 Å²	79	90.7 Å²	90.7	41%	0.414	46%	0.464	S	S	.	.	H	α-helix	trans	-71.8	-37.1	174.6	-112.8	116.5	0	0	0	110.9	Y158 I159 Y162 A169	Y158-L165 HydrophobicContact CE1-CD1 4.32Å; I159-L165 HydrophobicContact CG1-CD2 3.92Å; Y162-L165 PolarHBondContact O-N 3.47Å; Y162-L165 VanDerWaalsContact O-N 3.12Å; L165-A169 VanDerWaalsContact O-CB 3.22Å; L165-A169 WeakPolarHBondContact O-CB 3.27Å; L165-A169 PolarHBondContact O-N 2.93Å
166	R	72.9	Confident	70	Confident	108 Å²	108	91.2 Å²	91.2	41%	0.408	47%	0.467	S	S	.	.	H	α-helix	trans	-62.7	-43.8	176.4	-127.5	-169.7	-67	165.8	-0.3	111.6	Y160 Y162 P163 A170	Y160-R166 PolarHBondContact O-NE 1.99Å; Y160-R166 PolarHBondContact O-NH2 3.13Å; Y162-R166 PolarHBondContact O-N 3.03Å; P163-R166 WeakPolarHBondContact O-CB 2.81Å; P163-R166 PolarHBondContact O-N 3.38Å; R166-A170 VanDerWaalsContact O-CB 3.31Å; R166-A170 WeakPolarHBondContact O-CB 3.31Å; R166-A170 PolarHBondContact O-N 3.14Å
167	S	75.2	Confident	69.4	Low	67 Å²	67	88.7 Å²	88.7	47%	0.469	46%	0.462	S	S	.	.	H	α-helix	trans	-67.1	-42.4	178.2	61.7	0	0	0	0	112.3	P163 N164 A170 R171	P163-S167 PolarHBondContact O-N 2.62Å; P163-S167 PolarHBondContact O-OG 2.89Å; N164-S167 PolarHBondContact O-OG 3.3Å; S167-A170 PolarHBondContact O-N 3.29Å; S167-R171 WeakPolarHBondContact O-CB 3.4Å; S167-R171 PolarHBondContact O-N 3.08Å
168	E	74.7	Confident	68.3	Low	98 Å²	98	90.4 Å²	90.4	46%	0.458	48%	0.478	S	S	.	.	H	α-helix	trans	-67.2	-42.2	175.1	-80.3	-60.9	155.6	0	0	112.4	N164 A170 R171 V172	N164-E168 PolarHBondContact O-N 3.32Å; E168-A170 VanDerWaalsContact C-N 3.33Å; E168-A170 PolarHBondContact O-N 3.35Å; E168-R171 WeakPolarHBondContact O-CB 3.39Å; E168-R171 PolarHBondContact O-N 3.28Å; E168-R171 VanDerWaalsContact O-N 3.14Å; E168-R171 IonicContact OE1-NH1 3.47Å; E168-R171 PolarHBondContact OE1-NH1 3.1Å; E168-V172 WeakPolarHBondContact O-CG2 3.45Å; E168-V172 PolarHBondContact O-N 2.96Å
169	A	71.3	Confident	67.5	Low	26 Å²	26	96 Å²	96	22%	0.215	51%	0.505	C	S	.	.	H	α-helix	trans	-59.2	-45.8	173.4	0	0	0	0	0	111.1	I159 L165 R171 V172 F173	I159-A169 HydrophobicContact CG2-CB 4.02Å; L165-A169 VanDerWaalsContact O-CB 3.22Å; L165-A169 WeakPolarHBondContact O-CB 3.27Å; L165-A169 PolarHBondContact O-N 2.93Å; A169-R171 VanDerWaalsContact C-N 3.27Å; A169-R171 PolarHBondContact O-N 3.13Å; A169-V172 PolarHBondContact O-N 3.31Å; A169-F173 WeakPolarHBondContact O-CD2 3.43Å; A169-F173 PolarHBondContact O-N 2.79Å
170	A	77.4	Confident	66.3	Low	49 Å²	49	99.4 Å²	99.4	41%	0.405	52%	0.523	S	S	.	.	H	α-helix	trans	-60.8	-36.7	176.2	0	0	0	0	0	112.3	R166 S167 E168 K174	R166-A170 VanDerWaalsContact O-CB 3.31Å; R166-A170 WeakPolarHBondContact O-CB 3.31Å; R166-A170 PolarHBondContact O-N 3.14Å; S167-A170 PolarHBondContact O-N 3.29Å; E168-A170 VanDerWaalsContact C-N 3.33Å; E168-A170 PolarHBondContact O-N 3.35Å; A170-K174 VanDerWaalsContact O-CB 3.32Å; A170-K174 WeakPolarHBondContact O-CB 3.5Å; A170-K174 WeakPolarHBondContact O-CG 3.45Å; A170-K174 PolarHBondContact O-N 2.87Å
171	R	78.7	Confident	64.8	Low	167 Å²	167	102 Å²	102	63%	0.63	54%	0.537	S	S	*	.	H	α-helix	trans	-65.1	-45.6	174.8	-174.1	-175.9	169.7	-177.8	-1.1	111.6	S167 E168 A169 K174 S175	S167-R171 WeakPolarHBondContact O-CB 3.4Å; S167-R171 PolarHBondContact O-N 3.08Å; E168-R171 WeakPolarHBondContact O-CB 3.39Å; E168-R171 PolarHBondContact O-N 3.28Å; E168-R171 VanDerWaalsContact O-N 3.14Å; E168-R171 IonicContact OE1-NH1 3.47Å; E168-R171 PolarHBondContact OE1-NH1 3.1Å; A169-R171 VanDerWaalsContact C-N 3.27Å; A169-R171 PolarHBondContact O-N 3.13Å; R171-K174 PolarHBondContact O-N 2.69Å; R171-S175 WeakPolarHBondContact O-CB 3.44Å; R171-S175 PolarHBondContact O-N 3.43Å
172	V	75.2	Confident	63.6	Low	84 Å²	84	114.5 Å²	114.5	51%	0.509	58%	0.576	S	S	.	*	H	α-helix	trans	-61.7	-47.7	175.5	175.1	0	0	0	0	110.7	E168 A169 K174 S175 C176	E168-V172 WeakPolarHBondContact O-CG2 3.45Å; E168-V172 PolarHBondContact O-N 2.96Å; A169-V172 PolarHBondContact O-N 3.31Å; V172-K174 PolarHBondContact O-N 3.45Å; V172-S175 WeakPolarHBondContact CA-OG 3.27Å; V172-S175 PolarHBondContact O-N 3.14Å; V172-S175 VanDerWaalsContact O-N 3.11Å; V172-S175 PolarHBondContact O-OG 2.86Å; V172-C176 PolarHBondContact O-N 3.42Å
173	F	70.3	Confident	63.7	Low	154 Å²	154	118.2 Å²	118.2	68%	0.675	60%	0.597	S	S	*	*	H	α-helix	trans	-61.8	-42	177.5	-84.7	-70.9	0	0	0	112.6	A169 S175 C176 S177	A169-F173 WeakPolarHBondContact O-CD2 3.43Å; A169-F173 PolarHBondContact O-N 2.79Å; F173-S175 VanDerWaalsContact C-N 3.31Å; F173-S175 PolarHBondContact O-N 2.88Å; F173-C176 PolarHBondContact O-N 2.94Å; F173-S177 PolarHBondContact O-N 3.27Å
174	K	71.4	Confident	63.4	Low	156 Å²	156	120.3 Å²	120.3	68%	0.678	60%	0.602	S	S	*	*	H	α-helix	trans	-63.3	-35.6	173.4	-83.2	-176.1	174.4	-177	0	112.7	A170 R171 V172 C176 S177	A170-K174 VanDerWaalsContact O-CB 3.32Å; A170-K174 WeakPolarHBondContact O-CB 3.5Å; A170-K174 WeakPolarHBondContact O-CG 3.45Å; A170-K174 PolarHBondContact O-N 2.87Å; R171-K174 PolarHBondContact O-N 2.69Å; V172-K174 PolarHBondContact O-N 3.45Å; K174-C176 VanDerWaalsContact C-N 3.32Å; K174-S177 WeakPolarHBondContact CA-OG 3.44Å; K174-S177 PolarHBondContact O-N 3.06Å; K174-S177 PolarHBondContact O-OG 3.2Å
175	S	65.2	Low	62.9	Low	76 Å²	76	119.5 Å²	119.5	53%	0.531	60%	0.595	S	S	.	*	H	α-helix	trans	-70	-30.9	175.6	74.2	0	0	0	0	112.4	R171 V172 F173	R171-S175 WeakPolarHBondContact O-CB 3.44Å; R171-S175 PolarHBondContact O-N 3.43Å; V172-S175 WeakPolarHBondContact CA-OG 3.27Å; V172-S175 PolarHBondContact O-N 3.14Å; V172-S175 VanDerWaalsContact O-N 3.11Å; V172-S175 PolarHBondContact O-OG 2.86Å; F173-S175 VanDerWaalsContact C-N 3.31Å; F173-S175 PolarHBondContact O-N 2.88Å
176	C	60.5	Low	62.7	Low	76 Å²	76	121.9 Å²	121.9	51%	0.514	61%	0.605	S	S	.	*	H	α-helix	trans	-77.1	-31.9	173.2	-86.7	0	0	0	0	113.3	V172 F173 K174 C178 K179	V172-C176 PolarHBondContact O-N 3.42Å; F173-C176 PolarHBondContact O-N 2.94Å; K174-C176 VanDerWaalsContact C-N 3.32Å; C176-C178 PolarHBondContact O-N 3.48Å; C176-C178 VanDerWaalsContact O-N 3.09Å; C176-K179 PolarHBondContact O-N 3.05Å
177	S	55	Low	62.1	Low	76 Å²	76	122.8 Å²	122.8	53%	0.531	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.6	-12.2	179.3	60.7	0	0	0	0	113.5	F173 K174 K179	F173-S177 PolarHBondContact O-N 3.27Å; K174-S177 WeakPolarHBondContact CA-OG 3.44Å; K174-S177 PolarHBondContact O-N 3.06Å; K174-S177 PolarHBondContact O-OG 3.2Å; S177-K179 VanDerWaalsContact C-N 3.26Å; S177-K179 PolarHBondContact O-N 3.46Å
178	C	48.3	Very low	61.2	Low	109 Å²	109	126.5 Å²	126.5	74%	0.736	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-6	170.9	-67.8	0	0	0	0	114.3	C176	C176-C178 PolarHBondContact O-N 3.48Å; C176-C178 VanDerWaalsContact O-N 3.09Å
179	K	48.9	Very low	60.2	Low	192 Å²	192	128.5 Å²	128.5	84%	0.835	64%	0.64	S	S	*	*	S	Bend	trans	-111.2	-9.5	-180	-72.1	-166	178.2	-176.3	0	115.6	C176 S177 K181	C176-K179 PolarHBondContact O-N 3.05Å; S177-K179 VanDerWaalsContact C-N 3.26Å; S177-K179 PolarHBondContact O-N 3.46Å; K179-K181 PolarHBondContact O-N 2.74Å
180	L	41.5	Very low	59.4	Low	124 Å²	124	136.4 Å²	136.4	65%	0.649	67%	0.673	S	S	*	*			trans	-97.7	78.9	172.9	-79.4	152.8	0	0	0	108.9	W182	L180-W182 PolarHBondContact O-N 2.81Å
181	K	38.1	Very low	57.9	Low	210 Å²	210	143.7 Å²	143.7	91%	0.913	70%	0.695	S	S	*	*			trans	-76.3	106.8	156.1	-83.8	-174.2	175	-177.5	0	106.7	K179	K179-K181 PolarHBondContact O-N 2.74Å
182	W	41.2	Very low	56	Low	300 Å²	300	141.5 Å²	141.5	100%	1.136	70%	0.701	S	S	*	*			trans	-92.3	0	157.1	-78.6	72.8	0	0	0	108.1	L180	L180-W182 PolarHBondContact O-N 2.81Å

Retrieved 182 of 182 residues in 56.5 ms (Link to these results)

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