A0A075X7J5_HUMAN Loading...

NADH-ubiquinone oxidoreductase chain 1

AlphaFold DB , UniProt , Accession A0A075X7J5, Species HUMAN (Homo sapiens, Human), Gene ND1, Length 193 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	68.9	Low	89.7	Confident	190 Å²	190	92.5 Å²	92.5	94%	0.936	51%	0.508	S	S	*	.				0	79.5	0	-71.5	-64.9	-170.4	0	0	109.6	M3 A4 N5	M1-M3 VanDerWaalsContact C-N 3.32Å; M1-M3 PolarHBondContact O-N 3.38Å; M1-A4 HydrophobicContact CB-CB 3.82Å; M1-A4 PolarHBondContact O-N 3.34Å; M1-N5 PolarHBondContact O-N 3.35Å
2	P	83.3	Confident	90.1	Very high	112 Å²	112	90.3 Å²	90.3	73%	0.727	50%	0.502	S	S	*	.	H	α-helix	trans	-63.5	-36.6	-174.9	25.6	-33.8	0	0	0	112.7	A4 N5 L6	P2-A4 VanDerWaalsContact C-N 3.34Å; P2-A4 PolarHBondContact O-N 3.44Å; P2-N5 PolarHBondContact O-N 3.44Å; P2-L6 PolarHBondContact O-N 2.65Å
3	M	88.8	Confident	90.5	Very high	120 Å²	120	85.6 Å²	85.6	59%	0.591	48%	0.475	S	S	*	.	H	α-helix	trans	-64.6	-37.3	177.2	-171	61.5	-172.4	0	0	112.8	M1 L6 L7	M1-M3 VanDerWaalsContact C-N 3.32Å; M1-M3 PolarHBondContact O-N 3.38Å; M3-L6 HydrophobicContact CE-CD2 4.47Å; M3-L6 PolarHBondContact O-N 2.93Å; M3-L6 HydrophobicContact SD-CD2 4.39Å; M3-L7 HydrophobicContact CE-CD1 4.38Å; M3-L7 HydrophobicContact CE-CD2 4.4Å; M3-L7 HydrophobicContact CE-CG 4.24Å; M3-L7 WeakPolarHBondContact O-CG 3.4Å; M3-L7 PolarHBondContact O-N 3.44Å
4	A	92.7	Very high	90.8	Very high	51 Å²	51	85.1 Å²	85.1	42%	0.421	47%	0.471	S	S	.	.	H	α-helix	trans	-65.3	-41.8	176.8	0	0	0	0	0	111.3	M1 P2 L6 L7 L8	M1-A4 HydrophobicContact CB-CB 3.82Å; M1-A4 PolarHBondContact O-N 3.34Å; P2-A4 VanDerWaalsContact C-N 3.34Å; P2-A4 PolarHBondContact O-N 3.44Å; A4-L6 VanDerWaalsContact C-N 3.33Å; A4-L6 PolarHBondContact O-N 3.06Å; A4-L7 PolarHBondContact O-N 3.1Å; A4-L8 WeakPolarHBondContact O-CB 3.48Å; A4-L8 PolarHBondContact O-N 3.27Å
5	N	91.3	Very high	91.1	Very high	98 Å²	98	84.8 Å²	84.8	52%	0.524	47%	0.467	S	S	.	.	H	α-helix	trans	-63.3	-39.4	175.4	-72.2	6.4	0	0	0	111.9	M1 P2 L8 L9 L95	M1-N5 PolarHBondContact O-N 3.35Å; P2-N5 PolarHBondContact O-N 3.44Å; N5-L8 PolarHBondContact O-N 3.43Å; N5-L9 PolarHBondContact O-N 3.3Å; N5-L95 HydrophobicContact CB-CD1 3.78Å
6	L	92	Very high	91.3	Very high	65 Å²	65	83.1 Å²	83.1	34%	0.34	47%	0.467	S	S	.	.	H	α-helix	trans	-64.3	-43.1	176.9	-177.2	148.7	0	0	0	111.8	P2 M3 A4 L9 I10	P2-L6 PolarHBondContact O-N 2.65Å; M3-L6 HydrophobicContact CE-CD2 4.47Å; M3-L6 PolarHBondContact O-N 2.93Å; M3-L6 HydrophobicContact SD-CD2 4.39Å; A4-L6 VanDerWaalsContact C-N 3.33Å; A4-L6 PolarHBondContact O-N 3.06Å; L6-L9 PolarHBondContact O-N 3.44Å; L6-I10 HydrophobicContact CD2-CD1 3.4Å; L6-I10 VanDerWaalsContact CD2-CD1 3.4Å; L6-I10 HydrophobicContact CD2-CG1 4.34Å; L6-I10 HydrophobicContact CG-CD1 3.97Å; L6-I10 WeakPolarHBondContact O-CG1 3.21Å; L6-I10 PolarHBondContact O-N 3.09Å
7	L	92.8	Very high	91.5	Very high	90 Å²	90	85.4 Å²	85.4	47%	0.471	48%	0.475	S	S	.	.	H	α-helix	trans	-64.5	-40.7	174.7	-72.8	169.8	0	0	0	112	M3 A4 L9 I10 V11	M3-L7 HydrophobicContact CE-CD1 4.38Å; M3-L7 HydrophobicContact CE-CD2 4.4Å; M3-L7 HydrophobicContact CE-CG 4.24Å; M3-L7 WeakPolarHBondContact O-CG 3.4Å; M3-L7 PolarHBondContact O-N 3.44Å; A4-L7 PolarHBondContact O-N 3.1Å; L7-L9 PolarHBondContact O-N 3.29Å; L7-I10 PolarHBondContact O-N 3.39Å; L7-V11 WeakPolarHBondContact O-CB 3.39Å; L7-V11 WeakPolarHBondContact O-CG2 3.39Å; L7-V11 PolarHBondContact O-N 2.72Å
8	L	93.8	Very high	91.6	Very high	134 Å²	134	82.7 Å²	82.7	70%	0.702	47%	0.466	S	S	*	.	H	α-helix	trans	-65.4	-23.4	176	-159.6	94.5	0	0	0	112.5	A4 N5 P12	A4-L8 WeakPolarHBondContact O-CB 3.48Å; A4-L8 PolarHBondContact O-N 3.27Å; N5-L8 PolarHBondContact O-N 3.43Å; L8-P12 WeakPolarHBondContact O-CD 3.39Å; L8-P12 WeakPolarHBondContact O-CG 3.17Å
9	L	93.1	Very high	91.8	Very high	36 Å²	36	81.8 Å²	81.8	19%	0.188	46%	0.456	C	S	.	.	H	α-helix	trans	-80.2	-53.9	172.3	-176.3	69.7	0	0	0	111	N5 L6 L7 P12 I13 W86 L95	N5-L9 PolarHBondContact O-N 3.3Å; L6-L9 PolarHBondContact O-N 3.44Å; L7-L9 PolarHBondContact O-N 3.29Å; L9-P12 WeakPolarHBondContact O-CD 3.49Å; L9-I13 HydrophobicContact CD1-CD1 3.9Å; L9-I13 HydrophobicContact CG-CD1 3.74Å; L9-I13 WeakPolarHBondContact O-CD1 3.2Å; L9-I13 WeakPolarHBondContact O-CG1 3.46Å; L9-I13 PolarHBondContact O-N 3.1Å; L9-W86 HydrophobicContact CD2-CB 4.37Å; L9-L95 HydrophobicContact CD2-CB 4.26Å; L9-L95 HydrophobicContact CD2-CD2 3.96Å; L9-L95 HydrophobicContact CD2-CG 4.47Å
10	I	94.3	Very high	92	Very high	45 Å²	45	82.7 Å²	82.7	23%	0.231	46%	0.459	C	S	.	.	H	α-helix	trans	-69	-43.6	-169.9	-65.2	175.8	0	0	0	112.3	L6 L7 I13 L14 L83	L6-I10 HydrophobicContact CD2-CD1 3.4Å; L6-I10 VanDerWaalsContact CD2-CD1 3.4Å; L6-I10 HydrophobicContact CD2-CG1 4.34Å; L6-I10 HydrophobicContact CG-CD1 3.97Å; L6-I10 WeakPolarHBondContact O-CG1 3.21Å; L6-I10 PolarHBondContact O-N 3.09Å; L7-I10 PolarHBondContact O-N 3.39Å; I10-I13 PolarHBondContact O-N 3.34Å; I10-L14 HydrophobicContact CG2-CD1 4.04Å; I10-L14 HydrophobicContact CG2-CG 4.39Å; I10-L14 PolarHBondContact O-N 3.31Å; I10-L14 VanDerWaalsContact O-N 3.1Å; I10-L83 HydrophobicContact CG2-CD1 4.23Å; I10-L83 HydrophobicContact CG2-CD2 4.08Å
11	V	95.3	Very high	92.1	Very high	76 Å²	76	82.7 Å²	82.7	46%	0.461	46%	0.457	S	S	.	.	H	α-helix	trans	-62.8	-49.3	-174	172.7	0	0	0	0	111.5	L7 I13 L14 I15	L7-V11 WeakPolarHBondContact O-CB 3.39Å; L7-V11 WeakPolarHBondContact O-CG2 3.39Å; L7-V11 PolarHBondContact O-N 2.72Å; V11-I13 VanDerWaalsContact C-N 3.32Å; V11-I13 PolarHBondContact O-N 3.06Å; V11-L14 PolarHBondContact O-N 3.32Å; V11-I15 HydrophobicContact CG1-CD1 3.81Å; V11-I15 WeakPolarHBondContact O-CG1 3.44Å; V11-I15 PolarHBondContact O-N 2.93Å; V11-I15 VanDerWaalsContact O-N 3.13Å
12	P	95.2	Very high	93.3	Very high	67 Å²	67	74 Å²	74	44%	0.435	42%	0.415	S	S	.	.	H	α-helix	trans	-62.3	-34.7	175.1	-26.8	38.7	0	0	0	113.9	L8 L9 I15 A16	L8-P12 WeakPolarHBondContact O-CD 3.39Å; L8-P12 WeakPolarHBondContact O-CG 3.17Å; L9-P12 WeakPolarHBondContact O-CD 3.49Å; P12-I15 PolarHBondContact O-N 3.45Å; P12-A16 VanDerWaalsContact O-CB 3.25Å; P12-A16 WeakPolarHBondContact O-CB 3.02Å; P12-A16 PolarHBondContact O-N 3.47Å
13	I	95.2	Very high	93.8	Very high	29 Å²	29	71.8 Å²	71.8	15%	0.149	40%	0.399	C	S	.	.	H	α-helix	trans	-62.3	-45.7	177.4	-68.8	164.7	0	0	0	110.8	L9 I10 V11 I15 A16 M17 W86	L9-I13 HydrophobicContact CD1-CD1 3.9Å; L9-I13 HydrophobicContact CG-CD1 3.74Å; L9-I13 WeakPolarHBondContact O-CD1 3.2Å; L9-I13 WeakPolarHBondContact O-CG1 3.46Å; L9-I13 PolarHBondContact O-N 3.1Å; I10-I13 PolarHBondContact O-N 3.34Å; V11-I13 VanDerWaalsContact C-N 3.32Å; V11-I13 PolarHBondContact O-N 3.06Å; I13-I15 VanDerWaalsContact C-N 3.34Å; I13-I15 PolarHBondContact O-N 3.26Å; I13-A16 PolarHBondContact O-N 3.34Å; I13-M17 WeakPolarHBondContact O-CB 3.41Å; I13-M17 PolarHBondContact O-N 3.04Å; I13-W86 HydrophobicContact CD1-CB 3.77Å; I13-W86 HydrophobicContact CD1-CD2 3.72Å; I13-W86 HydrophobicContact CD1-CE3 4.11Å; I13-W86 HydrophobicContact CD1-CG 3.55Å; I13-W86 HydrophobicContact CG1-CD2 4.26Å; I13-W86 HydrophobicContact CG1-CE3 4.43Å; I13-W86 HydrophobicContact CG2-CZ2 4.47Å
14	L	94.3	Very high	94.2	Very high	79 Å²	79	70.3 Å²	70.3	41%	0.414	39%	0.391	S	S	.	.	H	α-helix	trans	-64.6	-39.2	177.7	-67.9	175.2	0	0	0	112	I10 V11 M17 A18	I10-L14 HydrophobicContact CG2-CD1 4.04Å; I10-L14 HydrophobicContact CG2-CG 4.39Å; I10-L14 PolarHBondContact O-N 3.31Å; I10-L14 VanDerWaalsContact O-N 3.1Å; V11-L14 PolarHBondContact O-N 3.32Å; L14-M17 PolarHBondContact O-N 3.35Å; L14-A18 PolarHBondContact O-N 3.42Å; L14-A18 VanDerWaalsContact O-N 3.08Å
15	I	94.9	Very high	94.2	Very high	80 Å²	80	72.6 Å²	72.6	41%	0.41	39%	0.388	S	S	.	.	H	α-helix	trans	-65.3	-44.4	175.3	-65.4	167.5	0	0	0	110.3	V11 P12 I13 M17 A18 F19	V11-I15 HydrophobicContact CG1-CD1 3.81Å; V11-I15 WeakPolarHBondContact O-CG1 3.44Å; V11-I15 PolarHBondContact O-N 2.93Å; V11-I15 VanDerWaalsContact O-N 3.13Å; P12-I15 PolarHBondContact O-N 3.45Å; I13-I15 VanDerWaalsContact C-N 3.34Å; I13-I15 PolarHBondContact O-N 3.26Å; I15-M17 VanDerWaalsContact C-N 3.34Å; I15-M17 PolarHBondContact O-N 3.02Å; I15-A18 WeakPolarHBondContact O-CB 3.49Å; I15-A18 PolarHBondContact O-N 3.32Å; I15-F19 HydrophobicContact CG2-CD2 3.75Å; I15-F19 HydrophobicContact CG2-CE2 3.7Å; I15-F19 VanDerWaalsContact O-CD2 3.3Å; I15-F19 WeakPolarHBondContact O-CD2 3.21Å; I15-F19 PolarHBondContact O-N 3.39Å
16	A	95.5	Very high	94.3	Very high	58 Å²	58	69.6 Å²	69.6	48%	0.479	37%	0.371	S	S	.	.	H	α-helix	trans	-61	-43	177.7	0	0	0	0	0	111.4	P12 I13 A18 F19 L20	P12-A16 VanDerWaalsContact O-CB 3.25Å; P12-A16 WeakPolarHBondContact O-CB 3.02Å; P12-A16 PolarHBondContact O-N 3.47Å; I13-A16 PolarHBondContact O-N 3.34Å; A16-A18 VanDerWaalsContact C-N 3.34Å; A16-A18 PolarHBondContact O-N 2.98Å; A16-F19 PolarHBondContact O-N 3.21Å; A16-L20 WeakPolarHBondContact O-CB 3.14Å; A16-L20 PolarHBondContact O-N 3.4Å
17	M	94.6	Very high	94.6	Very high	121 Å²	121	71 Å²	71	60%	0.596	38%	0.377	S	S	*	.	H	α-helix	trans	-59.5	-42.9	174.4	-176.1	-173.9	175	0	0	111.8	I13 L14 I15 F19 L20 M21	I13-M17 WeakPolarHBondContact O-CB 3.41Å; I13-M17 PolarHBondContact O-N 3.04Å; L14-M17 PolarHBondContact O-N 3.35Å; I15-M17 VanDerWaalsContact C-N 3.34Å; I15-M17 PolarHBondContact O-N 3.02Å; M17-F19 PolarHBondContact O-N 3.14Å; M17-L20 WeakPolarHBondContact O-CB 3.34Å; M17-L20 PolarHBondContact O-N 3.38Å; M17-M21 PolarHBondContact O-N 3.26Å
18	A	93.2	Very high	94.7	Very high	37 Å²	37	70 Å²	70	31%	0.306	37%	0.372	S	S	.	.	H	α-helix	trans	-62.3	-42.6	177.6	0	0	0	0	0	112	L14 I15 A16 M21 P48	L14-A18 PolarHBondContact O-N 3.42Å; L14-A18 VanDerWaalsContact O-N 3.08Å; I15-A18 WeakPolarHBondContact O-CB 3.49Å; I15-A18 PolarHBondContact O-N 3.32Å; A16-A18 VanDerWaalsContact C-N 3.34Å; A16-A18 PolarHBondContact O-N 2.98Å; A18-M21 PolarHBondContact O-N 3.25Å; A18-P48 HydrophobicContact CB-CB 3.89Å; A18-P48 WeakPolarHBondContact O-CB 3.43Å; A18-P48 VanDerWaalsContact O-CG 3.32Å; A18-P48 WeakPolarHBondContact O-CG 3.47Å
19	F	95.2	Very high	94.8	Very high	66 Å²	66	63.7 Å²	63.7	29%	0.289	34%	0.34	S	S	.	.	H	α-helix	trans	-73	-29.1	176.6	-78.4	-70.4	0	0	0	113.5	I15 A16 M17 M21 L22 T23 L45 P48 F49	I15-F19 HydrophobicContact CG2-CD2 3.75Å; I15-F19 HydrophobicContact CG2-CE2 3.7Å; I15-F19 VanDerWaalsContact O-CD2 3.3Å; I15-F19 WeakPolarHBondContact O-CD2 3.21Å; I15-F19 PolarHBondContact O-N 3.39Å; A16-F19 PolarHBondContact O-N 3.21Å; M17-F19 PolarHBondContact O-N 3.14Å; F19-M21 VanDerWaalsContact C-N 3.25Å; F19-M21 PolarHBondContact O-N 3.41Å; F19-L22 WeakPolarHBondContact O-CB 3.3Å; F19-L22 PolarHBondContact O-N 3.13Å; F19-T23 PolarHBondContact O-N 3.3Å; F19-T23 PolarHBondContact O-OG1 3.2Å; F19-L45 HydrophobicContact CE1-CD2 4.14Å; F19-P48 HydrophobicContact CD1-CG 4.34Å; F19-F49 HydrophobicContact CZ-CE2 4.15Å
20	L	95.3	Very high	94.9	Very high	99 Å²	99	68.5 Å²	68.5	52%	0.518	36%	0.356	S	S	.	.	H	α-helix	trans	-57.7	-39.7	174	-174.4	145.7	0	0	0	111.3	A16 M17 L22 T23 E24	A16-L20 WeakPolarHBondContact O-CB 3.14Å; A16-L20 PolarHBondContact O-N 3.4Å; M17-L20 WeakPolarHBondContact O-CB 3.34Å; M17-L20 PolarHBondContact O-N 3.38Å; L20-L22 VanDerWaalsContact C-N 3.3Å; L20-L22 PolarHBondContact O-N 2.78Å; L20-T23 WeakPolarHBondContact CA-OG1 3.19Å; L20-T23 PolarHBondContact O-N 2.76Å; L20-T23 PolarHBondContact O-OG1 3.4Å; L20-E24 VanDerWaalsContact O-CB 3.3Å; L20-E24 WeakPolarHBondContact O-CB 3.29Å; L20-E24 PolarHBondContact O-N 3.04Å
21	M	93.7	Very high	95.1	Very high	83 Å²	83	73.1 Å²	73.1	41%	0.409	38%	0.378	S	S	.	.	H	α-helix	trans	-62.4	-35.5	175.1	-60.9	-54.4	-56.8	0	0	112.9	M17 A18 F19 R25	M17-M21 PolarHBondContact O-N 3.26Å; A18-M21 PolarHBondContact O-N 3.25Å; F19-M21 VanDerWaalsContact C-N 3.25Å; F19-M21 PolarHBondContact O-N 3.41Å; M21-R25 WeakPolarHBondContact O-CG 3.47Å; M21-R25 PolarHBondContact O-N 3.16Å
22	L	94.4	Very high	95.2	Very high	9 Å²	9	74.7 Å²	74.7	5%	0.047	38%	0.381	C	S	.	.	H	α-helix	trans	-72.5	-44.3	176.6	172.6	152.5	0	0	0	111.5	F19 L20 E24 R25 K26 G44 Q47 P48	F19-L22 WeakPolarHBondContact O-CB 3.3Å; F19-L22 PolarHBondContact O-N 3.13Å; L20-L22 VanDerWaalsContact C-N 3.3Å; L20-L22 PolarHBondContact O-N 2.78Å; L22-E24 VanDerWaalsContact C-N 3.33Å; L22-R25 PolarHBondContact O-N 3.24Å; L22-K26 HydrophobicContact CD2-CD 3.92Å; L22-K26 HydrophobicContact CD2-CG 4.47Å; L22-K26 PolarHBondContact O-N 3.48Å; L22-G44 WeakPolarHBondContact CD1-O 3.49Å; L22-Q47 HydrophobicContact CD1-CB 4.24Å; L22-P48 HydrophobicContact CB-CG 3.87Å; L22-P48 HydrophobicContact CD1-CG 4.13Å
23	T	94.9	Very high	95.2	Very high	65 Å²	65	79.7 Å²	79.7	40%	0.399	40%	0.403	S	S	.	.	H	α-helix	trans	-64.7	-42	-179.6	55.8	0	0	0	0	110.3	F19 L20 R25 K26 I27	F19-T23 PolarHBondContact O-N 3.3Å; F19-T23 PolarHBondContact O-OG1 3.2Å; L20-T23 WeakPolarHBondContact CA-OG1 3.19Å; L20-T23 PolarHBondContact O-N 2.76Å; L20-T23 PolarHBondContact O-OG1 3.4Å; T23-R25 PolarHBondContact O-N 3.01Å; T23-K26 PolarHBondContact O-N 2.66Å; T23-I27 WeakPolarHBondContact O-CB 3.25Å; T23-I27 VanDerWaalsContact O-CG1 3.25Å; T23-I27 WeakPolarHBondContact O-CG1 3.42Å; T23-I27 PolarHBondContact O-N 3.32Å
24	E	95.6	Very high	95.2	Very high	88 Å²	88	85.6 Å²	85.6	41%	0.411	42%	0.423	S	S	.	.	H	α-helix	trans	-54.9	-53.8	173.7	-170.7	-165.1	162.6	0	0	111.3	L20 L22 K26 I27 L28	L20-E24 VanDerWaalsContact O-CB 3.3Å; L20-E24 WeakPolarHBondContact O-CB 3.29Å; L20-E24 PolarHBondContact O-N 3.04Å; L22-E24 VanDerWaalsContact C-N 3.33Å; E24-K26 VanDerWaalsContact C-N 3.27Å; E24-K26 PolarHBondContact O-N 3.33Å; E24-I27 PolarHBondContact O-N 3.31Å; E24-L28 HydrophobicContact CG-CD1 3.89Å; E24-L28 HydrophobicContact CG-CG 4.46Å; E24-L28 WeakPolarHBondContact O-CB 3.43Å; E24-L28 WeakPolarHBondContact O-CG 3.23Å; E24-L28 PolarHBondContact O-N 3.06Å
25	R	94.6	Very high	95	Very high	100 Å²	100	89.8 Å²	89.8	38%	0.377	44%	0.438	S	S	.	.	H	α-helix	trans	-60	-35.5	179	-72.8	179.9	-175.8	170	10.9	113.1	M21 L22 T23 G29 P37 D51	M21-R25 WeakPolarHBondContact O-CG 3.47Å; M21-R25 PolarHBondContact O-N 3.16Å; L22-R25 PolarHBondContact O-N 3.24Å; T23-R25 PolarHBondContact O-N 3.01Å; R25-G29 PolarHBondContact O-N 2.88Å; R25-P37 HydrophobicContact CB-CG 4.01Å; R25-D51 IonicContact CZ-OD2 3.23Å; R25-D51 VanDerWaalsContact CZ-OD2 3.23Å; R25-D51 IonicContact NH1-OD2 2.74Å; R25-D51 PolarHBondContact NH1-OD2 3.44Å; R25-D51 IonicContact NH2-OD2 2.88Å; R25-D51 PolarHBondContact NH2-OD2 3.29Å
26	K	93.5	Very high	94.9	Very high	35 Å²	35	86.6 Å²	86.6	15%	0.152	43%	0.425	C	S	.	.	H	α-helix	trans	-71.8	-50.5	177.1	-79.9	-171.4	175.3	-175.9	0	112	L22 T23 E24 L28 G29 Y30 P37 Y43	L22-K26 HydrophobicContact CD2-CD 3.92Å; L22-K26 HydrophobicContact CD2-CG 4.47Å; L22-K26 PolarHBondContact O-N 3.48Å; T23-K26 PolarHBondContact O-N 2.66Å; E24-K26 VanDerWaalsContact C-N 3.27Å; E24-K26 PolarHBondContact O-N 3.33Å; K26-L28 VanDerWaalsContact C-N 3.35Å; K26-L28 PolarHBondContact O-N 3.02Å; K26-G29 WeakPolarHBondContact O-CA 3.39Å; K26-G29 PolarHBondContact O-N 2.89Å; K26-G29 VanDerWaalsContact O-N 3.13Å; K26-Y30 HydrophobicContact CB-CE2 4.34Å; K26-Y30 WeakPolarHBondContact O-CD2 3.07Å; K26-Y30 PolarHBondContact O-N 3.1Å; K26-P37 WeakPolarHBondContact CE-O 3.38Å; K26-Y43 WeakPolarHBondContact CE-O 3.35Å; K26-Y43 PolarHBondContact NZ-O 3.05Å
27	I	96.6	Very high	94.7	Very high	93 Å²	93	85.2 Å²	85.2	48%	0.477	41%	0.411	S	S	.	.	H	α-helix	trans	-59.6	-47.9	-179.2	-67.4	166.1	0	0	0	109.6	T23 E24 G29 Y30 M31	T23-I27 WeakPolarHBondContact O-CB 3.25Å; T23-I27 VanDerWaalsContact O-CG1 3.25Å; T23-I27 WeakPolarHBondContact O-CG1 3.42Å; T23-I27 PolarHBondContact O-N 3.32Å; E24-I27 PolarHBondContact O-N 3.31Å; I27-G29 VanDerWaalsContact C-N 3.31Å; I27-G29 PolarHBondContact O-N 2.93Å; I27-Y30 PolarHBondContact O-N 2.64Å; I27-M31 HydrophobicContact CG2-CE 3.56Å; I27-M31 HydrophobicContact CG2-CG 4.47Å; I27-M31 HydrophobicContact CG2-SD 4.01Å; I27-M31 WeakPolarHBondContact O-CG 3.46Å; I27-M31 PolarHBondContact O-N 3.26Å
28	L	96.1	Very high	94.5	Very high	71 Å²	71	81.8 Å²	81.8	37%	0.372	40%	0.396	S	S	.	.	H	α-helix	trans	-61.9	-38	175.5	-70.6	175.6	0	0	0	112.4	E24 K26 M31 Q32	E24-L28 HydrophobicContact CG-CD1 3.89Å; E24-L28 HydrophobicContact CG-CG 4.46Å; E24-L28 WeakPolarHBondContact O-CB 3.43Å; E24-L28 WeakPolarHBondContact O-CG 3.23Å; E24-L28 PolarHBondContact O-N 3.06Å; K26-L28 VanDerWaalsContact C-N 3.35Å; K26-L28 PolarHBondContact O-N 3.02Å; L28-M31 HydrophobicContact CD2-SD 4.45Å; L28-Q32 VanDerWaalsContact O-CB 3.32Å; L28-Q32 WeakPolarHBondContact O-CB 3.5Å; L28-Q32 WeakPolarHBondContact O-CG 3.1Å; L28-Q32 PolarHBondContact O-N 2.87Å
29	G	95.5	Very high	94.4	Very high	1 Å²	1	86.8 Å²	86.8	1%	0.01	42%	0.422	C	S	.	.	H	α-helix	trans	-57.1	-53.6	173.2	0	0	0	0	0	111.3	R25 K26 I27 M31 Q32 L33 R34	R25-G29 PolarHBondContact O-N 2.88Å; K26-G29 WeakPolarHBondContact O-CA 3.39Å; K26-G29 PolarHBondContact O-N 2.89Å; K26-G29 VanDerWaalsContact O-N 3.13Å; I27-G29 VanDerWaalsContact C-N 3.31Å; I27-G29 PolarHBondContact O-N 2.93Å; G29-M31 PolarHBondContact O-N 3.18Å; G29-Q32 CarbonylContact O-C 3.51Å; G29-Q32 WeakPolarHBondContact O-CA 3.44Å; G29-Q32 PolarHBondContact O-N 3.15Å; G29-L33 PolarHBondContact O-N 3.21Å; G29-R34 CarbonylContact C-O 3.36Å; G29-R34 WeakPolarHBondContact CA-O 3.02Å; G29-R34 CarbonylContact O-C 3.36Å; G29-R34 WeakPolarHBondContact O-CG 3.35Å; G29-R34 PolarHBondContact O-N 3.24Å
30	Y	95.9	Very high	94.1	Very high	137 Å²	137	86.1 Å²	86.1	54%	0.537	42%	0.423	S	S	.	.	H	α-helix	trans	-63.7	-39.8	-178.7	-72.4	-65.4	0	0	0	112.7	K26 I27 Q32 L33 R34	K26-Y30 HydrophobicContact CB-CE2 4.34Å; K26-Y30 WeakPolarHBondContact O-CD2 3.07Å; K26-Y30 PolarHBondContact O-N 3.1Å; I27-Y30 PolarHBondContact O-N 2.64Å; Y30-Q32 PolarHBondContact O-N 3.5Å; Y30-L33 PolarHBondContact O-N 3.1Å; Y30-L33 VanDerWaalsContact O-N 3.11Å; Y30-R34 PolarHBondContact N-O 3.34Å
31	M	97.4	Very high	93.9	Very high	142 Å²	142	82.8 Å²	82.8	70%	0.7	41%	0.413	S	S	*	.	H	α-helix	trans	-59.7	-34.6	172.6	-71.8	175.1	173.6	0	0	112.2	I27 L28 G29 L33	I27-M31 HydrophobicContact CG2-CE 3.56Å; I27-M31 HydrophobicContact CG2-CG 4.47Å; I27-M31 HydrophobicContact CG2-SD 4.01Å; I27-M31 WeakPolarHBondContact O-CG 3.46Å; I27-M31 PolarHBondContact O-N 3.26Å; L28-M31 HydrophobicContact CD2-SD 4.45Å; G29-M31 PolarHBondContact O-N 3.18Å; M31-L33 VanDerWaalsContact C-N 3.31Å; M31-L33 PolarHBondContact O-N 2.98Å
32	Q	96.9	Very high	93.7	Very high	109 Å²	109	83.1 Å²	83.1	51%	0.509	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	13.5	177.9	-67	171.4	-2.7	0	0	113.5	L28 G29 Y30 R34	L28-Q32 VanDerWaalsContact O-CB 3.32Å; L28-Q32 WeakPolarHBondContact O-CB 3.5Å; L28-Q32 WeakPolarHBondContact O-CG 3.1Å; L28-Q32 PolarHBondContact O-N 2.87Å; G29-Q32 CarbonylContact O-C 3.51Å; G29-Q32 WeakPolarHBondContact O-CA 3.44Å; G29-Q32 PolarHBondContact O-N 3.15Å; Y30-Q32 PolarHBondContact O-N 3.5Å; Q32-R34 HydrophobicContact CB-CG 4.17Å; Q32-R34 PolarHBondContact O-N 3.47Å; Q32-R34 VanDerWaalsContact O-N 3.16Å
33	L	96	Very high	93.4	Very high	172 Å²	172	91.1 Å²	91.1	90%	0.901	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	27.5	-177.3	-61.7	169.9	0	0	0	114.4	G29 Y30 M31	G29-L33 PolarHBondContact O-N 3.21Å; Y30-L33 PolarHBondContact O-N 3.1Å; Y30-L33 VanDerWaalsContact O-N 3.11Å; M31-L33 VanDerWaalsContact C-N 3.31Å; M31-L33 PolarHBondContact O-N 2.98Å
34	R	95.1	Very high	93.2	Very high	153 Å²	153	88 Å²	88	58%	0.577	43%	0.433	S	S	*	.	S	Bend	trans	-123.9	163.5	173.2	66.3	179.5	179.1	126.8	-1.1	111.3	G29 Y30 Q32	G29-R34 CarbonylContact C-O 3.36Å; G29-R34 WeakPolarHBondContact CA-O 3.02Å; G29-R34 CarbonylContact O-C 3.36Å; G29-R34 WeakPolarHBondContact O-CG 3.35Å; G29-R34 PolarHBondContact O-N 3.24Å; Y30-R34 PolarHBondContact N-O 3.34Å; Q32-R34 HydrophobicContact CB-CG 4.17Å; Q32-R34 PolarHBondContact O-N 3.47Å; Q32-R34 VanDerWaalsContact O-N 3.16Å
35	K	90.5	Very high	93.1	Very high	166 Å²	166	87.8 Å²	87.8	72%	0.722	43%	0.434	S	S	*	.			trans	-82.7	139.1	174.5	-66.4	-178.8	-177.1	177.8	0	109.9
36	G	93.1	Very high	93	Very high	14 Å²	14	87.3 Å²	87.3	14%	0.144	44%	0.438	C	S	.	.			trans	-72	-172.2	165.7	0	0	0	0	0	112.5	N38	G36-N38 PolarHBondContact O-N 3.13Å; G36-N38 VanDerWaalsContact O-N 3.08Å
37	P	90.6	Very high	93	Very high	28 Å²	28	87.2 Å²	87.2	18%	0.182	44%	0.439	C	S	.	.	S	Bend	trans	-58.5	114.9	178	-20	31.2	0	0	0	110.8	R25 K26 G44 Q47	R25-P37 HydrophobicContact CB-CG 4.01Å; K26-P37 WeakPolarHBondContact CE-O 3.38Å; P37-G44 WeakPolarHBondContact O-CA 3.4Å; P37-Q47 HydrophobicContact CB-CB 4.42Å; P37-Q47 HydrophobicContact CB-CG 4.07Å; P37-Q47 HydrophobicContact CG-CG 4.42Å
38	N	91.3	Very high	92.8	Very high	50 Å²	50	83.4 Å²	83.4	27%	0.267	42%	0.42	S	S	.	.			trans	-128.3	-5.2	-179	-77.3	-12.1	0	0	0	113.5	G36	G36-N38 PolarHBondContact O-N 3.13Å; G36-N38 VanDerWaalsContact O-N 3.08Å
39	V	90.1	Very high	92.6	Very high	141 Å²	141	85.3 Å²	85.3	86%	0.855	43%	0.425	S	S	*	.	S	Bend	trans	-91.7	-40.6	-172.7	-178.1	0	0	0	0	112.4	G41	V39-G41 PolarHBondContact O-N 3.35Å
40	V	89.1	Confident	92.5	Very high	53 Å²	53	87.2 Å²	87.2	32%	0.321	44%	0.441	S	S	.	.	S	Bend	trans	-78.3	91	-177.5	-176.5	0	0	0	0	110.1	G44 L46 A50	V40-G44 CarbonylContact O-C 2.85Å; V40-G44 WeakPolarHBondContact O-CA 3.2Å; V40-L46 HydrophobicContact CG1-CB 4.08Å; V40-L46 PolarHBondContact O-N 3.34Å; V40-A50 HydrophobicContact CG1-CB 4.02Å
41	G	90.6	Very high	92.4	Very high	29 Å²	29	82.5 Å²	82.5	30%	0.299	43%	0.425	S	S	.	.	S	Bend	trans	79.2	178.1	-176.2	0	0	0	0	0	113.8	V39 Y43 G44	V39-G41 PolarHBondContact O-N 3.35Å; G41-Y43 PolarHBondContact O-N 3.1Å; G41-Y43 VanDerWaalsContact O-N 3.16Å; G41-G44 PolarHBondContact O-N 3.4Å
42	P	89.2	Confident	92.2	Very high	89 Å²	89	77.6 Å²	77.6	58%	0.578	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-61.7	120.4	-178.9	25.5	-32.7	0	0	0	109.9	G44 L45	P42-G44 PolarHBondContact O-N 3.25Å; P42-L45 HydrophobicContact CG-CD1 4.44Å; P42-L45 WeakPolarHBondContact O-CB 3.48Å; P42-L45 WeakPolarHBondContact O-CG 3.37Å; P42-L45 PolarHBondContact O-N 3.41Å; P42-L45 VanDerWaalsContact O-N 3.1Å
43	Y	89.7	Confident	92	Very high	177 Å²	177	78.9 Å²	78.9	69%	0.694	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	49.5	31.1	-173.6	-59.4	-81.2	0	0	0	113.6	K26 G41 L45	K26-Y43 WeakPolarHBondContact CE-O 3.35Å; K26-Y43 PolarHBondContact NZ-O 3.05Å; G41-Y43 PolarHBondContact O-N 3.1Å; G41-Y43 VanDerWaalsContact O-N 3.16Å; Y43-L45 VanDerWaalsContact C-N 3.29Å; Y43-L45 PolarHBondContact O-N 3.11Å
44	G	90	Very high	92	Very high	0 Å²	0	77.5 Å²	77.5	0%	0	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	75.8	5.6	178.5	0	0	0	0	0	115.9	L22 P37 V40 G41 P42 L46 Q47	L22-G44 WeakPolarHBondContact CD1-O 3.49Å; P37-G44 WeakPolarHBondContact O-CA 3.4Å; V40-G44 CarbonylContact O-C 2.85Å; V40-G44 WeakPolarHBondContact O-CA 3.2Å; G41-G44 PolarHBondContact O-N 3.4Å; P42-G44 PolarHBondContact O-N 3.25Å; G44-L46 PolarHBondContact O-N 2.77Å; G44-Q47 WeakPolarHBondContact O-CB 3.45Å; G44-Q47 PolarHBondContact O-N 3.4Å
45	L	92.6	Very high	91.8	Very high	83 Å²	83	76.4 Å²	76.4	44%	0.435	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-26.8	-175	-76.8	170.7	0	0	0	114.2	F19 P42 Y43 Q47 P48	F19-L45 HydrophobicContact CE1-CD2 4.14Å; P42-L45 HydrophobicContact CG-CD1 4.44Å; P42-L45 WeakPolarHBondContact O-CB 3.48Å; P42-L45 WeakPolarHBondContact O-CG 3.37Å; P42-L45 PolarHBondContact O-N 3.41Å; P42-L45 VanDerWaalsContact O-N 3.1Å; Y43-L45 VanDerWaalsContact C-N 3.29Å; Y43-L45 PolarHBondContact O-N 3.11Å; L45-Q47 VanDerWaalsContact C-N 3.33Å; L45-P48 WeakPolarHBondContact O-CD 3.44Å
46	L	93.9	Very high	91.9	Very high	91 Å²	91	77.2 Å²	77.2	48%	0.476	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-2.5	179.3	-64.7	175.2	0	0	0	113.3	V40 G44 F49 A50	V40-L46 HydrophobicContact CG1-CB 4.08Å; V40-L46 PolarHBondContact O-N 3.34Å; G44-L46 PolarHBondContact O-N 2.77Å; L46-F49 HydrophobicContact CD2-CD2 4.22Å; L46-F49 PolarHBondContact O-N 3.16Å; L46-A50 PolarHBondContact O-N 3.27Å; L46-A50 VanDerWaalsContact O-N 3.12Å
47	Q	92.5	Very high	92	Very high	33 Å²	33	82.1 Å²	82.1	15%	0.154	44%	0.438	C	S	.	.	H	α-helix	trans	-56.9	-44.7	-179.7	-172.6	72.6	43.2	0	0	113.7	L22 P37 G44 L45 F49 A50 D51	L22-Q47 HydrophobicContact CD1-CB 4.24Å; P37-Q47 HydrophobicContact CB-CB 4.42Å; P37-Q47 HydrophobicContact CB-CG 4.07Å; P37-Q47 HydrophobicContact CG-CG 4.42Å; G44-Q47 WeakPolarHBondContact O-CB 3.45Å; G44-Q47 PolarHBondContact O-N 3.4Å; L45-Q47 VanDerWaalsContact C-N 3.33Å; Q47-F49 VanDerWaalsContact C-N 3.29Å; Q47-F49 PolarHBondContact O-N 3.19Å; Q47-A50 PolarHBondContact O-N 3.22Å; Q47-D51 PolarHBondContact NE2-OD1 3.08Å; Q47-D51 PolarHBondContact O-N 3.21Å
48	P	92.9	Very high	92.3	Very high	13 Å²	13	87.2 Å²	87.2	8%	0.084	46%	0.457	C	S	.	.	H	α-helix	trans	-63.1	-36.7	-179	-23.1	35.9	0	0	0	112.6	A18 F19 L22 L45 D51 A52	A18-P48 HydrophobicContact CB-CB 3.89Å; A18-P48 WeakPolarHBondContact O-CB 3.43Å; A18-P48 VanDerWaalsContact O-CG 3.32Å; A18-P48 WeakPolarHBondContact O-CG 3.47Å; F19-P48 HydrophobicContact CD1-CG 4.34Å; L22-P48 HydrophobicContact CB-CG 3.87Å; L22-P48 HydrophobicContact CD1-CG 4.13Å; L45-P48 WeakPolarHBondContact O-CD 3.44Å; P48-D51 PolarHBondContact O-N 3.3Å; P48-A52 WeakPolarHBondContact O-CB 3.28Å; P48-A52 PolarHBondContact O-N 3.05Å
49	F	92.4	Very high	92.2	Very high	111 Å²	111	92.2 Å²	92.2	49%	0.487	48%	0.479	S	S	.	.	H	α-helix	trans	-67.4	-40.6	176.2	-64.4	-74.2	0	0	0	111.7	F19 L46 Q47 A52 M53	F19-F49 HydrophobicContact CZ-CE2 4.15Å; L46-F49 HydrophobicContact CD2-CD2 4.22Å; L46-F49 PolarHBondContact O-N 3.16Å; Q47-F49 VanDerWaalsContact C-N 3.29Å; Q47-F49 PolarHBondContact O-N 3.19Å; F49-A52 PolarHBondContact O-N 3.3Å; F49-M53 WeakPolarHBondContact O-CB 3.13Å; F49-M53 WeakPolarHBondContact O-CG 2.94Å; F49-M53 PolarHBondContact O-N 2.9Å
50	A	93.8	Very high	92.1	Very high	40 Å²	40	90.3 Å²	90.3	33%	0.331	47%	0.469	S	S	.	.	H	α-helix	trans	-64.4	-42.8	175.4	0	0	0	0	0	112.1	V40 L46 Q47 K54	V40-A50 HydrophobicContact CG1-CB 4.02Å; L46-A50 PolarHBondContact O-N 3.27Å; L46-A50 VanDerWaalsContact O-N 3.12Å; Q47-A50 PolarHBondContact O-N 3.22Å; A50-K54 VanDerWaalsContact O-CB 3.29Å; A50-K54 WeakPolarHBondContact O-CB 3.49Å; A50-K54 PolarHBondContact O-N 3.12Å
51	D	93.3	Very high	91.9	Very high	39 Å²	39	93.8 Å²	93.8	21%	0.209	49%	0.485	C	S	.	.	H	α-helix	trans	-64.6	-42.1	176.6	-75.6	4.4	0	0	0	111	R25 Q47 P48 K54 L55	R25-D51 IonicContact CZ-OD2 3.23Å; R25-D51 VanDerWaalsContact CZ-OD2 3.23Å; R25-D51 IonicContact NH1-OD2 2.74Å; R25-D51 PolarHBondContact NH1-OD2 3.44Å; R25-D51 IonicContact NH2-OD2 2.88Å; R25-D51 PolarHBondContact NH2-OD2 3.29Å; Q47-D51 PolarHBondContact NE2-OD1 3.08Å; Q47-D51 PolarHBondContact O-N 3.21Å; P48-D51 PolarHBondContact O-N 3.3Å; D51-K54 PolarHBondContact O-N 3.36Å; D51-L55 WeakPolarHBondContact O-CG 3.49Å; D51-L55 PolarHBondContact O-N 3.19Å
52	A	93	Very high	91.6	Very high	39 Å²	39	98.6 Å²	98.6	32%	0.322	50%	0.498	S	S	.	.	H	α-helix	trans	-63.2	-49.5	176.2	0	0	0	0	0	112.1	P48 F49 K54 L55 F56	P48-A52 WeakPolarHBondContact O-CB 3.28Å; P48-A52 PolarHBondContact O-N 3.05Å; F49-A52 PolarHBondContact O-N 3.3Å; A52-K54 VanDerWaalsContact C-N 3.29Å; A52-K54 PolarHBondContact O-N 3.46Å; A52-L55 PolarHBondContact O-N 3.48Å; A52-F56 HydrophobicContact CB-CE2 4.44Å; A52-F56 WeakPolarHBondContact O-CD2 3.34Å; A52-F56 PolarHBondContact O-N 3.07Å
53	M	93.5	Very high	91.1	Very high	136 Å²	136	96.8 Å²	96.8	67%	0.67	49%	0.486	S	S	*	.	H	α-helix	trans	-57.9	-44.3	176.4	-77.3	-170.6	178.7	0	0	111.3	F49 L55 F56 T57	F49-M53 WeakPolarHBondContact O-CB 3.13Å; F49-M53 WeakPolarHBondContact O-CG 2.94Å; F49-M53 PolarHBondContact O-N 2.9Å; M53-L55 VanDerWaalsContact C-N 3.33Å; M53-L55 PolarHBondContact O-N 3.06Å; M53-F56 PolarHBondContact O-N 2.88Å; M53-T57 WeakPolarHBondContact O-CG2 3.47Å; M53-T57 PolarHBondContact O-N 3.04Å; M53-T57 PolarHBondContact O-OG1 3.35Å; M53-T57 VanDerWaalsContact O-OG1 3.09Å
54	K	94.4	Very high	90.5	Very high	143 Å²	143	93.6 Å²	93.6	62%	0.622	50%	0.496	S	S	*	.	H	α-helix	trans	-57.1	-46.2	176.6	179.3	-178.5	177.9	-179.1	0	111.7	A50 D51 A52 T57 K58	A50-K54 VanDerWaalsContact O-CB 3.29Å; A50-K54 WeakPolarHBondContact O-CB 3.49Å; A50-K54 PolarHBondContact O-N 3.12Å; D51-K54 PolarHBondContact O-N 3.36Å; A52-K54 VanDerWaalsContact C-N 3.29Å; A52-K54 PolarHBondContact O-N 3.46Å; K54-T57 PolarHBondContact O-N 3.35Å; K54-T57 PolarHBondContact O-OG1 3.49Å; K54-T57 VanDerWaalsContact O-OG1 3.09Å; K54-K58 WeakPolarHBondContact O-CB 3.32Å; K54-K58 PolarHBondContact O-N 3.37Å; K54-K58 VanDerWaalsContact O-N 3.16Å
55	L	92.3	Very high	90.1	Very high	129 Å²	129	97.7 Å²	97.7	68%	0.675	52%	0.521	S	S	*	.	H	α-helix	trans	-65.7	-38.6	179.4	-71	173.3	0	0	0	112.4	D51 A52 M53 K58	D51-L55 WeakPolarHBondContact O-CG 3.49Å; D51-L55 PolarHBondContact O-N 3.19Å; A52-L55 PolarHBondContact O-N 3.48Å; M53-L55 VanDerWaalsContact C-N 3.33Å; M53-L55 PolarHBondContact O-N 3.06Å; L55-K58 PolarHBondContact O-N 3.46Å
56	F	92.6	Very high	89.6	Confident	183 Å²	183	94.4 Å²	94.4	80%	0.803	51%	0.505	S	S	*	.	H	α-helix	trans	-72.1	-32.2	178.1	-72.3	-55.5	0	0	0	114	A52 M53 K58	A52-F56 HydrophobicContact CB-CE2 4.44Å; A52-F56 WeakPolarHBondContact O-CD2 3.34Å; A52-F56 PolarHBondContact O-N 3.07Å; M53-F56 PolarHBondContact O-N 2.88Å; F56-K58 VanDerWaalsContact C-N 3.34Å
57	T	94.8	Very high	89.4	Confident	118 Å²	118	92.6 Å²	92.6	72%	0.724	50%	0.498	S	S	*	.	H	α-helix	trans	-80.6	-16.6	176.9	57.5	0	0	0	0	113.6	M53 K54	M53-T57 WeakPolarHBondContact O-CG2 3.47Å; M53-T57 PolarHBondContact O-N 3.04Å; M53-T57 PolarHBondContact O-OG1 3.35Å; M53-T57 VanDerWaalsContact O-OG1 3.09Å; K54-T57 PolarHBondContact O-N 3.35Å; K54-T57 PolarHBondContact O-OG1 3.49Å; K54-T57 VanDerWaalsContact O-OG1 3.09Å
58	K	95.6	Very high	89.1	Confident	135 Å²	135	96.3 Å²	96.3	59%	0.587	52%	0.518	S	S	*	.	S	Bend	trans	-73.9	139	-177	-169.3	174.2	-179.2	-174.8	0	109.8	K54 L55 F56	K54-K58 WeakPolarHBondContact O-CB 3.32Å; K54-K58 PolarHBondContact O-N 3.37Å; K54-K58 VanDerWaalsContact O-N 3.16Å; L55-K58 PolarHBondContact O-N 3.46Å; F56-K58 VanDerWaalsContact C-N 3.34Å
59	E	90.8	Very high	88.9	Confident	155 Å²	155	100.6 Å²	100.6	72%	0.724	54%	0.544	S	S	*	.			trans	-55.8	126.7	175.9	-172.6	-179.9	174.7	0	0	110.6	L61	E59-L61 PolarHBondContact O-N 3.29Å; E59-L61 VanDerWaalsContact O-N 3.09Å
60	P	86.6	Confident	88.8	Confident	100 Å²	100	97.1 Å²	97.1	65%	0.649	53%	0.53	S	S	*	.			trans	-71.3	106.2	178	28.1	-33	0	0	0	109.6	K62	P60-K62 PolarHBondContact O-N 3.4Å; P60-K62 VanDerWaalsContact O-N 3.12Å
61	L	85.4	Confident	88.6	Confident	127 Å²	127	99.1 Å²	99.1	67%	0.665	53%	0.53	S	S	*	.			trans	-71.2	105.8	176.5	-65.6	172.5	0	0	0	110	E59 Y71	E59-L61 PolarHBondContact O-N 3.29Å; E59-L61 VanDerWaalsContact O-N 3.09Å; L61-Y71 PolarHBondContact O-OH 2.84Å
62	K	83.6	Confident	88.5	Confident	130 Å²	130	101.1 Å²	101.1	57%	0.565	54%	0.539	S	S	*	.			trans	-103.6	114.8	171.6	-67.4	-178.9	-177.5	177.9	0	109.3	P60 A64	P60-K62 PolarHBondContact O-N 3.4Å; P60-K62 VanDerWaalsContact O-N 3.12Å; K62-A64 PolarHBondContact O-N 2.93Å
63	P	80.4	Confident	88.5	Confident	50 Å²	50	102 Å²	102	33%	0.325	54%	0.541	S	S	.	.			trans	-63.9	135	178	-17.1	28.9	0	0	0	111	T65 S66	P63-T65 PolarHBondContact O-N 3.47Å; P63-S66 WeakPolarHBondContact O-CB 3.4Å; P63-S66 PolarHBondContact O-N 3.27Å; P63-S66 VanDerWaalsContact O-N 3.15Å; P63-S66 PolarHBondContact O-OG 3.2Å
64	A	77	Confident	88.5	Confident	110 Å²	110	95.6 Å²	95.6	91%	0.909	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.7	-179.5	0	0	0	0	0	113.4	K62 S66	K62-A64 PolarHBondContact O-N 2.93Å; A64-S66 VanDerWaalsContact C-N 3.34Å
65	T	80.1	Confident	88.4	Confident	87 Å²	87	92.4 Å²	92.4	53%	0.534	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	0.5	-179.4	52.9	0	0	0	0	113.8	P63 N124	P63-T65 PolarHBondContact O-N 3.47Å; T65-N124 WeakPolarHBondContact O-CB 3.38Å; T65-N124 PolarHBondContact O-ND2 2.9Å
66	S	83.8	Confident	88.5	Confident	13 Å²	13	90 Å²	90	9%	0.091	50%	0.495	C	S	.	.	S	Bend	trans	-84.8	151.5	-172.6	66.1	0	0	0	0	113.9	P63 A64 I68 A122	P63-S66 WeakPolarHBondContact O-CB 3.4Å; P63-S66 PolarHBondContact O-N 3.27Å; P63-S66 VanDerWaalsContact O-N 3.15Å; P63-S66 PolarHBondContact O-OG 3.2Å; A64-S66 VanDerWaalsContact C-N 3.34Å; S66-I68 PolarHBondContact O-N 3.31Å; S66-A122 CarbonylContact C-O 3.56Å; S66-A122 WeakPolarHBondContact CA-O 3.47Å; S66-A122 WeakPolarHBondContact CB-O 3.31Å
67	T	88.9	Confident	88.6	Confident	54 Å²	54	83 Å²	83	33%	0.331	47%	0.465	S	S	.	.			trans	-80.4	103	168	54.3	0	0	0	0	109.4	T69 L70 Y71 W121 A122	T67-T69 VanDerWaalsContact C-N 3.28Å; T67-T69 PolarHBondContact O-N 3.14Å; T67-L70 PolarHBondContact O-N 3.03Å; T67-Y71 WeakPolarHBondContact O-CB 3.45Å; T67-Y71 PolarHBondContact O-N 3.39Å; T67-W121 HydrophobicContact CG2-CZ3 4.42Å; T67-A122 PolarHBondContact N-O 3.45Å; T67-A122 WeakPolarHBondContact OG1-CA 3.47Å; T67-A122 WeakPolarHBondContact OG1-CB 3.47Å
68	I	85.9	Confident	88.6	Confident	110 Å²	110	79.1 Å²	79.1	56%	0.564	45%	0.445	S	S	*	.	H	α-helix	trans	-56.8	-40.1	-169.5	-64	162.9	0	0	0	112.5	S66 I72	S66-I68 PolarHBondContact O-N 3.31Å; I68-I72 HydrophobicContact CG2-CD1 3.82Å; I68-I72 WeakPolarHBondContact O-CG1 3.43Å; I68-I72 PolarHBondContact O-N 2.73Å
69	T	89.5	Confident	88.6	Confident	103 Å²	103	77.1 Å²	77.1	63%	0.632	44%	0.441	S	S	*	.	H	α-helix	trans	-61.5	-53.8	-178.5	51.4	0	0	0	0	111.1	T67 Y71 I72 T73	T67-T69 VanDerWaalsContact C-N 3.28Å; T67-T69 PolarHBondContact O-N 3.14Å; T69-Y71 PolarHBondContact O-N 3.14Å; T69-I72 PolarHBondContact O-N 3.46Å; T69-T73 VanDerWaalsContact O-CG2 3.27Å; T69-T73 WeakPolarHBondContact O-CG2 3.46Å; T69-T73 PolarHBondContact O-N 3.27Å; T69-T73 PolarHBondContact O-OG1 3.08Å
70	L	89.3	Confident	88.8	Confident	39 Å²	39	73.4 Å²	73.4	20%	0.204	43%	0.428	C	S	.	.	H	α-helix	trans	-68.8	-34.3	-179.4	-68.7	174.4	0	0	0	112.8	T67 I72 T73 A74 W118 W121 A122	T67-L70 PolarHBondContact O-N 3.03Å; L70-I72 VanDerWaalsContact C-N 3.27Å; L70-I72 PolarHBondContact O-N 3.49Å; L70-T73 WeakPolarHBondContact CA-OG1 3.25Å; L70-T73 PolarHBondContact O-N 2.9Å; L70-T73 PolarHBondContact O-OG1 2.91Å; L70-A74 VanDerWaalsContact O-CB 3.23Å; L70-A74 WeakPolarHBondContact O-CB 3.35Å; L70-A74 PolarHBondContact O-N 2.85Å; L70-W118 HydrophobicContact CD2-CD2 4.05Å; L70-W118 HydrophobicContact CD2-CE3 4.2Å; L70-W118 HydrophobicContact CD2-CG 4.18Å; L70-W121 HydrophobicContact CD1-CE3 3.42Å; L70-W121 VanDerWaalsContact CD1-CE3 3.42Å; L70-W121 HydrophobicContact CD1-CZ3 3.36Å; L70-A122 HydrophobicContact CB-CB 3.71Å
71	Y	89.8	Confident	89.2	Confident	82 Å²	82	68.8 Å²	68.8	32%	0.322	40%	0.398	S	S	.	.	H	α-helix	trans	-63.9	-33.8	178.4	-169.2	-99.6	0	0	0	112.5	L61 T67 T69 P75 A122	L61-Y71 PolarHBondContact O-OH 2.84Å; T67-Y71 WeakPolarHBondContact O-CB 3.45Å; T67-Y71 PolarHBondContact O-N 3.39Å; T69-Y71 PolarHBondContact O-N 3.14Å; Y71-P75 WeakPolarHBondContact O-CD 3.46Å; Y71-A122 HydrophobicContact CD2-CB 4.5Å
72	I	91.3	Very high	89.7	Confident	80 Å²	80	65 Å²	65	41%	0.41	39%	0.385	S	S	.	.	H	α-helix	trans	-84.3	-40.1	176.8	-63.5	170.1	0	0	0	111	I68 T69 L70 P75 T76	I68-I72 HydrophobicContact CG2-CD1 3.82Å; I68-I72 WeakPolarHBondContact O-CG1 3.43Å; I68-I72 PolarHBondContact O-N 2.73Å; T69-I72 PolarHBondContact O-N 3.46Å; L70-I72 VanDerWaalsContact C-N 3.27Å; L70-I72 PolarHBondContact O-N 3.49Å; I72-P75 WeakPolarHBondContact O-CD 3.3Å; I72-P75 WeakPolarHBondContact O-CG 3.49Å; I72-T76 WeakPolarHBondContact O-CG2 3.16Å
73	T	93.1	Very high	90.2	Very high	57 Å²	57	60.6 Å²	60.6	35%	0.35	37%	0.368	S	S	.	.	H	α-helix	trans	-71.6	-34	-177.1	59	0	0	0	0	112.8	T69 L70 T76 L77	T69-T73 VanDerWaalsContact O-CG2 3.27Å; T69-T73 WeakPolarHBondContact O-CG2 3.46Å; T69-T73 PolarHBondContact O-N 3.27Å; T69-T73 PolarHBondContact O-OG1 3.08Å; L70-T73 WeakPolarHBondContact CA-OG1 3.25Å; L70-T73 PolarHBondContact O-N 2.9Å; L70-T73 PolarHBondContact O-OG1 2.91Å; T73-T76 WeakPolarHBondContact CA-OG1 3.48Å; T73-T76 PolarHBondContact O-N 3.21Å; T73-T76 PolarHBondContact O-OG1 3.09Å; T73-L77 WeakPolarHBondContact O-CB 3.34Å; T73-L77 PolarHBondContact O-N 3.13Å
74	A	93	Very high	90.9	Very high	2 Å²	2	62.2 Å²	62.2	2%	0.017	37%	0.373	C	S	.	.	H	α-helix	trans	-55.1	-54	-179.1	0	0	0	0	0	114.2	L70 T76 L77 A78 W118	L70-A74 VanDerWaalsContact O-CB 3.23Å; L70-A74 WeakPolarHBondContact O-CB 3.35Å; L70-A74 PolarHBondContact O-N 2.85Å; A74-T76 VanDerWaalsContact C-N 3.32Å; A74-T76 PolarHBondContact O-N 3.31Å; A74-L77 PolarHBondContact O-N 3.07Å; A74-A78 PolarHBondContact O-N 3.39Å; A74-W118 HydrophobicContact CB-CB 4.05Å
75	P	92.6	Very high	91.7	Very high	77 Å²	77	59.2 Å²	59.2	50%	0.5	34%	0.341	S	S	.	.	H	α-helix	trans	-66.9	-31.4	177.6	25.3	-34.3	0	0	0	112.9	Y71 I72 L79	Y71-P75 WeakPolarHBondContact O-CD 3.46Å; I72-P75 WeakPolarHBondContact O-CD 3.3Å; I72-P75 WeakPolarHBondContact O-CG 3.49Å; P75-L79 PolarHBondContact O-N 2.93Å; P75-L79 VanDerWaalsContact O-N 3.12Å
76	T	94.5	Very high	92.4	Very high	79 Å²	79	59.9 Å²	59.9	49%	0.485	33%	0.334	S	S	.	.	H	α-helix	trans	-66.4	-42.1	174.3	62.5	0	0	0	0	111.4	I72 T73 A74 L79 T80	I72-T76 WeakPolarHBondContact O-CG2 3.16Å; T73-T76 WeakPolarHBondContact CA-OG1 3.48Å; T73-T76 PolarHBondContact O-N 3.21Å; T73-T76 PolarHBondContact O-OG1 3.09Å; A74-T76 VanDerWaalsContact C-N 3.32Å; A74-T76 PolarHBondContact O-N 3.31Å; T76-L79 PolarHBondContact O-N 3.48Å; T76-T80 VanDerWaalsContact O-CG2 3.26Å; T76-T80 WeakPolarHBondContact O-CG2 3.41Å; T76-T80 PolarHBondContact O-N 2.91Å; T76-T80 PolarHBondContact O-OG1 3.49Å
77	L	95.5	Very high	92.8	Very high	34 Å²	34	60.4 Å²	60.4	18%	0.178	34%	0.337	C	S	.	.	H	α-helix	trans	-63.7	-45.9	177.6	-174.4	133.7	0	0	0	110.6	T73 A74 L79 T80 I81 W118	T73-L77 WeakPolarHBondContact O-CB 3.34Å; T73-L77 PolarHBondContact O-N 3.13Å; A74-L77 PolarHBondContact O-N 3.07Å; L77-L79 PolarHBondContact O-N 3.26Å; L77-T80 WeakPolarHBondContact CA-OG1 3.47Å; L77-T80 PolarHBondContact O-N 3.33Å; L77-T80 PolarHBondContact O-OG1 3.47Å; L77-I81 HydrophobicContact CD2-CD1 3.36Å; L77-I81 HydrophobicContact CD2-CG1 4.42Å; L77-I81 HydrophobicContact CG-CD1 3.86Å; L77-I81 HydrophobicContact CG-CG1 4.48Å; L77-I81 WeakPolarHBondContact O-CG1 3.34Å; L77-I81 PolarHBondContact O-N 3.38Å; L77-W118 HydrophobicContact CD1-CE3 4.49Å; L77-W118 HydrophobicContact CD1-CH2 4.18Å; L77-W118 HydrophobicContact CD1-CZ3 3.71Å
78	A	94.8	Very high	93	Very high	37 Å²	37	58 Å²	58	31%	0.306	32%	0.322	S	S	.	.	H	α-helix	trans	-54.8	-49.4	175.5	0	0	0	0	0	112.3	A74 T80 I81 A82	A74-A78 PolarHBondContact O-N 3.39Å; A78-T80 PolarHBondContact O-N 2.97Å; A78-I81 PolarHBondContact O-N 3.02Å; A78-A82 WeakPolarHBondContact O-CB 3.47Å; A78-A82 PolarHBondContact O-N 2.88Å
79	L	95.1	Very high	93.4	Very high	94 Å²	94	55.5 Å²	55.5	49%	0.492	31%	0.309	S	S	.	.	H	α-helix	trans	-64.5	-41.2	178.8	-173.9	70.3	0	0	0	111.9	P75 T76 L77 A82 L83	P75-L79 PolarHBondContact O-N 2.93Å; P75-L79 VanDerWaalsContact O-N 3.12Å; T76-L79 PolarHBondContact O-N 3.48Å; L77-L79 PolarHBondContact O-N 3.26Å; L79-A82 PolarHBondContact O-N 3.34Å; L79-L83 HydrophobicContact CG-CD1 4.28Å; L79-L83 WeakPolarHBondContact O-CG 3.44Å; L79-L83 PolarHBondContact O-N 3.39Å
80	T	95.1	Very high	93.4	Very high	76 Å²	76	52 Å²	52	47%	0.466	29%	0.288	S	S	.	.	H	α-helix	trans	-63.8	-43.2	179.1	56.2	0	0	0	0	112.3	T76 L77 A78 L83 L84	T76-T80 VanDerWaalsContact O-CG2 3.26Å; T76-T80 WeakPolarHBondContact O-CG2 3.41Å; T76-T80 PolarHBondContact O-N 2.91Å; T76-T80 PolarHBondContact O-OG1 3.49Å; L77-T80 WeakPolarHBondContact CA-OG1 3.47Å; L77-T80 PolarHBondContact O-N 3.33Å; L77-T80 PolarHBondContact O-OG1 3.47Å; A78-T80 PolarHBondContact O-N 2.97Å; T80-L83 PolarHBondContact O-N 3.07Å; T80-L84 WeakPolarHBondContact O-CB 3.19Å; T80-L84 VanDerWaalsContact O-CG 3.25Å; T80-L84 WeakPolarHBondContact O-CG 3.32Å; T80-L84 PolarHBondContact O-N 2.89Å
81	I	95.6	Very high	93.4	Very high	4 Å²	4	55.5 Å²	55.5	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-65.7	-44.7	177.7	-65.1	170.1	0	0	0	110.2	L77 A78 L83 L84 L85 T108 L111 A112	L77-I81 HydrophobicContact CD2-CD1 3.36Å; L77-I81 HydrophobicContact CD2-CG1 4.42Å; L77-I81 HydrophobicContact CG-CD1 3.86Å; L77-I81 HydrophobicContact CG-CG1 4.48Å; L77-I81 WeakPolarHBondContact O-CG1 3.34Å; L77-I81 PolarHBondContact O-N 3.38Å; A78-I81 PolarHBondContact O-N 3.02Å; I81-L83 VanDerWaalsContact C-N 3.27Å; I81-L83 PolarHBondContact O-N 3.33Å; I81-L84 PolarHBondContact O-N 3.16Å; I81-L84 VanDerWaalsContact O-N 3.15Å; I81-L85 HydrophobicContact CG2-CD1 4.37Å; I81-L85 PolarHBondContact O-N 3.34Å; I81-L85 VanDerWaalsContact O-N 3.11Å; I81-T108 VanDerWaalsContact CG2-O 3.24Å; I81-T108 WeakPolarHBondContact CG2-O 3.48Å; I81-L111 HydrophobicContact CD1-CB 3.94Å; I81-L111 HydrophobicContact CD1-CD2 3.85Å; I81-L111 HydrophobicContact CD1-CG 3.7Å; I81-L111 HydrophobicContact CG1-CD2 4.16Å; I81-A112 HydrophobicContact CG2-CB 4.11Å
82	A	94.5	Very high	93.2	Very high	46 Å²	46	56.8 Å²	56.8	38%	0.38	32%	0.323	S	S	.	.	H	α-helix	trans	-56.8	-40.5	177.8	0	0	0	0	0	112.1	A78 L79 W86	A78-A82 WeakPolarHBondContact O-CB 3.47Å; A78-A82 PolarHBondContact O-N 2.88Å; L79-A82 PolarHBondContact O-N 3.34Å; A82-W86 PolarHBondContact O-NE1 2.81Å
83	L	94.3	Very high	93.1	Very high	39 Å²	39	59.3 Å²	59.3	20%	0.204	34%	0.338	C	S	.	.	H	α-helix	trans	-74.9	-35.3	177.1	-67.9	175.1	0	0	0	113.1	I10 L79 T80 I81 L85 W86	I10-L83 HydrophobicContact CG2-CD1 4.23Å; I10-L83 HydrophobicContact CG2-CD2 4.08Å; L79-L83 HydrophobicContact CG-CD1 4.28Å; L79-L83 WeakPolarHBondContact O-CG 3.44Å; L79-L83 PolarHBondContact O-N 3.39Å; T80-L83 PolarHBondContact O-N 3.07Å; I81-L83 VanDerWaalsContact C-N 3.27Å; I81-L83 PolarHBondContact O-N 3.33Å; L83-L85 VanDerWaalsContact C-N 3.32Å; L83-L85 PolarHBondContact O-N 3.04Å; L83-W86 PolarHBondContact O-N 3.02Å
84	L	94.4	Very high	93.1	Very high	84 Å²	84	57.8 Å²	57.8	44%	0.44	33%	0.329	S	S	.	.	H	α-helix	trans	-63.8	-36.7	178.5	-77.9	169	0	0	0	112.6	T80 I81 W86 T87	T80-L84 WeakPolarHBondContact O-CB 3.19Å; T80-L84 VanDerWaalsContact O-CG 3.25Å; T80-L84 WeakPolarHBondContact O-CG 3.32Å; T80-L84 PolarHBondContact O-N 2.89Å; I81-L84 PolarHBondContact O-N 3.16Å; I81-L84 VanDerWaalsContact O-N 3.15Å; L84-W86 PolarHBondContact O-N 3.11Å; L84-W86 VanDerWaalsContact O-N 3.11Å; L84-T87 WeakPolarHBondContact O-CB 3.34Å; L84-T87 WeakPolarHBondContact O-CG2 3.44Å; L84-T87 PolarHBondContact O-N 3.2Å; L84-T87 PolarHBondContact O-OG1 3.45Å
85	L	94.7	Very high	93.1	Very high	46 Å²	46	60.8 Å²	60.8	24%	0.241	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-23.9	178.5	-81.4	166.4	0	0	0	113.7	I81 L83 P88 I105 T108	I81-L85 HydrophobicContact CG2-CD1 4.37Å; I81-L85 PolarHBondContact O-N 3.34Å; I81-L85 VanDerWaalsContact O-N 3.11Å; L83-L85 VanDerWaalsContact C-N 3.32Å; L83-L85 PolarHBondContact O-N 3.04Å; L85-P88 WeakPolarHBondContact O-CD 3.43Å; L85-I105 HydrophobicContact CD2-CB 4.34Å; L85-I105 HydrophobicContact CD2-CG1 4.47Å; L85-I105 HydrophobicContact CD2-CG2 3.89Å; L85-T108 WeakPolarHBondContact CD2-OG1 3.43Å
86	W	94.4	Very high	93	Very high	101 Å²	101	60.1 Å²	60.1	38%	0.383	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-17.2	178.7	-66.5	88.8	0	0	0	114.2	L9 I13 A82 L83 L84 L89 M91	L9-W86 HydrophobicContact CD2-CB 4.37Å; I13-W86 HydrophobicContact CD1-CB 3.77Å; I13-W86 HydrophobicContact CD1-CD2 3.72Å; I13-W86 HydrophobicContact CD1-CE3 4.11Å; I13-W86 HydrophobicContact CD1-CG 3.55Å; I13-W86 HydrophobicContact CG1-CD2 4.26Å; I13-W86 HydrophobicContact CG1-CE3 4.43Å; I13-W86 HydrophobicContact CG2-CZ2 4.47Å; A82-W86 PolarHBondContact O-NE1 2.81Å; L83-W86 PolarHBondContact O-N 3.02Å; L84-W86 PolarHBondContact O-N 3.11Å; L84-W86 VanDerWaalsContact O-N 3.11Å; W86-L89 HydrophobicContact CD2-CD1 4.18Å; W86-L89 HydrophobicContact CE3-CD1 3.71Å; W86-L89 HydrophobicContact CZ3-CD1 4.19Å; W86-L89 PolarHBondContact O-N 3.22Å; W86-M91 HydrophobicContact CE3-CE 3.63Å; W86-M91 HydrophobicContact CZ3-CE 3.61Å
87	T	92.2	Very high	92.9	Very high	24 Å²	24	61.4 Å²	61.4	15%	0.147	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-38.9	-173	63.4	0	0	0	0	115.3	L84 L95 V96	L84-T87 WeakPolarHBondContact O-CB 3.34Å; L84-T87 WeakPolarHBondContact O-CG2 3.44Å; L84-T87 PolarHBondContact O-N 3.2Å; L84-T87 PolarHBondContact O-OG1 3.45Å; T87-L95 HydrophobicContact CG2-CD2 4.07Å; T87-L95 PolarHBondContact O-N 3.05Å; T87-V96 PolarHBondContact O-N 3.29Å; T87-V96 VanDerWaalsContact O-N 3.14Å
88	P	93.3	Very high	92.8	Very high	3 Å²	3	62.4 Å²	62.4	2%	0.019	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-8.2	178.9	39.2	-40.6	0	0	0	113.2	L85 P90 P94 L98 F104 I105 L162	L85-P88 WeakPolarHBondContact O-CD 3.43Å; P88-P90 WeakPolarHBondContact O-CD 3.41Å; P88-P94 WeakPolarHBondContact O-CB 3.48Å; P88-L98 HydrophobicContact CB-CD1 4.39Å; P88-F104 HydrophobicContact CB-CD1 4.45Å; P88-F104 HydrophobicContact CG-CD1 3.86Å; P88-F104 HydrophobicContact CG-CE1 4.17Å; P88-I105 HydrophobicContact CG-CD1 4.15Å; P88-I105 HydrophobicContact CG-CG1 3.86Å; P88-L162 HydrophobicContact CB-CD1 4.04Å; P88-L162 HydrophobicContact CG-CD1 4.26Å; P88-L162 WeakPolarHBondContact O-CD1 3.25Å
89	L	93.7	Very high	92.7	Very high	58 Å²	58	66.4 Å²	66.4	30%	0.304	36%	0.364	S	S	.	.			trans	-66.3	123.7	-176.1	-71.5	176.9	0	0	0	110.3	W86 M91 I105	W86-L89 HydrophobicContact CD2-CD1 4.18Å; W86-L89 HydrophobicContact CE3-CD1 3.71Å; W86-L89 HydrophobicContact CZ3-CD1 4.19Å; W86-L89 PolarHBondContact O-N 3.22Å; L89-M91 HydrophobicContact CB-CE 4.45Å; L89-M91 PolarHBondContact O-N 2.92Å; L89-I105 HydrophobicContact CD2-CD1 4Å
90	P	91.2	Very high	92.6	Very high	29 Å²	29	66.4 Å²	66.4	19%	0.188	36%	0.364	C	S	.	.			trans	-80.1	118.3	-178.1	32.6	-34.9	0	0	0	110.2	P88 L162 I166	P88-P90 WeakPolarHBondContact O-CD 3.41Å; P90-L162 HydrophobicContact CG-CB 3.86Å; P90-I166 HydrophobicContact CB-CD1 3.66Å; P90-I166 HydrophobicContact CG-CD1 3.79Å; P90-I166 HydrophobicContact CG-CG1 4.29Å
91	M	88	Confident	92.6	Very high	114 Å²	114	62.8 Å²	62.8	56%	0.562	34%	0.342	S	S	*	.	S	Bend	trans	-134	88.7	175.2	-62.3	-177	-166.2	0	0	112	W86 L89 N93	W86-M91 HydrophobicContact CE3-CE 3.63Å; W86-M91 HydrophobicContact CZ3-CE 3.61Å; L89-M91 HydrophobicContact CB-CE 4.45Å; L89-M91 PolarHBondContact O-N 2.92Å; M91-N93 PolarHBondContact N-O 3.38Å; M91-N93 PolarHBondContact O-N 3.5Å
92	P	86.1	Confident	92.4	Very high	108 Å²	108	63 Å²	63	70%	0.701	34%	0.344	S	S	*	.	S	Bend		-51.8	-16.6	-55.1	28.7	-37.5	0	0	0	114.6
93	N	89.6	Confident	92.4	Very high	134 Å²	134	64.5 Å²	64.5	72%	0.717	35%	0.345	S	S	*	.	S	Bend	trans	-104.9	133.3	172.1	-68	-34.4	0	0	0	109.4	M91	M91-N93 PolarHBondContact N-O 3.38Å; M91-N93 PolarHBondContact O-N 3.5Å
94	P	92.9	Very high	92.4	Very high	25 Å²	25	65.6 Å²	65.6	16%	0.162	35%	0.348	C	S	.	.			trans	-74.1	156.8	175.9	31.5	-35.3	0	0	0	111.5	P88 V96 N97	P88-P94 WeakPolarHBondContact O-CB 3.48Å; P94-V96 VanDerWaalsContact C-N 3.33Å; P94-N97 HydrophobicContact CG-CB 3.89Å
95	L	91.9	Very high	92.4	Very high	64 Å²	64	63.6 Å²	63.6	34%	0.335	34%	0.337	S	S	.	.	S	Bend	trans	-63.6	-44	171.9	-173.4	87	0	0	0	110.3	N5 L9 T87	N5-L95 HydrophobicContact CB-CD1 3.78Å; L9-L95 HydrophobicContact CD2-CB 4.26Å; L9-L95 HydrophobicContact CD2-CD2 3.96Å; L9-L95 HydrophobicContact CD2-CG 4.47Å; T87-L95 HydrophobicContact CG2-CD2 4.07Å; T87-L95 PolarHBondContact O-N 3.05Å
96	V	91.9	Very high	92.3	Very high	64 Å²	64	62.9 Å²	62.9	39%	0.388	33%	0.333	S	S	.	.	S	Bend	trans	-124.7	111.3	175.3	-174.2	0	0	0	0	108.3	T87 P94 L98	T87-V96 PolarHBondContact O-N 3.29Å; T87-V96 VanDerWaalsContact O-N 3.14Å; P94-V96 VanDerWaalsContact C-N 3.33Å; V96-L98 HydrophobicContact CG1-CD2 3.67Å; V96-L98 HydrophobicContact CG1-CG 3.88Å; V96-L98 PolarHBondContact O-N 3.41Å
97	N	91.8	Very high	92.3	Very high	105 Å²	105	60.9 Å²	60.9	56%	0.561	34%	0.338	S	S	*	.			trans	-79	105	175.4	-170	0.3	0	0	0	109.7	P94 N161	P94-N97 HydrophobicContact CG-CB 3.89Å; N97-N161 PolarHBondContact OD1-ND2 3.45Å
98	L	93.1	Very high	92.4	Very high	56 Å²	56	60.5 Å²	60.5	29%	0.293	34%	0.336	S	S	.	.			trans	-106.3	130.7	178.8	-63.5	177.8	0	0	0	110	P88 V96 L100 G101 F104 N161	P88-L98 HydrophobicContact CB-CD1 4.39Å; V96-L98 HydrophobicContact CG1-CD2 3.67Å; V96-L98 HydrophobicContact CG1-CG 3.88Å; V96-L98 PolarHBondContact O-N 3.41Å; L98-L100 PolarHBondContact O-N 3.11Å; L98-G101 PolarHBondContact O-N 2.92Å; L98-F104 HydrophobicContact CD1-CB 4.08Å; L98-F104 HydrophobicContact CD1-CD1 4.25Å; L98-F104 HydrophobicContact CD1-CD2 4.05Å; L98-F104 HydrophobicContact CD1-CG 3.86Å; L98-N161 PolarHBondContact O-OD1 3.16Å
99	N	93	Very high	92.4	Very high	120 Å²	120	60.8 Å²	60.8	64%	0.642	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-32.8	175.2	-167.9	21.9	0	0	0	112.3	F160 N161	N99-F160 CarbonylContact O-C 3.16Å; N99-N161 PolarHBondContact O-N 3.15Å
100	L	93.9	Very high	92.3	Very high	94 Å²	94	60.3 Å²	60.3	49%	0.492	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	41.4	177.4	-55.7	179.3	0	0	0	111.3	L98 L102 L103 F104 F160	L98-L100 PolarHBondContact O-N 3.11Å; L100-L102 VanDerWaalsContact C-N 3.29Å; L100-L102 PolarHBondContact O-N 2.98Å; L100-L103 HydrophobicContact CB-CB 4.31Å; L100-L103 HydrophobicContact CB-CD1 4.12Å; L100-L103 HydrophobicContact CD1-CD1 4.37Å; L100-L103 HydrophobicContact CD2-CD1 3.98Å; L100-L103 HydrophobicContact CG-CD1 4.37Å; L100-L103 PolarHBondContact O-N 2.97Å; L100-F104 PolarHBondContact O-N 3.29Å; L100-F160 HydrophobicContact CD2-CB 3.97Å; L100-F160 HydrophobicContact CD2-CD2 4.17Å; L100-F160 HydrophobicContact CD2-CG 4.3Å
101	G	93.4	Very high	92.4	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-57.6	-37.4	-174.6	0	0	0	0	0	114	L98 F104 I105 F160	L98-G101 PolarHBondContact O-N 2.92Å; G101-F104 WeakPolarHBondContact O-CB 3.13Å; G101-F104 PolarHBondContact O-N 3.27Å; G101-I105 PolarHBondContact O-N 3.46Å; G101-I105 VanDerWaalsContact O-N 3.16Å; G101-F160 PolarHBondContact N-O 2.89Å
102	L	92.7	Very high	92.6	Very high	9 Å²	9	58.8 Å²	58.8	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-72.7	-40.3	-179.9	-162.9	151.7	0	0	0	112.6	L100 F104 I105 L106 L150 L154 F160 L162	L100-L102 VanDerWaalsContact C-N 3.29Å; L100-L102 PolarHBondContact O-N 2.98Å; L102-F104 VanDerWaalsContact C-N 3.26Å; L102-F104 PolarHBondContact O-N 3.29Å; L102-I105 PolarHBondContact O-N 3.02Å; L102-L106 HydrophobicContact CD2-CD1 4.09Å; L102-L106 PolarHBondContact O-N 2.96Å; L102-L106 VanDerWaalsContact O-N 3.14Å; L102-L150 HydrophobicContact CD1-CD2 3.69Å; L102-L150 HydrophobicContact CD2-CB 3.99Å; L102-L150 HydrophobicContact CD2-CD1 3.82Å; L102-L150 HydrophobicContact CD2-CD2 3.88Å; L102-L150 HydrophobicContact CD2-CG 4.09Å; L102-L150 HydrophobicContact CG-CD2 4.09Å; L102-L154 HydrophobicContact CD1-CD1 3.88Å; L102-L154 HydrophobicContact CD1-CD2 3.57Å; L102-L154 HydrophobicContact CD1-CG 3.82Å; L102-L154 HydrophobicContact CD2-CD1 3.8Å; L102-L154 HydrophobicContact CG-CD1 4.27Å; L102-F160 WeakPolarHBondContact CB-O 3.39Å; L102-F160 PolarHBondContact N-O 3Å; L102-L162 HydrophobicContact CB-CD2 4.32Å; L102-L162 HydrophobicContact CD1-CD2 4.31Å; L102-L162 HydrophobicContact CG-CD2 4.5Å
103	L	93.6	Very high	93	Very high	76 Å²	76	54.3 Å²	54.3	40%	0.398	31%	0.307	S	S	.	.	H	α-helix	trans	-63.3	-35.7	172.9	-76.4	157.5	0	0	0	111.6	L100 L106 A107 F160	L100-L103 HydrophobicContact CB-CB 4.31Å; L100-L103 HydrophobicContact CB-CD1 4.12Å; L100-L103 HydrophobicContact CD1-CD1 4.37Å; L100-L103 HydrophobicContact CD2-CD1 3.98Å; L100-L103 HydrophobicContact CG-CD1 4.37Å; L100-L103 PolarHBondContact O-N 2.97Å; L103-L106 PolarHBondContact O-N 3.43Å; L103-A107 WeakPolarHBondContact O-CB 3.06Å; L103-A107 PolarHBondContact O-N 3.42Å; L103-F160 HydrophobicContact CD1-CB 4.39Å; L103-F160 HydrophobicContact CD1-CD1 3.68Å; L103-F160 HydrophobicContact CD1-CD2 4.23Å; L103-F160 HydrophobicContact CD1-CE1 3.93Å; L103-F160 HydrophobicContact CD1-CE2 4.46Å; L103-F160 HydrophobicContact CD1-CG 3.85Å; L103-F160 HydrophobicContact CD1-CZ 4.32Å; L103-F160 HydrophobicContact CD2-CE1 4.39Å; L103-F160 HydrophobicContact CG-CD1 3.76Å; L103-F160 HydrophobicContact CG-CE1 4.02Å; L103-F160 HydrophobicContact CG-CG 4.37Å
104	F	95.1	Very high	93.1	Very high	63 Å²	63	53.6 Å²	53.6	28%	0.276	30%	0.295	S	S	.	.	H	α-helix	trans	-60.2	-45.9	173.3	175	-90.2	0	0	0	111.3	P88 L98 L100 G101 L102 L106 A107 T108	P88-F104 HydrophobicContact CB-CD1 4.45Å; P88-F104 HydrophobicContact CG-CD1 3.86Å; P88-F104 HydrophobicContact CG-CE1 4.17Å; L98-F104 HydrophobicContact CD1-CB 4.08Å; L98-F104 HydrophobicContact CD1-CD1 4.25Å; L98-F104 HydrophobicContact CD1-CD2 4.05Å; L98-F104 HydrophobicContact CD1-CG 3.86Å; L100-F104 PolarHBondContact O-N 3.29Å; G101-F104 WeakPolarHBondContact O-CB 3.13Å; G101-F104 PolarHBondContact O-N 3.27Å; L102-F104 VanDerWaalsContact C-N 3.26Å; L102-F104 PolarHBondContact O-N 3.29Å; F104-L106 PolarHBondContact O-N 2.92Å; F104-A107 PolarHBondContact O-N 3.17Å; F104-T108 HydrophobicContact CD1-CG2 4.25Å; F104-T108 HydrophobicContact CD2-CG2 4.29Å; F104-T108 HydrophobicContact CE1-CG2 3.85Å; F104-T108 HydrophobicContact CE2-CG2 3.87Å; F104-T108 HydrophobicContact CG-CG2 4.47Å; F104-T108 HydrophobicContact CZ-CG2 3.65Å; F104-T108 WeakPolarHBondContact O-CG2 3.47Å; F104-T108 PolarHBondContact O-N 3.37Å; F104-T108 PolarHBondContact O-OG1 3.2Å
105	I	94.3	Very high	93.2	Very high	41 Å²	41	53 Å²	53	21%	0.21	29%	0.292	C	S	.	.	H	α-helix	trans	-56.8	-51	176.4	-69.5	175.7	0	0	0	110.6	L85 P88 L89 G101 L102 A107 T108 S109 L162	L85-I105 HydrophobicContact CD2-CB 4.34Å; L85-I105 HydrophobicContact CD2-CG1 4.47Å; L85-I105 HydrophobicContact CD2-CG2 3.89Å; P88-I105 HydrophobicContact CG-CD1 4.15Å; P88-I105 HydrophobicContact CG-CG1 3.86Å; L89-I105 HydrophobicContact CD2-CD1 4Å; G101-I105 PolarHBondContact O-N 3.46Å; G101-I105 VanDerWaalsContact O-N 3.16Å; L102-I105 PolarHBondContact O-N 3.02Å; I105-A107 PolarHBondContact O-N 3.41Å; I105-T108 PolarHBondContact O-N 3.41Å; I105-T108 PolarHBondContact O-OG1 2.9Å; I105-S109 PolarHBondContact O-N 2.93Å; I105-S109 PolarHBondContact O-OG 3.47Å; I105-L162 HydrophobicContact CD1-CD1 3.6Å; I105-L162 HydrophobicContact CD1-CD2 4.47Å
106	L	93.3	Very high	93.3	Very high	31 Å²	31	52.9 Å²	52.9	16%	0.162	29%	0.29	C	S	.	.	H	α-helix	trans	-58.2	-43	177.5	-106	156.9	0	0	0	113.2	L102 L103 F104 S109 S110 L146 A147 L150	L102-L106 HydrophobicContact CD2-CD1 4.09Å; L102-L106 PolarHBondContact O-N 2.96Å; L102-L106 VanDerWaalsContact O-N 3.14Å; L103-L106 PolarHBondContact O-N 3.43Å; F104-L106 PolarHBondContact O-N 2.92Å; L106-S109 PolarHBondContact O-OG 2.74Å; L106-S109 VanDerWaalsContact O-OG 3.09Å; L106-S110 PolarHBondContact O-N 3.4Å; L106-S110 PolarHBondContact O-OG 2.93Å; L106-L146 HydrophobicContact CD2-CD2 4.42Å; L106-A147 HydrophobicContact CD1-CB 4.29Å; L106-A147 HydrophobicContact CD2-CB 3.88Å; L106-L150 HydrophobicContact CD1-CD1 3.63Å; L106-L150 HydrophobicContact CG-CD1 3.98Å
107	A	93.8	Very high	93.4	Very high	59 Å²	59	52.4 Å²	52.4	49%	0.488	29%	0.286	S	S	.	.	H	α-helix	trans	-67.3	-39.7	178.3	0	0	0	0	0	111.5	L103 F104 I105 S110 L111	L103-A107 WeakPolarHBondContact O-CB 3.06Å; L103-A107 PolarHBondContact O-N 3.42Å; F104-A107 PolarHBondContact O-N 3.17Å; I105-A107 PolarHBondContact O-N 3.41Å; A107-S110 PolarHBondContact O-OG 3.49Å; A107-L111 PolarHBondContact O-N 2.86Å
108	T	94.4	Very high	93.5	Very high	16 Å²	16	51.7 Å²	51.7	10%	0.098	28%	0.275	C	S	.	.	H	α-helix	trans	-74.1	-32.2	178.5	53.6	0	0	0	0	113.1	I81 L85 F104 I105 L111 A112	I81-T108 VanDerWaalsContact CG2-O 3.24Å; I81-T108 WeakPolarHBondContact CG2-O 3.48Å; L85-T108 WeakPolarHBondContact CD2-OG1 3.43Å; F104-T108 HydrophobicContact CD1-CG2 4.25Å; F104-T108 HydrophobicContact CD2-CG2 4.29Å; F104-T108 HydrophobicContact CE1-CG2 3.85Å; F104-T108 HydrophobicContact CE2-CG2 3.87Å; F104-T108 HydrophobicContact CG-CG2 4.47Å; F104-T108 HydrophobicContact CZ-CG2 3.65Å; F104-T108 WeakPolarHBondContact O-CG2 3.47Å; F104-T108 PolarHBondContact O-N 3.37Å; F104-T108 PolarHBondContact O-OG1 3.2Å; I105-T108 PolarHBondContact O-N 3.41Å; I105-T108 PolarHBondContact O-OG1 2.9Å; T108-L111 WeakPolarHBondContact O-CB 3.49Å; T108-L111 PolarHBondContact O-N 3.41Å; T108-A112 PolarHBondContact O-N 3.14Å
109	S	92.1	Very high	93.5	Very high	10 Å²	10	51.4 Å²	51.4	7%	0.07	28%	0.278	C	S	.	.	H	α-helix	trans	-67.4	-42.1	175.5	69.9	0	0	0	0	111.4	I105 L106 L111 A112 E192	I105-S109 PolarHBondContact O-N 2.93Å; I105-S109 PolarHBondContact O-OG 3.47Å; L106-S109 PolarHBondContact O-OG 2.74Å; L106-S109 VanDerWaalsContact O-OG 3.09Å; S109-L111 PolarHBondContact O-N 2.92Å; S109-A112 WeakPolarHBondContact O-CB 3.37Å; S109-A112 PolarHBondContact O-N 2.88Å; S109-E192 WeakPolarHBondContact CB-OE1 3.37Å; S109-E192 PolarHBondContact OG-OE1 2.94Å
110	S	91.6	Very high	93.4	Very high	47 Å²	47	46 Å²	46	33%	0.329	25%	0.25	S	S	.	.	H	α-helix	trans	-61.3	-27	174	63.9	0	0	0	0	113.8	L106 A107 A112 E143	L106-S110 PolarHBondContact O-N 3.4Å; L106-S110 PolarHBondContact O-OG 2.93Å; A107-S110 PolarHBondContact O-OG 3.49Å; S110-A112 VanDerWaalsContact C-N 3.32Å; S110-E143 WeakPolarHBondContact CA-OE1 3.29Å; S110-E143 WeakPolarHBondContact CB-OE2 3.34Å
111	L	93.4	Very high	93.4	Very high	80 Å²	80	48.7 Å²	48.7	42%	0.419	25%	0.254	S	S	.	.	H	α-helix	trans	-71.3	-26.4	173.7	-165.8	66.8	0	0	0	112.5	I81 A107 T108 S109 V113 Y114	I81-L111 HydrophobicContact CD1-CB 3.94Å; I81-L111 HydrophobicContact CD1-CD2 3.85Å; I81-L111 HydrophobicContact CD1-CG 3.7Å; I81-L111 HydrophobicContact CG1-CD2 4.16Å; A107-L111 PolarHBondContact O-N 2.86Å; T108-L111 WeakPolarHBondContact O-CB 3.49Å; T108-L111 PolarHBondContact O-N 3.41Å; S109-L111 PolarHBondContact O-N 2.92Å; L111-V113 PolarHBondContact O-N 3.34Å; L111-Y114 HydrophobicContact CD1-CD2 3.73Å; L111-Y114 HydrophobicContact CD1-CE2 4.08Å; L111-Y114 PolarHBondContact O-N 3.21Å
112	A	92.4	Very high	93.3	Very high	31 Å²	31	48.7 Å²	48.7	26%	0.256	25%	0.254	S	S	.	.	H	α-helix	trans	-62.1	-30.3	-178	0	0	0	0	0	112.2	I81 T108 S109 S110 Y114 S115	I81-A112 HydrophobicContact CG2-CB 4.11Å; T108-A112 PolarHBondContact O-N 3.14Å; S109-A112 WeakPolarHBondContact O-CB 3.37Å; S109-A112 PolarHBondContact O-N 2.88Å; S110-A112 VanDerWaalsContact C-N 3.32Å; A112-Y114 PolarHBondContact O-N 3.39Å; A112-S115 WeakPolarHBondContact O-CB 3.46Å; A112-S115 PolarHBondContact O-N 3.08Å; A112-S115 PolarHBondContact O-OG 2.85Å
113	V	94.4	Very high	93	Very high	14 Å²	14	49.1 Å²	49.1	9%	0.085	26%	0.258	C	S	.	.	H	α-helix	trans	-56.3	-34.8	177.9	-175.6	0	0	0	0	112.3	L111 S115 I116 L117 V136 T139 E143	L111-V113 PolarHBondContact O-N 3.34Å; V113-S115 VanDerWaalsContact C-N 3.3Å; V113-S115 PolarHBondContact O-N 2.98Å; V113-I116 PolarHBondContact O-N 3.25Å; V113-L117 PolarHBondContact O-N 3.37Å; V113-L117 VanDerWaalsContact O-N 3.08Å; V113-V136 HydrophobicContact CG1-CB 4.07Å; V113-V136 HydrophobicContact CG1-CG1 3.8Å; V113-V136 HydrophobicContact CG1-CG2 3.73Å; V113-T139 WeakPolarHBondContact CG1-OG1 3.41Å; V113-T139 HydrophobicContact CG2-CG2 4.37Å; V113-T139 VanDerWaalsContact CG2-OG1 3.24Å; V113-T139 WeakPolarHBondContact CG2-OG1 3.18Å; V113-E143 VanDerWaalsContact CG2-OE1 3.24Å; V113-E143 WeakPolarHBondContact CG2-OE1 3.34Å
114	Y	93.1	Very high	92.8	Very high	119 Å²	119	50.6 Å²	50.6	47%	0.467	27%	0.266	S	S	.	.	H	α-helix	trans	-65.9	-31.5	178.6	-68.7	-73.6	0	0	0	112.9	L111 A112 I116 L117 W118	L111-Y114 HydrophobicContact CD1-CD2 3.73Å; L111-Y114 HydrophobicContact CD1-CE2 4.08Å; L111-Y114 PolarHBondContact O-N 3.21Å; A112-Y114 PolarHBondContact O-N 3.39Å; Y114-I116 VanDerWaalsContact C-N 3.3Å; Y114-I116 PolarHBondContact O-N 3.28Å; Y114-L117 PolarHBondContact O-N 2.92Å; Y114-W118 VanDerWaalsContact O-CB 3.3Å; Y114-W118 WeakPolarHBondContact O-CB 3.48Å; Y114-W118 PolarHBondContact O-N 2.91Å
115	S	94.6	Very high	92.6	Very high	14 Å²	14	50.1 Å²	50.1	10%	0.098	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-39.3	175.9	71.3	0	0	0	0	111.9	A112 V113 S119	A112-S115 WeakPolarHBondContact O-CB 3.46Å; A112-S115 PolarHBondContact O-N 3.08Å; A112-S115 PolarHBondContact O-OG 2.85Å; V113-S115 VanDerWaalsContact C-N 3.3Å; V113-S115 PolarHBondContact O-N 2.98Å; S115-S119 WeakPolarHBondContact O-CB 3.36Å; S115-S119 PolarHBondContact O-N 3.37Å; S115-S119 PolarHBondContact O-OG 3.45Å; S115-S119 VanDerWaalsContact O-OG 3.12Å
116	I	93.6	Very high	92.4	Very high	60 Å²	60	54.3 Å²	54.3	31%	0.308	29%	0.293	S	S	.	.	H	α-helix	trans	-70.1	-46.7	178.9	-56.8	172.4	0	0	0	109.6	V113 Y114 W118 S119 G120 A132 A135	V113-I116 PolarHBondContact O-N 3.25Å; Y114-I116 VanDerWaalsContact C-N 3.3Å; Y114-I116 PolarHBondContact O-N 3.28Å; I116-W118 PolarHBondContact O-N 3.25Å; I116-S119 PolarHBondContact O-N 3.47Å; I116-S119 PolarHBondContact O-OG 3.42Å; I116-G120 PolarHBondContact O-N 2.64Å; I116-A132 HydrophobicContact CG2-CB 4.45Å; I116-A135 HydrophobicContact CG2-CB 3.78Å
117	L	94.3	Very high	92.4	Very high	55 Å²	55	62.8 Å²	62.8	29%	0.288	33%	0.325	S	S	.	.	H	α-helix	trans	-61.4	-46.9	178.8	-176	66	0	0	0	112	V113 Y114 G120 W121 L133 V136	V113-L117 PolarHBondContact O-N 3.37Å; V113-L117 VanDerWaalsContact O-N 3.08Å; Y114-L117 PolarHBondContact O-N 2.92Å; L117-G120 PolarHBondContact O-N 3.16Å; L117-W121 WeakPolarHBondContact O-CB 3.39Å; L117-W121 PolarHBondContact O-N 2.99Å; L117-L133 HydrophobicContact CD1-CD2 4.37Å; L117-V136 HydrophobicContact CB-CG2 4Å; L117-V136 HydrophobicContact CD1-CG2 4.24Å
118	W	94	Very high	92.3	Very high	89 Å²	89	61.6 Å²	61.6	34%	0.337	32%	0.315	S	S	.	.	H	α-helix	trans	-65.7	-40.6	-179.7	-69.3	-4.1	0	0	0	111.9	L70 A74 L77 Y114 I116 A122	L70-W118 HydrophobicContact CD2-CD2 4.05Å; L70-W118 HydrophobicContact CD2-CE3 4.2Å; L70-W118 HydrophobicContact CD2-CG 4.18Å; A74-W118 HydrophobicContact CB-CB 4.05Å; L77-W118 HydrophobicContact CD1-CE3 4.49Å; L77-W118 HydrophobicContact CD1-CH2 4.18Å; L77-W118 HydrophobicContact CD1-CZ3 3.71Å; Y114-W118 VanDerWaalsContact O-CB 3.3Å; Y114-W118 WeakPolarHBondContact O-CB 3.48Å; Y114-W118 PolarHBondContact O-N 2.91Å; I116-W118 PolarHBondContact O-N 3.25Å; W118-A122 WeakPolarHBondContact O-CB 3.21Å; W118-A122 PolarHBondContact O-N 2.93Å
119	S	92.4	Very high	92.3	Very high	51 Å²	51	63.7 Å²	63.7	36%	0.357	33%	0.325	S	S	.	.	H	α-helix	trans	-64.4	-40.8	176.9	65.3	0	0	0	0	112.4	S115 I116 S123	S115-S119 WeakPolarHBondContact O-CB 3.36Å; S115-S119 PolarHBondContact O-N 3.37Å; S115-S119 PolarHBondContact O-OG 3.45Å; S115-S119 VanDerWaalsContact O-OG 3.12Å; I116-S119 PolarHBondContact O-N 3.47Å; I116-S119 PolarHBondContact O-OG 3.42Å; S119-S123 PolarHBondContact O-N 2.91Å
120	G	92.2	Very high	92.4	Very high	6 Å²	6	67.8 Å²	67.8	6%	0.062	35%	0.345	C	S	.	.	H	α-helix	trans	-63.3	-51.3	176.1	0	0	0	0	0	112.7	I116 L117 S123	I116-G120 PolarHBondContact O-N 2.64Å; L117-G120 PolarHBondContact O-N 3.16Å; G120-S123 PolarHBondContact O-N 2.89Å; G120-S123 PolarHBondContact O-OG 3.49Å
121	W	91.9	Very high	92.6	Very high	151 Å²	151	67.4 Å²	67.4	57%	0.572	35%	0.348	S	S	*	.	H	α-helix	trans	-66.1	-40.7	179.8	-169.3	73.6	0	0	0	112.4	T67 L70 L117 S123 N124 L129	T67-W121 HydrophobicContact CG2-CZ3 4.42Å; L70-W121 HydrophobicContact CD1-CE3 3.42Å; L70-W121 VanDerWaalsContact CD1-CE3 3.42Å; L70-W121 HydrophobicContact CD1-CZ3 3.36Å; L117-W121 WeakPolarHBondContact O-CB 3.39Å; L117-W121 PolarHBondContact O-N 2.99Å; W121-S123 VanDerWaalsContact C-N 3.26Å; W121-S123 PolarHBondContact O-N 3.28Å; W121-N124 PolarHBondContact O-N 3.48Å; W121-L129 HydrophobicContact CB-CD1 4.42Å
122	A	91.6	Very high	92.7	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.7	-29.3	-178.8	0	0	0	0	0	113.4	S66 T67 L70 Y71 W118 N124	S66-A122 CarbonylContact C-O 3.56Å; S66-A122 WeakPolarHBondContact CA-O 3.47Å; S66-A122 WeakPolarHBondContact CB-O 3.31Å; T67-A122 PolarHBondContact N-O 3.45Å; T67-A122 WeakPolarHBondContact OG1-CA 3.47Å; T67-A122 WeakPolarHBondContact OG1-CB 3.47Å; L70-A122 HydrophobicContact CB-CB 3.71Å; Y71-A122 HydrophobicContact CD2-CB 4.5Å; W118-A122 WeakPolarHBondContact O-CB 3.21Å; W118-A122 PolarHBondContact O-N 2.93Å; A122-N124 PolarHBondContact O-N 3.02Å
123	S	87.4	Confident	92.8	Very high	19 Å²	19	66.9 Å²	66.9	13%	0.133	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-14.4	-179	74.3	0	0	0	0	114.6	S119 G120 W121 S125 A128	S119-S123 PolarHBondContact O-N 2.91Å; G120-S123 PolarHBondContact O-N 2.89Å; G120-S123 PolarHBondContact O-OG 3.49Å; W121-S123 VanDerWaalsContact C-N 3.26Å; W121-S123 PolarHBondContact O-N 3.28Å; S123-S125 PolarHBondContact O-N 3.14Å; S123-S125 VanDerWaalsContact O-N 3.16Å; S123-S125 PolarHBondContact OG-OG 3.33Å; S123-A128 WeakPolarHBondContact OG-CB 3.46Å
124	N	89.3	Confident	92.9	Very high	107 Å²	107	75.2 Å²	75.2	57%	0.572	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	40.6	-179.5	-160.2	15.6	0	0	0	114	T65 W121 A122	T65-N124 WeakPolarHBondContact O-CB 3.38Å; T65-N124 PolarHBondContact O-ND2 2.9Å; W121-N124 PolarHBondContact O-N 3.48Å; A122-N124 PolarHBondContact O-N 3.02Å
125	S	89.9	Confident	92.9	Very high	53 Å²	53	70.8 Å²	70.8	37%	0.371	36%	0.36	S	S	.	.			trans	-124.2	134.4	172.9	71.9	0	0	0	0	110.3	S123 Y127 A128 L129	S123-S125 PolarHBondContact O-N 3.14Å; S123-S125 VanDerWaalsContact O-N 3.16Å; S123-S125 PolarHBondContact OG-OG 3.33Å; S125-Y127 VanDerWaalsContact C-N 3.26Å; S125-Y127 PolarHBondContact O-N 2.75Å; S125-A128 PolarHBondContact O-N 2.96Å; S125-A128 WeakPolarHBondContact OG-CB 3.36Å; S125-A128 PolarHBondContact OG-N 3.23Å; S125-L129 PolarHBondContact O-N 3.24Å
126	N	90.5	Very high	93	Very high	128 Å²	128	71.2 Å²	71.2	68%	0.684	36%	0.362	S	S	*	.	H	α-helix	trans	-59.4	-38.1	-175.2	-69	-19.5	0	0	0	112.2	L129 I130	N126-L129 PolarHBondContact O-N 3.01Å; N126-I130 VanDerWaalsContact O-CG1 3.25Å; N126-I130 WeakPolarHBondContact O-CG1 3.28Å; N126-I130 PolarHBondContact O-N 3.39Å
127	Y	93.8	Very high	93	Very high	210 Å²	210	71.3 Å²	71.3	82%	0.824	37%	0.372	S	S	*	.	H	α-helix	trans	-67.4	-42.1	178.3	-71.8	-74.7	0	0	0	112.9	S125 L129 I130 G131	S125-Y127 VanDerWaalsContact C-N 3.26Å; S125-Y127 PolarHBondContact O-N 2.75Å; Y127-L129 VanDerWaalsContact C-N 3.33Å; Y127-I130 PolarHBondContact O-N 3.09Å; Y127-G131 PolarHBondContact O-N 3.09Å
128	A	91.7	Very high	93	Very high	34 Å²	34	73 Å²	73	28%	0.281	38%	0.378	S	S	.	.	H	α-helix	trans	-67.4	-36.9	177	0	0	0	0	0	111.5	S123 S125 G131 A132	S123-A128 WeakPolarHBondContact OG-CB 3.46Å; S125-A128 PolarHBondContact O-N 2.96Å; S125-A128 WeakPolarHBondContact OG-CB 3.36Å; S125-A128 PolarHBondContact OG-N 3.23Å; A128-G131 PolarHBondContact O-N 3.49Å; A128-A132 WeakPolarHBondContact O-CB 3.46Å; A128-A132 PolarHBondContact O-N 3.46Å
129	L	93.3	Very high	93	Very high	59 Å²	59	69.3 Å²	69.3	31%	0.309	37%	0.366	S	S	.	.	H	α-helix	trans	-64.8	-45.7	175.7	-175.6	63.9	0	0	0	111.8	W121 S125 N126 Y127 G131 A132 L133	W121-L129 HydrophobicContact CB-CD1 4.42Å; S125-L129 PolarHBondContact O-N 3.24Å; N126-L129 PolarHBondContact O-N 3.01Å; Y127-L129 VanDerWaalsContact C-N 3.33Å; L129-G131 VanDerWaalsContact C-N 3.31Å; L129-G131 PolarHBondContact O-N 3.48Å; L129-A132 PolarHBondContact O-N 2.95Å; L129-L133 HydrophobicContact CG-CD1 4.35Å; L129-L133 WeakPolarHBondContact O-CG 3.4Å; L129-L133 PolarHBondContact O-N 2.94Å
130	I	95.1	Very high	93	Very high	97 Å²	97	71.2 Å²	71.2	50%	0.497	37%	0.371	S	S	.	.	H	α-helix	trans	-61.2	-42.3	175.3	-68.1	165.5	0	0	0	110.5	N126 Y127 L133 R134	N126-I130 VanDerWaalsContact O-CG1 3.25Å; N126-I130 WeakPolarHBondContact O-CG1 3.28Å; N126-I130 PolarHBondContact O-N 3.39Å; Y127-I130 PolarHBondContact O-N 3.09Å; I130-L133 PolarHBondContact O-N 3.39Å; I130-R134 VanDerWaalsContact O-CG 3.29Å; I130-R134 WeakPolarHBondContact O-CG 3.26Å; I130-R134 PolarHBondContact O-N 3.38Å
131	G	95.8	Very high	93.1	Very high	38 Å²	38	74 Å²	74	39%	0.392	39%	0.389	S	S	.	.	H	α-helix	trans	-60.5	-45.7	175.9	0	0	0	0	0	112.6	Y127 A128 L129 R134 A135	Y127-G131 PolarHBondContact O-N 3.09Å; A128-G131 PolarHBondContact O-N 3.49Å; L129-G131 VanDerWaalsContact C-N 3.31Å; L129-G131 PolarHBondContact O-N 3.48Å; G131-R134 PolarHBondContact O-N 3.41Å; G131-A135 PolarHBondContact O-N 2.99Å
132	A	94.8	Very high	93.2	Very high	5 Å²	5	70.9 Å²	70.9	4%	0.041	38%	0.378	C	S	.	.	H	α-helix	trans	-65	-44.1	178.2	0	0	0	0	0	112.4	I116 A128 L129 R134 A135 V136	I116-A132 HydrophobicContact CG2-CB 4.45Å; A128-A132 WeakPolarHBondContact O-CB 3.46Å; A128-A132 PolarHBondContact O-N 3.46Å; L129-A132 PolarHBondContact O-N 2.95Å; A132-R134 VanDerWaalsContact C-N 3.29Å; A132-R134 PolarHBondContact O-N 3.49Å; A132-A135 PolarHBondContact O-N 3.2Å; A132-V136 WeakPolarHBondContact O-CB 3.39Å; A132-V136 WeakPolarHBondContact O-CG2 3.34Å; A132-V136 PolarHBondContact O-N 3.39Å
133	L	95	Very high	93.3	Very high	96 Å²	96	72.4 Å²	72.4	50%	0.503	39%	0.385	S	S	.	.	H	α-helix	trans	-61.8	-37.3	176.5	-71.4	173.1	0	0	0	112.3	L117 L129 I130 A137	L117-L133 HydrophobicContact CD1-CD2 4.37Å; L129-L133 HydrophobicContact CG-CD1 4.35Å; L129-L133 WeakPolarHBondContact O-CG 3.4Å; L129-L133 PolarHBondContact O-N 2.94Å; I130-L133 PolarHBondContact O-N 3.39Å; L133-A137 WeakPolarHBondContact O-CB 3.35Å; L133-A137 PolarHBondContact O-N 3.49Å
134	R	96.1	Very high	93.6	Very high	188 Å²	188	75.8 Å²	75.8	71%	0.709	40%	0.404	S	S	*	.	H	α-helix	trans	-66.3	-45.8	175.1	-74.4	177.1	63.4	178.1	-0.7	112.2	I130 G131 A132 V136 A137 Q138	I130-R134 VanDerWaalsContact O-CG 3.29Å; I130-R134 WeakPolarHBondContact O-CG 3.26Å; I130-R134 PolarHBondContact O-N 3.38Å; G131-R134 PolarHBondContact O-N 3.41Å; A132-R134 VanDerWaalsContact C-N 3.29Å; A132-R134 PolarHBondContact O-N 3.49Å; R134-V136 VanDerWaalsContact C-N 3.34Å; R134-A137 PolarHBondContact O-N 3.18Å; R134-Q138 PolarHBondContact O-N 2.92Å
135	A	94.7	Very high	93.8	Very high	27 Å²	27	73.5 Å²	73.5	22%	0.223	40%	0.395	C	S	.	.	H	α-helix	trans	-61.8	-43.5	177.3	0	0	0	0	0	111.3	I116 G131 A132 A137 Q138 T139	I116-A135 HydrophobicContact CG2-CB 3.78Å; G131-A135 PolarHBondContact O-N 2.99Å; A132-A135 PolarHBondContact O-N 3.2Å; A135-A137 PolarHBondContact O-N 3.12Å; A135-Q138 WeakPolarHBondContact O-CB 3.34Å; A135-Q138 PolarHBondContact O-N 3.21Å; A135-T139 WeakPolarHBondContact O-CG2 3.36Å; A135-T139 PolarHBondContact O-N 3.29Å; A135-T139 PolarHBondContact O-OG1 3.44Å
136	V	95.1	Very high	94	Very high	22 Å²	22	71.3 Å²	71.3	13%	0.133	38%	0.379	C	S	.	.	H	α-helix	trans	-62.4	-42.7	176.5	171.4	0	0	0	0	111.7	V113 L117 A132 R134 Q138 T139 I140	V113-V136 HydrophobicContact CG1-CB 4.07Å; V113-V136 HydrophobicContact CG1-CG1 3.8Å; V113-V136 HydrophobicContact CG1-CG2 3.73Å; L117-V136 HydrophobicContact CB-CG2 4Å; L117-V136 HydrophobicContact CD1-CG2 4.24Å; A132-V136 WeakPolarHBondContact O-CB 3.39Å; A132-V136 WeakPolarHBondContact O-CG2 3.34Å; A132-V136 PolarHBondContact O-N 3.39Å; R134-V136 VanDerWaalsContact C-N 3.34Å; V136-Q138 VanDerWaalsContact C-N 3.28Å; V136-Q138 PolarHBondContact O-N 2.86Å; V136-T139 PolarHBondContact O-N 3.18Å; V136-T139 PolarHBondContact O-OG1 3.36Å; V136-T139 VanDerWaalsContact O-OG1 3.1Å; V136-I140 HydrophobicContact CG1-CD1 3.62Å; V136-I140 HydrophobicContact CG1-CG1 4.41Å; V136-I140 VanDerWaalsContact O-CG1 3.27Å; V136-I140 WeakPolarHBondContact O-CG1 3.38Å; V136-I140 PolarHBondContact O-N 3.09Å; V136-I140 VanDerWaalsContact O-N 3.11Å
137	A	93.9	Very high	94.1	Very high	63 Å²	63	66.9 Å²	66.9	52%	0.521	36%	0.36	S	S	.	.	H	α-helix	trans	-62.1	-38.8	176.3	0	0	0	0	0	111.9	L133 R134 A135 S141	L133-A137 WeakPolarHBondContact O-CB 3.35Å; L133-A137 PolarHBondContact O-N 3.49Å; R134-A137 PolarHBondContact O-N 3.18Å; A135-A137 PolarHBondContact O-N 3.12Å; A137-S141 WeakPolarHBondContact O-CB 3.22Å; A137-S141 PolarHBondContact O-N 3.45Å; A137-S141 PolarHBondContact O-OG 3.47Å
138	Q	95.5	Very high	94.2	Very high	90 Å²	90	62.1 Å²	62.1	42%	0.421	35%	0.348	S	S	.	.	H	α-helix	trans	-65.1	-54.3	175.8	177.2	177	-16.6	0	0	111.1	R134 A135 V136 I140 S141 Y142 A191	R134-Q138 PolarHBondContact O-N 2.92Å; A135-Q138 WeakPolarHBondContact O-CB 3.34Å; A135-Q138 PolarHBondContact O-N 3.21Å; V136-Q138 VanDerWaalsContact C-N 3.28Å; V136-Q138 PolarHBondContact O-N 2.86Å; Q138-I140 PolarHBondContact O-N 2.91Å; Q138-S141 PolarHBondContact O-N 3.48Å; Q138-S141 VanDerWaalsContact O-N 3.12Å; Q138-S141 PolarHBondContact O-OG 2.95Å; Q138-Y142 HydrophobicContact CG-CD2 3.9Å; Q138-Y142 HydrophobicContact CG-CE2 3.99Å; Q138-Y142 VanDerWaalsContact O-CD2 3.25Å; Q138-Y142 WeakPolarHBondContact O-CD2 3.24Å; Q138-Y142 PolarHBondContact O-N 2.75Å; Q138-Y142 VanDerWaalsContact O-N 3.13Å; Q138-A191 PolarHBondContact NE2-O 3.46Å
139	T	93.9	Very high	94.3	Very high	12 Å²	12	61.2 Å²	61.2	7%	0.074	34%	0.338	C	S	.	.	H	α-helix	trans	-59.6	-45.6	-176.3	56.4	0	0	0	0	111.8	V113 A135 V136 S141 Y142 E143	V113-T139 WeakPolarHBondContact CG1-OG1 3.41Å; V113-T139 HydrophobicContact CG2-CG2 4.37Å; V113-T139 VanDerWaalsContact CG2-OG1 3.24Å; V113-T139 WeakPolarHBondContact CG2-OG1 3.18Å; A135-T139 WeakPolarHBondContact O-CG2 3.36Å; A135-T139 PolarHBondContact O-N 3.29Å; A135-T139 PolarHBondContact O-OG1 3.44Å; V136-T139 PolarHBondContact O-N 3.18Å; V136-T139 PolarHBondContact O-OG1 3.36Å; V136-T139 VanDerWaalsContact O-OG1 3.1Å; T139-S141 VanDerWaalsContact C-N 3.32Å; T139-S141 PolarHBondContact O-N 3.32Å; T139-Y142 PolarHBondContact O-N 3.16Å; T139-E143 WeakPolarHBondContact O-CB 3.35Å; T139-E143 WeakPolarHBondContact O-CG 3.34Å; T139-E143 PolarHBondContact O-N 2.74Å
140	I	92.3	Very high	94.3	Very high	91 Å²	91	59.4 Å²	59.4	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-62.5	-39.6	178.5	-63.6	169.2	0	0	0	111.2	V136 Q138 Y142	V136-I140 HydrophobicContact CG1-CD1 3.62Å; V136-I140 HydrophobicContact CG1-CG1 4.41Å; V136-I140 VanDerWaalsContact O-CG1 3.27Å; V136-I140 WeakPolarHBondContact O-CG1 3.38Å; V136-I140 PolarHBondContact O-N 3.09Å; V136-I140 VanDerWaalsContact O-N 3.11Å; Q138-I140 PolarHBondContact O-N 2.91Å; I140-Y142 VanDerWaalsContact C-N 3.34Å; I140-Y142 PolarHBondContact O-N 2.88Å
141	S	94.1	Very high	94.2	Very high	63 Å²	63	59.2 Å²	59.2	44%	0.441	33%	0.328	S	S	.	.	H	α-helix	trans	-64.1	-38.6	179	68.7	0	0	0	0	112.8	A137 Q138 T139	A137-S141 WeakPolarHBondContact O-CB 3.22Å; A137-S141 PolarHBondContact O-N 3.45Å; A137-S141 PolarHBondContact O-OG 3.47Å; Q138-S141 PolarHBondContact O-N 3.48Å; Q138-S141 VanDerWaalsContact O-N 3.12Å; Q138-S141 PolarHBondContact O-OG 2.95Å; T139-S141 VanDerWaalsContact C-N 3.32Å; T139-S141 PolarHBondContact O-N 3.32Å
142	Y	93.9	Very high	94	Very high	86 Å²	86	59 Å²	59	34%	0.337	32%	0.321	S	S	.	.	H	α-helix	trans	-84.3	-29.3	-177.6	-74.4	-74.3	0	0	0	112.4	Q138 T139 I140 V144 T145 L146 A191	Q138-Y142 HydrophobicContact CG-CD2 3.9Å; Q138-Y142 HydrophobicContact CG-CE2 3.99Å; Q138-Y142 VanDerWaalsContact O-CD2 3.25Å; Q138-Y142 WeakPolarHBondContact O-CD2 3.24Å; Q138-Y142 PolarHBondContact O-N 2.75Å; Q138-Y142 VanDerWaalsContact O-N 3.13Å; T139-Y142 PolarHBondContact O-N 3.16Å; I140-Y142 VanDerWaalsContact C-N 3.34Å; I140-Y142 PolarHBondContact O-N 2.88Å; Y142-V144 VanDerWaalsContact C-N 3.27Å; Y142-V144 PolarHBondContact O-N 2.84Å; Y142-T145 PolarHBondContact O-N 3.3Å; Y142-T145 VanDerWaalsContact O-N 3.11Å; Y142-T145 PolarHBondContact O-OG1 3.08Å; Y142-L146 WeakPolarHBondContact O-CB 3.37Å; Y142-L146 PolarHBondContact O-N 2.7Å; Y142-A191 HydrophobicContact CD1-CB 3.73Å; Y142-A191 HydrophobicContact CD2-CB 3.49Å; Y142-A191 VanDerWaalsContact CD2-CB 3.49Å; Y142-A191 HydrophobicContact CE1-CB 3.65Å; Y142-A191 HydrophobicContact CE2-CB 3.45Å; Y142-A191 VanDerWaalsContact CE2-CB 3.45Å; Y142-A191 HydrophobicContact CG-CB 3.65Å
143	E	93.5	Very high	93.8	Very high	32 Å²	32	59.7 Å²	59.7	15%	0.15	32%	0.324	C	S	.	.	H	α-helix	trans	-55.5	-40.2	172.7	-86.2	176.8	-150.5	0	0	112.9	S110 V113 T139 T145 L146 A147	S110-E143 WeakPolarHBondContact CA-OE1 3.29Å; S110-E143 WeakPolarHBondContact CB-OE2 3.34Å; V113-E143 VanDerWaalsContact CG2-OE1 3.24Å; V113-E143 WeakPolarHBondContact CG2-OE1 3.34Å; T139-E143 WeakPolarHBondContact O-CB 3.35Å; T139-E143 WeakPolarHBondContact O-CG 3.34Å; T139-E143 PolarHBondContact O-N 2.74Å; E143-T145 VanDerWaalsContact C-N 3.35Å; E143-T145 PolarHBondContact O-N 3.31Å; E143-L146 WeakPolarHBondContact O-CB 3.38Å; E143-L146 PolarHBondContact O-N 3.11Å; E143-A147 WeakPolarHBondContact O-CB 3.44Å; E143-A147 PolarHBondContact O-N 3.21Å
144	V	93.7	Very high	93.6	Very high	90 Å²	90	55.6 Å²	55.6	55%	0.545	30%	0.303	S	S	.	.	H	α-helix	trans	-62	-45.8	177.6	178.5	0	0	0	0	110.5	Y142 A147 I148	Y142-V144 VanDerWaalsContact C-N 3.27Å; Y142-V144 PolarHBondContact O-N 2.84Å; V144-A147 PolarHBondContact O-N 3.01Å; V144-I148 HydrophobicContact CG1-CD1 4.1Å; V144-I148 WeakPolarHBondContact O-CG1 3.37Å; V144-I148 PolarHBondContact O-N 2.84Å
145	T	93.9	Very high	93.4	Very high	60 Å²	60	53.4 Å²	53.4	37%	0.368	31%	0.305	S	S	.	.	H	α-helix	trans	-67.3	-39.4	177.8	62.4	0	0	0	0	111.9	Y142 E143 A147 I148 I149	Y142-T145 PolarHBondContact O-N 3.3Å; Y142-T145 VanDerWaalsContact O-N 3.11Å; Y142-T145 PolarHBondContact O-OG1 3.08Å; E143-T145 VanDerWaalsContact C-N 3.35Å; E143-T145 PolarHBondContact O-N 3.31Å; T145-A147 PolarHBondContact O-N 3.29Å; T145-I148 PolarHBondContact O-N 3.26Å; T145-I149 WeakPolarHBondContact O-CB 3.48Å; T145-I149 WeakPolarHBondContact O-CD1 3.44Å; T145-I149 WeakPolarHBondContact O-CG1 3.35Å; T145-I149 PolarHBondContact O-N 3.44Å
146	L	93.3	Very high	93.2	Very high	6 Å²	6	56.8 Å²	56.8	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-56.7	-49.1	176.3	-162.5	82.7	0	0	0	110.5	L106 Y142 E143 I148 I149 L150 W185 T189 E192	L106-L146 HydrophobicContact CD2-CD2 4.42Å; Y142-L146 WeakPolarHBondContact O-CB 3.37Å; Y142-L146 PolarHBondContact O-N 2.7Å; E143-L146 WeakPolarHBondContact O-CB 3.38Å; E143-L146 PolarHBondContact O-N 3.11Å; L146-I148 PolarHBondContact O-N 3.16Å; L146-I149 PolarHBondContact O-N 3.42Å; L146-L150 HydrophobicContact CG-CD1 4.33Å; L146-L150 WeakPolarHBondContact O-CB 3.4Å; L146-L150 WeakPolarHBondContact O-CG 3.14Å; L146-L150 PolarHBondContact O-N 3.23Å; L146-W185 HydrophobicContact CB-CZ3 4.16Å; L146-W185 HydrophobicContact CD1-CD2 4.43Å; L146-W185 HydrophobicContact CD1-CE3 3.76Å; L146-W185 HydrophobicContact CD1-CH2 3.18Å; L146-W185 HydrophobicContact CD1-CZ2 3.97Å; L146-W185 HydrophobicContact CD1-CZ3 3.06Å; L146-W185 HydrophobicContact CD2-CH2 4.17Å; L146-W185 HydrophobicContact CD2-CZ3 4.46Å; L146-W185 HydrophobicContact CG-CE3 4.34Å; L146-W185 HydrophobicContact CG-CH2 3.42Å; L146-W185 VanDerWaalsContact CG-CH2 3.42Å; L146-W185 HydrophobicContact CG-CZ3 3.29Å; L146-W185 WeakPolarHBondContact O-CZ3 3.04Å; L146-T189 HydrophobicContact CD1-CG2 3.9Å; L146-E192 WeakPolarHBondContact CD2-OE2 3.25Å
147	A	93.8	Very high	93	Very high	36 Å²	36	56.7 Å²	56.7	30%	0.298	32%	0.317	S	S	.	.	H	α-helix	trans	-61.6	-43.7	-180	0	0	0	0	0	112.6	L106 E143 V144 T145 L151	L106-A147 HydrophobicContact CD1-CB 4.29Å; L106-A147 HydrophobicContact CD2-CB 3.88Å; E143-A147 WeakPolarHBondContact O-CB 3.44Å; E143-A147 PolarHBondContact O-N 3.21Å; V144-A147 PolarHBondContact O-N 3.01Å; T145-A147 PolarHBondContact O-N 3.29Å; A147-L151 WeakPolarHBondContact O-CB 3.39Å; A147-L151 PolarHBondContact O-N 3.21Å
148	I	93.9	Very high	92.8	Very high	110 Å²	110	57 Å²	57	56%	0.564	33%	0.327	S	S	*	.	H	α-helix	trans	-69.7	-42.5	-179.4	-63.4	165.7	0	0	0	110.9	V144 T145 L146 L151 S152	V144-I148 HydrophobicContact CG1-CD1 4.1Å; V144-I148 WeakPolarHBondContact O-CG1 3.37Å; V144-I148 PolarHBondContact O-N 2.84Å; T145-I148 PolarHBondContact O-N 3.26Å; L146-I148 PolarHBondContact O-N 3.16Å; I148-L151 PolarHBondContact O-N 3.19Å; I148-S152 PolarHBondContact O-N 3.1Å
149	I	94.6	Very high	92.7	Very high	15 Å²	15	54.4 Å²	54.4	8%	0.077	32%	0.318	C	S	.	.	H	α-helix	trans	-63.7	-46.7	177.6	-65.6	163.2	0	0	0	109.8	T145 L146 L151 S152 T153 L181 M184 W185	T145-I149 WeakPolarHBondContact O-CB 3.48Å; T145-I149 WeakPolarHBondContact O-CD1 3.44Å; T145-I149 WeakPolarHBondContact O-CG1 3.35Å; T145-I149 PolarHBondContact O-N 3.44Å; L146-I149 PolarHBondContact O-N 3.42Å; I149-L151 VanDerWaalsContact C-N 3.33Å; I149-L151 PolarHBondContact O-N 3.24Å; I149-S152 PolarHBondContact O-N 2.91Å; I149-S152 VanDerWaalsContact O-N 3.16Å; I149-S152 PolarHBondContact O-OG 3.2Å; I149-T153 PolarHBondContact O-N 3.47Å; I149-T153 VanDerWaalsContact O-N 3.09Å; I149-L181 HydrophobicContact CG2-CB 4.32Å; I149-L181 HydrophobicContact CG2-CD2 4.43Å; I149-M184 HydrophobicContact CD1-CB 3.76Å; I149-W185 HydrophobicContact CB-CE3 4.1Å; I149-W185 HydrophobicContact CG2-CB 3.97Å; I149-W185 HydrophobicContact CG2-CD2 4.48Å; I149-W185 HydrophobicContact CG2-CE3 3.79Å
150	L	92.5	Very high	92.6	Very high	20 Å²	20	57.4 Å²	57.4	11%	0.105	33%	0.33	C	S	.	.	H	α-helix	trans	-57.1	-47.4	174.8	-84.9	164.1	0	0	0	111.9	L102 L106 L146 S152 T153 L154 W185	L102-L150 HydrophobicContact CD1-CD2 3.69Å; L102-L150 HydrophobicContact CD2-CB 3.99Å; L102-L150 HydrophobicContact CD2-CD1 3.82Å; L102-L150 HydrophobicContact CD2-CD2 3.88Å; L102-L150 HydrophobicContact CD2-CG 4.09Å; L102-L150 HydrophobicContact CG-CD2 4.09Å; L106-L150 HydrophobicContact CD1-CD1 3.63Å; L106-L150 HydrophobicContact CG-CD1 3.98Å; L146-L150 HydrophobicContact CG-CD1 4.33Å; L146-L150 WeakPolarHBondContact O-CB 3.4Å; L146-L150 WeakPolarHBondContact O-CG 3.14Å; L146-L150 PolarHBondContact O-N 3.23Å; L150-S152 VanDerWaalsContact C-N 3.26Å; L150-S152 PolarHBondContact O-N 2.65Å; L150-T153 PolarHBondContact O-N 3.03Å; L150-T153 VanDerWaalsContact O-N 3.14Å; L150-T153 PolarHBondContact O-OG1 3.37Å; L150-L154 WeakPolarHBondContact O-CB 3.24Å; L150-L154 VanDerWaalsContact O-CG 3.31Å; L150-L154 WeakPolarHBondContact O-CG 3.43Å; L150-L154 PolarHBondContact O-N 3.13Å; L150-W185 HydrophobicContact CB-CZ3 4.43Å; L150-W185 HydrophobicContact CD1-CH2 3.37Å; L150-W185 HydrophobicContact CD1-CZ2 4.47Å; L150-W185 HydrophobicContact CD1-CZ3 3.62Å; L150-W185 HydrophobicContact CD2-CH2 3.69Å; L150-W185 HydrophobicContact CD2-CZ2 4.2Å; L150-W185 HydrophobicContact CD2-CZ3 3.95Å; L150-W185 HydrophobicContact CG-CE3 4.24Å; L150-W185 HydrophobicContact CG-CH2 3.41Å; L150-W185 VanDerWaalsContact CG-CH2 3.41Å; L150-W185 HydrophobicContact CG-CZ2 4.37Å; L150-W185 HydrophobicContact CG-CZ3 3.31Å
151	L	93.5	Very high	92.7	Very high	93 Å²	93	54 Å²	54	49%	0.487	31%	0.314	S	S	.	.	H	α-helix	trans	-56.7	-43.2	178.2	-175.1	67	0	0	0	111.4	A147 I148 I149 T153 L154 L155 F160	A147-L151 WeakPolarHBondContact O-CB 3.39Å; A147-L151 PolarHBondContact O-N 3.21Å; I148-L151 PolarHBondContact O-N 3.19Å; I149-L151 VanDerWaalsContact C-N 3.33Å; I149-L151 PolarHBondContact O-N 3.24Å; L151-T153 PolarHBondContact O-N 3.35Å; L151-L154 WeakPolarHBondContact O-CB 3.47Å; L151-L154 PolarHBondContact O-N 3.45Å; L151-L155 WeakPolarHBondContact O-CG 3.45Å; L151-L155 PolarHBondContact O-N 2.68Å; L151-L155 VanDerWaalsContact O-N 3.14Å; L151-F160 HydrophobicContact CD1-CZ 4.48Å
152	S	92.2	Very high	92.6	Very high	34 Å²	34	52 Å²	52	24%	0.238	30%	0.298	C	S	.	.	H	α-helix	trans	-63.7	-38.9	178.5	72.7	0	0	0	0	113	I148 I149 L150 L154 L181	I148-S152 PolarHBondContact O-N 3.1Å; I149-S152 PolarHBondContact O-N 2.91Å; I149-S152 VanDerWaalsContact O-N 3.16Å; I149-S152 PolarHBondContact O-OG 3.2Å; L150-S152 VanDerWaalsContact C-N 3.26Å; L150-S152 PolarHBondContact O-N 2.65Å; S152-L154 VanDerWaalsContact C-N 3.34Å; S152-L181 VanDerWaalsContact OG-CD1 3.28Å; S152-L181 WeakPolarHBondContact OG-CD1 3.41Å; S152-L181 WeakPolarHBondContact OG-CD2 3.32Å
153	T	90.6	Very high	92.5	Very high	19 Å²	19	49.6 Å²	49.6	12%	0.117	29%	0.293	C	S	.	.	H	α-helix	trans	-69.3	-33.7	174.6	62.4	0	0	0	0	112.2	I149 L150 L151 L155 M156	I149-T153 PolarHBondContact O-N 3.47Å; I149-T153 VanDerWaalsContact O-N 3.09Å; L150-T153 PolarHBondContact O-N 3.03Å; L150-T153 VanDerWaalsContact O-N 3.14Å; L150-T153 PolarHBondContact O-OG1 3.37Å; L151-T153 PolarHBondContact O-N 3.35Å; T153-L155 VanDerWaalsContact C-N 3.33Å; T153-L155 PolarHBondContact O-N 3.23Å; T153-M156 WeakPolarHBondContact O-CB 3.35Å; T153-M156 PolarHBondContact O-N 3.35Å
154	L	90.9	Very high	92.4	Very high	11 Å²	11	49.9 Å²	49.9	6%	0.058	30%	0.297	C	S	.	.	H	α-helix	trans	-68.4	-30.4	179.1	-77.8	174	0	0	0	113.2	L102 L150 L151 S152 M156 S157 G158 S159 F160	L102-L154 HydrophobicContact CD1-CD1 3.88Å; L102-L154 HydrophobicContact CD1-CD2 3.57Å; L102-L154 HydrophobicContact CD1-CG 3.82Å; L102-L154 HydrophobicContact CD2-CD1 3.8Å; L102-L154 HydrophobicContact CG-CD1 4.27Å; L150-L154 WeakPolarHBondContact O-CB 3.24Å; L150-L154 VanDerWaalsContact O-CG 3.31Å; L150-L154 WeakPolarHBondContact O-CG 3.43Å; L150-L154 PolarHBondContact O-N 3.13Å; L151-L154 WeakPolarHBondContact O-CB 3.47Å; L151-L154 PolarHBondContact O-N 3.45Å; S152-L154 VanDerWaalsContact C-N 3.34Å; L154-M156 PolarHBondContact O-N 3.36Å; L154-S157 PolarHBondContact O-N 3.12Å; L154-S157 PolarHBondContact O-OG 3.21Å; L154-G158 PolarHBondContact O-N 3.36Å; L154-S159 VanDerWaalsContact CD2-O 3.28Å; L154-S159 WeakPolarHBondContact CD2-O 3.24Å; L154-F160 HydrophobicContact CD1-CD1 3.39Å; L154-F160 HydrophobicContact CD1-CE1 3.43Å; L154-F160 VanDerWaalsContact CD1-CE1 3.43Å; L154-F160 HydrophobicContact CD1-CG 4.41Å; L154-F160 HydrophobicContact CD1-CZ 4.48Å
155	L	92.3	Very high	92.3	Very high	142 Å²	142	47.3 Å²	47.3	74%	0.743	28%	0.28	S	S	*	.	H	α-helix	trans	-57	-30.1	174	-68.6	174.4	0	0	0	112.2	L151 T153	L151-L155 WeakPolarHBondContact O-CG 3.45Å; L151-L155 PolarHBondContact O-N 2.68Å; L151-L155 VanDerWaalsContact O-N 3.14Å; T153-L155 VanDerWaalsContact C-N 3.33Å; T153-L155 PolarHBondContact O-N 3.23Å
156	M	89.7	Confident	92.3	Very high	98 Å²	98	48 Å²	48	48%	0.483	28%	0.281	S	S	.	.	H	α-helix	trans	-76.5	-30.2	175	-59.7	-179.8	70.3	0	0	112.6	T153 L154 L174 P177	T153-M156 WeakPolarHBondContact O-CB 3.35Å; T153-M156 PolarHBondContact O-N 3.35Å; L154-M156 PolarHBondContact O-N 3.36Å; M156-L174 HydrophobicContact CB-CD1 4.13Å; M156-L174 HydrophobicContact CE-CD1 3.74Å; M156-L174 HydrophobicContact SD-CD1 3.77Å; M156-P177 HydrophobicContact CE-CB 3.82Å; M156-P177 HydrophobicContact CE-CG 3.67Å
157	S	90.6	Very high	92.2	Very high	19 Å²	19	51.5 Å²	51.5	13%	0.133	30%	0.303	C	S	.	.	H	α-helix	trans	-85	-26.4	-179.6	78.9	0	0	0	0	114.3	L154 S159	L154-S157 PolarHBondContact O-N 3.12Å; L154-S157 PolarHBondContact O-OG 3.21Å; S157-S159 VanDerWaalsContact C-N 3.28Å; S157-S159 PolarHBondContact O-N 2.99Å; S157-S159 PolarHBondContact OG-N 3.42Å; S157-S159 PolarHBondContact OG-O 3.38Å; S157-S159 VanDerWaalsContact OG-O 3.07Å
158	G	90.6	Very high	92.2	Very high	71 Å²	71	52.2 Å²	52.2	73%	0.732	30%	0.303	S	S	*	.	S	Bend	trans	74.9	-1.4	-177.9	0	0	0	0	0	116.4	L154	L154-G158 PolarHBondContact O-N 3.36Å
159	S	92.4	Very high	92.1	Very high	34 Å²	34	50.3 Å²	50.3	24%	0.238	29%	0.292	C	S	.	.	S	Bend	trans	-152.9	153.8	-178.3	55.6	0	0	0	0	112.9	L154 S157 N161 T164	L154-S159 VanDerWaalsContact CD2-O 3.28Å; L154-S159 WeakPolarHBondContact CD2-O 3.24Å; S157-S159 VanDerWaalsContact C-N 3.28Å; S157-S159 PolarHBondContact O-N 2.99Å; S157-S159 PolarHBondContact OG-N 3.42Å; S157-S159 PolarHBondContact OG-O 3.38Å; S157-S159 VanDerWaalsContact OG-O 3.07Å; S159-N161 VanDerWaalsContact C-N 3.28Å; S159-N161 PolarHBondContact O-N 3.49Å; S159-T164 VanDerWaalsContact OG-CB 3.23Å; S159-T164 WeakPolarHBondContact OG-CB 3.42Å; S159-T164 WeakPolarHBondContact OG-CG2 3.25Å; S159-T164 PolarHBondContact OG-OG1 3.4Å
160	F	92.4	Very high	92	Very high	75 Å²	75	56.1 Å²	56.1	33%	0.329	32%	0.319	S	S	.	.	S	Bend	trans	-84.2	1	179.6	-69.3	-83.7	0	0	0	114.2	N99 L100 G101 L102 L103 L151 L154	N99-F160 CarbonylContact O-C 3.16Å; L100-F160 HydrophobicContact CD2-CB 3.97Å; L100-F160 HydrophobicContact CD2-CD2 4.17Å; L100-F160 HydrophobicContact CD2-CG 4.3Å; G101-F160 PolarHBondContact N-O 2.89Å; L102-F160 WeakPolarHBondContact CB-O 3.39Å; L102-F160 PolarHBondContact N-O 3Å; L103-F160 HydrophobicContact CD1-CB 4.39Å; L103-F160 HydrophobicContact CD1-CD1 3.68Å; L103-F160 HydrophobicContact CD1-CD2 4.23Å; L103-F160 HydrophobicContact CD1-CE1 3.93Å; L103-F160 HydrophobicContact CD1-CE2 4.46Å; L103-F160 HydrophobicContact CD1-CG 3.85Å; L103-F160 HydrophobicContact CD1-CZ 4.32Å; L103-F160 HydrophobicContact CD2-CE1 4.39Å; L103-F160 HydrophobicContact CG-CD1 3.76Å; L103-F160 HydrophobicContact CG-CE1 4.02Å; L103-F160 HydrophobicContact CG-CG 4.37Å; L151-F160 HydrophobicContact CD1-CZ 4.48Å; L154-F160 HydrophobicContact CD1-CD1 3.39Å; L154-F160 HydrophobicContact CD1-CE1 3.43Å; L154-F160 VanDerWaalsContact CD1-CE1 3.43Å; L154-F160 HydrophobicContact CD1-CG 4.41Å; L154-F160 HydrophobicContact CD1-CZ 4.48Å
161	N	94.1	Very high	91.9	Very high	21 Å²	21	63.7 Å²	63.7	11%	0.112	35%	0.353	C	S	.	.			trans	-76	138.1	177.1	-165.7	-16.5	0	0	0	109.4	N97 L98 N99 S159 S163 T164	N97-N161 PolarHBondContact OD1-ND2 3.45Å; L98-N161 PolarHBondContact O-OD1 3.16Å; N99-N161 PolarHBondContact O-N 3.15Å; S159-N161 VanDerWaalsContact C-N 3.28Å; S159-N161 PolarHBondContact O-N 3.49Å; N161-S163 PolarHBondContact ND2-OG 3.37Å; N161-S163 PolarHBondContact OD1-N 3.39Å; N161-S163 VanDerWaalsContact OD1-N 3.13Å; N161-S163 PolarHBondContact OD1-OG 2.98Å; N161-T164 HydrophobicContact CB-CG2 4.2Å; N161-T164 PolarHBondContact O-OG1 3.05Å
162	L	91.5	Very high	92	Very high	20 Å²	20	65 Å²	65	11%	0.105	36%	0.36	C	S	.	.	H	α-helix	trans	-75.8	-26.6	177.8	-69.3	163	0	0	0	112	P88 P90 L102 I105 T164 L165	P88-L162 HydrophobicContact CB-CD1 4.04Å; P88-L162 HydrophobicContact CG-CD1 4.26Å; P88-L162 WeakPolarHBondContact O-CD1 3.25Å; P90-L162 HydrophobicContact CG-CB 3.86Å; L102-L162 HydrophobicContact CB-CD2 4.32Å; L102-L162 HydrophobicContact CD1-CD2 4.31Å; L102-L162 HydrophobicContact CG-CD2 4.5Å; I105-L162 HydrophobicContact CD1-CD1 3.6Å; I105-L162 HydrophobicContact CD1-CD2 4.47Å; L162-T164 VanDerWaalsContact C-N 3.33Å; L162-T164 PolarHBondContact O-N 3.09Å; L162-L165 VanDerWaalsContact O-CB 3.29Å; L162-L165 WeakPolarHBondContact O-CB 3.43Å; L162-L165 PolarHBondContact O-N 3.12Å
163	S	92.6	Very high	92	Very high	35 Å²	35	72.5 Å²	72.5	25%	0.245	38%	0.383	C	S	.	.	H	α-helix	trans	-68.6	-33	178.6	67	0	0	0	0	112.6	N161 L165 I166	N161-S163 PolarHBondContact ND2-OG 3.37Å; N161-S163 PolarHBondContact OD1-N 3.39Å; N161-S163 VanDerWaalsContact OD1-N 3.13Å; N161-S163 PolarHBondContact OD1-OG 2.98Å; S163-L165 PolarHBondContact O-N 2.95Å; S163-I166 WeakPolarHBondContact O-CB 3.27Å; S163-I166 PolarHBondContact O-N 3.42Å
164	T	91.8	Very high	92.2	Very high	38 Å²	38	72.8 Å²	72.8	23%	0.233	38%	0.384	C	S	.	.	H	α-helix	trans	-69.2	-27.5	176.2	52.4	0	0	0	0	111	S159 N161 L162 I166 T167 T168	S159-T164 VanDerWaalsContact OG-CB 3.23Å; S159-T164 WeakPolarHBondContact OG-CB 3.42Å; S159-T164 WeakPolarHBondContact OG-CG2 3.25Å; S159-T164 PolarHBondContact OG-OG1 3.4Å; N161-T164 HydrophobicContact CB-CG2 4.2Å; N161-T164 PolarHBondContact O-OG1 3.05Å; L162-T164 VanDerWaalsContact C-N 3.33Å; L162-T164 PolarHBondContact O-N 3.09Å; T164-I166 VanDerWaalsContact C-N 3.27Å; T164-I166 PolarHBondContact O-N 3.04Å; T164-T167 WeakPolarHBondContact CA-OG1 3.39Å; T164-T167 PolarHBondContact O-N 3.42Å; T164-T167 VanDerWaalsContact O-N 3.1Å; T164-T167 PolarHBondContact O-OG1 3.08Å; T164-T168 WeakPolarHBondContact O-CG2 3.43Å; T164-T168 PolarHBondContact O-N 3.49Å
165	L	92.1	Very high	92.3	Very high	37 Å²	37	77.4 Å²	77.4	19%	0.194	41%	0.408	C	S	.	.	H	α-helix	trans	-62.1	-34.3	174.1	-156	142.4	0	0	0	112	L162 S163 T168 Q169	L162-L165 VanDerWaalsContact O-CB 3.29Å; L162-L165 WeakPolarHBondContact O-CB 3.43Å; L162-L165 PolarHBondContact O-N 3.12Å; S163-L165 PolarHBondContact O-N 2.95Å; L165-T168 WeakPolarHBondContact CA-OG1 3.38Å; L165-T168 PolarHBondContact O-N 2.9Å; L165-T168 PolarHBondContact O-OG1 3.12Å; L165-Q169 VanDerWaalsContact CD2-NE2 3.25Å; L165-Q169 WeakPolarHBondContact O-CG 3.4Å; L165-Q169 PolarHBondContact O-N 3.28Å
166	I	92.9	Very high	92.3	Very high	75 Å²	75	75.8 Å²	75.8	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-63.3	-48.5	171.6	-61	176	0	0	0	110.3	P90 S163 T164 T168 Q169	P90-I166 HydrophobicContact CB-CD1 3.66Å; P90-I166 HydrophobicContact CG-CD1 3.79Å; P90-I166 HydrophobicContact CG-CG1 4.29Å; S163-I166 WeakPolarHBondContact O-CB 3.27Å; S163-I166 PolarHBondContact O-N 3.42Å; T164-I166 VanDerWaalsContact C-N 3.27Å; T164-I166 PolarHBondContact O-N 3.04Å; I166-T168 PolarHBondContact O-N 3.48Å; I166-Q169 PolarHBondContact O-N 2.88Å
167	T	91.7	Very high	92.4	Very high	79 Å²	79	74.9 Å²	74.9	49%	0.485	40%	0.401	S	S	.	.	H	α-helix	trans	-62.2	-33.7	-179.9	60.6	0	0	0	0	112.3	T164 Q169 E170	T164-T167 WeakPolarHBondContact CA-OG1 3.39Å; T164-T167 PolarHBondContact O-N 3.42Å; T164-T167 VanDerWaalsContact O-N 3.1Å; T164-T167 PolarHBondContact O-OG1 3.08Å; T167-Q169 PolarHBondContact O-N 3.31Å; T167-E170 WeakPolarHBondContact O-CG 3.3Å; T167-E170 PolarHBondContact O-N 2.89Å
168	T	92.6	Very high	92.6	Very high	51 Å²	51	74.4 Å²	74.4	31%	0.313	40%	0.398	S	S	.	.	H	α-helix	trans	-69.6	-21	178.1	64.5	0	0	0	0	113.2	T164 L165 I166	T164-T168 WeakPolarHBondContact O-CG2 3.43Å; T164-T168 PolarHBondContact O-N 3.49Å; L165-T168 WeakPolarHBondContact CA-OG1 3.38Å; L165-T168 PolarHBondContact O-N 2.9Å; L165-T168 PolarHBondContact O-OG1 3.12Å; I166-T168 PolarHBondContact O-N 3.48Å
169	Q	92.6	Very high	92.8	Very high	70 Å²	70	78.8 Å²	78.8	33%	0.327	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	8.5	-178.3	-67	-177.5	3.9	0	0	113.3	L165 I166 T167 H171 L172 L174	L165-Q169 VanDerWaalsContact CD2-NE2 3.25Å; L165-Q169 WeakPolarHBondContact O-CG 3.4Å; L165-Q169 PolarHBondContact O-N 3.28Å; I166-Q169 PolarHBondContact O-N 2.88Å; T167-Q169 PolarHBondContact O-N 3.31Å; Q169-H171 PolarHBondContact O-N 2.87Å; Q169-L172 WeakPolarHBondContact CA-O 3.23Å; Q169-L174 HydrophobicContact CG-CB 4.01Å
170	E	92.4	Very high	92.9	Very high	137 Å²	137	79.8 Å²	79.8	64%	0.64	40%	0.398	S	S	*	.	S	Bend	trans	-62.1	-41.1	-177.6	-77	-179.6	-170.3	0	0	113.1	T167	T167-E170 WeakPolarHBondContact O-CG 3.3Å; T167-E170 PolarHBondContact O-N 2.89Å
171	H	91.6	Very high	93	Very high	178 Å²	178	78.4 Å²	78.4	82%	0.824	39%	0.394	S	S	*	.	S	Bend	trans	-90.8	-40.7	-177	-63.4	-49	0	0	0	113.5	Q169	Q169-H171 PolarHBondContact O-N 2.87Å
172	L	93.9	Very high	93	Very high	120 Å²	120	78.7 Å²	78.7	63%	0.628	40%	0.399	S	S	*	.	S	Bend	trans	-143.1	140.5	-177.2	-72.4	171.2	0	0	0	109.4	Q169 L174	Q169-L172 WeakPolarHBondContact CA-O 3.23Å; L172-L174 PolarHBondContact O-N 3.11Å
173	W	93.4	Very high	93.2	Very high	192 Å²	192	83.3 Å²	83.3	73%	0.727	42%	0.422	S	S	*	.			trans	-65.4	132.5	172.7	-64	-9.5	0	0	0	110.4	L175 L176 P177	W173-L175 PolarHBondContact O-N 3.27Å; W173-L175 VanDerWaalsContact O-N 3.09Å; W173-L176 PolarHBondContact O-N 3.37Å; W173-L176 VanDerWaalsContact O-N 3.1Å; W173-P177 WeakPolarHBondContact O-CD 3.37Å
174	L	93.8	Very high	93.4	Very high	25 Å²	25	86.3 Å²	86.3	13%	0.131	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-24.1	179.9	-162.3	72.4	0	0	0	112.5	M156 Q169 L172 L176 P177 S178	M156-L174 HydrophobicContact CB-CD1 4.13Å; M156-L174 HydrophobicContact CE-CD1 3.74Å; M156-L174 HydrophobicContact SD-CD1 3.77Å; Q169-L174 HydrophobicContact CG-CB 4.01Å; L172-L174 PolarHBondContact O-N 3.11Å; L174-L176 PolarHBondContact O-N 2.98Å; L174-P177 WeakPolarHBondContact O-CD 3.27Å; L174-P177 WeakPolarHBondContact O-CG 3.4Å; L174-S178 PolarHBondContact O-N 3.42Å; L174-S178 VanDerWaalsContact O-N 3.15Å; L174-S178 PolarHBondContact O-OG 3.47Å
175	L	93.3	Very high	93.6	Very high	109 Å²	109	88.2 Å²	88.2	57%	0.571	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-31	177	-171.3	142.6	0	0	0	113.2	W173 W179 A182	W173-L175 PolarHBondContact O-N 3.27Å; W173-L175 VanDerWaalsContact O-N 3.09Å; L175-W179 WeakPolarHBondContact O-CA 3.15Å; L175-W179 WeakPolarHBondContact O-CB 3.43Å; L175-W179 PolarHBondContact O-N 3.03Å; L175-W179 VanDerWaalsContact O-N 3.1Å; L175-A182 HydrophobicContact CD1-CB 4.37Å; L175-A182 HydrophobicContact CG-CB 4.16Å
176	L	92.6	Very high	93.7	Very high	108 Å²	108	92.6 Å²	92.6	57%	0.565	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-55.9	-179.9	-68.5	170.4	0	0	0	112.8	W173 L174 S178	W173-L176 PolarHBondContact O-N 3.37Å; W173-L176 VanDerWaalsContact O-N 3.1Å; L174-L176 PolarHBondContact O-N 2.98Å; L176-S178 VanDerWaalsContact C-N 3.35Å; L176-S178 PolarHBondContact O-N 3.34Å
177	P	92.3	Very high	93.9	Very high	78 Å²	78	94.1 Å²	94.1	51%	0.506	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-31.4	178.3	26.6	-35.2	0	0	0	113	M156 W173 L174	M156-P177 HydrophobicContact CE-CB 3.82Å; M156-P177 HydrophobicContact CE-CG 3.67Å; W173-P177 WeakPolarHBondContact O-CD 3.37Å; L174-P177 WeakPolarHBondContact O-CD 3.27Å; L174-P177 WeakPolarHBondContact O-CG 3.4Å
178	S	93.9	Very high	94	Very high	9 Å²	9	90.5 Å²	90.5	6%	0.063	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	33	-175.9	78	0	0	0	0	113.5	L174 L176 L181 A182	L174-S178 PolarHBondContact O-N 3.42Å; L174-S178 VanDerWaalsContact O-N 3.15Å; L174-S178 PolarHBondContact O-OG 3.47Å; L176-S178 VanDerWaalsContact C-N 3.35Å; L176-S178 PolarHBondContact O-N 3.34Å; S178-L181 WeakPolarHBondContact O-CB 3.29Å; S178-L181 PolarHBondContact O-N 3.33Å; S178-L181 VanDerWaalsContact O-N 3.07Å; S178-A182 PolarHBondContact O-N 3.29Å
179	W	94.4	Very high	94.1	Very high	163 Å²	163	89.8 Å²	89.8	62%	0.617	44%	0.435	S	S	*	.	H	α-helix	trans	-55.3	-37.5	-174.4	78.1	-94.4	0	0	0	115.1	L175 L181 A182 M183	L175-W179 WeakPolarHBondContact O-CA 3.15Å; L175-W179 WeakPolarHBondContact O-CB 3.43Å; L175-W179 PolarHBondContact O-N 3.03Å; L175-W179 VanDerWaalsContact O-N 3.1Å; W179-L181 VanDerWaalsContact C-N 3.35Å; W179-A182 PolarHBondContact O-N 3.21Å; W179-M183 HydrophobicContact CE3-CG 4.36Å; W179-M183 WeakPolarHBondContact O-CG 3.06Å; W179-M183 PolarHBondContact O-N 3.48Å
180	P	94.9	Very high	94.2	Very high	56 Å²	56	91.9 Å²	91.9	36%	0.364	45%	0.448	S	S	.	.	H	α-helix	trans	-68.7	-38.3	178	-15.3	30.8	0	0	0	111.1	M183 M184	P180-M183 PolarHBondContact O-N 2.66Å; P180-M184 WeakPolarHBondContact O-CG 3.4Å; P180-M184 PolarHBondContact O-N 3.06Å
181	L	95	Very high	94.1	Very high	46 Å²	46	85.9 Å²	85.9	24%	0.241	42%	0.422	C	S	.	.	H	α-helix	trans	-65.4	-41.2	175.8	-66.5	169.2	0	0	0	110.6	I149 S152 S178 W179 M183 M184 W185	I149-L181 HydrophobicContact CG2-CB 4.32Å; I149-L181 HydrophobicContact CG2-CD2 4.43Å; S152-L181 VanDerWaalsContact OG-CD1 3.28Å; S152-L181 WeakPolarHBondContact OG-CD1 3.41Å; S152-L181 WeakPolarHBondContact OG-CD2 3.32Å; S178-L181 WeakPolarHBondContact O-CB 3.29Å; S178-L181 PolarHBondContact O-N 3.33Å; S178-L181 VanDerWaalsContact O-N 3.07Å; W179-L181 VanDerWaalsContact C-N 3.35Å; L181-M183 VanDerWaalsContact C-N 3.35Å; L181-M183 PolarHBondContact O-N 3.15Å; L181-M184 HydrophobicContact CD2-CE 3.78Å; L181-M184 PolarHBondContact O-N 2.98Å; L181-W185 WeakPolarHBondContact O-CB 3.08Å; L181-W185 PolarHBondContact O-N 3.06Å
182	A	94.7	Very high	94.1	Very high	26 Å²	26	79.6 Å²	79.6	22%	0.215	39%	0.393	C	S	.	.	H	α-helix	trans	-63.6	-38.6	176.7	0	0	0	0	0	112.3	L175 S178 W179 W185 F186	L175-A182 HydrophobicContact CD1-CB 4.37Å; L175-A182 HydrophobicContact CG-CB 4.16Å; S178-A182 PolarHBondContact O-N 3.29Å; W179-A182 PolarHBondContact O-N 3.21Å; A182-W185 WeakPolarHBondContact O-CB 3.44Å; A182-W185 PolarHBondContact O-N 3.19Å; A182-F186 WeakPolarHBondContact O-CB 3.32Å; A182-F186 PolarHBondContact O-N 3.27Å
183	M	95.6	Very high	93.7	Very high	118 Å²	118	81.7 Å²	81.7	58%	0.581	41%	0.411	S	S	*	.	H	α-helix	trans	-68.1	-44.9	175.6	-72.5	-63.7	-176.3	0	0	112.2	W179 P180 L181 W185 F186 I187	W179-M183 HydrophobicContact CE3-CG 4.36Å; W179-M183 WeakPolarHBondContact O-CG 3.06Å; W179-M183 PolarHBondContact O-N 3.48Å; P180-M183 PolarHBondContact O-N 2.66Å; L181-M183 VanDerWaalsContact C-N 3.35Å; L181-M183 PolarHBondContact O-N 3.15Å; M183-W185 VanDerWaalsContact C-N 3.31Å; M183-W185 PolarHBondContact O-N 3.22Å; M183-F186 PolarHBondContact O-N 3.28Å; M183-I187 WeakPolarHBondContact O-CG1 3.4Å; M183-I187 PolarHBondContact O-N 3.46Å; M183-I187 VanDerWaalsContact O-N 3.14Å
184	M	96.1	Very high	93.7	Very high	98 Å²	98	76.2 Å²	76.2	48%	0.483	40%	0.395	S	S	.	.	H	α-helix	trans	-63.5	-39.8	175.2	-69.2	-172.3	-62.6	0	0	111.5	I149 P180 L181 F186 I187 S188	I149-M184 HydrophobicContact CD1-CB 3.76Å; P180-M184 WeakPolarHBondContact O-CG 3.4Å; P180-M184 PolarHBondContact O-N 3.06Å; L181-M184 HydrophobicContact CD2-CE 3.78Å; L181-M184 PolarHBondContact O-N 2.98Å; M184-F186 PolarHBondContact O-N 2.77Å; M184-I187 PolarHBondContact O-N 3.28Å; M184-S188 PolarHBondContact O-N 3.46Å; M184-S188 PolarHBondContact O-OG 2.98Å
185	W	95.1	Very high	93.7	Very high	78 Å²	78	78.9 Å²	78.9	30%	0.295	41%	0.409	S	S	.	.	H	α-helix	trans	-58.8	-45	174.9	178.8	-102.2	0	0	0	112.3	L146 I149 L150 L181 A182 M183 I187 S188 T189	L146-W185 HydrophobicContact CB-CZ3 4.16Å; L146-W185 HydrophobicContact CD1-CD2 4.43Å; L146-W185 HydrophobicContact CD1-CE3 3.76Å; L146-W185 HydrophobicContact CD1-CH2 3.18Å; L146-W185 HydrophobicContact CD1-CZ2 3.97Å; L146-W185 HydrophobicContact CD1-CZ3 3.06Å; L146-W185 HydrophobicContact CD2-CH2 4.17Å; L146-W185 HydrophobicContact CD2-CZ3 4.46Å; L146-W185 HydrophobicContact CG-CE3 4.34Å; L146-W185 HydrophobicContact CG-CH2 3.42Å; L146-W185 VanDerWaalsContact CG-CH2 3.42Å; L146-W185 HydrophobicContact CG-CZ3 3.29Å; L146-W185 WeakPolarHBondContact O-CZ3 3.04Å; I149-W185 HydrophobicContact CB-CE3 4.1Å; I149-W185 HydrophobicContact CG2-CB 3.97Å; I149-W185 HydrophobicContact CG2-CD2 4.48Å; I149-W185 HydrophobicContact CG2-CE3 3.79Å; L150-W185 HydrophobicContact CB-CZ3 4.43Å; L150-W185 HydrophobicContact CD1-CH2 3.37Å; L150-W185 HydrophobicContact CD1-CZ2 4.47Å; L150-W185 HydrophobicContact CD1-CZ3 3.62Å; L150-W185 HydrophobicContact CD2-CH2 3.69Å; L150-W185 HydrophobicContact CD2-CZ2 4.2Å; L150-W185 HydrophobicContact CD2-CZ3 3.95Å; L150-W185 HydrophobicContact CG-CE3 4.24Å; L150-W185 HydrophobicContact CG-CH2 3.41Å; L150-W185 VanDerWaalsContact CG-CH2 3.41Å; L150-W185 HydrophobicContact CG-CZ2 4.37Å; L150-W185 HydrophobicContact CG-CZ3 3.31Å; L181-W185 WeakPolarHBondContact O-CB 3.08Å; L181-W185 PolarHBondContact O-N 3.06Å; A182-W185 WeakPolarHBondContact O-CB 3.44Å; A182-W185 PolarHBondContact O-N 3.19Å; M183-W185 VanDerWaalsContact C-N 3.31Å; M183-W185 PolarHBondContact O-N 3.22Å; W185-I187 VanDerWaalsContact C-N 3.34Å; W185-I187 PolarHBondContact O-N 3.16Å; W185-S188 WeakPolarHBondContact CA-OG 3.08Å; W185-S188 PolarHBondContact O-N 3.3Å; W185-S188 PolarHBondContact O-OG 3.46Å; W185-T189 HydrophobicContact CD2-CG2 4.16Å; W185-T189 HydrophobicContact CH2-CG2 4.36Å; W185-T189 HydrophobicContact CZ2-CG2 3.73Å; W185-T189 WeakPolarHBondContact O-CB 3.46Å; W185-T189 WeakPolarHBondContact O-CG2 3.07Å; W185-T189 PolarHBondContact O-N 3.01Å; W185-T189 PolarHBondContact O-OG1 3.26Å
186	F	96	Very high	93.8	Very high	129 Å²	129	77.2 Å²	77.2	57%	0.566	40%	0.4	S	S	*	.	H	α-helix	trans	-63	-41.5	178.2	-178.4	-105	0	0	0	111.8	A182 M183 M184 T189 L190	A182-F186 WeakPolarHBondContact O-CB 3.32Å; A182-F186 PolarHBondContact O-N 3.27Å; M183-F186 PolarHBondContact O-N 3.28Å; M184-F186 PolarHBondContact O-N 2.77Å; F186-T189 WeakPolarHBondContact CA-OG1 3.41Å; F186-T189 PolarHBondContact O-OG1 2.95Å; F186-L190 HydrophobicContact CZ-CD1 4.44Å; F186-L190 WeakPolarHBondContact O-CB 3.15Å; F186-L190 PolarHBondContact O-N 3.49Å; F186-L190 VanDerWaalsContact O-N 3.08Å
187	I	96.2	Very high	93.8	Very high	106 Å²	106	75.4 Å²	75.4	54%	0.544	39%	0.39	S	S	.	.	H	α-helix	trans	-68.4	-41.2	177.3	-64.4	164.8	0	0	0	111	M183 M184 W185 L190 A191	M183-I187 WeakPolarHBondContact O-CG1 3.4Å; M183-I187 PolarHBondContact O-N 3.46Å; M183-I187 VanDerWaalsContact O-N 3.14Å; M184-I187 PolarHBondContact O-N 3.28Å; W185-I187 VanDerWaalsContact C-N 3.34Å; W185-I187 PolarHBondContact O-N 3.16Å; I187-L190 PolarHBondContact O-N 3.45Å; I187-A191 PolarHBondContact O-N 2.92Å; I187-A191 VanDerWaalsContact O-N 3.08Å
188	S	94.7	Very high	93.9	Very high	3 Å²	3	75.3 Å²	75.3	2%	0.021	38%	0.383	C	S	.	.	H	α-helix	trans	-66	-41	179.1	60.9	0	0	0	0	111.9	M184 W185 A191 E192	M184-S188 PolarHBondContact O-N 3.46Å; M184-S188 PolarHBondContact O-OG 2.98Å; W185-S188 WeakPolarHBondContact CA-OG 3.08Å; W185-S188 PolarHBondContact O-N 3.3Å; W185-S188 PolarHBondContact O-OG 3.46Å; S188-A191 PolarHBondContact O-N 2.86Å; S188-A191 VanDerWaalsContact O-N 3.16Å; S188-E192 PolarHBondContact O-N 2.98Å
189	T	94.3	Very high	93.9	Very high	37 Å²	37	79.7 Å²	79.7	23%	0.227	40%	0.404	C	S	.	.	H	α-helix	trans	-66.2	-37.4	176.5	48.7	0	0	0	0	112.1	L146 W185 F186 A191 E192 T193	L146-T189 HydrophobicContact CD1-CG2 3.9Å; W185-T189 HydrophobicContact CD2-CG2 4.16Å; W185-T189 HydrophobicContact CH2-CG2 4.36Å; W185-T189 HydrophobicContact CZ2-CG2 3.73Å; W185-T189 WeakPolarHBondContact O-CB 3.46Å; W185-T189 WeakPolarHBondContact O-CG2 3.07Å; W185-T189 PolarHBondContact O-N 3.01Å; W185-T189 PolarHBondContact O-OG1 3.26Å; F186-T189 WeakPolarHBondContact CA-OG1 3.41Å; F186-T189 PolarHBondContact O-OG1 2.95Å; T189-A191 PolarHBondContact O-N 3.44Å; T189-E192 PolarHBondContact O-N 3.37Å; T189-T193 PolarHBondContact O-N 3.2Å; T189-T193 PolarHBondContact O-OG1 2.97Å
190	L	93.6	Very high	93.9	Very high	114 Å²	114	73.7 Å²	73.7	60%	0.597	39%	0.389	S	S	*	.	H	α-helix	trans	-66.9	-24	173.4	-168.6	127.6	0	0	0	113.3	F186 I187	F186-L190 HydrophobicContact CZ-CD1 4.44Å; F186-L190 WeakPolarHBondContact O-CB 3.15Å; F186-L190 PolarHBondContact O-N 3.49Å; F186-L190 VanDerWaalsContact O-N 3.08Å; I187-L190 PolarHBondContact O-N 3.45Å
191	A	91.8	Very high	93.8	Very high	11 Å²	11	75.1 Å²	75.1	9%	0.091	39%	0.391	C	S	.	.	H	α-helix	trans	-90	-20.1	175.7	0	0	0	0	0	113.3	Q138 Y142 I187 S188 T189	Q138-A191 PolarHBondContact NE2-O 3.46Å; Y142-A191 HydrophobicContact CD1-CB 3.73Å; Y142-A191 HydrophobicContact CD2-CB 3.49Å; Y142-A191 VanDerWaalsContact CD2-CB 3.49Å; Y142-A191 HydrophobicContact CE1-CB 3.65Å; Y142-A191 HydrophobicContact CE2-CB 3.45Å; Y142-A191 VanDerWaalsContact CE2-CB 3.45Å; Y142-A191 HydrophobicContact CG-CB 3.65Å; I187-A191 PolarHBondContact O-N 2.92Å; I187-A191 VanDerWaalsContact O-N 3.08Å; S188-A191 PolarHBondContact O-N 2.86Å; S188-A191 VanDerWaalsContact O-N 3.16Å; T189-A191 PolarHBondContact O-N 3.44Å
192	E	89.9	Confident	93.7	Very high	46 Å²	46	77.5 Å²	77.5	22%	0.215	40%	0.403	C	S	.	.	H	α-helix	trans	-77.6	-40.1	176.2	-172.8	-179.8	-177.8	0	0	111.9	S109 L146 S188 T189	S109-E192 WeakPolarHBondContact CB-OE1 3.37Å; S109-E192 PolarHBondContact OG-OE1 2.94Å; L146-E192 WeakPolarHBondContact CD2-OE2 3.25Å; S188-E192 PolarHBondContact O-N 2.98Å; T189-E192 PolarHBondContact O-N 3.37Å
193	T	86.6	Confident	93.6	Very high	164 Å²	164	82.2 Å²	82.2	100%	1.006	42%	0.421	S	S	*	.			trans	-89.5	0	-179.7	62.7	0	0	0	0	113	T189	T189-T193 PolarHBondContact O-N 3.2Å; T189-T193 PolarHBondContact O-OG1 2.97Å

Retrieved 193 of 193 residues in 275.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).